data_18321 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 18321 _Entry.PDB_ID 2LQN save_ save_delta_chem_shifts _Entity_delta_chem_shifts.Sf_category delta_chem_shifts _Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts _Entity_delta_chem_shifts.Model_type single _Entity_delta_chem_shifts.Entry_ID 18321 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Conformer_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 1 . 1 1 2 2 SER HA H 2 4.521 4.521 4.848 -0.327 18321 2 1 1 . 1 1 2 2 SER CA C 2 58.326 58.326 57.524 0.802 18321 3 1 1 . 1 1 2 2 SER CB C 2 64.062 64.062 64.415 -0.353 18321 4 1 1 . 1 1 3 3 SER HA H 3 4.465 4.465 4.454 0.011 18321 5 1 1 . 1 1 3 3 SER C C 3 173.887 173.887 174.685 -0.798 18321 6 1 1 . 1 1 3 3 SER CA C 3 58.374 58.374 59.320 -0.946 18321 7 1 1 . 1 1 3 3 SER CB C 3 63.920 63.920 63.347 0.573 18321 8 1 1 . 1 1 4 4 ALA N N 4 124.755 124.755 123.274 1.481 18321 9 1 1 . 1 1 4 4 ALA HA H 4 4.547 4.547 4.832 -0.285 18321 10 1 1 . 1 1 4 4 ALA CA C 4 52.737 52.737 51.783 0.954 18321 11 1 1 . 1 1 4 4 ALA CB C 4 19.636 19.636 19.355 0.281 18321 12 1 1 . 1 1 4 4 ALA H H 4 8.244 8.244 7.818 0.426 18321 13 1 1 . 1 1 5 5 ARG N N 5 120.383 120.383 124.347 -3.964 18321 14 1 1 . 1 1 5 5 ARG HA H 5 4.524 4.524 4.381 0.143 18321 15 1 1 . 1 1 5 5 ARG C C 5 175.611 175.611 176.766 -1.155 18321 16 1 1 . 1 1 5 5 ARG CA C 5 56.082 56.082 56.116 -0.034 18321 17 1 1 . 1 1 5 5 ARG CB C 5 30.695 30.695 32.021 -1.326 18321 18 1 1 . 1 1 5 5 ARG H H 5 8.727 8.727 8.276 0.451 18321 19 1 1 . 1 1 6 6 PHE N N 6 115.159 115.159 118.679 -3.520 18321 20 1 1 . 1 1 6 6 PHE HA H 6 4.786 4.786 4.020 0.766 18321 21 1 1 . 1 1 6 6 PHE C C 6 172.076 172.076 175.822 -3.746 18321 22 1 1 . 1 1 6 6 PHE CA C 6 56.640 56.640 59.417 -2.777 18321 23 1 1 . 1 1 6 6 PHE CB C 6 40.378 40.378 37.662 2.716 18321 24 1 1 . 1 1 6 6 PHE H H 6 7.536 7.536 7.998 -0.462 18321 25 1 1 . 1 1 7 7 ASP N N 7 121.846 121.846 119.513 2.333 18321 26 1 1 . 1 1 7 7 ASP HA H 7 4.846 4.846 4.487 0.359 18321 27 1 1 . 1 1 7 7 ASP CA C 7 52.327 52.327 54.524 -2.197 18321 28 1 1 . 1 1 7 7 ASP CB C 7 41.298 41.298 41.847 -0.549 18321 29 1 1 . 1 1 7 7 ASP H H 7 9.062 9.062 8.984 0.078 18321 30 1 1 . 1 1 8 8 SER HA H 8 3.950 3.950 4.244 -0.294 18321 31 1 1 . 1 1 8 8 SER C C 8 174.705 174.705 173.406 1.299 18321 32 1 1 . 1 1 8 8 SER CA C 8 61.937 61.937 58.960 2.977 18321 33 1 1 . 1 1 8 8 SER CB C 8 62.260 62.260 62.372 -0.112 18321 34 1 1 . 1 1 9 9 SER N N 9 114.373 114.373 112.687 1.686 18321 35 1 1 . 1 1 9 9 SER HA H 9 4.529 4.529 4.804 -0.275 18321 36 1 1 . 1 1 9 9 SER C C 9 175.089 175.089 172.534 2.555 18321 37 1 1 . 1 1 9 9 SER CA C 9 59.851 59.851 59.730 0.121 18321 38 1 1 . 1 1 9 9 SER CB C 9 64.246 64.246 66.126 -1.880 18321 39 1 1 . 1 1 9 9 SER H H 9 8.722 8.722 9.495 -0.773 18321 40 1 1 . 1 1 10 10 ASP N N 10 121.818 121.818 122.778 -0.960 18321 41 1 1 . 1 1 10 10 ASP HA H 10 4.730 4.730 4.749 -0.019 18321 42 1 1 . 1 1 10 10 ASP C C 10 174.455 174.455 177.156 -2.701 18321 43 1 1 . 1 1 10 10 ASP CA C 10 52.432 52.432 53.706 -1.274 18321 44 1 1 . 1 1 10 10 ASP CB C 10 39.607 39.607 41.898 -2.291 18321 45 1 1 . 1 1 10 10 ASP H H 10 7.600 7.600 9.522 -1.922 18321 46 1 1 . 1 1 11 11 ARG N N 11 125.238 125.238 125.482 -0.244 18321 47 1 1 . 1 1 11 11 ARG HA H 11 1.936 1.936 3.226 -1.290 18321 48 1 1 . 1 1 11 11 ARG C C 11 176.916 176.916 177.626 -0.710 18321 49 1 1 . 1 1 11 11 ARG CA C 11 57.451 57.451 57.457 -0.006 18321 50 1 1 . 1 1 11 11 ARG CB C 11 43.014 43.014 29.558 13.456 18321 51 1 1 . 1 1 11 11 ARG H H 11 7.739 7.739 8.384 -0.645 18321 52 1 1 . 1 1 12 12 SER N N 12 112.065 112.065 112.230 -0.165 18321 53 1 1 . 1 1 12 12 SER HA H 12 4.695 4.695 4.367 0.328 18321 54 1 1 . 1 1 12 12 SER C C 12 175.092 175.092 173.724 1.368 18321 55 1 1 . 1 1 12 12 SER CA C 12 60.785 60.785 59.230 1.555 18321 56 1 1 . 1 1 12 12 SER CB C 12 62.889 62.889 62.883 0.006 18321 57 1 1 . 1 1 12 12 SER H H 12 7.888 7.888 8.036 -0.148 18321 58 1 1 . 1 1 13 13 ALA N N 13 122.249 122.249 122.451 -0.202 18321 59 1 1 . 1 1 13 13 ALA HA H 13 4.216 4.216 4.506 -0.290 18321 60 1 1 . 1 1 13 13 ALA C C 13 178.069 178.069 177.531 0.538 18321 61 1 1 . 1 1 13 13 ALA CA C 13 53.562 53.562 53.579 -0.017 18321 62 1 1 . 1 1 13 13 ALA CB C 13 19.339 19.339 19.674 -0.335 18321 63 1 1 . 1 1 13 13 ALA H H 13 7.418 7.418 7.645 -0.227 18321 64 1 1 . 1 1 14 14 TRP N N 14 107.433 107.433 111.902 -4.469 18321 65 1 1 . 1 1 14 14 TRP HA H 14 4.785 4.785 4.703 0.082 18321 66 1 1 . 1 1 14 14 TRP C C 14 175.286 175.286 175.566 -0.280 18321 67 1 1 . 1 1 14 14 TRP CA C 14 55.212 55.212 55.330 -0.118 18321 68 1 1 . 1 1 14 14 TRP CB C 14 32.776 32.776 31.196 1.580 18321 69 1 1 . 1 1 14 14 TRP H H 14 6.273 6.273 6.959 -0.686 18321 70 1 1 . 1 1 15 15 TYR N N 15 122.315 122.315 123.951 -1.636 18321 71 1 1 . 1 1 15 15 TYR HA H 15 5.436 5.436 4.918 0.518 18321 72 1 1 . 1 1 15 15 TYR C C 15 175.325 175.325 174.635 0.690 18321 73 1 1 . 1 1 15 15 TYR CA C 15 56.609 56.609 57.773 -1.165 18321 74 1 1 . 1 1 15 15 TYR CB C 15 36.940 36.940 38.112 -1.172 18321 75 1 1 . 1 1 15 15 TYR H H 15 8.221 8.221 7.062 1.159 18321 76 1 1 . 1 1 16 16 MET N N 16 126.031 126.031 128.423 -2.392 18321 77 1 1 . 1 1 16 16 MET HA H 16 4.462 4.462 4.366 0.096 18321 78 1 1 . 1 1 16 16 MET CA C 16 53.046 53.046 52.795 0.251 18321 79 1 1 . 1 1 16 16 MET CB C 16 41.114 41.114 33.717 7.397 18321 80 1 1 . 1 1 16 16 MET H H 16 8.989 8.989 8.674 0.315 18321 81 1 1 . 1 1 17 17 GLY CA C 17 45.803 45.803 45.229 0.574 18321 82 1 1 . 1 1 18 18 PRO HA H 18 4.675 4.675 4.472 0.203 18321 83 1 1 . 1 1 18 18 PRO C C 18 175.943 175.943 175.187 0.756 18321 84 1 1 . 1 1 18 18 PRO CA C 18 63.647 63.647 63.596 0.051 18321 85 1 1 . 1 1 18 18 PRO CB C 18 29.276 29.276 30.976 -1.700 18321 86 1 1 . 1 1 19 19 VAL N N 19 126.159 126.159 124.353 1.806 18321 87 1 1 . 1 1 19 19 VAL HA H 19 4.011 4.011 4.120 -0.109 18321 88 1 1 . 1 1 19 19 VAL C C 19 175.812 175.812 174.915 0.897 18321 89 1 1 . 1 1 19 19 VAL CA C 19 62.355 62.355 61.316 1.039 18321 90 1 1 . 1 1 19 19 VAL CB C 19 33.468 33.468 34.151 -0.683 18321 91 1 1 . 1 1 19 19 VAL H H 19 7.851 7.851 7.858 -0.007 18321 92 1 1 . 1 1 20 20 SER N N 20 123.950 123.950 110.747 13.203 18321 93 1 1 . 1 1 20 20 SER HA H 20 4.453 4.453 4.237 0.216 18321 94 1 1 . 1 1 20 20 SER CA C 20 57.631 57.631 58.109 -0.478 18321 95 1 1 . 1 1 20 20 SER CB C 20 65.951 65.951 63.161 2.790 18321 96 1 1 . 1 1 20 20 SER H H 20 8.800 8.800 8.197 0.603 18321 97 1 1 . 1 1 21 21 ARG N N 21 123.461 123.461 121.840 1.621 18321 98 1 1 . 1 1 21 21 ARG HA H 21 3.489 3.489 3.902 -0.413 18321 99 1 1 . 1 1 21 21 ARG C C 21 178.164 178.164 178.581 -0.417 18321 100 1 1 . 1 1 21 21 ARG CA C 21 60.025 60.025 60.033 -0.008 18321 101 1 1 . 1 1 21 21 ARG CB C 21 30.334 30.334 30.011 0.323 18321 102 1 1 . 1 1 21 21 ARG H H 21 9.307 9.307 8.793 0.514 18321 103 1 1 . 1 1 22 22 GLN N N 22 116.591 116.591 118.895 -2.304 18321 104 1 1 . 1 1 22 22 GLN HA H 22 4.008 4.008 4.024 -0.016 18321 105 1 1 . 1 1 22 22 GLN CA C 22 59.095 59.095 59.605 -0.510 18321 106 1 1 . 1 1 22 22 GLN CB C 22 29.249 29.249 28.011 1.238 18321 107 1 1 . 1 1 22 22 GLN H H 22 8.394 8.394 8.621 -0.227 18321 108 1 1 . 1 1 23 23 GLU N N 23 122.191 122.191 119.909 2.282 18321 109 1 1 . 1 1 23 23 GLU HA H 23 4.037 4.037 4.107 -0.070 18321 110 1 1 . 1 1 23 23 GLU C C 23 178.986 178.986 178.521 0.465 18321 111 1 1 . 1 1 23 23 GLU CA C 23 59.081 59.081 58.726 0.355 18321 112 1 1 . 1 1 23 23 GLU CB C 23 31.896 31.896 29.115 2.781 18321 113 1 1 . 1 1 23 23 GLU H H 23 8.106 8.106 7.752 0.354 18321 114 1 1 . 1 1 24 24 ALA N N 24 121.964 121.964 121.970 -0.006 18321 115 1 1 . 1 1 24 24 ALA HA H 24 3.762 3.762 3.939 -0.177 18321 116 1 1 . 1 1 24 24 ALA C C 24 178.653 178.653 179.552 -0.899 18321 117 1 1 . 1 1 24 24 ALA CA C 24 55.480 55.480 55.596 -0.116 18321 118 1 1 . 1 1 24 24 ALA CB C 24 18.049 18.049 18.498 -0.449 18321 119 1 1 . 1 1 24 24 ALA H H 24 8.732 8.732 8.412 0.320 18321 120 1 1 . 1 1 25 25 GLN N N 25 116.229 116.229 117.405 -1.176 18321 121 1 1 . 1 1 25 25 GLN HA H 25 3.950 3.950 4.091 -0.141 18321 122 1 1 . 1 1 25 25 GLN C C 25 177.442 177.442 178.947 -1.505 18321 123 1 1 . 1 1 25 25 GLN CA C 25 59.651 59.651 58.622 1.029 18321 124 1 1 . 1 1 25 25 GLN CB C 25 29.308 29.308 28.373 0.935 18321 125 1 1 . 1 1 25 25 GLN H H 25 8.391 8.391 8.155 0.236 18321 126 1 1 . 1 1 26 26 THR N N 26 115.105 115.105 113.634 1.471 18321 127 1 1 . 1 1 26 26 THR HA H 26 3.920 3.920 4.259 -0.339 18321 128 1 1 . 1 1 26 26 THR C C 26 176.835 176.835 176.398 0.437 18321 129 1 1 . 1 1 26 26 THR CA C 26 66.335 66.335 63.944 2.392 18321 130 1 1 . 1 1 26 26 THR CB C 26 68.876 68.876 68.497 0.379 18321 131 1 1 . 1 1 26 26 THR H H 26 8.223 8.223 7.686 0.537 18321 132 1 1 . 1 1 27 27 ARG N N 27 119.096 119.096 118.828 0.268 18321 133 1 1 . 1 1 27 27 ARG HA H 27 4.047 4.047 4.283 -0.236 18321 134 1 1 . 1 1 27 27 ARG C C 27 177.245 177.245 176.674 0.571 18321 135 1 1 . 1 1 27 27 ARG CA C 27 58.528 58.528 57.925 0.603 18321 136 1 1 . 1 1 27 27 ARG CB C 27 30.184 30.184 30.730 -0.546 18321 137 1 1 . 1 1 27 27 ARG H H 27 8.093 8.093 7.688 0.405 18321 138 1 1 . 1 1 28 28 LEU N N 28 114.602 114.602 117.188 -2.586 18321 139 1 1 . 1 1 28 28 LEU HA H 28 4.325 4.325 4.493 -0.168 18321 140 1 1 . 1 1 28 28 LEU C C 28 177.197 177.197 175.796 1.401 18321 141 1 1 . 1 1 28 28 LEU CA C 28 55.143 55.143 53.660 1.483 18321 142 1 1 . 1 1 28 28 LEU CB C 28 44.902 44.902 43.206 1.696 18321 143 1 1 . 1 1 28 28 LEU H H 28 7.438 7.438 7.196 0.242 18321 144 1 1 . 1 1 29 29 GLN N N 29 121.312 121.312 121.480 -0.168 18321 145 1 1 . 1 1 29 29 GLN HA H 29 3.856 3.856 4.124 -0.268 18321 146 1 1 . 1 1 29 29 GLN C C 29 178.048 178.048 177.225 0.823 18321 147 1 1 . 1 1 29 29 GLN CA C 29 57.691 57.691 56.444 1.247 18321 148 1 1 . 1 1 29 29 GLN CB C 29 27.293 27.293 26.708 0.585 18321 149 1 1 . 1 1 29 29 GLN H H 29 8.250 8.250 7.488 0.762 18321 150 1 1 . 1 1 30 30 GLY N N 30 116.768 116.768 115.012 1.756 18321 151 1 1 . 1 1 30 30 GLY C C 30 174.914 174.914 174.462 0.452 18321 152 1 1 . 1 1 30 30 GLY CA C 30 45.491 45.491 46.103 -0.612 18321 153 1 1 . 1 1 30 30 GLY H H 30 9.135 9.135 8.903 0.232 18321 154 1 1 . 1 1 31 31 GLN N N 31 117.979 117.979 119.576 -1.597 18321 155 1 1 . 1 1 31 31 GLN HA H 31 4.329 4.329 3.809 0.520 18321 156 1 1 . 1 1 31 31 GLN C C 31 177.174 177.174 176.476 0.698 18321 157 1 1 . 1 1 31 31 GLN CA C 31 53.910 53.910 58.253 -4.343 18321 158 1 1 . 1 1 31 31 GLN CB C 31 29.574 29.574 27.300 2.274 18321 159 1 1 . 1 1 31 31 GLN H H 31 7.695 7.695 8.163 -0.468 18321 160 1 1 . 1 1 32 32 ARG N N 32 123.918 123.918 118.832 5.086 18321 161 1 1 . 1 1 32 32 ARG HA H 32 3.940 3.940 4.416 -0.476 18321 162 1 1 . 1 1 32 32 ARG C C 32 175.810 175.810 175.293 0.517 18321 163 1 1 . 1 1 32 32 ARG CA C 32 56.770 56.770 55.400 1.370 18321 164 1 1 . 1 1 32 32 ARG CB C 32 30.074 30.074 31.809 -1.735 18321 165 1 1 . 1 1 32 32 ARG H H 32 8.955 8.955 8.275 0.680 18321 166 1 1 . 1 1 33 33 HIS N N 33 122.248 122.248 116.305 5.943 18321 167 1 1 . 1 1 33 33 HIS HA H 33 4.627 4.627 4.261 0.366 18321 168 1 1 . 1 1 33 33 HIS C C 33 177.089 177.089 176.380 0.709 18321 169 1 1 . 1 1 33 33 HIS CA C 33 55.858 55.858 56.674 -0.816 18321 170 1 1 . 1 1 33 33 HIS CB C 33 28.648 28.648 29.004 -0.356 18321 171 1 1 . 1 1 33 33 HIS H H 33 8.302 8.302 8.118 0.184 18321 172 1 1 . 1 1 34 34 GLY N N 34 109.518 109.518 104.985 4.533 18321 173 1 1 . 1 1 34 34 GLY C C 34 176.730 176.730 173.143 3.587 18321 174 1 1 . 1 1 34 34 GLY CA C 34 45.967 45.967 45.545 0.422 18321 175 1 1 . 1 1 34 34 GLY H H 34 9.496 9.496 8.749 0.747 18321 176 1 1 . 1 1 35 35 MET N N 35 125.193 125.193 119.060 6.133 18321 177 1 1 . 1 1 35 35 MET HA H 35 5.750 5.750 5.776 -0.026 18321 178 1 1 . 1 1 35 35 MET C C 35 174.388 174.388 174.707 -0.319 18321 179 1 1 . 1 1 35 35 MET CA C 35 55.762 55.762 54.415 1.347 18321 180 1 1 . 1 1 35 35 MET CB C 35 32.706 32.706 35.991 -3.285 18321 181 1 1 . 1 1 35 35 MET H H 35 8.359 8.359 7.255 1.104 18321 182 1 1 . 1 1 36 36 PHE N N 36 123.311 123.311 118.033 5.278 18321 183 1 1 . 1 1 36 36 PHE HA H 36 5.985 5.985 5.796 0.189 18321 184 1 1 . 1 1 36 36 PHE C C 36 172.140 172.140 172.786 -0.646 18321 185 1 1 . 1 1 36 36 PHE CA C 36 55.755 55.755 55.206 0.549 18321 186 1 1 . 1 1 36 36 PHE CB C 36 45.197 45.197 42.892 2.305 18321 187 1 1 . 1 1 36 36 PHE H H 36 8.261 8.261 7.890 0.371 18321 188 1 1 . 1 1 37 37 LEU N N 37 114.652 114.652 116.677 -2.025 18321 189 1 1 . 1 1 37 37 LEU HA H 37 4.489 4.489 5.079 -0.590 18321 190 1 1 . 1 1 37 37 LEU C C 37 174.033 174.033 174.952 -0.919 18321 191 1 1 . 1 1 37 37 LEU CA C 37 55.382 55.382 54.406 0.976 18321 192 1 1 . 1 1 37 37 LEU CB C 37 44.791 44.791 45.340 -0.549 18321 193 1 1 . 1 1 37 37 LEU H H 37 9.292 9.292 9.259 0.033 18321 194 1 1 . 1 1 38 38 VAL N N 38 121.009 121.009 123.593 -2.584 18321 195 1 1 . 1 1 38 38 VAL HA H 38 5.504 5.504 4.730 0.774 18321 196 1 1 . 1 1 38 38 VAL C C 38 173.581 173.581 175.673 -2.092 18321 197 1 1 . 1 1 38 38 VAL CA C 38 61.316 61.316 62.145 -0.829 18321 198 1 1 . 1 1 38 38 VAL CB C 38 33.302 33.302 32.154 1.147 18321 199 1 1 . 1 1 38 38 VAL H H 38 8.991 8.991 8.605 0.386 18321 200 1 1 . 1 1 39 39 ARG N N 39 124.863 124.863 128.066 -3.203 18321 201 1 1 . 1 1 39 39 ARG HA H 39 5.444 5.444 5.011 0.433 18321 202 1 1 . 1 1 39 39 ARG C C 39 175.772 175.772 175.020 0.752 18321 203 1 1 . 1 1 39 39 ARG CA C 39 52.558 52.558 53.490 -0.932 18321 204 1 1 . 1 1 39 39 ARG CB C 39 34.980 34.980 32.443 2.537 18321 205 1 1 . 1 1 39 39 ARG H H 39 9.569 9.569 8.418 1.151 18321 206 1 1 . 1 1 40 40 ASP N N 40 122.330 122.330 119.593 2.737 18321 207 1 1 . 1 1 40 40 ASP HA H 40 4.785 4.785 5.032 -0.247 18321 208 1 1 . 1 1 40 40 ASP C C 40 176.332 176.332 175.982 0.350 18321 209 1 1 . 1 1 40 40 ASP CA C 40 55.334 55.334 55.043 0.291 18321 210 1 1 . 1 1 40 40 ASP CB C 40 40.650 40.650 42.385 -1.735 18321 211 1 1 . 1 1 40 40 ASP H H 40 8.413 8.413 8.520 -0.107 18321 212 1 1 . 1 1 41 41 SER N N 41 114.363 114.363 120.023 -5.660 18321 213 1 1 . 1 1 41 41 SER HA H 41 4.506 4.506 4.434 0.072 18321 214 1 1 . 1 1 41 41 SER CA C 41 57.525 57.525 58.870 -1.345 18321 215 1 1 . 1 1 41 41 SER CB C 41 63.706 63.706 63.435 0.271 18321 216 1 1 . 1 1 41 41 SER H H 41 7.791 7.791 8.217 -0.426 18321 217 1 1 . 1 1 42 42 SER N N 42 126.932 126.932 124.280 2.652 18321 218 1 1 . 1 1 42 42 SER HA H 42 4.410 4.410 4.480 -0.070 18321 219 1 1 . 1 1 42 42 SER CA C 42 60.362 60.362 59.764 0.598 18321 220 1 1 . 1 1 42 42 SER CB C 42 63.707 63.707 63.093 0.614 18321 221 1 1 . 1 1 42 42 SER H H 42 10.519 10.519 8.644 1.875 18321 222 1 1 . 1 1 43 43 THR HA H 43 4.097 4.097 4.389 -0.292 18321 223 1 1 . 1 1 43 43 THR CA C 43 64.722 64.722 62.942 1.780 18321 224 1 1 . 1 1 43 43 THR CB C 43 69.439 69.439 69.682 -0.243 18321 225 1 1 . 1 1 44 44 CYS HA H 44 5.100 5.100 4.938 0.162 18321 226 1 1 . 1 1 44 44 CYS CA C 44 51.779 51.779 56.147 -4.368 18321 227 1 1 . 1 1 44 44 CYS CB C 44 41.314 41.314 30.174 11.140 18321 228 1 1 . 1 1 45 45 PRO HA H 45 4.278 4.278 4.315 -0.037 18321 229 1 1 . 1 1 45 45 PRO C C 45 178.127 178.127 177.285 0.842 18321 230 1 1 . 1 1 45 45 PRO CA C 45 64.151 64.151 64.600 -0.449 18321 231 1 1 . 1 1 45 45 PRO CB C 45 31.596 31.596 31.655 -0.059 18321 232 1 1 . 1 1 46 46 GLY N N 46 114.947 114.947 113.107 1.840 18321 233 1 1 . 1 1 46 46 GLY C C 46 174.701 174.701 173.805 0.896 18321 234 1 1 . 1 1 46 46 GLY CA C 46 45.225 45.225 44.831 0.394 18321 235 1 1 . 1 1 46 46 GLY H H 46 8.812 8.812 8.610 0.202 18321 236 1 1 . 1 1 47 47 ASP N N 47 120.862 120.862 121.903 -1.041 18321 237 1 1 . 1 1 47 47 ASP HA H 47 5.235 5.235 4.630 0.605 18321 238 1 1 . 1 1 47 47 ASP C C 47 176.480 176.480 174.988 1.492 18321 239 1 1 . 1 1 47 47 ASP CA C 47 53.591 53.591 54.661 -1.070 18321 240 1 1 . 1 1 47 47 ASP CB C 47 41.707 41.707 42.352 -0.645 18321 241 1 1 . 1 1 47 47 ASP H H 47 7.997 7.997 7.623 0.374 18321 242 1 1 . 1 1 48 48 TYR N N 48 118.473 118.473 115.281 3.192 18321 243 1 1 . 1 1 48 48 TYR HA H 48 5.431 5.431 5.129 0.302 18321 244 1 1 . 1 1 48 48 TYR C C 48 173.783 173.783 175.297 -1.514 18321 245 1 1 . 1 1 48 48 TYR CA C 48 56.891 56.891 56.789 0.102 18321 246 1 1 . 1 1 48 48 TYR CB C 48 43.274 43.274 42.751 0.523 18321 247 1 1 . 1 1 48 48 TYR H H 48 8.892 8.892 9.078 -0.186 18321 248 1 1 . 1 1 49 49 VAL N N 49 119.105 119.105 119.680 -0.575 18321 249 1 1 . 1 1 49 49 VAL HA H 49 4.800 4.800 4.626 0.174 18321 250 1 1 . 1 1 49 49 VAL C C 49 174.397 174.397 174.758 -0.361 18321 251 1 1 . 1 1 49 49 VAL CA C 49 61.439 61.439 62.065 -0.626 18321 252 1 1 . 1 1 49 49 VAL CB C 49 35.388 35.388 33.807 1.581 18321 253 1 1 . 1 1 49 49 VAL H H 49 9.661 9.661 8.769 0.892 18321 254 1 1 . 1 1 50 50 LEU N N 50 129.599 129.599 131.523 -1.924 18321 255 1 1 . 1 1 50 50 LEU HA H 50 5.033 5.033 5.061 -0.028 18321 256 1 1 . 1 1 50 50 LEU C C 50 175.001 175.001 175.382 -0.381 18321 257 1 1 . 1 1 50 50 LEU CA C 50 53.352 53.352 53.813 -0.461 18321 258 1 1 . 1 1 50 50 LEU CB C 50 44.062 44.062 42.367 1.695 18321 259 1 1 . 1 1 50 50 LEU H H 50 9.405 9.405 9.221 0.184 18321 260 1 1 . 1 1 51 51 SER N N 51 126.895 126.895 124.744 2.151 18321 261 1 1 . 1 1 51 51 SER HA H 51 5.731 5.731 4.994 0.737 18321 262 1 1 . 1 1 51 51 SER C C 51 173.094 173.094 173.200 -0.106 18321 263 1 1 . 1 1 51 51 SER CA C 51 58.834 58.834 57.336 1.498 18321 264 1 1 . 1 1 51 51 SER CB C 51 64.977 64.977 64.100 0.877 18321 265 1 1 . 1 1 51 51 SER H H 51 9.094 9.094 9.243 -0.149 18321 266 1 1 . 1 1 52 52 VAL N N 52 121.777 121.777 125.239 -3.462 18321 267 1 1 . 1 1 52 52 VAL HA H 52 5.066 5.066 4.709 0.357 18321 268 1 1 . 1 1 52 52 VAL C C 52 174.573 174.573 174.890 -0.317 18321 269 1 1 . 1 1 52 52 VAL CA C 52 59.535 59.535 60.468 -0.933 18321 270 1 1 . 1 1 52 52 VAL CB C 52 36.834 36.834 35.047 1.788 18321 271 1 1 . 1 1 52 52 VAL H H 52 8.816 8.816 8.734 0.082 18321 272 1 1 . 1 1 53 53 SER N N 53 120.489 120.489 122.466 -1.977 18321 273 1 1 . 1 1 53 53 SER HA H 53 4.811 4.811 4.528 0.283 18321 274 1 1 . 1 1 53 53 SER C C 53 174.065 174.065 172.715 1.350 18321 275 1 1 . 1 1 53 53 SER CA C 53 57.496 57.496 57.996 -0.500 18321 276 1 1 . 1 1 53 53 SER CB C 53 62.623 62.623 63.309 -0.686 18321 277 1 1 . 1 1 53 53 SER H H 53 8.780 8.780 9.152 -0.372 18321 278 1 1 . 1 1 54 54 GLU N N 54 132.020 132.020 128.687 3.333 18321 279 1 1 . 1 1 54 54 GLU HA H 54 4.250 4.250 4.533 -0.283 18321 280 1 1 . 1 1 54 54 GLU C C 54 175.387 175.387 175.025 0.362 18321 281 1 1 . 1 1 54 54 GLU CA C 54 56.999 56.999 55.436 1.563 18321 282 1 1 . 1 1 54 54 GLU CB C 54 32.556 32.556 33.029 -0.473 18321 283 1 1 . 1 1 54 54 GLU H H 54 8.472 8.472 7.795 0.677 18321 284 1 1 . 1 1 55 55 ASN N N 55 126.517 126.517 119.523 6.994 18321 285 1 1 . 1 1 55 55 ASN HA H 55 4.220 4.220 4.252 -0.032 18321 286 1 1 . 1 1 55 55 ASN C C 55 174.546 174.546 175.054 -0.508 18321 287 1 1 . 1 1 55 55 ASN CA C 55 54.770 54.770 54.228 0.541 18321 288 1 1 . 1 1 55 55 ASN CB C 55 37.314 37.314 37.850 -0.536 18321 289 1 1 . 1 1 55 55 ASN H H 55 8.853 8.853 8.477 0.376 18321 290 1 1 . 1 1 56 56 SER N N 56 112.009 112.009 109.165 2.844 18321 291 1 1 . 1 1 56 56 SER HA H 56 4.334 4.334 4.135 0.199 18321 292 1 1 . 1 1 56 56 SER C C 56 173.354 173.354 172.640 0.714 18321 293 1 1 . 1 1 56 56 SER CA C 56 59.966 59.966 59.434 0.532 18321 294 1 1 . 1 1 56 56 SER CB C 56 62.242 62.242 62.157 0.085 18321 295 1 1 . 1 1 56 56 SER H H 56 10.418 10.418 8.275 2.143 18321 296 1 1 . 1 1 57 57 ARG N N 57 121.764 121.764 118.010 3.754 18321 297 1 1 . 1 1 57 57 ARG HA H 57 5.167 5.167 4.497 0.670 18321 298 1 1 . 1 1 57 57 ARG C C 57 174.983 174.983 173.831 1.152 18321 299 1 1 . 1 1 57 57 ARG CA C 57 54.550 54.550 55.739 -1.189 18321 300 1 1 . 1 1 57 57 ARG CB C 57 31.886 31.886 30.728 1.158 18321 301 1 1 . 1 1 57 57 ARG H H 57 8.097 8.097 8.126 -0.029 18321 302 1 1 . 1 1 58 58 VAL N N 58 121.866 121.866 123.028 -1.162 18321 303 1 1 . 1 1 58 58 VAL HA H 58 4.768 4.768 4.286 0.482 18321 304 1 1 . 1 1 58 58 VAL C C 58 175.388 175.388 176.150 -0.762 18321 305 1 1 . 1 1 58 58 VAL CA C 58 61.818 61.818 62.434 -0.617 18321 306 1 1 . 1 1 58 58 VAL CB C 58 34.135 34.135 30.918 3.217 18321 307 1 1 . 1 1 58 58 VAL H H 58 8.081 8.081 8.093 -0.012 18321 308 1 1 . 1 1 59 59 SER N N 59 124.445 124.445 123.446 0.999 18321 309 1 1 . 1 1 59 59 SER HA H 59 4.462 4.462 4.268 0.194 18321 310 1 1 . 1 1 59 59 SER C C 59 172.185 172.185 173.252 -1.067 18321 311 1 1 . 1 1 59 59 SER CA C 59 56.629 56.629 58.227 -1.598 18321 312 1 1 . 1 1 59 59 SER CB C 59 66.218 66.218 63.320 2.898 18321 313 1 1 . 1 1 59 59 SER H H 59 9.082 9.082 7.988 1.094 18321 314 1 1 . 1 1 60 60 HIS N N 60 121.224 121.224 125.387 -4.163 18321 315 1 1 . 1 1 60 60 HIS HA H 60 4.885 4.885 4.765 0.120 18321 316 1 1 . 1 1 60 60 HIS C C 60 174.674 174.674 174.616 0.058 18321 317 1 1 . 1 1 60 60 HIS CA C 60 54.900 54.900 55.522 -0.622 18321 318 1 1 . 1 1 60 60 HIS CB C 60 32.331 32.331 30.037 2.294 18321 319 1 1 . 1 1 60 60 HIS H H 60 8.331 8.331 8.520 -0.189 18321 320 1 1 . 1 1 61 61 TYR N N 61 124.780 124.780 124.596 0.184 18321 321 1 1 . 1 1 61 61 TYR HA H 61 4.655 4.655 4.740 -0.085 18321 322 1 1 . 1 1 61 61 TYR CA C 61 57.409 57.409 56.396 1.013 18321 323 1 1 . 1 1 61 61 TYR CB C 61 39.785 39.785 39.062 0.723 18321 324 1 1 . 1 1 61 61 TYR H H 61 9.273 9.273 9.337 -0.064 18321 325 1 1 . 1 1 62 62 ILE HA H 62 4.298 4.298 4.340 -0.042 18321 326 1 1 . 1 1 62 62 ILE C C 62 174.817 174.817 175.584 -0.767 18321 327 1 1 . 1 1 62 62 ILE CA C 62 61.908 61.908 61.808 0.100 18321 328 1 1 . 1 1 62 62 ILE CB C 62 38.321 38.321 38.981 -0.660 18321 329 1 1 . 1 1 63 63 ILE N N 63 128.552 128.552 128.648 -0.096 18321 330 1 1 . 1 1 63 63 ILE HA H 63 4.788 4.788 4.804 -0.016 18321 331 1 1 . 1 1 63 63 ILE C C 63 175.982 175.982 174.920 1.062 18321 332 1 1 . 1 1 63 63 ILE CA C 63 59.629 59.629 59.894 -0.265 18321 333 1 1 . 1 1 63 63 ILE CB C 63 39.747 39.747 39.411 0.336 18321 334 1 1 . 1 1 63 63 ILE H H 63 9.155 9.155 8.903 0.252 18321 335 1 1 . 1 1 64 64 ASN N N 64 123.240 123.240 126.803 -3.563 18321 336 1 1 . 1 1 64 64 ASN HA H 64 4.857 4.857 5.542 -0.685 18321 337 1 1 . 1 1 64 64 ASN C C 64 175.324 175.324 174.721 0.603 18321 338 1 1 . 1 1 64 64 ASN CA C 64 53.736 53.736 53.098 0.638 18321 339 1 1 . 1 1 64 64 ASN CB C 64 41.531 41.531 40.470 1.061 18321 340 1 1 . 1 1 64 64 ASN H H 64 9.379 9.379 8.815 0.564 18321 341 1 1 . 1 1 65 65 SER N N 65 121.157 121.157 117.755 3.402 18321 342 1 1 . 1 1 65 65 SER HA H 65 4.548 4.548 4.657 -0.109 18321 343 1 1 . 1 1 65 65 SER C C 65 174.328 174.328 174.519 -0.191 18321 344 1 1 . 1 1 65 65 SER CA C 65 58.306 58.306 58.020 0.286 18321 345 1 1 . 1 1 65 65 SER CB C 65 62.878 62.878 63.231 -0.353 18321 346 1 1 . 1 1 65 65 SER H H 65 9.195 9.195 8.765 0.430 18321 347 1 1 . 1 1 66 66 LEU N N 66 127.417 127.417 129.194 -1.777 18321 348 1 1 . 1 1 66 66 LEU HA H 66 4.605 4.605 4.399 0.206 18321 349 1 1 . 1 1 66 66 LEU CA C 66 52.888 52.888 53.292 -0.404 18321 350 1 1 . 1 1 66 66 LEU CB C 66 41.799 41.799 41.428 0.371 18321 351 1 1 . 1 1 66 66 LEU H H 66 8.143 8.143 8.375 -0.232 18321 352 1 1 . 1 1 68 68 ASN HA H 68 4.386 4.386 4.669 -0.283 18321 353 1 1 . 1 1 68 68 ASN C C 68 174.487 174.487 174.836 -0.349 18321 354 1 1 . 1 1 68 68 ASN CA C 68 53.365 53.365 52.699 0.666 18321 355 1 1 . 1 1 68 68 ASN CB C 68 36.778 36.778 38.173 -1.395 18321 356 1 1 . 1 1 69 69 ARG N N 69 111.329 111.329 116.614 -5.285 18321 357 1 1 . 1 1 69 69 ARG HA H 69 3.876 3.876 3.750 0.126 18321 358 1 1 . 1 1 69 69 ARG CA C 69 57.393 57.393 56.987 0.406 18321 359 1 1 . 1 1 69 69 ARG CB C 69 26.665 26.665 28.115 -1.450 18321 360 1 1 . 1 1 69 69 ARG H H 69 8.191 8.191 8.035 0.156 18321 361 1 1 . 1 1 70 70 ARG N N 70 116.120 116.120 115.932 0.188 18321 362 1 1 . 1 1 70 70 ARG HA H 70 4.556 4.556 4.552 0.004 18321 363 1 1 . 1 1 70 70 ARG C C 70 174.882 174.882 173.912 0.970 18321 364 1 1 . 1 1 70 70 ARG CA C 70 55.509 55.509 53.624 1.885 18321 365 1 1 . 1 1 70 70 ARG CB C 70 31.771 31.771 34.000 -2.229 18321 366 1 1 . 1 1 70 70 ARG H H 70 6.667 6.667 7.364 -0.697 18321 367 1 1 . 1 1 71 71 PHE N N 71 116.313 116.313 116.959 -0.646 18321 368 1 1 . 1 1 71 71 PHE HA H 71 5.540 5.540 5.722 -0.182 18321 369 1 1 . 1 1 71 71 PHE C C 71 174.391 174.391 174.746 -0.355 18321 370 1 1 . 1 1 71 71 PHE CA C 71 57.528 57.528 56.547 0.981 18321 371 1 1 . 1 1 71 71 PHE CB C 71 44.115 44.115 43.470 0.645 18321 372 1 1 . 1 1 71 71 PHE H H 71 8.700 8.700 8.325 0.375 18321 373 1 1 . 1 1 72 72 LYS N N 72 122.770 122.770 125.012 -2.242 18321 374 1 1 . 1 1 72 72 LYS HA H 72 5.483 5.483 4.947 0.536 18321 375 1 1 . 1 1 72 72 LYS C C 72 173.923 173.923 175.017 -1.094 18321 376 1 1 . 1 1 72 72 LYS CA C 72 54.855 54.855 55.354 -0.499 18321 377 1 1 . 1 1 72 72 LYS CB C 72 37.710 37.710 35.791 1.919 18321 378 1 1 . 1 1 72 72 LYS H H 72 9.138 9.138 8.663 0.475 18321 379 1 1 . 1 1 73 73 ILE N N 73 124.576 124.576 129.387 -4.811 18321 380 1 1 . 1 1 73 73 ILE HA H 73 4.955 4.955 5.184 -0.229 18321 381 1 1 . 1 1 73 73 ILE C C 73 175.728 175.728 175.934 -0.206 18321 382 1 1 . 1 1 73 73 ILE CA C 73 58.935 58.935 59.588 -0.653 18321 383 1 1 . 1 1 73 73 ILE CB C 73 40.965 40.965 39.211 1.754 18321 384 1 1 . 1 1 73 73 ILE H H 73 8.826 8.826 9.080 -0.254 18321 385 1 1 . 1 1 74 74 GLY N N 74 118.718 118.718 119.393 -0.675 18321 386 1 1 . 1 1 74 74 GLY C C 74 174.436 174.436 174.935 -0.499 18321 387 1 1 . 1 1 74 74 GLY CA C 74 47.401 47.401 45.822 1.579 18321 388 1 1 . 1 1 74 74 GLY H H 74 9.317 9.317 8.769 0.548 18321 389 1 1 . 1 1 75 75 ASP N N 75 125.691 125.691 118.691 7.000 18321 390 1 1 . 1 1 75 75 ASP HA H 75 4.713 4.713 4.227 0.486 18321 391 1 1 . 1 1 75 75 ASP C C 75 175.841 175.841 175.170 0.671 18321 392 1 1 . 1 1 75 75 ASP CA C 75 53.815 53.815 56.330 -2.515 18321 393 1 1 . 1 1 75 75 ASP CB C 75 41.288 41.288 40.486 0.801 18321 394 1 1 . 1 1 75 75 ASP H H 75 8.665 8.665 8.800 -0.135 18321 395 1 1 . 1 1 76 76 GLN N N 76 120.368 120.368 121.083 -0.715 18321 396 1 1 . 1 1 76 76 GLN C C 76 173.630 173.630 174.931 -1.301 18321 397 1 1 . 1 1 76 76 GLN CA C 76 54.254 54.254 54.509 -0.255 18321 398 1 1 . 1 1 76 76 GLN CB C 76 31.248 31.248 28.835 2.413 18321 399 1 1 . 1 1 76 76 GLN H H 76 8.289 8.289 7.764 0.525 18321 400 1 1 . 1 1 77 77 GLU N N 77 120.435 120.435 123.212 -2.777 18321 401 1 1 . 1 1 77 77 GLU C C 77 175.484 175.484 174.664 0.820 18321 402 1 1 . 1 1 77 77 GLU CA C 77 54.203 54.203 54.822 -0.619 18321 403 1 1 . 1 1 77 77 GLU CB C 77 33.141 33.141 30.932 2.209 18321 404 1 1 . 1 1 77 77 GLU H H 77 7.732 7.732 8.196 -0.464 18321 405 1 1 . 1 1 78 78 PHE N N 78 117.911 117.911 122.284 -4.373 18321 406 1 1 . 1 1 78 78 PHE HA H 78 4.659 4.659 4.699 -0.040 18321 407 1 1 . 1 1 78 78 PHE C C 78 175.673 175.673 176.451 -0.778 18321 408 1 1 . 1 1 78 78 PHE CA C 78 57.160 57.160 56.518 0.642 18321 409 1 1 . 1 1 78 78 PHE CB C 78 45.405 45.405 40.783 4.622 18321 410 1 1 . 1 1 78 78 PHE H H 78 9.235 9.235 8.373 0.862 18321 411 1 1 . 1 1 79 79 ASP N N 79 119.296 119.296 118.414 0.882 18321 412 1 1 . 1 1 79 79 ASP HA H 79 4.462 4.462 4.638 -0.176 18321 413 1 1 . 1 1 79 79 ASP C C 79 174.482 174.482 175.302 -0.820 18321 414 1 1 . 1 1 79 79 ASP CA C 79 56.629 56.629 55.335 1.294 18321 415 1 1 . 1 1 79 79 ASP CB C 79 41.697 41.697 41.920 -0.223 18321 416 1 1 . 1 1 79 79 ASP H H 79 9.187 9.187 8.764 0.423 18321 417 1 1 . 1 1 80 80 HIS N N 80 107.631 107.631 110.671 -3.040 18321 418 1 1 . 1 1 80 80 HIS HA H 80 5.022 5.022 5.025 -0.003 18321 419 1 1 . 1 1 80 80 HIS C C 80 174.626 174.626 174.770 -0.144 18321 420 1 1 . 1 1 80 80 HIS CA C 80 54.223 54.223 54.722 -0.499 18321 421 1 1 . 1 1 80 80 HIS CB C 80 32.205 32.205 31.142 1.063 18321 422 1 1 . 1 1 80 80 HIS H H 80 7.200 7.200 7.094 0.106 18321 423 1 1 . 1 1 81 81 LEU N N 81 120.710 120.710 120.724 -0.014 18321 424 1 1 . 1 1 81 81 LEU HA H 81 3.804 3.804 4.027 -0.223 18321 425 1 1 . 1 1 81 81 LEU CA C 81 58.709 58.709 59.854 -1.145 18321 426 1 1 . 1 1 81 81 LEU CB C 81 39.646 39.646 40.074 -0.428 18321 427 1 1 . 1 1 81 81 LEU H H 81 8.886 8.886 9.108 -0.222 18321 428 1 1 . 1 1 82 82 PRO HA H 82 4.020 4.020 4.056 -0.036 18321 429 1 1 . 1 1 82 82 PRO C C 82 175.619 175.619 176.760 -1.141 18321 430 1 1 . 1 1 82 82 PRO CA C 82 67.025 67.025 64.769 2.256 18321 431 1 1 . 1 1 82 82 PRO CB C 82 30.962 30.962 30.804 0.158 18321 432 1 1 . 1 1 83 83 ALA N N 83 124.281 124.281 119.640 4.641 18321 433 1 1 . 1 1 83 83 ALA HA H 83 4.019 4.019 4.029 -0.010 18321 434 1 1 . 1 1 83 83 ALA C C 83 179.709 179.709 178.568 1.141 18321 435 1 1 . 1 1 83 83 ALA CA C 83 54.985 54.985 53.974 1.011 18321 436 1 1 . 1 1 83 83 ALA CB C 83 18.425 18.425 18.201 0.224 18321 437 1 1 . 1 1 83 83 ALA H H 83 8.527 8.527 7.369 1.158 18321 438 1 1 . 1 1 84 84 LEU N N 84 122.960 122.960 117.283 5.677 18321 439 1 1 . 1 1 84 84 LEU HA H 84 1.917 1.917 2.928 -1.011 18321 440 1 1 . 1 1 84 84 LEU C C 84 177.652 177.652 178.042 -0.390 18321 441 1 1 . 1 1 84 84 LEU CA C 84 58.261 58.261 57.052 1.209 18321 442 1 1 . 1 1 84 84 LEU CB C 84 42.544 42.544 40.782 1.762 18321 443 1 1 . 1 1 84 84 LEU H H 84 6.982 6.982 7.196 -0.214 18321 444 1 1 . 1 1 85 85 LEU N N 85 117.940 117.940 118.386 -0.446 18321 445 1 1 . 1 1 85 85 LEU HA H 85 3.463 3.463 3.758 -0.295 18321 446 1 1 . 1 1 85 85 LEU C C 85 178.809 178.809 178.384 0.425 18321 447 1 1 . 1 1 85 85 LEU CA C 85 57.522 57.522 57.359 0.163 18321 448 1 1 . 1 1 85 85 LEU CB C 85 41.242 41.242 41.171 0.071 18321 449 1 1 . 1 1 85 85 LEU H H 85 7.773 7.773 7.366 0.407 18321 450 1 1 . 1 1 86 86 GLU N N 86 115.762 115.762 117.373 -1.611 18321 451 1 1 . 1 1 86 86 GLU HA H 86 3.540 3.540 3.992 -0.452 18321 452 1 1 . 1 1 86 86 GLU C C 86 180.228 180.228 178.912 1.316 18321 453 1 1 . 1 1 86 86 GLU CA C 86 58.943 58.943 58.071 0.872 18321 454 1 1 . 1 1 86 86 GLU CB C 86 29.561 29.561 29.633 -0.072 18321 455 1 1 . 1 1 86 86 GLU H H 86 8.300 8.300 7.315 0.985 18321 456 1 1 . 1 1 87 87 PHE N N 87 121.135 121.135 121.786 -0.651 18321 457 1 1 . 1 1 87 87 PHE HA H 87 4.122 4.122 4.160 -0.038 18321 458 1 1 . 1 1 87 87 PHE C C 87 179.497 179.497 177.050 2.447 18321 459 1 1 . 1 1 87 87 PHE CA C 87 62.090 62.090 60.416 1.674 18321 460 1 1 . 1 1 87 87 PHE CB C 87 40.103 40.103 39.226 0.877 18321 461 1 1 . 1 1 87 87 PHE H H 87 7.717 7.717 7.397 0.320 18321 462 1 1 . 1 1 88 88 TYR N N 88 116.579 116.579 116.509 0.070 18321 463 1 1 . 1 1 88 88 TYR HA H 88 4.933 4.933 4.269 0.664 18321 464 1 1 . 1 1 88 88 TYR C C 88 174.799 174.799 176.787 -1.988 18321 465 1 1 . 1 1 88 88 TYR CA C 88 61.333 61.333 58.350 2.983 18321 466 1 1 . 1 1 88 88 TYR CB C 88 36.539 36.539 36.681 -0.142 18321 467 1 1 . 1 1 88 88 TYR H H 88 7.478 7.478 7.989 -0.511 18321 468 1 1 . 1 1 89 89 LYS N N 89 117.737 117.737 118.805 -1.068 18321 469 1 1 . 1 1 89 89 LYS HA H 89 4.466 4.466 4.040 0.426 18321 470 1 1 . 1 1 89 89 LYS C C 89 178.417 178.417 176.745 1.672 18321 471 1 1 . 1 1 89 89 LYS CA C 89 59.486 59.486 58.669 0.817 18321 472 1 1 . 1 1 89 89 LYS CB C 89 34.523 34.523 32.747 1.776 18321 473 1 1 . 1 1 89 89 LYS H H 89 7.505 7.505 7.456 0.049 18321 474 1 1 . 1 1 90 90 ILE N N 90 110.972 110.972 109.834 1.138 18321 475 1 1 . 1 1 90 90 ILE HA H 90 4.181 4.181 4.244 -0.063 18321 476 1 1 . 1 1 90 90 ILE C C 90 174.571 174.571 175.904 -1.333 18321 477 1 1 . 1 1 90 90 ILE CA C 90 60.516 60.516 60.849 -0.334 18321 478 1 1 . 1 1 90 90 ILE CB C 90 39.979 39.979 38.741 1.238 18321 479 1 1 . 1 1 90 90 ILE H H 90 6.710 6.710 7.174 -0.464 18321 480 1 1 . 1 1 91 91 HIS N N 91 119.479 119.479 121.225 -1.746 18321 481 1 1 . 1 1 91 91 HIS HA H 91 4.357 4.357 4.246 0.111 18321 482 1 1 . 1 1 91 91 HIS C C 91 172.751 172.751 174.972 -2.221 18321 483 1 1 . 1 1 91 91 HIS CA C 91 55.066 55.066 58.045 -2.979 18321 484 1 1 . 1 1 91 91 HIS CB C 91 29.756 29.756 31.415 -1.659 18321 485 1 1 . 1 1 91 91 HIS H H 91 7.460 7.460 7.509 -0.049 18321 486 1 1 . 1 1 92 92 TYR N N 92 117.642 117.642 115.198 2.444 18321 487 1 1 . 1 1 92 92 TYR HA H 92 4.131 4.131 4.287 -0.156 18321 488 1 1 . 1 1 92 92 TYR C C 92 177.348 177.348 175.289 2.059 18321 489 1 1 . 1 1 92 92 TYR CA C 92 58.627 58.627 58.395 0.232 18321 490 1 1 . 1 1 92 92 TYR CB C 92 39.481 39.481 35.900 3.581 18321 491 1 1 . 1 1 92 92 TYR H H 92 8.067 8.067 7.376 0.691 18321 492 1 1 . 1 1 93 93 LEU N N 93 123.560 123.560 122.492 1.068 18321 493 1 1 . 1 1 93 93 LEU HA H 93 4.104 4.104 4.213 -0.109 18321 494 1 1 . 1 1 93 93 LEU C C 93 175.610 175.610 178.489 -2.879 18321 495 1 1 . 1 1 93 93 LEU CA C 93 56.381 56.381 56.788 -0.407 18321 496 1 1 . 1 1 93 93 LEU CB C 93 38.896 38.896 42.136 -3.240 18321 497 1 1 . 1 1 93 93 LEU H H 93 7.907 7.907 7.918 -0.011 18321 498 1 1 . 1 1 94 94 ASP N N 94 118.194 118.194 115.097 3.097 18321 499 1 1 . 1 1 94 94 ASP HA H 94 4.940 4.940 4.502 0.438 18321 500 1 1 . 1 1 94 94 ASP C C 94 176.123 176.123 176.979 -0.856 18321 501 1 1 . 1 1 94 94 ASP CA C 94 56.235 56.235 56.871 -0.636 18321 502 1 1 . 1 1 94 94 ASP CB C 94 42.078 42.078 41.051 1.027 18321 503 1 1 . 1 1 94 94 ASP H H 94 8.640 8.640 8.684 -0.044 18321 504 1 1 . 1 1 95 95 THR N N 95 105.073 105.073 107.783 -2.710 18321 505 1 1 . 1 1 95 95 THR HA H 95 4.318 4.318 4.553 -0.235 18321 506 1 1 . 1 1 95 95 THR C C 95 174.685 174.685 173.103 1.582 18321 507 1 1 . 1 1 95 95 THR CA C 95 60.756 60.756 62.293 -1.537 18321 508 1 1 . 1 1 95 95 THR CB C 95 71.058 71.058 69.347 1.711 18321 509 1 1 . 1 1 95 95 THR H H 95 8.576 8.576 7.745 0.831 18321 510 1 1 . 1 1 96 96 THR N N 96 116.817 116.817 115.244 1.573 18321 511 1 1 . 1 1 96 96 THR HA H 96 5.129 5.129 4.787 0.342 18321 512 1 1 . 1 1 96 96 THR C C 96 172.464 172.464 172.694 -0.230 18321 513 1 1 . 1 1 96 96 THR CA C 96 60.762 60.762 60.220 0.542 18321 514 1 1 . 1 1 96 96 THR CB C 96 71.425 71.425 70.454 0.971 18321 515 1 1 . 1 1 96 96 THR H H 96 8.205 8.205 7.835 0.370 18321 516 1 1 . 1 1 97 97 THR N N 97 114.324 114.324 113.266 1.058 18321 517 1 1 . 1 1 97 97 THR HA H 97 5.128 5.128 4.521 0.607 18321 518 1 1 . 1 1 97 97 THR C C 97 175.480 175.480 174.684 0.796 18321 519 1 1 . 1 1 97 97 THR CA C 97 60.233 60.233 59.548 0.685 18321 520 1 1 . 1 1 97 97 THR CB C 97 70.415 70.415 70.337 0.078 18321 521 1 1 . 1 1 97 97 THR H H 97 7.128 7.128 8.079 -0.951 18321 522 1 1 . 1 1 98 98 LEU N N 98 116.674 116.674 122.326 -5.652 18321 523 1 1 . 1 1 98 98 LEU HA H 98 4.075 4.075 4.288 -0.213 18321 524 1 1 . 1 1 98 98 LEU C C 98 177.892 177.892 176.812 1.080 18321 525 1 1 . 1 1 98 98 LEU CA C 98 59.597 59.597 54.690 4.907 18321 526 1 1 . 1 1 98 98 LEU CB C 98 41.172 41.172 40.211 0.961 18321 527 1 1 . 1 1 98 98 LEU H H 98 8.743 8.743 7.876 0.867 18321 528 1 1 . 1 1 99 99 ILE N N 99 122.988 122.988 123.005 -0.017 18321 529 1 1 . 1 1 99 99 ILE HA H 99 4.415 4.415 4.124 0.291 18321 530 1 1 . 1 1 99 99 ILE C C 99 175.055 175.055 176.647 -1.592 18321 531 1 1 . 1 1 99 99 ILE CA C 99 62.183 62.183 62.923 -0.740 18321 532 1 1 . 1 1 99 99 ILE CB C 99 40.252 40.252 38.278 1.974 18321 533 1 1 . 1 1 99 99 ILE H H 99 8.998 8.998 8.175 0.823 18321 534 1 1 . 1 1 100 100 GLU N N 100 114.067 114.067 113.009 1.058 18321 535 1 1 . 1 1 100 100 GLU CA C 100 52.910 52.910 53.812 -0.902 18321 536 1 1 . 1 1 100 100 GLU CB C 100 31.155 31.155 30.922 0.233 18321 537 1 1 . 1 1 100 100 GLU H H 100 7.332 7.332 7.790 -0.458 18321 538 1 1 . 1 1 101 101 PRO HA H 101 4.952 4.952 3.406 1.546 18321 539 1 1 . 1 1 101 101 PRO C C 101 175.976 175.976 176.275 -0.299 18321 540 1 1 . 1 1 101 101 PRO CA C 101 53.312 53.312 61.572 -8.260 18321 541 1 1 . 1 1 101 101 PRO CB C 101 31.598 31.598 31.792 -0.194 18321 542 1 1 . 1 1 102 102 ALA N N 102 125.968 125.968 124.689 1.279 18321 543 1 1 . 1 1 102 102 ALA HA H 102 4.516 4.516 4.321 0.195 18321 544 1 1 . 1 1 102 102 ALA CA C 102 49.852 49.852 49.827 0.025 18321 545 1 1 . 1 1 102 102 ALA CB C 102 17.766 17.766 18.024 -0.258 18321 546 1 1 . 1 1 102 102 ALA H H 102 8.232 8.232 8.015 0.217 18321 547 1 1 . 1 1 103 103 PRO HA H 103 4.283 4.283 4.125 0.158 18321 548 1 1 . 1 1 103 103 PRO CA C 103 62.435 62.435 62.637 -0.202 18321 549 1 1 . 1 1 103 103 PRO CB C 103 32.145 32.145 32.010 0.135 18321 550 1 1 . 1 1 104 104 ARG HA H 104 4.004 4.004 4.136 -0.132 18321 551 1 1 . 1 1 104 104 ARG CA C 104 56.660 56.660 58.003 -1.343 18321 552 1 1 . 1 1 106 106 PRO C C 106 174.587 174.587 176.115 -1.528 18321 553 1 1 . 1 1 106 106 PRO CA C 106 57.867 57.867 62.024 -4.157 18321 554 1 1 . 1 1 106 106 PRO CB C 106 31.942 31.942 30.300 1.642 18321 555 1 1 . 1 1 107 107 SER N N 107 121.280 121.280 117.991 3.289 18321 556 1 1 . 1 1 107 107 SER CA C 107 61.772 61.772 57.589 4.183 18321 557 1 1 . 1 1 107 107 SER CB C 107 63.234 63.234 62.593 0.641 18321 558 1 1 . 1 1 107 107 SER H H 107 8.132 8.132 7.636 0.496 18321 559 1 1 . 1 1 109 109 PRO C C 109 177.129 177.129 176.849 0.280 18321 560 1 1 . 1 1 109 109 PRO CA C 109 62.638 62.638 64.586 -1.948 18321 561 1 1 . 1 1 109 109 PRO CB C 109 30.970 30.970 32.060 -1.090 18321 562 1 1 . 1 1 110 110 MET N N 110 120.772 120.772 113.364 7.408 18321 563 1 1 . 1 1 110 110 MET C C 110 176.892 176.892 175.382 1.510 18321 564 1 1 . 1 1 110 110 MET CA C 110 55.310 55.310 55.009 0.301 18321 565 1 1 . 1 1 110 110 MET CB C 110 32.202 32.202 33.296 -1.094 18321 566 1 1 . 1 1 110 110 MET H H 110 8.430 8.430 7.620 0.810 18321 567 1 1 . 1 1 111 111 GLY N N 111 110.158 110.158 109.023 1.135 18321 568 1 1 . 1 1 111 111 GLY C C 111 177.430 177.430 174.793 2.637 18321 569 1 1 . 1 1 111 111 GLY CA C 111 44.951 44.951 45.291 -0.340 18321 570 1 1 . 1 1 111 111 GLY H H 111 8.384 8.384 8.688 -0.304 18321 571 1 1 . 1 1 112 112 SER N N 112 116.762 116.762 122.057 -5.295 18321 572 1 1 . 1 1 112 112 SER CA C 112 55.948 55.948 58.637 -2.689 18321 573 1 1 . 1 1 112 112 SER CB C 112 62.745 62.745 62.829 -0.084 18321 574 1 1 . 1 1 112 112 SER H H 112 8.161 8.161 8.139 0.022 18321 575 1 1 . 1 1 113 113 VAL C C 113 176.083 176.083 176.272 -0.189 18321 576 1 1 . 1 1 114 114 SER N N 114 119.151 119.151 123.421 -4.270 18321 577 1 1 . 1 1 114 114 SER C C 114 173.638 173.638 174.445 -0.807 18321 578 1 1 . 1 1 114 114 SER CA C 114 58.005 58.005 60.540 -2.535 18321 579 1 1 . 1 1 114 114 SER CB C 114 63.169 63.169 62.696 0.473 18321 580 1 1 . 1 1 114 114 SER H H 114 8.319 8.319 8.749 -0.430 18321 581 1 1 . 1 1 115 115 ALA N N 115 126.914 126.914 124.812 2.102 18321 582 1 1 . 1 1 115 115 ALA CA C 115 51.561 51.561 52.051 -0.490 18321 583 1 1 . 1 1 115 115 ALA CB C 115 17.714 17.714 18.241 -0.527 18321 584 1 1 . 1 1 115 115 ALA H H 115 8.197 8.197 7.893 0.304 18321 585 1 1 . 1 1 119 119 PRO C C 119 177.065 177.065 176.897 0.168 18321 586 1 1 . 1 1 120 120 THR N N 120 113.976 113.976 110.658 3.318 18321 587 1 1 . 1 1 120 120 THR C C 120 174.461 174.461 173.119 1.342 18321 588 1 1 . 1 1 120 120 THR CA C 120 61.215 61.215 62.435 -1.220 18321 589 1 1 . 1 1 120 120 THR CB C 120 69.508 69.508 69.952 -0.444 18321 590 1 1 . 1 1 120 120 THR H H 120 8.138 8.138 7.966 0.172 18321 591 1 1 . 1 1 121 121 ALA N N 121 125.859 125.859 122.902 2.957 18321 592 1 1 . 1 1 121 121 ALA CA C 121 52.281 52.281 51.901 0.380 18321 593 1 1 . 1 1 121 121 ALA CB C 121 18.623 18.623 19.965 -1.342 18321 594 1 1 . 1 1 121 121 ALA H H 121 8.272 8.272 7.647 0.625 18321 595 1 1 . 1 1 122 122 GLU C C 122 176.316 176.316 175.114 1.202 18321 596 1 1 . 1 1 123 123 ASP N N 123 120.448 120.448 117.924 2.524 18321 597 1 1 . 1 1 123 123 ASP C C 123 175.906 175.906 175.740 0.166 18321 598 1 1 . 1 1 123 123 ASP CA C 123 54.167 54.167 55.107 -0.940 18321 599 1 1 . 1 1 123 123 ASP CB C 123 40.695 40.695 40.962 -0.266 18321 600 1 1 . 1 1 123 123 ASP H H 123 8.181 8.181 8.016 0.165 18321 601 1 1 . 1 1 124 124 ASN N N 124 118.207 118.207 117.964 0.243 18321 602 1 1 . 1 1 124 124 ASN C C 124 174.851 174.851 174.668 0.183 18321 603 1 1 . 1 1 124 124 ASN CA C 124 52.771 52.771 52.730 0.042 18321 604 1 1 . 1 1 124 124 ASN CB C 124 38.304 38.304 39.480 -1.176 18321 605 1 1 . 1 1 124 124 ASN H H 124 8.307 8.307 8.068 0.239 18321 606 1 1 . 1 1 125 125 LEU N N 125 121.311 121.311 120.071 1.240 18321 607 1 1 . 1 1 125 125 LEU C C 125 175.750 175.750 175.681 0.069 18321 608 1 1 . 1 1 125 125 LEU CA C 125 54.428 54.428 55.565 -1.137 18321 609 1 1 . 1 1 125 125 LEU CB C 125 41.350 41.350 39.577 1.773 18321 610 1 1 . 1 1 125 125 LEU H H 125 7.747 7.747 8.747 -1.000 18321 611 1 1 . 1 1 126 126 GLU N N 126 122.485 122.485 118.846 3.639 18321 612 1 1 . 1 1 126 126 GLU C C 126 174.008 174.008 173.979 0.029 18321 613 1 1 . 1 1 126 126 GLU CA C 126 54.855 54.855 56.977 -2.122 18321 614 1 1 . 1 1 126 126 GLU CB C 126 30.472 30.472 30.920 -0.448 18321 615 1 1 . 1 1 126 126 GLU H H 126 8.453 8.453 8.184 0.269 18321 616 1 1 . 1 1 127 127 TYR N N 127 122.713 122.713 119.809 2.904 18321 617 1 1 . 1 1 127 127 TYR C C 127 176.859 176.859 174.499 2.360 18321 618 1 1 . 1 1 127 127 TYR CA C 127 56.528 56.528 57.122 -0.594 18321 619 1 1 . 1 1 127 127 TYR CB C 127 40.982 40.982 39.843 1.139 18321 620 1 1 . 1 1 127 127 TYR H H 127 8.469 8.469 8.329 0.140 18321 621 1 1 . 1 1 128 128 VAL N N 128 112.432 112.432 123.410 -10.978 18321 622 1 1 . 1 1 128 128 VAL C C 128 173.150 173.150 174.472 -1.322 18321 623 1 1 . 1 1 128 128 VAL CA C 128 57.940 57.940 60.711 -2.771 18321 624 1 1 . 1 1 128 128 VAL CB C 128 34.935 34.935 35.353 -0.418 18321 625 1 1 . 1 1 128 128 VAL H H 128 9.078 9.078 8.859 0.219 18321 626 1 1 . 1 1 129 129 ARG N N 129 120.373 120.373 124.327 -3.954 18321 627 1 1 . 1 1 129 129 ARG C C 129 176.539 176.539 175.172 1.367 18321 628 1 1 . 1 1 129 129 ARG CA C 129 52.534 52.534 54.322 -1.788 18321 629 1 1 . 1 1 129 129 ARG CB C 129 32.942 32.942 33.148 -0.206 18321 630 1 1 . 1 1 129 129 ARG H H 129 9.010 9.010 8.276 0.734 18321 631 1 1 . 1 1 130 130 THR N N 130 116.637 116.637 111.951 4.686 18321 632 1 1 . 1 1 130 130 THR CA C 130 60.618 60.618 60.479 0.139 18321 633 1 1 . 1 1 130 130 THR CB C 130 69.170 69.170 71.297 -2.127 18321 634 1 1 . 1 1 130 130 THR H H 130 9.045 9.045 9.361 -0.316 18321 635 1 1 . 1 1 131 131 LEU N N 131 122.910 122.910 121.605 1.305 18321 636 1 1 . 1 1 131 131 LEU C C 131 175.269 175.269 177.846 -2.577 18321 637 1 1 . 1 1 131 131 LEU CA C 131 55.122 55.122 55.345 -0.223 18321 638 1 1 . 1 1 131 131 LEU CB C 131 43.108 43.108 42.827 0.281 18321 639 1 1 . 1 1 131 131 LEU H H 131 9.224 9.224 8.348 0.876 18321 640 1 1 . 1 1 132 132 TYR N N 132 112.885 112.885 119.839 -6.954 18321 641 1 1 . 1 1 132 132 TYR C C 132 173.818 173.818 175.294 -1.476 18321 642 1 1 . 1 1 132 132 TYR CA C 132 54.230 54.230 58.883 -4.653 18321 643 1 1 . 1 1 132 132 TYR CB C 132 42.672 42.672 40.247 2.425 18321 644 1 1 . 1 1 132 132 TYR H H 132 7.284 7.284 7.800 -0.515 18321 645 1 1 . 1 1 133 133 ASP N N 133 118.003 118.003 119.279 -1.276 18321 646 1 1 . 1 1 133 133 ASP C C 133 175.779 175.779 174.513 1.266 18321 647 1 1 . 1 1 133 133 ASP CA C 133 54.351 54.351 55.314 -0.963 18321 648 1 1 . 1 1 133 133 ASP CB C 133 41.241 41.241 38.926 2.315 18321 649 1 1 . 1 1 133 133 ASP H H 133 8.399 8.399 8.249 0.150 18321 650 1 1 . 1 1 134 134 PHE N N 134 121.081 121.081 122.224 -1.143 18321 651 1 1 . 1 1 134 134 PHE CA C 134 52.552 52.552 54.631 -2.079 18321 652 1 1 . 1 1 134 134 PHE CB C 134 41.217 41.217 41.026 0.191 18321 653 1 1 . 1 1 134 134 PHE H H 134 8.797 8.797 6.675 2.122 18321 654 1 1 . 1 1 136 136 GLY C C 136 171.616 171.616 175.244 -3.628 18321 655 1 1 . 1 1 137 137 ASN N N 137 119.394 119.394 115.848 3.546 18321 656 1 1 . 1 1 137 137 ASN C C 137 174.500 174.500 173.523 0.977 18321 657 1 1 . 1 1 137 137 ASN CA C 137 44.670 44.670 54.621 -9.951 18321 658 1 1 . 1 1 137 137 ASN H H 137 9.477 9.477 8.567 0.910 18321 659 1 1 . 1 1 138 138 ASP N N 138 120.608 120.608 118.740 1.868 18321 660 1 1 . 1 1 138 138 ASP C C 138 176.987 176.987 174.864 2.123 18321 661 1 1 . 1 1 138 138 ASP CA C 138 52.992 52.992 53.562 -0.570 18321 662 1 1 . 1 1 138 138 ASP H H 138 8.216 8.216 8.221 -0.005 18321 663 1 1 . 1 1 139 139 ALA N N 139 124.371 124.371 121.011 3.360 18321 664 1 1 . 1 1 139 139 ALA C C 139 178.472 178.472 179.189 -0.717 18321 665 1 1 . 1 1 139 139 ALA CA C 139 54.513 54.513 53.801 0.712 18321 666 1 1 . 1 1 139 139 ALA CB C 139 18.045 18.045 19.574 -1.529 18321 667 1 1 . 1 1 139 139 ALA H H 139 8.565 8.565 8.600 -0.035 18321 668 1 1 . 1 1 140 140 GLU N N 140 115.022 115.022 118.049 -3.027 18321 669 1 1 . 1 1 140 140 GLU C C 140 177.027 177.027 175.845 1.182 18321 670 1 1 . 1 1 140 140 GLU CA C 140 56.181 56.181 58.044 -1.863 18321 671 1 1 . 1 1 140 140 GLU CB C 140 28.619 28.619 30.099 -1.480 18321 672 1 1 . 1 1 140 140 GLU H H 140 8.616 8.616 8.507 0.109 18321 673 1 1 . 1 1 141 141 ASP N N 141 121.913 121.913 119.538 2.375 18321 674 1 1 . 1 1 141 141 ASP C C 141 175.923 175.923 174.658 1.265 18321 675 1 1 . 1 1 141 141 ASP CA C 141 54.736 54.736 53.235 1.501 18321 676 1 1 . 1 1 141 141 ASP CB C 141 41.305 41.305 43.425 -2.120 18321 677 1 1 . 1 1 141 141 ASP H H 141 7.636 7.636 7.856 -0.220 18321 678 1 1 . 1 1 142 142 LEU N N 142 127.651 127.651 126.908 0.743 18321 679 1 1 . 1 1 142 142 LEU CA C 142 50.955 50.955 52.879 -1.924 18321 680 1 1 . 1 1 142 142 LEU CB C 142 42.343 42.343 43.541 -1.198 18321 681 1 1 . 1 1 142 142 LEU H H 142 9.479 9.479 8.093 1.386 18321 682 1 1 . 1 1 143 143 PRO C C 143 177.924 177.924 175.776 2.148 18321 683 1 1 . 1 1 144 144 PHE N N 144 114.483 114.483 120.439 -5.956 18321 684 1 1 . 1 1 144 144 PHE C C 144 175.055 175.055 174.773 0.282 18321 685 1 1 . 1 1 144 144 PHE CA C 144 55.543 55.543 54.903 0.640 18321 686 1 1 . 1 1 144 144 PHE CB C 144 40.581 40.581 41.158 -0.577 18321 687 1 1 . 1 1 144 144 PHE H H 144 8.637 8.637 7.371 1.266 18321 688 1 1 . 1 1 145 145 LYS N N 145 121.342 121.342 119.789 1.553 18321 689 1 1 . 1 1 145 145 LYS C C 145 176.925 176.925 175.713 1.212 18321 690 1 1 . 1 1 145 145 LYS CA C 145 53.043 53.043 55.310 -2.268 18321 691 1 1 . 1 1 145 145 LYS CB C 145 33.804 33.804 34.601 -0.797 18321 692 1 1 . 1 1 145 145 LYS H H 145 9.418 9.418 8.979 0.439 18321 693 1 1 . 1 1 146 146 LYS N N 146 123.378 123.378 118.739 4.639 18321 694 1 1 . 1 1 146 146 LYS CA C 146 57.883 57.883 55.771 2.112 18321 695 1 1 . 1 1 146 146 LYS CB C 146 32.008 32.008 31.576 0.432 18321 696 1 1 . 1 1 146 146 LYS H H 146 9.002 9.002 8.458 0.544 18321 697 1 1 . 1 1 147 147 GLY C C 147 174.315 174.315 173.849 0.466 18321 698 1 1 . 1 1 148 148 GLU N N 148 121.392 121.392 119.149 2.243 18321 699 1 1 . 1 1 148 148 GLU C C 148 174.998 174.998 175.239 -0.241 18321 700 1 1 . 1 1 148 148 GLU CA C 148 56.867 56.867 53.250 3.617 18321 701 1 1 . 1 1 148 148 GLU CB C 148 31.649 31.649 30.643 1.006 18321 702 1 1 . 1 1 148 148 GLU H H 148 7.937 7.937 7.824 0.113 18321 703 1 1 . 1 1 149 149 ILE N N 149 120.124 120.124 119.780 0.344 18321 704 1 1 . 1 1 149 149 ILE C C 149 176.647 176.647 174.835 1.812 18321 705 1 1 . 1 1 149 149 ILE CA C 149 58.621 58.621 60.448 -1.827 18321 706 1 1 . 1 1 149 149 ILE CB C 149 36.952 36.952 39.830 -2.877 18321 707 1 1 . 1 1 149 149 ILE H H 149 8.346 8.346 8.344 0.002 18321 708 1 1 . 1 1 150 150 LEU N N 150 126.950 126.950 124.990 1.960 18321 709 1 1 . 1 1 150 150 LEU CA C 150 51.967 51.967 52.814 -0.847 18321 710 1 1 . 1 1 150 150 LEU CB C 150 44.182 44.182 45.736 -1.554 18321 711 1 1 . 1 1 150 150 LEU H H 150 8.988 8.988 9.059 -0.071 18321 712 1 1 . 1 1 151 151 VAL C C 151 175.670 175.670 175.694 -0.024 18321 713 1 1 . 1 1 152 152 ILE N N 152 124.997 124.997 129.669 -4.672 18321 714 1 1 . 1 1 152 152 ILE CA C 152 58.331 58.331 60.034 -1.703 18321 715 1 1 . 1 1 152 152 ILE CB C 152 34.093 34.093 34.721 -0.629 18321 716 1 1 . 1 1 152 152 ILE H H 152 8.673 8.673 8.288 0.385 18321 717 1 1 . 1 1 153 153 ILE N N 153 124.710 124.710 127.122 -2.412 18321 718 1 1 . 1 1 153 153 ILE C C 153 176.264 176.264 174.586 1.678 18321 719 1 1 . 1 1 154 154 GLU N N 154 117.398 117.398 116.097 1.301 18321 720 1 1 . 1 1 154 154 GLU C C 154 173.959 173.959 174.681 -0.722 18321 721 1 1 . 1 1 154 154 GLU CA C 154 55.289 55.289 54.196 1.093 18321 722 1 1 . 1 1 154 154 GLU CB C 154 32.842 32.842 32.721 0.121 18321 723 1 1 . 1 1 154 154 GLU H H 154 7.818 7.818 8.288 -0.470 18321 724 1 1 . 1 1 155 155 LYS N N 155 121.130 121.130 123.684 -2.554 18321 725 1 1 . 1 1 155 155 LYS CA C 155 53.022 53.022 53.035 -0.013 18321 726 1 1 . 1 1 155 155 LYS CB C 155 32.663 32.663 33.163 -0.500 18321 727 1 1 . 1 1 155 155 LYS H H 155 8.654 8.654 9.350 -0.696 18321 728 1 1 . 1 1 157 157 GLU C C 157 175.190 175.190 176.923 -1.733 18321 729 1 1 . 1 1 157 157 GLU CA C 157 53.785 53.785 54.145 -0.360 18321 730 1 1 . 1 1 157 157 GLU CB C 157 32.685 32.685 31.749 0.936 18321 731 1 1 . 1 1 158 158 GLU N N 158 117.425 117.425 118.867 -1.442 18321 732 1 1 . 1 1 158 158 GLU C C 158 178.600 178.600 177.830 0.770 18321 733 1 1 . 1 1 158 158 GLU CA C 158 59.044 59.044 58.956 0.088 18321 734 1 1 . 1 1 158 158 GLU CB C 158 29.706 29.706 29.745 -0.039 18321 735 1 1 . 1 1 158 158 GLU H H 158 8.678 8.678 8.876 -0.198 18321 736 1 1 . 1 1 159 159 GLN N N 159 110.925 110.925 117.717 -6.792 18321 737 1 1 . 1 1 159 159 GLN C C 159 175.539 175.539 174.898 0.641 18321 738 1 1 . 1 1 159 159 GLN CA C 159 54.942 54.942 56.235 -1.293 18321 739 1 1 . 1 1 159 159 GLN CB C 159 28.572 28.572 29.495 -0.923 18321 740 1 1 . 1 1 159 159 GLN H H 159 8.483 8.483 8.651 -0.168 18321 741 1 1 . 1 1 160 160 TRP N N 160 120.171 120.171 120.155 0.016 18321 742 1 1 . 1 1 160 160 TRP C C 160 173.444 173.444 174.849 -1.405 18321 743 1 1 . 1 1 160 160 TRP CA C 160 56.175 56.175 56.399 -0.224 18321 744 1 1 . 1 1 160 160 TRP CB C 160 31.796 31.796 32.505 -0.709 18321 745 1 1 . 1 1 160 160 TRP H H 160 6.826 6.826 7.859 -1.033 18321 746 1 1 . 1 1 161 161 TRP N N 161 120.687 120.687 121.515 -0.828 18321 747 1 1 . 1 1 161 161 TRP C C 161 174.736 174.736 175.695 -0.959 18321 748 1 1 . 1 1 161 161 TRP CA C 161 51.889 51.889 54.707 -2.818 18321 749 1 1 . 1 1 161 161 TRP CB C 161 32.772 32.772 31.764 1.008 18321 750 1 1 . 1 1 161 161 TRP H H 161 8.462 8.462 9.467 -1.005 18321 751 1 1 . 1 1 162 162 SER N N 162 115.691 115.691 119.666 -3.975 18321 752 1 1 . 1 1 162 162 SER C C 162 174.320 174.320 173.394 0.926 18321 753 1 1 . 1 1 162 162 SER CA C 162 57.011 57.011 58.356 -1.345 18321 754 1 1 . 1 1 162 162 SER CB C 162 63.948 63.948 63.499 0.449 18321 755 1 1 . 1 1 162 162 SER H H 162 8.830 8.830 9.266 -0.436 18321 756 1 1 . 1 1 163 163 ALA N N 163 130.630 130.630 128.296 2.334 18321 757 1 1 . 1 1 163 163 ALA CA C 163 50.029 50.029 49.932 0.097 18321 758 1 1 . 1 1 163 163 ALA CB C 163 25.500 25.500 22.781 2.719 18321 759 1 1 . 1 1 163 163 ALA H H 163 9.585 9.585 9.119 0.466 18321 760 1 1 . 1 1 164 164 ARG N N 164 117.526 117.526 120.247 -2.721 18321 761 1 1 . 1 1 164 164 ARG C C 164 176.719 176.719 176.611 0.108 18321 762 1 1 . 1 1 164 164 ARG CA C 164 52.975 52.975 54.303 -1.328 18321 763 1 1 . 1 1 164 164 ARG CB C 164 34.260 34.260 31.073 3.187 18321 764 1 1 . 1 1 164 164 ARG H H 164 9.097 9.097 8.783 0.314 18321 765 1 1 . 1 1 165 165 ASN N N 165 123.935 123.935 122.951 0.984 18321 766 1 1 . 1 1 165 165 ASN C C 165 178.484 178.484 176.576 1.908 18321 767 1 1 . 1 1 165 165 ASN CA C 165 50.332 50.332 52.855 -2.523 18321 768 1 1 . 1 1 165 165 ASN CB C 165 39.487 39.487 40.019 -0.532 18321 769 1 1 . 1 1 165 165 ASN H H 165 8.756 8.756 8.622 0.134 18321 770 1 1 . 1 1 166 166 LYS N N 166 118.464 118.464 120.092 -1.628 18321 771 1 1 . 1 1 166 166 LYS C C 166 176.967 176.967 177.627 -0.660 18321 772 1 1 . 1 1 166 166 LYS CA C 166 58.430 58.430 58.800 -0.370 18321 773 1 1 . 1 1 166 166 LYS CB C 166 30.918 30.918 32.196 -1.278 18321 774 1 1 . 1 1 166 166 LYS H H 166 8.915 8.915 8.735 0.180 18321 775 1 1 . 1 1 167 167 ASP N N 167 118.138 118.138 115.527 2.611 18321 776 1 1 . 1 1 167 167 ASP C C 167 176.464 176.464 177.055 -0.591 18321 777 1 1 . 1 1 167 167 ASP CA C 167 54.212 54.212 55.272 -1.060 18321 778 1 1 . 1 1 167 167 ASP CB C 167 41.178 41.178 40.856 0.322 18321 779 1 1 . 1 1 167 167 ASP H H 167 7.508 7.508 8.252 -0.744 18321 780 1 1 . 1 1 168 168 GLY N N 168 107.901 107.901 106.147 1.754 18321 781 1 1 . 1 1 168 168 GLY C C 168 173.613 173.613 173.345 0.268 18321 782 1 1 . 1 1 168 168 GLY CA C 168 44.783 44.783 44.890 -0.107 18321 783 1 1 . 1 1 168 168 GLY H H 168 8.173 8.173 7.975 0.198 18321 784 1 1 . 1 1 169 169 ARG N N 169 124.324 124.324 120.601 3.723 18321 785 1 1 . 1 1 169 169 ARG CA C 169 56.106 56.106 55.862 0.243 18321 786 1 1 . 1 1 169 169 ARG CB C 169 29.648 29.648 31.165 -1.517 18321 787 1 1 . 1 1 169 169 ARG H H 169 7.998 7.998 8.117 -0.119 18321 788 1 1 . 1 1 170 170 VAL C C 170 177.590 177.590 175.209 2.381 18321 789 1 1 . 1 1 171 171 GLY N N 171 112.582 112.582 114.048 -1.466 18321 790 1 1 . 1 1 171 171 GLY C C 171 170.991 170.991 172.416 -1.425 18321 791 1 1 . 1 1 171 171 GLY CA C 171 45.361 45.361 44.759 0.602 18321 792 1 1 . 1 1 171 171 GLY H H 171 9.013 9.013 8.681 0.332 18321 793 1 1 . 1 1 172 172 MET N N 172 117.368 117.368 120.441 -3.073 18321 794 1 1 . 1 1 172 172 MET C C 172 177.921 177.921 176.368 1.553 18321 795 1 1 . 1 1 172 172 MET CA C 172 53.536 53.536 54.459 -0.923 18321 796 1 1 . 1 1 172 172 MET CB C 172 30.838 30.838 33.306 -2.468 18321 797 1 1 . 1 1 172 172 MET H H 172 8.885 8.885 8.082 0.803 18321 798 1 1 . 1 1 173 173 ILE N N 173 113.130 113.130 118.644 -5.514 18321 799 1 1 . 1 1 173 173 ILE CA C 173 56.284 56.284 57.919 -1.635 18321 800 1 1 . 1 1 173 173 ILE CB C 173 40.870 40.870 40.777 0.093 18321 801 1 1 . 1 1 173 173 ILE H H 173 9.704 9.704 9.323 0.381 18321 802 1 1 . 1 1 174 174 PRO C C 174 176.714 176.714 177.527 -0.813 18321 803 1 1 . 1 1 174 174 PRO CA C 174 66.290 66.290 61.495 4.795 18321 804 1 1 . 1 1 174 174 PRO CB C 174 28.993 28.993 30.882 -1.889 18321 805 1 1 . 1 1 175 175 VAL N N 175 128.066 128.066 123.634 4.432 18321 806 1 1 . 1 1 175 175 VAL CA C 175 59.356 59.356 67.131 -7.775 18321 807 1 1 . 1 1 175 175 VAL H H 175 7.327 7.327 8.087 -0.760 18321 808 1 1 . 1 1 176 176 PRO C C 176 176.351 176.351 176.447 -0.096 18321 809 1 1 . 1 1 177 177 TYR N N 177 115.756 115.756 115.977 -0.221 18321 810 1 1 . 1 1 177 177 TYR C C 177 175.011 175.011 175.456 -0.445 18321 811 1 1 . 1 1 177 177 TYR CA C 177 56.756 56.756 57.238 -0.482 18321 812 1 1 . 1 1 177 177 TYR CB C 177 37.507 37.507 39.190 -1.683 18321 813 1 1 . 1 1 177 177 TYR H H 177 7.784 7.784 7.439 0.345 18321 814 1 1 . 1 1 178 178 VAL N N 178 111.428 111.428 116.116 -4.688 18321 815 1 1 . 1 1 178 178 VAL C C 178 173.417 173.417 175.908 -2.491 18321 816 1 1 . 1 1 178 178 VAL CA C 178 58.307 58.307 59.553 -1.246 18321 817 1 1 . 1 1 178 178 VAL CB C 178 34.602 34.602 33.827 0.775 18321 818 1 1 . 1 1 178 178 VAL H H 178 7.801 7.801 7.519 0.282 18321 819 1 1 . 1 1 179 179 GLU N N 179 118.581 118.581 120.162 -1.581 18321 820 1 1 . 1 1 179 179 GLU C C 179 175.225 175.225 175.317 -0.092 18321 821 1 1 . 1 1 179 179 GLU CA C 179 53.114 53.114 56.201 -3.087 18321 822 1 1 . 1 1 179 179 GLU CB C 179 32.712 32.712 30.548 2.164 18321 823 1 1 . 1 1 179 179 GLU H H 179 8.819 8.819 8.432 0.387 18321 824 1 1 . 1 1 180 180 LYS N N 180 124.167 124.167 121.397 2.770 18321 825 1 1 . 1 1 180 180 LYS C C 180 176.303 176.303 176.599 -0.296 18321 826 1 1 . 1 1 180 180 LYS CA C 180 57.318 57.318 56.871 0.447 18321 827 1 1 . 1 1 180 180 LYS CB C 180 31.675 31.675 32.482 -0.807 18321 828 1 1 . 1 1 180 180 LYS H H 180 8.775 8.775 7.962 0.813 18321 829 1 1 . 1 1 181 181 LEU N N 181 125.157 125.157 126.227 -1.070 18321 830 1 1 . 1 1 181 181 LEU C C 181 176.462 176.462 177.641 -1.179 18321 831 1 1 . 1 1 181 181 LEU CA C 181 54.470 54.470 56.721 -2.252 18321 832 1 1 . 1 1 181 181 LEU CB C 181 41.625 41.625 42.861 -1.236 18321 833 1 1 . 1 1 181 181 LEU H H 181 8.084 8.084 8.027 0.057 18321 834 1 1 . 1 1 182 182 VAL N N 182 123.167 123.167 119.210 3.957 18321 835 1 1 . 1 1 182 182 VAL C C 182 175.983 175.983 173.592 2.391 18321 836 1 1 . 1 1 182 182 VAL CA C 182 61.613 61.613 62.512 -0.899 18321 837 1 1 . 1 1 182 182 VAL CB C 182 32.085 32.085 30.825 1.260 18321 838 1 1 . 1 1 182 182 VAL H H 182 8.345 8.345 8.311 0.034 18321 839 1 1 . 1 1 183 183 ARG N N 183 125.775 125.775 124.079 1.696 18321 840 1 1 . 1 1 183 183 ARG CA C 183 57.801 57.801 54.879 2.922 18321 841 1 1 . 1 1 183 183 ARG CB C 183 30.091 30.091 32.956 -2.865 18321 842 1 1 . 1 1 183 183 ARG H H 183 8.530 8.530 7.725 0.805 18321 843 1 1 . 1 1 184 184 SER C C 184 173.239 173.239 174.428 -1.189 18321 844 1 1 . 1 1 185 185 SER N N 185 116.511 116.511 113.599 2.912 18321 845 1 1 . 1 1 185 185 SER CA C 185 58.428 58.428 56.449 1.979 18321 846 1 1 . 1 1 185 185 SER CB C 185 69.737 69.737 63.318 6.419 18321 847 1 1 . 1 1 185 185 SER H H 185 7.944 7.944 7.777 0.167 18321 848 1 1 . 1 1 190 190 HIS C C 190 176.953 176.953 174.489 2.464 18321 849 1 1 . 1 1 190 190 HIS CA C 190 54.229 54.229 55.692 -1.463 18321 850 1 1 . 1 1 190 190 HIS CB C 190 35.112 35.112 28.007 7.105 18321 851 1 1 . 1 1 191 191 GLY N N 191 109.491 109.491 111.361 -1.870 18321 852 1 1 . 1 1 191 191 GLY C C 191 172.295 172.295 174.420 -2.125 18321 853 1 1 . 1 1 191 191 GLY CA C 191 45.227 45.227 45.582 -0.355 18321 854 1 1 . 1 1 191 191 GLY H H 191 8.719 8.719 7.987 0.732 18321 855 1 1 . 1 1 192 192 ASN N N 192 118.700 118.700 119.383 -0.683 18321 856 1 1 . 1 1 192 192 ASN HA H 192 4.312 4.312 4.396 -0.084 18321 857 1 1 . 1 1 192 192 ASN C C 192 176.369 176.369 175.054 1.315 18321 858 1 1 . 1 1 192 192 ASN CA C 192 57.787 57.787 55.092 2.695 18321 859 1 1 . 1 1 192 192 ASN H H 192 7.508 7.508 8.315 -0.807 18321 860 1 1 . 1 1 193 193 ARG N N 193 120.743 120.743 120.960 -0.217 18321 861 1 1 . 1 1 193 193 ARG H H 193 9.032 9.032 8.288 0.744 18321 862 1 1 . 1 1 197 197 SER HA H 197 4.388 4.388 4.018 0.370 18321 863 1 1 . 1 1 197 197 SER C C 197 174.133 174.133 173.378 0.755 18321 864 1 1 . 1 1 197 197 SER CA C 197 58.128 58.128 59.390 -1.262 18321 865 1 1 . 1 1 197 197 SER CB C 197 62.966 62.966 62.748 0.218 18321 866 1 1 . 1 1 198 198 TYR N N 198 121.435 121.435 125.793 -4.358 18321 867 1 1 . 1 1 198 198 TYR HA H 198 4.543 4.543 4.523 0.020 18321 868 1 1 . 1 1 198 198 TYR C C 198 176.230 176.230 176.905 -0.675 18321 869 1 1 . 1 1 198 198 TYR CA C 198 57.536 57.536 58.475 -0.939 18321 870 1 1 . 1 1 198 198 TYR CB C 198 38.279 38.279 39.399 -1.120 18321 871 1 1 . 1 1 198 198 TYR H H 198 8.071 8.071 8.354 -0.283 18321 872 1 1 . 1 1 199 199 GLY N N 199 110.039 110.039 108.700 1.339 18321 873 1 1 . 1 1 199 199 GLY C C 199 173.475 173.475 172.476 0.999 18321 874 1 1 . 1 1 199 199 GLY CA C 199 44.805 44.805 44.733 0.072 18321 875 1 1 . 1 1 199 199 GLY H H 199 8.162 8.162 8.533 -0.371 18321 876 1 1 . 1 1 200 200 ILE N N 200 121.530 121.530 123.746 -2.216 18321 877 1 1 . 1 1 200 200 ILE CA C 200 58.102 58.102 58.708 -0.606 18321 878 1 1 . 1 1 200 200 ILE CB C 200 37.760 37.760 39.314 -1.554 18321 879 1 1 . 1 1 200 200 ILE H H 200 7.851 7.851 8.252 -0.401 18321 880 1 1 . 1 1 201 201 PRO C C 201 176.485 176.485 175.699 0.786 18321 881 1 1 . 1 1 201 201 PRO CA C 201 53.893 53.893 62.638 -8.745 18321 882 1 1 . 1 1 201 201 PRO CB C 201 29.042 29.042 31.216 -2.174 18321 883 1 1 . 1 1 202 202 GLU N N 202 122.468 122.468 123.853 -1.385 18321 884 1 1 . 1 1 202 202 GLU CA C 202 62.490 62.490 53.897 8.593 18321 885 1 1 . 1 1 202 202 GLU CB C 202 31.170 31.170 31.542 -0.372 18321 886 1 1 . 1 1 202 202 GLU H H 202 8.328 8.328 8.034 0.294 18321 887 1 1 . 1 1 203 203 PRO CA C 203 62.803 62.803 64.165 -1.362 18321 888 1 1 . 1 1 203 203 PRO CB C 203 31.220 31.220 31.603 -0.383 18321 889 1 1 . 1 1 204 204 ALA N N 204 123.251 123.251 119.579 3.672 18321 890 1 1 . 1 1 204 204 ALA HA H 204 4.180 4.180 4.140 0.040 18321 891 1 1 . 1 1 204 204 ALA CA C 204 52.124 52.124 53.696 -1.572 18321 892 1 1 . 1 1 204 204 ALA CB C 204 18.892 18.892 18.440 0.452 18321 893 1 1 . 1 1 204 204 ALA H H 204 8.308 8.308 7.977 0.331 18321 894 1 1 . 1 1 205 205 HIS N N 205 117.874 117.874 116.156 1.718 18321 895 1 1 . 1 1 205 205 HIS C C 205 173.282 173.282 174.772 -1.490 18321 896 1 1 . 1 1 205 205 HIS H H 205 8.045 8.045 7.816 0.229 18321 897 1 1 . 1 1 206 206 ALA N N 206 125.519 125.519 124.073 1.446 18321 898 1 1 . 1 1 206 206 ALA HA H 206 4.204 4.204 4.088 0.116 18321 899 1 1 . 1 1 206 206 ALA CA C 206 40.196 40.196 54.093 -13.897 18321 900 1 1 . 1 1 206 206 ALA CB C 206 19.407 19.407 19.294 0.113 18321 901 1 1 . 1 1 206 206 ALA H H 206 8.061 8.061 7.523 0.538 18321 902 1 1 . 1 1 207 207 TYR N N 207 120.381 120.381 118.672 1.709 18321 903 1 1 . 1 1 207 207 TYR HA H 207 4.570 4.570 4.626 -0.056 18321 904 1 1 . 1 1 207 207 TYR CA C 207 52.572 52.572 56.442 -3.870 18321 905 1 1 . 1 1 207 207 TYR CB C 207 41.333 41.333 38.016 3.317 18321 906 1 1 . 1 1 207 207 TYR H H 207 8.199 8.199 7.957 0.242 18321 907 1 1 . 1 1 208 208 ALA HA H 208 4.281 4.281 4.532 -0.251 18321 908 1 1 . 1 1 208 208 ALA C C 208 177.736 177.736 177.864 -0.128 18321 909 1 1 . 1 1 208 208 ALA CA C 208 52.084 52.084 52.059 0.025 18321 910 1 1 . 1 1 208 208 ALA CB C 208 18.999 18.999 19.816 -0.817 18321 911 1 1 . 1 1 209 209 GLN N N 209 119.295 119.295 121.971 -2.676 18321 912 1 1 . 1 1 209 209 GLN CA C 209 61.474 61.474 54.649 6.825 18321 913 1 1 . 1 1 209 209 GLN CB C 209 32.039 32.039 28.272 3.767 18321 914 1 1 . 1 1 209 209 GLN H H 209 8.125 8.125 8.558 -0.433 18321 915 1 1 . 1 1 210 210 PRO HA H 210 4.395 4.395 4.313 0.082 18321 916 1 1 . 1 1 210 210 PRO CA C 210 62.584 62.584 62.723 -0.139 18321 917 1 1 . 1 1 211 211 GLN HA H 211 4.377 4.377 3.977 0.400 18321 918 1 1 . 1 1 211 211 GLN CA C 211 55.859 55.859 57.957 -2.098 18321 919 1 1 . 1 1 211 211 GLN CB C 211 29.577 29.577 28.740 0.837 18321 920 1 1 . 1 1 212 212 THR C C 212 176.551 176.551 173.089 3.462 18321 921 1 1 . 1 1 212 212 THR CB C 212 69.890 69.890 68.913 0.977 18321 922 1 1 . 1 1 213 213 THR N N 213 108.487 108.487 121.798 -13.311 18321 923 1 1 . 1 1 213 213 THR CA C 213 61.236 61.236 62.950 -1.714 18321 924 1 1 . 1 1 213 213 THR CB C 213 69.091 69.091 69.068 0.023 18321 925 1 1 . 1 1 213 213 THR H H 213 8.243 8.243 8.452 -0.209 18321 926 1 1 . 1 1 214 214 THR N N 214 119.445 119.445 123.160 -3.715 18321 927 1 1 . 1 1 214 214 THR CA C 214 59.425 59.425 60.734 -1.309 18321 928 1 1 . 1 1 214 214 THR CB C 214 69.251 69.251 69.752 -0.501 18321 929 1 1 . 1 1 214 214 THR H H 214 8.188 8.188 8.278 -0.090 18321 930 1 1 . 1 1 215 215 PRO HA H 215 4.361 4.361 4.685 -0.324 18321 931 1 1 . 1 1 215 215 PRO C C 215 175.422 175.422 175.882 -0.460 18321 932 1 1 . 1 1 215 215 PRO CA C 215 63.320 63.320 62.691 0.629 18321 933 1 1 . 1 1 215 215 PRO CB C 215 31.918 31.918 31.689 0.229 18321 934 1 1 . 1 1 216 216 LEU N N 216 121.602 121.602 125.222 -3.620 18321 935 1 1 . 1 1 216 216 LEU CA C 216 52.203 52.203 51.991 0.212 18321 936 1 1 . 1 1 216 216 LEU CB C 216 42.451 42.451 41.547 0.904 18321 937 1 1 . 1 1 216 216 LEU H H 216 7.891 7.891 8.076 -0.185 18321 938 1 1 . 1 1 217 217 PRO HA H 217 4.398 4.398 4.504 -0.106 18321 939 1 1 . 1 1 217 217 PRO C C 217 176.577 176.577 175.870 0.707 18321 940 1 1 . 1 1 217 217 PRO CA C 217 62.984 62.984 62.728 0.256 18321 941 1 1 . 1 1 217 217 PRO CB C 217 32.056 32.056 30.540 1.516 18321 942 1 1 . 1 1 218 218 ALA N N 218 124.087 124.087 128.065 -3.978 18321 943 1 1 . 1 1 218 218 ALA HA H 218 4.309 4.309 4.470 -0.161 18321 944 1 1 . 1 1 218 218 ALA C C 218 177.844 177.844 177.246 0.598 18321 945 1 1 . 1 1 218 218 ALA CA C 218 52.379 52.379 51.538 0.841 18321 946 1 1 . 1 1 218 218 ALA CB C 218 19.133 19.133 19.736 -0.603 18321 947 1 1 . 1 1 218 218 ALA H H 218 8.261 8.261 7.969 0.292 18321 948 1 1 . 1 1 219 219 VAL N N 219 118.942 118.942 121.667 -2.725 18321 949 1 1 . 1 1 219 219 VAL HA H 219 4.142 4.142 4.017 0.125 18321 950 1 1 . 1 1 219 219 VAL CA C 219 62.102 62.102 63.277 -1.175 18321 951 1 1 . 1 1 219 219 VAL CB C 219 32.923 32.923 31.843 1.080 18321 952 1 1 . 1 1 219 219 VAL H H 219 8.049 8.049 8.516 -0.467 18321 953 1 1 . 1 1 220 220 SER N N 220 119.207 119.207 125.048 -5.841 18321 954 1 1 . 1 1 220 220 SER HA H 220 4.436 4.436 4.841 -0.405 18321 955 1 1 . 1 1 220 220 SER CA C 220 57.813 57.813 57.537 0.276 18321 956 1 1 . 1 1 220 220 SER CB C 220 63.375 63.375 65.506 -2.131 18321 957 1 1 . 1 1 220 220 SER H H 220 8.275 8.275 8.658 -0.383 18321 958 1 1 . 1 1 221 221 GLY N N 221 110.973 110.973 109.716 1.257 18321 959 1 1 . 1 1 221 221 GLY C C 221 173.962 173.962 173.643 0.319 18321 960 1 1 . 1 1 221 221 GLY CA C 221 45.286 45.286 44.785 0.501 18321 961 1 1 . 1 1 221 221 GLY H H 221 8.374 8.374 8.407 -0.033 18321 962 1 1 . 1 1 222 222 SER N N 222 115.516 115.516 117.571 -2.055 18321 963 1 1 . 1 1 222 222 SER HA H 222 4.763 4.763 4.999 -0.236 18321 964 1 1 . 1 1 222 222 SER CA C 222 56.407 56.407 55.746 0.661 18321 965 1 1 . 1 1 222 222 SER CB C 222 63.993 63.993 65.017 -1.024 18321 966 1 1 . 1 1 222 222 SER H H 222 8.155 8.155 8.392 -0.237 18321 967 1 1 . 1 1 223 223 PRO HA H 223 4.417 4.417 4.491 -0.074 18321 968 1 1 . 1 1 223 223 PRO CA C 223 63.805 63.805 62.920 0.885 18321 969 1 1 . 1 1 223 223 PRO CB C 223 32.090 32.090 31.800 0.290 18321 970 1 1 . 1 1 224 224 GLY N N 224 109.149 109.149 112.532 -3.383 18321 971 1 1 . 1 1 224 224 GLY C C 224 173.813 173.813 173.588 0.225 18321 972 1 1 . 1 1 224 224 GLY CA C 224 44.512 44.512 44.773 -0.261 18321 973 1 1 . 1 1 224 224 GLY H H 224 8.376 8.376 8.592 -0.216 18321 974 1 1 . 1 1 225 225 ALA N N 225 123.599 123.599 128.339 -4.740 18321 975 1 1 . 1 1 225 225 ALA C C 225 177.341 177.341 176.433 0.908 18321 976 1 1 . 1 1 225 225 ALA CA C 225 51.878 51.878 51.740 0.138 18321 977 1 1 . 1 1 225 225 ALA CB C 225 19.169 19.169 20.126 -0.957 18321 978 1 1 . 1 1 225 225 ALA H H 225 7.959 7.959 7.697 0.262 18321 979 1 1 . 1 1 226 226 ALA N N 226 123.218 123.218 127.719 -4.501 18321 980 1 1 . 1 1 226 226 ALA HA H 226 4.350 4.350 4.414 -0.064 18321 981 1 1 . 1 1 226 226 ALA C C 226 177.520 177.520 177.171 0.349 18321 982 1 1 . 1 1 226 226 ALA CA C 226 52.535 52.535 51.924 0.611 18321 983 1 1 . 1 1 226 226 ALA CB C 226 19.171 19.171 18.706 0.466 18321 984 1 1 . 1 1 226 226 ALA H H 226 8.169 8.169 8.445 -0.276 18321 985 1 1 . 1 1 227 227 ILE N N 227 120.086 120.086 122.680 -2.594 18321 986 1 1 . 1 1 227 227 ILE HA H 227 4.201 4.201 4.147 0.054 18321 987 1 1 . 1 1 227 227 ILE C C 227 174.814 174.814 176.304 -1.490 18321 988 1 1 . 1 1 227 227 ILE CA C 227 60.929 60.929 60.621 0.308 18321 989 1 1 . 1 1 227 227 ILE CB C 227 38.872 38.872 36.742 2.131 18321 990 1 1 . 1 1 227 227 ILE H H 227 8.037 8.037 8.526 -0.489 18321 991 1 1 . 1 1 228 228 THR N N 228 117.224 117.224 116.110 1.114 18321 992 1 1 . 1 1 228 228 THR HA H 228 4.203 4.203 4.367 -0.164 18321 993 1 1 . 1 1 228 228 THR CA C 228 57.108 57.108 60.922 -3.813 18321 994 1 1 . 1 1 228 228 THR CB C 228 69.945 69.945 68.902 1.043 18321 995 1 1 . 1 1 228 228 THR H H 228 7.775 7.775 7.616 0.159 18321 996 1 1 . 1 1 229 229 PRO HA H 229 4.750 4.750 4.309 0.441 18321 997 1 1 . 1 1 229 229 PRO CA C 229 62.480 62.480 62.923 -0.443 18321 998 1 1 . 1 1 229 229 PRO CB C 229 33.995 33.995 31.853 2.142 18321 999 1 1 . 1 1 230 230 LEU N N 230 123.629 123.629 119.098 4.531 18321 1000 1 1 . 1 1 230 230 LEU CA C 230 53.076 53.076 54.135 -1.059 18321 1001 1 1 . 1 1 230 230 LEU CB C 230 40.608 40.608 41.297 -0.689 18321 1002 1 1 . 1 1 230 230 LEU H H 230 8.453 8.453 7.656 0.797 18321 1003 1 1 . 1 1 231 231 PRO HA H 231 4.412 4.412 4.682 -0.270 18321 1004 1 1 . 1 1 231 231 PRO C C 231 176.571 176.571 176.540 0.031 18321 1005 1 1 . 1 1 231 231 PRO CA C 231 63.225 63.225 62.042 1.183 18321 1006 1 1 . 1 1 231 231 PRO CB C 231 31.191 31.191 32.675 -1.484 18321 1007 1 1 . 1 1 232 232 SER N N 232 115.169 115.169 116.509 -1.340 18321 1008 1 1 . 1 1 232 232 SER HA H 232 4.450 4.450 4.292 0.158 18321 1009 1 1 . 1 1 232 232 SER CA C 232 58.604 58.604 59.899 -1.295 18321 1010 1 1 . 1 1 232 232 SER CB C 232 63.962 63.962 62.844 1.118 18321 1011 1 1 . 1 1 232 232 SER H H 232 8.280 8.280 8.489 -0.209 18321 1012 1 1 . 1 1 233 233 THR N N 233 115.155 115.155 117.276 -2.121 18321 1013 1 1 . 1 1 233 233 THR HA H 233 4.351 4.351 4.401 -0.050 18321 1014 1 1 . 1 1 233 233 THR C C 233 177.237 177.237 174.582 2.655 18321 1015 1 1 . 1 1 233 233 THR CA C 233 61.939 61.939 61.640 0.299 18321 1016 1 1 . 1 1 233 233 THR CB C 233 68.986 68.986 69.863 -0.877 18321 1017 1 1 . 1 1 233 233 THR H H 233 8.096 8.096 8.363 -0.267 18321 1018 1 1 . 1 1 234 234 GLN N N 234 122.040 122.040 118.153 3.887 18321 1019 1 1 . 1 1 234 234 GLN HA H 234 4.681 4.681 3.975 0.706 18321 1020 1 1 . 1 1 234 234 GLN C C 234 176.177 176.177 174.959 1.218 18321 1021 1 1 . 1 1 234 234 GLN CA C 234 55.861 55.861 56.417 -0.556 18321 1022 1 1 . 1 1 234 234 GLN CB C 234 28.583 28.583 27.073 1.510 18321 1023 1 1 . 1 1 234 234 GLN H H 234 8.256 8.256 8.533 -0.277 18321 1024 1 1 . 1 1 235 235 ASN N N 235 119.506 119.506 117.884 1.622 18321 1025 1 1 . 1 1 235 235 ASN HA H 235 4.775 4.775 4.800 -0.025 18321 1026 1 1 . 1 1 235 235 ASN C C 235 174.974 174.974 175.395 -0.421 18321 1027 1 1 . 1 1 235 235 ASN CA C 235 53.191 53.191 53.608 -0.417 18321 1028 1 1 . 1 1 235 235 ASN CB C 235 38.511 38.511 39.066 -0.555 18321 1029 1 1 . 1 1 235 235 ASN H H 235 8.346 8.346 7.537 0.809 18321 1030 1 1 . 1 1 236 236 GLY N N 236 109.378 109.378 109.654 -0.276 18321 1031 1 1 . 1 1 236 236 GLY CA C 236 44.023 44.023 44.677 -0.654 18321 1032 1 1 . 1 1 236 236 GLY H H 236 7.939 7.939 8.455 -0.516 18321 1033 1 1 . 1 1 237 237 PRO HA H 237 4.336 4.336 4.316 0.020 18321 1034 1 1 . 1 1 237 237 PRO C C 237 175.942 175.942 175.574 0.368 18321 1035 1 1 . 1 1 237 237 PRO CA C 237 62.797 62.797 62.310 0.487 18321 1036 1 1 . 1 1 237 237 PRO CB C 237 27.421 27.421 32.322 -4.901 18321 1037 1 1 . 1 1 238 238 VAL N N 238 120.535 120.535 119.657 0.878 18321 1038 1 1 . 1 1 238 238 VAL HA H 238 4.195 4.195 4.153 0.042 18321 1039 1 1 . 1 1 238 238 VAL C C 238 173.775 173.775 174.520 -0.745 18321 1040 1 1 . 1 1 238 238 VAL CA C 238 61.173 61.173 61.639 -0.466 18321 1041 1 1 . 1 1 238 238 VAL CB C 238 38.328 38.328 32.165 6.163 18321 1042 1 1 . 1 1 238 238 VAL H H 238 7.986 7.986 7.835 0.151 18321 1043 1 1 . 1 1 239 239 PHE N N 239 123.522 123.522 125.813 -2.291 18321 1044 1 1 . 1 1 239 239 PHE HA H 239 5.539 5.539 5.361 0.178 18321 1045 1 1 . 1 1 239 239 PHE C C 239 174.207 174.207 174.386 -0.179 18321 1046 1 1 . 1 1 239 239 PHE CA C 239 56.993 56.993 56.103 0.890 18321 1047 1 1 . 1 1 239 239 PHE CB C 239 41.743 41.743 41.962 -0.219 18321 1048 1 1 . 1 1 239 239 PHE H H 239 8.927 8.927 8.638 0.289 18321 1049 1 1 . 1 1 240 240 ALA N N 240 120.871 120.871 124.670 -3.799 18321 1050 1 1 . 1 1 240 240 ALA HA H 240 5.352 5.352 5.610 -0.258 18321 1051 1 1 . 1 1 240 240 ALA C C 240 174.639 174.639 175.439 -0.800 18321 1052 1 1 . 1 1 240 240 ALA CA C 240 49.736 49.736 50.533 -0.798 18321 1053 1 1 . 1 1 240 240 ALA CB C 240 23.480 23.480 23.062 0.418 18321 1054 1 1 . 1 1 240 240 ALA H H 240 9.398 9.398 8.899 0.499 18321 1055 1 1 . 1 1 241 241 LYS N N 241 121.227 121.227 123.471 -2.244 18321 1056 1 1 . 1 1 241 241 LYS HA H 241 5.373 5.373 5.255 0.118 18321 1057 1 1 . 1 1 241 241 LYS C C 241 176.772 176.772 175.759 1.013 18321 1058 1 1 . 1 1 241 241 LYS CA C 241 53.128 53.128 54.515 -1.387 18321 1059 1 1 . 1 1 241 241 LYS CB C 241 34.850 34.850 35.121 -0.271 18321 1060 1 1 . 1 1 241 241 LYS H H 241 8.947 8.947 8.299 0.648 18321 1061 1 1 . 1 1 242 242 ALA N N 242 126.833 126.833 130.534 -3.701 18321 1062 1 1 . 1 1 242 242 ALA HA H 242 4.764 4.764 4.569 0.195 18321 1063 1 1 . 1 1 242 242 ALA C C 242 178.506 178.506 177.063 1.443 18321 1064 1 1 . 1 1 242 242 ALA CA C 242 52.788 52.788 51.499 1.289 18321 1065 1 1 . 1 1 242 242 ALA CB C 242 19.084 19.084 18.954 0.130 18321 1066 1 1 . 1 1 242 242 ALA H H 242 9.373 9.373 8.927 0.446 18321 1067 1 1 . 1 1 243 243 ILE N N 243 118.731 118.731 118.462 0.269 18321 1068 1 1 . 1 1 243 243 ILE HA H 243 4.454 4.454 4.239 0.215 18321 1069 1 1 . 1 1 243 243 ILE C C 243 174.773 174.773 175.615 -0.842 18321 1070 1 1 . 1 1 243 243 ILE CA C 243 60.613 60.613 62.261 -1.648 18321 1071 1 1 . 1 1 243 243 ILE CB C 243 39.232 39.232 38.579 0.653 18321 1072 1 1 . 1 1 243 243 ILE H H 243 8.933 8.933 8.295 0.638 18321 1073 1 1 . 1 1 244 244 GLN N N 244 121.616 121.616 119.746 1.870 18321 1074 1 1 . 1 1 244 244 GLN HA H 244 4.283 4.283 4.511 -0.228 18321 1075 1 1 . 1 1 244 244 GLN C C 244 172.815 172.815 174.655 -1.840 18321 1076 1 1 . 1 1 244 244 GLN CA C 244 54.750 54.750 54.414 0.336 18321 1077 1 1 . 1 1 244 244 GLN CB C 244 31.469 31.469 32.385 -0.916 18321 1078 1 1 . 1 1 244 244 GLN H H 244 7.438 7.438 7.705 -0.267 18321 1079 1 1 . 1 1 245 245 LYS N N 245 124.215 124.215 122.913 1.302 18321 1080 1 1 . 1 1 245 245 LYS HA H 245 3.962 3.962 4.165 -0.203 18321 1081 1 1 . 1 1 245 245 LYS C C 245 175.679 175.679 176.516 -0.837 18321 1082 1 1 . 1 1 245 245 LYS CA C 245 56.413 56.413 56.676 -0.263 18321 1083 1 1 . 1 1 245 245 LYS CB C 245 32.847 32.847 32.241 0.606 18321 1084 1 1 . 1 1 245 245 LYS H H 245 8.318 8.318 8.494 -0.176 18321 1085 1 1 . 1 1 246 246 ARG N N 246 127.327 127.327 125.595 1.732 18321 1086 1 1 . 1 1 246 246 ARG HA H 246 4.221 4.221 4.765 -0.544 18321 1087 1 1 . 1 1 246 246 ARG CA C 246 56.279 56.279 54.474 1.805 18321 1088 1 1 . 1 1 246 246 ARG CB C 246 32.987 32.987 31.586 1.401 18321 1089 1 1 . 1 1 246 246 ARG H H 246 9.248 9.248 8.657 0.591 18321 1090 1 1 . 1 1 249 249 CYS HA H 249 4.260 4.260 4.449 -0.189 18321 1091 1 1 . 1 1 249 249 CYS CA C 249 55.886 55.886 57.327 -1.441 18321 1092 1 1 . 1 1 249 249 CYS CB C 249 34.146 34.146 29.924 4.222 18321 1093 1 1 . 1 1 250 250 ALA HA H 250 3.926 3.926 4.184 -0.258 18321 1094 1 1 . 1 1 250 250 ALA CA C 250 54.344 54.344 54.011 0.333 18321 1095 1 1 . 1 1 250 250 ALA CB C 250 18.342 18.342 18.780 -0.438 18321 1096 1 1 . 1 1 251 251 TYR N N 251 110.618 110.618 113.337 -2.719 18321 1097 1 1 . 1 1 251 251 TYR HA H 251 4.489 4.489 4.757 -0.268 18321 1098 1 1 . 1 1 251 251 TYR C C 251 175.286 175.286 174.519 0.767 18321 1099 1 1 . 1 1 251 251 TYR CA C 251 56.137 56.137 53.916 2.221 18321 1100 1 1 . 1 1 251 251 TYR CB C 251 37.203 37.203 37.304 -0.101 18321 1101 1 1 . 1 1 251 251 TYR H H 251 7.037 7.037 6.973 0.064 18321 1102 1 1 . 1 1 252 252 ASP N N 252 121.835 121.835 121.192 0.643 18321 1103 1 1 . 1 1 252 252 ASP HA H 252 4.763 4.763 4.638 0.125 18321 1104 1 1 . 1 1 252 252 ASP CA C 252 52.351 52.351 54.605 -2.255 18321 1105 1 1 . 1 1 252 252 ASP CB C 252 39.995 39.995 41.465 -1.470 18321 1106 1 1 . 1 1 252 252 ASP H H 252 7.339 7.339 7.443 -0.104 18321 1107 1 1 . 1 1 253 253 LYS N N 253 123.177 123.177 124.113 -0.936 18321 1108 1 1 . 1 1 253 253 LYS HA H 253 4.270 4.270 4.579 -0.309 18321 1109 1 1 . 1 1 253 253 LYS C C 253 177.724 177.724 176.098 1.626 18321 1110 1 1 . 1 1 253 253 LYS CA C 253 57.036 57.036 55.734 1.302 18321 1111 1 1 . 1 1 253 253 LYS H H 253 8.396 8.396 8.683 -0.287 18321 1112 1 1 . 1 1 254 254 THR N N 254 108.317 108.317 110.697 -2.380 18321 1113 1 1 . 1 1 254 254 THR HA H 254 4.517 4.517 4.507 0.010 18321 1114 1 1 . 1 1 254 254 THR C C 254 174.012 174.012 172.799 1.213 18321 1115 1 1 . 1 1 254 254 THR CA C 254 61.036 61.036 61.844 -0.808 18321 1116 1 1 . 1 1 254 254 THR CB C 254 69.307 69.307 70.102 -0.795 18321 1117 1 1 . 1 1 254 254 THR H H 254 8.217 8.217 7.857 0.360 18321 1118 1 1 . 1 1 255 255 ALA N N 255 124.762 124.762 124.757 0.005 18321 1119 1 1 . 1 1 255 255 ALA HA H 255 4.524 4.524 5.317 -0.793 18321 1120 1 1 . 1 1 255 255 ALA C C 255 176.630 176.630 175.794 0.836 18321 1121 1 1 . 1 1 255 255 ALA CA C 255 51.352 51.352 50.036 1.316 18321 1122 1 1 . 1 1 255 255 ALA CB C 255 20.135 20.135 20.074 0.061 18321 1123 1 1 . 1 1 255 255 ALA H H 255 7.096 7.096 9.471 -2.375 18321 1124 1 1 . 1 1 256 256 LEU N N 256 124.379 124.379 124.423 -0.044 18321 1125 1 1 . 1 1 256 256 LEU HA H 256 4.328 4.328 4.195 0.133 18321 1126 1 1 . 1 1 256 256 LEU C C 256 176.007 176.007 175.901 0.106 18321 1127 1 1 . 1 1 256 256 LEU CA C 256 53.502 53.502 54.564 -1.062 18321 1128 1 1 . 1 1 256 256 LEU CB C 256 44.665 44.665 43.515 1.150 18321 1129 1 1 . 1 1 256 256 LEU H H 256 8.889 8.889 8.590 0.299 18321 1130 1 1 . 1 1 257 257 ALA N N 257 129.619 129.619 127.280 2.339 18321 1131 1 1 . 1 1 257 257 ALA HA H 257 4.445 4.445 4.897 -0.452 18321 1132 1 1 . 1 1 257 257 ALA C C 257 176.813 176.813 176.449 0.364 18321 1133 1 1 . 1 1 257 257 ALA CA C 257 51.179 51.179 51.048 0.131 18321 1134 1 1 . 1 1 257 257 ALA CB C 257 18.973 18.973 20.104 -1.131 18321 1135 1 1 . 1 1 257 257 ALA H H 257 8.529 8.529 8.204 0.325 18321 1136 1 1 . 1 1 258 258 LEU N N 258 119.300 119.300 124.291 -4.991 18321 1137 1 1 . 1 1 258 258 LEU HA H 258 4.782 4.782 4.771 0.011 18321 1138 1 1 . 1 1 258 258 LEU CA C 258 53.259 53.259 53.481 -0.222 18321 1139 1 1 . 1 1 258 258 LEU CB C 258 45.972 45.972 46.549 -0.577 18321 1140 1 1 . 1 1 258 258 LEU H H 258 8.505 8.505 8.805 -0.300 18321 1141 1 1 . 1 1 259 259 GLU N N 259 123.919 123.919 117.319 6.600 18321 1142 1 1 . 1 1 259 259 GLU HA H 259 4.516 4.516 4.580 -0.064 18321 1143 1 1 . 1 1 259 259 GLU C C 259 175.795 175.795 174.594 1.201 18321 1144 1 1 . 1 1 259 259 GLU CA C 259 52.896 52.896 54.843 -1.947 18321 1145 1 1 . 1 1 259 259 GLU H H 259 8.943 8.943 8.242 0.701 18321 1146 1 1 . 1 1 260 260 VAL N N 260 122.122 122.122 121.188 0.934 18321 1147 1 1 . 1 1 260 260 VAL HA H 260 2.923 2.923 4.426 -1.503 18321 1148 1 1 . 1 1 260 260 VAL C C 260 177.964 177.964 177.554 0.410 18321 1149 1 1 . 1 1 260 260 VAL CA C 260 65.417 65.417 64.088 1.329 18321 1150 1 1 . 1 1 260 260 VAL CB C 260 30.668 30.668 31.674 -1.006 18321 1151 1 1 . 1 1 260 260 VAL H H 260 8.956 8.956 8.425 0.531 18321 1152 1 1 . 1 1 261 261 GLY N N 261 116.009 116.009 116.399 -0.390 18321 1153 1 1 . 1 1 261 261 GLY C C 261 176.288 176.288 173.619 2.669 18321 1154 1 1 . 1 1 261 261 GLY CA C 261 44.210 44.210 44.685 -0.475 18321 1155 1 1 . 1 1 261 261 GLY H H 261 8.799 8.799 8.686 0.113 18321 1156 1 1 . 1 1 262 262 ASP N N 262 121.945 121.945 120.718 1.227 18321 1157 1 1 . 1 1 262 262 ASP HA H 262 4.423 4.423 4.940 -0.517 18321 1158 1 1 . 1 1 262 262 ASP C C 262 175.381 175.381 175.015 0.366 18321 1159 1 1 . 1 1 262 262 ASP CA C 262 55.243 55.243 52.322 2.921 18321 1160 1 1 . 1 1 262 262 ASP CB C 262 41.819 41.819 42.791 -0.972 18321 1161 1 1 . 1 1 262 262 ASP H H 262 8.180 8.180 7.687 0.493 18321 1162 1 1 . 1 1 263 263 ILE N N 263 121.452 121.452 123.300 -1.848 18321 1163 1 1 . 1 1 263 263 ILE HA H 263 4.707 4.707 4.819 -0.112 18321 1164 1 1 . 1 1 263 263 ILE C C 263 174.996 174.996 176.004 -1.008 18321 1165 1 1 . 1 1 263 263 ILE CA C 263 59.289 59.289 59.099 0.190 18321 1166 1 1 . 1 1 263 263 ILE CB C 263 36.987 36.987 38.340 -1.353 18321 1167 1 1 . 1 1 263 263 ILE H H 263 8.460 8.460 8.548 -0.088 18321 1168 1 1 . 1 1 264 264 VAL N N 264 128.756 128.756 128.920 -0.164 18321 1169 1 1 . 1 1 264 264 VAL HA H 264 4.309 4.309 4.069 0.240 18321 1170 1 1 . 1 1 264 264 VAL C C 264 175.486 175.486 175.067 0.419 18321 1171 1 1 . 1 1 264 264 VAL CA C 264 59.091 59.091 61.859 -2.768 18321 1172 1 1 . 1 1 264 264 VAL CB C 264 34.541 34.541 32.206 2.335 18321 1173 1 1 . 1 1 264 264 VAL H H 264 9.479 9.479 9.309 0.170 18321 1174 1 1 . 1 1 265 265 LYS N N 265 128.101 128.101 130.186 -2.085 18321 1175 1 1 . 1 1 265 265 LYS HA H 265 4.342 4.342 4.289 0.053 18321 1176 1 1 . 1 1 265 265 LYS C C 265 175.531 175.531 174.653 0.878 18321 1177 1 1 . 1 1 265 265 LYS CA C 265 55.620 55.620 56.126 -0.506 18321 1178 1 1 . 1 1 265 265 LYS CB C 265 33.149 33.149 32.530 0.619 18321 1179 1 1 . 1 1 265 265 LYS H H 265 8.715 8.715 8.757 -0.042 18321 1180 1 1 . 1 1 266 266 VAL N N 266 129.537 129.537 128.357 1.180 18321 1181 1 1 . 1 1 266 266 VAL HA H 266 4.333 4.333 4.730 -0.397 18321 1182 1 1 . 1 1 266 266 VAL C C 266 176.166 176.166 174.760 1.406 18321 1183 1 1 . 1 1 266 266 VAL CA C 266 63.339 63.339 60.101 3.238 18321 1184 1 1 . 1 1 266 266 VAL CB C 266 30.712 30.712 34.657 -3.945 18321 1185 1 1 . 1 1 266 266 VAL H H 266 9.073 9.073 8.229 0.844 18321 1186 1 1 . 1 1 267 267 THR N N 267 120.020 120.020 122.563 -2.543 18321 1187 1 1 . 1 1 267 267 THR HA H 267 4.189 4.189 4.319 -0.130 18321 1188 1 1 . 1 1 267 267 THR C C 267 176.054 176.054 175.391 0.663 18321 1189 1 1 . 1 1 267 267 THR CA C 267 62.204 62.204 63.483 -1.280 18321 1190 1 1 . 1 1 267 267 THR CB C 267 68.200 68.200 69.435 -1.235 18321 1191 1 1 . 1 1 267 267 THR H H 267 9.130 9.130 8.428 0.702 18321 1192 1 1 . 1 1 268 268 ARG N N 268 120.839 120.839 123.410 -2.571 18321 1193 1 1 . 1 1 268 268 ARG HA H 268 4.236 4.236 4.613 -0.377 18321 1194 1 1 . 1 1 268 268 ARG CA C 268 56.321 56.321 54.920 1.401 18321 1195 1 1 . 1 1 268 268 ARG CB C 268 33.049 33.049 30.814 2.235 18321 1196 1 1 . 1 1 268 268 ARG H H 268 7.631 7.631 7.581 0.050 18321 1197 1 1 . 1 1 269 269 MET N N 269 125.443 125.443 122.020 3.423 18321 1198 1 1 . 1 1 269 269 MET C C 269 174.392 174.392 173.994 0.398 18321 1199 1 1 . 1 1 269 269 MET H H 269 8.532 8.532 8.356 0.176 18321 1200 1 1 . 1 1 270 270 ASN N N 270 119.125 119.125 121.683 -2.558 18321 1201 1 1 . 1 1 270 270 ASN HA H 270 4.546 4.546 4.810 -0.264 18321 1202 1 1 . 1 1 270 270 ASN C C 270 172.133 172.133 176.793 -4.660 18321 1203 1 1 . 1 1 270 270 ASN CA C 270 53.639 53.639 52.395 1.244 18321 1204 1 1 . 1 1 270 270 ASN CB C 270 39.845 39.845 39.605 0.240 18321 1205 1 1 . 1 1 270 270 ASN H H 270 6.631 6.631 8.489 -1.858 18321 1206 1 1 . 1 1 271 271 ILE N N 271 122.532 122.532 116.746 5.786 18321 1207 1 1 . 1 1 271 271 ILE HA H 271 4.417 4.417 4.206 0.211 18321 1208 1 1 . 1 1 271 271 ILE CA C 271 63.348 63.348 62.904 0.444 18321 1209 1 1 . 1 1 271 271 ILE CB C 271 38.198 38.198 36.756 1.442 18321 1210 1 1 . 1 1 271 271 ILE H H 271 8.565 8.565 8.388 0.177 18321 1211 1 1 . 1 1 272 272 ASN HA H 272 4.527 4.527 4.726 -0.200 18321 1212 1 1 . 1 1 272 272 ASN C C 272 176.259 176.259 176.259 0.000 18321 1213 1 1 . 1 1 272 272 ASN CA C 272 53.225 53.225 53.048 0.177 18321 1214 1 1 . 1 1 272 272 ASN CB C 272 37.565 37.565 39.113 -1.548 18321 1215 1 1 . 1 1 273 273 GLY N N 273 107.043 107.043 108.544 -1.501 18321 1216 1 1 . 1 1 273 273 GLY C C 273 173.216 173.216 172.473 0.743 18321 1217 1 1 . 1 1 273 273 GLY CA C 273 45.299 45.299 45.083 0.216 18321 1218 1 1 . 1 1 273 273 GLY H H 273 8.086 8.086 7.759 0.327 18321 1219 1 1 . 1 1 274 274 GLN N N 274 120.624 120.624 121.508 -0.884 18321 1220 1 1 . 1 1 274 274 GLN HA H 274 4.551 4.551 4.298 0.253 18321 1221 1 1 . 1 1 274 274 GLN C C 274 175.039 175.039 175.777 -0.738 18321 1222 1 1 . 1 1 274 274 GLN CA C 274 54.556 54.556 55.149 -0.593 18321 1223 1 1 . 1 1 274 274 GLN CB C 274 33.698 33.698 28.579 5.119 18321 1224 1 1 . 1 1 274 274 GLN H H 274 8.045 8.045 7.954 0.091 18321 1225 1 1 . 1 1 275 275 TRP N N 275 125.596 125.596 125.332 0.264 18321 1226 1 1 . 1 1 275 275 TRP HA H 275 4.588 4.588 4.569 0.019 18321 1227 1 1 . 1 1 275 275 TRP C C 275 172.832 172.832 175.860 -3.028 18321 1228 1 1 . 1 1 275 275 TRP CA C 275 55.296 55.296 53.807 1.489 18321 1229 1 1 . 1 1 275 275 TRP CB C 275 31.393 31.393 29.851 1.542 18321 1230 1 1 . 1 1 275 275 TRP H H 275 8.484 8.484 7.835 0.649 18321 1231 1 1 . 1 1 276 276 GLU N N 276 119.012 119.012 120.143 -1.131 18321 1232 1 1 . 1 1 276 276 GLU HA H 276 5.190 5.190 5.036 0.154 18321 1233 1 1 . 1 1 276 276 GLU C C 276 176.553 176.553 176.201 0.352 18321 1234 1 1 . 1 1 276 276 GLU CA C 276 54.288 54.288 55.815 -1.527 18321 1235 1 1 . 1 1 276 276 GLU CB C 276 32.851 32.851 31.088 1.763 18321 1236 1 1 . 1 1 276 276 GLU H H 276 8.643 8.643 8.981 -0.338 18321 1237 1 1 . 1 1 277 277 GLY N N 277 111.364 111.364 111.231 0.133 18321 1238 1 1 . 1 1 277 277 GLY C C 277 170.707 170.707 172.218 -1.511 18321 1239 1 1 . 1 1 277 277 GLY CA C 277 46.723 46.723 44.648 2.075 18321 1240 1 1 . 1 1 277 277 GLY H H 277 9.072 9.072 8.689 0.383 18321 1241 1 1 . 1 1 278 278 GLU N N 278 117.733 117.733 123.364 -5.631 18321 1242 1 1 . 1 1 278 278 GLU HA H 278 5.748 5.748 4.749 0.999 18321 1243 1 1 . 1 1 278 278 GLU C C 278 176.051 176.051 175.051 1.000 18321 1244 1 1 . 1 1 278 278 GLU CA C 278 53.620 53.620 55.143 -1.523 18321 1245 1 1 . 1 1 278 278 GLU CB C 278 33.742 33.742 30.675 3.067 18321 1246 1 1 . 1 1 278 278 GLU H H 278 8.810 8.810 8.035 0.775 18321 1247 1 1 . 1 1 279 279 VAL N N 279 123.834 123.834 123.404 0.430 18321 1248 1 1 . 1 1 279 279 VAL HA H 279 4.404 4.404 4.264 0.140 18321 1249 1 1 . 1 1 279 279 VAL C C 279 175.289 175.289 176.656 -1.367 18321 1250 1 1 . 1 1 279 279 VAL CA C 279 61.166 61.166 61.143 0.023 18321 1251 1 1 . 1 1 279 279 VAL CB C 279 34.123 34.123 32.703 1.420 18321 1252 1 1 . 1 1 279 279 VAL H H 279 8.887 8.887 7.932 0.955 18321 1253 1 1 . 1 1 280 280 ASN N N 280 126.025 126.025 120.509 5.516 18321 1254 1 1 . 1 1 280 280 ASN HA H 280 4.435 4.435 4.679 -0.244 18321 1255 1 1 . 1 1 280 280 ASN C C 280 175.205 175.205 175.904 -0.699 18321 1256 1 1 . 1 1 280 280 ASN CA C 280 45.615 45.615 53.784 -8.169 18321 1257 1 1 . 1 1 280 280 ASN CB C 280 37.386 37.386 37.133 0.253 18321 1258 1 1 . 1 1 280 280 ASN H H 280 9.322 9.322 8.456 0.866 18321 1259 1 1 . 1 1 281 281 GLY N N 281 104.588 104.588 109.594 -5.006 18321 1260 1 1 . 1 1 281 281 GLY C C 281 173.944 173.944 173.443 0.501 18321 1261 1 1 . 1 1 281 281 GLY CA C 281 45.224 45.224 45.758 -0.534 18321 1262 1 1 . 1 1 281 281 GLY H H 281 8.768 8.768 8.392 0.376 18321 1263 1 1 . 1 1 282 282 ARG N N 282 122.567 122.567 120.472 2.095 18321 1264 1 1 . 1 1 282 282 ARG HA H 282 4.559 4.559 4.611 -0.052 18321 1265 1 1 . 1 1 282 282 ARG C C 282 174.350 174.350 173.944 0.406 18321 1266 1 1 . 1 1 282 282 ARG CA C 282 54.933 54.933 55.360 -0.427 18321 1267 1 1 . 1 1 282 282 ARG CB C 282 31.765 31.765 32.487 -0.722 18321 1268 1 1 . 1 1 282 282 ARG H H 282 8.149 8.149 7.928 0.221 18321 1269 1 1 . 1 1 283 283 LYS N N 283 121.565 121.565 125.970 -4.405 18321 1270 1 1 . 1 1 283 283 LYS HA H 283 5.584 5.584 5.402 0.182 18321 1271 1 1 . 1 1 283 283 LYS CA C 283 54.143 54.143 54.800 -0.657 18321 1272 1 1 . 1 1 283 283 LYS CB C 283 36.040 36.040 35.026 1.014 18321 1273 1 1 . 1 1 283 283 LYS H H 283 8.424 8.424 8.482 -0.058 18321 1274 1 1 . 1 1 284 284 GLY C C 284 173.006 173.006 172.184 0.822 18321 1275 1 1 . 1 1 284 284 GLY CA C 284 45.886 45.886 45.523 0.363 18321 1276 1 1 . 1 1 285 285 LEU N N 285 119.673 119.673 121.009 -1.336 18321 1277 1 1 . 1 1 285 285 LEU HA H 285 5.718 5.718 5.686 0.032 18321 1278 1 1 . 1 1 285 285 LEU C C 285 178.657 178.657 176.293 2.364 18321 1279 1 1 . 1 1 285 285 LEU CA C 285 53.656 53.656 53.958 -0.302 18321 1280 1 1 . 1 1 285 285 LEU CB C 285 44.813 44.813 43.768 1.045 18321 1281 1 1 . 1 1 285 285 LEU H H 285 8.734 8.734 8.452 0.282 18321 1282 1 1 . 1 1 286 286 PHE N N 286 118.785 118.785 117.637 1.148 18321 1283 1 1 . 1 1 286 286 PHE HA H 286 4.521 4.521 5.056 -0.535 18321 1284 1 1 . 1 1 286 286 PHE CA C 286 57.592 57.592 54.701 2.891 18321 1285 1 1 . 1 1 286 286 PHE CB C 286 40.669 40.669 39.922 0.747 18321 1286 1 1 . 1 1 286 286 PHE H H 286 9.120 9.120 8.424 0.696 18321 1287 1 1 . 1 1 287 287 PRO HA H 287 4.385 4.385 4.681 -0.296 18321 1288 1 1 . 1 1 287 287 PRO CA C 287 62.814 62.814 62.945 -0.131 18321 1289 1 1 . 1 1 287 287 PRO CB C 287 32.133 32.133 29.597 2.536 18321 1290 1 1 . 1 1 288 288 PHE C C 288 174.837 174.837 176.065 -1.228 18321 1291 1 1 . 1 1 288 288 PHE CA C 288 59.020 59.020 59.528 -0.508 18321 1292 1 1 . 1 1 288 288 PHE CB C 288 34.987 34.987 36.578 -1.591 18321 1293 1 1 . 1 1 289 289 THR N N 289 107.865 107.865 110.579 -2.714 18321 1294 1 1 . 1 1 289 289 THR HA H 289 3.589 3.589 3.788 -0.199 18321 1295 1 1 . 1 1 289 289 THR C C 289 176.125 176.125 174.057 2.068 18321 1296 1 1 . 1 1 289 289 THR CA C 289 62.243 62.243 64.722 -2.479 18321 1297 1 1 . 1 1 289 289 THR CB C 289 69.365 69.365 68.584 0.781 18321 1298 1 1 . 1 1 289 289 THR H H 289 6.453 6.453 8.402 -1.949 18321 1299 1 1 . 1 1 290 290 HIS N N 290 119.462 119.462 114.071 5.391 18321 1300 1 1 . 1 1 290 290 HIS HA H 290 4.196 4.196 4.197 -0.001 18321 1301 1 1 . 1 1 290 290 HIS C C 290 175.165 175.165 174.143 1.022 18321 1302 1 1 . 1 1 290 290 HIS CA C 290 57.635 57.635 56.752 0.883 18321 1303 1 1 . 1 1 290 290 HIS CB C 290 29.840 29.840 27.908 1.932 18321 1304 1 1 . 1 1 290 290 HIS H H 290 7.835 7.835 7.872 -0.037 18321 1305 1 1 . 1 1 291 291 VAL N N 291 110.050 110.050 114.022 -3.972 18321 1306 1 1 . 1 1 291 291 VAL HA H 291 5.445 5.445 4.759 0.686 18321 1307 1 1 . 1 1 291 291 VAL C C 291 173.386 173.386 175.306 -1.920 18321 1308 1 1 . 1 1 291 291 VAL CA C 291 57.794 57.794 60.409 -2.615 18321 1309 1 1 . 1 1 291 291 VAL CB C 291 35.784 35.784 33.225 2.559 18321 1310 1 1 . 1 1 291 291 VAL H H 291 7.562 7.562 8.012 -0.450 18321 1311 1 1 . 1 1 292 292 LYS N N 292 119.445 119.445 121.113 -1.668 18321 1312 1 1 . 1 1 292 292 LYS HA H 292 4.857 4.857 4.751 0.106 18321 1313 1 1 . 1 1 292 292 LYS C C 292 176.512 176.512 175.463 1.049 18321 1314 1 1 . 1 1 292 292 LYS CA C 292 54.647 54.647 54.582 0.065 18321 1315 1 1 . 1 1 292 292 LYS CB C 292 35.665 35.665 35.004 0.661 18321 1316 1 1 . 1 1 292 292 LYS H H 292 8.753 8.753 8.034 0.719 18321 1317 1 1 . 1 1 293 293 ILE N N 293 128.707 128.707 126.538 2.169 18321 1318 1 1 . 1 1 293 293 ILE HA H 293 4.509 4.509 4.431 0.078 18321 1319 1 1 . 1 1 293 293 ILE C C 293 175.666 175.666 176.364 -0.698 18321 1320 1 1 . 1 1 293 293 ILE CA C 293 62.563 62.563 61.311 1.252 18321 1321 1 1 . 1 1 293 293 ILE CB C 293 38.076 38.076 36.660 1.416 18321 1322 1 1 . 1 1 293 293 ILE H H 293 9.107 9.107 8.900 0.207 18321 1323 1 1 . 1 1 294 294 PHE N N 294 126.638 126.638 125.755 0.883 18321 1324 1 1 . 1 1 294 294 PHE HA H 294 4.898 4.898 4.963 -0.065 18321 1325 1 1 . 1 1 294 294 PHE C C 294 175.838 175.838 172.763 3.075 18321 1326 1 1 . 1 1 294 294 PHE CA C 294 56.335 56.335 56.138 0.197 18321 1327 1 1 . 1 1 294 294 PHE CB C 294 41.196 41.196 41.125 0.071 18321 1328 1 1 . 1 1 294 294 PHE H H 294 8.716 8.716 8.612 0.104 18321 1329 1 1 . 1 1 295 295 ASP N N 295 122.961 122.961 119.976 2.985 18321 1330 1 1 . 1 1 295 295 ASP HA H 295 5.003 5.003 4.831 0.172 18321 1331 1 1 . 1 1 295 295 ASP CA C 295 50.602 50.602 51.067 -0.465 18321 1332 1 1 . 1 1 295 295 ASP CB C 295 40.754 40.754 43.772 -3.018 18321 1333 1 1 . 1 1 295 295 ASP H H 295 8.418 8.418 8.645 -0.227 18321 1334 1 1 . 1 1 296 296 PRO HA H 296 4.524 4.524 4.691 -0.167 18321 1335 1 1 . 1 1 296 296 PRO C C 296 176.807 176.807 176.493 0.314 18321 1336 1 1 . 1 1 296 296 PRO CA C 296 62.987 62.987 63.470 -0.483 18321 1337 1 1 . 1 1 296 296 PRO CB C 296 32.033 32.033 31.617 0.416 18321 1338 1 1 . 1 1 297 297 GLN N N 297 120.729 120.729 118.407 2.322 18321 1339 1 1 . 1 1 297 297 GLN HA H 297 4.274 4.274 4.134 0.140 18321 1340 1 1 . 1 1 297 297 GLN CA C 297 56.427 56.427 56.298 0.129 18321 1341 1 1 . 1 1 297 297 GLN CB C 297 28.819 28.819 29.549 -0.730 18321 1342 1 1 . 1 1 297 297 GLN H H 297 8.551 8.551 8.200 0.351 18321 1343 1 1 . 1 1 299 299 PRO C C 299 176.936 176.936 177.853 -0.917 18321 1344 1 1 . 1 1 299 299 PRO CA C 299 63.406 63.406 64.388 -0.982 18321 1345 1 1 . 1 1 299 299 PRO CB C 299 31.421 31.421 32.061 -0.640 18321 1346 1 1 . 1 1 300 300 ASP N N 300 119.609 119.609 120.923 -1.314 18321 1347 1 1 . 1 1 300 300 ASP C C 300 176.344 176.344 177.068 -0.724 18321 1348 1 1 . 1 1 300 300 ASP CA C 300 54.178 54.178 57.108 -2.930 18321 1349 1 1 . 1 1 300 300 ASP CB C 300 40.661 40.661 40.814 -0.153 18321 1350 1 1 . 1 1 300 300 ASP H H 300 8.239 8.239 8.147 0.092 18321 1351 1 1 . 1 1 301 301 GLU N N 301 120.462 120.462 116.981 3.481 18321 1352 1 1 . 1 1 301 301 GLU CA C 301 56.188 56.188 55.231 0.957 18321 1353 1 1 . 1 1 301 301 GLU CB C 301 29.507 29.507 28.968 0.539 18321 1354 1 1 . 1 1 301 301 GLU H H 301 8.084 8.084 8.631 -0.547 18321 1355 1 2 . 1 1 2 2 SER HA H 2 4.521 4.521 4.243 0.278 18321 1356 1 2 . 1 1 2 2 SER CA C 2 58.326 58.326 59.091 -0.765 18321 1357 1 2 . 1 1 2 2 SER CB C 2 64.062 64.062 63.394 0.668 18321 1358 1 2 . 1 1 3 3 SER HA H 3 4.465 4.465 4.180 0.285 18321 1359 1 2 . 1 1 3 3 SER C C 3 173.887 173.887 175.641 -1.754 18321 1360 1 2 . 1 1 3 3 SER CA C 3 58.374 58.374 60.354 -1.980 18321 1361 1 2 . 1 1 3 3 SER CB C 3 63.920 63.920 63.252 0.668 18321 1362 1 2 . 1 1 4 4 ALA N N 4 124.755 124.755 124.061 0.694 18321 1363 1 2 . 1 1 4 4 ALA HA H 4 4.547 4.547 4.829 -0.282 18321 1364 1 2 . 1 1 4 4 ALA CA C 4 52.737 52.737 51.261 1.476 18321 1365 1 2 . 1 1 4 4 ALA CB C 4 19.636 19.636 17.814 1.823 18321 1366 1 2 . 1 1 4 4 ALA H H 4 8.244 8.244 8.178 0.066 18321 1367 1 2 . 1 1 5 5 ARG N N 5 120.383 120.383 122.880 -2.497 18321 1368 1 2 . 1 1 5 5 ARG HA H 5 4.524 4.524 4.521 0.003 18321 1369 1 2 . 1 1 5 5 ARG C C 5 175.611 175.611 174.686 0.925 18321 1370 1 2 . 1 1 5 5 ARG CA C 5 56.082 56.082 54.907 1.175 18321 1371 1 2 . 1 1 5 5 ARG CB C 5 30.695 30.695 29.440 1.255 18321 1372 1 2 . 1 1 5 5 ARG H H 5 8.727 8.727 7.788 0.939 18321 1373 1 2 . 1 1 6 6 PHE N N 6 115.159 115.159 121.951 -6.792 18321 1374 1 2 . 1 1 6 6 PHE HA H 6 4.786 4.786 4.764 0.022 18321 1375 1 2 . 1 1 6 6 PHE C C 6 172.076 172.076 173.115 -1.039 18321 1376 1 2 . 1 1 6 6 PHE CA C 6 56.640 56.640 56.162 0.478 18321 1377 1 2 . 1 1 6 6 PHE CB C 6 40.378 40.378 41.152 -0.774 18321 1378 1 2 . 1 1 6 6 PHE H H 6 7.536 7.536 7.634 -0.098 18321 1379 1 2 . 1 1 7 7 ASP N N 7 121.846 121.846 123.620 -1.774 18321 1380 1 2 . 1 1 7 7 ASP HA H 7 4.846 4.846 4.760 0.086 18321 1381 1 2 . 1 1 7 7 ASP CA C 7 52.327 52.327 54.424 -2.097 18321 1382 1 2 . 1 1 7 7 ASP CB C 7 41.298 41.298 41.396 -0.098 18321 1383 1 2 . 1 1 7 7 ASP H H 7 9.062 9.062 8.810 0.252 18321 1384 1 2 . 1 1 8 8 SER HA H 8 3.950 3.950 4.435 -0.485 18321 1385 1 2 . 1 1 8 8 SER C C 8 174.705 174.705 173.800 0.905 18321 1386 1 2 . 1 1 8 8 SER CA C 8 61.937 61.937 59.513 2.424 18321 1387 1 2 . 1 1 8 8 SER CB C 8 62.260 62.260 61.995 0.265 18321 1388 1 2 . 1 1 9 9 SER N N 9 114.373 114.373 115.894 -1.521 18321 1389 1 2 . 1 1 9 9 SER HA H 9 4.529 4.529 4.688 -0.159 18321 1390 1 2 . 1 1 9 9 SER C C 9 175.089 175.089 173.076 2.013 18321 1391 1 2 . 1 1 9 9 SER CA C 9 59.851 59.851 59.108 0.743 18321 1392 1 2 . 1 1 9 9 SER CB C 9 64.246 64.246 64.569 -0.323 18321 1393 1 2 . 1 1 9 9 SER H H 9 8.722 8.722 8.904 -0.182 18321 1394 1 2 . 1 1 10 10 ASP N N 10 121.818 121.818 124.405 -2.587 18321 1395 1 2 . 1 1 10 10 ASP HA H 10 4.730 4.730 4.602 0.128 18321 1396 1 2 . 1 1 10 10 ASP C C 10 174.455 174.455 177.314 -2.859 18321 1397 1 2 . 1 1 10 10 ASP CA C 10 52.432 52.432 54.814 -2.382 18321 1398 1 2 . 1 1 10 10 ASP CB C 10 39.607 39.607 41.330 -1.723 18321 1399 1 2 . 1 1 10 10 ASP H H 10 7.600 7.600 8.101 -0.501 18321 1400 1 2 . 1 1 11 11 ARG N N 11 125.238 125.238 125.320 -0.082 18321 1401 1 2 . 1 1 11 11 ARG HA H 11 1.936 1.936 3.103 -1.167 18321 1402 1 2 . 1 1 11 11 ARG C C 11 176.916 176.916 177.690 -0.774 18321 1403 1 2 . 1 1 11 11 ARG CA C 11 57.451 57.451 57.676 -0.225 18321 1404 1 2 . 1 1 11 11 ARG CB C 11 43.014 43.014 29.468 13.546 18321 1405 1 2 . 1 1 11 11 ARG H H 11 7.739 7.739 8.297 -0.558 18321 1406 1 2 . 1 1 12 12 SER N N 12 112.065 112.065 112.574 -0.509 18321 1407 1 2 . 1 1 12 12 SER HA H 12 4.695 4.695 4.288 0.407 18321 1408 1 2 . 1 1 12 12 SER C C 12 175.092 175.092 174.010 1.082 18321 1409 1 2 . 1 1 12 12 SER CA C 12 60.785 60.785 59.333 1.452 18321 1410 1 2 . 1 1 12 12 SER CB C 12 62.889 62.889 62.446 0.444 18321 1411 1 2 . 1 1 12 12 SER H H 12 7.888 7.888 7.736 0.152 18321 1412 1 2 . 1 1 13 13 ALA N N 13 122.249 122.249 123.052 -0.803 18321 1413 1 2 . 1 1 13 13 ALA HA H 13 4.216 4.216 4.269 -0.053 18321 1414 1 2 . 1 1 13 13 ALA C C 13 178.069 178.069 177.415 0.654 18321 1415 1 2 . 1 1 13 13 ALA CA C 13 53.562 53.562 53.785 -0.223 18321 1416 1 2 . 1 1 13 13 ALA CB C 13 19.339 19.339 19.817 -0.478 18321 1417 1 2 . 1 1 13 13 ALA H H 13 7.418 7.418 7.685 -0.267 18321 1418 1 2 . 1 1 14 14 TRP N N 14 107.433 107.433 111.686 -4.253 18321 1419 1 2 . 1 1 14 14 TRP HA H 14 4.785 4.785 4.679 0.106 18321 1420 1 2 . 1 1 14 14 TRP C C 14 175.286 175.286 175.733 -0.447 18321 1421 1 2 . 1 1 14 14 TRP CA C 14 55.212 55.212 55.113 0.099 18321 1422 1 2 . 1 1 14 14 TRP CB C 14 32.776 32.776 30.901 1.875 18321 1423 1 2 . 1 1 14 14 TRP H H 14 6.273 6.273 6.816 -0.543 18321 1424 1 2 . 1 1 15 15 TYR N N 15 122.315 122.315 124.474 -2.159 18321 1425 1 2 . 1 1 15 15 TYR HA H 15 5.436 5.436 4.803 0.633 18321 1426 1 2 . 1 1 15 15 TYR C C 15 175.325 175.325 175.041 0.284 18321 1427 1 2 . 1 1 15 15 TYR CA C 15 56.609 56.609 58.139 -1.530 18321 1428 1 2 . 1 1 15 15 TYR CB C 15 36.940 36.940 38.336 -1.395 18321 1429 1 2 . 1 1 15 15 TYR H H 15 8.221 8.221 7.534 0.687 18321 1430 1 2 . 1 1 16 16 MET N N 16 126.031 126.031 125.422 0.609 18321 1431 1 2 . 1 1 16 16 MET HA H 16 4.462 4.462 4.387 0.075 18321 1432 1 2 . 1 1 16 16 MET CA C 16 53.046 53.046 53.500 -0.454 18321 1433 1 2 . 1 1 16 16 MET CB C 16 41.114 41.114 32.312 8.802 18321 1434 1 2 . 1 1 16 16 MET H H 16 8.989 8.989 8.501 0.488 18321 1435 1 2 . 1 1 17 17 GLY CA C 17 45.803 45.803 45.527 0.276 18321 1436 1 2 . 1 1 18 18 PRO HA H 18 4.675 4.675 4.427 0.248 18321 1437 1 2 . 1 1 18 18 PRO C C 18 175.943 175.943 175.460 0.483 18321 1438 1 2 . 1 1 18 18 PRO CA C 18 63.647 63.647 63.440 0.207 18321 1439 1 2 . 1 1 18 18 PRO CB C 18 29.276 29.276 30.262 -0.986 18321 1440 1 2 . 1 1 19 19 VAL N N 19 126.159 126.159 122.024 4.135 18321 1441 1 2 . 1 1 19 19 VAL HA H 19 4.011 4.011 4.294 -0.283 18321 1442 1 2 . 1 1 19 19 VAL C C 19 175.812 175.812 174.283 1.529 18321 1443 1 2 . 1 1 19 19 VAL CA C 19 62.355 62.355 60.746 1.609 18321 1444 1 2 . 1 1 19 19 VAL CB C 19 33.468 33.468 36.125 -2.657 18321 1445 1 2 . 1 1 19 19 VAL H H 19 7.851 7.851 7.688 0.163 18321 1446 1 2 . 1 1 20 20 SER N N 20 123.950 123.950 117.325 6.625 18321 1447 1 2 . 1 1 20 20 SER HA H 20 4.453 4.453 5.141 -0.688 18321 1448 1 2 . 1 1 20 20 SER CA C 20 57.631 57.631 55.999 1.632 18321 1449 1 2 . 1 1 20 20 SER CB C 20 65.951 65.951 65.912 0.039 18321 1450 1 2 . 1 1 20 20 SER H H 20 8.800 8.800 8.217 0.583 18321 1451 1 2 . 1 1 21 21 ARG N N 21 123.461 123.461 122.346 1.115 18321 1452 1 2 . 1 1 21 21 ARG HA H 21 3.489 3.489 3.980 -0.491 18321 1453 1 2 . 1 1 21 21 ARG C C 21 178.164 178.164 178.618 -0.454 18321 1454 1 2 . 1 1 21 21 ARG CA C 21 60.025 60.025 60.952 -0.927 18321 1455 1 2 . 1 1 21 21 ARG CB C 21 30.334 30.334 29.822 0.512 18321 1456 1 2 . 1 1 21 21 ARG H H 21 9.307 9.307 8.875 0.432 18321 1457 1 2 . 1 1 22 22 GLN N N 22 116.591 116.591 118.530 -1.939 18321 1458 1 2 . 1 1 22 22 GLN HA H 22 4.008 4.008 4.067 -0.059 18321 1459 1 2 . 1 1 22 22 GLN CA C 22 59.095 59.095 58.711 0.384 18321 1460 1 2 . 1 1 22 22 GLN CB C 22 29.249 29.249 27.922 1.327 18321 1461 1 2 . 1 1 22 22 GLN H H 22 8.394 8.394 8.722 -0.328 18321 1462 1 2 . 1 1 23 23 GLU N N 23 122.191 122.191 120.024 2.167 18321 1463 1 2 . 1 1 23 23 GLU HA H 23 4.037 4.037 4.086 -0.049 18321 1464 1 2 . 1 1 23 23 GLU C C 23 178.986 178.986 178.480 0.506 18321 1465 1 2 . 1 1 23 23 GLU CA C 23 59.081 59.081 58.731 0.350 18321 1466 1 2 . 1 1 23 23 GLU CB C 23 31.896 31.896 29.373 2.523 18321 1467 1 2 . 1 1 23 23 GLU H H 23 8.106 8.106 8.414 -0.308 18321 1468 1 2 . 1 1 24 24 ALA N N 24 121.964 121.964 122.124 -0.160 18321 1469 1 2 . 1 1 24 24 ALA HA H 24 3.762 3.762 3.904 -0.142 18321 1470 1 2 . 1 1 24 24 ALA C C 24 178.653 178.653 179.375 -0.722 18321 1471 1 2 . 1 1 24 24 ALA CA C 24 55.480 55.480 55.313 0.167 18321 1472 1 2 . 1 1 24 24 ALA CB C 24 18.049 18.049 18.334 -0.284 18321 1473 1 2 . 1 1 24 24 ALA H H 24 8.732 8.732 8.294 0.438 18321 1474 1 2 . 1 1 25 25 GLN N N 25 116.229 116.229 117.610 -1.381 18321 1475 1 2 . 1 1 25 25 GLN HA H 25 3.950 3.950 4.049 -0.099 18321 1476 1 2 . 1 1 25 25 GLN C C 25 177.442 177.442 178.733 -1.291 18321 1477 1 2 . 1 1 25 25 GLN CA C 25 59.651 59.651 58.588 1.063 18321 1478 1 2 . 1 1 25 25 GLN CB C 25 29.308 29.308 28.758 0.550 18321 1479 1 2 . 1 1 25 25 GLN H H 25 8.391 8.391 8.479 -0.088 18321 1480 1 2 . 1 1 26 26 THR N N 26 115.105 115.105 113.722 1.383 18321 1481 1 2 . 1 1 26 26 THR HA H 26 3.920 3.920 4.201 -0.281 18321 1482 1 2 . 1 1 26 26 THR C C 26 176.835 176.835 175.092 1.743 18321 1483 1 2 . 1 1 26 26 THR CA C 26 66.335 66.335 63.138 3.197 18321 1484 1 2 . 1 1 26 26 THR CB C 26 68.876 68.876 68.800 0.076 18321 1485 1 2 . 1 1 26 26 THR H H 26 8.223 8.223 8.023 0.200 18321 1486 1 2 . 1 1 27 27 ARG N N 27 119.096 119.096 117.863 1.233 18321 1487 1 2 . 1 1 27 27 ARG HA H 27 4.047 4.047 4.306 -0.259 18321 1488 1 2 . 1 1 27 27 ARG C C 27 177.245 177.245 176.779 0.466 18321 1489 1 2 . 1 1 27 27 ARG CA C 27 58.528 58.528 57.168 1.360 18321 1490 1 2 . 1 1 27 27 ARG CB C 27 30.184 30.184 30.896 -0.713 18321 1491 1 2 . 1 1 27 27 ARG H H 27 8.093 8.093 7.448 0.645 18321 1492 1 2 . 1 1 28 28 LEU N N 28 114.602 114.602 118.586 -3.984 18321 1493 1 2 . 1 1 28 28 LEU HA H 28 4.325 4.325 4.443 -0.118 18321 1494 1 2 . 1 1 28 28 LEU C C 28 177.197 177.197 176.283 0.914 18321 1495 1 2 . 1 1 28 28 LEU CA C 28 55.143 55.143 53.918 1.225 18321 1496 1 2 . 1 1 28 28 LEU CB C 28 44.902 44.902 42.759 2.143 18321 1497 1 2 . 1 1 28 28 LEU H H 28 7.438 7.438 7.398 0.040 18321 1498 1 2 . 1 1 29 29 GLN N N 29 121.312 121.312 120.729 0.583 18321 1499 1 2 . 1 1 29 29 GLN HA H 29 3.856 3.856 4.220 -0.364 18321 1500 1 2 . 1 1 29 29 GLN C C 29 178.048 178.048 176.717 1.331 18321 1501 1 2 . 1 1 29 29 GLN CA C 29 57.691 57.691 56.300 1.391 18321 1502 1 2 . 1 1 29 29 GLN CB C 29 27.293 27.293 27.251 0.042 18321 1503 1 2 . 1 1 29 29 GLN H H 29 8.250 8.250 7.636 0.614 18321 1504 1 2 . 1 1 30 30 GLY N N 30 116.768 116.768 112.459 4.309 18321 1505 1 2 . 1 1 30 30 GLY C C 30 174.914 174.914 173.917 0.997 18321 1506 1 2 . 1 1 30 30 GLY CA C 30 45.491 45.491 45.302 0.189 18321 1507 1 2 . 1 1 30 30 GLY H H 30 9.135 9.135 8.191 0.944 18321 1508 1 2 . 1 1 31 31 GLN N N 31 117.979 117.979 119.152 -1.173 18321 1509 1 2 . 1 1 31 31 GLN HA H 31 4.329 4.329 4.158 0.171 18321 1510 1 2 . 1 1 31 31 GLN C C 31 177.174 177.174 176.558 0.616 18321 1511 1 2 . 1 1 31 31 GLN CA C 31 53.910 53.910 55.616 -1.706 18321 1512 1 2 . 1 1 31 31 GLN CB C 31 29.574 29.574 29.134 0.440 18321 1513 1 2 . 1 1 31 31 GLN H H 31 7.695 7.695 7.983 -0.288 18321 1514 1 2 . 1 1 32 32 ARG N N 32 123.918 123.918 120.111 3.807 18321 1515 1 2 . 1 1 32 32 ARG HA H 32 3.940 3.940 3.943 -0.003 18321 1516 1 2 . 1 1 32 32 ARG C C 32 175.810 175.810 176.126 -0.316 18321 1517 1 2 . 1 1 32 32 ARG CA C 32 56.770 56.770 56.894 -0.124 18321 1518 1 2 . 1 1 32 32 ARG CB C 32 30.074 30.074 30.173 -0.099 18321 1519 1 2 . 1 1 32 32 ARG H H 32 8.955 8.955 8.553 0.402 18321 1520 1 2 . 1 1 33 33 HIS N N 33 122.248 122.248 121.450 0.798 18321 1521 1 2 . 1 1 33 33 HIS HA H 33 4.627 4.627 4.737 -0.110 18321 1522 1 2 . 1 1 33 33 HIS C C 33 177.089 177.089 176.688 0.401 18321 1523 1 2 . 1 1 33 33 HIS CA C 33 55.858 55.858 57.322 -1.464 18321 1524 1 2 . 1 1 33 33 HIS CB C 33 28.648 28.648 30.162 -1.514 18321 1525 1 2 . 1 1 33 33 HIS H H 33 8.302 8.302 8.311 -0.009 18321 1526 1 2 . 1 1 34 34 GLY N N 34 109.518 109.518 110.658 -1.140 18321 1527 1 2 . 1 1 34 34 GLY C C 34 176.730 176.730 174.330 2.400 18321 1528 1 2 . 1 1 34 34 GLY CA C 34 45.967 45.967 44.934 1.033 18321 1529 1 2 . 1 1 34 34 GLY H H 34 9.496 9.496 8.943 0.553 18321 1530 1 2 . 1 1 35 35 MET N N 35 125.193 125.193 123.378 1.815 18321 1531 1 2 . 1 1 35 35 MET HA H 35 5.750 5.750 5.060 0.690 18321 1532 1 2 . 1 1 35 35 MET C C 35 174.388 174.388 175.399 -1.011 18321 1533 1 2 . 1 1 35 35 MET CA C 35 55.762 55.762 57.292 -1.530 18321 1534 1 2 . 1 1 35 35 MET CB C 35 32.706 32.706 33.269 -0.562 18321 1535 1 2 . 1 1 35 35 MET H H 35 8.359 8.359 7.404 0.955 18321 1536 1 2 . 1 1 36 36 PHE N N 36 123.311 123.311 116.715 6.596 18321 1537 1 2 . 1 1 36 36 PHE HA H 36 5.985 5.985 5.606 0.379 18321 1538 1 2 . 1 1 36 36 PHE C C 36 172.140 172.140 173.000 -0.860 18321 1539 1 2 . 1 1 36 36 PHE CA C 36 55.755 55.755 55.590 0.165 18321 1540 1 2 . 1 1 36 36 PHE CB C 36 45.197 45.197 42.627 2.570 18321 1541 1 2 . 1 1 36 36 PHE H H 36 8.261 8.261 7.613 0.648 18321 1542 1 2 . 1 1 37 37 LEU N N 37 114.652 114.652 116.492 -1.840 18321 1543 1 2 . 1 1 37 37 LEU HA H 37 4.489 4.489 5.067 -0.578 18321 1544 1 2 . 1 1 37 37 LEU C C 37 174.033 174.033 174.758 -0.725 18321 1545 1 2 . 1 1 37 37 LEU CA C 37 55.382 55.382 54.663 0.719 18321 1546 1 2 . 1 1 37 37 LEU CB C 37 44.791 44.791 45.461 -0.670 18321 1547 1 2 . 1 1 37 37 LEU H H 37 9.292 9.292 8.659 0.633 18321 1548 1 2 . 1 1 38 38 VAL N N 38 121.009 121.009 123.514 -2.505 18321 1549 1 2 . 1 1 38 38 VAL HA H 38 5.504 5.504 4.686 0.818 18321 1550 1 2 . 1 1 38 38 VAL C C 38 173.581 173.581 175.424 -1.843 18321 1551 1 2 . 1 1 38 38 VAL CA C 38 61.316 61.316 62.114 -0.798 18321 1552 1 2 . 1 1 38 38 VAL CB C 38 33.302 33.302 32.482 0.820 18321 1553 1 2 . 1 1 38 38 VAL H H 38 8.991 8.991 8.510 0.481 18321 1554 1 2 . 1 1 39 39 ARG N N 39 124.863 124.863 127.822 -2.959 18321 1555 1 2 . 1 1 39 39 ARG HA H 39 5.444 5.444 5.041 0.403 18321 1556 1 2 . 1 1 39 39 ARG C C 39 175.772 175.772 174.811 0.961 18321 1557 1 2 . 1 1 39 39 ARG CA C 39 52.558 52.558 53.208 -0.650 18321 1558 1 2 . 1 1 39 39 ARG CB C 39 34.980 34.980 32.886 2.094 18321 1559 1 2 . 1 1 39 39 ARG H H 39 9.569 9.569 8.197 1.372 18321 1560 1 2 . 1 1 40 40 ASP N N 40 122.330 122.330 119.943 2.387 18321 1561 1 2 . 1 1 40 40 ASP HA H 40 4.785 4.785 5.127 -0.342 18321 1562 1 2 . 1 1 40 40 ASP C C 40 176.332 176.332 175.925 0.407 18321 1563 1 2 . 1 1 40 40 ASP CA C 40 55.334 55.334 54.656 0.678 18321 1564 1 2 . 1 1 40 40 ASP CB C 40 40.650 40.650 42.222 -1.572 18321 1565 1 2 . 1 1 40 40 ASP H H 40 8.413 8.413 8.603 -0.190 18321 1566 1 2 . 1 1 41 41 SER N N 41 114.363 114.363 119.791 -5.428 18321 1567 1 2 . 1 1 41 41 SER HA H 41 4.506 4.506 4.397 0.109 18321 1568 1 2 . 1 1 41 41 SER CA C 41 57.525 57.525 58.940 -1.415 18321 1569 1 2 . 1 1 41 41 SER CB C 41 63.706 63.706 63.379 0.327 18321 1570 1 2 . 1 1 41 41 SER H H 41 7.791 7.791 8.372 -0.581 18321 1571 1 2 . 1 1 42 42 SER N N 42 126.932 126.932 124.554 2.378 18321 1572 1 2 . 1 1 42 42 SER HA H 42 4.410 4.410 4.474 -0.064 18321 1573 1 2 . 1 1 42 42 SER CA C 42 60.362 60.362 60.397 -0.035 18321 1574 1 2 . 1 1 42 42 SER CB C 42 63.707 63.707 63.037 0.670 18321 1575 1 2 . 1 1 42 42 SER H H 42 10.519 10.519 8.868 1.651 18321 1576 1 2 . 1 1 43 43 THR HA H 43 4.097 4.097 4.310 -0.213 18321 1577 1 2 . 1 1 43 43 THR CA C 43 64.722 64.722 64.432 0.290 18321 1578 1 2 . 1 1 43 43 THR CB C 43 69.439 69.439 69.513 -0.074 18321 1579 1 2 . 1 1 44 44 CYS HA H 44 5.100 5.100 4.888 0.212 18321 1580 1 2 . 1 1 44 44 CYS CA C 44 51.779 51.779 55.836 -4.057 18321 1581 1 2 . 1 1 44 44 CYS CB C 44 41.314 41.314 29.820 11.494 18321 1582 1 2 . 1 1 45 45 PRO HA H 45 4.278 4.278 4.477 -0.199 18321 1583 1 2 . 1 1 45 45 PRO C C 45 178.127 178.127 177.032 1.095 18321 1584 1 2 . 1 1 45 45 PRO CA C 45 64.151 64.151 64.747 -0.596 18321 1585 1 2 . 1 1 45 45 PRO CB C 45 31.596 31.596 31.006 0.590 18321 1586 1 2 . 1 1 46 46 GLY N N 46 114.947 114.947 114.327 0.620 18321 1587 1 2 . 1 1 46 46 GLY C C 46 174.701 174.701 174.173 0.528 18321 1588 1 2 . 1 1 46 46 GLY CA C 46 45.225 45.225 45.110 0.115 18321 1589 1 2 . 1 1 46 46 GLY H H 46 8.812 8.812 9.243 -0.431 18321 1590 1 2 . 1 1 47 47 ASP N N 47 120.862 120.862 122.019 -1.157 18321 1591 1 2 . 1 1 47 47 ASP HA H 47 5.235 5.235 4.993 0.242 18321 1592 1 2 . 1 1 47 47 ASP C C 47 176.480 176.480 175.860 0.620 18321 1593 1 2 . 1 1 47 47 ASP CA C 47 53.591 53.591 54.768 -1.177 18321 1594 1 2 . 1 1 47 47 ASP CB C 47 41.707 41.707 42.259 -0.552 18321 1595 1 2 . 1 1 47 47 ASP H H 47 7.997 7.997 7.830 0.167 18321 1596 1 2 . 1 1 48 48 TYR N N 48 118.473 118.473 115.944 2.529 18321 1597 1 2 . 1 1 48 48 TYR HA H 48 5.431 5.431 5.391 0.040 18321 1598 1 2 . 1 1 48 48 TYR C C 48 173.783 173.783 175.891 -2.108 18321 1599 1 2 . 1 1 48 48 TYR CA C 48 56.891 56.891 56.605 0.286 18321 1600 1 2 . 1 1 48 48 TYR CB C 48 43.274 43.274 42.757 0.517 18321 1601 1 2 . 1 1 48 48 TYR H H 48 8.892 8.892 9.057 -0.165 18321 1602 1 2 . 1 1 49 49 VAL N N 49 119.105 119.105 119.427 -0.322 18321 1603 1 2 . 1 1 49 49 VAL HA H 49 4.800 4.800 4.487 0.313 18321 1604 1 2 . 1 1 49 49 VAL C C 49 174.397 174.397 174.655 -0.258 18321 1605 1 2 . 1 1 49 49 VAL CA C 49 61.439 61.439 62.534 -1.095 18321 1606 1 2 . 1 1 49 49 VAL CB C 49 35.388 35.388 34.632 0.756 18321 1607 1 2 . 1 1 49 49 VAL H H 49 9.661 9.661 8.724 0.937 18321 1608 1 2 . 1 1 50 50 LEU N N 50 129.599 129.599 131.156 -1.557 18321 1609 1 2 . 1 1 50 50 LEU HA H 50 5.033 5.033 5.362 -0.329 18321 1610 1 2 . 1 1 50 50 LEU C C 50 175.001 175.001 175.521 -0.520 18321 1611 1 2 . 1 1 50 50 LEU CA C 50 53.352 53.352 53.687 -0.334 18321 1612 1 2 . 1 1 50 50 LEU CB C 50 44.062 44.062 42.457 1.605 18321 1613 1 2 . 1 1 50 50 LEU H H 50 9.405 9.405 9.262 0.143 18321 1614 1 2 . 1 1 51 51 SER N N 51 126.895 126.895 124.235 2.660 18321 1615 1 2 . 1 1 51 51 SER HA H 51 5.731 5.731 4.908 0.823 18321 1616 1 2 . 1 1 51 51 SER C C 51 173.094 173.094 173.701 -0.607 18321 1617 1 2 . 1 1 51 51 SER CA C 51 58.834 58.834 57.686 1.148 18321 1618 1 2 . 1 1 51 51 SER CB C 51 64.977 64.977 63.617 1.360 18321 1619 1 2 . 1 1 51 51 SER H H 51 9.094 9.094 8.838 0.256 18321 1620 1 2 . 1 1 52 52 VAL N N 52 121.777 121.777 126.321 -4.544 18321 1621 1 2 . 1 1 52 52 VAL HA H 52 5.066 5.066 4.483 0.583 18321 1622 1 2 . 1 1 52 52 VAL C C 52 174.573 174.573 175.002 -0.429 18321 1623 1 2 . 1 1 52 52 VAL CA C 52 59.535 59.535 60.743 -1.208 18321 1624 1 2 . 1 1 52 52 VAL CB C 52 36.834 36.834 34.952 1.882 18321 1625 1 2 . 1 1 52 52 VAL H H 52 8.816 8.816 8.908 -0.092 18321 1626 1 2 . 1 1 53 53 SER N N 53 120.489 120.489 122.185 -1.696 18321 1627 1 2 . 1 1 53 53 SER HA H 53 4.811 4.811 5.155 -0.344 18321 1628 1 2 . 1 1 53 53 SER C C 53 174.065 174.065 173.754 0.311 18321 1629 1 2 . 1 1 53 53 SER CA C 53 57.496 57.496 57.518 -0.022 18321 1630 1 2 . 1 1 53 53 SER CB C 53 62.623 62.623 62.803 -0.180 18321 1631 1 2 . 1 1 53 53 SER H H 53 8.780 8.780 8.935 -0.155 18321 1632 1 2 . 1 1 54 54 GLU N N 54 132.020 132.020 125.010 7.010 18321 1633 1 2 . 1 1 54 54 GLU HA H 54 4.250 4.250 4.372 -0.122 18321 1634 1 2 . 1 1 54 54 GLU C C 54 175.387 175.387 175.363 0.024 18321 1635 1 2 . 1 1 54 54 GLU CA C 54 56.999 56.999 55.754 1.245 18321 1636 1 2 . 1 1 54 54 GLU CB C 54 32.556 32.556 34.162 -1.606 18321 1637 1 2 . 1 1 54 54 GLU H H 54 8.472 8.472 7.793 0.679 18321 1638 1 2 . 1 1 55 55 ASN N N 55 126.517 126.517 116.762 9.755 18321 1639 1 2 . 1 1 55 55 ASN HA H 55 4.220 4.220 4.182 0.038 18321 1640 1 2 . 1 1 55 55 ASN C C 55 174.546 174.546 174.794 -0.248 18321 1641 1 2 . 1 1 55 55 ASN CA C 55 54.770 54.770 56.299 -1.529 18321 1642 1 2 . 1 1 55 55 ASN CB C 55 37.314 37.314 38.000 -0.686 18321 1643 1 2 . 1 1 55 55 ASN H H 55 8.853 8.853 8.657 0.196 18321 1644 1 2 . 1 1 56 56 SER N N 56 112.009 112.009 112.149 -0.140 18321 1645 1 2 . 1 1 56 56 SER HA H 56 4.334 4.334 5.007 -0.673 18321 1646 1 2 . 1 1 56 56 SER C C 56 173.354 173.354 173.292 0.062 18321 1647 1 2 . 1 1 56 56 SER CA C 56 59.966 59.966 60.307 -0.341 18321 1648 1 2 . 1 1 56 56 SER CB C 56 62.242 62.242 66.607 -4.365 18321 1649 1 2 . 1 1 56 56 SER H H 56 10.418 10.418 8.481 1.937 18321 1650 1 2 . 1 1 57 57 ARG N N 57 121.764 121.764 118.778 2.986 18321 1651 1 2 . 1 1 57 57 ARG HA H 57 5.167 5.167 4.917 0.250 18321 1652 1 2 . 1 1 57 57 ARG C C 57 174.983 174.983 173.951 1.032 18321 1653 1 2 . 1 1 57 57 ARG CA C 57 54.550 54.550 57.508 -2.958 18321 1654 1 2 . 1 1 57 57 ARG CB C 57 31.886 31.886 32.252 -0.365 18321 1655 1 2 . 1 1 57 57 ARG H H 57 8.097 8.097 8.540 -0.443 18321 1656 1 2 . 1 1 58 58 VAL N N 58 121.866 121.866 120.890 0.976 18321 1657 1 2 . 1 1 58 58 VAL HA H 58 4.768 4.768 4.870 -0.102 18321 1658 1 2 . 1 1 58 58 VAL C C 58 175.388 175.388 174.356 1.032 18321 1659 1 2 . 1 1 58 58 VAL CA C 58 61.818 61.818 60.675 1.143 18321 1660 1 2 . 1 1 58 58 VAL CB C 58 34.135 34.135 32.432 1.703 18321 1661 1 2 . 1 1 58 58 VAL H H 58 8.081 8.081 7.848 0.233 18321 1662 1 2 . 1 1 59 59 SER N N 59 124.445 124.445 122.596 1.849 18321 1663 1 2 . 1 1 59 59 SER HA H 59 4.462 4.462 4.482 -0.020 18321 1664 1 2 . 1 1 59 59 SER C C 59 172.185 172.185 173.282 -1.097 18321 1665 1 2 . 1 1 59 59 SER CA C 59 56.629 56.629 57.320 -0.691 18321 1666 1 2 . 1 1 59 59 SER CB C 59 66.218 66.218 64.068 2.150 18321 1667 1 2 . 1 1 59 59 SER H H 59 9.082 9.082 8.886 0.196 18321 1668 1 2 . 1 1 60 60 HIS N N 60 121.224 121.224 126.058 -4.834 18321 1669 1 2 . 1 1 60 60 HIS HA H 60 4.885 4.885 4.718 0.167 18321 1670 1 2 . 1 1 60 60 HIS C C 60 174.674 174.674 174.200 0.474 18321 1671 1 2 . 1 1 60 60 HIS CA C 60 54.900 54.900 55.475 -0.575 18321 1672 1 2 . 1 1 60 60 HIS CB C 60 32.331 32.331 29.779 2.552 18321 1673 1 2 . 1 1 60 60 HIS H H 60 8.331 8.331 8.625 -0.294 18321 1674 1 2 . 1 1 61 61 TYR N N 61 124.780 124.780 125.126 -0.346 18321 1675 1 2 . 1 1 61 61 TYR HA H 61 4.655 4.655 4.820 -0.165 18321 1676 1 2 . 1 1 61 61 TYR CA C 61 57.409 57.409 56.785 0.624 18321 1677 1 2 . 1 1 61 61 TYR CB C 61 39.785 39.785 38.773 1.012 18321 1678 1 2 . 1 1 61 61 TYR H H 61 9.273 9.273 9.231 0.042 18321 1679 1 2 . 1 1 62 62 ILE HA H 62 4.298 4.298 4.291 0.007 18321 1680 1 2 . 1 1 62 62 ILE C C 62 174.817 174.817 175.435 -0.618 18321 1681 1 2 . 1 1 62 62 ILE CA C 62 61.908 61.908 61.687 0.221 18321 1682 1 2 . 1 1 62 62 ILE CB C 62 38.321 38.321 38.749 -0.428 18321 1683 1 2 . 1 1 63 63 ILE N N 63 128.552 128.552 129.596 -1.044 18321 1684 1 2 . 1 1 63 63 ILE HA H 63 4.788 4.788 4.619 0.169 18321 1685 1 2 . 1 1 63 63 ILE C C 63 175.982 175.982 174.736 1.246 18321 1686 1 2 . 1 1 63 63 ILE CA C 63 59.629 59.629 60.055 -0.426 18321 1687 1 2 . 1 1 63 63 ILE CB C 63 39.747 39.747 38.728 1.019 18321 1688 1 2 . 1 1 63 63 ILE H H 63 9.155 9.155 8.569 0.586 18321 1689 1 2 . 1 1 64 64 ASN N N 64 123.240 123.240 127.659 -4.419 18321 1690 1 2 . 1 1 64 64 ASN HA H 64 4.857 4.857 5.166 -0.309 18321 1691 1 2 . 1 1 64 64 ASN C C 64 175.324 175.324 174.607 0.717 18321 1692 1 2 . 1 1 64 64 ASN CA C 64 53.736 53.736 53.507 0.229 18321 1693 1 2 . 1 1 64 64 ASN CB C 64 41.531 41.531 40.134 1.397 18321 1694 1 2 . 1 1 64 64 ASN H H 64 9.379 9.379 8.651 0.728 18321 1695 1 2 . 1 1 65 65 SER N N 65 121.157 121.157 118.340 2.817 18321 1696 1 2 . 1 1 65 65 SER HA H 65 4.548 4.548 4.610 -0.062 18321 1697 1 2 . 1 1 65 65 SER C C 65 174.328 174.328 174.577 -0.249 18321 1698 1 2 . 1 1 65 65 SER CA C 65 58.306 58.306 58.146 0.160 18321 1699 1 2 . 1 1 65 65 SER CB C 65 62.878 62.878 62.980 -0.102 18321 1700 1 2 . 1 1 65 65 SER H H 65 9.195 9.195 9.282 -0.087 18321 1701 1 2 . 1 1 66 66 LEU N N 66 127.417 127.417 129.158 -1.741 18321 1702 1 2 . 1 1 66 66 LEU HA H 66 4.605 4.605 4.618 -0.013 18321 1703 1 2 . 1 1 66 66 LEU CA C 66 52.888 52.888 52.566 0.321 18321 1704 1 2 . 1 1 66 66 LEU CB C 66 41.799 41.799 41.812 -0.013 18321 1705 1 2 . 1 1 66 66 LEU H H 66 8.143 8.143 8.043 0.100 18321 1706 1 2 . 1 1 68 68 ASN HA H 68 4.386 4.386 4.634 -0.248 18321 1707 1 2 . 1 1 68 68 ASN C C 68 174.487 174.487 175.560 -1.073 18321 1708 1 2 . 1 1 68 68 ASN CA C 68 53.365 53.365 52.978 0.387 18321 1709 1 2 . 1 1 68 68 ASN CB C 68 36.778 36.778 37.809 -1.031 18321 1710 1 2 . 1 1 69 69 ARG N N 69 111.329 111.329 114.092 -2.763 18321 1711 1 2 . 1 1 69 69 ARG HA H 69 3.876 3.876 3.817 0.059 18321 1712 1 2 . 1 1 69 69 ARG CA C 69 57.393 57.393 57.097 0.296 18321 1713 1 2 . 1 1 69 69 ARG CB C 69 26.665 26.665 26.939 -0.274 18321 1714 1 2 . 1 1 69 69 ARG H H 69 8.191 8.191 7.600 0.591 18321 1715 1 2 . 1 1 70 70 ARG N N 70 116.120 116.120 115.522 0.598 18321 1716 1 2 . 1 1 70 70 ARG HA H 70 4.556 4.556 5.107 -0.551 18321 1717 1 2 . 1 1 70 70 ARG C C 70 174.882 174.882 173.993 0.889 18321 1718 1 2 . 1 1 70 70 ARG CA C 70 55.509 55.509 53.942 1.567 18321 1719 1 2 . 1 1 70 70 ARG CB C 70 31.771 31.771 34.243 -2.472 18321 1720 1 2 . 1 1 70 70 ARG H H 70 6.667 6.667 7.207 -0.540 18321 1721 1 2 . 1 1 71 71 PHE N N 71 116.313 116.313 119.116 -2.803 18321 1722 1 2 . 1 1 71 71 PHE HA H 71 5.540 5.540 5.550 -0.010 18321 1723 1 2 . 1 1 71 71 PHE C C 71 174.391 174.391 175.441 -1.050 18321 1724 1 2 . 1 1 71 71 PHE CA C 71 57.528 57.528 56.257 1.271 18321 1725 1 2 . 1 1 71 71 PHE CB C 71 44.115 44.115 42.000 2.115 18321 1726 1 2 . 1 1 71 71 PHE H H 71 8.700 8.700 8.389 0.311 18321 1727 1 2 . 1 1 72 72 LYS N N 72 122.770 122.770 126.981 -4.211 18321 1728 1 2 . 1 1 72 72 LYS HA H 72 5.483 5.483 4.868 0.615 18321 1729 1 2 . 1 1 72 72 LYS C C 72 173.923 173.923 175.605 -1.682 18321 1730 1 2 . 1 1 72 72 LYS CA C 72 54.855 54.855 55.209 -0.354 18321 1731 1 2 . 1 1 72 72 LYS CB C 72 37.710 37.710 34.162 3.548 18321 1732 1 2 . 1 1 72 72 LYS H H 72 9.138 9.138 8.546 0.592 18321 1733 1 2 . 1 1 73 73 ILE N N 73 124.576 124.576 128.864 -4.288 18321 1734 1 2 . 1 1 73 73 ILE HA H 73 4.955 4.955 4.801 0.154 18321 1735 1 2 . 1 1 73 73 ILE C C 73 175.728 175.728 176.329 -0.601 18321 1736 1 2 . 1 1 73 73 ILE CA C 73 58.935 58.935 60.399 -1.464 18321 1737 1 2 . 1 1 73 73 ILE CB C 73 40.965 40.965 39.148 1.817 18321 1738 1 2 . 1 1 73 73 ILE H H 73 8.826 8.826 8.555 0.271 18321 1739 1 2 . 1 1 74 74 GLY N N 74 118.718 118.718 118.909 -0.191 18321 1740 1 2 . 1 1 74 74 GLY C C 74 174.436 174.436 174.051 0.385 18321 1741 1 2 . 1 1 74 74 GLY CA C 74 47.401 47.401 45.859 1.542 18321 1742 1 2 . 1 1 74 74 GLY H H 74 9.317 9.317 9.520 -0.203 18321 1743 1 2 . 1 1 75 75 ASP N N 75 125.691 125.691 115.448 10.243 18321 1744 1 2 . 1 1 75 75 ASP HA H 75 4.713 4.713 4.172 0.541 18321 1745 1 2 . 1 1 75 75 ASP C C 75 175.841 175.841 175.272 0.569 18321 1746 1 2 . 1 1 75 75 ASP CA C 75 53.815 53.815 56.013 -2.198 18321 1747 1 2 . 1 1 75 75 ASP CB C 75 41.288 41.288 40.726 0.562 18321 1748 1 2 . 1 1 75 75 ASP H H 75 8.665 8.665 8.263 0.402 18321 1749 1 2 . 1 1 76 76 GLN N N 76 120.368 120.368 119.646 0.722 18321 1750 1 2 . 1 1 76 76 GLN C C 76 173.630 173.630 174.532 -0.902 18321 1751 1 2 . 1 1 76 76 GLN CA C 76 54.254 54.254 55.441 -1.188 18321 1752 1 2 . 1 1 76 76 GLN CB C 76 31.248 31.248 29.882 1.366 18321 1753 1 2 . 1 1 76 76 GLN H H 76 8.289 8.289 7.624 0.665 18321 1754 1 2 . 1 1 77 77 GLU N N 77 120.435 120.435 121.573 -1.138 18321 1755 1 2 . 1 1 77 77 GLU C C 77 175.484 175.484 175.138 0.346 18321 1756 1 2 . 1 1 77 77 GLU CA C 77 54.203 54.203 55.087 -0.884 18321 1757 1 2 . 1 1 77 77 GLU CB C 77 33.141 33.141 30.858 2.283 18321 1758 1 2 . 1 1 77 77 GLU H H 77 7.732 7.732 8.135 -0.403 18321 1759 1 2 . 1 1 78 78 PHE N N 78 117.911 117.911 121.456 -3.545 18321 1760 1 2 . 1 1 78 78 PHE HA H 78 4.659 4.659 4.710 -0.051 18321 1761 1 2 . 1 1 78 78 PHE C C 78 175.673 175.673 176.183 -0.510 18321 1762 1 2 . 1 1 78 78 PHE CA C 78 57.160 57.160 56.747 0.413 18321 1763 1 2 . 1 1 78 78 PHE CB C 78 45.405 45.405 42.184 3.221 18321 1764 1 2 . 1 1 78 78 PHE H H 78 9.235 9.235 8.199 1.036 18321 1765 1 2 . 1 1 79 79 ASP N N 79 119.296 119.296 118.447 0.849 18321 1766 1 2 . 1 1 79 79 ASP HA H 79 4.462 4.462 4.571 -0.109 18321 1767 1 2 . 1 1 79 79 ASP C C 79 174.482 174.482 175.739 -1.257 18321 1768 1 2 . 1 1 79 79 ASP CA C 79 56.629 56.629 56.414 0.215 18321 1769 1 2 . 1 1 79 79 ASP CB C 79 41.697 41.697 41.265 0.432 18321 1770 1 2 . 1 1 79 79 ASP H H 79 9.187 9.187 8.816 0.371 18321 1771 1 2 . 1 1 80 80 HIS N N 80 107.631 107.631 110.096 -2.465 18321 1772 1 2 . 1 1 80 80 HIS HA H 80 5.022 5.022 5.049 -0.027 18321 1773 1 2 . 1 1 80 80 HIS C C 80 174.626 174.626 174.409 0.217 18321 1774 1 2 . 1 1 80 80 HIS CA C 80 54.223 54.223 55.080 -0.857 18321 1775 1 2 . 1 1 80 80 HIS CB C 80 32.205 32.205 31.349 0.856 18321 1776 1 2 . 1 1 80 80 HIS H H 80 7.200 7.200 7.065 0.135 18321 1777 1 2 . 1 1 81 81 LEU N N 81 120.710 120.710 120.874 -0.164 18321 1778 1 2 . 1 1 81 81 LEU HA H 81 3.804 3.804 4.132 -0.328 18321 1779 1 2 . 1 1 81 81 LEU CA C 81 58.709 58.709 59.782 -1.073 18321 1780 1 2 . 1 1 81 81 LEU CB C 81 39.646 39.646 40.075 -0.429 18321 1781 1 2 . 1 1 81 81 LEU H H 81 8.886 8.886 9.085 -0.199 18321 1782 1 2 . 1 1 82 82 PRO HA H 82 4.020 4.020 4.156 -0.136 18321 1783 1 2 . 1 1 82 82 PRO C C 82 175.619 175.619 176.522 -0.903 18321 1784 1 2 . 1 1 82 82 PRO CA C 82 67.025 67.025 64.691 2.334 18321 1785 1 2 . 1 1 82 82 PRO CB C 82 30.962 30.962 30.843 0.119 18321 1786 1 2 . 1 1 83 83 ALA N N 83 124.281 124.281 119.101 5.180 18321 1787 1 2 . 1 1 83 83 ALA HA H 83 4.019 4.019 4.096 -0.077 18321 1788 1 2 . 1 1 83 83 ALA C C 83 179.709 179.709 178.628 1.081 18321 1789 1 2 . 1 1 83 83 ALA CA C 83 54.985 54.985 53.639 1.346 18321 1790 1 2 . 1 1 83 83 ALA CB C 83 18.425 18.425 18.872 -0.447 18321 1791 1 2 . 1 1 83 83 ALA H H 83 8.527 8.527 7.474 1.053 18321 1792 1 2 . 1 1 84 84 LEU N N 84 122.960 122.960 116.470 6.490 18321 1793 1 2 . 1 1 84 84 LEU HA H 84 1.917 1.917 2.969 -1.052 18321 1794 1 2 . 1 1 84 84 LEU C C 84 177.652 177.652 178.015 -0.363 18321 1795 1 2 . 1 1 84 84 LEU CA C 84 58.261 58.261 56.932 1.329 18321 1796 1 2 . 1 1 84 84 LEU CB C 84 42.544 42.544 40.847 1.696 18321 1797 1 2 . 1 1 84 84 LEU H H 84 6.982 6.982 7.170 -0.188 18321 1798 1 2 . 1 1 85 85 LEU N N 85 117.940 117.940 119.803 -1.863 18321 1799 1 2 . 1 1 85 85 LEU HA H 85 3.463 3.463 3.841 -0.378 18321 1800 1 2 . 1 1 85 85 LEU C C 85 178.809 178.809 178.695 0.114 18321 1801 1 2 . 1 1 85 85 LEU CA C 85 57.522 57.522 57.264 0.258 18321 1802 1 2 . 1 1 85 85 LEU CB C 85 41.242 41.242 41.110 0.132 18321 1803 1 2 . 1 1 85 85 LEU H H 85 7.773 7.773 7.446 0.327 18321 1804 1 2 . 1 1 86 86 GLU N N 86 115.762 115.762 118.004 -2.242 18321 1805 1 2 . 1 1 86 86 GLU HA H 86 3.540 3.540 4.063 -0.523 18321 1806 1 2 . 1 1 86 86 GLU C C 86 180.228 180.228 176.654 3.574 18321 1807 1 2 . 1 1 86 86 GLU CA C 86 58.943 58.943 57.231 1.712 18321 1808 1 2 . 1 1 86 86 GLU CB C 86 29.561 29.561 29.428 0.133 18321 1809 1 2 . 1 1 86 86 GLU H H 86 8.300 8.300 7.639 0.661 18321 1810 1 2 . 1 1 87 87 PHE N N 87 121.135 121.135 118.838 2.297 18321 1811 1 2 . 1 1 87 87 PHE HA H 87 4.122 4.122 4.339 -0.217 18321 1812 1 2 . 1 1 87 87 PHE C C 87 179.497 179.497 176.507 2.990 18321 1813 1 2 . 1 1 87 87 PHE CA C 87 62.090 62.090 59.471 2.619 18321 1814 1 2 . 1 1 87 87 PHE CB C 87 40.103 40.103 40.163 -0.059 18321 1815 1 2 . 1 1 87 87 PHE H H 87 7.717 7.717 7.126 0.591 18321 1816 1 2 . 1 1 88 88 TYR N N 88 116.579 116.579 119.038 -2.459 18321 1817 1 2 . 1 1 88 88 TYR HA H 88 4.933 4.933 4.270 0.663 18321 1818 1 2 . 1 1 88 88 TYR C C 88 174.799 174.799 177.142 -2.343 18321 1819 1 2 . 1 1 88 88 TYR CA C 88 61.333 61.333 58.256 3.077 18321 1820 1 2 . 1 1 88 88 TYR CB C 88 36.539 36.539 37.037 -0.498 18321 1821 1 2 . 1 1 88 88 TYR H H 88 7.478 7.478 7.873 -0.395 18321 1822 1 2 . 1 1 89 89 LYS N N 89 117.737 117.737 117.823 -0.086 18321 1823 1 2 . 1 1 89 89 LYS HA H 89 4.466 4.466 4.056 0.410 18321 1824 1 2 . 1 1 89 89 LYS C C 89 178.417 178.417 176.631 1.786 18321 1825 1 2 . 1 1 89 89 LYS CA C 89 59.486 59.486 58.320 1.166 18321 1826 1 2 . 1 1 89 89 LYS CB C 89 34.523 34.523 32.309 2.215 18321 1827 1 2 . 1 1 89 89 LYS H H 89 7.505 7.505 8.242 -0.737 18321 1828 1 2 . 1 1 90 90 ILE N N 90 110.972 110.972 111.892 -0.920 18321 1829 1 2 . 1 1 90 90 ILE HA H 90 4.181 4.181 4.163 0.018 18321 1830 1 2 . 1 1 90 90 ILE C C 90 174.571 174.571 175.993 -1.422 18321 1831 1 2 . 1 1 90 90 ILE CA C 90 60.516 60.516 61.407 -0.891 18321 1832 1 2 . 1 1 90 90 ILE CB C 90 39.979 39.979 38.196 1.783 18321 1833 1 2 . 1 1 90 90 ILE H H 90 6.710 6.710 7.241 -0.531 18321 1834 1 2 . 1 1 91 91 HIS N N 91 119.479 119.479 121.159 -1.680 18321 1835 1 2 . 1 1 91 91 HIS HA H 91 4.357 4.357 4.240 0.117 18321 1836 1 2 . 1 1 91 91 HIS C C 91 172.751 172.751 174.962 -2.211 18321 1837 1 2 . 1 1 91 91 HIS CA C 91 55.066 55.066 57.422 -2.356 18321 1838 1 2 . 1 1 91 91 HIS CB C 91 29.756 29.756 30.712 -0.956 18321 1839 1 2 . 1 1 91 91 HIS H H 91 7.460 7.460 7.589 -0.129 18321 1840 1 2 . 1 1 92 92 TYR N N 92 117.642 117.642 115.907 1.735 18321 1841 1 2 . 1 1 92 92 TYR HA H 92 4.131 4.131 4.361 -0.230 18321 1842 1 2 . 1 1 92 92 TYR C C 92 177.348 177.348 176.213 1.135 18321 1843 1 2 . 1 1 92 92 TYR CA C 92 58.627 58.627 58.276 0.351 18321 1844 1 2 . 1 1 92 92 TYR CB C 92 39.481 39.481 35.751 3.730 18321 1845 1 2 . 1 1 92 92 TYR H H 92 8.067 8.067 7.753 0.314 18321 1846 1 2 . 1 1 93 93 LEU N N 93 123.560 123.560 120.366 3.194 18321 1847 1 2 . 1 1 93 93 LEU HA H 93 4.104 4.104 3.984 0.120 18321 1848 1 2 . 1 1 93 93 LEU C C 93 175.610 175.610 177.212 -1.602 18321 1849 1 2 . 1 1 93 93 LEU CA C 93 56.381 56.381 57.806 -1.425 18321 1850 1 2 . 1 1 93 93 LEU CB C 93 38.896 38.896 41.917 -3.021 18321 1851 1 2 . 1 1 93 93 LEU H H 93 7.907 7.907 8.197 -0.290 18321 1852 1 2 . 1 1 94 94 ASP N N 94 118.194 118.194 113.323 4.871 18321 1853 1 2 . 1 1 94 94 ASP HA H 94 4.940 4.940 4.706 0.234 18321 1854 1 2 . 1 1 94 94 ASP C C 94 176.123 176.123 176.715 -0.592 18321 1855 1 2 . 1 1 94 94 ASP CA C 94 56.235 56.235 54.736 1.499 18321 1856 1 2 . 1 1 94 94 ASP CB C 94 42.078 42.078 41.749 0.328 18321 1857 1 2 . 1 1 94 94 ASP H H 94 8.640 8.640 8.336 0.304 18321 1858 1 2 . 1 1 95 95 THR N N 95 105.073 105.073 113.988 -8.915 18321 1859 1 2 . 1 1 95 95 THR HA H 95 4.318 4.318 4.654 -0.336 18321 1860 1 2 . 1 1 95 95 THR C C 95 174.685 174.685 174.059 0.626 18321 1861 1 2 . 1 1 95 95 THR CA C 95 60.756 60.756 61.309 -0.554 18321 1862 1 2 . 1 1 95 95 THR CB C 95 71.058 71.058 69.341 1.716 18321 1863 1 2 . 1 1 95 95 THR H H 95 8.576 8.576 8.327 0.249 18321 1864 1 2 . 1 1 96 96 THR N N 96 116.817 116.817 115.103 1.714 18321 1865 1 2 . 1 1 96 96 THR HA H 96 5.129 5.129 4.799 0.330 18321 1866 1 2 . 1 1 96 96 THR C C 96 172.464 172.464 172.421 0.043 18321 1867 1 2 . 1 1 96 96 THR CA C 96 60.762 60.762 61.238 -0.476 18321 1868 1 2 . 1 1 96 96 THR CB C 96 71.425 71.425 70.919 0.506 18321 1869 1 2 . 1 1 96 96 THR H H 96 8.205 8.205 7.538 0.667 18321 1870 1 2 . 1 1 97 97 THR N N 97 114.324 114.324 113.192 1.132 18321 1871 1 2 . 1 1 97 97 THR HA H 97 5.128 5.128 4.507 0.621 18321 1872 1 2 . 1 1 97 97 THR C C 97 175.480 175.480 174.015 1.465 18321 1873 1 2 . 1 1 97 97 THR CA C 97 60.233 60.233 59.839 0.394 18321 1874 1 2 . 1 1 97 97 THR CB C 97 70.415 70.415 71.459 -1.044 18321 1875 1 2 . 1 1 97 97 THR H H 97 7.128 7.128 8.083 -0.955 18321 1876 1 2 . 1 1 98 98 LEU N N 98 116.674 116.674 122.552 -5.878 18321 1877 1 2 . 1 1 98 98 LEU HA H 98 4.075 4.075 4.036 0.039 18321 1878 1 2 . 1 1 98 98 LEU C C 98 177.892 177.892 176.886 1.006 18321 1879 1 2 . 1 1 98 98 LEU CA C 98 59.597 59.597 55.559 4.038 18321 1880 1 2 . 1 1 98 98 LEU CB C 98 41.172 41.172 40.690 0.482 18321 1881 1 2 . 1 1 98 98 LEU H H 98 8.743 8.743 7.890 0.853 18321 1882 1 2 . 1 1 99 99 ILE N N 99 122.988 122.988 123.214 -0.226 18321 1883 1 2 . 1 1 99 99 ILE HA H 99 4.415 4.415 4.266 0.149 18321 1884 1 2 . 1 1 99 99 ILE C C 99 175.055 175.055 175.922 -0.867 18321 1885 1 2 . 1 1 99 99 ILE CA C 99 62.183 62.183 61.453 0.730 18321 1886 1 2 . 1 1 99 99 ILE CB C 99 40.252 40.252 38.787 1.465 18321 1887 1 2 . 1 1 99 99 ILE H H 99 8.998 8.998 8.194 0.804 18321 1888 1 2 . 1 1 100 100 GLU N N 100 114.067 114.067 114.225 -0.158 18321 1889 1 2 . 1 1 100 100 GLU CA C 100 52.910 52.910 53.395 -0.485 18321 1890 1 2 . 1 1 100 100 GLU CB C 100 31.155 31.155 30.649 0.506 18321 1891 1 2 . 1 1 100 100 GLU H H 100 7.332 7.332 7.695 -0.363 18321 1892 1 2 . 1 1 101 101 PRO HA H 101 4.952 4.952 3.466 1.486 18321 1893 1 2 . 1 1 101 101 PRO C C 101 175.976 175.976 176.248 -0.272 18321 1894 1 2 . 1 1 101 101 PRO CA C 101 53.312 53.312 62.133 -8.821 18321 1895 1 2 . 1 1 101 101 PRO CB C 101 31.598 31.598 31.781 -0.183 18321 1896 1 2 . 1 1 102 102 ALA N N 102 125.968 125.968 124.476 1.492 18321 1897 1 2 . 1 1 102 102 ALA HA H 102 4.516 4.516 4.387 0.129 18321 1898 1 2 . 1 1 102 102 ALA CA C 102 49.852 49.852 50.047 -0.195 18321 1899 1 2 . 1 1 102 102 ALA CB C 102 17.766 17.766 18.395 -0.629 18321 1900 1 2 . 1 1 102 102 ALA H H 102 8.232 8.232 7.917 0.315 18321 1901 1 2 . 1 1 103 103 PRO HA H 103 4.283 4.283 4.345 -0.062 18321 1902 1 2 . 1 1 103 103 PRO CA C 103 62.435 62.435 62.754 -0.319 18321 1903 1 2 . 1 1 103 103 PRO CB C 103 32.145 32.145 31.672 0.474 18321 1904 1 2 . 1 1 104 104 ARG HA H 104 4.004 4.004 4.099 -0.095 18321 1905 1 2 . 1 1 104 104 ARG CA C 104 56.660 56.660 56.302 0.358 18321 1906 1 2 . 1 1 106 106 PRO C C 106 174.587 174.587 175.656 -1.069 18321 1907 1 2 . 1 1 106 106 PRO CA C 106 57.867 57.867 62.258 -4.391 18321 1908 1 2 . 1 1 106 106 PRO CB C 106 31.942 31.942 33.114 -1.172 18321 1909 1 2 . 1 1 107 107 SER N N 107 121.280 121.280 114.216 7.064 18321 1910 1 2 . 1 1 107 107 SER CA C 107 61.772 61.772 56.722 5.050 18321 1911 1 2 . 1 1 107 107 SER CB C 107 63.234 63.234 62.925 0.309 18321 1912 1 2 . 1 1 107 107 SER H H 107 8.132 8.132 8.099 0.033 18321 1913 1 2 . 1 1 109 109 PRO C C 109 177.129 177.129 177.031 0.098 18321 1914 1 2 . 1 1 109 109 PRO CA C 109 62.638 62.638 63.053 -0.415 18321 1915 1 2 . 1 1 109 109 PRO CB C 109 30.970 30.970 31.378 -0.408 18321 1916 1 2 . 1 1 110 110 MET N N 110 120.772 120.772 121.919 -1.147 18321 1917 1 2 . 1 1 110 110 MET C C 110 176.892 176.892 175.306 1.586 18321 1918 1 2 . 1 1 110 110 MET CA C 110 55.310 55.310 56.666 -1.356 18321 1919 1 2 . 1 1 110 110 MET CB C 110 32.202 32.202 32.360 -0.158 18321 1920 1 2 . 1 1 110 110 MET H H 110 8.430 8.430 8.804 -0.374 18321 1921 1 2 . 1 1 111 111 GLY N N 111 110.158 110.158 107.496 2.662 18321 1922 1 2 . 1 1 111 111 GLY C C 111 177.430 177.430 174.445 2.985 18321 1923 1 2 . 1 1 111 111 GLY CA C 111 44.951 44.951 44.720 0.231 18321 1924 1 2 . 1 1 111 111 GLY H H 111 8.384 8.384 7.912 0.472 18321 1925 1 2 . 1 1 112 112 SER N N 112 116.762 116.762 118.683 -1.921 18321 1926 1 2 . 1 1 112 112 SER CA C 112 55.948 55.948 58.895 -2.947 18321 1927 1 2 . 1 1 112 112 SER CB C 112 62.745 62.745 63.864 -1.119 18321 1928 1 2 . 1 1 112 112 SER H H 112 8.161 8.161 8.661 -0.500 18321 1929 1 2 . 1 1 113 113 VAL C C 113 176.083 176.083 174.775 1.308 18321 1930 1 2 . 1 1 114 114 SER N N 114 119.151 119.151 120.188 -1.037 18321 1931 1 2 . 1 1 114 114 SER C C 114 173.638 173.638 174.557 -0.919 18321 1932 1 2 . 1 1 114 114 SER CA C 114 58.005 58.005 58.665 -0.660 18321 1933 1 2 . 1 1 114 114 SER CB C 114 63.169 63.169 64.213 -1.044 18321 1934 1 2 . 1 1 114 114 SER H H 114 8.319 8.319 8.022 0.297 18321 1935 1 2 . 1 1 115 115 ALA N N 115 126.914 126.914 125.109 1.805 18321 1936 1 2 . 1 1 115 115 ALA CA C 115 51.561 51.561 52.393 -0.832 18321 1937 1 2 . 1 1 115 115 ALA CB C 115 17.714 17.714 17.923 -0.209 18321 1938 1 2 . 1 1 115 115 ALA H H 115 8.197 8.197 8.218 -0.021 18321 1939 1 2 . 1 1 119 119 PRO C C 119 177.065 177.065 176.905 0.160 18321 1940 1 2 . 1 1 120 120 THR N N 120 113.976 113.976 119.035 -5.059 18321 1941 1 2 . 1 1 120 120 THR C C 120 174.461 174.461 174.497 -0.036 18321 1942 1 2 . 1 1 120 120 THR CA C 120 61.215 61.215 62.567 -1.352 18321 1943 1 2 . 1 1 120 120 THR CB C 120 69.508 69.508 69.229 0.279 18321 1944 1 2 . 1 1 120 120 THR H H 120 8.138 8.138 8.363 -0.225 18321 1945 1 2 . 1 1 121 121 ALA N N 121 125.859 125.859 124.664 1.195 18321 1946 1 2 . 1 1 121 121 ALA CA C 121 52.281 52.281 52.602 -0.321 18321 1947 1 2 . 1 1 121 121 ALA CB C 121 18.623 18.623 19.432 -0.809 18321 1948 1 2 . 1 1 121 121 ALA H H 121 8.272 8.272 8.041 0.231 18321 1949 1 2 . 1 1 122 122 GLU C C 122 176.316 176.316 175.360 0.956 18321 1950 1 2 . 1 1 123 123 ASP N N 123 120.448 120.448 119.791 0.657 18321 1951 1 2 . 1 1 123 123 ASP C C 123 175.906 175.906 173.889 2.017 18321 1952 1 2 . 1 1 123 123 ASP CA C 123 54.167 54.167 55.039 -0.872 18321 1953 1 2 . 1 1 123 123 ASP CB C 123 40.695 40.695 40.611 0.084 18321 1954 1 2 . 1 1 123 123 ASP H H 123 8.181 8.181 8.551 -0.370 18321 1955 1 2 . 1 1 124 124 ASN N N 124 118.207 118.207 120.216 -2.009 18321 1956 1 2 . 1 1 124 124 ASN C C 124 174.851 174.851 174.051 0.800 18321 1957 1 2 . 1 1 124 124 ASN CA C 124 52.771 52.771 52.286 0.485 18321 1958 1 2 . 1 1 124 124 ASN CB C 124 38.304 38.304 39.931 -1.627 18321 1959 1 2 . 1 1 124 124 ASN H H 124 8.307 8.307 8.319 -0.012 18321 1960 1 2 . 1 1 125 125 LEU N N 125 121.311 121.311 120.102 1.209 18321 1961 1 2 . 1 1 125 125 LEU C C 125 175.750 175.750 175.926 -0.176 18321 1962 1 2 . 1 1 125 125 LEU CA C 125 54.428 54.428 55.736 -1.308 18321 1963 1 2 . 1 1 125 125 LEU CB C 125 41.350 41.350 40.758 0.592 18321 1964 1 2 . 1 1 125 125 LEU H H 125 7.747 7.747 8.655 -0.908 18321 1965 1 2 . 1 1 126 126 GLU N N 126 122.485 122.485 120.325 2.160 18321 1966 1 2 . 1 1 126 126 GLU C C 126 174.008 174.008 174.466 -0.458 18321 1967 1 2 . 1 1 126 126 GLU CA C 126 54.855 54.855 56.342 -1.487 18321 1968 1 2 . 1 1 126 126 GLU CB C 126 30.472 30.472 30.433 0.039 18321 1969 1 2 . 1 1 126 126 GLU H H 126 8.453 8.453 8.072 0.381 18321 1970 1 2 . 1 1 127 127 TYR N N 127 122.713 122.713 120.659 2.054 18321 1971 1 2 . 1 1 127 127 TYR C C 127 176.859 176.859 174.779 2.080 18321 1972 1 2 . 1 1 127 127 TYR CA C 127 56.528 56.528 57.568 -1.040 18321 1973 1 2 . 1 1 127 127 TYR CB C 127 40.982 40.982 39.508 1.474 18321 1974 1 2 . 1 1 127 127 TYR H H 127 8.469 8.469 8.259 0.210 18321 1975 1 2 . 1 1 128 128 VAL N N 128 112.432 112.432 125.168 -12.736 18321 1976 1 2 . 1 1 128 128 VAL C C 128 173.150 173.150 174.226 -1.076 18321 1977 1 2 . 1 1 128 128 VAL CA C 128 57.940 57.940 60.065 -2.125 18321 1978 1 2 . 1 1 128 128 VAL CB C 128 34.935 34.935 35.420 -0.485 18321 1979 1 2 . 1 1 128 128 VAL H H 128 9.078 9.078 9.161 -0.083 18321 1980 1 2 . 1 1 129 129 ARG N N 129 120.373 120.373 123.343 -2.970 18321 1981 1 2 . 1 1 129 129 ARG C C 129 176.539 176.539 175.343 1.196 18321 1982 1 2 . 1 1 129 129 ARG CA C 129 52.534 52.534 53.370 -0.835 18321 1983 1 2 . 1 1 129 129 ARG CB C 129 32.942 32.942 33.130 -0.188 18321 1984 1 2 . 1 1 129 129 ARG H H 129 9.010 9.010 8.146 0.864 18321 1985 1 2 . 1 1 130 130 THR N N 130 116.637 116.637 112.689 3.948 18321 1986 1 2 . 1 1 130 130 THR CA C 130 60.618 60.618 60.850 -0.232 18321 1987 1 2 . 1 1 130 130 THR CB C 130 69.170 69.170 70.075 -0.905 18321 1988 1 2 . 1 1 130 130 THR H H 130 9.045 9.045 8.415 0.630 18321 1989 1 2 . 1 1 131 131 LEU N N 131 122.910 122.910 124.006 -1.096 18321 1990 1 2 . 1 1 131 131 LEU C C 131 175.269 175.269 176.566 -1.297 18321 1991 1 2 . 1 1 131 131 LEU CA C 131 55.122 55.122 54.870 0.253 18321 1992 1 2 . 1 1 131 131 LEU CB C 131 43.108 43.108 42.406 0.702 18321 1993 1 2 . 1 1 131 131 LEU H H 131 9.224 9.224 8.416 0.808 18321 1994 1 2 . 1 1 132 132 TYR N N 132 112.885 112.885 118.570 -5.685 18321 1995 1 2 . 1 1 132 132 TYR C C 132 173.818 173.818 175.041 -1.223 18321 1996 1 2 . 1 1 132 132 TYR CA C 132 54.230 54.230 59.026 -4.796 18321 1997 1 2 . 1 1 132 132 TYR CB C 132 42.672 42.672 40.612 2.060 18321 1998 1 2 . 1 1 132 132 TYR H H 132 7.284 7.284 7.672 -0.388 18321 1999 1 2 . 1 1 133 133 ASP N N 133 118.003 118.003 119.620 -1.617 18321 2000 1 2 . 1 1 133 133 ASP C C 133 175.779 175.779 174.118 1.661 18321 2001 1 2 . 1 1 133 133 ASP CA C 133 54.351 54.351 55.258 -0.907 18321 2002 1 2 . 1 1 133 133 ASP CB C 133 41.241 41.241 39.960 1.281 18321 2003 1 2 . 1 1 133 133 ASP H H 133 8.399 8.399 8.377 0.022 18321 2004 1 2 . 1 1 134 134 PHE N N 134 121.081 121.081 123.389 -2.308 18321 2005 1 2 . 1 1 134 134 PHE CA C 134 52.552 52.552 54.342 -1.790 18321 2006 1 2 . 1 1 134 134 PHE CB C 134 41.217 41.217 41.209 0.008 18321 2007 1 2 . 1 1 134 134 PHE H H 134 8.797 8.797 7.377 1.420 18321 2008 1 2 . 1 1 136 136 GLY C C 136 171.616 171.616 174.550 -2.934 18321 2009 1 2 . 1 1 137 137 ASN N N 137 119.394 119.394 116.847 2.547 18321 2010 1 2 . 1 1 137 137 ASN C C 137 174.500 174.500 173.718 0.782 18321 2011 1 2 . 1 1 137 137 ASN CA C 137 44.670 44.670 54.112 -9.442 18321 2012 1 2 . 1 1 137 137 ASN H H 137 9.477 9.477 8.235 1.242 18321 2013 1 2 . 1 1 138 138 ASP N N 138 120.608 120.608 118.548 2.060 18321 2014 1 2 . 1 1 138 138 ASP C C 138 176.987 176.987 174.479 2.508 18321 2015 1 2 . 1 1 138 138 ASP CA C 138 52.992 52.992 53.207 -0.215 18321 2016 1 2 . 1 1 138 138 ASP H H 138 8.216 8.216 7.930 0.286 18321 2017 1 2 . 1 1 139 139 ALA N N 139 124.371 124.371 121.490 2.881 18321 2018 1 2 . 1 1 139 139 ALA C C 139 178.472 178.472 178.544 -0.072 18321 2019 1 2 . 1 1 139 139 ALA CA C 139 54.513 54.513 53.768 0.745 18321 2020 1 2 . 1 1 139 139 ALA CB C 139 18.045 18.045 19.548 -1.503 18321 2021 1 2 . 1 1 139 139 ALA H H 139 8.565 8.565 8.520 0.045 18321 2022 1 2 . 1 1 140 140 GLU N N 140 115.022 115.022 118.299 -3.277 18321 2023 1 2 . 1 1 140 140 GLU C C 140 177.027 177.027 175.925 1.102 18321 2024 1 2 . 1 1 140 140 GLU CA C 140 56.181 56.181 58.017 -1.836 18321 2025 1 2 . 1 1 140 140 GLU CB C 140 28.619 28.619 30.049 -1.430 18321 2026 1 2 . 1 1 140 140 GLU H H 140 8.616 8.616 8.466 0.150 18321 2027 1 2 . 1 1 141 141 ASP N N 141 121.913 121.913 119.844 2.069 18321 2028 1 2 . 1 1 141 141 ASP C C 141 175.923 175.923 174.738 1.185 18321 2029 1 2 . 1 1 141 141 ASP CA C 141 54.736 54.736 53.087 1.649 18321 2030 1 2 . 1 1 141 141 ASP CB C 141 41.305 41.305 42.988 -1.683 18321 2031 1 2 . 1 1 141 141 ASP H H 141 7.636 7.636 7.910 -0.274 18321 2032 1 2 . 1 1 142 142 LEU N N 142 127.651 127.651 126.489 1.162 18321 2033 1 2 . 1 1 142 142 LEU CA C 142 50.955 50.955 53.065 -2.110 18321 2034 1 2 . 1 1 142 142 LEU CB C 142 42.343 42.343 43.506 -1.163 18321 2035 1 2 . 1 1 142 142 LEU H H 142 9.479 9.479 8.191 1.288 18321 2036 1 2 . 1 1 143 143 PRO C C 143 177.924 177.924 175.616 2.308 18321 2037 1 2 . 1 1 144 144 PHE N N 144 114.483 114.483 120.441 -5.958 18321 2038 1 2 . 1 1 144 144 PHE C C 144 175.055 175.055 175.310 -0.255 18321 2039 1 2 . 1 1 144 144 PHE CA C 144 55.543 55.543 54.804 0.739 18321 2040 1 2 . 1 1 144 144 PHE CB C 144 40.581 40.581 40.837 -0.256 18321 2041 1 2 . 1 1 144 144 PHE H H 144 8.637 8.637 7.242 1.395 18321 2042 1 2 . 1 1 145 145 LYS N N 145 121.342 121.342 119.727 1.615 18321 2043 1 2 . 1 1 145 145 LYS C C 145 176.925 176.925 178.168 -1.243 18321 2044 1 2 . 1 1 145 145 LYS CA C 145 53.043 53.043 54.221 -1.178 18321 2045 1 2 . 1 1 145 145 LYS CB C 145 33.804 33.804 34.942 -1.138 18321 2046 1 2 . 1 1 145 145 LYS H H 145 9.418 9.418 8.607 0.811 18321 2047 1 2 . 1 1 146 146 LYS N N 146 123.378 123.378 119.486 3.892 18321 2048 1 2 . 1 1 146 146 LYS CA C 146 57.883 57.883 57.037 0.846 18321 2049 1 2 . 1 1 146 146 LYS CB C 146 32.008 32.008 32.443 -0.435 18321 2050 1 2 . 1 1 146 146 LYS H H 146 9.002 9.002 8.795 0.207 18321 2051 1 2 . 1 1 147 147 GLY C C 147 174.315 174.315 173.491 0.824 18321 2052 1 2 . 1 1 148 148 GLU N N 148 121.392 121.392 120.340 1.052 18321 2053 1 2 . 1 1 148 148 GLU C C 148 174.998 174.998 175.086 -0.088 18321 2054 1 2 . 1 1 148 148 GLU CA C 148 56.867 56.867 54.750 2.117 18321 2055 1 2 . 1 1 148 148 GLU CB C 148 31.649 31.649 32.236 -0.587 18321 2056 1 2 . 1 1 148 148 GLU H H 148 7.937 7.937 7.684 0.253 18321 2057 1 2 . 1 1 149 149 ILE N N 149 120.124 120.124 121.910 -1.786 18321 2058 1 2 . 1 1 149 149 ILE C C 149 176.647 176.647 175.230 1.417 18321 2059 1 2 . 1 1 149 149 ILE CA C 149 58.621 58.621 59.694 -1.073 18321 2060 1 2 . 1 1 149 149 ILE CB C 149 36.952 36.952 38.415 -1.463 18321 2061 1 2 . 1 1 149 149 ILE H H 149 8.346 8.346 8.575 -0.229 18321 2062 1 2 . 1 1 150 150 LEU N N 150 126.950 126.950 124.781 2.169 18321 2063 1 2 . 1 1 150 150 LEU CA C 150 51.967 51.967 52.702 -0.735 18321 2064 1 2 . 1 1 150 150 LEU CB C 150 44.182 44.182 45.907 -1.725 18321 2065 1 2 . 1 1 150 150 LEU H H 150 8.988 8.988 9.187 -0.199 18321 2066 1 2 . 1 1 151 151 VAL C C 151 175.670 175.670 175.752 -0.082 18321 2067 1 2 . 1 1 152 152 ILE N N 152 124.997 124.997 128.659 -3.662 18321 2068 1 2 . 1 1 152 152 ILE CA C 152 58.331 58.331 59.808 -1.477 18321 2069 1 2 . 1 1 152 152 ILE CB C 152 34.093 34.093 34.665 -0.572 18321 2070 1 2 . 1 1 152 152 ILE H H 152 8.673 8.673 8.427 0.246 18321 2071 1 2 . 1 1 153 153 ILE N N 153 124.710 124.710 126.386 -1.676 18321 2072 1 2 . 1 1 153 153 ILE C C 153 176.264 176.264 174.656 1.608 18321 2073 1 2 . 1 1 154 154 GLU N N 154 117.398 117.398 117.125 0.273 18321 2074 1 2 . 1 1 154 154 GLU C C 154 173.959 173.959 174.745 -0.786 18321 2075 1 2 . 1 1 154 154 GLU CA C 154 55.289 55.289 54.348 0.941 18321 2076 1 2 . 1 1 154 154 GLU CB C 154 32.842 32.842 32.284 0.558 18321 2077 1 2 . 1 1 154 154 GLU H H 154 7.818 7.818 8.095 -0.277 18321 2078 1 2 . 1 1 155 155 LYS N N 155 121.130 121.130 123.491 -2.361 18321 2079 1 2 . 1 1 155 155 LYS CA C 155 53.022 53.022 52.651 0.371 18321 2080 1 2 . 1 1 155 155 LYS CB C 155 32.663 32.663 33.372 -0.709 18321 2081 1 2 . 1 1 155 155 LYS H H 155 8.654 8.654 8.633 0.021 18321 2082 1 2 . 1 1 157 157 GLU C C 157 175.190 175.190 175.599 -0.409 18321 2083 1 2 . 1 1 157 157 GLU CA C 157 53.785 53.785 54.268 -0.483 18321 2084 1 2 . 1 1 157 157 GLU CB C 157 32.685 32.685 31.481 1.204 18321 2085 1 2 . 1 1 158 158 GLU N N 158 117.425 117.425 120.286 -2.861 18321 2086 1 2 . 1 1 158 158 GLU C C 158 178.600 178.600 176.957 1.643 18321 2087 1 2 . 1 1 158 158 GLU CA C 158 59.044 59.044 58.269 0.775 18321 2088 1 2 . 1 1 158 158 GLU CB C 158 29.706 29.706 30.085 -0.379 18321 2089 1 2 . 1 1 158 158 GLU H H 158 8.678 8.678 8.813 -0.135 18321 2090 1 2 . 1 1 159 159 GLN N N 159 110.925 110.925 117.456 -6.531 18321 2091 1 2 . 1 1 159 159 GLN C C 159 175.539 175.539 175.457 0.082 18321 2092 1 2 . 1 1 159 159 GLN CA C 159 54.942 54.942 58.181 -3.239 18321 2093 1 2 . 1 1 159 159 GLN CB C 159 28.572 28.572 29.982 -1.409 18321 2094 1 2 . 1 1 159 159 GLN H H 159 8.483 8.483 8.488 -0.005 18321 2095 1 2 . 1 1 160 160 TRP N N 160 120.171 120.171 117.468 2.703 18321 2096 1 2 . 1 1 160 160 TRP C C 160 173.444 173.444 175.026 -1.582 18321 2097 1 2 . 1 1 160 160 TRP CA C 160 56.175 56.175 55.938 0.237 18321 2098 1 2 . 1 1 160 160 TRP CB C 160 31.796 31.796 32.493 -0.697 18321 2099 1 2 . 1 1 160 160 TRP H H 160 6.826 6.826 7.536 -0.710 18321 2100 1 2 . 1 1 161 161 TRP N N 161 120.687 120.687 121.160 -0.473 18321 2101 1 2 . 1 1 161 161 TRP C C 161 174.736 174.736 176.105 -1.369 18321 2102 1 2 . 1 1 161 161 TRP CA C 161 51.889 51.889 54.408 -2.519 18321 2103 1 2 . 1 1 161 161 TRP CB C 161 32.772 32.772 31.569 1.204 18321 2104 1 2 . 1 1 161 161 TRP H H 161 8.462 8.462 9.487 -1.025 18321 2105 1 2 . 1 1 162 162 SER N N 162 115.691 115.691 120.164 -4.473 18321 2106 1 2 . 1 1 162 162 SER C C 162 174.320 174.320 173.317 1.003 18321 2107 1 2 . 1 1 162 162 SER CA C 162 57.011 57.011 58.333 -1.321 18321 2108 1 2 . 1 1 162 162 SER CB C 162 63.948 63.948 63.251 0.697 18321 2109 1 2 . 1 1 162 162 SER H H 162 8.830 8.830 8.975 -0.145 18321 2110 1 2 . 1 1 163 163 ALA N N 163 130.630 130.630 128.035 2.595 18321 2111 1 2 . 1 1 163 163 ALA CA C 163 50.029 50.029 49.933 0.096 18321 2112 1 2 . 1 1 163 163 ALA CB C 163 25.500 25.500 22.378 3.122 18321 2113 1 2 . 1 1 163 163 ALA H H 163 9.585 9.585 9.015 0.570 18321 2114 1 2 . 1 1 164 164 ARG N N 164 117.526 117.526 120.827 -3.301 18321 2115 1 2 . 1 1 164 164 ARG C C 164 176.719 176.719 176.690 0.029 18321 2116 1 2 . 1 1 164 164 ARG CA C 164 52.975 52.975 54.417 -1.442 18321 2117 1 2 . 1 1 164 164 ARG CB C 164 34.260 34.260 30.576 3.684 18321 2118 1 2 . 1 1 164 164 ARG H H 164 9.097 9.097 8.836 0.261 18321 2119 1 2 . 1 1 165 165 ASN N N 165 123.935 123.935 122.527 1.408 18321 2120 1 2 . 1 1 165 165 ASN C C 165 178.484 178.484 177.363 1.121 18321 2121 1 2 . 1 1 165 165 ASN CA C 165 50.332 50.332 54.258 -3.926 18321 2122 1 2 . 1 1 165 165 ASN CB C 165 39.487 39.487 39.384 0.103 18321 2123 1 2 . 1 1 165 165 ASN H H 165 8.756 8.756 9.178 -0.422 18321 2124 1 2 . 1 1 166 166 LYS N N 166 118.464 118.464 120.607 -2.143 18321 2125 1 2 . 1 1 166 166 LYS C C 166 176.967 176.967 177.332 -0.365 18321 2126 1 2 . 1 1 166 166 LYS CA C 166 58.430 58.430 58.169 0.261 18321 2127 1 2 . 1 1 166 166 LYS CB C 166 30.918 30.918 31.774 -0.856 18321 2128 1 2 . 1 1 166 166 LYS H H 166 8.915 8.915 9.475 -0.560 18321 2129 1 2 . 1 1 167 167 ASP N N 167 118.138 118.138 116.482 1.656 18321 2130 1 2 . 1 1 167 167 ASP C C 167 176.464 176.464 177.096 -0.632 18321 2131 1 2 . 1 1 167 167 ASP CA C 167 54.212 54.212 54.778 -0.566 18321 2132 1 2 . 1 1 167 167 ASP CB C 167 41.178 41.178 41.184 -0.006 18321 2133 1 2 . 1 1 167 167 ASP H H 167 7.508 7.508 8.190 -0.682 18321 2134 1 2 . 1 1 168 168 GLY N N 168 107.901 107.901 107.868 0.033 18321 2135 1 2 . 1 1 168 168 GLY C C 168 173.613 173.613 173.571 0.042 18321 2136 1 2 . 1 1 168 168 GLY CA C 168 44.783 44.783 45.237 -0.454 18321 2137 1 2 . 1 1 168 168 GLY H H 168 8.173 8.173 8.169 0.004 18321 2138 1 2 . 1 1 169 169 ARG N N 169 124.324 124.324 120.462 3.862 18321 2139 1 2 . 1 1 169 169 ARG CA C 169 56.106 56.106 56.099 0.007 18321 2140 1 2 . 1 1 169 169 ARG CB C 169 29.648 29.648 31.284 -1.636 18321 2141 1 2 . 1 1 169 169 ARG H H 169 7.998 7.998 7.810 0.188 18321 2142 1 2 . 1 1 170 170 VAL C C 170 177.590 177.590 175.085 2.505 18321 2143 1 2 . 1 1 171 171 GLY N N 171 112.582 112.582 113.692 -1.110 18321 2144 1 2 . 1 1 171 171 GLY C C 171 170.991 170.991 172.379 -1.388 18321 2145 1 2 . 1 1 171 171 GLY CA C 171 45.361 45.361 44.794 0.568 18321 2146 1 2 . 1 1 171 171 GLY H H 171 9.013 9.013 8.621 0.392 18321 2147 1 2 . 1 1 172 172 MET N N 172 117.368 117.368 120.017 -2.649 18321 2148 1 2 . 1 1 172 172 MET C C 172 177.921 177.921 176.548 1.373 18321 2149 1 2 . 1 1 172 172 MET CA C 172 53.536 53.536 56.535 -2.999 18321 2150 1 2 . 1 1 172 172 MET CB C 172 30.838 30.838 34.068 -3.230 18321 2151 1 2 . 1 1 172 172 MET H H 172 8.885 8.885 8.821 0.064 18321 2152 1 2 . 1 1 173 173 ILE N N 173 113.130 113.130 116.970 -3.840 18321 2153 1 2 . 1 1 173 173 ILE CA C 173 56.284 56.284 58.141 -1.857 18321 2154 1 2 . 1 1 173 173 ILE CB C 173 40.870 40.870 40.726 0.144 18321 2155 1 2 . 1 1 173 173 ILE H H 173 9.704 9.704 9.392 0.312 18321 2156 1 2 . 1 1 174 174 PRO C C 174 176.714 176.714 177.712 -0.998 18321 2157 1 2 . 1 1 174 174 PRO CA C 174 66.290 66.290 61.234 5.056 18321 2158 1 2 . 1 1 174 174 PRO CB C 174 28.993 28.993 30.506 -1.513 18321 2159 1 2 . 1 1 175 175 VAL N N 175 128.066 128.066 124.374 3.692 18321 2160 1 2 . 1 1 175 175 VAL CA C 175 59.356 59.356 67.230 -7.874 18321 2161 1 2 . 1 1 175 175 VAL H H 175 7.327 7.327 7.815 -0.488 18321 2162 1 2 . 1 1 176 176 PRO C C 176 176.351 176.351 176.837 -0.486 18321 2163 1 2 . 1 1 177 177 TYR N N 177 115.756 115.756 114.454 1.302 18321 2164 1 2 . 1 1 177 177 TYR C C 177 175.011 175.011 175.434 -0.423 18321 2165 1 2 . 1 1 177 177 TYR CA C 177 56.756 56.756 56.499 0.257 18321 2166 1 2 . 1 1 177 177 TYR CB C 177 37.507 37.507 38.668 -1.161 18321 2167 1 2 . 1 1 177 177 TYR H H 177 7.784 7.784 7.540 0.244 18321 2168 1 2 . 1 1 178 178 VAL N N 178 111.428 111.428 115.641 -4.213 18321 2169 1 2 . 1 1 178 178 VAL C C 178 173.417 173.417 175.942 -2.525 18321 2170 1 2 . 1 1 178 178 VAL CA C 178 58.307 58.307 59.295 -0.988 18321 2171 1 2 . 1 1 178 178 VAL CB C 178 34.602 34.602 34.408 0.194 18321 2172 1 2 . 1 1 178 178 VAL H H 178 7.801 7.801 7.404 0.397 18321 2173 1 2 . 1 1 179 179 GLU N N 179 118.581 118.581 120.309 -1.728 18321 2174 1 2 . 1 1 179 179 GLU C C 179 175.225 175.225 175.061 0.164 18321 2175 1 2 . 1 1 179 179 GLU CA C 179 53.114 53.114 56.141 -3.027 18321 2176 1 2 . 1 1 179 179 GLU CB C 179 32.712 32.712 30.215 2.497 18321 2177 1 2 . 1 1 179 179 GLU H H 179 8.819 8.819 8.440 0.379 18321 2178 1 2 . 1 1 180 180 LYS N N 180 124.167 124.167 120.855 3.312 18321 2179 1 2 . 1 1 180 180 LYS C C 180 176.303 176.303 176.767 -0.464 18321 2180 1 2 . 1 1 180 180 LYS CA C 180 57.318 57.318 56.801 0.517 18321 2181 1 2 . 1 1 180 180 LYS CB C 180 31.675 31.675 32.556 -0.881 18321 2182 1 2 . 1 1 180 180 LYS H H 180 8.775 8.775 7.937 0.838 18321 2183 1 2 . 1 1 181 181 LEU N N 181 125.157 125.157 125.130 0.027 18321 2184 1 2 . 1 1 181 181 LEU C C 181 176.462 176.462 177.012 -0.550 18321 2185 1 2 . 1 1 181 181 LEU CA C 181 54.470 54.470 56.866 -2.396 18321 2186 1 2 . 1 1 181 181 LEU CB C 181 41.625 41.625 42.958 -1.333 18321 2187 1 2 . 1 1 181 181 LEU H H 181 8.084 8.084 8.616 -0.532 18321 2188 1 2 . 1 1 182 182 VAL N N 182 123.167 123.167 115.773 7.394 18321 2189 1 2 . 1 1 182 182 VAL C C 182 175.983 175.983 174.501 1.482 18321 2190 1 2 . 1 1 182 182 VAL CA C 182 61.613 61.613 62.769 -1.156 18321 2191 1 2 . 1 1 182 182 VAL CB C 182 32.085 32.085 30.358 1.726 18321 2192 1 2 . 1 1 182 182 VAL H H 182 8.345 8.345 8.171 0.174 18321 2193 1 2 . 1 1 183 183 ARG N N 183 125.775 125.775 124.462 1.313 18321 2194 1 2 . 1 1 183 183 ARG CA C 183 57.801 57.801 55.242 2.559 18321 2195 1 2 . 1 1 183 183 ARG CB C 183 30.091 30.091 32.251 -2.160 18321 2196 1 2 . 1 1 183 183 ARG H H 183 8.530 8.530 7.824 0.706 18321 2197 1 2 . 1 1 184 184 SER C C 184 173.239 173.239 174.029 -0.790 18321 2198 1 2 . 1 1 185 185 SER N N 185 116.511 116.511 112.790 3.721 18321 2199 1 2 . 1 1 185 185 SER CA C 185 58.428 58.428 56.238 2.190 18321 2200 1 2 . 1 1 185 185 SER CB C 185 69.737 69.737 63.777 5.960 18321 2201 1 2 . 1 1 185 185 SER H H 185 7.944 7.944 8.109 -0.165 18321 2202 1 2 . 1 1 190 190 HIS C C 190 176.953 176.953 175.367 1.586 18321 2203 1 2 . 1 1 190 190 HIS CA C 190 54.229 54.229 55.756 -1.527 18321 2204 1 2 . 1 1 190 190 HIS CB C 190 35.112 35.112 29.411 5.701 18321 2205 1 2 . 1 1 191 191 GLY N N 191 109.491 109.491 109.870 -0.379 18321 2206 1 2 . 1 1 191 191 GLY C C 191 172.295 172.295 173.352 -1.057 18321 2207 1 2 . 1 1 191 191 GLY CA C 191 45.227 45.227 44.838 0.389 18321 2208 1 2 . 1 1 191 191 GLY H H 191 8.719 8.719 7.768 0.951 18321 2209 1 2 . 1 1 192 192 ASN N N 192 118.700 118.700 118.882 -0.182 18321 2210 1 2 . 1 1 192 192 ASN HA H 192 4.312 4.312 4.856 -0.544 18321 2211 1 2 . 1 1 192 192 ASN C C 192 176.369 176.369 175.399 0.970 18321 2212 1 2 . 1 1 192 192 ASN CA C 192 57.787 57.787 53.752 4.035 18321 2213 1 2 . 1 1 192 192 ASN H H 192 7.508 7.508 8.769 -1.261 18321 2214 1 2 . 1 1 193 193 ARG N N 193 120.743 120.743 119.967 0.776 18321 2215 1 2 . 1 1 193 193 ARG H H 193 9.032 9.032 8.449 0.583 18321 2216 1 2 . 1 1 197 197 SER HA H 197 4.388 4.388 4.214 0.174 18321 2217 1 2 . 1 1 197 197 SER C C 197 174.133 174.133 173.899 0.234 18321 2218 1 2 . 1 1 197 197 SER CA C 197 58.128 58.128 59.071 -0.943 18321 2219 1 2 . 1 1 197 197 SER CB C 197 62.966 62.966 62.673 0.293 18321 2220 1 2 . 1 1 198 198 TYR N N 198 121.435 121.435 125.542 -4.107 18321 2221 1 2 . 1 1 198 198 TYR HA H 198 4.543 4.543 4.574 -0.031 18321 2222 1 2 . 1 1 198 198 TYR C C 198 176.230 176.230 176.606 -0.376 18321 2223 1 2 . 1 1 198 198 TYR CA C 198 57.536 57.536 57.873 -0.337 18321 2224 1 2 . 1 1 198 198 TYR CB C 198 38.279 38.279 36.916 1.363 18321 2225 1 2 . 1 1 198 198 TYR H H 198 8.071 8.071 8.990 -0.919 18321 2226 1 2 . 1 1 199 199 GLY N N 199 110.039 110.039 110.977 -0.938 18321 2227 1 2 . 1 1 199 199 GLY C C 199 173.475 173.475 174.224 -0.749 18321 2228 1 2 . 1 1 199 199 GLY CA C 199 44.805 44.805 45.517 -0.712 18321 2229 1 2 . 1 1 199 199 GLY H H 199 8.162 8.162 8.289 -0.127 18321 2230 1 2 . 1 1 200 200 ILE N N 200 121.530 121.530 119.002 2.528 18321 2231 1 2 . 1 1 200 200 ILE CA C 200 58.102 58.102 58.100 0.002 18321 2232 1 2 . 1 1 200 200 ILE CB C 200 37.760 37.760 39.280 -1.520 18321 2233 1 2 . 1 1 200 200 ILE H H 200 7.851 7.851 7.728 0.123 18321 2234 1 2 . 1 1 201 201 PRO C C 201 176.485 176.485 175.972 0.513 18321 2235 1 2 . 1 1 201 201 PRO CA C 201 53.893 53.893 63.319 -9.425 18321 2236 1 2 . 1 1 201 201 PRO CB C 201 29.042 29.042 32.192 -3.150 18321 2237 1 2 . 1 1 202 202 GLU N N 202 122.468 122.468 120.150 2.318 18321 2238 1 2 . 1 1 202 202 GLU CA C 202 62.490 62.490 53.093 9.397 18321 2239 1 2 . 1 1 202 202 GLU CB C 202 31.170 31.170 30.382 0.788 18321 2240 1 2 . 1 1 202 202 GLU H H 202 8.328 8.328 8.023 0.305 18321 2241 1 2 . 1 1 203 203 PRO CA C 203 62.803 62.803 62.751 0.052 18321 2242 1 2 . 1 1 203 203 PRO CB C 203 31.220 31.220 31.027 0.193 18321 2243 1 2 . 1 1 204 204 ALA N N 204 123.251 123.251 128.542 -5.291 18321 2244 1 2 . 1 1 204 204 ALA HA H 204 4.180 4.180 4.468 -0.288 18321 2245 1 2 . 1 1 204 204 ALA CA C 204 52.124 52.124 51.814 0.310 18321 2246 1 2 . 1 1 204 204 ALA CB C 204 18.892 18.892 18.687 0.205 18321 2247 1 2 . 1 1 204 204 ALA H H 204 8.308 8.308 8.358 -0.050 18321 2248 1 2 . 1 1 205 205 HIS N N 205 117.874 117.874 124.976 -7.102 18321 2249 1 2 . 1 1 205 205 HIS C C 205 173.282 173.282 174.521 -1.239 18321 2250 1 2 . 1 1 205 205 HIS H H 205 8.045 8.045 8.184 -0.139 18321 2251 1 2 . 1 1 206 206 ALA N N 206 125.519 125.519 127.222 -1.703 18321 2252 1 2 . 1 1 206 206 ALA HA H 206 4.204 4.204 4.102 0.102 18321 2253 1 2 . 1 1 206 206 ALA CA C 206 40.196 40.196 53.071 -12.875 18321 2254 1 2 . 1 1 206 206 ALA CB C 206 19.407 19.407 17.720 1.687 18321 2255 1 2 . 1 1 206 206 ALA H H 206 8.061 8.061 8.407 -0.346 18321 2256 1 2 . 1 1 207 207 TYR N N 207 120.381 120.381 118.340 2.041 18321 2257 1 2 . 1 1 207 207 TYR HA H 207 4.570 4.570 4.410 0.160 18321 2258 1 2 . 1 1 207 207 TYR CA C 207 52.572 52.572 59.539 -6.967 18321 2259 1 2 . 1 1 207 207 TYR CB C 207 41.333 41.333 39.018 2.315 18321 2260 1 2 . 1 1 207 207 TYR H H 207 8.199 8.199 8.077 0.122 18321 2261 1 2 . 1 1 208 208 ALA HA H 208 4.281 4.281 4.547 -0.266 18321 2262 1 2 . 1 1 208 208 ALA C C 208 177.736 177.736 177.399 0.337 18321 2263 1 2 . 1 1 208 208 ALA CA C 208 52.084 52.084 52.904 -0.820 18321 2264 1 2 . 1 1 208 208 ALA CB C 208 18.999 18.999 19.602 -0.603 18321 2265 1 2 . 1 1 209 209 GLN N N 209 119.295 119.295 119.717 -0.422 18321 2266 1 2 . 1 1 209 209 GLN CA C 209 61.474 61.474 53.112 8.362 18321 2267 1 2 . 1 1 209 209 GLN CB C 209 32.039 32.039 28.755 3.284 18321 2268 1 2 . 1 1 209 209 GLN H H 209 8.125 8.125 8.233 -0.108 18321 2269 1 2 . 1 1 210 210 PRO HA H 210 4.395 4.395 4.230 0.165 18321 2270 1 2 . 1 1 210 210 PRO CA C 210 62.584 62.584 63.607 -1.023 18321 2271 1 2 . 1 1 211 211 GLN HA H 211 4.377 4.377 4.099 0.278 18321 2272 1 2 . 1 1 211 211 GLN CA C 211 55.859 55.859 56.430 -0.571 18321 2273 1 2 . 1 1 211 211 GLN CB C 211 29.577 29.577 27.591 1.986 18321 2274 1 2 . 1 1 212 212 THR C C 212 176.551 176.551 174.760 1.791 18321 2275 1 2 . 1 1 212 212 THR CB C 212 69.890 69.890 68.707 1.183 18321 2276 1 2 . 1 1 213 213 THR N N 213 108.487 108.487 117.673 -9.186 18321 2277 1 2 . 1 1 213 213 THR CA C 213 61.236 61.236 64.764 -3.528 18321 2278 1 2 . 1 1 213 213 THR CB C 213 69.091 69.091 69.163 -0.072 18321 2279 1 2 . 1 1 213 213 THR H H 213 8.243 8.243 8.466 -0.223 18321 2280 1 2 . 1 1 214 214 THR N N 214 119.445 119.445 114.821 4.624 18321 2281 1 2 . 1 1 214 214 THR CA C 214 59.425 59.425 60.586 -1.161 18321 2282 1 2 . 1 1 214 214 THR CB C 214 69.251 69.251 71.200 -1.949 18321 2283 1 2 . 1 1 214 214 THR H H 214 8.188 8.188 7.721 0.467 18321 2284 1 2 . 1 1 215 215 PRO HA H 215 4.361 4.361 4.619 -0.258 18321 2285 1 2 . 1 1 215 215 PRO C C 215 175.422 175.422 175.929 -0.507 18321 2286 1 2 . 1 1 215 215 PRO CA C 215 63.320 63.320 62.776 0.544 18321 2287 1 2 . 1 1 215 215 PRO CB C 215 31.918 31.918 32.457 -0.539 18321 2288 1 2 . 1 1 216 216 LEU N N 216 121.602 121.602 125.406 -3.804 18321 2289 1 2 . 1 1 216 216 LEU CA C 216 52.203 52.203 56.576 -4.373 18321 2290 1 2 . 1 1 216 216 LEU CB C 216 42.451 42.451 40.280 2.171 18321 2291 1 2 . 1 1 216 216 LEU H H 216 7.891 7.891 8.531 -0.640 18321 2292 1 2 . 1 1 217 217 PRO HA H 217 4.398 4.398 4.456 -0.058 18321 2293 1 2 . 1 1 217 217 PRO C C 217 176.577 176.577 176.128 0.449 18321 2294 1 2 . 1 1 217 217 PRO CA C 217 62.984 62.984 63.268 -0.284 18321 2295 1 2 . 1 1 217 217 PRO CB C 217 32.056 32.056 32.116 -0.060 18321 2296 1 2 . 1 1 218 218 ALA N N 218 124.087 124.087 125.108 -1.021 18321 2297 1 2 . 1 1 218 218 ALA HA H 218 4.309 4.309 4.549 -0.240 18321 2298 1 2 . 1 1 218 218 ALA C C 218 177.844 177.844 176.428 1.416 18321 2299 1 2 . 1 1 218 218 ALA CA C 218 52.379 52.379 51.311 1.068 18321 2300 1 2 . 1 1 218 218 ALA CB C 218 19.133 19.133 19.360 -0.227 18321 2301 1 2 . 1 1 218 218 ALA H H 218 8.261 8.261 7.924 0.337 18321 2302 1 2 . 1 1 219 219 VAL N N 219 118.942 118.942 119.063 -0.121 18321 2303 1 2 . 1 1 219 219 VAL HA H 219 4.142 4.142 4.410 -0.268 18321 2304 1 2 . 1 1 219 219 VAL CA C 219 62.102 62.102 60.829 1.273 18321 2305 1 2 . 1 1 219 219 VAL CB C 219 32.923 32.923 33.188 -0.265 18321 2306 1 2 . 1 1 219 219 VAL H H 219 8.049 8.049 7.989 0.060 18321 2307 1 2 . 1 1 220 220 SER N N 220 119.207 119.207 117.946 1.261 18321 2308 1 2 . 1 1 220 220 SER HA H 220 4.436 4.436 4.489 -0.053 18321 2309 1 2 . 1 1 220 220 SER CA C 220 57.813 57.813 58.394 -0.581 18321 2310 1 2 . 1 1 220 220 SER CB C 220 63.375 63.375 63.488 -0.113 18321 2311 1 2 . 1 1 220 220 SER H H 220 8.275 8.275 8.473 -0.198 18321 2312 1 2 . 1 1 221 221 GLY N N 221 110.973 110.973 110.842 0.131 18321 2313 1 2 . 1 1 221 221 GLY C C 221 173.962 173.962 174.103 -0.141 18321 2314 1 2 . 1 1 221 221 GLY CA C 221 45.286 45.286 45.458 -0.172 18321 2315 1 2 . 1 1 221 221 GLY H H 221 8.374 8.374 8.228 0.146 18321 2316 1 2 . 1 1 222 222 SER N N 222 115.516 115.516 118.431 -2.915 18321 2317 1 2 . 1 1 222 222 SER HA H 222 4.763 4.763 4.881 -0.118 18321 2318 1 2 . 1 1 222 222 SER CA C 222 56.407 56.407 56.012 0.395 18321 2319 1 2 . 1 1 222 222 SER CB C 222 63.993 63.993 65.091 -1.098 18321 2320 1 2 . 1 1 222 222 SER H H 222 8.155 8.155 7.967 0.188 18321 2321 1 2 . 1 1 223 223 PRO HA H 223 4.417 4.417 4.530 -0.113 18321 2322 1 2 . 1 1 223 223 PRO CA C 223 63.805 63.805 62.727 1.079 18321 2323 1 2 . 1 1 223 223 PRO CB C 223 32.090 32.090 32.521 -0.431 18321 2324 1 2 . 1 1 224 224 GLY N N 224 109.149 109.149 107.857 1.292 18321 2325 1 2 . 1 1 224 224 GLY C C 224 173.813 173.813 174.329 -0.516 18321 2326 1 2 . 1 1 224 224 GLY CA C 224 44.512 44.512 45.400 -0.888 18321 2327 1 2 . 1 1 224 224 GLY H H 224 8.376 8.376 8.430 -0.054 18321 2328 1 2 . 1 1 225 225 ALA N N 225 123.599 123.599 121.843 1.756 18321 2329 1 2 . 1 1 225 225 ALA C C 225 177.341 177.341 176.201 1.140 18321 2330 1 2 . 1 1 225 225 ALA CA C 225 51.878 51.878 51.585 0.293 18321 2331 1 2 . 1 1 225 225 ALA CB C 225 19.169 19.169 20.099 -0.929 18321 2332 1 2 . 1 1 225 225 ALA H H 225 7.959 7.959 7.410 0.549 18321 2333 1 2 . 1 1 226 226 ALA N N 226 123.218 123.218 122.750 0.468 18321 2334 1 2 . 1 1 226 226 ALA HA H 226 4.350 4.350 4.119 0.231 18321 2335 1 2 . 1 1 226 226 ALA C C 226 177.520 177.520 176.687 0.833 18321 2336 1 2 . 1 1 226 226 ALA CA C 226 52.535 52.535 52.654 -0.119 18321 2337 1 2 . 1 1 226 226 ALA CB C 226 19.171 19.171 17.854 1.317 18321 2338 1 2 . 1 1 226 226 ALA H H 226 8.169 8.169 8.274 -0.105 18321 2339 1 2 . 1 1 227 227 ILE N N 227 120.086 120.086 119.414 0.672 18321 2340 1 2 . 1 1 227 227 ILE HA H 227 4.201 4.201 4.008 0.193 18321 2341 1 2 . 1 1 227 227 ILE C C 227 174.814 174.814 175.920 -1.106 18321 2342 1 2 . 1 1 227 227 ILE CA C 227 60.929 60.929 61.557 -0.628 18321 2343 1 2 . 1 1 227 227 ILE CB C 227 38.872 38.872 36.027 2.845 18321 2344 1 2 . 1 1 227 227 ILE H H 227 8.037 8.037 7.939 0.098 18321 2345 1 2 . 1 1 228 228 THR N N 228 117.224 117.224 120.175 -2.951 18321 2346 1 2 . 1 1 228 228 THR HA H 228 4.203 4.203 4.190 0.013 18321 2347 1 2 . 1 1 228 228 THR CA C 228 57.108 57.108 62.465 -5.357 18321 2348 1 2 . 1 1 228 228 THR CB C 228 69.945 69.945 67.804 2.141 18321 2349 1 2 . 1 1 228 228 THR H H 228 7.775 7.775 8.232 -0.457 18321 2350 1 2 . 1 1 229 229 PRO HA H 229 4.750 4.750 4.333 0.417 18321 2351 1 2 . 1 1 229 229 PRO CA C 229 62.480 62.480 64.107 -1.627 18321 2352 1 2 . 1 1 229 229 PRO CB C 229 33.995 33.995 32.239 1.756 18321 2353 1 2 . 1 1 230 230 LEU N N 230 123.629 123.629 114.242 9.387 18321 2354 1 2 . 1 1 230 230 LEU CA C 230 53.076 53.076 52.830 0.246 18321 2355 1 2 . 1 1 230 230 LEU CB C 230 40.608 40.608 41.958 -1.350 18321 2356 1 2 . 1 1 230 230 LEU H H 230 8.453 8.453 7.462 0.991 18321 2357 1 2 . 1 1 231 231 PRO HA H 231 4.412 4.412 4.493 -0.081 18321 2358 1 2 . 1 1 231 231 PRO C C 231 176.571 176.571 176.678 -0.107 18321 2359 1 2 . 1 1 231 231 PRO CA C 231 63.225 63.225 64.314 -1.089 18321 2360 1 2 . 1 1 231 231 PRO CB C 231 31.191 31.191 32.208 -1.017 18321 2361 1 2 . 1 1 232 232 SER N N 232 115.169 115.169 109.914 5.255 18321 2362 1 2 . 1 1 232 232 SER HA H 232 4.450 4.450 4.637 -0.187 18321 2363 1 2 . 1 1 232 232 SER CA C 232 58.604 58.604 58.241 0.363 18321 2364 1 2 . 1 1 232 232 SER CB C 232 63.962 63.962 63.832 0.130 18321 2365 1 2 . 1 1 232 232 SER H H 232 8.280 8.280 7.790 0.490 18321 2366 1 2 . 1 1 233 233 THR N N 233 115.155 115.155 114.542 0.613 18321 2367 1 2 . 1 1 233 233 THR HA H 233 4.351 4.351 4.284 0.067 18321 2368 1 2 . 1 1 233 233 THR C C 233 177.237 177.237 174.348 2.889 18321 2369 1 2 . 1 1 233 233 THR CA C 233 61.939 61.939 62.460 -0.521 18321 2370 1 2 . 1 1 233 233 THR CB C 233 68.986 68.986 69.030 -0.044 18321 2371 1 2 . 1 1 233 233 THR H H 233 8.096 8.096 7.712 0.384 18321 2372 1 2 . 1 1 234 234 GLN N N 234 122.040 122.040 120.981 1.059 18321 2373 1 2 . 1 1 234 234 GLN HA H 234 4.681 4.681 4.079 0.602 18321 2374 1 2 . 1 1 234 234 GLN C C 234 176.177 176.177 174.399 1.778 18321 2375 1 2 . 1 1 234 234 GLN CA C 234 55.861 55.861 56.151 -0.290 18321 2376 1 2 . 1 1 234 234 GLN CB C 234 28.583 28.583 27.570 1.013 18321 2377 1 2 . 1 1 234 234 GLN H H 234 8.256 8.256 8.300 -0.044 18321 2378 1 2 . 1 1 235 235 ASN N N 235 119.506 119.506 122.075 -2.569 18321 2379 1 2 . 1 1 235 235 ASN HA H 235 4.775 4.775 4.889 -0.114 18321 2380 1 2 . 1 1 235 235 ASN C C 235 174.974 174.974 175.331 -0.357 18321 2381 1 2 . 1 1 235 235 ASN CA C 235 53.191 53.191 52.644 0.547 18321 2382 1 2 . 1 1 235 235 ASN CB C 235 38.511 38.511 38.690 -0.179 18321 2383 1 2 . 1 1 235 235 ASN H H 235 8.346 8.346 8.362 -0.016 18321 2384 1 2 . 1 1 236 236 GLY N N 236 109.378 109.378 111.953 -2.575 18321 2385 1 2 . 1 1 236 236 GLY CA C 236 44.023 44.023 44.125 -0.102 18321 2386 1 2 . 1 1 236 236 GLY H H 236 7.939 7.939 8.258 -0.319 18321 2387 1 2 . 1 1 237 237 PRO HA H 237 4.336 4.336 4.182 0.154 18321 2388 1 2 . 1 1 237 237 PRO C C 237 175.942 175.942 175.495 0.447 18321 2389 1 2 . 1 1 237 237 PRO CA C 237 62.797 62.797 62.290 0.507 18321 2390 1 2 . 1 1 237 237 PRO CB C 237 27.421 27.421 32.333 -4.912 18321 2391 1 2 . 1 1 238 238 VAL N N 238 120.535 120.535 120.572 -0.037 18321 2392 1 2 . 1 1 238 238 VAL HA H 238 4.195 4.195 3.994 0.201 18321 2393 1 2 . 1 1 238 238 VAL C C 238 173.775 173.775 174.904 -1.129 18321 2394 1 2 . 1 1 238 238 VAL CA C 238 61.173 61.173 62.270 -1.097 18321 2395 1 2 . 1 1 238 238 VAL CB C 238 38.328 38.328 32.252 6.076 18321 2396 1 2 . 1 1 238 238 VAL H H 238 7.986 7.986 8.212 -0.226 18321 2397 1 2 . 1 1 239 239 PHE N N 239 123.522 123.522 127.348 -3.826 18321 2398 1 2 . 1 1 239 239 PHE HA H 239 5.539 5.539 5.171 0.368 18321 2399 1 2 . 1 1 239 239 PHE C C 239 174.207 174.207 175.085 -0.878 18321 2400 1 2 . 1 1 239 239 PHE CA C 239 56.993 56.993 56.566 0.427 18321 2401 1 2 . 1 1 239 239 PHE CB C 239 41.743 41.743 40.078 1.665 18321 2402 1 2 . 1 1 239 239 PHE H H 239 8.927 8.927 8.659 0.268 18321 2403 1 2 . 1 1 240 240 ALA N N 240 120.871 120.871 126.926 -6.055 18321 2404 1 2 . 1 1 240 240 ALA HA H 240 5.352 5.352 5.410 -0.058 18321 2405 1 2 . 1 1 240 240 ALA C C 240 174.639 174.639 175.703 -1.064 18321 2406 1 2 . 1 1 240 240 ALA CA C 240 49.736 49.736 50.298 -0.562 18321 2407 1 2 . 1 1 240 240 ALA CB C 240 23.480 23.480 22.264 1.216 18321 2408 1 2 . 1 1 240 240 ALA H H 240 9.398 9.398 9.086 0.312 18321 2409 1 2 . 1 1 241 241 LYS N N 241 121.227 121.227 124.956 -3.729 18321 2410 1 2 . 1 1 241 241 LYS HA H 241 5.373 5.373 4.808 0.565 18321 2411 1 2 . 1 1 241 241 LYS C C 241 176.772 176.772 175.878 0.894 18321 2412 1 2 . 1 1 241 241 LYS CA C 241 53.128 53.128 54.897 -1.769 18321 2413 1 2 . 1 1 241 241 LYS CB C 241 34.850 34.850 34.065 0.785 18321 2414 1 2 . 1 1 241 241 LYS H H 241 8.947 8.947 8.669 0.278 18321 2415 1 2 . 1 1 242 242 ALA N N 242 126.833 126.833 130.231 -3.398 18321 2416 1 2 . 1 1 242 242 ALA HA H 242 4.764 4.764 4.593 0.171 18321 2417 1 2 . 1 1 242 242 ALA C C 242 178.506 178.506 177.363 1.143 18321 2418 1 2 . 1 1 242 242 ALA CA C 242 52.788 52.788 51.925 0.863 18321 2419 1 2 . 1 1 242 242 ALA CB C 242 19.084 19.084 18.789 0.295 18321 2420 1 2 . 1 1 242 242 ALA H H 242 9.373 9.373 8.793 0.580 18321 2421 1 2 . 1 1 243 243 ILE N N 243 118.731 118.731 119.804 -1.073 18321 2422 1 2 . 1 1 243 243 ILE HA H 243 4.454 4.454 4.267 0.187 18321 2423 1 2 . 1 1 243 243 ILE C C 243 174.773 174.773 175.841 -1.068 18321 2424 1 2 . 1 1 243 243 ILE CA C 243 60.613 60.613 60.888 -0.275 18321 2425 1 2 . 1 1 243 243 ILE CB C 243 39.232 39.232 38.325 0.907 18321 2426 1 2 . 1 1 243 243 ILE H H 243 8.933 8.933 8.120 0.813 18321 2427 1 2 . 1 1 244 244 GLN N N 244 121.616 121.616 120.299 1.317 18321 2428 1 2 . 1 1 244 244 GLN HA H 244 4.283 4.283 4.469 -0.186 18321 2429 1 2 . 1 1 244 244 GLN C C 244 172.815 172.815 175.332 -2.517 18321 2430 1 2 . 1 1 244 244 GLN CA C 244 54.750 54.750 53.933 0.817 18321 2431 1 2 . 1 1 244 244 GLN CB C 244 31.469 31.469 32.300 -0.831 18321 2432 1 2 . 1 1 244 244 GLN H H 244 7.438 7.438 7.776 -0.338 18321 2433 1 2 . 1 1 245 245 LYS N N 245 124.215 124.215 123.958 0.257 18321 2434 1 2 . 1 1 245 245 LYS HA H 245 3.962 3.962 4.316 -0.354 18321 2435 1 2 . 1 1 245 245 LYS C C 245 175.679 175.679 176.394 -0.715 18321 2436 1 2 . 1 1 245 245 LYS CA C 245 56.413 56.413 57.944 -1.531 18321 2437 1 2 . 1 1 245 245 LYS CB C 245 32.847 32.847 33.013 -0.166 18321 2438 1 2 . 1 1 245 245 LYS H H 245 8.318 8.318 8.533 -0.215 18321 2439 1 2 . 1 1 246 246 ARG N N 246 127.327 127.327 123.339 3.988 18321 2440 1 2 . 1 1 246 246 ARG HA H 246 4.221 4.221 4.610 -0.389 18321 2441 1 2 . 1 1 246 246 ARG CA C 246 56.279 56.279 55.065 1.214 18321 2442 1 2 . 1 1 246 246 ARG CB C 246 32.987 32.987 31.256 1.731 18321 2443 1 2 . 1 1 246 246 ARG H H 246 9.248 9.248 8.869 0.379 18321 2444 1 2 . 1 1 249 249 CYS HA H 249 4.260 4.260 4.242 0.018 18321 2445 1 2 . 1 1 249 249 CYS CA C 249 55.886 55.886 57.288 -1.402 18321 2446 1 2 . 1 1 249 249 CYS CB C 249 34.146 34.146 28.940 5.206 18321 2447 1 2 . 1 1 250 250 ALA HA H 250 3.926 3.926 4.076 -0.150 18321 2448 1 2 . 1 1 250 250 ALA CA C 250 54.344 54.344 54.377 -0.033 18321 2449 1 2 . 1 1 250 250 ALA CB C 250 18.342 18.342 18.506 -0.164 18321 2450 1 2 . 1 1 251 251 TYR N N 251 110.618 110.618 111.725 -1.107 18321 2451 1 2 . 1 1 251 251 TYR HA H 251 4.489 4.489 4.679 -0.190 18321 2452 1 2 . 1 1 251 251 TYR C C 251 175.286 175.286 175.038 0.248 18321 2453 1 2 . 1 1 251 251 TYR CA C 251 56.137 56.137 54.908 1.229 18321 2454 1 2 . 1 1 251 251 TYR CB C 251 37.203 37.203 38.034 -0.831 18321 2455 1 2 . 1 1 251 251 TYR H H 251 7.037 7.037 7.078 -0.041 18321 2456 1 2 . 1 1 252 252 ASP N N 252 121.835 121.835 122.506 -0.671 18321 2457 1 2 . 1 1 252 252 ASP HA H 252 4.763 4.763 4.774 -0.011 18321 2458 1 2 . 1 1 252 252 ASP CA C 252 52.351 52.351 55.210 -2.859 18321 2459 1 2 . 1 1 252 252 ASP CB C 252 39.995 39.995 40.657 -0.662 18321 2460 1 2 . 1 1 252 252 ASP H H 252 7.339 7.339 7.357 -0.018 18321 2461 1 2 . 1 1 253 253 LYS N N 253 123.177 123.177 123.836 -0.659 18321 2462 1 2 . 1 1 253 253 LYS HA H 253 4.270 4.270 4.376 -0.106 18321 2463 1 2 . 1 1 253 253 LYS C C 253 177.724 177.724 177.522 0.202 18321 2464 1 2 . 1 1 253 253 LYS CA C 253 57.036 57.036 57.711 -0.675 18321 2465 1 2 . 1 1 253 253 LYS H H 253 8.396 8.396 8.338 0.058 18321 2466 1 2 . 1 1 254 254 THR N N 254 108.317 108.317 112.543 -4.226 18321 2467 1 2 . 1 1 254 254 THR HA H 254 4.517 4.517 4.370 0.147 18321 2468 1 2 . 1 1 254 254 THR C C 254 174.012 174.012 173.672 0.340 18321 2469 1 2 . 1 1 254 254 THR CA C 254 61.036 61.036 61.888 -0.852 18321 2470 1 2 . 1 1 254 254 THR CB C 254 69.307 69.307 68.466 0.841 18321 2471 1 2 . 1 1 254 254 THR H H 254 8.217 8.217 8.177 0.040 18321 2472 1 2 . 1 1 255 255 ALA N N 255 124.762 124.762 124.323 0.439 18321 2473 1 2 . 1 1 255 255 ALA HA H 255 4.524 4.524 4.931 -0.407 18321 2474 1 2 . 1 1 255 255 ALA C C 255 176.630 176.630 175.697 0.933 18321 2475 1 2 . 1 1 255 255 ALA CA C 255 51.352 51.352 50.597 0.755 18321 2476 1 2 . 1 1 255 255 ALA CB C 255 20.135 20.135 20.572 -0.437 18321 2477 1 2 . 1 1 255 255 ALA H H 255 7.096 7.096 7.643 -0.547 18321 2478 1 2 . 1 1 256 256 LEU N N 256 124.379 124.379 124.115 0.264 18321 2479 1 2 . 1 1 256 256 LEU HA H 256 4.328 4.328 4.579 -0.251 18321 2480 1 2 . 1 1 256 256 LEU C C 256 176.007 176.007 175.663 0.344 18321 2481 1 2 . 1 1 256 256 LEU CA C 256 53.502 53.502 54.054 -0.552 18321 2482 1 2 . 1 1 256 256 LEU CB C 256 44.665 44.665 44.181 0.484 18321 2483 1 2 . 1 1 256 256 LEU H H 256 8.889 8.889 7.955 0.934 18321 2484 1 2 . 1 1 257 257 ALA N N 257 129.619 129.619 128.214 1.405 18321 2485 1 2 . 1 1 257 257 ALA HA H 257 4.445 4.445 4.949 -0.504 18321 2486 1 2 . 1 1 257 257 ALA C C 257 176.813 176.813 176.594 0.219 18321 2487 1 2 . 1 1 257 257 ALA CA C 257 51.179 51.179 51.074 0.105 18321 2488 1 2 . 1 1 257 257 ALA CB C 257 18.973 18.973 19.147 -0.174 18321 2489 1 2 . 1 1 257 257 ALA H H 257 8.529 8.529 8.297 0.232 18321 2490 1 2 . 1 1 258 258 LEU N N 258 119.300 119.300 125.272 -5.972 18321 2491 1 2 . 1 1 258 258 LEU HA H 258 4.782 4.782 4.636 0.146 18321 2492 1 2 . 1 1 258 258 LEU CA C 258 53.259 53.259 53.997 -0.738 18321 2493 1 2 . 1 1 258 258 LEU CB C 258 45.972 45.972 44.737 1.235 18321 2494 1 2 . 1 1 258 258 LEU H H 258 8.505 8.505 8.731 -0.226 18321 2495 1 2 . 1 1 259 259 GLU N N 259 123.919 123.919 121.919 2.000 18321 2496 1 2 . 1 1 259 259 GLU HA H 259 4.516 4.516 4.490 0.026 18321 2497 1 2 . 1 1 259 259 GLU C C 259 175.795 175.795 174.982 0.813 18321 2498 1 2 . 1 1 259 259 GLU CA C 259 52.896 52.896 53.888 -0.992 18321 2499 1 2 . 1 1 259 259 GLU H H 259 8.943 8.943 8.550 0.393 18321 2500 1 2 . 1 1 260 260 VAL N N 260 122.122 122.122 124.117 -1.995 18321 2501 1 2 . 1 1 260 260 VAL HA H 260 2.923 2.923 4.231 -1.308 18321 2502 1 2 . 1 1 260 260 VAL C C 260 177.964 177.964 177.305 0.659 18321 2503 1 2 . 1 1 260 260 VAL CA C 260 65.417 65.417 63.878 1.539 18321 2504 1 2 . 1 1 260 260 VAL CB C 260 30.668 30.668 31.100 -0.432 18321 2505 1 2 . 1 1 260 260 VAL H H 260 8.956 8.956 8.559 0.397 18321 2506 1 2 . 1 1 261 261 GLY N N 261 116.009 116.009 116.858 -0.849 18321 2507 1 2 . 1 1 261 261 GLY C C 261 176.288 176.288 173.571 2.717 18321 2508 1 2 . 1 1 261 261 GLY CA C 261 44.210 44.210 44.555 -0.345 18321 2509 1 2 . 1 1 261 261 GLY H H 261 8.799 8.799 8.984 -0.185 18321 2510 1 2 . 1 1 262 262 ASP N N 262 121.945 121.945 120.110 1.835 18321 2511 1 2 . 1 1 262 262 ASP HA H 262 4.423 4.423 5.015 -0.592 18321 2512 1 2 . 1 1 262 262 ASP C C 262 175.381 175.381 174.954 0.427 18321 2513 1 2 . 1 1 262 262 ASP CA C 262 55.243 55.243 52.420 2.823 18321 2514 1 2 . 1 1 262 262 ASP CB C 262 41.819 41.819 43.451 -1.632 18321 2515 1 2 . 1 1 262 262 ASP H H 262 8.180 8.180 7.763 0.417 18321 2516 1 2 . 1 1 263 263 ILE N N 263 121.452 121.452 121.370 0.082 18321 2517 1 2 . 1 1 263 263 ILE HA H 263 4.707 4.707 4.598 0.109 18321 2518 1 2 . 1 1 263 263 ILE C C 263 174.996 174.996 175.847 -0.851 18321 2519 1 2 . 1 1 263 263 ILE CA C 263 59.289 59.289 59.205 0.084 18321 2520 1 2 . 1 1 263 263 ILE CB C 263 36.987 36.987 38.501 -1.514 18321 2521 1 2 . 1 1 263 263 ILE H H 263 8.460 8.460 8.360 0.100 18321 2522 1 2 . 1 1 264 264 VAL N N 264 128.756 128.756 129.222 -0.466 18321 2523 1 2 . 1 1 264 264 VAL HA H 264 4.309 4.309 4.124 0.185 18321 2524 1 2 . 1 1 264 264 VAL C C 264 175.486 175.486 174.864 0.622 18321 2525 1 2 . 1 1 264 264 VAL CA C 264 59.091 59.091 61.444 -2.353 18321 2526 1 2 . 1 1 264 264 VAL CB C 264 34.541 34.541 31.852 2.689 18321 2527 1 2 . 1 1 264 264 VAL H H 264 9.479 9.479 9.349 0.130 18321 2528 1 2 . 1 1 265 265 LYS N N 265 128.101 128.101 130.055 -1.954 18321 2529 1 2 . 1 1 265 265 LYS HA H 265 4.342 4.342 4.491 -0.149 18321 2530 1 2 . 1 1 265 265 LYS C C 265 175.531 175.531 175.288 0.243 18321 2531 1 2 . 1 1 265 265 LYS CA C 265 55.620 55.620 55.739 -0.119 18321 2532 1 2 . 1 1 265 265 LYS CB C 265 33.149 33.149 32.433 0.716 18321 2533 1 2 . 1 1 265 265 LYS H H 265 8.715 8.715 8.769 -0.054 18321 2534 1 2 . 1 1 266 266 VAL N N 266 129.537 129.537 127.687 1.850 18321 2535 1 2 . 1 1 266 266 VAL HA H 266 4.333 4.333 4.404 -0.071 18321 2536 1 2 . 1 1 266 266 VAL C C 266 176.166 176.166 174.611 1.555 18321 2537 1 2 . 1 1 266 266 VAL CA C 266 63.339 63.339 61.087 2.252 18321 2538 1 2 . 1 1 266 266 VAL CB C 266 30.712 30.712 34.474 -3.762 18321 2539 1 2 . 1 1 266 266 VAL H H 266 9.073 9.073 8.471 0.602 18321 2540 1 2 . 1 1 267 267 THR N N 267 120.020 120.020 122.776 -2.756 18321 2541 1 2 . 1 1 267 267 THR HA H 267 4.189 4.189 4.428 -0.239 18321 2542 1 2 . 1 1 267 267 THR C C 267 176.054 176.054 175.025 1.029 18321 2543 1 2 . 1 1 267 267 THR CA C 267 62.204 62.204 63.069 -0.865 18321 2544 1 2 . 1 1 267 267 THR CB C 267 68.200 68.200 69.748 -1.548 18321 2545 1 2 . 1 1 267 267 THR H H 267 9.130 9.130 8.344 0.786 18321 2546 1 2 . 1 1 268 268 ARG N N 268 120.839 120.839 124.369 -3.530 18321 2547 1 2 . 1 1 268 268 ARG HA H 268 4.236 4.236 4.576 -0.340 18321 2548 1 2 . 1 1 268 268 ARG CA C 268 56.321 56.321 54.480 1.841 18321 2549 1 2 . 1 1 268 268 ARG CB C 268 33.049 33.049 29.765 3.284 18321 2550 1 2 . 1 1 268 268 ARG H H 268 7.631 7.631 7.637 -0.006 18321 2551 1 2 . 1 1 269 269 MET N N 269 125.443 125.443 125.579 -0.136 18321 2552 1 2 . 1 1 269 269 MET C C 269 174.392 174.392 175.422 -1.030 18321 2553 1 2 . 1 1 269 269 MET H H 269 8.532 8.532 8.548 -0.016 18321 2554 1 2 . 1 1 270 270 ASN N N 270 119.125 119.125 123.750 -4.625 18321 2555 1 2 . 1 1 270 270 ASN HA H 270 4.546 4.546 4.754 -0.208 18321 2556 1 2 . 1 1 270 270 ASN C C 270 172.133 172.133 176.321 -4.188 18321 2557 1 2 . 1 1 270 270 ASN CA C 270 53.639 53.639 53.993 -0.354 18321 2558 1 2 . 1 1 270 270 ASN CB C 270 39.845 39.845 38.662 1.183 18321 2559 1 2 . 1 1 270 270 ASN H H 270 6.631 6.631 9.245 -2.614 18321 2560 1 2 . 1 1 271 271 ILE N N 271 122.532 122.532 115.105 7.427 18321 2561 1 2 . 1 1 271 271 ILE HA H 271 4.417 4.417 3.671 0.746 18321 2562 1 2 . 1 1 271 271 ILE CA C 271 63.348 63.348 64.146 -0.798 18321 2563 1 2 . 1 1 271 271 ILE CB C 271 38.198 38.198 35.874 2.324 18321 2564 1 2 . 1 1 271 271 ILE H H 271 8.565 8.565 8.387 0.178 18321 2565 1 2 . 1 1 272 272 ASN HA H 272 4.527 4.527 4.578 -0.051 18321 2566 1 2 . 1 1 272 272 ASN C C 272 176.259 176.259 176.430 -0.171 18321 2567 1 2 . 1 1 272 272 ASN CA C 272 53.225 53.225 55.421 -2.196 18321 2568 1 2 . 1 1 272 272 ASN CB C 272 37.565 37.565 38.970 -1.405 18321 2569 1 2 . 1 1 273 273 GLY N N 273 107.043 107.043 104.089 2.954 18321 2570 1 2 . 1 1 273 273 GLY C C 273 173.216 173.216 173.128 0.088 18321 2571 1 2 . 1 1 273 273 GLY CA C 273 45.299 45.299 45.162 0.137 18321 2572 1 2 . 1 1 273 273 GLY H H 273 8.086 8.086 7.895 0.191 18321 2573 1 2 . 1 1 274 274 GLN N N 274 120.624 120.624 122.343 -1.719 18321 2574 1 2 . 1 1 274 274 GLN HA H 274 4.551 4.551 4.590 -0.039 18321 2575 1 2 . 1 1 274 274 GLN C C 274 175.039 175.039 175.588 -0.549 18321 2576 1 2 . 1 1 274 274 GLN CA C 274 54.556 54.556 55.663 -1.107 18321 2577 1 2 . 1 1 274 274 GLN CB C 274 33.698 33.698 28.697 5.001 18321 2578 1 2 . 1 1 274 274 GLN H H 274 8.045 8.045 7.847 0.198 18321 2579 1 2 . 1 1 275 275 TRP N N 275 125.596 125.596 125.197 0.399 18321 2580 1 2 . 1 1 275 275 TRP HA H 275 4.588 4.588 4.669 -0.081 18321 2581 1 2 . 1 1 275 275 TRP C C 275 172.832 172.832 175.589 -2.757 18321 2582 1 2 . 1 1 275 275 TRP CA C 275 55.296 55.296 53.841 1.455 18321 2583 1 2 . 1 1 275 275 TRP CB C 275 31.393 31.393 30.558 0.835 18321 2584 1 2 . 1 1 275 275 TRP H H 275 8.484 8.484 8.596 -0.112 18321 2585 1 2 . 1 1 276 276 GLU N N 276 119.012 119.012 121.953 -2.941 18321 2586 1 2 . 1 1 276 276 GLU HA H 276 5.190 5.190 5.528 -0.338 18321 2587 1 2 . 1 1 276 276 GLU C C 276 176.553 176.553 175.985 0.568 18321 2588 1 2 . 1 1 276 276 GLU CA C 276 54.288 54.288 54.909 -0.621 18321 2589 1 2 . 1 1 276 276 GLU CB C 276 32.851 32.851 32.120 0.731 18321 2590 1 2 . 1 1 276 276 GLU H H 276 8.643 8.643 8.958 -0.315 18321 2591 1 2 . 1 1 277 277 GLY N N 277 111.364 111.364 112.714 -1.350 18321 2592 1 2 . 1 1 277 277 GLY C C 277 170.707 170.707 172.103 -1.396 18321 2593 1 2 . 1 1 277 277 GLY CA C 277 46.723 46.723 43.861 2.862 18321 2594 1 2 . 1 1 277 277 GLY H H 277 9.072 9.072 8.661 0.411 18321 2595 1 2 . 1 1 278 278 GLU N N 278 117.733 117.733 121.855 -4.122 18321 2596 1 2 . 1 1 278 278 GLU HA H 278 5.748 5.748 5.094 0.654 18321 2597 1 2 . 1 1 278 278 GLU C C 278 176.051 176.051 175.128 0.923 18321 2598 1 2 . 1 1 278 278 GLU CA C 278 53.620 53.620 54.992 -1.372 18321 2599 1 2 . 1 1 278 278 GLU CB C 278 33.742 33.742 32.362 1.380 18321 2600 1 2 . 1 1 278 278 GLU H H 278 8.810 8.810 8.350 0.460 18321 2601 1 2 . 1 1 279 279 VAL N N 279 123.834 123.834 126.437 -2.603 18321 2602 1 2 . 1 1 279 279 VAL HA H 279 4.404 4.404 4.412 -0.008 18321 2603 1 2 . 1 1 279 279 VAL C C 279 175.289 175.289 175.209 0.080 18321 2604 1 2 . 1 1 279 279 VAL CA C 279 61.166 61.166 61.146 0.020 18321 2605 1 2 . 1 1 279 279 VAL CB C 279 34.123 34.123 34.984 -0.862 18321 2606 1 2 . 1 1 279 279 VAL H H 279 8.887 8.887 9.167 -0.280 18321 2607 1 2 . 1 1 280 280 ASN N N 280 126.025 126.025 126.679 -0.654 18321 2608 1 2 . 1 1 280 280 ASN HA H 280 4.435 4.435 4.439 -0.004 18321 2609 1 2 . 1 1 280 280 ASN C C 280 175.205 175.205 175.640 -0.435 18321 2610 1 2 . 1 1 280 280 ASN CA C 280 45.615 45.615 53.785 -8.170 18321 2611 1 2 . 1 1 280 280 ASN CB C 280 37.386 37.386 37.499 -0.113 18321 2612 1 2 . 1 1 280 280 ASN H H 280 9.322 9.322 9.305 0.017 18321 2613 1 2 . 1 1 281 281 GLY N N 281 104.588 104.588 102.775 1.813 18321 2614 1 2 . 1 1 281 281 GLY C C 281 173.944 173.944 173.796 0.148 18321 2615 1 2 . 1 1 281 281 GLY CA C 281 45.224 45.224 45.033 0.191 18321 2616 1 2 . 1 1 281 281 GLY H H 281 8.768 8.768 8.365 0.403 18321 2617 1 2 . 1 1 282 282 ARG N N 282 122.567 122.567 122.977 -0.410 18321 2618 1 2 . 1 1 282 282 ARG HA H 282 4.559 4.559 4.547 0.012 18321 2619 1 2 . 1 1 282 282 ARG C C 282 174.350 174.350 174.477 -0.127 18321 2620 1 2 . 1 1 282 282 ARG CA C 282 54.933 54.933 55.130 -0.197 18321 2621 1 2 . 1 1 282 282 ARG CB C 282 31.765 31.765 31.945 -0.180 18321 2622 1 2 . 1 1 282 282 ARG H H 282 8.149 8.149 7.858 0.291 18321 2623 1 2 . 1 1 283 283 LYS N N 283 121.565 121.565 124.097 -2.532 18321 2624 1 2 . 1 1 283 283 LYS HA H 283 5.584 5.584 5.587 -0.003 18321 2625 1 2 . 1 1 283 283 LYS CA C 283 54.143 54.143 54.704 -0.561 18321 2626 1 2 . 1 1 283 283 LYS CB C 283 36.040 36.040 34.805 1.235 18321 2627 1 2 . 1 1 283 283 LYS H H 283 8.424 8.424 8.610 -0.186 18321 2628 1 2 . 1 1 284 284 GLY C C 284 173.006 173.006 172.623 0.383 18321 2629 1 2 . 1 1 284 284 GLY CA C 284 45.886 45.886 45.118 0.768 18321 2630 1 2 . 1 1 285 285 LEU N N 285 119.673 119.673 121.644 -1.971 18321 2631 1 2 . 1 1 285 285 LEU HA H 285 5.718 5.718 5.545 0.173 18321 2632 1 2 . 1 1 285 285 LEU C C 285 178.657 178.657 176.459 2.198 18321 2633 1 2 . 1 1 285 285 LEU CA C 285 53.656 53.656 54.115 -0.459 18321 2634 1 2 . 1 1 285 285 LEU CB C 285 44.813 44.813 43.309 1.504 18321 2635 1 2 . 1 1 285 285 LEU H H 285 8.734 8.734 8.798 -0.064 18321 2636 1 2 . 1 1 286 286 PHE N N 286 118.785 118.785 120.711 -1.926 18321 2637 1 2 . 1 1 286 286 PHE HA H 286 4.521 4.521 5.106 -0.585 18321 2638 1 2 . 1 1 286 286 PHE CA C 286 57.592 57.592 54.430 3.162 18321 2639 1 2 . 1 1 286 286 PHE CB C 286 40.669 40.669 39.853 0.816 18321 2640 1 2 . 1 1 286 286 PHE H H 286 9.120 9.120 8.859 0.261 18321 2641 1 2 . 1 1 287 287 PRO HA H 287 4.385 4.385 4.691 -0.306 18321 2642 1 2 . 1 1 287 287 PRO CA C 287 62.814 62.814 62.060 0.754 18321 2643 1 2 . 1 1 287 287 PRO CB C 287 32.133 32.133 31.943 0.190 18321 2644 1 2 . 1 1 288 288 PHE C C 288 174.837 174.837 174.900 -0.063 18321 2645 1 2 . 1 1 288 288 PHE CA C 288 59.020 59.020 58.308 0.712 18321 2646 1 2 . 1 1 288 288 PHE CB C 288 34.987 34.987 37.172 -2.185 18321 2647 1 2 . 1 1 289 289 THR N N 289 107.865 107.865 108.022 -0.157 18321 2648 1 2 . 1 1 289 289 THR HA H 289 3.589 3.589 3.922 -0.333 18321 2649 1 2 . 1 1 289 289 THR C C 289 176.125 176.125 175.025 1.100 18321 2650 1 2 . 1 1 289 289 THR CA C 289 62.243 62.243 62.490 -0.247 18321 2651 1 2 . 1 1 289 289 THR CB C 289 69.365 69.365 68.675 0.690 18321 2652 1 2 . 1 1 289 289 THR H H 289 6.453 6.453 7.444 -0.991 18321 2653 1 2 . 1 1 290 290 HIS N N 290 119.462 119.462 118.861 0.601 18321 2654 1 2 . 1 1 290 290 HIS HA H 290 4.196 4.196 4.780 -0.584 18321 2655 1 2 . 1 1 290 290 HIS C C 290 175.165 175.165 173.828 1.337 18321 2656 1 2 . 1 1 290 290 HIS CA C 290 57.635 57.635 57.242 0.393 18321 2657 1 2 . 1 1 290 290 HIS CB C 290 29.840 29.840 31.901 -2.061 18321 2658 1 2 . 1 1 290 290 HIS H H 290 7.835 7.835 7.818 0.017 18321 2659 1 2 . 1 1 291 291 VAL N N 291 110.050 110.050 113.253 -3.203 18321 2660 1 2 . 1 1 291 291 VAL HA H 291 5.445 5.445 5.162 0.283 18321 2661 1 2 . 1 1 291 291 VAL C C 291 173.386 173.386 174.857 -1.471 18321 2662 1 2 . 1 1 291 291 VAL CA C 291 57.794 57.794 59.049 -1.255 18321 2663 1 2 . 1 1 291 291 VAL CB C 291 35.784 35.784 35.173 0.611 18321 2664 1 2 . 1 1 291 291 VAL H H 291 7.562 7.562 7.352 0.210 18321 2665 1 2 . 1 1 292 292 LYS N N 292 119.445 119.445 121.035 -1.590 18321 2666 1 2 . 1 1 292 292 LYS HA H 292 4.857 4.857 4.806 0.051 18321 2667 1 2 . 1 1 292 292 LYS C C 292 176.512 176.512 175.495 1.017 18321 2668 1 2 . 1 1 292 292 LYS CA C 292 54.647 54.647 54.790 -0.143 18321 2669 1 2 . 1 1 292 292 LYS CB C 292 35.665 35.665 36.779 -1.115 18321 2670 1 2 . 1 1 292 292 LYS H H 292 8.753 8.753 8.286 0.467 18321 2671 1 2 . 1 1 293 293 ILE N N 293 128.707 128.707 123.970 4.737 18321 2672 1 2 . 1 1 293 293 ILE HA H 293 4.509 4.509 4.414 0.095 18321 2673 1 2 . 1 1 293 293 ILE C C 293 175.666 175.666 176.654 -0.988 18321 2674 1 2 . 1 1 293 293 ILE CA C 293 62.563 62.563 62.585 -0.022 18321 2675 1 2 . 1 1 293 293 ILE CB C 293 38.076 38.076 38.528 -0.452 18321 2676 1 2 . 1 1 293 293 ILE H H 293 9.107 9.107 8.793 0.314 18321 2677 1 2 . 1 1 294 294 PHE N N 294 126.638 126.638 126.814 -0.176 18321 2678 1 2 . 1 1 294 294 PHE HA H 294 4.898 4.898 4.919 -0.021 18321 2679 1 2 . 1 1 294 294 PHE C C 294 175.838 175.838 174.075 1.763 18321 2680 1 2 . 1 1 294 294 PHE CA C 294 56.335 56.335 56.178 0.157 18321 2681 1 2 . 1 1 294 294 PHE CB C 294 41.196 41.196 40.704 0.492 18321 2682 1 2 . 1 1 294 294 PHE H H 294 8.716 8.716 8.447 0.269 18321 2683 1 2 . 1 1 295 295 ASP N N 295 122.961 122.961 121.674 1.287 18321 2684 1 2 . 1 1 295 295 ASP HA H 295 5.003 5.003 4.730 0.273 18321 2685 1 2 . 1 1 295 295 ASP CA C 295 50.602 50.602 52.537 -1.935 18321 2686 1 2 . 1 1 295 295 ASP CB C 295 40.754 40.754 41.181 -0.427 18321 2687 1 2 . 1 1 295 295 ASP H H 295 8.418 8.418 8.680 -0.262 18321 2688 1 2 . 1 1 296 296 PRO HA H 296 4.524 4.524 4.167 0.357 18321 2689 1 2 . 1 1 296 296 PRO C C 296 176.807 176.807 177.099 -0.292 18321 2690 1 2 . 1 1 296 296 PRO CA C 296 62.987 62.987 64.448 -1.460 18321 2691 1 2 . 1 1 296 296 PRO CB C 296 32.033 32.033 32.015 0.018 18321 2692 1 2 . 1 1 297 297 GLN N N 297 120.729 120.729 115.733 4.996 18321 2693 1 2 . 1 1 297 297 GLN HA H 297 4.274 4.274 4.140 0.134 18321 2694 1 2 . 1 1 297 297 GLN CA C 297 56.427 56.427 55.131 1.296 18321 2695 1 2 . 1 1 297 297 GLN CB C 297 28.819 28.819 29.043 -0.224 18321 2696 1 2 . 1 1 297 297 GLN H H 297 8.551 8.551 8.050 0.501 18321 2697 1 2 . 1 1 299 299 PRO C C 299 176.936 176.936 175.173 1.763 18321 2698 1 2 . 1 1 299 299 PRO CA C 299 63.406 63.406 63.090 0.316 18321 2699 1 2 . 1 1 299 299 PRO CB C 299 31.421 31.421 32.118 -0.697 18321 2700 1 2 . 1 1 300 300 ASP N N 300 119.609 119.609 119.198 0.411 18321 2701 1 2 . 1 1 300 300 ASP C C 300 176.344 176.344 175.634 0.710 18321 2702 1 2 . 1 1 300 300 ASP CA C 300 54.178 54.178 53.275 0.903 18321 2703 1 2 . 1 1 300 300 ASP CB C 300 40.661 40.661 42.289 -1.628 18321 2704 1 2 . 1 1 300 300 ASP H H 300 8.239 8.239 7.599 0.640 18321 2705 1 2 . 1 1 301 301 GLU N N 301 120.462 120.462 118.163 2.299 18321 2706 1 2 . 1 1 301 301 GLU CA C 301 56.188 56.188 57.702 -1.514 18321 2707 1 2 . 1 1 301 301 GLU CB C 301 29.507 29.507 29.132 0.375 18321 2708 1 2 . 1 1 301 301 GLU H H 301 8.084 8.084 8.618 -0.534 18321 2709 1 3 . 1 1 2 2 SER HA H 2 4.521 4.521 4.505 0.016 18321 2710 1 3 . 1 1 2 2 SER CA C 2 58.326 58.326 58.001 0.325 18321 2711 1 3 . 1 1 2 2 SER CB C 2 64.062 64.062 64.175 -0.114 18321 2712 1 3 . 1 1 3 3 SER HA H 3 4.465 4.465 4.326 0.139 18321 2713 1 3 . 1 1 3 3 SER C C 3 173.887 173.887 174.558 -0.671 18321 2714 1 3 . 1 1 3 3 SER CA C 3 58.374 58.374 59.657 -1.283 18321 2715 1 3 . 1 1 3 3 SER CB C 3 63.920 63.920 63.602 0.318 18321 2716 1 3 . 1 1 4 4 ALA N N 4 124.755 124.755 125.218 -0.463 18321 2717 1 3 . 1 1 4 4 ALA HA H 4 4.547 4.547 4.565 -0.018 18321 2718 1 3 . 1 1 4 4 ALA CA C 4 52.737 52.737 52.247 0.490 18321 2719 1 3 . 1 1 4 4 ALA CB C 4 19.636 19.636 18.428 1.208 18321 2720 1 3 . 1 1 4 4 ALA H H 4 8.244 8.244 7.381 0.863 18321 2721 1 3 . 1 1 5 5 ARG N N 5 120.383 120.383 124.335 -3.952 18321 2722 1 3 . 1 1 5 5 ARG HA H 5 4.524 4.524 4.759 -0.235 18321 2723 1 3 . 1 1 5 5 ARG C C 5 175.611 175.611 174.703 0.908 18321 2724 1 3 . 1 1 5 5 ARG CA C 5 56.082 56.082 55.108 0.974 18321 2725 1 3 . 1 1 5 5 ARG CB C 5 30.695 30.695 29.718 0.977 18321 2726 1 3 . 1 1 5 5 ARG H H 5 8.727 8.727 8.275 0.452 18321 2727 1 3 . 1 1 6 6 PHE N N 6 115.159 115.159 121.273 -6.114 18321 2728 1 3 . 1 1 6 6 PHE HA H 6 4.786 4.786 4.809 -0.023 18321 2729 1 3 . 1 1 6 6 PHE C C 6 172.076 172.076 174.073 -1.997 18321 2730 1 3 . 1 1 6 6 PHE CA C 6 56.640 56.640 55.435 1.205 18321 2731 1 3 . 1 1 6 6 PHE CB C 6 40.378 40.378 41.085 -0.707 18321 2732 1 3 . 1 1 6 6 PHE H H 6 7.536 7.536 7.928 -0.392 18321 2733 1 3 . 1 1 7 7 ASP N N 7 121.846 121.846 120.704 1.142 18321 2734 1 3 . 1 1 7 7 ASP HA H 7 4.846 4.846 4.560 0.286 18321 2735 1 3 . 1 1 7 7 ASP CA C 7 52.327 52.327 53.326 -0.999 18321 2736 1 3 . 1 1 7 7 ASP CB C 7 41.298 41.298 39.404 1.894 18321 2737 1 3 . 1 1 7 7 ASP H H 7 9.062 9.062 8.701 0.361 18321 2738 1 3 . 1 1 8 8 SER HA H 8 3.950 3.950 4.394 -0.444 18321 2739 1 3 . 1 1 8 8 SER C C 8 174.705 174.705 174.077 0.628 18321 2740 1 3 . 1 1 8 8 SER CA C 8 61.937 61.937 58.735 3.202 18321 2741 1 3 . 1 1 8 8 SER CB C 8 62.260 62.260 61.743 0.517 18321 2742 1 3 . 1 1 9 9 SER N N 9 114.373 114.373 117.265 -2.892 18321 2743 1 3 . 1 1 9 9 SER HA H 9 4.529 4.529 4.779 -0.250 18321 2744 1 3 . 1 1 9 9 SER C C 9 175.089 175.089 173.414 1.675 18321 2745 1 3 . 1 1 9 9 SER CA C 9 59.851 59.851 58.960 0.891 18321 2746 1 3 . 1 1 9 9 SER CB C 9 64.246 64.246 64.423 -0.177 18321 2747 1 3 . 1 1 9 9 SER H H 9 8.722 8.722 8.668 0.054 18321 2748 1 3 . 1 1 10 10 ASP N N 10 121.818 121.818 123.874 -2.056 18321 2749 1 3 . 1 1 10 10 ASP HA H 10 4.730 4.730 4.569 0.161 18321 2750 1 3 . 1 1 10 10 ASP C C 10 174.455 174.455 177.702 -3.247 18321 2751 1 3 . 1 1 10 10 ASP CA C 10 52.432 52.432 54.565 -2.133 18321 2752 1 3 . 1 1 10 10 ASP CB C 10 39.607 39.607 41.538 -1.931 18321 2753 1 3 . 1 1 10 10 ASP H H 10 7.600 7.600 7.963 -0.363 18321 2754 1 3 . 1 1 11 11 ARG N N 11 125.238 125.238 126.600 -1.362 18321 2755 1 3 . 1 1 11 11 ARG HA H 11 1.936 1.936 3.009 -1.073 18321 2756 1 3 . 1 1 11 11 ARG C C 11 176.916 176.916 177.507 -0.591 18321 2757 1 3 . 1 1 11 11 ARG CA C 11 57.451 57.451 58.329 -0.878 18321 2758 1 3 . 1 1 11 11 ARG CB C 11 43.014 43.014 29.276 13.738 18321 2759 1 3 . 1 1 11 11 ARG H H 11 7.739 7.739 8.440 -0.701 18321 2760 1 3 . 1 1 12 12 SER N N 12 112.065 112.065 111.967 0.098 18321 2761 1 3 . 1 1 12 12 SER HA H 12 4.695 4.695 4.235 0.460 18321 2762 1 3 . 1 1 12 12 SER C C 12 175.092 175.092 174.534 0.558 18321 2763 1 3 . 1 1 12 12 SER CA C 12 60.785 60.785 59.455 1.330 18321 2764 1 3 . 1 1 12 12 SER CB C 12 62.889 62.889 62.312 0.577 18321 2765 1 3 . 1 1 12 12 SER H H 12 7.888 7.888 7.854 0.034 18321 2766 1 3 . 1 1 13 13 ALA N N 13 122.249 122.249 124.266 -2.017 18321 2767 1 3 . 1 1 13 13 ALA HA H 13 4.216 4.216 4.274 -0.058 18321 2768 1 3 . 1 1 13 13 ALA C C 13 178.069 178.069 177.673 0.396 18321 2769 1 3 . 1 1 13 13 ALA CA C 13 53.562 53.562 53.935 -0.373 18321 2770 1 3 . 1 1 13 13 ALA CB C 13 19.339 19.339 19.697 -0.358 18321 2771 1 3 . 1 1 13 13 ALA H H 13 7.418 7.418 7.658 -0.240 18321 2772 1 3 . 1 1 14 14 TRP N N 14 107.433 107.433 112.013 -4.580 18321 2773 1 3 . 1 1 14 14 TRP HA H 14 4.785 4.785 4.718 0.067 18321 2774 1 3 . 1 1 14 14 TRP C C 14 175.286 175.286 175.845 -0.559 18321 2775 1 3 . 1 1 14 14 TRP CA C 14 55.212 55.212 55.290 -0.078 18321 2776 1 3 . 1 1 14 14 TRP CB C 14 32.776 32.776 31.299 1.477 18321 2777 1 3 . 1 1 14 14 TRP H H 14 6.273 6.273 6.835 -0.562 18321 2778 1 3 . 1 1 15 15 TYR N N 15 122.315 122.315 124.727 -2.412 18321 2779 1 3 . 1 1 15 15 TYR HA H 15 5.436 5.436 4.852 0.584 18321 2780 1 3 . 1 1 15 15 TYR C C 15 175.325 175.325 174.608 0.717 18321 2781 1 3 . 1 1 15 15 TYR CA C 15 56.609 56.609 58.015 -1.406 18321 2782 1 3 . 1 1 15 15 TYR CB C 15 36.940 36.940 37.786 -0.847 18321 2783 1 3 . 1 1 15 15 TYR H H 15 8.221 8.221 7.659 0.562 18321 2784 1 3 . 1 1 16 16 MET N N 16 126.031 126.031 128.094 -2.063 18321 2785 1 3 . 1 1 16 16 MET HA H 16 4.462 4.462 4.421 0.041 18321 2786 1 3 . 1 1 16 16 MET CA C 16 53.046 53.046 52.567 0.479 18321 2787 1 3 . 1 1 16 16 MET CB C 16 41.114 41.114 33.168 7.946 18321 2788 1 3 . 1 1 16 16 MET H H 16 8.989 8.989 8.873 0.116 18321 2789 1 3 . 1 1 17 17 GLY CA C 17 45.803 45.803 45.182 0.621 18321 2790 1 3 . 1 1 18 18 PRO HA H 18 4.675 4.675 4.470 0.205 18321 2791 1 3 . 1 1 18 18 PRO C C 18 175.943 175.943 175.722 0.221 18321 2792 1 3 . 1 1 18 18 PRO CA C 18 63.647 63.647 63.358 0.289 18321 2793 1 3 . 1 1 18 18 PRO CB C 18 29.276 29.276 30.573 -1.297 18321 2794 1 3 . 1 1 19 19 VAL N N 19 126.159 126.159 123.435 2.724 18321 2795 1 3 . 1 1 19 19 VAL HA H 19 4.011 4.011 4.350 -0.339 18321 2796 1 3 . 1 1 19 19 VAL C C 19 175.812 175.812 174.528 1.284 18321 2797 1 3 . 1 1 19 19 VAL CA C 19 62.355 62.355 60.453 1.901 18321 2798 1 3 . 1 1 19 19 VAL CB C 19 33.468 33.468 36.087 -2.619 18321 2799 1 3 . 1 1 19 19 VAL H H 19 7.851 7.851 7.654 0.197 18321 2800 1 3 . 1 1 20 20 SER N N 20 123.950 123.950 116.642 7.308 18321 2801 1 3 . 1 1 20 20 SER HA H 20 4.453 4.453 4.958 -0.505 18321 2802 1 3 . 1 1 20 20 SER CA C 20 57.631 57.631 56.870 0.761 18321 2803 1 3 . 1 1 20 20 SER CB C 20 65.951 65.951 65.535 0.416 18321 2804 1 3 . 1 1 20 20 SER H H 20 8.800 8.800 8.140 0.660 18321 2805 1 3 . 1 1 21 21 ARG N N 21 123.461 123.461 121.399 2.062 18321 2806 1 3 . 1 1 21 21 ARG HA H 21 3.489 3.489 4.073 -0.584 18321 2807 1 3 . 1 1 21 21 ARG C C 21 178.164 178.164 178.665 -0.501 18321 2808 1 3 . 1 1 21 21 ARG CA C 21 60.025 60.025 60.923 -0.898 18321 2809 1 3 . 1 1 21 21 ARG CB C 21 30.334 30.334 29.796 0.538 18321 2810 1 3 . 1 1 21 21 ARG H H 21 9.307 9.307 8.785 0.522 18321 2811 1 3 . 1 1 22 22 GLN N N 22 116.591 116.591 118.373 -1.782 18321 2812 1 3 . 1 1 22 22 GLN HA H 22 4.008 4.008 4.120 -0.112 18321 2813 1 3 . 1 1 22 22 GLN CA C 22 59.095 59.095 59.321 -0.226 18321 2814 1 3 . 1 1 22 22 GLN CB C 22 29.249 29.249 28.221 1.028 18321 2815 1 3 . 1 1 22 22 GLN H H 22 8.394 8.394 8.699 -0.305 18321 2816 1 3 . 1 1 23 23 GLU N N 23 122.191 122.191 120.012 2.179 18321 2817 1 3 . 1 1 23 23 GLU HA H 23 4.037 4.037 4.070 -0.033 18321 2818 1 3 . 1 1 23 23 GLU C C 23 178.986 178.986 178.669 0.317 18321 2819 1 3 . 1 1 23 23 GLU CA C 23 59.081 59.081 59.262 -0.181 18321 2820 1 3 . 1 1 23 23 GLU CB C 23 31.896 31.896 28.636 3.260 18321 2821 1 3 . 1 1 23 23 GLU H H 23 8.106 8.106 8.637 -0.531 18321 2822 1 3 . 1 1 24 24 ALA N N 24 121.964 121.964 121.509 0.455 18321 2823 1 3 . 1 1 24 24 ALA HA H 24 3.762 3.762 3.930 -0.168 18321 2824 1 3 . 1 1 24 24 ALA C C 24 178.653 178.653 179.443 -0.790 18321 2825 1 3 . 1 1 24 24 ALA CA C 24 55.480 55.480 55.310 0.170 18321 2826 1 3 . 1 1 24 24 ALA CB C 24 18.049 18.049 18.509 -0.460 18321 2827 1 3 . 1 1 24 24 ALA H H 24 8.732 8.732 8.282 0.450 18321 2828 1 3 . 1 1 25 25 GLN N N 25 116.229 116.229 118.104 -1.875 18321 2829 1 3 . 1 1 25 25 GLN HA H 25 3.950 3.950 4.032 -0.082 18321 2830 1 3 . 1 1 25 25 GLN C C 25 177.442 177.442 178.306 -0.864 18321 2831 1 3 . 1 1 25 25 GLN CA C 25 59.651 59.651 58.807 0.844 18321 2832 1 3 . 1 1 25 25 GLN CB C 25 29.308 29.308 28.570 0.738 18321 2833 1 3 . 1 1 25 25 GLN H H 25 8.391 8.391 8.335 0.056 18321 2834 1 3 . 1 1 26 26 THR N N 26 115.105 115.105 113.975 1.130 18321 2835 1 3 . 1 1 26 26 THR HA H 26 3.920 3.920 4.123 -0.203 18321 2836 1 3 . 1 1 26 26 THR C C 26 176.835 176.835 176.595 0.240 18321 2837 1 3 . 1 1 26 26 THR CA C 26 66.335 66.335 64.927 1.408 18321 2838 1 3 . 1 1 26 26 THR CB C 26 68.876 68.876 68.737 0.139 18321 2839 1 3 . 1 1 26 26 THR H H 26 8.223 8.223 8.292 -0.069 18321 2840 1 3 . 1 1 27 27 ARG N N 27 119.096 119.096 116.963 2.133 18321 2841 1 3 . 1 1 27 27 ARG HA H 27 4.047 4.047 4.299 -0.252 18321 2842 1 3 . 1 1 27 27 ARG C C 27 177.245 177.245 176.696 0.549 18321 2843 1 3 . 1 1 27 27 ARG CA C 27 58.528 58.528 57.626 0.902 18321 2844 1 3 . 1 1 27 27 ARG CB C 27 30.184 30.184 30.820 -0.636 18321 2845 1 3 . 1 1 27 27 ARG H H 27 8.093 8.093 7.767 0.326 18321 2846 1 3 . 1 1 28 28 LEU N N 28 114.602 114.602 115.831 -1.229 18321 2847 1 3 . 1 1 28 28 LEU HA H 28 4.325 4.325 4.547 -0.222 18321 2848 1 3 . 1 1 28 28 LEU C C 28 177.197 177.197 176.509 0.688 18321 2849 1 3 . 1 1 28 28 LEU CA C 28 55.143 55.143 54.406 0.738 18321 2850 1 3 . 1 1 28 28 LEU CB C 28 44.902 44.902 43.533 1.369 18321 2851 1 3 . 1 1 28 28 LEU H H 28 7.438 7.438 7.765 -0.327 18321 2852 1 3 . 1 1 29 29 GLN N N 29 121.312 121.312 121.225 0.087 18321 2853 1 3 . 1 1 29 29 GLN HA H 29 3.856 3.856 4.206 -0.350 18321 2854 1 3 . 1 1 29 29 GLN C C 29 178.048 178.048 176.848 1.200 18321 2855 1 3 . 1 1 29 29 GLN CA C 29 57.691 57.691 56.984 0.707 18321 2856 1 3 . 1 1 29 29 GLN CB C 29 27.293 27.293 28.204 -0.911 18321 2857 1 3 . 1 1 29 29 GLN H H 29 8.250 8.250 8.280 -0.030 18321 2858 1 3 . 1 1 30 30 GLY N N 30 116.768 116.768 114.758 2.010 18321 2859 1 3 . 1 1 30 30 GLY C C 30 174.914 174.914 174.560 0.354 18321 2860 1 3 . 1 1 30 30 GLY CA C 30 45.491 45.491 45.532 -0.042 18321 2861 1 3 . 1 1 30 30 GLY H H 30 9.135 9.135 8.424 0.711 18321 2862 1 3 . 1 1 31 31 GLN N N 31 117.979 117.979 119.241 -1.262 18321 2863 1 3 . 1 1 31 31 GLN HA H 31 4.329 4.329 4.469 -0.140 18321 2864 1 3 . 1 1 31 31 GLN C C 31 177.174 177.174 177.136 0.038 18321 2865 1 3 . 1 1 31 31 GLN CA C 31 53.910 53.910 54.502 -0.592 18321 2866 1 3 . 1 1 31 31 GLN CB C 31 29.574 29.574 29.951 -0.377 18321 2867 1 3 . 1 1 31 31 GLN H H 31 7.695 7.695 7.719 -0.024 18321 2868 1 3 . 1 1 32 32 ARG N N 32 123.918 123.918 120.247 3.671 18321 2869 1 3 . 1 1 32 32 ARG HA H 32 3.940 3.940 4.057 -0.117 18321 2870 1 3 . 1 1 32 32 ARG C C 32 175.810 175.810 176.207 -0.397 18321 2871 1 3 . 1 1 32 32 ARG CA C 32 56.770 56.770 56.767 0.003 18321 2872 1 3 . 1 1 32 32 ARG CB C 32 30.074 30.074 30.103 -0.029 18321 2873 1 3 . 1 1 32 32 ARG H H 32 8.955 8.955 8.618 0.337 18321 2874 1 3 . 1 1 33 33 HIS N N 33 122.248 122.248 123.208 -0.960 18321 2875 1 3 . 1 1 33 33 HIS HA H 33 4.627 4.627 4.619 0.008 18321 2876 1 3 . 1 1 33 33 HIS C C 33 177.089 177.089 176.207 0.882 18321 2877 1 3 . 1 1 33 33 HIS CA C 33 55.858 55.858 56.219 -0.361 18321 2878 1 3 . 1 1 33 33 HIS CB C 33 28.648 28.648 30.257 -1.609 18321 2879 1 3 . 1 1 33 33 HIS H H 33 8.302 8.302 8.741 -0.439 18321 2880 1 3 . 1 1 34 34 GLY N N 34 109.518 109.518 113.257 -3.739 18321 2881 1 3 . 1 1 34 34 GLY C C 34 176.730 176.730 172.902 3.828 18321 2882 1 3 . 1 1 34 34 GLY CA C 34 45.967 45.967 45.156 0.811 18321 2883 1 3 . 1 1 34 34 GLY H H 34 9.496 9.496 9.329 0.167 18321 2884 1 3 . 1 1 35 35 MET N N 35 125.193 125.193 121.317 3.876 18321 2885 1 3 . 1 1 35 35 MET HA H 35 5.750 5.750 5.905 -0.155 18321 2886 1 3 . 1 1 35 35 MET C C 35 174.388 174.388 174.106 0.282 18321 2887 1 3 . 1 1 35 35 MET CA C 35 55.762 55.762 54.176 1.586 18321 2888 1 3 . 1 1 35 35 MET CB C 35 32.706 32.706 35.369 -2.663 18321 2889 1 3 . 1 1 35 35 MET H H 35 8.359 8.359 7.337 1.022 18321 2890 1 3 . 1 1 36 36 PHE N N 36 123.311 123.311 121.161 2.150 18321 2891 1 3 . 1 1 36 36 PHE HA H 36 5.985 5.985 5.773 0.212 18321 2892 1 3 . 1 1 36 36 PHE C C 36 172.140 172.140 172.795 -0.655 18321 2893 1 3 . 1 1 36 36 PHE CA C 36 55.755 55.755 54.945 0.810 18321 2894 1 3 . 1 1 36 36 PHE CB C 36 45.197 45.197 42.670 2.527 18321 2895 1 3 . 1 1 36 36 PHE H H 36 8.261 8.261 7.882 0.379 18321 2896 1 3 . 1 1 37 37 LEU N N 37 114.652 114.652 115.740 -1.088 18321 2897 1 3 . 1 1 37 37 LEU HA H 37 4.489 4.489 4.988 -0.499 18321 2898 1 3 . 1 1 37 37 LEU C C 37 174.033 174.033 174.928 -0.895 18321 2899 1 3 . 1 1 37 37 LEU CA C 37 55.382 55.382 54.695 0.687 18321 2900 1 3 . 1 1 37 37 LEU CB C 37 44.791 44.791 45.531 -0.740 18321 2901 1 3 . 1 1 37 37 LEU H H 37 9.292 9.292 8.985 0.307 18321 2902 1 3 . 1 1 38 38 VAL N N 38 121.009 121.009 122.242 -1.233 18321 2903 1 3 . 1 1 38 38 VAL HA H 38 5.504 5.504 4.820 0.684 18321 2904 1 3 . 1 1 38 38 VAL C C 38 173.581 173.581 175.459 -1.878 18321 2905 1 3 . 1 1 38 38 VAL CA C 38 61.316 61.316 61.752 -0.436 18321 2906 1 3 . 1 1 38 38 VAL CB C 38 33.302 33.302 32.821 0.481 18321 2907 1 3 . 1 1 38 38 VAL H H 38 8.991 8.991 8.607 0.384 18321 2908 1 3 . 1 1 39 39 ARG N N 39 124.863 124.863 126.904 -2.041 18321 2909 1 3 . 1 1 39 39 ARG HA H 39 5.444 5.444 4.610 0.834 18321 2910 1 3 . 1 1 39 39 ARG C C 39 175.772 175.772 174.763 1.009 18321 2911 1 3 . 1 1 39 39 ARG CA C 39 52.558 52.558 53.554 -0.996 18321 2912 1 3 . 1 1 39 39 ARG CB C 39 34.980 34.980 32.916 2.064 18321 2913 1 3 . 1 1 39 39 ARG H H 39 9.569 9.569 8.378 1.191 18321 2914 1 3 . 1 1 40 40 ASP N N 40 122.330 122.330 120.605 1.725 18321 2915 1 3 . 1 1 40 40 ASP HA H 40 4.785 4.785 5.067 -0.282 18321 2916 1 3 . 1 1 40 40 ASP C C 40 176.332 176.332 176.172 0.160 18321 2917 1 3 . 1 1 40 40 ASP CA C 40 55.334 55.334 54.931 0.404 18321 2918 1 3 . 1 1 40 40 ASP CB C 40 40.650 40.650 41.844 -1.194 18321 2919 1 3 . 1 1 40 40 ASP H H 40 8.413 8.413 8.464 -0.051 18321 2920 1 3 . 1 1 41 41 SER N N 41 114.363 114.363 120.397 -6.034 18321 2921 1 3 . 1 1 41 41 SER HA H 41 4.506 4.506 4.585 -0.079 18321 2922 1 3 . 1 1 41 41 SER CA C 41 57.525 57.525 58.006 -0.481 18321 2923 1 3 . 1 1 41 41 SER CB C 41 63.706 63.706 63.813 -0.107 18321 2924 1 3 . 1 1 41 41 SER H H 41 7.791 7.791 8.433 -0.642 18321 2925 1 3 . 1 1 42 42 SER N N 42 126.932 126.932 118.331 8.601 18321 2926 1 3 . 1 1 42 42 SER HA H 42 4.410 4.410 4.788 -0.378 18321 2927 1 3 . 1 1 42 42 SER CA C 42 60.362 60.362 58.113 2.249 18321 2928 1 3 . 1 1 42 42 SER CB C 42 63.707 63.707 62.882 0.825 18321 2929 1 3 . 1 1 42 42 SER H H 42 10.519 10.519 8.753 1.766 18321 2930 1 3 . 1 1 43 43 THR HA H 43 4.097 4.097 4.388 -0.291 18321 2931 1 3 . 1 1 43 43 THR CA C 43 64.722 64.722 63.071 1.651 18321 2932 1 3 . 1 1 43 43 THR CB C 43 69.439 69.439 69.574 -0.135 18321 2933 1 3 . 1 1 44 44 CYS HA H 44 5.100 5.100 4.938 0.162 18321 2934 1 3 . 1 1 44 44 CYS CA C 44 51.779 51.779 56.218 -4.439 18321 2935 1 3 . 1 1 44 44 CYS CB C 44 41.314 41.314 30.142 11.172 18321 2936 1 3 . 1 1 45 45 PRO HA H 45 4.278 4.278 4.359 -0.081 18321 2937 1 3 . 1 1 45 45 PRO C C 45 178.127 178.127 177.423 0.704 18321 2938 1 3 . 1 1 45 45 PRO CA C 45 64.151 64.151 64.261 -0.110 18321 2939 1 3 . 1 1 45 45 PRO CB C 45 31.596 31.596 31.549 0.047 18321 2940 1 3 . 1 1 46 46 GLY N N 46 114.947 114.947 113.424 1.523 18321 2941 1 3 . 1 1 46 46 GLY C C 46 174.701 174.701 173.816 0.885 18321 2942 1 3 . 1 1 46 46 GLY CA C 46 45.225 45.225 44.804 0.421 18321 2943 1 3 . 1 1 46 46 GLY H H 46 8.812 8.812 8.810 0.002 18321 2944 1 3 . 1 1 47 47 ASP N N 47 120.862 120.862 120.931 -0.069 18321 2945 1 3 . 1 1 47 47 ASP HA H 47 5.235 5.235 4.759 0.476 18321 2946 1 3 . 1 1 47 47 ASP C C 47 176.480 176.480 174.836 1.644 18321 2947 1 3 . 1 1 47 47 ASP CA C 47 53.591 53.591 53.571 0.020 18321 2948 1 3 . 1 1 47 47 ASP CB C 47 41.707 41.707 42.777 -1.070 18321 2949 1 3 . 1 1 47 47 ASP H H 47 7.997 7.997 7.445 0.552 18321 2950 1 3 . 1 1 48 48 TYR N N 48 118.473 118.473 116.420 2.053 18321 2951 1 3 . 1 1 48 48 TYR HA H 48 5.431 5.431 5.483 -0.052 18321 2952 1 3 . 1 1 48 48 TYR C C 48 173.783 173.783 175.559 -1.776 18321 2953 1 3 . 1 1 48 48 TYR CA C 48 56.891 56.891 56.183 0.708 18321 2954 1 3 . 1 1 48 48 TYR CB C 48 43.274 43.274 42.532 0.742 18321 2955 1 3 . 1 1 48 48 TYR H H 48 8.892 8.892 9.185 -0.293 18321 2956 1 3 . 1 1 49 49 VAL N N 49 119.105 119.105 118.904 0.201 18321 2957 1 3 . 1 1 49 49 VAL HA H 49 4.800 4.800 4.608 0.192 18321 2958 1 3 . 1 1 49 49 VAL C C 49 174.397 174.397 174.624 -0.227 18321 2959 1 3 . 1 1 49 49 VAL CA C 49 61.439 61.439 62.075 -0.636 18321 2960 1 3 . 1 1 49 49 VAL CB C 49 35.388 35.388 34.742 0.646 18321 2961 1 3 . 1 1 49 49 VAL H H 49 9.661 9.661 8.700 0.961 18321 2962 1 3 . 1 1 50 50 LEU N N 50 129.599 129.599 131.224 -1.625 18321 2963 1 3 . 1 1 50 50 LEU HA H 50 5.033 5.033 5.115 -0.082 18321 2964 1 3 . 1 1 50 50 LEU C C 50 175.001 175.001 175.421 -0.420 18321 2965 1 3 . 1 1 50 50 LEU CA C 50 53.352 53.352 53.567 -0.215 18321 2966 1 3 . 1 1 50 50 LEU CB C 50 44.062 44.062 42.352 1.710 18321 2967 1 3 . 1 1 50 50 LEU H H 50 9.405 9.405 9.224 0.181 18321 2968 1 3 . 1 1 51 51 SER N N 51 126.895 126.895 124.517 2.378 18321 2969 1 3 . 1 1 51 51 SER HA H 51 5.731 5.731 5.222 0.509 18321 2970 1 3 . 1 1 51 51 SER C C 51 173.094 173.094 173.248 -0.154 18321 2971 1 3 . 1 1 51 51 SER CA C 51 58.834 58.834 57.012 1.822 18321 2972 1 3 . 1 1 51 51 SER CB C 51 64.977 64.977 64.129 0.848 18321 2973 1 3 . 1 1 51 51 SER H H 51 9.094 9.094 8.861 0.233 18321 2974 1 3 . 1 1 52 52 VAL N N 52 121.777 121.777 124.657 -2.880 18321 2975 1 3 . 1 1 52 52 VAL HA H 52 5.066 5.066 4.619 0.447 18321 2976 1 3 . 1 1 52 52 VAL C C 52 174.573 174.573 174.856 -0.283 18321 2977 1 3 . 1 1 52 52 VAL CA C 52 59.535 59.535 60.536 -1.001 18321 2978 1 3 . 1 1 52 52 VAL CB C 52 36.834 36.834 35.304 1.530 18321 2979 1 3 . 1 1 52 52 VAL H H 52 8.816 8.816 8.558 0.258 18321 2980 1 3 . 1 1 53 53 SER N N 53 120.489 120.489 122.650 -2.161 18321 2981 1 3 . 1 1 53 53 SER HA H 53 4.811 4.811 4.701 0.110 18321 2982 1 3 . 1 1 53 53 SER C C 53 174.065 174.065 172.501 1.564 18321 2983 1 3 . 1 1 53 53 SER CA C 53 57.496 57.496 57.092 0.404 18321 2984 1 3 . 1 1 53 53 SER CB C 53 62.623 62.623 63.332 -0.709 18321 2985 1 3 . 1 1 53 53 SER H H 53 8.780 8.780 9.158 -0.378 18321 2986 1 3 . 1 1 54 54 GLU N N 54 132.020 132.020 128.088 3.932 18321 2987 1 3 . 1 1 54 54 GLU HA H 54 4.250 4.250 4.162 0.088 18321 2988 1 3 . 1 1 54 54 GLU C C 54 175.387 175.387 174.948 0.439 18321 2989 1 3 . 1 1 54 54 GLU CA C 54 56.999 56.999 55.752 1.247 18321 2990 1 3 . 1 1 54 54 GLU CB C 54 32.556 32.556 32.915 -0.359 18321 2991 1 3 . 1 1 54 54 GLU H H 54 8.472 8.472 7.805 0.667 18321 2992 1 3 . 1 1 55 55 ASN N N 55 126.517 126.517 119.598 6.919 18321 2993 1 3 . 1 1 55 55 ASN HA H 55 4.220 4.220 4.158 0.062 18321 2994 1 3 . 1 1 55 55 ASN C C 55 174.546 174.546 174.590 -0.044 18321 2995 1 3 . 1 1 55 55 ASN CA C 55 54.770 54.770 54.301 0.469 18321 2996 1 3 . 1 1 55 55 ASN CB C 55 37.314 37.314 37.769 -0.455 18321 2997 1 3 . 1 1 55 55 ASN H H 55 8.853 8.853 8.272 0.581 18321 2998 1 3 . 1 1 56 56 SER N N 56 112.009 112.009 110.817 1.192 18321 2999 1 3 . 1 1 56 56 SER HA H 56 4.334 4.334 4.083 0.251 18321 3000 1 3 . 1 1 56 56 SER C C 56 173.354 173.354 172.164 1.190 18321 3001 1 3 . 1 1 56 56 SER CA C 56 59.966 59.966 59.365 0.601 18321 3002 1 3 . 1 1 56 56 SER CB C 56 62.242 62.242 62.173 0.069 18321 3003 1 3 . 1 1 56 56 SER H H 56 10.418 10.418 7.577 2.841 18321 3004 1 3 . 1 1 57 57 ARG N N 57 121.764 121.764 120.013 1.751 18321 3005 1 3 . 1 1 57 57 ARG HA H 57 5.167 5.167 4.366 0.801 18321 3006 1 3 . 1 1 57 57 ARG C C 57 174.983 174.983 174.265 0.718 18321 3007 1 3 . 1 1 57 57 ARG CA C 57 54.550 54.550 55.119 -0.569 18321 3008 1 3 . 1 1 57 57 ARG CB C 57 31.886 31.886 31.316 0.570 18321 3009 1 3 . 1 1 57 57 ARG H H 57 8.097 8.097 8.001 0.096 18321 3010 1 3 . 1 1 58 58 VAL N N 58 121.866 121.866 122.868 -1.002 18321 3011 1 3 . 1 1 58 58 VAL HA H 58 4.768 4.768 4.317 0.451 18321 3012 1 3 . 1 1 58 58 VAL C C 58 175.388 175.388 176.349 -0.961 18321 3013 1 3 . 1 1 58 58 VAL CA C 58 61.818 61.818 62.409 -0.591 18321 3014 1 3 . 1 1 58 58 VAL CB C 58 34.135 34.135 30.323 3.812 18321 3015 1 3 . 1 1 58 58 VAL H H 58 8.081 8.081 8.001 0.080 18321 3016 1 3 . 1 1 59 59 SER N N 59 124.445 124.445 122.840 1.605 18321 3017 1 3 . 1 1 59 59 SER HA H 59 4.462 4.462 4.298 0.164 18321 3018 1 3 . 1 1 59 59 SER C C 59 172.185 172.185 173.623 -1.438 18321 3019 1 3 . 1 1 59 59 SER CA C 59 56.629 56.629 57.650 -1.020 18321 3020 1 3 . 1 1 59 59 SER CB C 59 66.218 66.218 63.752 2.466 18321 3021 1 3 . 1 1 59 59 SER H H 59 9.082 9.082 8.479 0.603 18321 3022 1 3 . 1 1 60 60 HIS N N 60 121.224 121.224 125.352 -4.128 18321 3023 1 3 . 1 1 60 60 HIS HA H 60 4.885 4.885 4.491 0.394 18321 3024 1 3 . 1 1 60 60 HIS C C 60 174.674 174.674 174.222 0.452 18321 3025 1 3 . 1 1 60 60 HIS CA C 60 54.900 54.900 55.564 -0.664 18321 3026 1 3 . 1 1 60 60 HIS CB C 60 32.331 32.331 29.538 2.793 18321 3027 1 3 . 1 1 60 60 HIS H H 60 8.331 8.331 8.627 -0.296 18321 3028 1 3 . 1 1 61 61 TYR N N 61 124.780 124.780 125.688 -0.908 18321 3029 1 3 . 1 1 61 61 TYR HA H 61 4.655 4.655 4.782 -0.127 18321 3030 1 3 . 1 1 61 61 TYR CA C 61 57.409 57.409 56.928 0.481 18321 3031 1 3 . 1 1 61 61 TYR CB C 61 39.785 39.785 37.862 1.923 18321 3032 1 3 . 1 1 61 61 TYR H H 61 9.273 9.273 9.141 0.132 18321 3033 1 3 . 1 1 62 62 ILE HA H 62 4.298 4.298 4.277 0.021 18321 3034 1 3 . 1 1 62 62 ILE C C 62 174.817 174.817 175.518 -0.701 18321 3035 1 3 . 1 1 62 62 ILE CA C 62 61.908 61.908 62.112 -0.204 18321 3036 1 3 . 1 1 62 62 ILE CB C 62 38.321 38.321 38.814 -0.493 18321 3037 1 3 . 1 1 63 63 ILE N N 63 128.552 128.552 128.425 0.127 18321 3038 1 3 . 1 1 63 63 ILE HA H 63 4.788 4.788 4.791 -0.003 18321 3039 1 3 . 1 1 63 63 ILE C C 63 175.982 175.982 174.817 1.165 18321 3040 1 3 . 1 1 63 63 ILE CA C 63 59.629 59.629 60.041 -0.412 18321 3041 1 3 . 1 1 63 63 ILE CB C 63 39.747 39.747 39.555 0.192 18321 3042 1 3 . 1 1 63 63 ILE H H 63 9.155 9.155 8.957 0.198 18321 3043 1 3 . 1 1 64 64 ASN N N 64 123.240 123.240 126.629 -3.389 18321 3044 1 3 . 1 1 64 64 ASN HA H 64 4.857 4.857 5.239 -0.382 18321 3045 1 3 . 1 1 64 64 ASN C C 64 175.324 175.324 174.936 0.388 18321 3046 1 3 . 1 1 64 64 ASN CA C 64 53.736 53.736 53.261 0.475 18321 3047 1 3 . 1 1 64 64 ASN CB C 64 41.531 41.531 40.326 1.205 18321 3048 1 3 . 1 1 64 64 ASN H H 64 9.379 9.379 8.900 0.479 18321 3049 1 3 . 1 1 65 65 SER N N 65 121.157 121.157 118.007 3.150 18321 3050 1 3 . 1 1 65 65 SER HA H 65 4.548 4.548 4.502 0.046 18321 3051 1 3 . 1 1 65 65 SER C C 65 174.328 174.328 174.348 -0.020 18321 3052 1 3 . 1 1 65 65 SER CA C 65 58.306 58.306 57.665 0.641 18321 3053 1 3 . 1 1 65 65 SER CB C 65 62.878 62.878 63.065 -0.187 18321 3054 1 3 . 1 1 65 65 SER H H 65 9.195 9.195 8.979 0.216 18321 3055 1 3 . 1 1 66 66 LEU N N 66 127.417 127.417 128.937 -1.520 18321 3056 1 3 . 1 1 66 66 LEU HA H 66 4.605 4.605 4.557 0.048 18321 3057 1 3 . 1 1 66 66 LEU CA C 66 52.888 52.888 52.785 0.103 18321 3058 1 3 . 1 1 66 66 LEU CB C 66 41.799 41.799 41.757 0.042 18321 3059 1 3 . 1 1 66 66 LEU H H 66 8.143 8.143 8.402 -0.259 18321 3060 1 3 . 1 1 68 68 ASN HA H 68 4.386 4.386 4.599 -0.213 18321 3061 1 3 . 1 1 68 68 ASN C C 68 174.487 174.487 175.287 -0.800 18321 3062 1 3 . 1 1 68 68 ASN CA C 68 53.365 53.365 52.908 0.457 18321 3063 1 3 . 1 1 68 68 ASN CB C 68 36.778 36.778 37.945 -1.167 18321 3064 1 3 . 1 1 69 69 ARG N N 69 111.329 111.329 117.048 -5.719 18321 3065 1 3 . 1 1 69 69 ARG HA H 69 3.876 3.876 3.798 0.078 18321 3066 1 3 . 1 1 69 69 ARG CA C 69 57.393 57.393 57.143 0.250 18321 3067 1 3 . 1 1 69 69 ARG CB C 69 26.665 26.665 27.802 -1.137 18321 3068 1 3 . 1 1 69 69 ARG H H 69 8.191 8.191 7.771 0.420 18321 3069 1 3 . 1 1 70 70 ARG N N 70 116.120 116.120 114.978 1.142 18321 3070 1 3 . 1 1 70 70 ARG HA H 70 4.556 4.556 5.302 -0.746 18321 3071 1 3 . 1 1 70 70 ARG C C 70 174.882 174.882 174.556 0.326 18321 3072 1 3 . 1 1 70 70 ARG CA C 70 55.509 55.509 53.643 1.866 18321 3073 1 3 . 1 1 70 70 ARG CB C 70 31.771 31.771 33.516 -1.745 18321 3074 1 3 . 1 1 70 70 ARG H H 70 6.667 6.667 7.333 -0.666 18321 3075 1 3 . 1 1 71 71 PHE N N 71 116.313 116.313 117.819 -1.506 18321 3076 1 3 . 1 1 71 71 PHE HA H 71 5.540 5.540 5.486 0.054 18321 3077 1 3 . 1 1 71 71 PHE C C 71 174.391 174.391 174.791 -0.400 18321 3078 1 3 . 1 1 71 71 PHE CA C 71 57.528 57.528 56.779 0.750 18321 3079 1 3 . 1 1 71 71 PHE CB C 71 44.115 44.115 42.720 1.395 18321 3080 1 3 . 1 1 71 71 PHE H H 71 8.700 8.700 9.117 -0.417 18321 3081 1 3 . 1 1 72 72 LYS N N 72 122.770 122.770 126.612 -3.842 18321 3082 1 3 . 1 1 72 72 LYS HA H 72 5.483 5.483 5.025 0.458 18321 3083 1 3 . 1 1 72 72 LYS C C 72 173.923 173.923 175.517 -1.594 18321 3084 1 3 . 1 1 72 72 LYS CA C 72 54.855 54.855 55.136 -0.281 18321 3085 1 3 . 1 1 72 72 LYS CB C 72 37.710 37.710 34.265 3.445 18321 3086 1 3 . 1 1 72 72 LYS H H 72 9.138 9.138 8.639 0.499 18321 3087 1 3 . 1 1 73 73 ILE N N 73 124.576 124.576 128.837 -4.261 18321 3088 1 3 . 1 1 73 73 ILE HA H 73 4.955 4.955 5.264 -0.309 18321 3089 1 3 . 1 1 73 73 ILE C C 73 175.728 175.728 176.704 -0.976 18321 3090 1 3 . 1 1 73 73 ILE CA C 73 58.935 58.935 60.100 -1.165 18321 3091 1 3 . 1 1 73 73 ILE CB C 73 40.965 40.965 38.992 1.974 18321 3092 1 3 . 1 1 73 73 ILE H H 73 8.826 8.826 8.398 0.428 18321 3093 1 3 . 1 1 74 74 GLY N N 74 118.718 118.718 119.509 -0.791 18321 3094 1 3 . 1 1 74 74 GLY C C 74 174.436 174.436 173.888 0.548 18321 3095 1 3 . 1 1 74 74 GLY CA C 74 47.401 47.401 46.964 0.437 18321 3096 1 3 . 1 1 74 74 GLY H H 74 9.317 9.317 9.151 0.166 18321 3097 1 3 . 1 1 75 75 ASP N N 75 125.691 125.691 121.900 3.791 18321 3098 1 3 . 1 1 75 75 ASP HA H 75 4.713 4.713 4.730 -0.017 18321 3099 1 3 . 1 1 75 75 ASP C C 75 175.841 175.841 175.684 0.157 18321 3100 1 3 . 1 1 75 75 ASP CA C 75 53.815 53.815 54.582 -0.767 18321 3101 1 3 . 1 1 75 75 ASP CB C 75 41.288 41.288 42.894 -1.605 18321 3102 1 3 . 1 1 75 75 ASP H H 75 8.665 8.665 8.640 0.025 18321 3103 1 3 . 1 1 76 76 GLN N N 76 120.368 120.368 120.614 -0.246 18321 3104 1 3 . 1 1 76 76 GLN C C 76 173.630 173.630 174.687 -1.057 18321 3105 1 3 . 1 1 76 76 GLN CA C 76 54.254 54.254 56.207 -1.953 18321 3106 1 3 . 1 1 76 76 GLN CB C 76 31.248 31.248 29.279 1.969 18321 3107 1 3 . 1 1 76 76 GLN H H 76 8.289 8.289 7.814 0.475 18321 3108 1 3 . 1 1 77 77 GLU N N 77 120.435 120.435 122.606 -2.171 18321 3109 1 3 . 1 1 77 77 GLU C C 77 175.484 175.484 175.627 -0.143 18321 3110 1 3 . 1 1 77 77 GLU CA C 77 54.203 54.203 55.306 -1.103 18321 3111 1 3 . 1 1 77 77 GLU CB C 77 33.141 33.141 30.275 2.866 18321 3112 1 3 . 1 1 77 77 GLU H H 77 7.732 7.732 8.240 -0.508 18321 3113 1 3 . 1 1 78 78 PHE N N 78 117.911 117.911 124.565 -6.654 18321 3114 1 3 . 1 1 78 78 PHE HA H 78 4.659 4.659 4.709 -0.050 18321 3115 1 3 . 1 1 78 78 PHE C C 78 175.673 175.673 176.556 -0.883 18321 3116 1 3 . 1 1 78 78 PHE CA C 78 57.160 57.160 56.939 0.221 18321 3117 1 3 . 1 1 78 78 PHE CB C 78 45.405 45.405 40.547 4.858 18321 3118 1 3 . 1 1 78 78 PHE H H 78 9.235 9.235 8.309 0.926 18321 3119 1 3 . 1 1 79 79 ASP N N 79 119.296 119.296 118.626 0.670 18321 3120 1 3 . 1 1 79 79 ASP HA H 79 4.462 4.462 4.528 -0.066 18321 3121 1 3 . 1 1 79 79 ASP C C 79 174.482 174.482 175.743 -1.261 18321 3122 1 3 . 1 1 79 79 ASP CA C 79 56.629 56.629 56.644 -0.015 18321 3123 1 3 . 1 1 79 79 ASP CB C 79 41.697 41.697 41.120 0.577 18321 3124 1 3 . 1 1 79 79 ASP H H 79 9.187 9.187 8.861 0.326 18321 3125 1 3 . 1 1 80 80 HIS N N 80 107.631 107.631 110.688 -3.057 18321 3126 1 3 . 1 1 80 80 HIS HA H 80 5.022 5.022 5.139 -0.117 18321 3127 1 3 . 1 1 80 80 HIS C C 80 174.626 174.626 174.736 -0.110 18321 3128 1 3 . 1 1 80 80 HIS CA C 80 54.223 54.223 54.879 -0.656 18321 3129 1 3 . 1 1 80 80 HIS CB C 80 32.205 32.205 31.860 0.345 18321 3130 1 3 . 1 1 80 80 HIS H H 80 7.200 7.200 7.075 0.125 18321 3131 1 3 . 1 1 81 81 LEU N N 81 120.710 120.710 121.195 -0.485 18321 3132 1 3 . 1 1 81 81 LEU HA H 81 3.804 3.804 4.068 -0.264 18321 3133 1 3 . 1 1 81 81 LEU CA C 81 58.709 58.709 59.863 -1.154 18321 3134 1 3 . 1 1 81 81 LEU CB C 81 39.646 39.646 39.986 -0.340 18321 3135 1 3 . 1 1 81 81 LEU H H 81 8.886 8.886 9.085 -0.199 18321 3136 1 3 . 1 1 82 82 PRO HA H 82 4.020 4.020 4.161 -0.141 18321 3137 1 3 . 1 1 82 82 PRO C C 82 175.619 175.619 177.438 -1.819 18321 3138 1 3 . 1 1 82 82 PRO CA C 82 67.025 67.025 65.272 1.753 18321 3139 1 3 . 1 1 82 82 PRO CB C 82 30.962 30.962 30.859 0.103 18321 3140 1 3 . 1 1 83 83 ALA N N 83 124.281 124.281 120.458 3.823 18321 3141 1 3 . 1 1 83 83 ALA HA H 83 4.019 4.019 4.122 -0.103 18321 3142 1 3 . 1 1 83 83 ALA C C 83 179.709 179.709 178.702 1.007 18321 3143 1 3 . 1 1 83 83 ALA CA C 83 54.985 54.985 54.385 0.600 18321 3144 1 3 . 1 1 83 83 ALA CB C 83 18.425 18.425 18.601 -0.176 18321 3145 1 3 . 1 1 83 83 ALA H H 83 8.527 8.527 7.544 0.983 18321 3146 1 3 . 1 1 84 84 LEU N N 84 122.960 122.960 117.646 5.314 18321 3147 1 3 . 1 1 84 84 LEU HA H 84 1.917 1.917 3.035 -1.118 18321 3148 1 3 . 1 1 84 84 LEU C C 84 177.652 177.652 178.201 -0.549 18321 3149 1 3 . 1 1 84 84 LEU CA C 84 58.261 58.261 57.086 1.175 18321 3150 1 3 . 1 1 84 84 LEU CB C 84 42.544 42.544 40.846 1.698 18321 3151 1 3 . 1 1 84 84 LEU H H 84 6.982 6.982 7.274 -0.292 18321 3152 1 3 . 1 1 85 85 LEU N N 85 117.940 117.940 119.309 -1.369 18321 3153 1 3 . 1 1 85 85 LEU HA H 85 3.463 3.463 3.760 -0.297 18321 3154 1 3 . 1 1 85 85 LEU C C 85 178.809 178.809 179.209 -0.400 18321 3155 1 3 . 1 1 85 85 LEU CA C 85 57.522 57.522 57.782 -0.260 18321 3156 1 3 . 1 1 85 85 LEU CB C 85 41.242 41.242 40.887 0.355 18321 3157 1 3 . 1 1 85 85 LEU H H 85 7.773 7.773 7.923 -0.150 18321 3158 1 3 . 1 1 86 86 GLU N N 86 115.762 115.762 119.003 -3.241 18321 3159 1 3 . 1 1 86 86 GLU HA H 86 3.540 3.540 3.929 -0.389 18321 3160 1 3 . 1 1 86 86 GLU C C 86 180.228 180.228 178.517 1.711 18321 3161 1 3 . 1 1 86 86 GLU CA C 86 58.943 58.943 58.821 0.122 18321 3162 1 3 . 1 1 86 86 GLU CB C 86 29.561 29.561 29.148 0.413 18321 3163 1 3 . 1 1 86 86 GLU H H 86 8.300 8.300 7.443 0.857 18321 3164 1 3 . 1 1 87 87 PHE N N 87 121.135 121.135 119.961 1.174 18321 3165 1 3 . 1 1 87 87 PHE HA H 87 4.122 4.122 4.078 0.044 18321 3166 1 3 . 1 1 87 87 PHE C C 87 179.497 179.497 177.659 1.838 18321 3167 1 3 . 1 1 87 87 PHE CA C 87 62.090 62.090 60.560 1.530 18321 3168 1 3 . 1 1 87 87 PHE CB C 87 40.103 40.103 38.952 1.151 18321 3169 1 3 . 1 1 87 87 PHE H H 87 7.717 7.717 7.548 0.169 18321 3170 1 3 . 1 1 88 88 TYR N N 88 116.579 116.579 118.109 -1.530 18321 3171 1 3 . 1 1 88 88 TYR HA H 88 4.933 4.933 4.146 0.787 18321 3172 1 3 . 1 1 88 88 TYR C C 88 174.799 174.799 177.345 -2.546 18321 3173 1 3 . 1 1 88 88 TYR CA C 88 61.333 61.333 59.348 1.985 18321 3174 1 3 . 1 1 88 88 TYR CB C 88 36.539 36.539 37.409 -0.870 18321 3175 1 3 . 1 1 88 88 TYR H H 88 7.478 7.478 7.858 -0.380 18321 3176 1 3 . 1 1 89 89 LYS N N 89 117.737 117.737 118.986 -1.249 18321 3177 1 3 . 1 1 89 89 LYS HA H 89 4.466 4.466 3.965 0.501 18321 3178 1 3 . 1 1 89 89 LYS C C 89 178.417 178.417 177.134 1.283 18321 3179 1 3 . 1 1 89 89 LYS CA C 89 59.486 59.486 59.233 0.253 18321 3180 1 3 . 1 1 89 89 LYS CB C 89 34.523 34.523 32.519 2.005 18321 3181 1 3 . 1 1 89 89 LYS H H 89 7.505 7.505 7.661 -0.156 18321 3182 1 3 . 1 1 90 90 ILE N N 90 110.972 110.972 109.987 0.985 18321 3183 1 3 . 1 1 90 90 ILE HA H 90 4.181 4.181 4.174 0.007 18321 3184 1 3 . 1 1 90 90 ILE C C 90 174.571 174.571 175.846 -1.275 18321 3185 1 3 . 1 1 90 90 ILE CA C 90 60.516 60.516 60.321 0.195 18321 3186 1 3 . 1 1 90 90 ILE CB C 90 39.979 39.979 37.736 2.243 18321 3187 1 3 . 1 1 90 90 ILE H H 90 6.710 6.710 7.232 -0.522 18321 3188 1 3 . 1 1 91 91 HIS N N 91 119.479 119.479 120.817 -1.338 18321 3189 1 3 . 1 1 91 91 HIS HA H 91 4.357 4.357 4.372 -0.015 18321 3190 1 3 . 1 1 91 91 HIS C C 91 172.751 172.751 175.091 -2.340 18321 3191 1 3 . 1 1 91 91 HIS CA C 91 55.066 55.066 56.568 -1.502 18321 3192 1 3 . 1 1 91 91 HIS CB C 91 29.756 29.756 32.076 -2.320 18321 3193 1 3 . 1 1 91 91 HIS H H 91 7.460 7.460 6.949 0.511 18321 3194 1 3 . 1 1 92 92 TYR N N 92 117.642 117.642 115.505 2.137 18321 3195 1 3 . 1 1 92 92 TYR HA H 92 4.131 4.131 4.351 -0.220 18321 3196 1 3 . 1 1 92 92 TYR C C 92 177.348 177.348 175.230 2.118 18321 3197 1 3 . 1 1 92 92 TYR CA C 92 58.627 58.627 57.988 0.639 18321 3198 1 3 . 1 1 92 92 TYR CB C 92 39.481 39.481 35.529 3.953 18321 3199 1 3 . 1 1 92 92 TYR H H 92 8.067 8.067 7.419 0.648 18321 3200 1 3 . 1 1 93 93 LEU N N 93 123.560 123.560 118.131 5.429 18321 3201 1 3 . 1 1 93 93 LEU HA H 93 4.104 4.104 4.029 0.075 18321 3202 1 3 . 1 1 93 93 LEU C C 93 175.610 175.610 177.473 -1.863 18321 3203 1 3 . 1 1 93 93 LEU CA C 93 56.381 56.381 56.960 -0.579 18321 3204 1 3 . 1 1 93 93 LEU CB C 93 38.896 38.896 41.854 -2.958 18321 3205 1 3 . 1 1 93 93 LEU H H 93 7.907 7.907 8.451 -0.544 18321 3206 1 3 . 1 1 94 94 ASP N N 94 118.194 118.194 113.093 5.101 18321 3207 1 3 . 1 1 94 94 ASP HA H 94 4.940 4.940 4.600 0.340 18321 3208 1 3 . 1 1 94 94 ASP C C 94 176.123 176.123 175.964 0.159 18321 3209 1 3 . 1 1 94 94 ASP CA C 94 56.235 56.235 55.567 0.668 18321 3210 1 3 . 1 1 94 94 ASP CB C 94 42.078 42.078 43.057 -0.979 18321 3211 1 3 . 1 1 94 94 ASP H H 94 8.640 8.640 8.016 0.624 18321 3212 1 3 . 1 1 95 95 THR N N 95 105.073 105.073 109.678 -4.605 18321 3213 1 3 . 1 1 95 95 THR HA H 95 4.318 4.318 4.546 -0.228 18321 3214 1 3 . 1 1 95 95 THR C C 95 174.685 174.685 174.082 0.603 18321 3215 1 3 . 1 1 95 95 THR CA C 95 60.756 60.756 62.553 -1.797 18321 3216 1 3 . 1 1 95 95 THR CB C 95 71.058 71.058 68.818 2.240 18321 3217 1 3 . 1 1 95 95 THR H H 95 8.576 8.576 8.126 0.450 18321 3218 1 3 . 1 1 96 96 THR N N 96 116.817 116.817 114.818 1.999 18321 3219 1 3 . 1 1 96 96 THR HA H 96 5.129 5.129 4.557 0.572 18321 3220 1 3 . 1 1 96 96 THR C C 96 172.464 172.464 173.713 -1.249 18321 3221 1 3 . 1 1 96 96 THR CA C 96 60.762 60.762 61.526 -0.764 18321 3222 1 3 . 1 1 96 96 THR CB C 96 71.425 71.425 69.537 1.888 18321 3223 1 3 . 1 1 96 96 THR H H 96 8.205 8.205 7.872 0.333 18321 3224 1 3 . 1 1 97 97 THR N N 97 114.324 114.324 111.158 3.166 18321 3225 1 3 . 1 1 97 97 THR HA H 97 5.128 5.128 3.856 1.272 18321 3226 1 3 . 1 1 97 97 THR C C 97 175.480 175.480 173.316 2.164 18321 3227 1 3 . 1 1 97 97 THR CA C 97 60.233 60.233 62.612 -2.379 18321 3228 1 3 . 1 1 97 97 THR CB C 97 70.415 70.415 68.124 2.292 18321 3229 1 3 . 1 1 97 97 THR H H 97 7.128 7.128 7.535 -0.407 18321 3230 1 3 . 1 1 98 98 LEU N N 98 116.674 116.674 122.793 -6.119 18321 3231 1 3 . 1 1 98 98 LEU HA H 98 4.075 4.075 4.366 -0.291 18321 3232 1 3 . 1 1 98 98 LEU C C 98 177.892 177.892 176.488 1.404 18321 3233 1 3 . 1 1 98 98 LEU CA C 98 59.597 59.597 53.875 5.722 18321 3234 1 3 . 1 1 98 98 LEU CB C 98 41.172 41.172 41.288 -0.116 18321 3235 1 3 . 1 1 98 98 LEU H H 98 8.743 8.743 8.296 0.447 18321 3236 1 3 . 1 1 99 99 ILE N N 99 122.988 122.988 122.623 0.365 18321 3237 1 3 . 1 1 99 99 ILE HA H 99 4.415 4.415 4.047 0.368 18321 3238 1 3 . 1 1 99 99 ILE C C 99 175.055 175.055 176.083 -1.028 18321 3239 1 3 . 1 1 99 99 ILE CA C 99 62.183 62.183 62.123 0.060 18321 3240 1 3 . 1 1 99 99 ILE CB C 99 40.252 40.252 38.725 1.527 18321 3241 1 3 . 1 1 99 99 ILE H H 99 8.998 8.998 8.214 0.784 18321 3242 1 3 . 1 1 100 100 GLU N N 100 114.067 114.067 113.682 0.385 18321 3243 1 3 . 1 1 100 100 GLU CA C 100 52.910 52.910 53.581 -0.671 18321 3244 1 3 . 1 1 100 100 GLU CB C 100 31.155 31.155 30.795 0.360 18321 3245 1 3 . 1 1 100 100 GLU H H 100 7.332 7.332 8.112 -0.780 18321 3246 1 3 . 1 1 101 101 PRO HA H 101 4.952 4.952 3.847 1.105 18321 3247 1 3 . 1 1 101 101 PRO C C 101 175.976 175.976 176.155 -0.179 18321 3248 1 3 . 1 1 101 101 PRO CA C 101 53.312 53.312 61.721 -8.409 18321 3249 1 3 . 1 1 101 101 PRO CB C 101 31.598 31.598 32.002 -0.404 18321 3250 1 3 . 1 1 102 102 ALA N N 102 125.968 125.968 123.213 2.755 18321 3251 1 3 . 1 1 102 102 ALA HA H 102 4.516 4.516 4.263 0.253 18321 3252 1 3 . 1 1 102 102 ALA CA C 102 49.852 49.852 49.915 -0.063 18321 3253 1 3 . 1 1 102 102 ALA CB C 102 17.766 17.766 18.207 -0.441 18321 3254 1 3 . 1 1 102 102 ALA H H 102 8.232 8.232 8.136 0.096 18321 3255 1 3 . 1 1 103 103 PRO HA H 103 4.283 4.283 4.288 -0.005 18321 3256 1 3 . 1 1 103 103 PRO CA C 103 62.435 62.435 63.395 -0.960 18321 3257 1 3 . 1 1 103 103 PRO CB C 103 32.145 32.145 32.057 0.088 18321 3258 1 3 . 1 1 104 104 ARG HA H 104 4.004 4.004 4.132 -0.128 18321 3259 1 3 . 1 1 104 104 ARG CA C 104 56.660 56.660 59.085 -2.425 18321 3260 1 3 . 1 1 106 106 PRO C C 106 174.587 174.587 176.597 -2.010 18321 3261 1 3 . 1 1 106 106 PRO CA C 106 57.867 57.867 63.653 -5.786 18321 3262 1 3 . 1 1 106 106 PRO CB C 106 31.942 31.942 32.850 -0.908 18321 3263 1 3 . 1 1 107 107 SER N N 107 121.280 121.280 113.856 7.424 18321 3264 1 3 . 1 1 107 107 SER CA C 107 61.772 61.772 57.042 4.730 18321 3265 1 3 . 1 1 107 107 SER CB C 107 63.234 63.234 64.231 -0.997 18321 3266 1 3 . 1 1 107 107 SER H H 107 8.132 8.132 7.674 0.458 18321 3267 1 3 . 1 1 109 109 PRO C C 109 177.129 177.129 176.139 0.990 18321 3268 1 3 . 1 1 109 109 PRO CA C 109 62.638 62.638 63.978 -1.340 18321 3269 1 3 . 1 1 109 109 PRO CB C 109 30.970 30.970 31.665 -0.695 18321 3270 1 3 . 1 1 110 110 MET N N 110 120.772 120.772 122.743 -1.971 18321 3271 1 3 . 1 1 110 110 MET C C 110 176.892 176.892 175.979 0.913 18321 3272 1 3 . 1 1 110 110 MET CA C 110 55.310 55.310 55.916 -0.606 18321 3273 1 3 . 1 1 110 110 MET CB C 110 32.202 32.202 33.740 -1.538 18321 3274 1 3 . 1 1 110 110 MET H H 110 8.430 8.430 8.758 -0.328 18321 3275 1 3 . 1 1 111 111 GLY N N 111 110.158 110.158 108.503 1.655 18321 3276 1 3 . 1 1 111 111 GLY C C 111 177.430 177.430 173.690 3.740 18321 3277 1 3 . 1 1 111 111 GLY CA C 111 44.951 44.951 45.227 -0.276 18321 3278 1 3 . 1 1 111 111 GLY H H 111 8.384 8.384 7.936 0.448 18321 3279 1 3 . 1 1 112 112 SER N N 112 116.762 116.762 114.211 2.551 18321 3280 1 3 . 1 1 112 112 SER CA C 112 55.948 55.948 58.946 -2.998 18321 3281 1 3 . 1 1 112 112 SER CB C 112 62.745 62.745 62.555 0.190 18321 3282 1 3 . 1 1 112 112 SER H H 112 8.161 8.161 8.424 -0.263 18321 3283 1 3 . 1 1 113 113 VAL C C 113 176.083 176.083 176.505 -0.422 18321 3284 1 3 . 1 1 114 114 SER N N 114 119.151 119.151 116.439 2.712 18321 3285 1 3 . 1 1 114 114 SER C C 114 173.638 173.638 173.728 -0.090 18321 3286 1 3 . 1 1 114 114 SER CA C 114 58.005 58.005 58.423 -0.418 18321 3287 1 3 . 1 1 114 114 SER CB C 114 63.169 63.169 61.919 1.250 18321 3288 1 3 . 1 1 114 114 SER H H 114 8.319 8.319 8.538 -0.219 18321 3289 1 3 . 1 1 115 115 ALA N N 115 126.914 126.914 123.668 3.246 18321 3290 1 3 . 1 1 115 115 ALA CA C 115 51.561 51.561 52.464 -0.903 18321 3291 1 3 . 1 1 115 115 ALA CB C 115 17.714 17.714 18.502 -0.788 18321 3292 1 3 . 1 1 115 115 ALA H H 115 8.197 8.197 7.626 0.571 18321 3293 1 3 . 1 1 119 119 PRO C C 119 177.065 177.065 176.265 0.800 18321 3294 1 3 . 1 1 120 120 THR N N 120 113.976 113.976 113.506 0.470 18321 3295 1 3 . 1 1 120 120 THR C C 120 174.461 174.461 174.200 0.261 18321 3296 1 3 . 1 1 120 120 THR CA C 120 61.215 61.215 63.286 -2.071 18321 3297 1 3 . 1 1 120 120 THR CB C 120 69.508 69.508 70.441 -0.933 18321 3298 1 3 . 1 1 120 120 THR H H 120 8.138 8.138 8.695 -0.557 18321 3299 1 3 . 1 1 121 121 ALA N N 121 125.859 125.859 126.500 -0.641 18321 3300 1 3 . 1 1 121 121 ALA CA C 121 52.281 52.281 50.875 1.406 18321 3301 1 3 . 1 1 121 121 ALA CB C 121 18.623 18.623 18.170 0.453 18321 3302 1 3 . 1 1 121 121 ALA H H 121 8.272 8.272 7.609 0.663 18321 3303 1 3 . 1 1 122 122 GLU C C 122 176.316 176.316 176.056 0.260 18321 3304 1 3 . 1 1 123 123 ASP N N 123 120.448 120.448 123.421 -2.973 18321 3305 1 3 . 1 1 123 123 ASP C C 123 175.906 175.906 174.006 1.900 18321 3306 1 3 . 1 1 123 123 ASP CA C 123 54.167 54.167 55.584 -1.417 18321 3307 1 3 . 1 1 123 123 ASP CB C 123 40.695 40.695 40.994 -0.299 18321 3308 1 3 . 1 1 123 123 ASP H H 123 8.181 8.181 8.886 -0.705 18321 3309 1 3 . 1 1 124 124 ASN N N 124 118.207 118.207 111.979 6.228 18321 3310 1 3 . 1 1 124 124 ASN C C 124 174.851 174.851 173.330 1.521 18321 3311 1 3 . 1 1 124 124 ASN CA C 124 52.771 52.771 51.218 1.553 18321 3312 1 3 . 1 1 124 124 ASN CB C 124 38.304 38.304 41.247 -2.943 18321 3313 1 3 . 1 1 124 124 ASN H H 124 8.307 8.307 7.627 0.680 18321 3314 1 3 . 1 1 125 125 LEU N N 125 121.311 121.311 119.439 1.872 18321 3315 1 3 . 1 1 125 125 LEU C C 125 175.750 175.750 176.072 -0.322 18321 3316 1 3 . 1 1 125 125 LEU CA C 125 54.428 54.428 55.656 -1.228 18321 3317 1 3 . 1 1 125 125 LEU CB C 125 41.350 41.350 40.531 0.819 18321 3318 1 3 . 1 1 125 125 LEU H H 125 7.747 7.747 8.572 -0.825 18321 3319 1 3 . 1 1 126 126 GLU N N 126 122.485 122.485 118.990 3.495 18321 3320 1 3 . 1 1 126 126 GLU C C 126 174.008 174.008 173.656 0.352 18321 3321 1 3 . 1 1 126 126 GLU CA C 126 54.855 54.855 56.859 -2.004 18321 3322 1 3 . 1 1 126 126 GLU CB C 126 30.472 30.472 31.060 -0.588 18321 3323 1 3 . 1 1 126 126 GLU H H 126 8.453 8.453 8.138 0.315 18321 3324 1 3 . 1 1 127 127 TYR N N 127 122.713 122.713 118.628 4.085 18321 3325 1 3 . 1 1 127 127 TYR C C 127 176.859 176.859 174.758 2.101 18321 3326 1 3 . 1 1 127 127 TYR CA C 127 56.528 56.528 56.819 -0.291 18321 3327 1 3 . 1 1 127 127 TYR CB C 127 40.982 40.982 40.812 0.170 18321 3328 1 3 . 1 1 127 127 TYR H H 127 8.469 8.469 7.796 0.673 18321 3329 1 3 . 1 1 128 128 VAL N N 128 112.432 112.432 123.434 -11.002 18321 3330 1 3 . 1 1 128 128 VAL C C 128 173.150 173.150 174.180 -1.030 18321 3331 1 3 . 1 1 128 128 VAL CA C 128 57.940 57.940 60.857 -2.917 18321 3332 1 3 . 1 1 128 128 VAL CB C 128 34.935 34.935 36.299 -1.364 18321 3333 1 3 . 1 1 128 128 VAL H H 128 9.078 9.078 9.157 -0.079 18321 3334 1 3 . 1 1 129 129 ARG N N 129 120.373 120.373 123.200 -2.827 18321 3335 1 3 . 1 1 129 129 ARG C C 129 176.539 176.539 175.265 1.274 18321 3336 1 3 . 1 1 129 129 ARG CA C 129 52.534 52.534 54.043 -1.509 18321 3337 1 3 . 1 1 129 129 ARG CB C 129 32.942 32.942 33.135 -0.193 18321 3338 1 3 . 1 1 129 129 ARG H H 129 9.010 9.010 8.098 0.912 18321 3339 1 3 . 1 1 130 130 THR N N 130 116.637 116.637 112.942 3.695 18321 3340 1 3 . 1 1 130 130 THR CA C 130 60.618 60.618 60.167 0.451 18321 3341 1 3 . 1 1 130 130 THR CB C 130 69.170 69.170 70.558 -1.388 18321 3342 1 3 . 1 1 130 130 THR H H 130 9.045 9.045 9.355 -0.310 18321 3343 1 3 . 1 1 131 131 LEU N N 131 122.910 122.910 122.611 0.299 18321 3344 1 3 . 1 1 131 131 LEU C C 131 175.269 175.269 177.764 -2.495 18321 3345 1 3 . 1 1 131 131 LEU CA C 131 55.122 55.122 55.763 -0.641 18321 3346 1 3 . 1 1 131 131 LEU CB C 131 43.108 43.108 42.712 0.396 18321 3347 1 3 . 1 1 131 131 LEU H H 131 9.224 9.224 8.048 1.176 18321 3348 1 3 . 1 1 132 132 TYR N N 132 112.885 112.885 119.697 -6.812 18321 3349 1 3 . 1 1 132 132 TYR C C 132 173.818 173.818 175.703 -1.885 18321 3350 1 3 . 1 1 132 132 TYR CA C 132 54.230 54.230 59.451 -5.221 18321 3351 1 3 . 1 1 132 132 TYR CB C 132 42.672 42.672 39.610 3.062 18321 3352 1 3 . 1 1 132 132 TYR H H 132 7.284 7.284 8.025 -0.741 18321 3353 1 3 . 1 1 133 133 ASP N N 133 118.003 118.003 119.385 -1.382 18321 3354 1 3 . 1 1 133 133 ASP C C 133 175.779 175.779 174.598 1.181 18321 3355 1 3 . 1 1 133 133 ASP CA C 133 54.351 54.351 55.313 -0.962 18321 3356 1 3 . 1 1 133 133 ASP CB C 133 41.241 41.241 39.875 1.366 18321 3357 1 3 . 1 1 133 133 ASP H H 133 8.399 8.399 8.318 0.081 18321 3358 1 3 . 1 1 134 134 PHE N N 134 121.081 121.081 123.647 -2.566 18321 3359 1 3 . 1 1 134 134 PHE CA C 134 52.552 52.552 54.615 -2.063 18321 3360 1 3 . 1 1 134 134 PHE CB C 134 41.217 41.217 41.400 -0.183 18321 3361 1 3 . 1 1 134 134 PHE H H 134 8.797 8.797 7.124 1.673 18321 3362 1 3 . 1 1 136 136 GLY C C 136 171.616 171.616 174.649 -3.033 18321 3363 1 3 . 1 1 137 137 ASN N N 137 119.394 119.394 116.468 2.926 18321 3364 1 3 . 1 1 137 137 ASN C C 137 174.500 174.500 173.528 0.972 18321 3365 1 3 . 1 1 137 137 ASN CA C 137 44.670 44.670 54.435 -9.765 18321 3366 1 3 . 1 1 137 137 ASN H H 137 9.477 9.477 8.313 1.164 18321 3367 1 3 . 1 1 138 138 ASP N N 138 120.608 120.608 118.291 2.317 18321 3368 1 3 . 1 1 138 138 ASP C C 138 176.987 176.987 174.768 2.219 18321 3369 1 3 . 1 1 138 138 ASP CA C 138 52.992 52.992 52.785 0.207 18321 3370 1 3 . 1 1 138 138 ASP H H 138 8.216 8.216 7.978 0.238 18321 3371 1 3 . 1 1 139 139 ALA N N 139 124.371 124.371 121.339 3.032 18321 3372 1 3 . 1 1 139 139 ALA C C 139 178.472 178.472 178.356 0.116 18321 3373 1 3 . 1 1 139 139 ALA CA C 139 54.513 54.513 53.513 1.000 18321 3374 1 3 . 1 1 139 139 ALA CB C 139 18.045 18.045 19.714 -1.669 18321 3375 1 3 . 1 1 139 139 ALA H H 139 8.565 8.565 8.503 0.062 18321 3376 1 3 . 1 1 140 140 GLU N N 140 115.022 115.022 117.045 -2.023 18321 3377 1 3 . 1 1 140 140 GLU C C 140 177.027 177.027 175.418 1.609 18321 3378 1 3 . 1 1 140 140 GLU CA C 140 56.181 56.181 56.806 -0.625 18321 3379 1 3 . 1 1 140 140 GLU CB C 140 28.619 28.619 31.092 -2.473 18321 3380 1 3 . 1 1 140 140 GLU H H 140 8.616 8.616 8.435 0.181 18321 3381 1 3 . 1 1 141 141 ASP N N 141 121.913 121.913 120.180 1.733 18321 3382 1 3 . 1 1 141 141 ASP C C 141 175.923 175.923 174.494 1.429 18321 3383 1 3 . 1 1 141 141 ASP CA C 141 54.736 54.736 53.580 1.156 18321 3384 1 3 . 1 1 141 141 ASP CB C 141 41.305 41.305 43.016 -1.711 18321 3385 1 3 . 1 1 141 141 ASP H H 141 7.636 7.636 7.965 -0.329 18321 3386 1 3 . 1 1 142 142 LEU N N 142 127.651 127.651 125.997 1.654 18321 3387 1 3 . 1 1 142 142 LEU CA C 142 50.955 50.955 52.673 -1.718 18321 3388 1 3 . 1 1 142 142 LEU CB C 142 42.343 42.343 43.813 -1.470 18321 3389 1 3 . 1 1 142 142 LEU H H 142 9.479 9.479 8.083 1.396 18321 3390 1 3 . 1 1 143 143 PRO C C 143 177.924 177.924 175.654 2.270 18321 3391 1 3 . 1 1 144 144 PHE N N 144 114.483 114.483 120.556 -6.073 18321 3392 1 3 . 1 1 144 144 PHE C C 144 175.055 175.055 174.858 0.197 18321 3393 1 3 . 1 1 144 144 PHE CA C 144 55.543 55.543 55.095 0.448 18321 3394 1 3 . 1 1 144 144 PHE CB C 144 40.581 40.581 41.108 -0.527 18321 3395 1 3 . 1 1 144 144 PHE H H 144 8.637 8.637 7.498 1.139 18321 3396 1 3 . 1 1 145 145 LYS N N 145 121.342 121.342 119.482 1.860 18321 3397 1 3 . 1 1 145 145 LYS C C 145 176.925 176.925 176.223 0.702 18321 3398 1 3 . 1 1 145 145 LYS CA C 145 53.043 53.043 54.637 -1.594 18321 3399 1 3 . 1 1 145 145 LYS CB C 145 33.804 33.804 35.371 -1.567 18321 3400 1 3 . 1 1 145 145 LYS H H 145 9.418 9.418 8.975 0.443 18321 3401 1 3 . 1 1 146 146 LYS N N 146 123.378 123.378 119.415 3.963 18321 3402 1 3 . 1 1 146 146 LYS CA C 146 57.883 57.883 55.531 2.352 18321 3403 1 3 . 1 1 146 146 LYS CB C 146 32.008 32.008 30.797 1.211 18321 3404 1 3 . 1 1 146 146 LYS H H 146 9.002 9.002 8.441 0.561 18321 3405 1 3 . 1 1 147 147 GLY C C 147 174.315 174.315 173.685 0.630 18321 3406 1 3 . 1 1 148 148 GLU N N 148 121.392 121.392 118.926 2.466 18321 3407 1 3 . 1 1 148 148 GLU C C 148 174.998 174.998 175.427 -0.429 18321 3408 1 3 . 1 1 148 148 GLU CA C 148 56.867 56.867 53.922 2.945 18321 3409 1 3 . 1 1 148 148 GLU CB C 148 31.649 31.649 30.270 1.379 18321 3410 1 3 . 1 1 148 148 GLU H H 148 7.937 7.937 7.870 0.067 18321 3411 1 3 . 1 1 149 149 ILE N N 149 120.124 120.124 120.511 -0.387 18321 3412 1 3 . 1 1 149 149 ILE C C 149 176.647 176.647 174.968 1.679 18321 3413 1 3 . 1 1 149 149 ILE CA C 149 58.621 58.621 59.675 -1.054 18321 3414 1 3 . 1 1 149 149 ILE CB C 149 36.952 36.952 39.268 -2.316 18321 3415 1 3 . 1 1 149 149 ILE H H 149 8.346 8.346 8.393 -0.047 18321 3416 1 3 . 1 1 150 150 LEU N N 150 126.950 126.950 124.820 2.130 18321 3417 1 3 . 1 1 150 150 LEU CA C 150 51.967 51.967 52.895 -0.928 18321 3418 1 3 . 1 1 150 150 LEU CB C 150 44.182 44.182 45.466 -1.284 18321 3419 1 3 . 1 1 150 150 LEU H H 150 8.988 8.988 9.214 -0.226 18321 3420 1 3 . 1 1 151 151 VAL C C 151 175.670 175.670 175.691 -0.021 18321 3421 1 3 . 1 1 152 152 ILE N N 152 124.997 124.997 128.510 -3.513 18321 3422 1 3 . 1 1 152 152 ILE CA C 152 58.331 58.331 60.040 -1.709 18321 3423 1 3 . 1 1 152 152 ILE CB C 152 34.093 34.093 34.756 -0.663 18321 3424 1 3 . 1 1 152 152 ILE H H 152 8.673 8.673 8.245 0.428 18321 3425 1 3 . 1 1 153 153 ILE N N 153 124.710 124.710 128.054 -3.344 18321 3426 1 3 . 1 1 153 153 ILE C C 153 176.264 176.264 175.264 1.000 18321 3427 1 3 . 1 1 154 154 GLU N N 154 117.398 117.398 118.197 -0.799 18321 3428 1 3 . 1 1 154 154 GLU C C 154 173.959 173.959 174.415 -0.456 18321 3429 1 3 . 1 1 154 154 GLU CA C 154 55.289 55.289 54.850 0.439 18321 3430 1 3 . 1 1 154 154 GLU CB C 154 32.842 32.842 33.297 -0.455 18321 3431 1 3 . 1 1 154 154 GLU H H 154 7.818 7.818 8.349 -0.531 18321 3432 1 3 . 1 1 155 155 LYS N N 155 121.130 121.130 124.588 -3.458 18321 3433 1 3 . 1 1 155 155 LYS CA C 155 53.022 53.022 52.343 0.679 18321 3434 1 3 . 1 1 155 155 LYS CB C 155 32.663 32.663 32.940 -0.277 18321 3435 1 3 . 1 1 155 155 LYS H H 155 8.654 8.654 8.556 0.098 18321 3436 1 3 . 1 1 157 157 GLU C C 157 175.190 175.190 176.503 -1.313 18321 3437 1 3 . 1 1 157 157 GLU CA C 157 53.785 53.785 54.300 -0.515 18321 3438 1 3 . 1 1 157 157 GLU CB C 157 32.685 32.685 31.976 0.709 18321 3439 1 3 . 1 1 158 158 GLU N N 158 117.425 117.425 119.732 -2.307 18321 3440 1 3 . 1 1 158 158 GLU C C 158 178.600 178.600 177.527 1.073 18321 3441 1 3 . 1 1 158 158 GLU CA C 158 59.044 59.044 57.811 1.233 18321 3442 1 3 . 1 1 158 158 GLU CB C 158 29.706 29.706 30.345 -0.639 18321 3443 1 3 . 1 1 158 158 GLU H H 158 8.678 8.678 8.958 -0.280 18321 3444 1 3 . 1 1 159 159 GLN N N 159 110.925 110.925 117.397 -6.472 18321 3445 1 3 . 1 1 159 159 GLN C C 159 175.539 175.539 175.365 0.174 18321 3446 1 3 . 1 1 159 159 GLN CA C 159 54.942 54.942 56.796 -1.854 18321 3447 1 3 . 1 1 159 159 GLN CB C 159 28.572 28.572 30.008 -1.435 18321 3448 1 3 . 1 1 159 159 GLN H H 159 8.483 8.483 8.180 0.303 18321 3449 1 3 . 1 1 160 160 TRP N N 160 120.171 120.171 119.664 0.507 18321 3450 1 3 . 1 1 160 160 TRP C C 160 173.444 173.444 174.772 -1.328 18321 3451 1 3 . 1 1 160 160 TRP CA C 160 56.175 56.175 56.457 -0.282 18321 3452 1 3 . 1 1 160 160 TRP CB C 160 31.796 31.796 32.346 -0.550 18321 3453 1 3 . 1 1 160 160 TRP H H 160 6.826 6.826 7.831 -1.005 18321 3454 1 3 . 1 1 161 161 TRP N N 161 120.687 120.687 121.541 -0.854 18321 3455 1 3 . 1 1 161 161 TRP C C 161 174.736 174.736 175.770 -1.034 18321 3456 1 3 . 1 1 161 161 TRP CA C 161 51.889 51.889 54.955 -3.066 18321 3457 1 3 . 1 1 161 161 TRP CB C 161 32.772 32.772 32.113 0.659 18321 3458 1 3 . 1 1 161 161 TRP H H 161 8.462 8.462 9.506 -1.044 18321 3459 1 3 . 1 1 162 162 SER N N 162 115.691 115.691 119.644 -3.953 18321 3460 1 3 . 1 1 162 162 SER C C 162 174.320 174.320 173.435 0.885 18321 3461 1 3 . 1 1 162 162 SER CA C 162 57.011 57.011 58.264 -1.253 18321 3462 1 3 . 1 1 162 162 SER CB C 162 63.948 63.948 63.282 0.666 18321 3463 1 3 . 1 1 162 162 SER H H 162 8.830 8.830 9.135 -0.305 18321 3464 1 3 . 1 1 163 163 ALA N N 163 130.630 130.630 128.372 2.258 18321 3465 1 3 . 1 1 163 163 ALA CA C 163 50.029 50.029 49.952 0.077 18321 3466 1 3 . 1 1 163 163 ALA CB C 163 25.500 25.500 22.333 3.167 18321 3467 1 3 . 1 1 163 163 ALA H H 163 9.585 9.585 9.131 0.454 18321 3468 1 3 . 1 1 164 164 ARG N N 164 117.526 117.526 121.019 -3.493 18321 3469 1 3 . 1 1 164 164 ARG C C 164 176.719 176.719 176.660 0.059 18321 3470 1 3 . 1 1 164 164 ARG CA C 164 52.975 52.975 54.330 -1.355 18321 3471 1 3 . 1 1 164 164 ARG CB C 164 34.260 34.260 30.731 3.529 18321 3472 1 3 . 1 1 164 164 ARG H H 164 9.097 9.097 9.002 0.095 18321 3473 1 3 . 1 1 165 165 ASN N N 165 123.935 123.935 123.921 0.014 18321 3474 1 3 . 1 1 165 165 ASN C C 165 178.484 178.484 177.115 1.369 18321 3475 1 3 . 1 1 165 165 ASN CA C 165 50.332 50.332 52.923 -2.591 18321 3476 1 3 . 1 1 165 165 ASN CB C 165 39.487 39.487 39.772 -0.285 18321 3477 1 3 . 1 1 165 165 ASN H H 165 8.756 8.756 8.807 -0.051 18321 3478 1 3 . 1 1 166 166 LYS N N 166 118.464 118.464 121.296 -2.832 18321 3479 1 3 . 1 1 166 166 LYS C C 166 176.967 176.967 176.748 0.219 18321 3480 1 3 . 1 1 166 166 LYS CA C 166 58.430 58.430 58.837 -0.408 18321 3481 1 3 . 1 1 166 166 LYS CB C 166 30.918 30.918 32.275 -1.357 18321 3482 1 3 . 1 1 166 166 LYS H H 166 8.915 8.915 8.802 0.113 18321 3483 1 3 . 1 1 167 167 ASP N N 167 118.138 118.138 115.424 2.714 18321 3484 1 3 . 1 1 167 167 ASP C C 167 176.464 176.464 177.077 -0.613 18321 3485 1 3 . 1 1 167 167 ASP CA C 167 54.212 54.212 54.881 -0.669 18321 3486 1 3 . 1 1 167 167 ASP CB C 167 41.178 41.178 40.667 0.511 18321 3487 1 3 . 1 1 167 167 ASP H H 167 7.508 7.508 8.358 -0.850 18321 3488 1 3 . 1 1 168 168 GLY N N 168 107.901 107.901 107.385 0.516 18321 3489 1 3 . 1 1 168 168 GLY C C 168 173.613 173.613 173.306 0.307 18321 3490 1 3 . 1 1 168 168 GLY CA C 168 44.783 44.783 44.900 -0.117 18321 3491 1 3 . 1 1 168 168 GLY H H 168 8.173 8.173 8.073 0.100 18321 3492 1 3 . 1 1 169 169 ARG N N 169 124.324 124.324 120.236 4.088 18321 3493 1 3 . 1 1 169 169 ARG CA C 169 56.106 56.106 54.959 1.147 18321 3494 1 3 . 1 1 169 169 ARG CB C 169 29.648 29.648 31.826 -2.178 18321 3495 1 3 . 1 1 169 169 ARG H H 169 7.998 7.998 8.184 -0.186 18321 3496 1 3 . 1 1 170 170 VAL C C 170 177.590 177.590 175.058 2.532 18321 3497 1 3 . 1 1 171 171 GLY N N 171 112.582 112.582 112.994 -0.412 18321 3498 1 3 . 1 1 171 171 GLY C C 171 170.991 170.991 172.485 -1.494 18321 3499 1 3 . 1 1 171 171 GLY CA C 171 45.361 45.361 44.850 0.511 18321 3500 1 3 . 1 1 171 171 GLY H H 171 9.013 9.013 8.542 0.471 18321 3501 1 3 . 1 1 172 172 MET N N 172 117.368 117.368 120.725 -3.357 18321 3502 1 3 . 1 1 172 172 MET C C 172 177.921 177.921 176.621 1.300 18321 3503 1 3 . 1 1 172 172 MET CA C 172 53.536 53.536 54.423 -0.888 18321 3504 1 3 . 1 1 172 172 MET CB C 172 30.838 30.838 33.309 -2.471 18321 3505 1 3 . 1 1 172 172 MET H H 172 8.885 8.885 8.309 0.576 18321 3506 1 3 . 1 1 173 173 ILE N N 173 113.130 113.130 118.582 -5.452 18321 3507 1 3 . 1 1 173 173 ILE CA C 173 56.284 56.284 57.982 -1.698 18321 3508 1 3 . 1 1 173 173 ILE CB C 173 40.870 40.870 40.958 -0.088 18321 3509 1 3 . 1 1 173 173 ILE H H 173 9.704 9.704 9.385 0.319 18321 3510 1 3 . 1 1 174 174 PRO C C 174 176.714 176.714 177.711 -0.997 18321 3511 1 3 . 1 1 174 174 PRO CA C 174 66.290 66.290 61.208 5.082 18321 3512 1 3 . 1 1 174 174 PRO CB C 174 28.993 28.993 30.759 -1.766 18321 3513 1 3 . 1 1 175 175 VAL N N 175 128.066 128.066 123.842 4.224 18321 3514 1 3 . 1 1 175 175 VAL CA C 175 59.356 59.356 67.761 -8.405 18321 3515 1 3 . 1 1 175 175 VAL H H 175 7.327 7.327 8.390 -1.063 18321 3516 1 3 . 1 1 176 176 PRO C C 176 176.351 176.351 176.704 -0.353 18321 3517 1 3 . 1 1 177 177 TYR N N 177 115.756 115.756 116.049 -0.293 18321 3518 1 3 . 1 1 177 177 TYR C C 177 175.011 175.011 175.501 -0.490 18321 3519 1 3 . 1 1 177 177 TYR CA C 177 56.756 56.756 57.705 -0.949 18321 3520 1 3 . 1 1 177 177 TYR CB C 177 37.507 37.507 39.034 -1.527 18321 3521 1 3 . 1 1 177 177 TYR H H 177 7.784 7.784 7.576 0.208 18321 3522 1 3 . 1 1 178 178 VAL N N 178 111.428 111.428 114.404 -2.976 18321 3523 1 3 . 1 1 178 178 VAL C C 178 173.417 173.417 176.030 -2.613 18321 3524 1 3 . 1 1 178 178 VAL CA C 178 58.307 58.307 59.094 -0.787 18321 3525 1 3 . 1 1 178 178 VAL CB C 178 34.602 34.602 34.391 0.211 18321 3526 1 3 . 1 1 178 178 VAL H H 178 7.801 7.801 7.466 0.335 18321 3527 1 3 . 1 1 179 179 GLU N N 179 118.581 118.581 119.328 -0.747 18321 3528 1 3 . 1 1 179 179 GLU C C 179 175.225 175.225 175.314 -0.089 18321 3529 1 3 . 1 1 179 179 GLU CA C 179 53.114 53.114 54.656 -1.542 18321 3530 1 3 . 1 1 179 179 GLU CB C 179 32.712 32.712 29.916 2.796 18321 3531 1 3 . 1 1 179 179 GLU H H 179 8.819 8.819 8.463 0.356 18321 3532 1 3 . 1 1 180 180 LYS N N 180 124.167 124.167 120.094 4.073 18321 3533 1 3 . 1 1 180 180 LYS C C 180 176.303 176.303 176.854 -0.551 18321 3534 1 3 . 1 1 180 180 LYS CA C 180 57.318 57.318 56.093 1.225 18321 3535 1 3 . 1 1 180 180 LYS CB C 180 31.675 31.675 32.228 -0.553 18321 3536 1 3 . 1 1 180 180 LYS H H 180 8.775 8.775 8.086 0.689 18321 3537 1 3 . 1 1 181 181 LEU N N 181 125.157 125.157 123.928 1.229 18321 3538 1 3 . 1 1 181 181 LEU C C 181 176.462 176.462 177.671 -1.209 18321 3539 1 3 . 1 1 181 181 LEU CA C 181 54.470 54.470 57.612 -3.142 18321 3540 1 3 . 1 1 181 181 LEU CB C 181 41.625 41.625 42.572 -0.947 18321 3541 1 3 . 1 1 181 181 LEU H H 181 8.084 8.084 8.485 -0.401 18321 3542 1 3 . 1 1 182 182 VAL N N 182 123.167 123.167 110.086 13.081 18321 3543 1 3 . 1 1 182 182 VAL C C 182 175.983 175.983 174.797 1.186 18321 3544 1 3 . 1 1 182 182 VAL CA C 182 61.613 61.613 61.221 0.392 18321 3545 1 3 . 1 1 182 182 VAL CB C 182 32.085 32.085 31.968 0.116 18321 3546 1 3 . 1 1 182 182 VAL H H 182 8.345 8.345 7.787 0.558 18321 3547 1 3 . 1 1 183 183 ARG N N 183 125.775 125.775 119.917 5.858 18321 3548 1 3 . 1 1 183 183 ARG CA C 183 57.801 57.801 55.237 2.564 18321 3549 1 3 . 1 1 183 183 ARG CB C 183 30.091 30.091 31.377 -1.286 18321 3550 1 3 . 1 1 183 183 ARG H H 183 8.530 8.530 7.265 1.265 18321 3551 1 3 . 1 1 184 184 SER C C 184 173.239 173.239 174.665 -1.426 18321 3552 1 3 . 1 1 185 185 SER N N 185 116.511 116.511 113.926 2.585 18321 3553 1 3 . 1 1 185 185 SER CA C 185 58.428 58.428 57.293 1.135 18321 3554 1 3 . 1 1 185 185 SER CB C 185 69.737 69.737 62.968 6.769 18321 3555 1 3 . 1 1 185 185 SER H H 185 7.944 7.944 8.448 -0.504 18321 3556 1 3 . 1 1 190 190 HIS C C 190 176.953 176.953 173.954 2.999 18321 3557 1 3 . 1 1 190 190 HIS CA C 190 54.229 54.229 57.460 -3.231 18321 3558 1 3 . 1 1 190 190 HIS CB C 190 35.112 35.112 29.568 5.544 18321 3559 1 3 . 1 1 191 191 GLY N N 191 109.491 109.491 105.695 3.796 18321 3560 1 3 . 1 1 191 191 GLY C C 191 172.295 172.295 173.084 -0.789 18321 3561 1 3 . 1 1 191 191 GLY CA C 191 45.227 45.227 44.263 0.964 18321 3562 1 3 . 1 1 191 191 GLY H H 191 8.719 8.719 7.883 0.836 18321 3563 1 3 . 1 1 192 192 ASN N N 192 118.700 118.700 118.636 0.064 18321 3564 1 3 . 1 1 192 192 ASN HA H 192 4.312 4.312 4.559 -0.247 18321 3565 1 3 . 1 1 192 192 ASN C C 192 176.369 176.369 175.795 0.574 18321 3566 1 3 . 1 1 192 192 ASN CA C 192 57.787 57.787 54.513 3.274 18321 3567 1 3 . 1 1 192 192 ASN H H 192 7.508 7.508 8.426 -0.918 18321 3568 1 3 . 1 1 193 193 ARG N N 193 120.743 120.743 120.072 0.671 18321 3569 1 3 . 1 1 193 193 ARG H H 193 9.032 9.032 8.289 0.743 18321 3570 1 3 . 1 1 197 197 SER HA H 197 4.388 4.388 4.333 0.055 18321 3571 1 3 . 1 1 197 197 SER C C 197 174.133 174.133 173.836 0.297 18321 3572 1 3 . 1 1 197 197 SER CA C 197 58.128 58.128 57.947 0.181 18321 3573 1 3 . 1 1 197 197 SER CB C 197 62.966 62.966 62.710 0.256 18321 3574 1 3 . 1 1 198 198 TYR N N 198 121.435 121.435 118.390 3.045 18321 3575 1 3 . 1 1 198 198 TYR HA H 198 4.543 4.543 4.605 -0.062 18321 3576 1 3 . 1 1 198 198 TYR C C 198 176.230 176.230 176.550 -0.320 18321 3577 1 3 . 1 1 198 198 TYR CA C 198 57.536 57.536 57.757 -0.221 18321 3578 1 3 . 1 1 198 198 TYR CB C 198 38.279 38.279 39.009 -0.730 18321 3579 1 3 . 1 1 198 198 TYR H H 198 8.071 8.071 7.843 0.228 18321 3580 1 3 . 1 1 199 199 GLY N N 199 110.039 110.039 110.005 0.034 18321 3581 1 3 . 1 1 199 199 GLY C C 199 173.475 173.475 173.991 -0.516 18321 3582 1 3 . 1 1 199 199 GLY CA C 199 44.805 44.805 45.313 -0.508 18321 3583 1 3 . 1 1 199 199 GLY H H 199 8.162 8.162 8.270 -0.108 18321 3584 1 3 . 1 1 200 200 ILE N N 200 121.530 121.530 123.024 -1.494 18321 3585 1 3 . 1 1 200 200 ILE CA C 200 58.102 58.102 56.678 1.424 18321 3586 1 3 . 1 1 200 200 ILE CB C 200 37.760 37.760 39.633 -1.873 18321 3587 1 3 . 1 1 200 200 ILE H H 200 7.851 7.851 7.624 0.227 18321 3588 1 3 . 1 1 201 201 PRO C C 201 176.485 176.485 176.393 0.092 18321 3589 1 3 . 1 1 201 201 PRO CA C 201 53.893 53.893 62.624 -8.731 18321 3590 1 3 . 1 1 201 201 PRO CB C 201 29.042 29.042 31.246 -2.204 18321 3591 1 3 . 1 1 202 202 GLU N N 202 122.468 122.468 123.262 -0.794 18321 3592 1 3 . 1 1 202 202 GLU CA C 202 62.490 62.490 57.247 5.243 18321 3593 1 3 . 1 1 202 202 GLU CB C 202 31.170 31.170 27.828 3.342 18321 3594 1 3 . 1 1 202 202 GLU H H 202 8.328 8.328 8.742 -0.414 18321 3595 1 3 . 1 1 203 203 PRO CA C 203 62.803 62.803 63.209 -0.406 18321 3596 1 3 . 1 1 203 203 PRO CB C 203 31.220 31.220 32.169 -0.949 18321 3597 1 3 . 1 1 204 204 ALA N N 204 123.251 123.251 127.159 -3.908 18321 3598 1 3 . 1 1 204 204 ALA HA H 204 4.180 4.180 4.617 -0.437 18321 3599 1 3 . 1 1 204 204 ALA CA C 204 52.124 52.124 51.475 0.649 18321 3600 1 3 . 1 1 204 204 ALA CB C 204 18.892 18.892 20.785 -1.893 18321 3601 1 3 . 1 1 204 204 ALA H H 204 8.308 8.308 8.354 -0.046 18321 3602 1 3 . 1 1 205 205 HIS N N 205 117.874 117.874 119.775 -1.901 18321 3603 1 3 . 1 1 205 205 HIS C C 205 173.282 173.282 173.950 -0.668 18321 3604 1 3 . 1 1 205 205 HIS H H 205 8.045 8.045 8.008 0.037 18321 3605 1 3 . 1 1 206 206 ALA N N 206 125.519 125.519 125.453 0.066 18321 3606 1 3 . 1 1 206 206 ALA HA H 206 4.204 4.204 4.229 -0.025 18321 3607 1 3 . 1 1 206 206 ALA CA C 206 40.196 40.196 52.517 -12.321 18321 3608 1 3 . 1 1 206 206 ALA CB C 206 19.407 19.407 19.552 -0.145 18321 3609 1 3 . 1 1 206 206 ALA H H 206 8.061 8.061 8.551 -0.490 18321 3610 1 3 . 1 1 207 207 TYR N N 207 120.381 120.381 119.694 0.687 18321 3611 1 3 . 1 1 207 207 TYR HA H 207 4.570 4.570 4.677 -0.107 18321 3612 1 3 . 1 1 207 207 TYR CA C 207 52.572 52.572 57.114 -4.542 18321 3613 1 3 . 1 1 207 207 TYR CB C 207 41.333 41.333 39.838 1.495 18321 3614 1 3 . 1 1 207 207 TYR H H 207 8.199 8.199 7.930 0.269 18321 3615 1 3 . 1 1 208 208 ALA HA H 208 4.281 4.281 4.366 -0.085 18321 3616 1 3 . 1 1 208 208 ALA C C 208 177.736 177.736 177.145 0.591 18321 3617 1 3 . 1 1 208 208 ALA CA C 208 52.084 52.084 52.424 -0.340 18321 3618 1 3 . 1 1 208 208 ALA CB C 208 18.999 18.999 18.973 0.026 18321 3619 1 3 . 1 1 209 209 GLN N N 209 119.295 119.295 121.889 -2.594 18321 3620 1 3 . 1 1 209 209 GLN CA C 209 61.474 61.474 55.168 6.306 18321 3621 1 3 . 1 1 209 209 GLN CB C 209 32.039 32.039 28.690 3.349 18321 3622 1 3 . 1 1 209 209 GLN H H 209 8.125 8.125 8.595 -0.470 18321 3623 1 3 . 1 1 210 210 PRO HA H 210 4.395 4.395 4.208 0.187 18321 3624 1 3 . 1 1 210 210 PRO CA C 210 62.584 62.584 64.423 -1.839 18321 3625 1 3 . 1 1 211 211 GLN HA H 211 4.377 4.377 4.421 -0.044 18321 3626 1 3 . 1 1 211 211 GLN CA C 211 55.859 55.859 55.167 0.692 18321 3627 1 3 . 1 1 211 211 GLN CB C 211 29.577 29.577 28.316 1.261 18321 3628 1 3 . 1 1 212 212 THR C C 212 176.551 176.551 174.231 2.320 18321 3629 1 3 . 1 1 212 212 THR CB C 212 69.890 69.890 69.803 0.087 18321 3630 1 3 . 1 1 213 213 THR N N 213 108.487 108.487 116.196 -7.709 18321 3631 1 3 . 1 1 213 213 THR CA C 213 61.236 61.236 62.886 -1.650 18321 3632 1 3 . 1 1 213 213 THR CB C 213 69.091 69.091 69.965 -0.874 18321 3633 1 3 . 1 1 213 213 THR H H 213 8.243 8.243 7.739 0.504 18321 3634 1 3 . 1 1 214 214 THR N N 214 119.445 119.445 118.591 0.854 18321 3635 1 3 . 1 1 214 214 THR CA C 214 59.425 59.425 60.233 -0.808 18321 3636 1 3 . 1 1 214 214 THR CB C 214 69.251 69.251 69.478 -0.227 18321 3637 1 3 . 1 1 214 214 THR H H 214 8.188 8.188 7.779 0.409 18321 3638 1 3 . 1 1 215 215 PRO HA H 215 4.361 4.361 4.649 -0.288 18321 3639 1 3 . 1 1 215 215 PRO C C 215 175.422 175.422 175.760 -0.338 18321 3640 1 3 . 1 1 215 215 PRO CA C 215 63.320 63.320 62.907 0.413 18321 3641 1 3 . 1 1 215 215 PRO CB C 215 31.918 31.918 32.455 -0.537 18321 3642 1 3 . 1 1 216 216 LEU N N 216 121.602 121.602 123.000 -1.398 18321 3643 1 3 . 1 1 216 216 LEU CA C 216 52.203 52.203 55.758 -3.555 18321 3644 1 3 . 1 1 216 216 LEU CB C 216 42.451 42.451 40.480 1.970 18321 3645 1 3 . 1 1 216 216 LEU H H 216 7.891 7.891 8.281 -0.390 18321 3646 1 3 . 1 1 217 217 PRO HA H 217 4.398 4.398 4.454 -0.056 18321 3647 1 3 . 1 1 217 217 PRO C C 217 176.577 176.577 176.297 0.280 18321 3648 1 3 . 1 1 217 217 PRO CA C 217 62.984 62.984 63.351 -0.367 18321 3649 1 3 . 1 1 217 217 PRO CB C 217 32.056 32.056 31.690 0.366 18321 3650 1 3 . 1 1 218 218 ALA N N 218 124.087 124.087 120.567 3.520 18321 3651 1 3 . 1 1 218 218 ALA HA H 218 4.309 4.309 4.011 0.298 18321 3652 1 3 . 1 1 218 218 ALA C C 218 177.844 177.844 176.796 1.048 18321 3653 1 3 . 1 1 218 218 ALA CA C 218 52.379 52.379 52.857 -0.478 18321 3654 1 3 . 1 1 218 218 ALA CB C 218 19.133 19.133 18.566 0.567 18321 3655 1 3 . 1 1 218 218 ALA H H 218 8.261 8.261 7.922 0.339 18321 3656 1 3 . 1 1 219 219 VAL N N 219 118.942 118.942 118.703 0.239 18321 3657 1 3 . 1 1 219 219 VAL HA H 219 4.142 4.142 4.172 -0.030 18321 3658 1 3 . 1 1 219 219 VAL CA C 219 62.102 62.102 63.954 -1.852 18321 3659 1 3 . 1 1 219 219 VAL CB C 219 32.923 32.923 32.997 -0.074 18321 3660 1 3 . 1 1 219 219 VAL H H 219 8.049 8.049 8.308 -0.259 18321 3661 1 3 . 1 1 220 220 SER N N 220 119.207 119.207 116.005 3.202 18321 3662 1 3 . 1 1 220 220 SER HA H 220 4.436 4.436 4.642 -0.206 18321 3663 1 3 . 1 1 220 220 SER CA C 220 57.813 57.813 57.617 0.196 18321 3664 1 3 . 1 1 220 220 SER CB C 220 63.375 63.375 62.856 0.519 18321 3665 1 3 . 1 1 220 220 SER H H 220 8.275 8.275 8.011 0.265 18321 3666 1 3 . 1 1 221 221 GLY N N 221 110.973 110.973 116.209 -5.236 18321 3667 1 3 . 1 1 221 221 GLY C C 221 173.962 173.962 175.823 -1.861 18321 3668 1 3 . 1 1 221 221 GLY CA C 221 45.286 45.286 46.197 -0.910 18321 3669 1 3 . 1 1 221 221 GLY H H 221 8.374 8.374 8.905 -0.531 18321 3670 1 3 . 1 1 222 222 SER N N 222 115.516 115.516 118.411 -2.895 18321 3671 1 3 . 1 1 222 222 SER HA H 222 4.763 4.763 4.421 0.342 18321 3672 1 3 . 1 1 222 222 SER CA C 222 56.407 56.407 62.230 -5.823 18321 3673 1 3 . 1 1 222 222 SER CB C 222 63.993 63.993 62.395 1.598 18321 3674 1 3 . 1 1 222 222 SER H H 222 8.155 8.155 8.163 -0.008 18321 3675 1 3 . 1 1 223 223 PRO HA H 223 4.417 4.417 4.519 -0.102 18321 3676 1 3 . 1 1 223 223 PRO CA C 223 63.805 63.805 62.700 1.105 18321 3677 1 3 . 1 1 223 223 PRO CB C 223 32.090 32.090 30.422 1.667 18321 3678 1 3 . 1 1 224 224 GLY N N 224 109.149 109.149 108.340 0.809 18321 3679 1 3 . 1 1 224 224 GLY C C 224 173.813 173.813 173.488 0.325 18321 3680 1 3 . 1 1 224 224 GLY CA C 224 44.512 44.512 45.536 -1.024 18321 3681 1 3 . 1 1 224 224 GLY H H 224 8.376 8.376 7.608 0.768 18321 3682 1 3 . 1 1 225 225 ALA N N 225 123.599 123.599 123.619 -0.020 18321 3683 1 3 . 1 1 225 225 ALA C C 225 177.341 177.341 177.492 -0.151 18321 3684 1 3 . 1 1 225 225 ALA CA C 225 51.878 51.878 51.546 0.332 18321 3685 1 3 . 1 1 225 225 ALA CB C 225 19.169 19.169 18.795 0.374 18321 3686 1 3 . 1 1 225 225 ALA H H 225 7.959 7.959 8.085 -0.126 18321 3687 1 3 . 1 1 226 226 ALA N N 226 123.218 123.218 128.167 -4.949 18321 3688 1 3 . 1 1 226 226 ALA HA H 226 4.350 4.350 4.393 -0.043 18321 3689 1 3 . 1 1 226 226 ALA C C 226 177.520 177.520 177.414 0.106 18321 3690 1 3 . 1 1 226 226 ALA CA C 226 52.535 52.535 51.822 0.713 18321 3691 1 3 . 1 1 226 226 ALA CB C 226 19.171 19.171 19.511 -0.340 18321 3692 1 3 . 1 1 226 226 ALA H H 226 8.169 8.169 8.522 -0.353 18321 3693 1 3 . 1 1 227 227 ILE N N 227 120.086 120.086 121.484 -1.398 18321 3694 1 3 . 1 1 227 227 ILE HA H 227 4.201 4.201 4.277 -0.076 18321 3695 1 3 . 1 1 227 227 ILE C C 227 174.814 174.814 176.155 -1.341 18321 3696 1 3 . 1 1 227 227 ILE CA C 227 60.929 60.929 60.614 0.315 18321 3697 1 3 . 1 1 227 227 ILE CB C 227 38.872 38.872 37.943 0.929 18321 3698 1 3 . 1 1 227 227 ILE H H 227 8.037 8.037 8.244 -0.207 18321 3699 1 3 . 1 1 228 228 THR N N 228 117.224 117.224 124.138 -6.914 18321 3700 1 3 . 1 1 228 228 THR HA H 228 4.203 4.203 4.618 -0.415 18321 3701 1 3 . 1 1 228 228 THR CA C 228 57.108 57.108 59.814 -2.706 18321 3702 1 3 . 1 1 228 228 THR CB C 228 69.945 69.945 69.586 0.359 18321 3703 1 3 . 1 1 228 228 THR H H 228 7.775 7.775 8.524 -0.749 18321 3704 1 3 . 1 1 229 229 PRO HA H 229 4.750 4.750 4.466 0.284 18321 3705 1 3 . 1 1 229 229 PRO CA C 229 62.480 62.480 62.663 -0.183 18321 3706 1 3 . 1 1 229 229 PRO CB C 229 33.995 33.995 32.210 1.785 18321 3707 1 3 . 1 1 230 230 LEU N N 230 123.629 123.629 117.701 5.928 18321 3708 1 3 . 1 1 230 230 LEU CA C 230 53.076 53.076 54.721 -1.645 18321 3709 1 3 . 1 1 230 230 LEU CB C 230 40.608 40.608 40.954 -0.346 18321 3710 1 3 . 1 1 230 230 LEU H H 230 8.453 8.453 8.342 0.111 18321 3711 1 3 . 1 1 231 231 PRO HA H 231 4.412 4.412 4.309 0.103 18321 3712 1 3 . 1 1 231 231 PRO C C 231 176.571 176.571 177.440 -0.869 18321 3713 1 3 . 1 1 231 231 PRO CA C 231 63.225 63.225 64.104 -0.879 18321 3714 1 3 . 1 1 231 231 PRO CB C 231 31.191 31.191 32.169 -0.978 18321 3715 1 3 . 1 1 232 232 SER N N 232 115.169 115.169 110.736 4.433 18321 3716 1 3 . 1 1 232 232 SER HA H 232 4.450 4.450 4.530 -0.081 18321 3717 1 3 . 1 1 232 232 SER CA C 232 58.604 58.604 57.979 0.625 18321 3718 1 3 . 1 1 232 232 SER CB C 232 63.962 63.962 63.429 0.533 18321 3719 1 3 . 1 1 232 232 SER H H 232 8.280 8.280 7.767 0.513 18321 3720 1 3 . 1 1 233 233 THR N N 233 115.155 115.155 115.257 -0.102 18321 3721 1 3 . 1 1 233 233 THR HA H 233 4.351 4.351 4.574 -0.223 18321 3722 1 3 . 1 1 233 233 THR C C 233 177.237 177.237 173.956 3.281 18321 3723 1 3 . 1 1 233 233 THR CA C 233 61.939 61.939 62.330 -0.391 18321 3724 1 3 . 1 1 233 233 THR CB C 233 68.986 68.986 69.876 -0.890 18321 3725 1 3 . 1 1 233 233 THR H H 233 8.096 8.096 8.040 0.056 18321 3726 1 3 . 1 1 234 234 GLN N N 234 122.040 122.040 119.487 2.553 18321 3727 1 3 . 1 1 234 234 GLN HA H 234 4.681 4.681 4.199 0.482 18321 3728 1 3 . 1 1 234 234 GLN C C 234 176.177 176.177 174.579 1.598 18321 3729 1 3 . 1 1 234 234 GLN CA C 234 55.861 55.861 55.891 -0.030 18321 3730 1 3 . 1 1 234 234 GLN CB C 234 28.583 28.583 28.849 -0.266 18321 3731 1 3 . 1 1 234 234 GLN H H 234 8.256 8.256 8.137 0.119 18321 3732 1 3 . 1 1 235 235 ASN N N 235 119.506 119.506 118.810 0.696 18321 3733 1 3 . 1 1 235 235 ASN HA H 235 4.775 4.775 4.519 0.256 18321 3734 1 3 . 1 1 235 235 ASN C C 235 174.974 174.974 174.072 0.902 18321 3735 1 3 . 1 1 235 235 ASN CA C 235 53.191 53.191 53.990 -0.799 18321 3736 1 3 . 1 1 235 235 ASN CB C 235 38.511 38.511 38.040 0.471 18321 3737 1 3 . 1 1 235 235 ASN H H 235 8.346 8.346 8.481 -0.135 18321 3738 1 3 . 1 1 236 236 GLY N N 236 109.378 109.378 109.228 0.150 18321 3739 1 3 . 1 1 236 236 GLY CA C 236 44.023 44.023 44.258 -0.235 18321 3740 1 3 . 1 1 236 236 GLY H H 236 7.939 7.939 8.354 -0.415 18321 3741 1 3 . 1 1 237 237 PRO HA H 237 4.336 4.336 4.295 0.041 18321 3742 1 3 . 1 1 237 237 PRO C C 237 175.942 175.942 176.280 -0.338 18321 3743 1 3 . 1 1 237 237 PRO CA C 237 62.797 62.797 61.999 0.798 18321 3744 1 3 . 1 1 237 237 PRO CB C 237 27.421 27.421 31.804 -4.383 18321 3745 1 3 . 1 1 238 238 VAL N N 238 120.535 120.535 123.053 -2.518 18321 3746 1 3 . 1 1 238 238 VAL HA H 238 4.195 4.195 3.891 0.304 18321 3747 1 3 . 1 1 238 238 VAL C C 238 173.775 173.775 175.223 -1.448 18321 3748 1 3 . 1 1 238 238 VAL CA C 238 61.173 61.173 62.807 -1.634 18321 3749 1 3 . 1 1 238 238 VAL CB C 238 38.328 38.328 31.344 6.984 18321 3750 1 3 . 1 1 238 238 VAL H H 238 7.986 7.986 7.825 0.161 18321 3751 1 3 . 1 1 239 239 PHE N N 239 123.522 123.522 125.342 -1.820 18321 3752 1 3 . 1 1 239 239 PHE HA H 239 5.539 5.539 5.125 0.414 18321 3753 1 3 . 1 1 239 239 PHE C C 239 174.207 174.207 174.712 -0.505 18321 3754 1 3 . 1 1 239 239 PHE CA C 239 56.993 56.993 56.573 0.420 18321 3755 1 3 . 1 1 239 239 PHE CB C 239 41.743 41.743 40.245 1.498 18321 3756 1 3 . 1 1 239 239 PHE H H 239 8.927 8.927 8.840 0.087 18321 3757 1 3 . 1 1 240 240 ALA N N 240 120.871 120.871 126.908 -6.037 18321 3758 1 3 . 1 1 240 240 ALA HA H 240 5.352 5.352 5.250 0.102 18321 3759 1 3 . 1 1 240 240 ALA C C 240 174.639 174.639 175.740 -1.101 18321 3760 1 3 . 1 1 240 240 ALA CA C 240 49.736 49.736 50.456 -0.720 18321 3761 1 3 . 1 1 240 240 ALA CB C 240 23.480 23.480 21.549 1.931 18321 3762 1 3 . 1 1 240 240 ALA H H 240 9.398 9.398 9.034 0.364 18321 3763 1 3 . 1 1 241 241 LYS N N 241 121.227 121.227 126.354 -5.127 18321 3764 1 3 . 1 1 241 241 LYS HA H 241 5.373 5.373 5.198 0.175 18321 3765 1 3 . 1 1 241 241 LYS C C 241 176.772 176.772 176.175 0.597 18321 3766 1 3 . 1 1 241 241 LYS CA C 241 53.128 53.128 54.729 -1.601 18321 3767 1 3 . 1 1 241 241 LYS CB C 241 34.850 34.850 34.373 0.477 18321 3768 1 3 . 1 1 241 241 LYS H H 241 8.947 8.947 8.941 0.006 18321 3769 1 3 . 1 1 242 242 ALA N N 242 126.833 126.833 130.556 -3.723 18321 3770 1 3 . 1 1 242 242 ALA HA H 242 4.764 4.764 4.450 0.314 18321 3771 1 3 . 1 1 242 242 ALA C C 242 178.506 178.506 177.800 0.706 18321 3772 1 3 . 1 1 242 242 ALA CA C 242 52.788 52.788 52.013 0.775 18321 3773 1 3 . 1 1 242 242 ALA CB C 242 19.084 19.084 18.884 0.200 18321 3774 1 3 . 1 1 242 242 ALA H H 242 9.373 9.373 9.013 0.360 18321 3775 1 3 . 1 1 243 243 ILE N N 243 118.731 118.731 118.229 0.502 18321 3776 1 3 . 1 1 243 243 ILE HA H 243 4.454 4.454 4.102 0.352 18321 3777 1 3 . 1 1 243 243 ILE C C 243 174.773 174.773 175.471 -0.698 18321 3778 1 3 . 1 1 243 243 ILE CA C 243 60.613 60.613 61.902 -1.289 18321 3779 1 3 . 1 1 243 243 ILE CB C 243 39.232 39.232 37.476 1.756 18321 3780 1 3 . 1 1 243 243 ILE H H 243 8.933 8.933 8.096 0.837 18321 3781 1 3 . 1 1 244 244 GLN N N 244 121.616 121.616 117.674 3.942 18321 3782 1 3 . 1 1 244 244 GLN HA H 244 4.283 4.283 4.496 -0.213 18321 3783 1 3 . 1 1 244 244 GLN C C 244 172.815 172.815 173.851 -1.036 18321 3784 1 3 . 1 1 244 244 GLN CA C 244 54.750 54.750 53.637 1.113 18321 3785 1 3 . 1 1 244 244 GLN CB C 244 31.469 31.469 31.123 0.346 18321 3786 1 3 . 1 1 244 244 GLN H H 244 7.438 7.438 7.543 -0.105 18321 3787 1 3 . 1 1 245 245 LYS N N 245 124.215 124.215 122.206 2.009 18321 3788 1 3 . 1 1 245 245 LYS HA H 245 3.962 3.962 4.550 -0.588 18321 3789 1 3 . 1 1 245 245 LYS C C 245 175.679 175.679 176.280 -0.601 18321 3790 1 3 . 1 1 245 245 LYS CA C 245 56.413 56.413 56.057 0.356 18321 3791 1 3 . 1 1 245 245 LYS CB C 245 32.847 32.847 32.976 -0.129 18321 3792 1 3 . 1 1 245 245 LYS H H 245 8.318 8.318 8.525 -0.207 18321 3793 1 3 . 1 1 246 246 ARG N N 246 127.327 127.327 127.098 0.229 18321 3794 1 3 . 1 1 246 246 ARG HA H 246 4.221 4.221 4.630 -0.409 18321 3795 1 3 . 1 1 246 246 ARG CA C 246 56.279 56.279 55.287 0.992 18321 3796 1 3 . 1 1 246 246 ARG CB C 246 32.987 32.987 31.511 1.476 18321 3797 1 3 . 1 1 246 246 ARG H H 246 9.248 9.248 8.462 0.786 18321 3798 1 3 . 1 1 249 249 CYS HA H 249 4.260 4.260 4.352 -0.092 18321 3799 1 3 . 1 1 249 249 CYS CA C 249 55.886 55.886 57.166 -1.280 18321 3800 1 3 . 1 1 249 249 CYS CB C 249 34.146 34.146 29.417 4.729 18321 3801 1 3 . 1 1 250 250 ALA HA H 250 3.926 3.926 4.043 -0.117 18321 3802 1 3 . 1 1 250 250 ALA CA C 250 54.344 54.344 54.578 -0.233 18321 3803 1 3 . 1 1 250 250 ALA CB C 250 18.342 18.342 18.641 -0.299 18321 3804 1 3 . 1 1 251 251 TYR N N 251 110.618 110.618 111.924 -1.306 18321 3805 1 3 . 1 1 251 251 TYR HA H 251 4.489 4.489 4.767 -0.278 18321 3806 1 3 . 1 1 251 251 TYR C C 251 175.286 175.286 175.143 0.143 18321 3807 1 3 . 1 1 251 251 TYR CA C 251 56.137 56.137 55.168 0.969 18321 3808 1 3 . 1 1 251 251 TYR CB C 251 37.203 37.203 37.715 -0.512 18321 3809 1 3 . 1 1 251 251 TYR H H 251 7.037 7.037 7.376 -0.339 18321 3810 1 3 . 1 1 252 252 ASP N N 252 121.835 121.835 123.003 -1.168 18321 3811 1 3 . 1 1 252 252 ASP HA H 252 4.763 4.763 4.921 -0.158 18321 3812 1 3 . 1 1 252 252 ASP CA C 252 52.351 52.351 53.562 -1.211 18321 3813 1 3 . 1 1 252 252 ASP CB C 252 39.995 39.995 39.892 0.103 18321 3814 1 3 . 1 1 252 252 ASP H H 252 7.339 7.339 7.654 -0.315 18321 3815 1 3 . 1 1 253 253 LYS N N 253 123.177 123.177 121.375 1.802 18321 3816 1 3 . 1 1 253 253 LYS HA H 253 4.270 4.270 4.105 0.165 18321 3817 1 3 . 1 1 253 253 LYS C C 253 177.724 177.724 177.388 0.336 18321 3818 1 3 . 1 1 253 253 LYS CA C 253 57.036 57.036 58.333 -1.297 18321 3819 1 3 . 1 1 253 253 LYS H H 253 8.396 8.396 8.171 0.225 18321 3820 1 3 . 1 1 254 254 THR N N 254 108.317 108.317 110.181 -1.864 18321 3821 1 3 . 1 1 254 254 THR HA H 254 4.517 4.517 4.324 0.193 18321 3822 1 3 . 1 1 254 254 THR C C 254 174.012 174.012 173.396 0.616 18321 3823 1 3 . 1 1 254 254 THR CA C 254 61.036 61.036 61.573 -0.537 18321 3824 1 3 . 1 1 254 254 THR CB C 254 69.307 69.307 68.025 1.282 18321 3825 1 3 . 1 1 254 254 THR H H 254 8.217 8.217 8.284 -0.067 18321 3826 1 3 . 1 1 255 255 ALA N N 255 124.762 124.762 124.670 0.092 18321 3827 1 3 . 1 1 255 255 ALA HA H 255 4.524 4.524 4.985 -0.461 18321 3828 1 3 . 1 1 255 255 ALA C C 255 176.630 176.630 176.022 0.608 18321 3829 1 3 . 1 1 255 255 ALA CA C 255 51.352 51.352 49.997 1.355 18321 3830 1 3 . 1 1 255 255 ALA CB C 255 20.135 20.135 20.355 -0.220 18321 3831 1 3 . 1 1 255 255 ALA H H 255 7.096 7.096 7.341 -0.245 18321 3832 1 3 . 1 1 256 256 LEU N N 256 124.379 124.379 126.008 -1.629 18321 3833 1 3 . 1 1 256 256 LEU HA H 256 4.328 4.328 4.446 -0.118 18321 3834 1 3 . 1 1 256 256 LEU C C 256 176.007 176.007 175.588 0.419 18321 3835 1 3 . 1 1 256 256 LEU CA C 256 53.502 53.502 54.474 -0.972 18321 3836 1 3 . 1 1 256 256 LEU CB C 256 44.665 44.665 44.069 0.596 18321 3837 1 3 . 1 1 256 256 LEU H H 256 8.889 8.889 8.005 0.884 18321 3838 1 3 . 1 1 257 257 ALA N N 257 129.619 129.619 126.679 2.940 18321 3839 1 3 . 1 1 257 257 ALA HA H 257 4.445 4.445 5.453 -1.008 18321 3840 1 3 . 1 1 257 257 ALA C C 257 176.813 176.813 176.611 0.202 18321 3841 1 3 . 1 1 257 257 ALA CA C 257 51.179 51.179 50.834 0.345 18321 3842 1 3 . 1 1 257 257 ALA CB C 257 18.973 18.973 19.798 -0.825 18321 3843 1 3 . 1 1 257 257 ALA H H 257 8.529 8.529 8.210 0.319 18321 3844 1 3 . 1 1 258 258 LEU N N 258 119.300 119.300 124.124 -4.824 18321 3845 1 3 . 1 1 258 258 LEU HA H 258 4.782 4.782 4.664 0.118 18321 3846 1 3 . 1 1 258 258 LEU CA C 258 53.259 53.259 53.672 -0.413 18321 3847 1 3 . 1 1 258 258 LEU CB C 258 45.972 45.972 46.180 -0.208 18321 3848 1 3 . 1 1 258 258 LEU H H 258 8.505 8.505 8.402 0.103 18321 3849 1 3 . 1 1 259 259 GLU N N 259 123.919 123.919 121.202 2.717 18321 3850 1 3 . 1 1 259 259 GLU HA H 259 4.516 4.516 4.509 0.007 18321 3851 1 3 . 1 1 259 259 GLU C C 259 175.795 175.795 175.994 -0.199 18321 3852 1 3 . 1 1 259 259 GLU CA C 259 52.896 52.896 53.929 -1.033 18321 3853 1 3 . 1 1 259 259 GLU H H 259 8.943 8.943 8.257 0.686 18321 3854 1 3 . 1 1 260 260 VAL N N 260 122.122 122.122 119.961 2.161 18321 3855 1 3 . 1 1 260 260 VAL HA H 260 2.923 2.923 4.121 -1.198 18321 3856 1 3 . 1 1 260 260 VAL C C 260 177.964 177.964 177.144 0.820 18321 3857 1 3 . 1 1 260 260 VAL CA C 260 65.417 65.417 63.340 2.077 18321 3858 1 3 . 1 1 260 260 VAL CB C 260 30.668 30.668 31.158 -0.490 18321 3859 1 3 . 1 1 260 260 VAL H H 260 8.956 8.956 8.397 0.559 18321 3860 1 3 . 1 1 261 261 GLY N N 261 116.009 116.009 117.082 -1.073 18321 3861 1 3 . 1 1 261 261 GLY C C 261 176.288 176.288 174.169 2.119 18321 3862 1 3 . 1 1 261 261 GLY CA C 261 44.210 44.210 44.840 -0.630 18321 3863 1 3 . 1 1 261 261 GLY H H 261 8.799 8.799 9.201 -0.402 18321 3864 1 3 . 1 1 262 262 ASP N N 262 121.945 121.945 121.073 0.872 18321 3865 1 3 . 1 1 262 262 ASP HA H 262 4.423 4.423 4.718 -0.295 18321 3866 1 3 . 1 1 262 262 ASP C C 262 175.381 175.381 174.945 0.436 18321 3867 1 3 . 1 1 262 262 ASP CA C 262 55.243 55.243 54.005 1.238 18321 3868 1 3 . 1 1 262 262 ASP CB C 262 41.819 41.819 42.117 -0.298 18321 3869 1 3 . 1 1 262 262 ASP H H 262 8.180 8.180 7.705 0.475 18321 3870 1 3 . 1 1 263 263 ILE N N 263 121.452 121.452 123.955 -2.503 18321 3871 1 3 . 1 1 263 263 ILE HA H 263 4.707 4.707 4.417 0.290 18321 3872 1 3 . 1 1 263 263 ILE C C 263 174.996 174.996 175.867 -0.871 18321 3873 1 3 . 1 1 263 263 ILE CA C 263 59.289 59.289 59.350 -0.061 18321 3874 1 3 . 1 1 263 263 ILE CB C 263 36.987 36.987 37.520 -0.533 18321 3875 1 3 . 1 1 263 263 ILE H H 263 8.460 8.460 8.552 -0.092 18321 3876 1 3 . 1 1 264 264 VAL N N 264 128.756 128.756 130.066 -1.310 18321 3877 1 3 . 1 1 264 264 VAL HA H 264 4.309 4.309 3.971 0.338 18321 3878 1 3 . 1 1 264 264 VAL C C 264 175.486 175.486 174.864 0.622 18321 3879 1 3 . 1 1 264 264 VAL CA C 264 59.091 59.091 62.077 -2.986 18321 3880 1 3 . 1 1 264 264 VAL CB C 264 34.541 34.541 31.250 3.291 18321 3881 1 3 . 1 1 264 264 VAL H H 264 9.479 9.479 9.184 0.295 18321 3882 1 3 . 1 1 265 265 LYS N N 265 128.101 128.101 129.554 -1.453 18321 3883 1 3 . 1 1 265 265 LYS HA H 265 4.342 4.342 4.373 -0.031 18321 3884 1 3 . 1 1 265 265 LYS C C 265 175.531 175.531 174.920 0.611 18321 3885 1 3 . 1 1 265 265 LYS CA C 265 55.620 55.620 55.608 0.012 18321 3886 1 3 . 1 1 265 265 LYS CB C 265 33.149 33.149 32.473 0.676 18321 3887 1 3 . 1 1 265 265 LYS H H 265 8.715 8.715 8.441 0.274 18321 3888 1 3 . 1 1 266 266 VAL N N 266 129.537 129.537 126.961 2.576 18321 3889 1 3 . 1 1 266 266 VAL HA H 266 4.333 4.333 4.400 -0.067 18321 3890 1 3 . 1 1 266 266 VAL C C 266 176.166 176.166 175.254 0.912 18321 3891 1 3 . 1 1 266 266 VAL CA C 266 63.339 63.339 60.735 2.604 18321 3892 1 3 . 1 1 266 266 VAL CB C 266 30.712 30.712 33.666 -2.954 18321 3893 1 3 . 1 1 266 266 VAL H H 266 9.073 9.073 7.670 1.403 18321 3894 1 3 . 1 1 267 267 THR N N 267 120.020 120.020 122.762 -2.742 18321 3895 1 3 . 1 1 267 267 THR HA H 267 4.189 4.189 4.409 -0.220 18321 3896 1 3 . 1 1 267 267 THR C C 267 176.054 176.054 175.301 0.753 18321 3897 1 3 . 1 1 267 267 THR CA C 267 62.204 62.204 62.999 -0.795 18321 3898 1 3 . 1 1 267 267 THR CB C 267 68.200 68.200 69.569 -1.369 18321 3899 1 3 . 1 1 267 267 THR H H 267 9.130 9.130 8.398 0.732 18321 3900 1 3 . 1 1 268 268 ARG N N 268 120.839 120.839 121.986 -1.147 18321 3901 1 3 . 1 1 268 268 ARG HA H 268 4.236 4.236 4.668 -0.432 18321 3902 1 3 . 1 1 268 268 ARG CA C 268 56.321 56.321 55.138 1.183 18321 3903 1 3 . 1 1 268 268 ARG CB C 268 33.049 33.049 33.168 -0.119 18321 3904 1 3 . 1 1 268 268 ARG H H 268 7.631 7.631 7.758 -0.127 18321 3905 1 3 . 1 1 269 269 MET N N 269 125.443 125.443 122.908 2.535 18321 3906 1 3 . 1 1 269 269 MET C C 269 174.392 174.392 174.832 -0.440 18321 3907 1 3 . 1 1 269 269 MET H H 269 8.532 8.532 8.522 0.010 18321 3908 1 3 . 1 1 270 270 ASN N N 270 119.125 119.125 122.969 -3.844 18321 3909 1 3 . 1 1 270 270 ASN HA H 270 4.546 4.546 4.846 -0.300 18321 3910 1 3 . 1 1 270 270 ASN C C 270 172.133 172.133 174.892 -2.759 18321 3911 1 3 . 1 1 270 270 ASN CA C 270 53.639 53.639 52.286 1.353 18321 3912 1 3 . 1 1 270 270 ASN CB C 270 39.845 39.845 39.227 0.618 18321 3913 1 3 . 1 1 270 270 ASN H H 270 6.631 6.631 8.826 -2.195 18321 3914 1 3 . 1 1 271 271 ILE N N 271 122.532 122.532 125.791 -3.259 18321 3915 1 3 . 1 1 271 271 ILE HA H 271 4.417 4.417 4.115 0.302 18321 3916 1 3 . 1 1 271 271 ILE CA C 271 63.348 63.348 61.488 1.860 18321 3917 1 3 . 1 1 271 271 ILE CB C 271 38.198 38.198 34.814 3.384 18321 3918 1 3 . 1 1 271 271 ILE H H 271 8.565 8.565 8.790 -0.225 18321 3919 1 3 . 1 1 272 272 ASN HA H 272 4.527 4.527 4.801 -0.274 18321 3920 1 3 . 1 1 272 272 ASN C C 272 176.259 176.259 176.073 0.186 18321 3921 1 3 . 1 1 272 272 ASN CA C 272 53.225 53.225 53.616 -0.391 18321 3922 1 3 . 1 1 272 272 ASN CB C 272 37.565 37.565 40.486 -2.921 18321 3923 1 3 . 1 1 273 273 GLY N N 273 107.043 107.043 111.047 -4.004 18321 3924 1 3 . 1 1 273 273 GLY C C 273 173.216 173.216 172.095 1.121 18321 3925 1 3 . 1 1 273 273 GLY CA C 273 45.299 45.299 45.414 -0.115 18321 3926 1 3 . 1 1 273 273 GLY H H 273 8.086 8.086 8.135 -0.049 18321 3927 1 3 . 1 1 274 274 GLN N N 274 120.624 120.624 116.320 4.304 18321 3928 1 3 . 1 1 274 274 GLN HA H 274 4.551 4.551 4.409 0.142 18321 3929 1 3 . 1 1 274 274 GLN C C 274 175.039 175.039 174.337 0.702 18321 3930 1 3 . 1 1 274 274 GLN CA C 274 54.556 54.556 54.505 0.051 18321 3931 1 3 . 1 1 274 274 GLN CB C 274 33.698 33.698 30.977 2.721 18321 3932 1 3 . 1 1 274 274 GLN H H 274 8.045 8.045 7.649 0.396 18321 3933 1 3 . 1 1 275 275 TRP N N 275 125.596 125.596 124.397 1.199 18321 3934 1 3 . 1 1 275 275 TRP HA H 275 4.588 4.588 4.911 -0.323 18321 3935 1 3 . 1 1 275 275 TRP C C 275 172.832 172.832 175.140 -2.308 18321 3936 1 3 . 1 1 275 275 TRP CA C 275 55.296 55.296 54.660 0.636 18321 3937 1 3 . 1 1 275 275 TRP CB C 275 31.393 31.393 30.563 0.830 18321 3938 1 3 . 1 1 275 275 TRP H H 275 8.484 8.484 8.569 -0.085 18321 3939 1 3 . 1 1 276 276 GLU N N 276 119.012 119.012 121.021 -2.009 18321 3940 1 3 . 1 1 276 276 GLU HA H 276 5.190 5.190 4.735 0.455 18321 3941 1 3 . 1 1 276 276 GLU C C 276 176.553 176.553 175.344 1.209 18321 3942 1 3 . 1 1 276 276 GLU CA C 276 54.288 54.288 55.288 -1.000 18321 3943 1 3 . 1 1 276 276 GLU CB C 276 32.851 32.851 31.604 1.247 18321 3944 1 3 . 1 1 276 276 GLU H H 276 8.643 8.643 8.939 -0.296 18321 3945 1 3 . 1 1 277 277 GLY N N 277 111.364 111.364 112.896 -1.532 18321 3946 1 3 . 1 1 277 277 GLY C C 277 170.707 170.707 171.929 -1.222 18321 3947 1 3 . 1 1 277 277 GLY CA C 277 46.723 46.723 44.581 2.142 18321 3948 1 3 . 1 1 277 277 GLY H H 277 9.072 9.072 8.155 0.917 18321 3949 1 3 . 1 1 278 278 GLU N N 278 117.733 117.733 125.048 -7.315 18321 3950 1 3 . 1 1 278 278 GLU HA H 278 5.748 5.748 5.198 0.550 18321 3951 1 3 . 1 1 278 278 GLU C C 278 176.051 176.051 175.207 0.844 18321 3952 1 3 . 1 1 278 278 GLU CA C 278 53.620 53.620 54.933 -1.313 18321 3953 1 3 . 1 1 278 278 GLU CB C 278 33.742 33.742 31.802 1.940 18321 3954 1 3 . 1 1 278 278 GLU H H 278 8.810 8.810 8.069 0.741 18321 3955 1 3 . 1 1 279 279 VAL N N 279 123.834 123.834 125.730 -1.896 18321 3956 1 3 . 1 1 279 279 VAL HA H 279 4.404 4.404 4.215 0.189 18321 3957 1 3 . 1 1 279 279 VAL C C 279 175.289 175.289 176.825 -1.536 18321 3958 1 3 . 1 1 279 279 VAL CA C 279 61.166 61.166 63.329 -2.163 18321 3959 1 3 . 1 1 279 279 VAL CB C 279 34.123 34.123 33.113 1.010 18321 3960 1 3 . 1 1 279 279 VAL H H 279 8.887 8.887 8.126 0.761 18321 3961 1 3 . 1 1 280 280 ASN N N 280 126.025 126.025 118.863 7.162 18321 3962 1 3 . 1 1 280 280 ASN HA H 280 4.435 4.435 4.701 -0.266 18321 3963 1 3 . 1 1 280 280 ASN C C 280 175.205 175.205 175.744 -0.539 18321 3964 1 3 . 1 1 280 280 ASN CA C 280 45.615 45.615 53.100 -7.486 18321 3965 1 3 . 1 1 280 280 ASN CB C 280 37.386 37.386 36.572 0.814 18321 3966 1 3 . 1 1 280 280 ASN H H 280 9.322 9.322 8.627 0.695 18321 3967 1 3 . 1 1 281 281 GLY N N 281 104.588 104.588 108.101 -3.513 18321 3968 1 3 . 1 1 281 281 GLY C C 281 173.944 173.944 173.240 0.704 18321 3969 1 3 . 1 1 281 281 GLY CA C 281 45.224 45.224 45.934 -0.710 18321 3970 1 3 . 1 1 281 281 GLY H H 281 8.768 8.768 8.169 0.599 18321 3971 1 3 . 1 1 282 282 ARG N N 282 122.567 122.567 118.946 3.621 18321 3972 1 3 . 1 1 282 282 ARG HA H 282 4.559 4.559 4.543 0.016 18321 3973 1 3 . 1 1 282 282 ARG C C 282 174.350 174.350 174.557 -0.207 18321 3974 1 3 . 1 1 282 282 ARG CA C 282 54.933 54.933 54.622 0.311 18321 3975 1 3 . 1 1 282 282 ARG CB C 282 31.765 31.765 33.559 -1.794 18321 3976 1 3 . 1 1 282 282 ARG H H 282 8.149 8.149 7.816 0.333 18321 3977 1 3 . 1 1 283 283 LYS N N 283 121.565 121.565 123.814 -2.249 18321 3978 1 3 . 1 1 283 283 LYS HA H 283 5.584 5.584 5.164 0.420 18321 3979 1 3 . 1 1 283 283 LYS CA C 283 54.143 54.143 55.487 -1.344 18321 3980 1 3 . 1 1 283 283 LYS CB C 283 36.040 36.040 33.475 2.565 18321 3981 1 3 . 1 1 283 283 LYS H H 283 8.424 8.424 8.640 -0.216 18321 3982 1 3 . 1 1 284 284 GLY C C 284 173.006 173.006 172.612 0.394 18321 3983 1 3 . 1 1 284 284 GLY CA C 284 45.886 45.886 44.591 1.295 18321 3984 1 3 . 1 1 285 285 LEU N N 285 119.673 119.673 121.775 -2.102 18321 3985 1 3 . 1 1 285 285 LEU HA H 285 5.718 5.718 5.139 0.579 18321 3986 1 3 . 1 1 285 285 LEU C C 285 178.657 178.657 176.291 2.366 18321 3987 1 3 . 1 1 285 285 LEU CA C 285 53.656 53.656 54.029 -0.373 18321 3988 1 3 . 1 1 285 285 LEU CB C 285 44.813 44.813 43.158 1.655 18321 3989 1 3 . 1 1 285 285 LEU H H 285 8.734 8.734 8.840 -0.106 18321 3990 1 3 . 1 1 286 286 PHE N N 286 118.785 118.785 119.353 -0.568 18321 3991 1 3 . 1 1 286 286 PHE HA H 286 4.521 4.521 4.918 -0.397 18321 3992 1 3 . 1 1 286 286 PHE CA C 286 57.592 57.592 53.952 3.640 18321 3993 1 3 . 1 1 286 286 PHE CB C 286 40.669 40.669 39.557 1.111 18321 3994 1 3 . 1 1 286 286 PHE H H 286 9.120 9.120 8.184 0.935 18321 3995 1 3 . 1 1 287 287 PRO HA H 287 4.385 4.385 3.915 0.470 18321 3996 1 3 . 1 1 287 287 PRO CA C 287 62.814 62.814 62.203 0.611 18321 3997 1 3 . 1 1 287 287 PRO CB C 287 32.133 32.133 31.512 0.621 18321 3998 1 3 . 1 1 288 288 PHE C C 288 174.837 174.837 177.308 -2.471 18321 3999 1 3 . 1 1 288 288 PHE CA C 288 59.020 59.020 60.225 -1.205 18321 4000 1 3 . 1 1 288 288 PHE CB C 288 34.987 34.987 36.055 -1.068 18321 4001 1 3 . 1 1 289 289 THR N N 289 107.865 107.865 114.930 -7.065 18321 4002 1 3 . 1 1 289 289 THR HA H 289 3.589 3.589 4.306 -0.717 18321 4003 1 3 . 1 1 289 289 THR C C 289 176.125 176.125 175.585 0.540 18321 4004 1 3 . 1 1 289 289 THR CA C 289 62.243 62.243 65.627 -3.384 18321 4005 1 3 . 1 1 289 289 THR CB C 289 69.365 69.365 68.772 0.593 18321 4006 1 3 . 1 1 289 289 THR H H 289 6.453 6.453 8.293 -1.840 18321 4007 1 3 . 1 1 290 290 HIS N N 290 119.462 119.462 116.726 2.736 18321 4008 1 3 . 1 1 290 290 HIS HA H 290 4.196 4.196 4.908 -0.712 18321 4009 1 3 . 1 1 290 290 HIS C C 290 175.165 175.165 174.668 0.497 18321 4010 1 3 . 1 1 290 290 HIS CA C 290 57.635 57.635 56.235 1.400 18321 4011 1 3 . 1 1 290 290 HIS CB C 290 29.840 29.840 30.180 -0.340 18321 4012 1 3 . 1 1 290 290 HIS H H 290 7.835 7.835 8.171 -0.336 18321 4013 1 3 . 1 1 291 291 VAL N N 291 110.050 110.050 112.890 -2.840 18321 4014 1 3 . 1 1 291 291 VAL HA H 291 5.445 5.445 4.804 0.641 18321 4015 1 3 . 1 1 291 291 VAL C C 291 173.386 173.386 174.564 -1.178 18321 4016 1 3 . 1 1 291 291 VAL CA C 291 57.794 57.794 58.829 -1.035 18321 4017 1 3 . 1 1 291 291 VAL CB C 291 35.784 35.784 34.830 0.954 18321 4018 1 3 . 1 1 291 291 VAL H H 291 7.562 7.562 7.680 -0.118 18321 4019 1 3 . 1 1 292 292 LYS N N 292 119.445 119.445 121.844 -2.399 18321 4020 1 3 . 1 1 292 292 LYS HA H 292 4.857 4.857 4.718 0.139 18321 4021 1 3 . 1 1 292 292 LYS C C 292 176.512 176.512 175.202 1.310 18321 4022 1 3 . 1 1 292 292 LYS CA C 292 54.647 54.647 54.767 -0.120 18321 4023 1 3 . 1 1 292 292 LYS CB C 292 35.665 35.665 35.569 0.096 18321 4024 1 3 . 1 1 292 292 LYS H H 292 8.753 8.753 8.403 0.350 18321 4025 1 3 . 1 1 293 293 ILE N N 293 128.707 128.707 127.678 1.029 18321 4026 1 3 . 1 1 293 293 ILE HA H 293 4.509 4.509 4.835 -0.326 18321 4027 1 3 . 1 1 293 293 ILE C C 293 175.666 175.666 175.819 -0.153 18321 4028 1 3 . 1 1 293 293 ILE CA C 293 62.563 62.563 61.886 0.677 18321 4029 1 3 . 1 1 293 293 ILE CB C 293 38.076 38.076 39.513 -1.437 18321 4030 1 3 . 1 1 293 293 ILE H H 293 9.107 9.107 8.876 0.231 18321 4031 1 3 . 1 1 294 294 PHE N N 294 126.638 126.638 125.562 1.076 18321 4032 1 3 . 1 1 294 294 PHE HA H 294 4.898 4.898 4.841 0.057 18321 4033 1 3 . 1 1 294 294 PHE C C 294 175.838 175.838 173.025 2.813 18321 4034 1 3 . 1 1 294 294 PHE CA C 294 56.335 56.335 55.867 0.468 18321 4035 1 3 . 1 1 294 294 PHE CB C 294 41.196 41.196 40.241 0.955 18321 4036 1 3 . 1 1 294 294 PHE H H 294 8.716 8.716 8.640 0.076 18321 4037 1 3 . 1 1 295 295 ASP N N 295 122.961 122.961 122.554 0.407 18321 4038 1 3 . 1 1 295 295 ASP HA H 295 5.003 5.003 4.758 0.245 18321 4039 1 3 . 1 1 295 295 ASP CA C 295 50.602 50.602 52.288 -1.686 18321 4040 1 3 . 1 1 295 295 ASP CB C 295 40.754 40.754 41.129 -0.374 18321 4041 1 3 . 1 1 295 295 ASP H H 295 8.418 8.418 8.489 -0.071 18321 4042 1 3 . 1 1 296 296 PRO HA H 296 4.524 4.524 4.153 0.371 18321 4043 1 3 . 1 1 296 296 PRO C C 296 176.807 176.807 176.855 -0.048 18321 4044 1 3 . 1 1 296 296 PRO CA C 296 62.987 62.987 63.864 -0.877 18321 4045 1 3 . 1 1 296 296 PRO CB C 296 32.033 32.033 32.188 -0.155 18321 4046 1 3 . 1 1 297 297 GLN N N 297 120.729 120.729 117.676 3.053 18321 4047 1 3 . 1 1 297 297 GLN HA H 297 4.274 4.274 4.247 0.027 18321 4048 1 3 . 1 1 297 297 GLN CA C 297 56.427 56.427 55.868 0.559 18321 4049 1 3 . 1 1 297 297 GLN CB C 297 28.819 28.819 29.962 -1.143 18321 4050 1 3 . 1 1 297 297 GLN H H 297 8.551 8.551 7.715 0.836 18321 4051 1 3 . 1 1 299 299 PRO C C 299 176.936 176.936 176.820 0.116 18321 4052 1 3 . 1 1 299 299 PRO CA C 299 63.406 63.406 63.269 0.137 18321 4053 1 3 . 1 1 299 299 PRO CB C 299 31.421 31.421 31.833 -0.412 18321 4054 1 3 . 1 1 300 300 ASP N N 300 119.609 119.609 121.693 -2.084 18321 4055 1 3 . 1 1 300 300 ASP C C 300 176.344 176.344 176.923 -0.579 18321 4056 1 3 . 1 1 300 300 ASP CA C 300 54.178 54.178 56.389 -2.211 18321 4057 1 3 . 1 1 300 300 ASP CB C 300 40.661 40.661 41.155 -0.494 18321 4058 1 3 . 1 1 300 300 ASP H H 300 8.239 8.239 8.292 -0.053 18321 4059 1 3 . 1 1 301 301 GLU N N 301 120.462 120.462 118.472 1.990 18321 4060 1 3 . 1 1 301 301 GLU CA C 301 56.188 56.188 55.653 0.535 18321 4061 1 3 . 1 1 301 301 GLU CB C 301 29.507 29.507 28.637 0.870 18321 4062 1 3 . 1 1 301 301 GLU H H 301 8.084 8.084 8.419 -0.335 18321 4063 1 4 . 1 1 2 2 SER HA H 2 4.521 4.521 4.697 -0.176 18321 4064 1 4 . 1 1 2 2 SER CA C 2 58.326 58.326 58.362 -0.036 18321 4065 1 4 . 1 1 2 2 SER CB C 2 64.062 64.062 65.085 -1.023 18321 4066 1 4 . 1 1 3 3 SER HA H 3 4.465 4.465 4.326 0.139 18321 4067 1 4 . 1 1 3 3 SER C C 3 173.887 173.887 173.610 0.277 18321 4068 1 4 . 1 1 3 3 SER CA C 3 58.374 58.374 59.640 -1.266 18321 4069 1 4 . 1 1 3 3 SER CB C 3 63.920 63.920 63.590 0.330 18321 4070 1 4 . 1 1 4 4 ALA N N 4 124.755 124.755 123.478 1.277 18321 4071 1 4 . 1 1 4 4 ALA HA H 4 4.547 4.547 4.591 -0.044 18321 4072 1 4 . 1 1 4 4 ALA CA C 4 52.737 52.737 52.285 0.452 18321 4073 1 4 . 1 1 4 4 ALA CB C 4 19.636 19.636 18.631 1.006 18321 4074 1 4 . 1 1 4 4 ALA H H 4 8.244 8.244 8.006 0.238 18321 4075 1 4 . 1 1 5 5 ARG N N 5 120.383 120.383 128.262 -7.879 18321 4076 1 4 . 1 1 5 5 ARG HA H 5 4.524 4.524 4.646 -0.122 18321 4077 1 4 . 1 1 5 5 ARG C C 5 175.611 175.611 174.204 1.407 18321 4078 1 4 . 1 1 5 5 ARG CA C 5 56.082 56.082 55.550 0.532 18321 4079 1 4 . 1 1 5 5 ARG CB C 5 30.695 30.695 31.156 -0.461 18321 4080 1 4 . 1 1 5 5 ARG H H 5 8.727 8.727 8.242 0.485 18321 4081 1 4 . 1 1 6 6 PHE N N 6 115.159 115.159 120.612 -5.453 18321 4082 1 4 . 1 1 6 6 PHE HA H 6 4.786 4.786 4.745 0.041 18321 4083 1 4 . 1 1 6 6 PHE C C 6 172.076 172.076 173.322 -1.246 18321 4084 1 4 . 1 1 6 6 PHE CA C 6 56.640 56.640 55.800 0.840 18321 4085 1 4 . 1 1 6 6 PHE CB C 6 40.378 40.378 40.943 -0.565 18321 4086 1 4 . 1 1 6 6 PHE H H 6 7.536 7.536 7.692 -0.156 18321 4087 1 4 . 1 1 7 7 ASP N N 7 121.846 121.846 121.976 -0.130 18321 4088 1 4 . 1 1 7 7 ASP HA H 7 4.846 4.846 4.750 0.096 18321 4089 1 4 . 1 1 7 7 ASP CA C 7 52.327 52.327 54.008 -1.681 18321 4090 1 4 . 1 1 7 7 ASP CB C 7 41.298 41.298 41.960 -0.662 18321 4091 1 4 . 1 1 7 7 ASP H H 7 9.062 9.062 8.743 0.319 18321 4092 1 4 . 1 1 8 8 SER HA H 8 3.950 3.950 4.252 -0.302 18321 4093 1 4 . 1 1 8 8 SER C C 8 174.705 174.705 175.389 -0.684 18321 4094 1 4 . 1 1 8 8 SER CA C 8 61.937 61.937 60.337 1.600 18321 4095 1 4 . 1 1 8 8 SER CB C 8 62.260 62.260 63.265 -1.005 18321 4096 1 4 . 1 1 9 9 SER N N 9 114.373 114.373 115.951 -1.578 18321 4097 1 4 . 1 1 9 9 SER HA H 9 4.529 4.529 4.766 -0.237 18321 4098 1 4 . 1 1 9 9 SER C C 9 175.089 175.089 174.094 0.995 18321 4099 1 4 . 1 1 9 9 SER CA C 9 59.851 59.851 59.667 0.184 18321 4100 1 4 . 1 1 9 9 SER CB C 9 64.246 64.246 64.129 0.117 18321 4101 1 4 . 1 1 9 9 SER H H 9 8.722 8.722 8.290 0.432 18321 4102 1 4 . 1 1 10 10 ASP N N 10 121.818 121.818 123.570 -1.752 18321 4103 1 4 . 1 1 10 10 ASP HA H 10 4.730 4.730 4.513 0.217 18321 4104 1 4 . 1 1 10 10 ASP C C 10 174.455 174.455 176.658 -2.203 18321 4105 1 4 . 1 1 10 10 ASP CA C 10 52.432 52.432 54.069 -1.637 18321 4106 1 4 . 1 1 10 10 ASP CB C 10 39.607 39.607 40.536 -0.929 18321 4107 1 4 . 1 1 10 10 ASP H H 10 7.600 7.600 8.180 -0.580 18321 4108 1 4 . 1 1 11 11 ARG N N 11 125.238 125.238 125.620 -0.382 18321 4109 1 4 . 1 1 11 11 ARG HA H 11 1.936 1.936 2.655 -0.719 18321 4110 1 4 . 1 1 11 11 ARG C C 11 176.916 176.916 177.031 -0.115 18321 4111 1 4 . 1 1 11 11 ARG CA C 11 57.451 57.451 58.623 -1.172 18321 4112 1 4 . 1 1 11 11 ARG CB C 11 43.014 43.014 29.868 13.146 18321 4113 1 4 . 1 1 11 11 ARG H H 11 7.739 7.739 7.816 -0.077 18321 4114 1 4 . 1 1 12 12 SER N N 12 112.065 112.065 112.404 -0.339 18321 4115 1 4 . 1 1 12 12 SER HA H 12 4.695 4.695 4.180 0.515 18321 4116 1 4 . 1 1 12 12 SER C C 12 175.092 175.092 174.337 0.755 18321 4117 1 4 . 1 1 12 12 SER CA C 12 60.785 60.785 60.777 0.008 18321 4118 1 4 . 1 1 12 12 SER CB C 12 62.889 62.889 62.700 0.188 18321 4119 1 4 . 1 1 12 12 SER H H 12 7.888 7.888 8.229 -0.341 18321 4120 1 4 . 1 1 13 13 ALA N N 13 122.249 122.249 123.364 -1.115 18321 4121 1 4 . 1 1 13 13 ALA HA H 13 4.216 4.216 4.436 -0.220 18321 4122 1 4 . 1 1 13 13 ALA C C 13 178.069 178.069 177.220 0.849 18321 4123 1 4 . 1 1 13 13 ALA CA C 13 53.562 53.562 53.790 -0.228 18321 4124 1 4 . 1 1 13 13 ALA CB C 13 19.339 19.339 19.467 -0.128 18321 4125 1 4 . 1 1 13 13 ALA H H 13 7.418 7.418 7.660 -0.242 18321 4126 1 4 . 1 1 14 14 TRP N N 14 107.433 107.433 111.984 -4.551 18321 4127 1 4 . 1 1 14 14 TRP HA H 14 4.785 4.785 4.625 0.160 18321 4128 1 4 . 1 1 14 14 TRP C C 14 175.286 175.286 175.555 -0.269 18321 4129 1 4 . 1 1 14 14 TRP CA C 14 55.212 55.212 55.232 -0.020 18321 4130 1 4 . 1 1 14 14 TRP CB C 14 32.776 32.776 31.178 1.598 18321 4131 1 4 . 1 1 14 14 TRP H H 14 6.273 6.273 6.941 -0.668 18321 4132 1 4 . 1 1 15 15 TYR N N 15 122.315 122.315 124.518 -2.203 18321 4133 1 4 . 1 1 15 15 TYR HA H 15 5.436 5.436 4.733 0.703 18321 4134 1 4 . 1 1 15 15 TYR C C 15 175.325 175.325 174.575 0.750 18321 4135 1 4 . 1 1 15 15 TYR CA C 15 56.609 56.609 58.347 -1.738 18321 4136 1 4 . 1 1 15 15 TYR CB C 15 36.940 36.940 37.712 -0.772 18321 4137 1 4 . 1 1 15 15 TYR H H 15 8.221 8.221 7.463 0.758 18321 4138 1 4 . 1 1 16 16 MET N N 16 126.031 126.031 127.887 -1.856 18321 4139 1 4 . 1 1 16 16 MET HA H 16 4.462 4.462 4.251 0.211 18321 4140 1 4 . 1 1 16 16 MET CA C 16 53.046 53.046 53.318 -0.272 18321 4141 1 4 . 1 1 16 16 MET CB C 16 41.114 41.114 33.098 8.016 18321 4142 1 4 . 1 1 16 16 MET H H 16 8.989 8.989 8.488 0.501 18321 4143 1 4 . 1 1 17 17 GLY CA C 17 45.803 45.803 45.219 0.584 18321 4144 1 4 . 1 1 18 18 PRO HA H 18 4.675 4.675 4.429 0.246 18321 4145 1 4 . 1 1 18 18 PRO C C 18 175.943 175.943 175.731 0.212 18321 4146 1 4 . 1 1 18 18 PRO CA C 18 63.647 63.647 63.001 0.646 18321 4147 1 4 . 1 1 18 18 PRO CB C 18 29.276 29.276 30.050 -0.774 18321 4148 1 4 . 1 1 19 19 VAL N N 19 126.159 126.159 120.977 5.182 18321 4149 1 4 . 1 1 19 19 VAL HA H 19 4.011 4.011 4.376 -0.365 18321 4150 1 4 . 1 1 19 19 VAL C C 19 175.812 175.812 174.954 0.858 18321 4151 1 4 . 1 1 19 19 VAL CA C 19 62.355 62.355 60.069 2.285 18321 4152 1 4 . 1 1 19 19 VAL CB C 19 33.468 33.468 35.678 -2.210 18321 4153 1 4 . 1 1 19 19 VAL H H 19 7.851 7.851 8.271 -0.420 18321 4154 1 4 . 1 1 20 20 SER N N 20 123.950 123.950 115.442 8.508 18321 4155 1 4 . 1 1 20 20 SER HA H 20 4.453 4.453 5.084 -0.631 18321 4156 1 4 . 1 1 20 20 SER CA C 20 57.631 57.631 56.616 1.015 18321 4157 1 4 . 1 1 20 20 SER CB C 20 65.951 65.951 65.565 0.386 18321 4158 1 4 . 1 1 20 20 SER H H 20 8.800 8.800 8.074 0.726 18321 4159 1 4 . 1 1 21 21 ARG N N 21 123.461 123.461 121.606 1.855 18321 4160 1 4 . 1 1 21 21 ARG HA H 21 3.489 3.489 4.082 -0.593 18321 4161 1 4 . 1 1 21 21 ARG C C 21 178.164 178.164 178.418 -0.254 18321 4162 1 4 . 1 1 21 21 ARG CA C 21 60.025 60.025 60.189 -0.164 18321 4163 1 4 . 1 1 21 21 ARG CB C 21 30.334 30.334 29.976 0.358 18321 4164 1 4 . 1 1 21 21 ARG H H 21 9.307 9.307 8.869 0.438 18321 4165 1 4 . 1 1 22 22 GLN N N 22 116.591 116.591 117.260 -0.669 18321 4166 1 4 . 1 1 22 22 GLN HA H 22 4.008 4.008 4.076 -0.068 18321 4167 1 4 . 1 1 22 22 GLN CA C 22 59.095 59.095 58.788 0.307 18321 4168 1 4 . 1 1 22 22 GLN CB C 22 29.249 29.249 27.937 1.312 18321 4169 1 4 . 1 1 22 22 GLN H H 22 8.394 8.394 8.492 -0.098 18321 4170 1 4 . 1 1 23 23 GLU N N 23 122.191 122.191 121.009 1.182 18321 4171 1 4 . 1 1 23 23 GLU HA H 23 4.037 4.037 4.020 0.017 18321 4172 1 4 . 1 1 23 23 GLU C C 23 178.986 178.986 178.885 0.101 18321 4173 1 4 . 1 1 23 23 GLU CA C 23 59.081 59.081 59.316 -0.234 18321 4174 1 4 . 1 1 23 23 GLU CB C 23 31.896 31.896 29.239 2.657 18321 4175 1 4 . 1 1 23 23 GLU H H 23 8.106 8.106 7.893 0.213 18321 4176 1 4 . 1 1 24 24 ALA N N 24 121.964 121.964 121.640 0.324 18321 4177 1 4 . 1 1 24 24 ALA HA H 24 3.762 3.762 3.933 -0.171 18321 4178 1 4 . 1 1 24 24 ALA C C 24 178.653 178.653 179.412 -0.759 18321 4179 1 4 . 1 1 24 24 ALA CA C 24 55.480 55.480 55.513 -0.033 18321 4180 1 4 . 1 1 24 24 ALA CB C 24 18.049 18.049 18.495 -0.446 18321 4181 1 4 . 1 1 24 24 ALA H H 24 8.732 8.732 8.247 0.485 18321 4182 1 4 . 1 1 25 25 GLN N N 25 116.229 116.229 117.977 -1.748 18321 4183 1 4 . 1 1 25 25 GLN HA H 25 3.950 3.950 4.008 -0.058 18321 4184 1 4 . 1 1 25 25 GLN C C 25 177.442 177.442 178.429 -0.987 18321 4185 1 4 . 1 1 25 25 GLN CA C 25 59.651 59.651 58.496 1.155 18321 4186 1 4 . 1 1 25 25 GLN CB C 25 29.308 29.308 28.372 0.936 18321 4187 1 4 . 1 1 25 25 GLN H H 25 8.391 8.391 8.056 0.335 18321 4188 1 4 . 1 1 26 26 THR N N 26 115.105 115.105 115.824 -0.719 18321 4189 1 4 . 1 1 26 26 THR HA H 26 3.920 3.920 3.996 -0.076 18321 4190 1 4 . 1 1 26 26 THR C C 26 176.835 176.835 177.431 -0.596 18321 4191 1 4 . 1 1 26 26 THR CA C 26 66.335 66.335 66.083 0.252 18321 4192 1 4 . 1 1 26 26 THR CB C 26 68.876 68.876 68.754 0.122 18321 4193 1 4 . 1 1 26 26 THR H H 26 8.223 8.223 7.684 0.539 18321 4194 1 4 . 1 1 27 27 ARG N N 27 119.096 119.096 118.397 0.699 18321 4195 1 4 . 1 1 27 27 ARG HA H 27 4.047 4.047 4.155 -0.108 18321 4196 1 4 . 1 1 27 27 ARG C C 27 177.245 177.245 176.651 0.594 18321 4197 1 4 . 1 1 27 27 ARG CA C 27 58.528 58.528 57.881 0.647 18321 4198 1 4 . 1 1 27 27 ARG CB C 27 30.184 30.184 30.439 -0.255 18321 4199 1 4 . 1 1 27 27 ARG H H 27 8.093 8.093 7.902 0.191 18321 4200 1 4 . 1 1 28 28 LEU N N 28 114.602 114.602 115.431 -0.829 18321 4201 1 4 . 1 1 28 28 LEU HA H 28 4.325 4.325 4.466 -0.141 18321 4202 1 4 . 1 1 28 28 LEU C C 28 177.197 177.197 176.477 0.720 18321 4203 1 4 . 1 1 28 28 LEU CA C 28 55.143 55.143 53.846 1.297 18321 4204 1 4 . 1 1 28 28 LEU CB C 28 44.902 44.902 42.970 1.932 18321 4205 1 4 . 1 1 28 28 LEU H H 28 7.438 7.438 7.237 0.201 18321 4206 1 4 . 1 1 29 29 GLN N N 29 121.312 121.312 121.048 0.264 18321 4207 1 4 . 1 1 29 29 GLN HA H 29 3.856 3.856 4.193 -0.337 18321 4208 1 4 . 1 1 29 29 GLN C C 29 178.048 178.048 176.630 1.418 18321 4209 1 4 . 1 1 29 29 GLN CA C 29 57.691 57.691 56.652 1.039 18321 4210 1 4 . 1 1 29 29 GLN CB C 29 27.293 27.293 27.359 -0.066 18321 4211 1 4 . 1 1 29 29 GLN H H 29 8.250 8.250 7.649 0.601 18321 4212 1 4 . 1 1 30 30 GLY N N 30 116.768 116.768 115.226 1.542 18321 4213 1 4 . 1 1 30 30 GLY C C 30 174.914 174.914 174.612 0.302 18321 4214 1 4 . 1 1 30 30 GLY CA C 30 45.491 45.491 45.305 0.186 18321 4215 1 4 . 1 1 30 30 GLY H H 30 9.135 9.135 8.230 0.905 18321 4216 1 4 . 1 1 31 31 GLN N N 31 117.979 117.979 119.550 -1.571 18321 4217 1 4 . 1 1 31 31 GLN HA H 31 4.329 4.329 4.366 -0.037 18321 4218 1 4 . 1 1 31 31 GLN C C 31 177.174 177.174 175.431 1.743 18321 4219 1 4 . 1 1 31 31 GLN CA C 31 53.910 53.910 54.723 -0.813 18321 4220 1 4 . 1 1 31 31 GLN CB C 31 29.574 29.574 29.942 -0.367 18321 4221 1 4 . 1 1 31 31 GLN H H 31 7.695 7.695 7.553 0.142 18321 4222 1 4 . 1 1 32 32 ARG N N 32 123.918 123.918 119.746 4.172 18321 4223 1 4 . 1 1 32 32 ARG HA H 32 3.940 3.940 3.976 -0.036 18321 4224 1 4 . 1 1 32 32 ARG C C 32 175.810 175.810 176.403 -0.593 18321 4225 1 4 . 1 1 32 32 ARG CA C 32 56.770 56.770 56.828 -0.058 18321 4226 1 4 . 1 1 32 32 ARG CB C 32 30.074 30.074 30.575 -0.501 18321 4227 1 4 . 1 1 32 32 ARG H H 32 8.955 8.955 8.581 0.374 18321 4228 1 4 . 1 1 33 33 HIS N N 33 122.248 122.248 123.553 -1.305 18321 4229 1 4 . 1 1 33 33 HIS HA H 33 4.627 4.627 4.707 -0.080 18321 4230 1 4 . 1 1 33 33 HIS C C 33 177.089 177.089 176.175 0.914 18321 4231 1 4 . 1 1 33 33 HIS CA C 33 55.858 55.858 56.754 -0.896 18321 4232 1 4 . 1 1 33 33 HIS CB C 33 28.648 28.648 30.355 -1.707 18321 4233 1 4 . 1 1 33 33 HIS H H 33 8.302 8.302 8.541 -0.239 18321 4234 1 4 . 1 1 34 34 GLY N N 34 109.518 109.518 110.923 -1.405 18321 4235 1 4 . 1 1 34 34 GLY C C 34 176.730 176.730 173.809 2.921 18321 4236 1 4 . 1 1 34 34 GLY CA C 34 45.967 45.967 45.042 0.925 18321 4237 1 4 . 1 1 34 34 GLY H H 34 9.496 9.496 8.735 0.761 18321 4238 1 4 . 1 1 35 35 MET N N 35 125.193 125.193 122.532 2.661 18321 4239 1 4 . 1 1 35 35 MET HA H 35 5.750 5.750 5.508 0.242 18321 4240 1 4 . 1 1 35 35 MET C C 35 174.388 174.388 174.946 -0.558 18321 4241 1 4 . 1 1 35 35 MET CA C 35 55.762 55.762 56.152 -0.390 18321 4242 1 4 . 1 1 35 35 MET CB C 35 32.706 32.706 34.223 -1.517 18321 4243 1 4 . 1 1 35 35 MET H H 35 8.359 8.359 7.290 1.069 18321 4244 1 4 . 1 1 36 36 PHE N N 36 123.311 123.311 117.935 5.376 18321 4245 1 4 . 1 1 36 36 PHE HA H 36 5.985 5.985 5.812 0.173 18321 4246 1 4 . 1 1 36 36 PHE C C 36 172.140 172.140 172.895 -0.755 18321 4247 1 4 . 1 1 36 36 PHE CA C 36 55.755 55.755 55.184 0.571 18321 4248 1 4 . 1 1 36 36 PHE CB C 36 45.197 45.197 42.792 2.405 18321 4249 1 4 . 1 1 36 36 PHE H H 36 8.261 8.261 7.643 0.618 18321 4250 1 4 . 1 1 37 37 LEU N N 37 114.652 114.652 116.456 -1.804 18321 4251 1 4 . 1 1 37 37 LEU HA H 37 4.489 4.489 5.131 -0.642 18321 4252 1 4 . 1 1 37 37 LEU C C 37 174.033 174.033 175.087 -1.054 18321 4253 1 4 . 1 1 37 37 LEU CA C 37 55.382 55.382 54.536 0.846 18321 4254 1 4 . 1 1 37 37 LEU CB C 37 44.791 44.791 45.423 -0.632 18321 4255 1 4 . 1 1 37 37 LEU H H 37 9.292 9.292 9.009 0.283 18321 4256 1 4 . 1 1 38 38 VAL N N 38 121.009 121.009 122.962 -1.953 18321 4257 1 4 . 1 1 38 38 VAL HA H 38 5.504 5.504 4.613 0.891 18321 4258 1 4 . 1 1 38 38 VAL C C 38 173.581 173.581 175.469 -1.888 18321 4259 1 4 . 1 1 38 38 VAL CA C 38 61.316 61.316 62.101 -0.785 18321 4260 1 4 . 1 1 38 38 VAL CB C 38 33.302 33.302 32.041 1.261 18321 4261 1 4 . 1 1 38 38 VAL H H 38 8.991 8.991 8.539 0.452 18321 4262 1 4 . 1 1 39 39 ARG N N 39 124.863 124.863 127.599 -2.736 18321 4263 1 4 . 1 1 39 39 ARG HA H 39 5.444 5.444 4.929 0.515 18321 4264 1 4 . 1 1 39 39 ARG C C 39 175.772 175.772 174.962 0.810 18321 4265 1 4 . 1 1 39 39 ARG CA C 39 52.558 52.558 53.414 -0.856 18321 4266 1 4 . 1 1 39 39 ARG CB C 39 34.980 34.980 32.515 2.465 18321 4267 1 4 . 1 1 39 39 ARG H H 39 9.569 9.569 8.298 1.271 18321 4268 1 4 . 1 1 40 40 ASP N N 40 122.330 122.330 119.612 2.718 18321 4269 1 4 . 1 1 40 40 ASP HA H 40 4.785 4.785 5.138 -0.353 18321 4270 1 4 . 1 1 40 40 ASP C C 40 176.332 176.332 175.888 0.444 18321 4271 1 4 . 1 1 40 40 ASP CA C 40 55.334 55.334 54.387 0.947 18321 4272 1 4 . 1 1 40 40 ASP CB C 40 40.650 40.650 42.572 -1.922 18321 4273 1 4 . 1 1 40 40 ASP H H 40 8.413 8.413 8.313 0.100 18321 4274 1 4 . 1 1 41 41 SER N N 41 114.363 114.363 119.290 -4.927 18321 4275 1 4 . 1 1 41 41 SER HA H 41 4.506 4.506 4.340 0.166 18321 4276 1 4 . 1 1 41 41 SER CA C 41 57.525 57.525 58.229 -0.704 18321 4277 1 4 . 1 1 41 41 SER CB C 41 63.706 63.706 63.596 0.111 18321 4278 1 4 . 1 1 41 41 SER H H 41 7.791 7.791 8.476 -0.685 18321 4279 1 4 . 1 1 42 42 SER N N 42 126.932 126.932 122.683 4.249 18321 4280 1 4 . 1 1 42 42 SER HA H 42 4.410 4.410 4.601 -0.191 18321 4281 1 4 . 1 1 42 42 SER CA C 42 60.362 60.362 59.853 0.509 18321 4282 1 4 . 1 1 42 42 SER CB C 42 63.707 63.707 63.286 0.421 18321 4283 1 4 . 1 1 42 42 SER H H 42 10.519 10.519 8.820 1.699 18321 4284 1 4 . 1 1 43 43 THR HA H 43 4.097 4.097 4.467 -0.370 18321 4285 1 4 . 1 1 43 43 THR CA C 43 64.722 64.722 62.440 2.282 18321 4286 1 4 . 1 1 43 43 THR CB C 43 69.439 69.439 70.274 -0.835 18321 4287 1 4 . 1 1 44 44 CYS HA H 44 5.100 5.100 4.959 0.141 18321 4288 1 4 . 1 1 44 44 CYS CA C 44 51.779 51.779 56.177 -4.398 18321 4289 1 4 . 1 1 44 44 CYS CB C 44 41.314 41.314 29.360 11.954 18321 4290 1 4 . 1 1 45 45 PRO HA H 45 4.278 4.278 4.219 0.059 18321 4291 1 4 . 1 1 45 45 PRO C C 45 178.127 178.127 177.455 0.672 18321 4292 1 4 . 1 1 45 45 PRO CA C 45 64.151 64.151 64.506 -0.355 18321 4293 1 4 . 1 1 45 45 PRO CB C 45 31.596 31.596 31.326 0.270 18321 4294 1 4 . 1 1 46 46 GLY N N 46 114.947 114.947 114.781 0.166 18321 4295 1 4 . 1 1 46 46 GLY C C 46 174.701 174.701 174.376 0.325 18321 4296 1 4 . 1 1 46 46 GLY CA C 46 45.225 45.225 44.869 0.356 18321 4297 1 4 . 1 1 46 46 GLY H H 46 8.812 8.812 9.235 -0.423 18321 4298 1 4 . 1 1 47 47 ASP N N 47 120.862 120.862 122.990 -2.128 18321 4299 1 4 . 1 1 47 47 ASP HA H 47 5.235 5.235 4.559 0.676 18321 4300 1 4 . 1 1 47 47 ASP C C 47 176.480 176.480 174.945 1.535 18321 4301 1 4 . 1 1 47 47 ASP CA C 47 53.591 53.591 54.653 -1.062 18321 4302 1 4 . 1 1 47 47 ASP CB C 47 41.707 41.707 41.905 -0.198 18321 4303 1 4 . 1 1 47 47 ASP H H 47 7.997 7.997 7.804 0.193 18321 4304 1 4 . 1 1 48 48 TYR N N 48 118.473 118.473 115.754 2.719 18321 4305 1 4 . 1 1 48 48 TYR HA H 48 5.431 5.431 5.241 0.190 18321 4306 1 4 . 1 1 48 48 TYR C C 48 173.783 173.783 175.778 -1.995 18321 4307 1 4 . 1 1 48 48 TYR CA C 48 56.891 56.891 56.625 0.266 18321 4308 1 4 . 1 1 48 48 TYR CB C 48 43.274 43.274 43.226 0.048 18321 4309 1 4 . 1 1 48 48 TYR H H 48 8.892 8.892 9.152 -0.260 18321 4310 1 4 . 1 1 49 49 VAL N N 49 119.105 119.105 119.223 -0.118 18321 4311 1 4 . 1 1 49 49 VAL HA H 49 4.800 4.800 4.577 0.223 18321 4312 1 4 . 1 1 49 49 VAL C C 49 174.397 174.397 174.602 -0.205 18321 4313 1 4 . 1 1 49 49 VAL CA C 49 61.439 61.439 61.995 -0.556 18321 4314 1 4 . 1 1 49 49 VAL CB C 49 35.388 35.388 34.612 0.776 18321 4315 1 4 . 1 1 49 49 VAL H H 49 9.661 9.661 8.644 1.017 18321 4316 1 4 . 1 1 50 50 LEU N N 50 129.599 129.599 131.187 -1.588 18321 4317 1 4 . 1 1 50 50 LEU HA H 50 5.033 5.033 5.210 -0.177 18321 4318 1 4 . 1 1 50 50 LEU C C 50 175.001 175.001 175.408 -0.407 18321 4319 1 4 . 1 1 50 50 LEU CA C 50 53.352 53.352 53.852 -0.500 18321 4320 1 4 . 1 1 50 50 LEU CB C 50 44.062 44.062 42.333 1.729 18321 4321 1 4 . 1 1 50 50 LEU H H 50 9.405 9.405 9.268 0.137 18321 4322 1 4 . 1 1 51 51 SER N N 51 126.895 126.895 124.823 2.072 18321 4323 1 4 . 1 1 51 51 SER HA H 51 5.731 5.731 5.062 0.669 18321 4324 1 4 . 1 1 51 51 SER C C 51 173.094 173.094 173.393 -0.299 18321 4325 1 4 . 1 1 51 51 SER CA C 51 58.834 58.834 57.447 1.387 18321 4326 1 4 . 1 1 51 51 SER CB C 51 64.977 64.977 63.879 1.098 18321 4327 1 4 . 1 1 51 51 SER H H 51 9.094 9.094 9.122 -0.028 18321 4328 1 4 . 1 1 52 52 VAL N N 52 121.777 121.777 125.644 -3.867 18321 4329 1 4 . 1 1 52 52 VAL HA H 52 5.066 5.066 4.700 0.366 18321 4330 1 4 . 1 1 52 52 VAL C C 52 174.573 174.573 174.536 0.037 18321 4331 1 4 . 1 1 52 52 VAL CA C 52 59.535 59.535 60.330 -0.795 18321 4332 1 4 . 1 1 52 52 VAL CB C 52 36.834 36.834 34.928 1.906 18321 4333 1 4 . 1 1 52 52 VAL H H 52 8.816 8.816 8.963 -0.147 18321 4334 1 4 . 1 1 53 53 SER N N 53 120.489 120.489 121.117 -0.628 18321 4335 1 4 . 1 1 53 53 SER HA H 53 4.811 4.811 4.515 0.296 18321 4336 1 4 . 1 1 53 53 SER C C 53 174.065 174.065 172.753 1.312 18321 4337 1 4 . 1 1 53 53 SER CA C 53 57.496 57.496 58.118 -0.623 18321 4338 1 4 . 1 1 53 53 SER CB C 53 62.623 62.623 63.237 -0.614 18321 4339 1 4 . 1 1 53 53 SER H H 53 8.780 8.780 9.049 -0.269 18321 4340 1 4 . 1 1 54 54 GLU N N 54 132.020 132.020 128.173 3.847 18321 4341 1 4 . 1 1 54 54 GLU HA H 54 4.250 4.250 4.194 0.056 18321 4342 1 4 . 1 1 54 54 GLU C C 54 175.387 175.387 175.085 0.302 18321 4343 1 4 . 1 1 54 54 GLU CA C 54 56.999 56.999 55.861 1.139 18321 4344 1 4 . 1 1 54 54 GLU CB C 54 32.556 32.556 33.101 -0.545 18321 4345 1 4 . 1 1 54 54 GLU H H 54 8.472 8.472 7.704 0.768 18321 4346 1 4 . 1 1 55 55 ASN N N 55 126.517 126.517 122.535 3.982 18321 4347 1 4 . 1 1 55 55 ASN HA H 55 4.220 4.220 4.228 -0.008 18321 4348 1 4 . 1 1 55 55 ASN C C 55 174.546 174.546 175.032 -0.486 18321 4349 1 4 . 1 1 55 55 ASN CA C 55 54.770 54.770 54.123 0.647 18321 4350 1 4 . 1 1 55 55 ASN CB C 55 37.314 37.314 37.392 -0.078 18321 4351 1 4 . 1 1 55 55 ASN H H 55 8.853 8.853 8.104 0.749 18321 4352 1 4 . 1 1 56 56 SER N N 56 112.009 112.009 110.550 1.459 18321 4353 1 4 . 1 1 56 56 SER HA H 56 4.334 4.334 4.130 0.204 18321 4354 1 4 . 1 1 56 56 SER C C 56 173.354 173.354 173.039 0.315 18321 4355 1 4 . 1 1 56 56 SER CA C 56 59.966 59.966 60.067 -0.101 18321 4356 1 4 . 1 1 56 56 SER CB C 56 62.242 62.242 62.006 0.236 18321 4357 1 4 . 1 1 56 56 SER H H 56 10.418 10.418 8.113 2.305 18321 4358 1 4 . 1 1 57 57 ARG N N 57 121.764 121.764 118.806 2.958 18321 4359 1 4 . 1 1 57 57 ARG HA H 57 5.167 5.167 4.338 0.829 18321 4360 1 4 . 1 1 57 57 ARG C C 57 174.983 174.983 173.904 1.079 18321 4361 1 4 . 1 1 57 57 ARG CA C 57 54.550 54.550 55.452 -0.902 18321 4362 1 4 . 1 1 57 57 ARG CB C 57 31.886 31.886 31.370 0.516 18321 4363 1 4 . 1 1 57 57 ARG H H 57 8.097 8.097 8.313 -0.216 18321 4364 1 4 . 1 1 58 58 VAL N N 58 121.866 121.866 122.275 -0.409 18321 4365 1 4 . 1 1 58 58 VAL HA H 58 4.768 4.768 4.190 0.578 18321 4366 1 4 . 1 1 58 58 VAL C C 58 175.388 175.388 175.862 -0.474 18321 4367 1 4 . 1 1 58 58 VAL CA C 58 61.818 61.818 62.604 -0.786 18321 4368 1 4 . 1 1 58 58 VAL CB C 58 34.135 34.135 30.435 3.700 18321 4369 1 4 . 1 1 58 58 VAL H H 58 8.081 8.081 8.165 -0.084 18321 4370 1 4 . 1 1 59 59 SER N N 59 124.445 124.445 124.057 0.388 18321 4371 1 4 . 1 1 59 59 SER HA H 59 4.462 4.462 4.265 0.197 18321 4372 1 4 . 1 1 59 59 SER C C 59 172.185 172.185 173.078 -0.893 18321 4373 1 4 . 1 1 59 59 SER CA C 59 56.629 56.629 58.198 -1.569 18321 4374 1 4 . 1 1 59 59 SER CB C 59 66.218 66.218 63.614 2.604 18321 4375 1 4 . 1 1 59 59 SER H H 59 9.082 9.082 8.491 0.591 18321 4376 1 4 . 1 1 60 60 HIS N N 60 121.224 121.224 125.524 -4.300 18321 4377 1 4 . 1 1 60 60 HIS HA H 60 4.885 4.885 4.666 0.219 18321 4378 1 4 . 1 1 60 60 HIS C C 60 174.674 174.674 174.353 0.321 18321 4379 1 4 . 1 1 60 60 HIS CA C 60 54.900 54.900 55.576 -0.676 18321 4380 1 4 . 1 1 60 60 HIS CB C 60 32.331 32.331 30.142 2.189 18321 4381 1 4 . 1 1 60 60 HIS H H 60 8.331 8.331 8.509 -0.178 18321 4382 1 4 . 1 1 61 61 TYR N N 61 124.780 124.780 124.573 0.207 18321 4383 1 4 . 1 1 61 61 TYR HA H 61 4.655 4.655 4.760 -0.105 18321 4384 1 4 . 1 1 61 61 TYR CA C 61 57.409 57.409 56.269 1.140 18321 4385 1 4 . 1 1 61 61 TYR CB C 61 39.785 39.785 38.889 0.896 18321 4386 1 4 . 1 1 61 61 TYR H H 61 9.273 9.273 9.266 0.007 18321 4387 1 4 . 1 1 62 62 ILE HA H 62 4.298 4.298 4.319 -0.021 18321 4388 1 4 . 1 1 62 62 ILE C C 62 174.817 174.817 175.332 -0.515 18321 4389 1 4 . 1 1 62 62 ILE CA C 62 61.908 61.908 61.666 0.242 18321 4390 1 4 . 1 1 62 62 ILE CB C 62 38.321 38.321 38.786 -0.465 18321 4391 1 4 . 1 1 63 63 ILE N N 63 128.552 128.552 128.984 -0.432 18321 4392 1 4 . 1 1 63 63 ILE HA H 63 4.788 4.788 4.752 0.036 18321 4393 1 4 . 1 1 63 63 ILE C C 63 175.982 175.982 175.156 0.826 18321 4394 1 4 . 1 1 63 63 ILE CA C 63 59.629 59.629 59.901 -0.272 18321 4395 1 4 . 1 1 63 63 ILE CB C 63 39.747 39.747 38.885 0.862 18321 4396 1 4 . 1 1 63 63 ILE H H 63 9.155 9.155 8.753 0.402 18321 4397 1 4 . 1 1 64 64 ASN N N 64 123.240 123.240 127.865 -4.625 18321 4398 1 4 . 1 1 64 64 ASN HA H 64 4.857 4.857 5.153 -0.296 18321 4399 1 4 . 1 1 64 64 ASN C C 64 175.324 175.324 174.524 0.800 18321 4400 1 4 . 1 1 64 64 ASN CA C 64 53.736 53.736 53.273 0.463 18321 4401 1 4 . 1 1 64 64 ASN CB C 64 41.531 41.531 40.272 1.259 18321 4402 1 4 . 1 1 64 64 ASN H H 64 9.379 9.379 8.902 0.477 18321 4403 1 4 . 1 1 65 65 SER N N 65 121.157 121.157 118.966 2.191 18321 4404 1 4 . 1 1 65 65 SER HA H 65 4.548 4.548 4.609 -0.061 18321 4405 1 4 . 1 1 65 65 SER C C 65 174.328 174.328 174.414 -0.086 18321 4406 1 4 . 1 1 65 65 SER CA C 65 58.306 58.306 58.019 0.287 18321 4407 1 4 . 1 1 65 65 SER CB C 65 62.878 62.878 62.715 0.163 18321 4408 1 4 . 1 1 65 65 SER H H 65 9.195 9.195 9.479 -0.284 18321 4409 1 4 . 1 1 66 66 LEU N N 66 127.417 127.417 128.061 -0.644 18321 4410 1 4 . 1 1 66 66 LEU HA H 66 4.605 4.605 4.398 0.207 18321 4411 1 4 . 1 1 66 66 LEU CA C 66 52.888 52.888 53.367 -0.478 18321 4412 1 4 . 1 1 66 66 LEU CB C 66 41.799 41.799 41.368 0.431 18321 4413 1 4 . 1 1 66 66 LEU H H 66 8.143 8.143 7.955 0.188 18321 4414 1 4 . 1 1 68 68 ASN HA H 68 4.386 4.386 4.623 -0.237 18321 4415 1 4 . 1 1 68 68 ASN C C 68 174.487 174.487 174.953 -0.466 18321 4416 1 4 . 1 1 68 68 ASN CA C 68 53.365 53.365 52.899 0.466 18321 4417 1 4 . 1 1 68 68 ASN CB C 68 36.778 36.778 37.502 -0.724 18321 4418 1 4 . 1 1 69 69 ARG N N 69 111.329 111.329 113.896 -2.567 18321 4419 1 4 . 1 1 69 69 ARG HA H 69 3.876 3.876 3.814 0.062 18321 4420 1 4 . 1 1 69 69 ARG CA C 69 57.393 57.393 57.100 0.293 18321 4421 1 4 . 1 1 69 69 ARG CB C 69 26.665 26.665 26.857 -0.192 18321 4422 1 4 . 1 1 69 69 ARG H H 69 8.191 8.191 7.970 0.221 18321 4423 1 4 . 1 1 70 70 ARG N N 70 116.120 116.120 115.896 0.224 18321 4424 1 4 . 1 1 70 70 ARG HA H 70 4.556 4.556 4.992 -0.436 18321 4425 1 4 . 1 1 70 70 ARG C C 70 174.882 174.882 174.016 0.866 18321 4426 1 4 . 1 1 70 70 ARG CA C 70 55.509 55.509 53.655 1.854 18321 4427 1 4 . 1 1 70 70 ARG CB C 70 31.771 31.771 33.825 -2.054 18321 4428 1 4 . 1 1 70 70 ARG H H 70 6.667 6.667 7.202 -0.535 18321 4429 1 4 . 1 1 71 71 PHE N N 71 116.313 116.313 117.818 -1.505 18321 4430 1 4 . 1 1 71 71 PHE HA H 71 5.540 5.540 5.598 -0.058 18321 4431 1 4 . 1 1 71 71 PHE C C 71 174.391 174.391 175.011 -0.620 18321 4432 1 4 . 1 1 71 71 PHE CA C 71 57.528 57.528 56.637 0.891 18321 4433 1 4 . 1 1 71 71 PHE CB C 71 44.115 44.115 42.567 1.548 18321 4434 1 4 . 1 1 71 71 PHE H H 71 8.700 8.700 8.189 0.511 18321 4435 1 4 . 1 1 72 72 LYS N N 72 122.770 122.770 126.418 -3.648 18321 4436 1 4 . 1 1 72 72 LYS HA H 72 5.483 5.483 4.865 0.618 18321 4437 1 4 . 1 1 72 72 LYS C C 72 173.923 173.923 175.375 -1.452 18321 4438 1 4 . 1 1 72 72 LYS CA C 72 54.855 54.855 55.297 -0.442 18321 4439 1 4 . 1 1 72 72 LYS CB C 72 37.710 37.710 34.653 3.057 18321 4440 1 4 . 1 1 72 72 LYS H H 72 9.138 9.138 8.493 0.645 18321 4441 1 4 . 1 1 73 73 ILE N N 73 124.576 124.576 129.896 -5.320 18321 4442 1 4 . 1 1 73 73 ILE HA H 73 4.955 4.955 4.797 0.158 18321 4443 1 4 . 1 1 73 73 ILE C C 73 175.728 175.728 175.863 -0.135 18321 4444 1 4 . 1 1 73 73 ILE CA C 73 58.935 58.935 60.414 -1.479 18321 4445 1 4 . 1 1 73 73 ILE CB C 73 40.965 40.965 38.036 2.929 18321 4446 1 4 . 1 1 73 73 ILE H H 73 8.826 8.826 9.108 -0.282 18321 4447 1 4 . 1 1 74 74 GLY N N 74 118.718 118.718 116.853 1.865 18321 4448 1 4 . 1 1 74 74 GLY C C 74 174.436 174.436 173.215 1.221 18321 4449 1 4 . 1 1 74 74 GLY CA C 74 47.401 47.401 46.617 0.784 18321 4450 1 4 . 1 1 74 74 GLY H H 74 9.317 9.317 9.485 -0.168 18321 4451 1 4 . 1 1 75 75 ASP N N 75 125.691 125.691 118.388 7.303 18321 4452 1 4 . 1 1 75 75 ASP HA H 75 4.713 4.713 4.510 0.203 18321 4453 1 4 . 1 1 75 75 ASP C C 75 175.841 175.841 174.627 1.214 18321 4454 1 4 . 1 1 75 75 ASP CA C 75 53.815 53.815 54.473 -0.658 18321 4455 1 4 . 1 1 75 75 ASP CB C 75 41.288 41.288 41.032 0.255 18321 4456 1 4 . 1 1 75 75 ASP H H 75 8.665 8.665 8.448 0.217 18321 4457 1 4 . 1 1 76 76 GLN N N 76 120.368 120.368 121.444 -1.076 18321 4458 1 4 . 1 1 76 76 GLN C C 76 173.630 173.630 174.518 -0.888 18321 4459 1 4 . 1 1 76 76 GLN CA C 76 54.254 54.254 56.366 -2.112 18321 4460 1 4 . 1 1 76 76 GLN CB C 76 31.248 31.248 29.033 2.215 18321 4461 1 4 . 1 1 76 76 GLN H H 76 8.289 8.289 7.941 0.348 18321 4462 1 4 . 1 1 77 77 GLU N N 77 120.435 120.435 122.879 -2.444 18321 4463 1 4 . 1 1 77 77 GLU C C 77 175.484 175.484 174.989 0.495 18321 4464 1 4 . 1 1 77 77 GLU CA C 77 54.203 54.203 54.484 -0.282 18321 4465 1 4 . 1 1 77 77 GLU CB C 77 33.141 33.141 31.398 1.743 18321 4466 1 4 . 1 1 77 77 GLU H H 77 7.732 7.732 8.191 -0.459 18321 4467 1 4 . 1 1 78 78 PHE N N 78 117.911 117.911 122.819 -4.908 18321 4468 1 4 . 1 1 78 78 PHE HA H 78 4.659 4.659 4.713 -0.054 18321 4469 1 4 . 1 1 78 78 PHE C C 78 175.673 175.673 176.657 -0.984 18321 4470 1 4 . 1 1 78 78 PHE CA C 78 57.160 57.160 56.230 0.930 18321 4471 1 4 . 1 1 78 78 PHE CB C 78 45.405 45.405 41.069 4.336 18321 4472 1 4 . 1 1 78 78 PHE H H 78 9.235 9.235 8.532 0.703 18321 4473 1 4 . 1 1 79 79 ASP N N 79 119.296 119.296 117.837 1.459 18321 4474 1 4 . 1 1 79 79 ASP HA H 79 4.462 4.462 4.444 0.018 18321 4475 1 4 . 1 1 79 79 ASP C C 79 174.482 174.482 175.660 -1.178 18321 4476 1 4 . 1 1 79 79 ASP CA C 79 56.629 56.629 55.928 0.701 18321 4477 1 4 . 1 1 79 79 ASP CB C 79 41.697 41.697 40.916 0.781 18321 4478 1 4 . 1 1 79 79 ASP H H 79 9.187 9.187 8.810 0.377 18321 4479 1 4 . 1 1 80 80 HIS N N 80 107.631 107.631 111.496 -3.865 18321 4480 1 4 . 1 1 80 80 HIS HA H 80 5.022 5.022 5.025 -0.003 18321 4481 1 4 . 1 1 80 80 HIS C C 80 174.626 174.626 174.663 -0.037 18321 4482 1 4 . 1 1 80 80 HIS CA C 80 54.223 54.223 55.077 -0.854 18321 4483 1 4 . 1 1 80 80 HIS CB C 80 32.205 32.205 30.752 1.453 18321 4484 1 4 . 1 1 80 80 HIS H H 80 7.200 7.200 7.139 0.061 18321 4485 1 4 . 1 1 81 81 LEU N N 81 120.710 120.710 120.857 -0.147 18321 4486 1 4 . 1 1 81 81 LEU HA H 81 3.804 3.804 4.144 -0.340 18321 4487 1 4 . 1 1 81 81 LEU CA C 81 58.709 58.709 60.211 -1.502 18321 4488 1 4 . 1 1 81 81 LEU CB C 81 39.646 39.646 40.039 -0.393 18321 4489 1 4 . 1 1 81 81 LEU H H 81 8.886 8.886 9.128 -0.242 18321 4490 1 4 . 1 1 82 82 PRO HA H 82 4.020 4.020 4.335 -0.315 18321 4491 1 4 . 1 1 82 82 PRO C C 82 175.619 175.619 176.834 -1.215 18321 4492 1 4 . 1 1 82 82 PRO CA C 82 67.025 67.025 64.891 2.134 18321 4493 1 4 . 1 1 82 82 PRO CB C 82 30.962 30.962 31.102 -0.140 18321 4494 1 4 . 1 1 83 83 ALA N N 83 124.281 124.281 118.558 5.723 18321 4495 1 4 . 1 1 83 83 ALA HA H 83 4.019 4.019 4.282 -0.263 18321 4496 1 4 . 1 1 83 83 ALA C C 83 179.709 179.709 178.783 0.926 18321 4497 1 4 . 1 1 83 83 ALA CA C 83 54.985 54.985 54.108 0.877 18321 4498 1 4 . 1 1 83 83 ALA CB C 83 18.425 18.425 18.919 -0.494 18321 4499 1 4 . 1 1 83 83 ALA H H 83 8.527 8.527 7.791 0.736 18321 4500 1 4 . 1 1 84 84 LEU N N 84 122.960 122.960 118.104 4.856 18321 4501 1 4 . 1 1 84 84 LEU HA H 84 1.917 1.917 2.975 -1.058 18321 4502 1 4 . 1 1 84 84 LEU C C 84 177.652 177.652 178.264 -0.612 18321 4503 1 4 . 1 1 84 84 LEU CA C 84 58.261 58.261 57.412 0.849 18321 4504 1 4 . 1 1 84 84 LEU CB C 84 42.544 42.544 40.919 1.625 18321 4505 1 4 . 1 1 84 84 LEU H H 84 6.982 6.982 7.267 -0.285 18321 4506 1 4 . 1 1 85 85 LEU N N 85 117.940 117.940 118.675 -0.735 18321 4507 1 4 . 1 1 85 85 LEU HA H 85 3.463 3.463 3.808 -0.345 18321 4508 1 4 . 1 1 85 85 LEU C C 85 178.809 178.809 178.325 0.484 18321 4509 1 4 . 1 1 85 85 LEU CA C 85 57.522 57.522 57.338 0.184 18321 4510 1 4 . 1 1 85 85 LEU CB C 85 41.242 41.242 41.249 -0.007 18321 4511 1 4 . 1 1 85 85 LEU H H 85 7.773 7.773 7.591 0.182 18321 4512 1 4 . 1 1 86 86 GLU N N 86 115.762 115.762 117.391 -1.629 18321 4513 1 4 . 1 1 86 86 GLU HA H 86 3.540 3.540 4.053 -0.513 18321 4514 1 4 . 1 1 86 86 GLU C C 86 180.228 180.228 178.365 1.863 18321 4515 1 4 . 1 1 86 86 GLU CA C 86 58.943 58.943 57.945 0.998 18321 4516 1 4 . 1 1 86 86 GLU CB C 86 29.561 29.561 29.642 -0.081 18321 4517 1 4 . 1 1 86 86 GLU H H 86 8.300 8.300 7.447 0.853 18321 4518 1 4 . 1 1 87 87 PHE N N 87 121.135 121.135 121.228 -0.093 18321 4519 1 4 . 1 1 87 87 PHE HA H 87 4.122 4.122 4.181 -0.059 18321 4520 1 4 . 1 1 87 87 PHE C C 87 179.497 179.497 177.253 2.244 18321 4521 1 4 . 1 1 87 87 PHE CA C 87 62.090 62.090 60.830 1.260 18321 4522 1 4 . 1 1 87 87 PHE CB C 87 40.103 40.103 39.337 0.767 18321 4523 1 4 . 1 1 87 87 PHE H H 87 7.717 7.717 7.668 0.049 18321 4524 1 4 . 1 1 88 88 TYR N N 88 116.579 116.579 117.287 -0.708 18321 4525 1 4 . 1 1 88 88 TYR HA H 88 4.933 4.933 4.275 0.658 18321 4526 1 4 . 1 1 88 88 TYR C C 88 174.799 174.799 177.017 -2.218 18321 4527 1 4 . 1 1 88 88 TYR CA C 88 61.333 61.333 59.265 2.068 18321 4528 1 4 . 1 1 88 88 TYR CB C 88 36.539 36.539 37.256 -0.717 18321 4529 1 4 . 1 1 88 88 TYR H H 88 7.478 7.478 8.001 -0.523 18321 4530 1 4 . 1 1 89 89 LYS N N 89 117.737 117.737 118.629 -0.892 18321 4531 1 4 . 1 1 89 89 LYS HA H 89 4.466 4.466 4.004 0.462 18321 4532 1 4 . 1 1 89 89 LYS C C 89 178.417 178.417 176.633 1.784 18321 4533 1 4 . 1 1 89 89 LYS CA C 89 59.486 59.486 58.654 0.833 18321 4534 1 4 . 1 1 89 89 LYS CB C 89 34.523 34.523 32.565 1.958 18321 4535 1 4 . 1 1 89 89 LYS H H 89 7.505 7.505 7.506 -0.001 18321 4536 1 4 . 1 1 90 90 ILE N N 90 110.972 110.972 109.411 1.561 18321 4537 1 4 . 1 1 90 90 ILE HA H 90 4.181 4.181 4.290 -0.109 18321 4538 1 4 . 1 1 90 90 ILE C C 90 174.571 174.571 175.423 -0.852 18321 4539 1 4 . 1 1 90 90 ILE CA C 90 60.516 60.516 60.783 -0.267 18321 4540 1 4 . 1 1 90 90 ILE CB C 90 39.979 39.979 37.537 2.442 18321 4541 1 4 . 1 1 90 90 ILE H H 90 6.710 6.710 7.359 -0.649 18321 4542 1 4 . 1 1 91 91 HIS N N 91 119.479 119.479 120.561 -1.082 18321 4543 1 4 . 1 1 91 91 HIS HA H 91 4.357 4.357 4.544 -0.187 18321 4544 1 4 . 1 1 91 91 HIS C C 91 172.751 172.751 174.580 -1.829 18321 4545 1 4 . 1 1 91 91 HIS CA C 91 55.066 55.066 56.738 -1.672 18321 4546 1 4 . 1 1 91 91 HIS CB C 91 29.756 29.756 32.847 -3.091 18321 4547 1 4 . 1 1 91 91 HIS H H 91 7.460 7.460 7.304 0.156 18321 4548 1 4 . 1 1 92 92 TYR N N 92 117.642 117.642 116.142 1.500 18321 4549 1 4 . 1 1 92 92 TYR HA H 92 4.131 4.131 4.357 -0.226 18321 4550 1 4 . 1 1 92 92 TYR C C 92 177.348 177.348 175.569 1.779 18321 4551 1 4 . 1 1 92 92 TYR CA C 92 58.627 58.627 59.049 -0.422 18321 4552 1 4 . 1 1 92 92 TYR CB C 92 39.481 39.481 36.711 2.770 18321 4553 1 4 . 1 1 92 92 TYR H H 92 8.067 8.067 7.693 0.374 18321 4554 1 4 . 1 1 93 93 LEU N N 93 123.560 123.560 115.991 7.569 18321 4555 1 4 . 1 1 93 93 LEU HA H 93 4.104 4.104 4.732 -0.628 18321 4556 1 4 . 1 1 93 93 LEU C C 93 175.610 175.610 175.729 -0.119 18321 4557 1 4 . 1 1 93 93 LEU CA C 93 56.381 56.381 54.577 1.804 18321 4558 1 4 . 1 1 93 93 LEU CB C 93 38.896 38.896 42.261 -3.365 18321 4559 1 4 . 1 1 93 93 LEU H H 93 7.907 7.907 7.932 -0.025 18321 4560 1 4 . 1 1 94 94 ASP N N 94 118.194 118.194 117.092 1.102 18321 4561 1 4 . 1 1 94 94 ASP HA H 94 4.940 4.940 4.863 0.077 18321 4562 1 4 . 1 1 94 94 ASP C C 94 176.123 176.123 176.067 0.056 18321 4563 1 4 . 1 1 94 94 ASP CA C 94 56.235 56.235 53.228 3.007 18321 4564 1 4 . 1 1 94 94 ASP CB C 94 42.078 42.078 40.951 1.127 18321 4565 1 4 . 1 1 94 94 ASP H H 94 8.640 8.640 7.757 0.883 18321 4566 1 4 . 1 1 95 95 THR N N 95 105.073 105.073 114.046 -8.973 18321 4567 1 4 . 1 1 95 95 THR HA H 95 4.318 4.318 3.915 0.403 18321 4568 1 4 . 1 1 95 95 THR C C 95 174.685 174.685 173.472 1.213 18321 4569 1 4 . 1 1 95 95 THR CA C 95 60.756 60.756 64.874 -4.118 18321 4570 1 4 . 1 1 95 95 THR CB C 95 71.058 71.058 68.995 2.063 18321 4571 1 4 . 1 1 95 95 THR H H 95 8.576 8.576 8.568 0.008 18321 4572 1 4 . 1 1 96 96 THR N N 96 116.817 116.817 112.063 4.754 18321 4573 1 4 . 1 1 96 96 THR HA H 96 5.129 5.129 4.816 0.313 18321 4574 1 4 . 1 1 96 96 THR C C 96 172.464 172.464 172.443 0.021 18321 4575 1 4 . 1 1 96 96 THR CA C 96 60.762 60.762 60.427 0.335 18321 4576 1 4 . 1 1 96 96 THR CB C 96 71.425 71.425 71.174 0.251 18321 4577 1 4 . 1 1 96 96 THR H H 96 8.205 8.205 7.790 0.415 18321 4578 1 4 . 1 1 97 97 THR N N 97 114.324 114.324 112.172 2.152 18321 4579 1 4 . 1 1 97 97 THR HA H 97 5.128 5.128 4.401 0.727 18321 4580 1 4 . 1 1 97 97 THR C C 97 175.480 175.480 173.984 1.496 18321 4581 1 4 . 1 1 97 97 THR CA C 97 60.233 60.233 58.885 1.348 18321 4582 1 4 . 1 1 97 97 THR CB C 97 70.415 70.415 70.814 -0.399 18321 4583 1 4 . 1 1 97 97 THR H H 97 7.128 7.128 7.893 -0.765 18321 4584 1 4 . 1 1 98 98 LEU N N 98 116.674 116.674 122.049 -5.375 18321 4585 1 4 . 1 1 98 98 LEU HA H 98 4.075 4.075 4.102 -0.027 18321 4586 1 4 . 1 1 98 98 LEU C C 98 177.892 177.892 176.799 1.093 18321 4587 1 4 . 1 1 98 98 LEU CA C 98 59.597 59.597 55.061 4.536 18321 4588 1 4 . 1 1 98 98 LEU CB C 98 41.172 41.172 40.325 0.847 18321 4589 1 4 . 1 1 98 98 LEU H H 98 8.743 8.743 8.472 0.271 18321 4590 1 4 . 1 1 99 99 ILE N N 99 122.988 122.988 122.975 0.013 18321 4591 1 4 . 1 1 99 99 ILE HA H 99 4.415 4.415 4.134 0.281 18321 4592 1 4 . 1 1 99 99 ILE C C 99 175.055 175.055 176.206 -1.151 18321 4593 1 4 . 1 1 99 99 ILE CA C 99 62.183 62.183 61.636 0.547 18321 4594 1 4 . 1 1 99 99 ILE CB C 99 40.252 40.252 38.627 1.625 18321 4595 1 4 . 1 1 99 99 ILE H H 99 8.998 8.998 8.096 0.902 18321 4596 1 4 . 1 1 100 100 GLU N N 100 114.067 114.067 116.394 -2.327 18321 4597 1 4 . 1 1 100 100 GLU CA C 100 52.910 52.910 53.021 -0.111 18321 4598 1 4 . 1 1 100 100 GLU CB C 100 31.155 31.155 32.597 -1.442 18321 4599 1 4 . 1 1 100 100 GLU H H 100 7.332 7.332 7.707 -0.375 18321 4600 1 4 . 1 1 101 101 PRO HA H 101 4.952 4.952 3.534 1.418 18321 4601 1 4 . 1 1 101 101 PRO C C 101 175.976 175.976 175.670 0.306 18321 4602 1 4 . 1 1 101 101 PRO CA C 101 53.312 53.312 62.444 -9.132 18321 4603 1 4 . 1 1 101 101 PRO CB C 101 31.598 31.598 31.992 -0.394 18321 4604 1 4 . 1 1 102 102 ALA N N 102 125.968 125.968 121.477 4.491 18321 4605 1 4 . 1 1 102 102 ALA HA H 102 4.516 4.516 4.418 0.098 18321 4606 1 4 . 1 1 102 102 ALA CA C 102 49.852 49.852 49.677 0.175 18321 4607 1 4 . 1 1 102 102 ALA CB C 102 17.766 17.766 18.123 -0.357 18321 4608 1 4 . 1 1 102 102 ALA H H 102 8.232 8.232 8.031 0.201 18321 4609 1 4 . 1 1 103 103 PRO HA H 103 4.283 4.283 4.284 -0.001 18321 4610 1 4 . 1 1 103 103 PRO CA C 103 62.435 62.435 63.490 -1.055 18321 4611 1 4 . 1 1 103 103 PRO CB C 103 32.145 32.145 31.322 0.823 18321 4612 1 4 . 1 1 104 104 ARG HA H 104 4.004 4.004 4.020 -0.016 18321 4613 1 4 . 1 1 104 104 ARG CA C 104 56.660 56.660 58.564 -1.904 18321 4614 1 4 . 1 1 106 106 PRO C C 106 174.587 174.587 175.625 -1.038 18321 4615 1 4 . 1 1 106 106 PRO CA C 106 57.867 57.867 63.207 -5.340 18321 4616 1 4 . 1 1 106 106 PRO CB C 106 31.942 31.942 31.618 0.324 18321 4617 1 4 . 1 1 107 107 SER N N 107 121.280 121.280 121.417 -0.137 18321 4618 1 4 . 1 1 107 107 SER CA C 107 61.772 61.772 55.352 6.420 18321 4619 1 4 . 1 1 107 107 SER CB C 107 63.234 63.234 63.794 -0.560 18321 4620 1 4 . 1 1 107 107 SER H H 107 8.132 8.132 8.085 0.047 18321 4621 1 4 . 1 1 109 109 PRO C C 109 177.129 177.129 176.504 0.625 18321 4622 1 4 . 1 1 109 109 PRO CA C 109 62.638 62.638 63.829 -1.191 18321 4623 1 4 . 1 1 109 109 PRO CB C 109 30.970 30.970 31.868 -0.898 18321 4624 1 4 . 1 1 110 110 MET N N 110 120.772 120.772 119.005 1.767 18321 4625 1 4 . 1 1 110 110 MET C C 110 176.892 176.892 176.437 0.455 18321 4626 1 4 . 1 1 110 110 MET CA C 110 55.310 55.310 56.253 -0.943 18321 4627 1 4 . 1 1 110 110 MET CB C 110 32.202 32.202 31.588 0.614 18321 4628 1 4 . 1 1 110 110 MET H H 110 8.430 8.430 7.869 0.561 18321 4629 1 4 . 1 1 111 111 GLY N N 111 110.158 110.158 112.500 -2.342 18321 4630 1 4 . 1 1 111 111 GLY C C 111 177.430 177.430 174.922 2.508 18321 4631 1 4 . 1 1 111 111 GLY CA C 111 44.951 44.951 45.482 -0.531 18321 4632 1 4 . 1 1 111 111 GLY H H 111 8.384 8.384 8.288 0.096 18321 4633 1 4 . 1 1 112 112 SER N N 112 116.762 116.762 120.453 -3.691 18321 4634 1 4 . 1 1 112 112 SER CA C 112 55.948 55.948 57.941 -1.993 18321 4635 1 4 . 1 1 112 112 SER CB C 112 62.745 62.745 62.427 0.318 18321 4636 1 4 . 1 1 112 112 SER H H 112 8.161 8.161 8.542 -0.381 18321 4637 1 4 . 1 1 113 113 VAL C C 113 176.083 176.083 176.477 -0.394 18321 4638 1 4 . 1 1 114 114 SER N N 114 119.151 119.151 115.726 3.425 18321 4639 1 4 . 1 1 114 114 SER C C 114 173.638 173.638 174.323 -0.685 18321 4640 1 4 . 1 1 114 114 SER CA C 114 58.005 58.005 58.268 -0.263 18321 4641 1 4 . 1 1 114 114 SER CB C 114 63.169 63.169 63.356 -0.187 18321 4642 1 4 . 1 1 114 114 SER H H 114 8.319 8.319 8.131 0.188 18321 4643 1 4 . 1 1 115 115 ALA N N 115 126.914 126.914 124.718 2.196 18321 4644 1 4 . 1 1 115 115 ALA CA C 115 51.561 51.561 54.193 -2.632 18321 4645 1 4 . 1 1 115 115 ALA CB C 115 17.714 17.714 17.505 0.209 18321 4646 1 4 . 1 1 115 115 ALA H H 115 8.197 8.197 7.402 0.795 18321 4647 1 4 . 1 1 119 119 PRO C C 119 177.065 177.065 176.740 0.325 18321 4648 1 4 . 1 1 120 120 THR N N 120 113.976 113.976 111.635 2.341 18321 4649 1 4 . 1 1 120 120 THR C C 120 174.461 174.461 173.879 0.582 18321 4650 1 4 . 1 1 120 120 THR CA C 120 61.215 61.215 63.011 -1.796 18321 4651 1 4 . 1 1 120 120 THR CB C 120 69.508 69.508 67.034 2.474 18321 4652 1 4 . 1 1 120 120 THR H H 120 8.138 8.138 8.279 -0.141 18321 4653 1 4 . 1 1 121 121 ALA N N 121 125.859 125.859 118.718 7.141 18321 4654 1 4 . 1 1 121 121 ALA CA C 121 52.281 52.281 53.109 -0.828 18321 4655 1 4 . 1 1 121 121 ALA CB C 121 18.623 18.623 19.024 -0.401 18321 4656 1 4 . 1 1 121 121 ALA H H 121 8.272 8.272 7.957 0.315 18321 4657 1 4 . 1 1 122 122 GLU C C 122 176.316 176.316 176.399 -0.083 18321 4658 1 4 . 1 1 123 123 ASP N N 123 120.448 120.448 118.760 1.688 18321 4659 1 4 . 1 1 123 123 ASP C C 123 175.906 175.906 175.809 0.097 18321 4660 1 4 . 1 1 123 123 ASP CA C 123 54.167 54.167 55.464 -1.297 18321 4661 1 4 . 1 1 123 123 ASP CB C 123 40.695 40.695 41.487 -0.792 18321 4662 1 4 . 1 1 123 123 ASP H H 123 8.181 8.181 8.512 -0.331 18321 4663 1 4 . 1 1 124 124 ASN N N 124 118.207 118.207 116.184 2.023 18321 4664 1 4 . 1 1 124 124 ASN C C 124 174.851 174.851 173.776 1.075 18321 4665 1 4 . 1 1 124 124 ASN CA C 124 52.771 52.771 53.218 -0.447 18321 4666 1 4 . 1 1 124 124 ASN CB C 124 38.304 38.304 39.220 -0.916 18321 4667 1 4 . 1 1 124 124 ASN H H 124 8.307 8.307 7.641 0.666 18321 4668 1 4 . 1 1 125 125 LEU N N 125 121.311 121.311 122.966 -1.655 18321 4669 1 4 . 1 1 125 125 LEU C C 125 175.750 175.750 175.409 0.341 18321 4670 1 4 . 1 1 125 125 LEU CA C 125 54.428 54.428 55.585 -1.157 18321 4671 1 4 . 1 1 125 125 LEU CB C 125 41.350 41.350 40.297 1.053 18321 4672 1 4 . 1 1 125 125 LEU H H 125 7.747 7.747 8.391 -0.644 18321 4673 1 4 . 1 1 126 126 GLU N N 126 122.485 122.485 120.879 1.606 18321 4674 1 4 . 1 1 126 126 GLU C C 126 174.008 174.008 174.183 -0.175 18321 4675 1 4 . 1 1 126 126 GLU CA C 126 54.855 54.855 56.524 -1.669 18321 4676 1 4 . 1 1 126 126 GLU CB C 126 30.472 30.472 31.323 -0.851 18321 4677 1 4 . 1 1 126 126 GLU H H 126 8.453 8.453 8.207 0.246 18321 4678 1 4 . 1 1 127 127 TYR N N 127 122.713 122.713 121.338 1.375 18321 4679 1 4 . 1 1 127 127 TYR C C 127 176.859 176.859 174.849 2.010 18321 4680 1 4 . 1 1 127 127 TYR CA C 127 56.528 56.528 56.982 -0.454 18321 4681 1 4 . 1 1 127 127 TYR CB C 127 40.982 40.982 38.948 2.034 18321 4682 1 4 . 1 1 127 127 TYR H H 127 8.469 8.469 7.710 0.759 18321 4683 1 4 . 1 1 128 128 VAL N N 128 112.432 112.432 125.132 -12.700 18321 4684 1 4 . 1 1 128 128 VAL C C 128 173.150 173.150 174.332 -1.182 18321 4685 1 4 . 1 1 128 128 VAL CA C 128 57.940 57.940 60.709 -2.769 18321 4686 1 4 . 1 1 128 128 VAL CB C 128 34.935 34.935 34.577 0.358 18321 4687 1 4 . 1 1 128 128 VAL H H 128 9.078 9.078 9.053 0.025 18321 4688 1 4 . 1 1 129 129 ARG N N 129 120.373 120.373 125.141 -4.768 18321 4689 1 4 . 1 1 129 129 ARG C C 129 176.539 176.539 175.528 1.011 18321 4690 1 4 . 1 1 129 129 ARG CA C 129 52.534 52.534 53.782 -1.248 18321 4691 1 4 . 1 1 129 129 ARG CB C 129 32.942 32.942 32.867 0.075 18321 4692 1 4 . 1 1 129 129 ARG H H 129 9.010 9.010 8.145 0.865 18321 4693 1 4 . 1 1 130 130 THR N N 130 116.637 116.637 112.459 4.178 18321 4694 1 4 . 1 1 130 130 THR CA C 130 60.618 60.618 60.683 -0.065 18321 4695 1 4 . 1 1 130 130 THR CB C 130 69.170 69.170 70.203 -1.033 18321 4696 1 4 . 1 1 130 130 THR H H 130 9.045 9.045 8.582 0.463 18321 4697 1 4 . 1 1 131 131 LEU N N 131 122.910 122.910 125.011 -2.101 18321 4698 1 4 . 1 1 131 131 LEU C C 131 175.269 175.269 178.301 -3.032 18321 4699 1 4 . 1 1 131 131 LEU CA C 131 55.122 55.122 55.702 -0.580 18321 4700 1 4 . 1 1 131 131 LEU CB C 131 43.108 43.108 42.408 0.700 18321 4701 1 4 . 1 1 131 131 LEU H H 131 9.224 9.224 8.387 0.837 18321 4702 1 4 . 1 1 132 132 TYR N N 132 112.885 112.885 120.045 -7.160 18321 4703 1 4 . 1 1 132 132 TYR C C 132 173.818 173.818 175.717 -1.899 18321 4704 1 4 . 1 1 132 132 TYR CA C 132 54.230 54.230 60.124 -5.894 18321 4705 1 4 . 1 1 132 132 TYR CB C 132 42.672 42.672 39.472 3.200 18321 4706 1 4 . 1 1 132 132 TYR H H 132 7.284 7.284 7.611 -0.327 18321 4707 1 4 . 1 1 133 133 ASP N N 133 118.003 118.003 119.183 -1.180 18321 4708 1 4 . 1 1 133 133 ASP C C 133 175.779 175.779 174.662 1.117 18321 4709 1 4 . 1 1 133 133 ASP CA C 133 54.351 54.351 55.306 -0.955 18321 4710 1 4 . 1 1 133 133 ASP CB C 133 41.241 41.241 39.858 1.383 18321 4711 1 4 . 1 1 133 133 ASP H H 133 8.399 8.399 8.221 0.178 18321 4712 1 4 . 1 1 134 134 PHE N N 134 121.081 121.081 124.218 -3.137 18321 4713 1 4 . 1 1 134 134 PHE CA C 134 52.552 52.552 54.851 -2.299 18321 4714 1 4 . 1 1 134 134 PHE CB C 134 41.217 41.217 41.569 -0.352 18321 4715 1 4 . 1 1 134 134 PHE H H 134 8.797 8.797 7.711 1.086 18321 4716 1 4 . 1 1 136 136 GLY C C 136 171.616 171.616 174.644 -3.028 18321 4717 1 4 . 1 1 137 137 ASN N N 137 119.394 119.394 116.948 2.446 18321 4718 1 4 . 1 1 137 137 ASN C C 137 174.500 174.500 173.930 0.570 18321 4719 1 4 . 1 1 137 137 ASN CA C 137 44.670 44.670 54.247 -9.577 18321 4720 1 4 . 1 1 137 137 ASN H H 137 9.477 9.477 8.178 1.299 18321 4721 1 4 . 1 1 138 138 ASP N N 138 120.608 120.608 119.374 1.234 18321 4722 1 4 . 1 1 138 138 ASP C C 138 176.987 176.987 174.411 2.576 18321 4723 1 4 . 1 1 138 138 ASP CA C 138 52.992 52.992 52.763 0.229 18321 4724 1 4 . 1 1 138 138 ASP H H 138 8.216 8.216 7.767 0.449 18321 4725 1 4 . 1 1 139 139 ALA N N 139 124.371 124.371 120.716 3.655 18321 4726 1 4 . 1 1 139 139 ALA C C 139 178.472 178.472 177.490 0.982 18321 4727 1 4 . 1 1 139 139 ALA CA C 139 54.513 54.513 52.447 2.066 18321 4728 1 4 . 1 1 139 139 ALA CB C 139 18.045 18.045 20.217 -2.172 18321 4729 1 4 . 1 1 139 139 ALA H H 139 8.565 8.565 8.535 0.030 18321 4730 1 4 . 1 1 140 140 GLU N N 140 115.022 115.022 117.778 -2.756 18321 4731 1 4 . 1 1 140 140 GLU C C 140 177.027 177.027 175.314 1.713 18321 4732 1 4 . 1 1 140 140 GLU CA C 140 56.181 56.181 56.862 -0.681 18321 4733 1 4 . 1 1 140 140 GLU CB C 140 28.619 28.619 31.774 -3.155 18321 4734 1 4 . 1 1 140 140 GLU H H 140 8.616 8.616 8.214 0.402 18321 4735 1 4 . 1 1 141 141 ASP N N 141 121.913 121.913 120.686 1.227 18321 4736 1 4 . 1 1 141 141 ASP C C 141 175.923 175.923 175.107 0.816 18321 4737 1 4 . 1 1 141 141 ASP CA C 141 54.736 54.736 53.627 1.109 18321 4738 1 4 . 1 1 141 141 ASP CB C 141 41.305 41.305 41.593 -0.288 18321 4739 1 4 . 1 1 141 141 ASP H H 141 7.636 7.636 8.157 -0.521 18321 4740 1 4 . 1 1 142 142 LEU N N 142 127.651 127.651 126.609 1.042 18321 4741 1 4 . 1 1 142 142 LEU CA C 142 50.955 50.955 52.975 -2.020 18321 4742 1 4 . 1 1 142 142 LEU CB C 142 42.343 42.343 43.586 -1.242 18321 4743 1 4 . 1 1 142 142 LEU H H 142 9.479 9.479 8.271 1.208 18321 4744 1 4 . 1 1 143 143 PRO C C 143 177.924 177.924 175.654 2.270 18321 4745 1 4 . 1 1 144 144 PHE N N 144 114.483 114.483 121.487 -7.004 18321 4746 1 4 . 1 1 144 144 PHE C C 144 175.055 175.055 174.729 0.326 18321 4747 1 4 . 1 1 144 144 PHE CA C 144 55.543 55.543 54.828 0.715 18321 4748 1 4 . 1 1 144 144 PHE CB C 144 40.581 40.581 41.314 -0.733 18321 4749 1 4 . 1 1 144 144 PHE H H 144 8.637 8.637 7.407 1.230 18321 4750 1 4 . 1 1 145 145 LYS N N 145 121.342 121.342 120.033 1.309 18321 4751 1 4 . 1 1 145 145 LYS C C 145 176.925 176.925 178.266 -1.341 18321 4752 1 4 . 1 1 145 145 LYS CA C 145 53.043 53.043 54.349 -1.306 18321 4753 1 4 . 1 1 145 145 LYS CB C 145 33.804 33.804 34.575 -0.770 18321 4754 1 4 . 1 1 145 145 LYS H H 145 9.418 9.418 8.999 0.419 18321 4755 1 4 . 1 1 146 146 LYS N N 146 123.378 123.378 118.953 4.425 18321 4756 1 4 . 1 1 146 146 LYS CA C 146 57.883 57.883 57.412 0.471 18321 4757 1 4 . 1 1 146 146 LYS CB C 146 32.008 32.008 32.266 -0.258 18321 4758 1 4 . 1 1 146 146 LYS H H 146 9.002 9.002 8.741 0.261 18321 4759 1 4 . 1 1 147 147 GLY C C 147 174.315 174.315 173.336 0.979 18321 4760 1 4 . 1 1 148 148 GLU N N 148 121.392 121.392 120.350 1.042 18321 4761 1 4 . 1 1 148 148 GLU C C 148 174.998 174.998 175.329 -0.331 18321 4762 1 4 . 1 1 148 148 GLU CA C 148 56.867 56.867 54.818 2.050 18321 4763 1 4 . 1 1 148 148 GLU CB C 148 31.649 31.649 32.020 -0.371 18321 4764 1 4 . 1 1 148 148 GLU H H 148 7.937 7.937 7.781 0.156 18321 4765 1 4 . 1 1 149 149 ILE N N 149 120.124 120.124 122.547 -2.423 18321 4766 1 4 . 1 1 149 149 ILE C C 149 176.647 176.647 175.053 1.594 18321 4767 1 4 . 1 1 149 149 ILE CA C 149 58.621 58.621 61.208 -2.587 18321 4768 1 4 . 1 1 149 149 ILE CB C 149 36.952 36.952 38.150 -1.198 18321 4769 1 4 . 1 1 149 149 ILE H H 149 8.346 8.346 8.637 -0.291 18321 4770 1 4 . 1 1 150 150 LEU N N 150 126.950 126.950 125.352 1.598 18321 4771 1 4 . 1 1 150 150 LEU CA C 150 51.967 51.967 52.973 -1.006 18321 4772 1 4 . 1 1 150 150 LEU CB C 150 44.182 44.182 45.657 -1.474 18321 4773 1 4 . 1 1 150 150 LEU H H 150 8.988 8.988 9.068 -0.080 18321 4774 1 4 . 1 1 151 151 VAL C C 151 175.670 175.670 176.061 -0.391 18321 4775 1 4 . 1 1 152 152 ILE N N 152 124.997 124.997 129.561 -4.564 18321 4776 1 4 . 1 1 152 152 ILE CA C 152 58.331 58.331 60.402 -2.071 18321 4777 1 4 . 1 1 152 152 ILE CB C 152 34.093 34.093 34.905 -0.812 18321 4778 1 4 . 1 1 152 152 ILE H H 152 8.673 8.673 8.773 -0.100 18321 4779 1 4 . 1 1 153 153 ILE N N 153 124.710 124.710 129.076 -4.366 18321 4780 1 4 . 1 1 153 153 ILE C C 153 176.264 176.264 175.019 1.245 18321 4781 1 4 . 1 1 154 154 GLU N N 154 117.398 117.398 117.030 0.368 18321 4782 1 4 . 1 1 154 154 GLU C C 154 173.959 173.959 174.089 -0.130 18321 4783 1 4 . 1 1 154 154 GLU CA C 154 55.289 55.289 54.512 0.777 18321 4784 1 4 . 1 1 154 154 GLU CB C 154 32.842 32.842 33.086 -0.244 18321 4785 1 4 . 1 1 154 154 GLU H H 154 7.818 7.818 8.430 -0.612 18321 4786 1 4 . 1 1 155 155 LYS N N 155 121.130 121.130 123.712 -2.582 18321 4787 1 4 . 1 1 155 155 LYS CA C 155 53.022 53.022 52.649 0.373 18321 4788 1 4 . 1 1 155 155 LYS CB C 155 32.663 32.663 32.943 -0.280 18321 4789 1 4 . 1 1 155 155 LYS H H 155 8.654 8.654 8.079 0.575 18321 4790 1 4 . 1 1 157 157 GLU C C 157 175.190 175.190 176.156 -0.966 18321 4791 1 4 . 1 1 157 157 GLU CA C 157 53.785 53.785 54.310 -0.525 18321 4792 1 4 . 1 1 157 157 GLU CB C 157 32.685 32.685 32.119 0.566 18321 4793 1 4 . 1 1 158 158 GLU N N 158 117.425 117.425 118.835 -1.410 18321 4794 1 4 . 1 1 158 158 GLU C C 158 178.600 178.600 178.280 0.320 18321 4795 1 4 . 1 1 158 158 GLU CA C 158 59.044 59.044 58.516 0.528 18321 4796 1 4 . 1 1 158 158 GLU CB C 158 29.706 29.706 30.134 -0.428 18321 4797 1 4 . 1 1 158 158 GLU H H 158 8.678 8.678 8.665 0.013 18321 4798 1 4 . 1 1 159 159 GLN N N 159 110.925 110.925 117.633 -6.708 18321 4799 1 4 . 1 1 159 159 GLN C C 159 175.539 175.539 174.870 0.669 18321 4800 1 4 . 1 1 159 159 GLN CA C 159 54.942 54.942 56.431 -1.489 18321 4801 1 4 . 1 1 159 159 GLN CB C 159 28.572 28.572 29.662 -1.090 18321 4802 1 4 . 1 1 159 159 GLN H H 159 8.483 8.483 8.507 -0.024 18321 4803 1 4 . 1 1 160 160 TRP N N 160 120.171 120.171 120.448 -0.277 18321 4804 1 4 . 1 1 160 160 TRP C C 160 173.444 173.444 174.798 -1.354 18321 4805 1 4 . 1 1 160 160 TRP CA C 160 56.175 56.175 56.367 -0.192 18321 4806 1 4 . 1 1 160 160 TRP CB C 160 31.796 31.796 32.215 -0.419 18321 4807 1 4 . 1 1 160 160 TRP H H 160 6.826 6.826 7.832 -1.006 18321 4808 1 4 . 1 1 161 161 TRP N N 161 120.687 120.687 121.935 -1.248 18321 4809 1 4 . 1 1 161 161 TRP C C 161 174.736 174.736 175.850 -1.114 18321 4810 1 4 . 1 1 161 161 TRP CA C 161 51.889 51.889 54.800 -2.910 18321 4811 1 4 . 1 1 161 161 TRP CB C 161 32.772 32.772 31.638 1.134 18321 4812 1 4 . 1 1 161 161 TRP H H 161 8.462 8.462 9.483 -1.021 18321 4813 1 4 . 1 1 162 162 SER N N 162 115.691 115.691 120.445 -4.754 18321 4814 1 4 . 1 1 162 162 SER C C 162 174.320 174.320 173.298 1.022 18321 4815 1 4 . 1 1 162 162 SER CA C 162 57.011 57.011 58.574 -1.563 18321 4816 1 4 . 1 1 162 162 SER CB C 162 63.948 63.948 63.124 0.824 18321 4817 1 4 . 1 1 162 162 SER H H 162 8.830 8.830 9.210 -0.380 18321 4818 1 4 . 1 1 163 163 ALA N N 163 130.630 130.630 128.365 2.265 18321 4819 1 4 . 1 1 163 163 ALA CA C 163 50.029 50.029 50.033 -0.004 18321 4820 1 4 . 1 1 163 163 ALA CB C 163 25.500 25.500 22.309 3.191 18321 4821 1 4 . 1 1 163 163 ALA H H 163 9.585 9.585 9.215 0.370 18321 4822 1 4 . 1 1 164 164 ARG N N 164 117.526 117.526 121.553 -4.027 18321 4823 1 4 . 1 1 164 164 ARG C C 164 176.719 176.719 176.697 0.022 18321 4824 1 4 . 1 1 164 164 ARG CA C 164 52.975 52.975 54.320 -1.345 18321 4825 1 4 . 1 1 164 164 ARG CB C 164 34.260 34.260 30.602 3.658 18321 4826 1 4 . 1 1 164 164 ARG H H 164 9.097 9.097 9.133 -0.036 18321 4827 1 4 . 1 1 165 165 ASN N N 165 123.935 123.935 122.874 1.061 18321 4828 1 4 . 1 1 165 165 ASN C C 165 178.484 178.484 177.156 1.328 18321 4829 1 4 . 1 1 165 165 ASN CA C 165 50.332 50.332 54.535 -4.204 18321 4830 1 4 . 1 1 165 165 ASN CB C 165 39.487 39.487 39.450 0.037 18321 4831 1 4 . 1 1 165 165 ASN H H 165 8.756 8.756 9.055 -0.299 18321 4832 1 4 . 1 1 166 166 LYS N N 166 118.464 118.464 121.207 -2.743 18321 4833 1 4 . 1 1 166 166 LYS C C 166 176.967 176.967 177.463 -0.496 18321 4834 1 4 . 1 1 166 166 LYS CA C 166 58.430 58.430 58.320 0.110 18321 4835 1 4 . 1 1 166 166 LYS CB C 166 30.918 30.918 32.285 -1.367 18321 4836 1 4 . 1 1 166 166 LYS H H 166 8.915 8.915 9.344 -0.429 18321 4837 1 4 . 1 1 167 167 ASP N N 167 118.138 118.138 116.132 2.006 18321 4838 1 4 . 1 1 167 167 ASP C C 167 176.464 176.464 177.142 -0.678 18321 4839 1 4 . 1 1 167 167 ASP CA C 167 54.212 54.212 55.067 -0.855 18321 4840 1 4 . 1 1 167 167 ASP CB C 167 41.178 41.178 41.445 -0.267 18321 4841 1 4 . 1 1 167 167 ASP H H 167 7.508 7.508 8.385 -0.877 18321 4842 1 4 . 1 1 168 168 GLY N N 168 107.901 107.901 106.849 1.052 18321 4843 1 4 . 1 1 168 168 GLY C C 168 173.613 173.613 173.446 0.167 18321 4844 1 4 . 1 1 168 168 GLY CA C 168 44.783 44.783 44.974 -0.191 18321 4845 1 4 . 1 1 168 168 GLY H H 168 8.173 8.173 8.066 0.107 18321 4846 1 4 . 1 1 169 169 ARG N N 169 124.324 124.324 121.281 3.043 18321 4847 1 4 . 1 1 169 169 ARG CA C 169 56.106 56.106 56.469 -0.363 18321 4848 1 4 . 1 1 169 169 ARG CB C 169 29.648 29.648 31.436 -1.788 18321 4849 1 4 . 1 1 169 169 ARG H H 169 7.998 7.998 7.847 0.151 18321 4850 1 4 . 1 1 170 170 VAL C C 170 177.590 177.590 174.694 2.896 18321 4851 1 4 . 1 1 171 171 GLY N N 171 112.582 112.582 113.784 -1.202 18321 4852 1 4 . 1 1 171 171 GLY C C 171 170.991 170.991 172.797 -1.806 18321 4853 1 4 . 1 1 171 171 GLY CA C 171 45.361 45.361 44.717 0.644 18321 4854 1 4 . 1 1 171 171 GLY H H 171 9.013 9.013 8.494 0.519 18321 4855 1 4 . 1 1 172 172 MET N N 172 117.368 117.368 121.905 -4.537 18321 4856 1 4 . 1 1 172 172 MET C C 172 177.921 177.921 176.100 1.821 18321 4857 1 4 . 1 1 172 172 MET CA C 172 53.536 53.536 54.738 -1.202 18321 4858 1 4 . 1 1 172 172 MET CB C 172 30.838 30.838 33.112 -2.274 18321 4859 1 4 . 1 1 172 172 MET H H 172 8.885 8.885 8.927 -0.042 18321 4860 1 4 . 1 1 173 173 ILE N N 173 113.130 113.130 118.327 -5.197 18321 4861 1 4 . 1 1 173 173 ILE CA C 173 56.284 56.284 57.955 -1.671 18321 4862 1 4 . 1 1 173 173 ILE CB C 173 40.870 40.870 40.765 0.105 18321 4863 1 4 . 1 1 173 173 ILE H H 173 9.704 9.704 9.324 0.380 18321 4864 1 4 . 1 1 174 174 PRO C C 174 176.714 176.714 177.850 -1.136 18321 4865 1 4 . 1 1 174 174 PRO CA C 174 66.290 66.290 61.438 4.852 18321 4866 1 4 . 1 1 174 174 PRO CB C 174 28.993 28.993 30.648 -1.655 18321 4867 1 4 . 1 1 175 175 VAL N N 175 128.066 128.066 124.166 3.900 18321 4868 1 4 . 1 1 175 175 VAL CA C 175 59.356 59.356 67.970 -8.614 18321 4869 1 4 . 1 1 175 175 VAL H H 175 7.327 7.327 8.072 -0.745 18321 4870 1 4 . 1 1 176 176 PRO C C 176 176.351 176.351 176.721 -0.370 18321 4871 1 4 . 1 1 177 177 TYR N N 177 115.756 115.756 115.773 -0.017 18321 4872 1 4 . 1 1 177 177 TYR C C 177 175.011 175.011 175.535 -0.524 18321 4873 1 4 . 1 1 177 177 TYR CA C 177 56.756 56.756 57.194 -0.438 18321 4874 1 4 . 1 1 177 177 TYR CB C 177 37.507 37.507 38.998 -1.491 18321 4875 1 4 . 1 1 177 177 TYR H H 177 7.784 7.784 7.510 0.274 18321 4876 1 4 . 1 1 178 178 VAL N N 178 111.428 111.428 114.948 -3.520 18321 4877 1 4 . 1 1 178 178 VAL C C 178 173.417 173.417 175.745 -2.328 18321 4878 1 4 . 1 1 178 178 VAL CA C 178 58.307 58.307 59.479 -1.172 18321 4879 1 4 . 1 1 178 178 VAL CB C 178 34.602 34.602 33.958 0.644 18321 4880 1 4 . 1 1 178 178 VAL H H 178 7.801 7.801 7.528 0.273 18321 4881 1 4 . 1 1 179 179 GLU N N 179 118.581 118.581 120.057 -1.476 18321 4882 1 4 . 1 1 179 179 GLU C C 179 175.225 175.225 175.590 -0.365 18321 4883 1 4 . 1 1 179 179 GLU CA C 179 53.114 53.114 55.020 -1.906 18321 4884 1 4 . 1 1 179 179 GLU CB C 179 32.712 32.712 30.601 2.111 18321 4885 1 4 . 1 1 179 179 GLU H H 179 8.819 8.819 8.399 0.420 18321 4886 1 4 . 1 1 180 180 LYS N N 180 124.167 124.167 120.465 3.702 18321 4887 1 4 . 1 1 180 180 LYS C C 180 176.303 176.303 176.424 -0.121 18321 4888 1 4 . 1 1 180 180 LYS CA C 180 57.318 57.318 56.926 0.392 18321 4889 1 4 . 1 1 180 180 LYS CB C 180 31.675 31.675 32.490 -0.815 18321 4890 1 4 . 1 1 180 180 LYS H H 180 8.775 8.775 7.992 0.783 18321 4891 1 4 . 1 1 181 181 LEU N N 181 125.157 125.157 125.499 -0.342 18321 4892 1 4 . 1 1 181 181 LEU C C 181 176.462 176.462 177.585 -1.123 18321 4893 1 4 . 1 1 181 181 LEU CA C 181 54.470 54.470 56.209 -1.739 18321 4894 1 4 . 1 1 181 181 LEU CB C 181 41.625 41.625 43.289 -1.665 18321 4895 1 4 . 1 1 181 181 LEU H H 181 8.084 8.084 8.459 -0.375 18321 4896 1 4 . 1 1 182 182 VAL N N 182 123.167 123.167 116.090 7.077 18321 4897 1 4 . 1 1 182 182 VAL C C 182 175.983 175.983 175.125 0.858 18321 4898 1 4 . 1 1 182 182 VAL CA C 182 61.613 61.613 62.643 -1.030 18321 4899 1 4 . 1 1 182 182 VAL CB C 182 32.085 32.085 30.700 1.385 18321 4900 1 4 . 1 1 182 182 VAL H H 182 8.345 8.345 8.058 0.287 18321 4901 1 4 . 1 1 183 183 ARG N N 183 125.775 125.775 126.456 -0.681 18321 4902 1 4 . 1 1 183 183 ARG CA C 183 57.801 57.801 55.509 2.292 18321 4903 1 4 . 1 1 183 183 ARG CB C 183 30.091 30.091 33.590 -3.498 18321 4904 1 4 . 1 1 183 183 ARG H H 183 8.530 8.530 7.900 0.630 18321 4905 1 4 . 1 1 184 184 SER C C 184 173.239 173.239 173.979 -0.740 18321 4906 1 4 . 1 1 185 185 SER N N 185 116.511 116.511 118.266 -1.755 18321 4907 1 4 . 1 1 185 185 SER CA C 185 58.428 58.428 56.799 1.629 18321 4908 1 4 . 1 1 185 185 SER CB C 185 69.737 69.737 63.209 6.528 18321 4909 1 4 . 1 1 185 185 SER H H 185 7.944 7.944 7.852 0.092 18321 4910 1 4 . 1 1 190 190 HIS C C 190 176.953 176.953 174.719 2.234 18321 4911 1 4 . 1 1 190 190 HIS CA C 190 54.229 54.229 58.374 -4.145 18321 4912 1 4 . 1 1 190 190 HIS CB C 190 35.112 35.112 29.413 5.699 18321 4913 1 4 . 1 1 191 191 GLY N N 191 109.491 109.491 106.492 2.999 18321 4914 1 4 . 1 1 191 191 GLY C C 191 172.295 172.295 172.863 -0.568 18321 4915 1 4 . 1 1 191 191 GLY CA C 191 45.227 45.227 44.407 0.820 18321 4916 1 4 . 1 1 191 191 GLY H H 191 8.719 8.719 8.323 0.396 18321 4917 1 4 . 1 1 192 192 ASN N N 192 118.700 118.700 115.473 3.227 18321 4918 1 4 . 1 1 192 192 ASN HA H 192 4.312 4.312 4.579 -0.267 18321 4919 1 4 . 1 1 192 192 ASN C C 192 176.369 176.369 174.955 1.414 18321 4920 1 4 . 1 1 192 192 ASN CA C 192 57.787 57.787 52.890 4.897 18321 4921 1 4 . 1 1 192 192 ASN H H 192 7.508 7.508 8.619 -1.111 18321 4922 1 4 . 1 1 193 193 ARG N N 193 120.743 120.743 120.263 0.480 18321 4923 1 4 . 1 1 193 193 ARG H H 193 9.032 9.032 7.767 1.265 18321 4924 1 4 . 1 1 197 197 SER HA H 197 4.388 4.388 4.330 0.058 18321 4925 1 4 . 1 1 197 197 SER C C 197 174.133 174.133 175.218 -1.085 18321 4926 1 4 . 1 1 197 197 SER CA C 197 58.128 58.128 58.456 -0.328 18321 4927 1 4 . 1 1 197 197 SER CB C 197 62.966 62.966 63.635 -0.669 18321 4928 1 4 . 1 1 198 198 TYR N N 198 121.435 121.435 119.457 1.978 18321 4929 1 4 . 1 1 198 198 TYR HA H 198 4.543 4.543 4.027 0.516 18321 4930 1 4 . 1 1 198 198 TYR C C 198 176.230 176.230 177.953 -1.723 18321 4931 1 4 . 1 1 198 198 TYR CA C 198 57.536 57.536 59.803 -2.267 18321 4932 1 4 . 1 1 198 198 TYR CB C 198 38.279 38.279 36.785 1.494 18321 4933 1 4 . 1 1 198 198 TYR H H 198 8.071 8.071 8.208 -0.137 18321 4934 1 4 . 1 1 199 199 GLY N N 199 110.039 110.039 109.396 0.643 18321 4935 1 4 . 1 1 199 199 GLY C C 199 173.475 173.475 174.212 -0.737 18321 4936 1 4 . 1 1 199 199 GLY CA C 199 44.805 44.805 45.858 -1.054 18321 4937 1 4 . 1 1 199 199 GLY H H 199 8.162 8.162 8.307 -0.145 18321 4938 1 4 . 1 1 200 200 ILE N N 200 121.530 121.530 122.353 -0.823 18321 4939 1 4 . 1 1 200 200 ILE CA C 200 58.102 58.102 57.948 0.154 18321 4940 1 4 . 1 1 200 200 ILE CB C 200 37.760 37.760 40.614 -2.854 18321 4941 1 4 . 1 1 200 200 ILE H H 200 7.851 7.851 7.879 -0.028 18321 4942 1 4 . 1 1 201 201 PRO C C 201 176.485 176.485 176.322 0.163 18321 4943 1 4 . 1 1 201 201 PRO CA C 201 53.893 53.893 64.871 -10.979 18321 4944 1 4 . 1 1 201 201 PRO CB C 201 29.042 29.042 32.181 -3.139 18321 4945 1 4 . 1 1 202 202 GLU N N 202 122.468 122.468 117.675 4.793 18321 4946 1 4 . 1 1 202 202 GLU CA C 202 62.490 62.490 53.156 9.334 18321 4947 1 4 . 1 1 202 202 GLU CB C 202 31.170 31.170 30.987 0.183 18321 4948 1 4 . 1 1 202 202 GLU H H 202 8.328 8.328 7.921 0.407 18321 4949 1 4 . 1 1 203 203 PRO CA C 203 62.803 62.803 63.230 -0.427 18321 4950 1 4 . 1 1 203 203 PRO CB C 203 31.220 31.220 31.516 -0.296 18321 4951 1 4 . 1 1 204 204 ALA N N 204 123.251 123.251 126.992 -3.741 18321 4952 1 4 . 1 1 204 204 ALA HA H 204 4.180 4.180 4.368 -0.188 18321 4953 1 4 . 1 1 204 204 ALA CA C 204 52.124 52.124 51.464 0.660 18321 4954 1 4 . 1 1 204 204 ALA CB C 204 18.892 18.892 20.547 -1.655 18321 4955 1 4 . 1 1 204 204 ALA H H 204 8.308 8.308 8.100 0.208 18321 4956 1 4 . 1 1 205 205 HIS N N 205 117.874 117.874 118.827 -0.953 18321 4957 1 4 . 1 1 205 205 HIS C C 205 173.282 173.282 174.147 -0.865 18321 4958 1 4 . 1 1 205 205 HIS H H 205 8.045 8.045 8.302 -0.257 18321 4959 1 4 . 1 1 206 206 ALA N N 206 125.519 125.519 124.831 0.688 18321 4960 1 4 . 1 1 206 206 ALA HA H 206 4.204 4.204 4.578 -0.374 18321 4961 1 4 . 1 1 206 206 ALA CA C 206 40.196 40.196 51.688 -11.492 18321 4962 1 4 . 1 1 206 206 ALA CB C 206 19.407 19.407 20.479 -1.072 18321 4963 1 4 . 1 1 206 206 ALA H H 206 8.061 8.061 8.536 -0.475 18321 4964 1 4 . 1 1 207 207 TYR N N 207 120.381 120.381 120.834 -0.453 18321 4965 1 4 . 1 1 207 207 TYR HA H 207 4.570 4.570 4.656 -0.086 18321 4966 1 4 . 1 1 207 207 TYR CA C 207 52.572 52.572 57.139 -4.567 18321 4967 1 4 . 1 1 207 207 TYR CB C 207 41.333 41.333 38.303 3.030 18321 4968 1 4 . 1 1 207 207 TYR H H 207 8.199 8.199 8.025 0.174 18321 4969 1 4 . 1 1 208 208 ALA HA H 208 4.281 4.281 3.794 0.487 18321 4970 1 4 . 1 1 208 208 ALA C C 208 177.736 177.736 177.416 0.320 18321 4971 1 4 . 1 1 208 208 ALA CA C 208 52.084 52.084 53.509 -1.425 18321 4972 1 4 . 1 1 208 208 ALA CB C 208 18.999 18.999 17.817 1.182 18321 4973 1 4 . 1 1 209 209 GLN N N 209 119.295 119.295 120.411 -1.116 18321 4974 1 4 . 1 1 209 209 GLN CA C 209 61.474 61.474 55.506 5.968 18321 4975 1 4 . 1 1 209 209 GLN CB C 209 32.039 32.039 28.725 3.314 18321 4976 1 4 . 1 1 209 209 GLN H H 209 8.125 8.125 8.681 -0.556 18321 4977 1 4 . 1 1 210 210 PRO HA H 210 4.395 4.395 4.452 -0.057 18321 4978 1 4 . 1 1 210 210 PRO CA C 210 62.584 62.584 62.736 -0.152 18321 4979 1 4 . 1 1 211 211 GLN HA H 211 4.377 4.377 4.414 -0.037 18321 4980 1 4 . 1 1 211 211 GLN CA C 211 55.859 55.859 55.797 0.062 18321 4981 1 4 . 1 1 211 211 GLN CB C 211 29.577 29.577 27.759 1.818 18321 4982 1 4 . 1 1 212 212 THR C C 212 176.551 176.551 175.338 1.213 18321 4983 1 4 . 1 1 212 212 THR CB C 212 69.890 69.890 69.087 0.803 18321 4984 1 4 . 1 1 213 213 THR N N 213 108.487 108.487 120.655 -12.168 18321 4985 1 4 . 1 1 213 213 THR CA C 213 61.236 61.236 63.959 -2.723 18321 4986 1 4 . 1 1 213 213 THR CB C 213 69.091 69.091 68.541 0.550 18321 4987 1 4 . 1 1 213 213 THR H H 213 8.243 8.243 8.079 0.164 18321 4988 1 4 . 1 1 214 214 THR N N 214 119.445 119.445 118.868 0.577 18321 4989 1 4 . 1 1 214 214 THR CA C 214 59.425 59.425 58.753 0.672 18321 4990 1 4 . 1 1 214 214 THR CB C 214 69.251 69.251 70.158 -0.907 18321 4991 1 4 . 1 1 214 214 THR H H 214 8.188 8.188 7.764 0.424 18321 4992 1 4 . 1 1 215 215 PRO HA H 215 4.361 4.361 4.658 -0.297 18321 4993 1 4 . 1 1 215 215 PRO C C 215 175.422 175.422 176.280 -0.858 18321 4994 1 4 . 1 1 215 215 PRO CA C 215 63.320 63.320 63.013 0.307 18321 4995 1 4 . 1 1 215 215 PRO CB C 215 31.918 31.918 31.262 0.656 18321 4996 1 4 . 1 1 216 216 LEU N N 216 121.602 121.602 121.619 -0.017 18321 4997 1 4 . 1 1 216 216 LEU CA C 216 52.203 52.203 56.176 -3.973 18321 4998 1 4 . 1 1 216 216 LEU CB C 216 42.451 42.451 40.130 2.321 18321 4999 1 4 . 1 1 216 216 LEU H H 216 7.891 7.891 7.662 0.229 18321 5000 1 4 . 1 1 217 217 PRO HA H 217 4.398 4.398 4.366 0.032 18321 5001 1 4 . 1 1 217 217 PRO C C 217 176.577 176.577 175.784 0.793 18321 5002 1 4 . 1 1 217 217 PRO CA C 217 62.984 62.984 63.365 -0.381 18321 5003 1 4 . 1 1 217 217 PRO CB C 217 32.056 32.056 30.974 1.081 18321 5004 1 4 . 1 1 218 218 ALA N N 218 124.087 124.087 126.935 -2.848 18321 5005 1 4 . 1 1 218 218 ALA HA H 218 4.309 4.309 4.549 -0.240 18321 5006 1 4 . 1 1 218 218 ALA C C 218 177.844 177.844 175.755 2.089 18321 5007 1 4 . 1 1 218 218 ALA CA C 218 52.379 52.379 52.361 0.018 18321 5008 1 4 . 1 1 218 218 ALA CB C 218 19.133 19.133 20.540 -1.407 18321 5009 1 4 . 1 1 218 218 ALA H H 218 8.261 8.261 8.326 -0.065 18321 5010 1 4 . 1 1 219 219 VAL N N 219 118.942 118.942 122.733 -3.791 18321 5011 1 4 . 1 1 219 219 VAL HA H 219 4.142 4.142 4.322 -0.180 18321 5012 1 4 . 1 1 219 219 VAL CA C 219 62.102 62.102 62.918 -0.816 18321 5013 1 4 . 1 1 219 219 VAL CB C 219 32.923 32.923 33.531 -0.608 18321 5014 1 4 . 1 1 219 219 VAL H H 219 8.049 8.049 8.554 -0.505 18321 5015 1 4 . 1 1 220 220 SER N N 220 119.207 119.207 117.212 1.995 18321 5016 1 4 . 1 1 220 220 SER HA H 220 4.436 4.436 4.828 -0.392 18321 5017 1 4 . 1 1 220 220 SER CA C 220 57.813 57.813 57.403 0.410 18321 5018 1 4 . 1 1 220 220 SER CB C 220 63.375 63.375 65.352 -1.977 18321 5019 1 4 . 1 1 220 220 SER H H 220 8.275 8.275 7.830 0.445 18321 5020 1 4 . 1 1 221 221 GLY N N 221 110.973 110.973 109.831 1.142 18321 5021 1 4 . 1 1 221 221 GLY C C 221 173.962 173.962 173.584 0.378 18321 5022 1 4 . 1 1 221 221 GLY CA C 221 45.286 45.286 44.073 1.213 18321 5023 1 4 . 1 1 221 221 GLY H H 221 8.374 8.374 8.353 0.021 18321 5024 1 4 . 1 1 222 222 SER N N 222 115.516 115.516 114.738 0.778 18321 5025 1 4 . 1 1 222 222 SER HA H 222 4.763 4.763 4.325 0.438 18321 5026 1 4 . 1 1 222 222 SER CA C 222 56.407 56.407 57.511 -1.104 18321 5027 1 4 . 1 1 222 222 SER CB C 222 63.993 63.993 63.353 0.640 18321 5028 1 4 . 1 1 222 222 SER H H 222 8.155 8.155 8.254 -0.099 18321 5029 1 4 . 1 1 223 223 PRO HA H 223 4.417 4.417 4.315 0.102 18321 5030 1 4 . 1 1 223 223 PRO CA C 223 63.805 63.805 63.433 0.372 18321 5031 1 4 . 1 1 223 223 PRO CB C 223 32.090 32.090 31.074 1.016 18321 5032 1 4 . 1 1 224 224 GLY N N 224 109.149 109.149 112.293 -3.144 18321 5033 1 4 . 1 1 224 224 GLY C C 224 173.813 173.813 174.066 -0.253 18321 5034 1 4 . 1 1 224 224 GLY CA C 224 44.512 44.512 45.373 -0.861 18321 5035 1 4 . 1 1 224 224 GLY H H 224 8.376 8.376 7.859 0.517 18321 5036 1 4 . 1 1 225 225 ALA N N 225 123.599 123.599 121.075 2.524 18321 5037 1 4 . 1 1 225 225 ALA C C 225 177.341 177.341 177.154 0.187 18321 5038 1 4 . 1 1 225 225 ALA CA C 225 51.878 51.878 53.345 -1.467 18321 5039 1 4 . 1 1 225 225 ALA CB C 225 19.169 19.169 18.368 0.801 18321 5040 1 4 . 1 1 225 225 ALA H H 225 7.959 7.959 8.101 -0.142 18321 5041 1 4 . 1 1 226 226 ALA N N 226 123.218 123.218 120.363 2.855 18321 5042 1 4 . 1 1 226 226 ALA HA H 226 4.350 4.350 4.201 0.149 18321 5043 1 4 . 1 1 226 226 ALA C C 226 177.520 177.520 178.438 -0.918 18321 5044 1 4 . 1 1 226 226 ALA CA C 226 52.535 52.535 53.135 -0.600 18321 5045 1 4 . 1 1 226 226 ALA CB C 226 19.171 19.171 18.538 0.633 18321 5046 1 4 . 1 1 226 226 ALA H H 226 8.169 8.169 8.132 0.037 18321 5047 1 4 . 1 1 227 227 ILE N N 227 120.086 120.086 116.961 3.125 18321 5048 1 4 . 1 1 227 227 ILE HA H 227 4.201 4.201 4.092 0.109 18321 5049 1 4 . 1 1 227 227 ILE C C 227 174.814 174.814 175.896 -1.082 18321 5050 1 4 . 1 1 227 227 ILE CA C 227 60.929 60.929 63.291 -2.362 18321 5051 1 4 . 1 1 227 227 ILE CB C 227 38.872 38.872 38.405 0.467 18321 5052 1 4 . 1 1 227 227 ILE H H 227 8.037 8.037 7.565 0.472 18321 5053 1 4 . 1 1 228 228 THR N N 228 117.224 117.224 112.760 4.464 18321 5054 1 4 . 1 1 228 228 THR HA H 228 4.203 4.203 4.674 -0.471 18321 5055 1 4 . 1 1 228 228 THR CA C 228 57.108 57.108 59.906 -2.798 18321 5056 1 4 . 1 1 228 228 THR CB C 228 69.945 69.945 70.520 -0.575 18321 5057 1 4 . 1 1 228 228 THR H H 228 7.775 7.775 7.436 0.339 18321 5058 1 4 . 1 1 229 229 PRO HA H 229 4.750 4.750 4.394 0.356 18321 5059 1 4 . 1 1 229 229 PRO CA C 229 62.480 62.480 62.771 -0.291 18321 5060 1 4 . 1 1 229 229 PRO CB C 229 33.995 33.995 31.993 2.002 18321 5061 1 4 . 1 1 230 230 LEU N N 230 123.629 123.629 127.354 -3.725 18321 5062 1 4 . 1 1 230 230 LEU CA C 230 53.076 53.076 51.531 1.545 18321 5063 1 4 . 1 1 230 230 LEU CB C 230 40.608 40.608 41.633 -1.024 18321 5064 1 4 . 1 1 230 230 LEU H H 230 8.453 8.453 8.280 0.173 18321 5065 1 4 . 1 1 231 231 PRO HA H 231 4.412 4.412 4.568 -0.156 18321 5066 1 4 . 1 1 231 231 PRO C C 231 176.571 176.571 176.767 -0.196 18321 5067 1 4 . 1 1 231 231 PRO CA C 231 63.225 63.225 63.081 0.144 18321 5068 1 4 . 1 1 231 231 PRO CB C 231 31.191 31.191 30.881 0.310 18321 5069 1 4 . 1 1 232 232 SER N N 232 115.169 115.169 116.146 -0.977 18321 5070 1 4 . 1 1 232 232 SER HA H 232 4.450 4.450 3.910 0.540 18321 5071 1 4 . 1 1 232 232 SER CA C 232 58.604 58.604 61.344 -2.740 18321 5072 1 4 . 1 1 232 232 SER CB C 232 63.962 63.962 61.827 2.135 18321 5073 1 4 . 1 1 232 232 SER H H 232 8.280 8.280 8.804 -0.524 18321 5074 1 4 . 1 1 233 233 THR N N 233 115.155 115.155 115.770 -0.615 18321 5075 1 4 . 1 1 233 233 THR HA H 233 4.351 4.351 3.809 0.542 18321 5076 1 4 . 1 1 233 233 THR C C 233 177.237 177.237 173.615 3.622 18321 5077 1 4 . 1 1 233 233 THR CA C 233 61.939 61.939 65.713 -3.775 18321 5078 1 4 . 1 1 233 233 THR CB C 233 68.986 68.986 67.436 1.550 18321 5079 1 4 . 1 1 233 233 THR H H 233 8.096 8.096 8.543 -0.447 18321 5080 1 4 . 1 1 234 234 GLN N N 234 122.040 122.040 120.120 1.920 18321 5081 1 4 . 1 1 234 234 GLN HA H 234 4.681 4.681 4.465 0.216 18321 5082 1 4 . 1 1 234 234 GLN C C 234 176.177 176.177 175.091 1.086 18321 5083 1 4 . 1 1 234 234 GLN CA C 234 55.861 55.861 55.230 0.631 18321 5084 1 4 . 1 1 234 234 GLN CB C 234 28.583 28.583 29.887 -1.304 18321 5085 1 4 . 1 1 234 234 GLN H H 234 8.256 8.256 8.052 0.204 18321 5086 1 4 . 1 1 235 235 ASN N N 235 119.506 119.506 120.598 -1.092 18321 5087 1 4 . 1 1 235 235 ASN HA H 235 4.775 4.775 4.822 -0.047 18321 5088 1 4 . 1 1 235 235 ASN C C 235 174.974 174.974 174.356 0.618 18321 5089 1 4 . 1 1 235 235 ASN CA C 235 53.191 53.191 53.355 -0.164 18321 5090 1 4 . 1 1 235 235 ASN CB C 235 38.511 38.511 40.019 -1.508 18321 5091 1 4 . 1 1 235 235 ASN H H 235 8.346 8.346 8.406 -0.061 18321 5092 1 4 . 1 1 236 236 GLY N N 236 109.378 109.378 110.767 -1.389 18321 5093 1 4 . 1 1 236 236 GLY CA C 236 44.023 44.023 44.829 -0.806 18321 5094 1 4 . 1 1 236 236 GLY H H 236 7.939 7.939 8.299 -0.360 18321 5095 1 4 . 1 1 237 237 PRO HA H 237 4.336 4.336 4.282 0.054 18321 5096 1 4 . 1 1 237 237 PRO C C 237 175.942 175.942 175.804 0.138 18321 5097 1 4 . 1 1 237 237 PRO CA C 237 62.797 62.797 62.202 0.596 18321 5098 1 4 . 1 1 237 237 PRO CB C 237 27.421 27.421 32.005 -4.585 18321 5099 1 4 . 1 1 238 238 VAL N N 238 120.535 120.535 124.833 -4.298 18321 5100 1 4 . 1 1 238 238 VAL HA H 238 4.195 4.195 3.850 0.345 18321 5101 1 4 . 1 1 238 238 VAL C C 238 173.775 173.775 175.400 -1.625 18321 5102 1 4 . 1 1 238 238 VAL CA C 238 61.173 61.173 62.954 -1.781 18321 5103 1 4 . 1 1 238 238 VAL CB C 238 38.328 38.328 32.016 6.312 18321 5104 1 4 . 1 1 238 238 VAL H H 238 7.986 7.986 8.108 -0.122 18321 5105 1 4 . 1 1 239 239 PHE N N 239 123.522 123.522 127.479 -3.957 18321 5106 1 4 . 1 1 239 239 PHE HA H 239 5.539 5.539 5.080 0.459 18321 5107 1 4 . 1 1 239 239 PHE C C 239 174.207 174.207 175.198 -0.991 18321 5108 1 4 . 1 1 239 239 PHE CA C 239 56.993 56.993 56.665 0.328 18321 5109 1 4 . 1 1 239 239 PHE CB C 239 41.743 41.743 39.913 1.830 18321 5110 1 4 . 1 1 239 239 PHE H H 239 8.927 8.927 8.412 0.515 18321 5111 1 4 . 1 1 240 240 ALA N N 240 120.871 120.871 127.091 -6.220 18321 5112 1 4 . 1 1 240 240 ALA HA H 240 5.352 5.352 5.520 -0.168 18321 5113 1 4 . 1 1 240 240 ALA C C 240 174.639 174.639 175.637 -0.998 18321 5114 1 4 . 1 1 240 240 ALA CA C 240 49.736 49.736 50.272 -0.536 18321 5115 1 4 . 1 1 240 240 ALA CB C 240 23.480 23.480 22.349 1.131 18321 5116 1 4 . 1 1 240 240 ALA H H 240 9.398 9.398 8.825 0.573 18321 5117 1 4 . 1 1 241 241 LYS N N 241 121.227 121.227 124.802 -3.575 18321 5118 1 4 . 1 1 241 241 LYS HA H 241 5.373 5.373 5.363 0.010 18321 5119 1 4 . 1 1 241 241 LYS C C 241 176.772 176.772 175.734 1.038 18321 5120 1 4 . 1 1 241 241 LYS CA C 241 53.128 53.128 54.414 -1.286 18321 5121 1 4 . 1 1 241 241 LYS CB C 241 34.850 34.850 35.227 -0.377 18321 5122 1 4 . 1 1 241 241 LYS H H 241 8.947 8.947 8.435 0.512 18321 5123 1 4 . 1 1 242 242 ALA N N 242 126.833 126.833 130.947 -4.114 18321 5124 1 4 . 1 1 242 242 ALA HA H 242 4.764 4.764 4.834 -0.070 18321 5125 1 4 . 1 1 242 242 ALA C C 242 178.506 178.506 177.679 0.827 18321 5126 1 4 . 1 1 242 242 ALA CA C 242 52.788 52.788 51.275 1.513 18321 5127 1 4 . 1 1 242 242 ALA CB C 242 19.084 19.084 19.261 -0.177 18321 5128 1 4 . 1 1 242 242 ALA H H 242 9.373 9.373 8.613 0.760 18321 5129 1 4 . 1 1 243 243 ILE N N 243 118.731 118.731 120.444 -1.713 18321 5130 1 4 . 1 1 243 243 ILE HA H 243 4.454 4.454 4.268 0.186 18321 5131 1 4 . 1 1 243 243 ILE C C 243 174.773 174.773 175.714 -0.941 18321 5132 1 4 . 1 1 243 243 ILE CA C 243 60.613 60.613 61.785 -1.172 18321 5133 1 4 . 1 1 243 243 ILE CB C 243 39.232 39.232 38.176 1.056 18321 5134 1 4 . 1 1 243 243 ILE H H 243 8.933 8.933 8.034 0.899 18321 5135 1 4 . 1 1 244 244 GLN N N 244 121.616 121.616 120.857 0.759 18321 5136 1 4 . 1 1 244 244 GLN HA H 244 4.283 4.283 4.513 -0.230 18321 5137 1 4 . 1 1 244 244 GLN C C 244 172.815 172.815 174.704 -1.889 18321 5138 1 4 . 1 1 244 244 GLN CA C 244 54.750 54.750 54.366 0.384 18321 5139 1 4 . 1 1 244 244 GLN CB C 244 31.469 31.469 31.566 -0.097 18321 5140 1 4 . 1 1 244 244 GLN H H 244 7.438 7.438 7.451 -0.013 18321 5141 1 4 . 1 1 245 245 LYS N N 245 124.215 124.215 124.602 -0.387 18321 5142 1 4 . 1 1 245 245 LYS HA H 245 3.962 3.962 4.262 -0.300 18321 5143 1 4 . 1 1 245 245 LYS C C 245 175.679 175.679 176.194 -0.515 18321 5144 1 4 . 1 1 245 245 LYS CA C 245 56.413 56.413 56.934 -0.521 18321 5145 1 4 . 1 1 245 245 LYS CB C 245 32.847 32.847 32.651 0.196 18321 5146 1 4 . 1 1 245 245 LYS H H 245 8.318 8.318 8.615 -0.297 18321 5147 1 4 . 1 1 246 246 ARG N N 246 127.327 127.327 125.771 1.556 18321 5148 1 4 . 1 1 246 246 ARG HA H 246 4.221 4.221 4.703 -0.482 18321 5149 1 4 . 1 1 246 246 ARG CA C 246 56.279 56.279 54.457 1.822 18321 5150 1 4 . 1 1 246 246 ARG CB C 246 32.987 32.987 31.489 1.498 18321 5151 1 4 . 1 1 246 246 ARG H H 246 9.248 9.248 8.363 0.885 18321 5152 1 4 . 1 1 249 249 CYS HA H 249 4.260 4.260 4.191 0.069 18321 5153 1 4 . 1 1 249 249 CYS CA C 249 55.886 55.886 57.044 -1.158 18321 5154 1 4 . 1 1 249 249 CYS CB C 249 34.146 34.146 29.153 4.993 18321 5155 1 4 . 1 1 250 250 ALA HA H 250 3.926 3.926 4.068 -0.142 18321 5156 1 4 . 1 1 250 250 ALA CA C 250 54.344 54.344 54.690 -0.346 18321 5157 1 4 . 1 1 250 250 ALA CB C 250 18.342 18.342 18.640 -0.298 18321 5158 1 4 . 1 1 251 251 TYR N N 251 110.618 110.618 111.641 -1.023 18321 5159 1 4 . 1 1 251 251 TYR HA H 251 4.489 4.489 4.754 -0.265 18321 5160 1 4 . 1 1 251 251 TYR C C 251 175.286 175.286 175.530 -0.244 18321 5161 1 4 . 1 1 251 251 TYR CA C 251 56.137 56.137 56.015 0.122 18321 5162 1 4 . 1 1 251 251 TYR CB C 251 37.203 37.203 37.963 -0.760 18321 5163 1 4 . 1 1 251 251 TYR H H 251 7.037 7.037 7.124 -0.087 18321 5164 1 4 . 1 1 252 252 ASP N N 252 121.835 121.835 120.950 0.885 18321 5165 1 4 . 1 1 252 252 ASP HA H 252 4.763 4.763 4.957 -0.194 18321 5166 1 4 . 1 1 252 252 ASP CA C 252 52.351 52.351 53.780 -1.429 18321 5167 1 4 . 1 1 252 252 ASP CB C 252 39.995 39.995 41.126 -1.131 18321 5168 1 4 . 1 1 252 252 ASP H H 252 7.339 7.339 7.660 -0.321 18321 5169 1 4 . 1 1 253 253 LYS N N 253 123.177 123.177 119.000 4.177 18321 5170 1 4 . 1 1 253 253 LYS HA H 253 4.270 4.270 4.048 0.222 18321 5171 1 4 . 1 1 253 253 LYS C C 253 177.724 177.724 177.176 0.548 18321 5172 1 4 . 1 1 253 253 LYS CA C 253 57.036 57.036 58.819 -1.783 18321 5173 1 4 . 1 1 253 253 LYS H H 253 8.396 8.396 8.413 -0.017 18321 5174 1 4 . 1 1 254 254 THR N N 254 108.317 108.317 108.015 0.302 18321 5175 1 4 . 1 1 254 254 THR HA H 254 4.517 4.517 4.357 0.160 18321 5176 1 4 . 1 1 254 254 THR C C 254 174.012 174.012 173.819 0.193 18321 5177 1 4 . 1 1 254 254 THR CA C 254 61.036 61.036 61.173 -0.138 18321 5178 1 4 . 1 1 254 254 THR CB C 254 69.307 69.307 68.475 0.832 18321 5179 1 4 . 1 1 254 254 THR H H 254 8.217 8.217 7.929 0.288 18321 5180 1 4 . 1 1 255 255 ALA N N 255 124.762 124.762 124.037 0.725 18321 5181 1 4 . 1 1 255 255 ALA HA H 255 4.524 4.524 4.833 -0.309 18321 5182 1 4 . 1 1 255 255 ALA C C 255 176.630 176.630 175.876 0.754 18321 5183 1 4 . 1 1 255 255 ALA CA C 255 51.352 51.352 50.577 0.775 18321 5184 1 4 . 1 1 255 255 ALA CB C 255 20.135 20.135 20.709 -0.574 18321 5185 1 4 . 1 1 255 255 ALA H H 255 7.096 7.096 7.567 -0.471 18321 5186 1 4 . 1 1 256 256 LEU N N 256 124.379 124.379 122.760 1.619 18321 5187 1 4 . 1 1 256 256 LEU HA H 256 4.328 4.328 4.422 -0.094 18321 5188 1 4 . 1 1 256 256 LEU C C 256 176.007 176.007 176.179 -0.172 18321 5189 1 4 . 1 1 256 256 LEU CA C 256 53.502 53.502 54.317 -0.815 18321 5190 1 4 . 1 1 256 256 LEU CB C 256 44.665 44.665 43.996 0.669 18321 5191 1 4 . 1 1 256 256 LEU H H 256 8.889 8.889 8.543 0.346 18321 5192 1 4 . 1 1 257 257 ALA N N 257 129.619 129.619 127.027 2.592 18321 5193 1 4 . 1 1 257 257 ALA HA H 257 4.445 4.445 5.023 -0.578 18321 5194 1 4 . 1 1 257 257 ALA C C 257 176.813 176.813 176.727 0.086 18321 5195 1 4 . 1 1 257 257 ALA CA C 257 51.179 51.179 51.227 -0.048 18321 5196 1 4 . 1 1 257 257 ALA CB C 257 18.973 18.973 18.999 -0.026 18321 5197 1 4 . 1 1 257 257 ALA H H 257 8.529 8.529 8.234 0.295 18321 5198 1 4 . 1 1 258 258 LEU N N 258 119.300 119.300 125.010 -5.710 18321 5199 1 4 . 1 1 258 258 LEU HA H 258 4.782 4.782 4.753 0.029 18321 5200 1 4 . 1 1 258 258 LEU CA C 258 53.259 53.259 53.770 -0.511 18321 5201 1 4 . 1 1 258 258 LEU CB C 258 45.972 45.972 45.678 0.294 18321 5202 1 4 . 1 1 258 258 LEU H H 258 8.505 8.505 8.830 -0.325 18321 5203 1 4 . 1 1 259 259 GLU N N 259 123.919 123.919 120.416 3.503 18321 5204 1 4 . 1 1 259 259 GLU HA H 259 4.516 4.516 4.595 -0.079 18321 5205 1 4 . 1 1 259 259 GLU C C 259 175.795 175.795 175.307 0.488 18321 5206 1 4 . 1 1 259 259 GLU CA C 259 52.896 52.896 54.552 -1.656 18321 5207 1 4 . 1 1 259 259 GLU H H 259 8.943 8.943 8.536 0.407 18321 5208 1 4 . 1 1 260 260 VAL N N 260 122.122 122.122 121.673 0.449 18321 5209 1 4 . 1 1 260 260 VAL HA H 260 2.923 2.923 4.163 -1.240 18321 5210 1 4 . 1 1 260 260 VAL C C 260 177.964 177.964 177.218 0.746 18321 5211 1 4 . 1 1 260 260 VAL CA C 260 65.417 65.417 64.333 1.084 18321 5212 1 4 . 1 1 260 260 VAL CB C 260 30.668 30.668 30.784 -0.116 18321 5213 1 4 . 1 1 260 260 VAL H H 260 8.956 8.956 8.570 0.386 18321 5214 1 4 . 1 1 261 261 GLY N N 261 116.009 116.009 116.048 -0.039 18321 5215 1 4 . 1 1 261 261 GLY C C 261 176.288 176.288 174.014 2.274 18321 5216 1 4 . 1 1 261 261 GLY CA C 261 44.210 44.210 44.743 -0.533 18321 5217 1 4 . 1 1 261 261 GLY H H 261 8.799 8.799 9.139 -0.340 18321 5218 1 4 . 1 1 262 262 ASP N N 262 121.945 121.945 121.861 0.084 18321 5219 1 4 . 1 1 262 262 ASP HA H 262 4.423 4.423 4.895 -0.472 18321 5220 1 4 . 1 1 262 262 ASP C C 262 175.381 175.381 175.230 0.151 18321 5221 1 4 . 1 1 262 262 ASP CA C 262 55.243 55.243 54.062 1.181 18321 5222 1 4 . 1 1 262 262 ASP CB C 262 41.819 41.819 42.739 -0.920 18321 5223 1 4 . 1 1 262 262 ASP H H 262 8.180 8.180 7.799 0.381 18321 5224 1 4 . 1 1 263 263 ILE N N 263 121.452 121.452 122.120 -0.668 18321 5225 1 4 . 1 1 263 263 ILE HA H 263 4.707 4.707 4.551 0.156 18321 5226 1 4 . 1 1 263 263 ILE C C 263 174.996 174.996 176.119 -1.123 18321 5227 1 4 . 1 1 263 263 ILE CA C 263 59.289 59.289 59.474 -0.184 18321 5228 1 4 . 1 1 263 263 ILE CB C 263 36.987 36.987 37.803 -0.816 18321 5229 1 4 . 1 1 263 263 ILE H H 263 8.460 8.460 8.348 0.112 18321 5230 1 4 . 1 1 264 264 VAL N N 264 128.756 128.756 129.341 -0.585 18321 5231 1 4 . 1 1 264 264 VAL HA H 264 4.309 4.309 4.127 0.182 18321 5232 1 4 . 1 1 264 264 VAL C C 264 175.486 175.486 174.823 0.663 18321 5233 1 4 . 1 1 264 264 VAL CA C 264 59.091 59.091 61.393 -2.302 18321 5234 1 4 . 1 1 264 264 VAL CB C 264 34.541 34.541 32.220 2.321 18321 5235 1 4 . 1 1 264 264 VAL H H 264 9.479 9.479 9.274 0.205 18321 5236 1 4 . 1 1 265 265 LYS N N 265 128.101 128.101 129.890 -1.789 18321 5237 1 4 . 1 1 265 265 LYS HA H 265 4.342 4.342 4.314 0.028 18321 5238 1 4 . 1 1 265 265 LYS C C 265 175.531 175.531 174.894 0.637 18321 5239 1 4 . 1 1 265 265 LYS CA C 265 55.620 55.620 55.711 -0.091 18321 5240 1 4 . 1 1 265 265 LYS CB C 265 33.149 33.149 32.712 0.437 18321 5241 1 4 . 1 1 265 265 LYS H H 265 8.715 8.715 8.797 -0.082 18321 5242 1 4 . 1 1 266 266 VAL N N 266 129.537 129.537 128.335 1.202 18321 5243 1 4 . 1 1 266 266 VAL HA H 266 4.333 4.333 4.738 -0.405 18321 5244 1 4 . 1 1 266 266 VAL C C 266 176.166 176.166 174.633 1.533 18321 5245 1 4 . 1 1 266 266 VAL CA C 266 63.339 63.339 60.689 2.650 18321 5246 1 4 . 1 1 266 266 VAL CB C 266 30.712 30.712 33.546 -2.834 18321 5247 1 4 . 1 1 266 266 VAL H H 266 9.073 9.073 8.001 1.072 18321 5248 1 4 . 1 1 267 267 THR N N 267 120.020 120.020 122.332 -2.312 18321 5249 1 4 . 1 1 267 267 THR HA H 267 4.189 4.189 4.495 -0.306 18321 5250 1 4 . 1 1 267 267 THR C C 267 176.054 176.054 174.852 1.202 18321 5251 1 4 . 1 1 267 267 THR CA C 267 62.204 62.204 61.887 0.317 18321 5252 1 4 . 1 1 267 267 THR CB C 267 68.200 68.200 69.455 -1.255 18321 5253 1 4 . 1 1 267 267 THR H H 267 9.130 9.130 8.321 0.809 18321 5254 1 4 . 1 1 268 268 ARG N N 268 120.839 120.839 123.291 -2.452 18321 5255 1 4 . 1 1 268 268 ARG HA H 268 4.236 4.236 4.568 -0.332 18321 5256 1 4 . 1 1 268 268 ARG CA C 268 56.321 56.321 55.474 0.847 18321 5257 1 4 . 1 1 268 268 ARG CB C 268 33.049 33.049 32.087 0.962 18321 5258 1 4 . 1 1 268 268 ARG H H 268 7.631 7.631 7.453 0.178 18321 5259 1 4 . 1 1 269 269 MET N N 269 125.443 125.443 125.760 -0.317 18321 5260 1 4 . 1 1 269 269 MET C C 269 174.392 174.392 175.232 -0.840 18321 5261 1 4 . 1 1 269 269 MET H H 269 8.532 8.532 8.584 -0.052 18321 5262 1 4 . 1 1 270 270 ASN N N 270 119.125 119.125 124.621 -5.496 18321 5263 1 4 . 1 1 270 270 ASN HA H 270 4.546 4.546 4.709 -0.163 18321 5264 1 4 . 1 1 270 270 ASN C C 270 172.133 172.133 175.413 -3.280 18321 5265 1 4 . 1 1 270 270 ASN CA C 270 53.639 53.639 54.965 -1.326 18321 5266 1 4 . 1 1 270 270 ASN CB C 270 39.845 39.845 38.802 1.043 18321 5267 1 4 . 1 1 270 270 ASN H H 270 6.631 6.631 9.239 -2.608 18321 5268 1 4 . 1 1 271 271 ILE N N 271 122.532 122.532 116.440 6.092 18321 5269 1 4 . 1 1 271 271 ILE HA H 271 4.417 4.417 4.087 0.330 18321 5270 1 4 . 1 1 271 271 ILE CA C 271 63.348 63.348 62.621 0.727 18321 5271 1 4 . 1 1 271 271 ILE CB C 271 38.198 38.198 37.833 0.365 18321 5272 1 4 . 1 1 271 271 ILE H H 271 8.565 8.565 8.365 0.200 18321 5273 1 4 . 1 1 272 272 ASN HA H 272 4.527 4.527 4.644 -0.117 18321 5274 1 4 . 1 1 272 272 ASN C C 272 176.259 176.259 176.238 0.021 18321 5275 1 4 . 1 1 272 272 ASN CA C 272 53.225 53.225 54.434 -1.208 18321 5276 1 4 . 1 1 272 272 ASN CB C 272 37.565 37.565 38.464 -0.899 18321 5277 1 4 . 1 1 273 273 GLY N N 273 107.043 107.043 106.518 0.525 18321 5278 1 4 . 1 1 273 273 GLY C C 273 173.216 173.216 173.178 0.038 18321 5279 1 4 . 1 1 273 273 GLY CA C 273 45.299 45.299 44.664 0.635 18321 5280 1 4 . 1 1 273 273 GLY H H 273 8.086 8.086 8.031 0.055 18321 5281 1 4 . 1 1 274 274 GLN N N 274 120.624 120.624 122.110 -1.486 18321 5282 1 4 . 1 1 274 274 GLN HA H 274 4.551 4.551 4.177 0.374 18321 5283 1 4 . 1 1 274 274 GLN C C 274 175.039 175.039 175.415 -0.376 18321 5284 1 4 . 1 1 274 274 GLN CA C 274 54.556 54.556 55.770 -1.214 18321 5285 1 4 . 1 1 274 274 GLN CB C 274 33.698 33.698 28.828 4.870 18321 5286 1 4 . 1 1 274 274 GLN H H 274 8.045 8.045 8.126 -0.081 18321 5287 1 4 . 1 1 275 275 TRP N N 275 125.596 125.596 125.982 -0.386 18321 5288 1 4 . 1 1 275 275 TRP HA H 275 4.588 4.588 4.711 -0.123 18321 5289 1 4 . 1 1 275 275 TRP C C 275 172.832 172.832 175.927 -3.095 18321 5290 1 4 . 1 1 275 275 TRP CA C 275 55.296 55.296 54.090 1.206 18321 5291 1 4 . 1 1 275 275 TRP CB C 275 31.393 31.393 30.637 0.756 18321 5292 1 4 . 1 1 275 275 TRP H H 275 8.484 8.484 7.360 1.124 18321 5293 1 4 . 1 1 276 276 GLU N N 276 119.012 119.012 120.287 -1.275 18321 5294 1 4 . 1 1 276 276 GLU HA H 276 5.190 5.190 4.701 0.489 18321 5295 1 4 . 1 1 276 276 GLU C C 276 176.553 176.553 175.991 0.562 18321 5296 1 4 . 1 1 276 276 GLU CA C 276 54.288 54.288 56.154 -1.866 18321 5297 1 4 . 1 1 276 276 GLU CB C 276 32.851 32.851 30.413 2.438 18321 5298 1 4 . 1 1 276 276 GLU H H 276 8.643 8.643 8.785 -0.142 18321 5299 1 4 . 1 1 277 277 GLY N N 277 111.364 111.364 111.377 -0.013 18321 5300 1 4 . 1 1 277 277 GLY C C 277 170.707 170.707 172.335 -1.628 18321 5301 1 4 . 1 1 277 277 GLY CA C 277 46.723 46.723 44.081 2.642 18321 5302 1 4 . 1 1 277 277 GLY H H 277 9.072 9.072 8.243 0.829 18321 5303 1 4 . 1 1 278 278 GLU N N 278 117.733 117.733 125.303 -7.570 18321 5304 1 4 . 1 1 278 278 GLU HA H 278 5.748 5.748 5.260 0.488 18321 5305 1 4 . 1 1 278 278 GLU C C 278 176.051 176.051 175.306 0.745 18321 5306 1 4 . 1 1 278 278 GLU CA C 278 53.620 53.620 55.034 -1.414 18321 5307 1 4 . 1 1 278 278 GLU CB C 278 33.742 33.742 32.321 1.421 18321 5308 1 4 . 1 1 278 278 GLU H H 278 8.810 8.810 8.239 0.571 18321 5309 1 4 . 1 1 279 279 VAL N N 279 123.834 123.834 126.969 -3.135 18321 5310 1 4 . 1 1 279 279 VAL HA H 279 4.404 4.404 4.375 0.029 18321 5311 1 4 . 1 1 279 279 VAL C C 279 175.289 175.289 175.719 -0.430 18321 5312 1 4 . 1 1 279 279 VAL CA C 279 61.166 61.166 60.634 0.532 18321 5313 1 4 . 1 1 279 279 VAL CB C 279 34.123 34.123 34.498 -0.375 18321 5314 1 4 . 1 1 279 279 VAL H H 279 8.887 8.887 9.247 -0.360 18321 5315 1 4 . 1 1 280 280 ASN N N 280 126.025 126.025 126.523 -0.498 18321 5316 1 4 . 1 1 280 280 ASN HA H 280 4.435 4.435 4.431 0.004 18321 5317 1 4 . 1 1 280 280 ASN C C 280 175.205 175.205 175.533 -0.328 18321 5318 1 4 . 1 1 280 280 ASN CA C 280 45.615 45.615 53.932 -8.317 18321 5319 1 4 . 1 1 280 280 ASN CB C 280 37.386 37.386 37.606 -0.220 18321 5320 1 4 . 1 1 280 280 ASN H H 280 9.322 9.322 9.313 0.009 18321 5321 1 4 . 1 1 281 281 GLY N N 281 104.588 104.588 102.782 1.806 18321 5322 1 4 . 1 1 281 281 GLY C C 281 173.944 173.944 173.722 0.222 18321 5323 1 4 . 1 1 281 281 GLY CA C 281 45.224 45.224 44.901 0.323 18321 5324 1 4 . 1 1 281 281 GLY H H 281 8.768 8.768 8.231 0.537 18321 5325 1 4 . 1 1 282 282 ARG N N 282 122.567 122.567 123.078 -0.511 18321 5326 1 4 . 1 1 282 282 ARG HA H 282 4.559 4.559 4.537 0.022 18321 5327 1 4 . 1 1 282 282 ARG C C 282 174.350 174.350 174.572 -0.222 18321 5328 1 4 . 1 1 282 282 ARG CA C 282 54.933 54.933 55.144 -0.211 18321 5329 1 4 . 1 1 282 282 ARG CB C 282 31.765 31.765 31.938 -0.173 18321 5330 1 4 . 1 1 282 282 ARG H H 282 8.149 8.149 7.844 0.305 18321 5331 1 4 . 1 1 283 283 LYS N N 283 121.565 121.565 124.778 -3.213 18321 5332 1 4 . 1 1 283 283 LYS HA H 283 5.584 5.584 5.447 0.137 18321 5333 1 4 . 1 1 283 283 LYS CA C 283 54.143 54.143 55.174 -1.031 18321 5334 1 4 . 1 1 283 283 LYS CB C 283 36.040 36.040 33.974 2.066 18321 5335 1 4 . 1 1 283 283 LYS H H 283 8.424 8.424 8.638 -0.214 18321 5336 1 4 . 1 1 284 284 GLY C C 284 173.006 173.006 172.810 0.196 18321 5337 1 4 . 1 1 284 284 GLY CA C 284 45.886 45.886 44.030 1.856 18321 5338 1 4 . 1 1 285 285 LEU N N 285 119.673 119.673 122.430 -2.757 18321 5339 1 4 . 1 1 285 285 LEU HA H 285 5.718 5.718 5.357 0.361 18321 5340 1 4 . 1 1 285 285 LEU C C 285 178.657 178.657 176.791 1.866 18321 5341 1 4 . 1 1 285 285 LEU CA C 285 53.656 53.656 54.241 -0.585 18321 5342 1 4 . 1 1 285 285 LEU CB C 285 44.813 44.813 42.096 2.717 18321 5343 1 4 . 1 1 285 285 LEU H H 285 8.734 8.734 8.600 0.134 18321 5344 1 4 . 1 1 286 286 PHE N N 286 118.785 118.785 122.562 -3.777 18321 5345 1 4 . 1 1 286 286 PHE HA H 286 4.521 4.521 5.062 -0.541 18321 5346 1 4 . 1 1 286 286 PHE CA C 286 57.592 57.592 54.095 3.497 18321 5347 1 4 . 1 1 286 286 PHE CB C 286 40.669 40.669 39.341 1.328 18321 5348 1 4 . 1 1 286 286 PHE H H 286 9.120 9.120 8.000 1.120 18321 5349 1 4 . 1 1 287 287 PRO HA H 287 4.385 4.385 4.409 -0.024 18321 5350 1 4 . 1 1 287 287 PRO CA C 287 62.814 62.814 61.472 1.342 18321 5351 1 4 . 1 1 287 287 PRO CB C 287 32.133 32.133 32.322 -0.189 18321 5352 1 4 . 1 1 288 288 PHE C C 288 174.837 174.837 174.958 -0.121 18321 5353 1 4 . 1 1 288 288 PHE CA C 288 59.020 59.020 58.705 0.315 18321 5354 1 4 . 1 1 288 288 PHE CB C 288 34.987 34.987 37.222 -2.235 18321 5355 1 4 . 1 1 289 289 THR N N 289 107.865 107.865 109.773 -1.908 18321 5356 1 4 . 1 1 289 289 THR HA H 289 3.589 3.589 4.133 -0.544 18321 5357 1 4 . 1 1 289 289 THR C C 289 176.125 176.125 175.986 0.139 18321 5358 1 4 . 1 1 289 289 THR CA C 289 62.243 62.243 64.193 -1.950 18321 5359 1 4 . 1 1 289 289 THR CB C 289 69.365 69.365 68.797 0.568 18321 5360 1 4 . 1 1 289 289 THR H H 289 6.453 6.453 7.390 -0.937 18321 5361 1 4 . 1 1 290 290 HIS N N 290 119.462 119.462 121.273 -1.811 18321 5362 1 4 . 1 1 290 290 HIS HA H 290 4.196 4.196 4.533 -0.337 18321 5363 1 4 . 1 1 290 290 HIS C C 290 175.165 175.165 174.277 0.888 18321 5364 1 4 . 1 1 290 290 HIS CA C 290 57.635 57.635 58.490 -0.855 18321 5365 1 4 . 1 1 290 290 HIS CB C 290 29.840 29.840 30.511 -0.671 18321 5366 1 4 . 1 1 290 290 HIS H H 290 7.835 7.835 7.857 -0.022 18321 5367 1 4 . 1 1 291 291 VAL N N 291 110.050 110.050 111.278 -1.228 18321 5368 1 4 . 1 1 291 291 VAL HA H 291 5.445 5.445 5.100 0.345 18321 5369 1 4 . 1 1 291 291 VAL C C 291 173.386 173.386 174.733 -1.347 18321 5370 1 4 . 1 1 291 291 VAL CA C 291 57.794 57.794 59.179 -1.385 18321 5371 1 4 . 1 1 291 291 VAL CB C 291 35.784 35.784 34.816 0.968 18321 5372 1 4 . 1 1 291 291 VAL H H 291 7.562 7.562 7.343 0.219 18321 5373 1 4 . 1 1 292 292 LYS N N 292 119.445 119.445 120.816 -1.371 18321 5374 1 4 . 1 1 292 292 LYS HA H 292 4.857 4.857 4.895 -0.038 18321 5375 1 4 . 1 1 292 292 LYS C C 292 176.512 176.512 175.984 0.528 18321 5376 1 4 . 1 1 292 292 LYS CA C 292 54.647 54.647 54.655 -0.008 18321 5377 1 4 . 1 1 292 292 LYS CB C 292 35.665 35.665 36.314 -0.649 18321 5378 1 4 . 1 1 292 292 LYS H H 292 8.753 8.753 8.159 0.594 18321 5379 1 4 . 1 1 293 293 ILE N N 293 128.707 128.707 124.629 4.078 18321 5380 1 4 . 1 1 293 293 ILE HA H 293 4.509 4.509 4.629 -0.120 18321 5381 1 4 . 1 1 293 293 ILE C C 293 175.666 175.666 176.615 -0.949 18321 5382 1 4 . 1 1 293 293 ILE CA C 293 62.563 62.563 62.425 0.138 18321 5383 1 4 . 1 1 293 293 ILE CB C 293 38.076 38.076 38.624 -0.548 18321 5384 1 4 . 1 1 293 293 ILE H H 293 9.107 9.107 8.761 0.346 18321 5385 1 4 . 1 1 294 294 PHE N N 294 126.638 126.638 126.392 0.246 18321 5386 1 4 . 1 1 294 294 PHE HA H 294 4.898 4.898 4.827 0.071 18321 5387 1 4 . 1 1 294 294 PHE C C 294 175.838 175.838 173.138 2.700 18321 5388 1 4 . 1 1 294 294 PHE CA C 294 56.335 56.335 56.318 0.017 18321 5389 1 4 . 1 1 294 294 PHE CB C 294 41.196 41.196 41.550 -0.354 18321 5390 1 4 . 1 1 294 294 PHE H H 294 8.716 8.716 8.485 0.231 18321 5391 1 4 . 1 1 295 295 ASP N N 295 122.961 122.961 121.949 1.012 18321 5392 1 4 . 1 1 295 295 ASP HA H 295 5.003 5.003 4.758 0.245 18321 5393 1 4 . 1 1 295 295 ASP CA C 295 50.602 50.602 52.479 -1.877 18321 5394 1 4 . 1 1 295 295 ASP CB C 295 40.754 40.754 41.337 -0.583 18321 5395 1 4 . 1 1 295 295 ASP H H 295 8.418 8.418 8.467 -0.049 18321 5396 1 4 . 1 1 296 296 PRO HA H 296 4.524 4.524 4.351 0.173 18321 5397 1 4 . 1 1 296 296 PRO C C 296 176.807 176.807 175.672 1.135 18321 5398 1 4 . 1 1 296 296 PRO CA C 296 62.987 62.987 62.331 0.656 18321 5399 1 4 . 1 1 296 296 PRO CB C 296 32.033 32.033 29.956 2.077 18321 5400 1 4 . 1 1 297 297 GLN N N 297 120.729 120.729 114.929 5.800 18321 5401 1 4 . 1 1 297 297 GLN HA H 297 4.274 4.274 3.965 0.309 18321 5402 1 4 . 1 1 297 297 GLN CA C 297 56.427 56.427 56.636 -0.209 18321 5403 1 4 . 1 1 297 297 GLN CB C 297 28.819 28.819 27.291 1.528 18321 5404 1 4 . 1 1 297 297 GLN H H 297 8.551 8.551 8.139 0.412 18321 5405 1 4 . 1 1 299 299 PRO C C 299 176.936 176.936 177.199 -0.263 18321 5406 1 4 . 1 1 299 299 PRO CA C 299 63.406 63.406 63.929 -0.523 18321 5407 1 4 . 1 1 299 299 PRO CB C 299 31.421 31.421 31.909 -0.488 18321 5408 1 4 . 1 1 300 300 ASP N N 300 119.609 119.609 120.340 -0.731 18321 5409 1 4 . 1 1 300 300 ASP C C 300 176.344 176.344 177.758 -1.414 18321 5410 1 4 . 1 1 300 300 ASP CA C 300 54.178 54.178 56.846 -2.667 18321 5411 1 4 . 1 1 300 300 ASP CB C 300 40.661 40.661 40.351 0.310 18321 5412 1 4 . 1 1 300 300 ASP H H 300 8.239 8.239 8.625 -0.386 18321 5413 1 4 . 1 1 301 301 GLU N N 301 120.462 120.462 120.543 -0.081 18321 5414 1 4 . 1 1 301 301 GLU CA C 301 56.188 56.188 56.179 0.008 18321 5415 1 4 . 1 1 301 301 GLU CB C 301 29.507 29.507 28.318 1.189 18321 5416 1 4 . 1 1 301 301 GLU H H 301 8.084 8.084 8.601 -0.517 18321 5417 1 5 . 1 1 2 2 SER HA H 2 4.521 4.521 4.904 -0.383 18321 5418 1 5 . 1 1 2 2 SER CA C 2 58.326 58.326 57.670 0.656 18321 5419 1 5 . 1 1 2 2 SER CB C 2 64.062 64.062 64.986 -0.924 18321 5420 1 5 . 1 1 3 3 SER HA H 3 4.465 4.465 4.373 0.092 18321 5421 1 5 . 1 1 3 3 SER C C 3 173.887 173.887 174.875 -0.988 18321 5422 1 5 . 1 1 3 3 SER CA C 3 58.374 58.374 60.023 -1.649 18321 5423 1 5 . 1 1 3 3 SER CB C 3 63.920 63.920 63.491 0.429 18321 5424 1 5 . 1 1 4 4 ALA N N 4 124.755 124.755 125.009 -0.254 18321 5425 1 5 . 1 1 4 4 ALA HA H 4 4.547 4.547 4.853 -0.306 18321 5426 1 5 . 1 1 4 4 ALA CA C 4 52.737 52.737 51.265 1.472 18321 5427 1 5 . 1 1 4 4 ALA CB C 4 19.636 19.636 17.989 1.647 18321 5428 1 5 . 1 1 4 4 ALA H H 4 8.244 8.244 8.123 0.121 18321 5429 1 5 . 1 1 5 5 ARG N N 5 120.383 120.383 123.514 -3.131 18321 5430 1 5 . 1 1 5 5 ARG HA H 5 4.524 4.524 4.552 -0.028 18321 5431 1 5 . 1 1 5 5 ARG C C 5 175.611 175.611 174.801 0.810 18321 5432 1 5 . 1 1 5 5 ARG CA C 5 56.082 56.082 55.800 0.282 18321 5433 1 5 . 1 1 5 5 ARG CB C 5 30.695 30.695 29.890 0.805 18321 5434 1 5 . 1 1 5 5 ARG H H 5 8.727 8.727 8.124 0.603 18321 5435 1 5 . 1 1 6 6 PHE N N 6 115.159 115.159 121.864 -6.705 18321 5436 1 5 . 1 1 6 6 PHE HA H 6 4.786 4.786 4.821 -0.035 18321 5437 1 5 . 1 1 6 6 PHE C C 6 172.076 172.076 173.846 -1.770 18321 5438 1 5 . 1 1 6 6 PHE CA C 6 56.640 56.640 55.488 1.152 18321 5439 1 5 . 1 1 6 6 PHE CB C 6 40.378 40.378 40.746 -0.368 18321 5440 1 5 . 1 1 6 6 PHE H H 6 7.536 7.536 7.734 -0.198 18321 5441 1 5 . 1 1 7 7 ASP N N 7 121.846 121.846 121.835 0.011 18321 5442 1 5 . 1 1 7 7 ASP HA H 7 4.846 4.846 4.663 0.183 18321 5443 1 5 . 1 1 7 7 ASP CA C 7 52.327 52.327 53.541 -1.214 18321 5444 1 5 . 1 1 7 7 ASP CB C 7 41.298 41.298 41.573 -0.275 18321 5445 1 5 . 1 1 7 7 ASP H H 7 9.062 9.062 8.623 0.439 18321 5446 1 5 . 1 1 8 8 SER HA H 8 3.950 3.950 4.664 -0.714 18321 5447 1 5 . 1 1 8 8 SER C C 8 174.705 174.705 173.788 0.917 18321 5448 1 5 . 1 1 8 8 SER CA C 8 61.937 61.937 58.957 2.980 18321 5449 1 5 . 1 1 8 8 SER CB C 8 62.260 62.260 61.597 0.663 18321 5450 1 5 . 1 1 9 9 SER N N 9 114.373 114.373 118.320 -3.947 18321 5451 1 5 . 1 1 9 9 SER HA H 9 4.529 4.529 4.797 -0.268 18321 5452 1 5 . 1 1 9 9 SER C C 9 175.089 175.089 173.772 1.317 18321 5453 1 5 . 1 1 9 9 SER CA C 9 59.851 59.851 59.367 0.484 18321 5454 1 5 . 1 1 9 9 SER CB C 9 64.246 64.246 64.784 -0.537 18321 5455 1 5 . 1 1 9 9 SER H H 9 8.722 8.722 8.724 -0.002 18321 5456 1 5 . 1 1 10 10 ASP N N 10 121.818 121.818 124.089 -2.271 18321 5457 1 5 . 1 1 10 10 ASP HA H 10 4.730 4.730 4.552 0.178 18321 5458 1 5 . 1 1 10 10 ASP C C 10 174.455 174.455 177.670 -3.215 18321 5459 1 5 . 1 1 10 10 ASP CA C 10 52.432 52.432 54.773 -2.341 18321 5460 1 5 . 1 1 10 10 ASP CB C 10 39.607 39.607 41.392 -1.785 18321 5461 1 5 . 1 1 10 10 ASP H H 10 7.600 7.600 8.623 -1.023 18321 5462 1 5 . 1 1 11 11 ARG N N 11 125.238 125.238 126.504 -1.266 18321 5463 1 5 . 1 1 11 11 ARG HA H 11 1.936 1.936 3.062 -1.126 18321 5464 1 5 . 1 1 11 11 ARG C C 11 176.916 176.916 177.140 -0.224 18321 5465 1 5 . 1 1 11 11 ARG CA C 11 57.451 57.451 58.260 -0.809 18321 5466 1 5 . 1 1 11 11 ARG CB C 11 43.014 43.014 29.368 13.646 18321 5467 1 5 . 1 1 11 11 ARG H H 11 7.739 7.739 8.366 -0.627 18321 5468 1 5 . 1 1 12 12 SER N N 12 112.065 112.065 112.324 -0.259 18321 5469 1 5 . 1 1 12 12 SER HA H 12 4.695 4.695 4.210 0.485 18321 5470 1 5 . 1 1 12 12 SER C C 12 175.092 175.092 174.531 0.561 18321 5471 1 5 . 1 1 12 12 SER CA C 12 60.785 60.785 60.324 0.461 18321 5472 1 5 . 1 1 12 12 SER CB C 12 62.889 62.889 62.751 0.138 18321 5473 1 5 . 1 1 12 12 SER H H 12 7.888 7.888 8.182 -0.294 18321 5474 1 5 . 1 1 13 13 ALA N N 13 122.249 122.249 122.573 -0.324 18321 5475 1 5 . 1 1 13 13 ALA HA H 13 4.216 4.216 4.296 -0.080 18321 5476 1 5 . 1 1 13 13 ALA C C 13 178.069 178.069 178.179 -0.110 18321 5477 1 5 . 1 1 13 13 ALA CA C 13 53.562 53.562 53.642 -0.080 18321 5478 1 5 . 1 1 13 13 ALA CB C 13 19.339 19.339 19.901 -0.562 18321 5479 1 5 . 1 1 13 13 ALA H H 13 7.418 7.418 7.568 -0.150 18321 5480 1 5 . 1 1 14 14 TRP N N 14 107.433 107.433 113.050 -5.617 18321 5481 1 5 . 1 1 14 14 TRP HA H 14 4.785 4.785 4.647 0.138 18321 5482 1 5 . 1 1 14 14 TRP C C 14 175.286 175.286 175.952 -0.666 18321 5483 1 5 . 1 1 14 14 TRP CA C 14 55.212 55.212 55.695 -0.483 18321 5484 1 5 . 1 1 14 14 TRP CB C 14 32.776 32.776 30.914 1.862 18321 5485 1 5 . 1 1 14 14 TRP H H 14 6.273 6.273 6.868 -0.595 18321 5486 1 5 . 1 1 15 15 TYR N N 15 122.315 122.315 124.305 -1.990 18321 5487 1 5 . 1 1 15 15 TYR HA H 15 5.436 5.436 4.905 0.531 18321 5488 1 5 . 1 1 15 15 TYR C C 15 175.325 175.325 175.216 0.109 18321 5489 1 5 . 1 1 15 15 TYR CA C 15 56.609 56.609 57.863 -1.254 18321 5490 1 5 . 1 1 15 15 TYR CB C 15 36.940 36.940 38.503 -1.563 18321 5491 1 5 . 1 1 15 15 TYR H H 15 8.221 8.221 7.331 0.890 18321 5492 1 5 . 1 1 16 16 MET N N 16 126.031 126.031 126.125 -0.094 18321 5493 1 5 . 1 1 16 16 MET HA H 16 4.462 4.462 4.334 0.128 18321 5494 1 5 . 1 1 16 16 MET CA C 16 53.046 53.046 53.188 -0.141 18321 5495 1 5 . 1 1 16 16 MET CB C 16 41.114 41.114 32.012 9.102 18321 5496 1 5 . 1 1 16 16 MET H H 16 8.989 8.989 8.603 0.386 18321 5497 1 5 . 1 1 17 17 GLY CA C 17 45.803 45.803 45.249 0.554 18321 5498 1 5 . 1 1 18 18 PRO HA H 18 4.675 4.675 5.074 -0.399 18321 5499 1 5 . 1 1 18 18 PRO C C 18 175.943 175.943 176.071 -0.128 18321 5500 1 5 . 1 1 18 18 PRO CA C 18 63.647 63.647 62.854 0.793 18321 5501 1 5 . 1 1 18 18 PRO CB C 18 29.276 29.276 31.091 -1.815 18321 5502 1 5 . 1 1 19 19 VAL N N 19 126.159 126.159 122.955 3.204 18321 5503 1 5 . 1 1 19 19 VAL HA H 19 4.011 4.011 4.271 -0.260 18321 5504 1 5 . 1 1 19 19 VAL C C 19 175.812 175.812 174.703 1.109 18321 5505 1 5 . 1 1 19 19 VAL CA C 19 62.355 62.355 60.919 1.436 18321 5506 1 5 . 1 1 19 19 VAL CB C 19 33.468 33.468 35.900 -2.432 18321 5507 1 5 . 1 1 19 19 VAL H H 19 7.851 7.851 7.744 0.107 18321 5508 1 5 . 1 1 20 20 SER N N 20 123.950 123.950 117.381 6.569 18321 5509 1 5 . 1 1 20 20 SER HA H 20 4.453 4.453 5.046 -0.593 18321 5510 1 5 . 1 1 20 20 SER CA C 20 57.631 57.631 56.524 1.107 18321 5511 1 5 . 1 1 20 20 SER CB C 20 65.951 65.951 65.750 0.201 18321 5512 1 5 . 1 1 20 20 SER H H 20 8.800 8.800 8.381 0.419 18321 5513 1 5 . 1 1 21 21 ARG N N 21 123.461 123.461 121.749 1.712 18321 5514 1 5 . 1 1 21 21 ARG HA H 21 3.489 3.489 3.989 -0.500 18321 5515 1 5 . 1 1 21 21 ARG C C 21 178.164 178.164 178.857 -0.693 18321 5516 1 5 . 1 1 21 21 ARG CA C 21 60.025 60.025 60.825 -0.800 18321 5517 1 5 . 1 1 21 21 ARG CB C 21 30.334 30.334 30.031 0.303 18321 5518 1 5 . 1 1 21 21 ARG H H 21 9.307 9.307 8.973 0.334 18321 5519 1 5 . 1 1 22 22 GLN N N 22 116.591 116.591 119.788 -3.197 18321 5520 1 5 . 1 1 22 22 GLN HA H 22 4.008 4.008 4.031 -0.023 18321 5521 1 5 . 1 1 22 22 GLN CA C 22 59.095 59.095 59.624 -0.529 18321 5522 1 5 . 1 1 22 22 GLN CB C 22 29.249 29.249 28.156 1.093 18321 5523 1 5 . 1 1 22 22 GLN H H 22 8.394 8.394 8.689 -0.295 18321 5524 1 5 . 1 1 23 23 GLU N N 23 122.191 122.191 119.026 3.165 18321 5525 1 5 . 1 1 23 23 GLU HA H 23 4.037 4.037 4.034 0.003 18321 5526 1 5 . 1 1 23 23 GLU C C 23 178.986 178.986 178.602 0.384 18321 5527 1 5 . 1 1 23 23 GLU CA C 23 59.081 59.081 59.327 -0.245 18321 5528 1 5 . 1 1 23 23 GLU CB C 23 31.896 31.896 29.374 2.522 18321 5529 1 5 . 1 1 23 23 GLU H H 23 8.106 8.106 8.565 -0.459 18321 5530 1 5 . 1 1 24 24 ALA N N 24 121.964 121.964 121.430 0.534 18321 5531 1 5 . 1 1 24 24 ALA HA H 24 3.762 3.762 3.924 -0.162 18321 5532 1 5 . 1 1 24 24 ALA C C 24 178.653 178.653 179.332 -0.679 18321 5533 1 5 . 1 1 24 24 ALA CA C 24 55.480 55.480 55.395 0.085 18321 5534 1 5 . 1 1 24 24 ALA CB C 24 18.049 18.049 18.350 -0.301 18321 5535 1 5 . 1 1 24 24 ALA H H 24 8.732 8.732 8.338 0.394 18321 5536 1 5 . 1 1 25 25 GLN N N 25 116.229 116.229 118.188 -1.959 18321 5537 1 5 . 1 1 25 25 GLN HA H 25 3.950 3.950 3.991 -0.041 18321 5538 1 5 . 1 1 25 25 GLN C C 25 177.442 177.442 178.030 -0.588 18321 5539 1 5 . 1 1 25 25 GLN CA C 25 59.651 59.651 58.727 0.924 18321 5540 1 5 . 1 1 25 25 GLN CB C 25 29.308 29.308 28.751 0.557 18321 5541 1 5 . 1 1 25 25 GLN H H 25 8.391 8.391 8.144 0.247 18321 5542 1 5 . 1 1 26 26 THR N N 26 115.105 115.105 112.535 2.570 18321 5543 1 5 . 1 1 26 26 THR HA H 26 3.920 3.920 4.184 -0.264 18321 5544 1 5 . 1 1 26 26 THR C C 26 176.835 176.835 175.436 1.399 18321 5545 1 5 . 1 1 26 26 THR CA C 26 66.335 66.335 64.169 2.166 18321 5546 1 5 . 1 1 26 26 THR CB C 26 68.876 68.876 68.670 0.206 18321 5547 1 5 . 1 1 26 26 THR H H 26 8.223 8.223 8.323 -0.100 18321 5548 1 5 . 1 1 27 27 ARG N N 27 119.096 119.096 117.545 1.551 18321 5549 1 5 . 1 1 27 27 ARG HA H 27 4.047 4.047 4.284 -0.237 18321 5550 1 5 . 1 1 27 27 ARG C C 27 177.245 177.245 177.082 0.163 18321 5551 1 5 . 1 1 27 27 ARG CA C 27 58.528 58.528 57.753 0.775 18321 5552 1 5 . 1 1 27 27 ARG CB C 27 30.184 30.184 30.830 -0.646 18321 5553 1 5 . 1 1 27 27 ARG H H 27 8.093 8.093 7.480 0.613 18321 5554 1 5 . 1 1 28 28 LEU N N 28 114.602 114.602 116.908 -2.306 18321 5555 1 5 . 1 1 28 28 LEU HA H 28 4.325 4.325 4.499 -0.174 18321 5556 1 5 . 1 1 28 28 LEU C C 28 177.197 177.197 176.377 0.820 18321 5557 1 5 . 1 1 28 28 LEU CA C 28 55.143 55.143 54.422 0.721 18321 5558 1 5 . 1 1 28 28 LEU CB C 28 44.902 44.902 43.095 1.807 18321 5559 1 5 . 1 1 28 28 LEU H H 28 7.438 7.438 7.593 -0.155 18321 5560 1 5 . 1 1 29 29 GLN N N 29 121.312 121.312 120.902 0.410 18321 5561 1 5 . 1 1 29 29 GLN HA H 29 3.856 3.856 4.213 -0.357 18321 5562 1 5 . 1 1 29 29 GLN C C 29 178.048 178.048 176.806 1.242 18321 5563 1 5 . 1 1 29 29 GLN CA C 29 57.691 57.691 56.306 1.385 18321 5564 1 5 . 1 1 29 29 GLN CB C 29 27.293 27.293 28.006 -0.713 18321 5565 1 5 . 1 1 29 29 GLN H H 29 8.250 8.250 7.981 0.269 18321 5566 1 5 . 1 1 30 30 GLY N N 30 116.768 116.768 115.839 0.929 18321 5567 1 5 . 1 1 30 30 GLY C C 30 174.914 174.914 173.781 1.133 18321 5568 1 5 . 1 1 30 30 GLY CA C 30 45.491 45.491 44.869 0.622 18321 5569 1 5 . 1 1 30 30 GLY H H 30 9.135 9.135 8.371 0.764 18321 5570 1 5 . 1 1 31 31 GLN N N 31 117.979 117.979 119.221 -1.242 18321 5571 1 5 . 1 1 31 31 GLN HA H 31 4.329 4.329 4.356 -0.027 18321 5572 1 5 . 1 1 31 31 GLN C C 31 177.174 177.174 175.559 1.615 18321 5573 1 5 . 1 1 31 31 GLN CA C 31 53.910 53.910 54.788 -0.878 18321 5574 1 5 . 1 1 31 31 GLN CB C 31 29.574 29.574 29.631 -0.057 18321 5575 1 5 . 1 1 31 31 GLN H H 31 7.695 7.695 7.327 0.368 18321 5576 1 5 . 1 1 32 32 ARG N N 32 123.918 123.918 120.757 3.161 18321 5577 1 5 . 1 1 32 32 ARG HA H 32 3.940 3.940 4.175 -0.235 18321 5578 1 5 . 1 1 32 32 ARG C C 32 175.810 175.810 176.241 -0.431 18321 5579 1 5 . 1 1 32 32 ARG CA C 32 56.770 56.770 56.461 0.309 18321 5580 1 5 . 1 1 32 32 ARG CB C 32 30.074 30.074 30.729 -0.655 18321 5581 1 5 . 1 1 32 32 ARG H H 32 8.955 8.955 8.545 0.410 18321 5582 1 5 . 1 1 33 33 HIS N N 33 122.248 122.248 123.216 -0.968 18321 5583 1 5 . 1 1 33 33 HIS HA H 33 4.627 4.627 4.300 0.327 18321 5584 1 5 . 1 1 33 33 HIS C C 33 177.089 177.089 176.238 0.851 18321 5585 1 5 . 1 1 33 33 HIS CA C 33 55.858 55.858 57.133 -1.275 18321 5586 1 5 . 1 1 33 33 HIS CB C 33 28.648 28.648 30.376 -1.728 18321 5587 1 5 . 1 1 33 33 HIS H H 33 8.302 8.302 8.503 -0.201 18321 5588 1 5 . 1 1 34 34 GLY N N 34 109.518 109.518 107.594 1.924 18321 5589 1 5 . 1 1 34 34 GLY C C 34 176.730 176.730 173.772 2.958 18321 5590 1 5 . 1 1 34 34 GLY CA C 34 45.967 45.967 45.158 0.809 18321 5591 1 5 . 1 1 34 34 GLY H H 34 9.496 9.496 9.123 0.373 18321 5592 1 5 . 1 1 35 35 MET N N 35 125.193 125.193 121.996 3.197 18321 5593 1 5 . 1 1 35 35 MET HA H 35 5.750 5.750 5.643 0.107 18321 5594 1 5 . 1 1 35 35 MET C C 35 174.388 174.388 175.452 -1.064 18321 5595 1 5 . 1 1 35 35 MET CA C 35 55.762 55.762 56.583 -0.821 18321 5596 1 5 . 1 1 35 35 MET CB C 35 32.706 32.706 33.888 -1.182 18321 5597 1 5 . 1 1 35 35 MET H H 35 8.359 8.359 7.316 1.043 18321 5598 1 5 . 1 1 36 36 PHE N N 36 123.311 123.311 116.322 6.989 18321 5599 1 5 . 1 1 36 36 PHE HA H 36 5.985 5.985 5.715 0.270 18321 5600 1 5 . 1 1 36 36 PHE C C 36 172.140 172.140 173.006 -0.866 18321 5601 1 5 . 1 1 36 36 PHE CA C 36 55.755 55.755 55.564 0.191 18321 5602 1 5 . 1 1 36 36 PHE CB C 36 45.197 45.197 42.661 2.536 18321 5603 1 5 . 1 1 36 36 PHE H H 36 8.261 8.261 7.939 0.322 18321 5604 1 5 . 1 1 37 37 LEU N N 37 114.652 114.652 117.284 -2.632 18321 5605 1 5 . 1 1 37 37 LEU HA H 37 4.489 4.489 5.034 -0.545 18321 5606 1 5 . 1 1 37 37 LEU C C 37 174.033 174.033 174.804 -0.771 18321 5607 1 5 . 1 1 37 37 LEU CA C 37 55.382 55.382 54.459 0.923 18321 5608 1 5 . 1 1 37 37 LEU CB C 37 44.791 44.791 45.518 -0.727 18321 5609 1 5 . 1 1 37 37 LEU H H 37 9.292 9.292 9.050 0.242 18321 5610 1 5 . 1 1 38 38 VAL N N 38 121.009 121.009 123.554 -2.545 18321 5611 1 5 . 1 1 38 38 VAL HA H 38 5.504 5.504 4.955 0.549 18321 5612 1 5 . 1 1 38 38 VAL C C 38 173.581 173.581 175.754 -2.173 18321 5613 1 5 . 1 1 38 38 VAL CA C 38 61.316 61.316 61.874 -0.558 18321 5614 1 5 . 1 1 38 38 VAL CB C 38 33.302 33.302 32.533 0.769 18321 5615 1 5 . 1 1 38 38 VAL H H 38 8.991 8.991 8.513 0.478 18321 5616 1 5 . 1 1 39 39 ARG N N 39 124.863 124.863 128.645 -3.782 18321 5617 1 5 . 1 1 39 39 ARG HA H 39 5.444 5.444 5.120 0.324 18321 5618 1 5 . 1 1 39 39 ARG C C 39 175.772 175.772 174.893 0.879 18321 5619 1 5 . 1 1 39 39 ARG CA C 39 52.558 52.558 53.762 -1.204 18321 5620 1 5 . 1 1 39 39 ARG CB C 39 34.980 34.980 32.786 2.194 18321 5621 1 5 . 1 1 39 39 ARG H H 39 9.569 9.569 8.555 1.014 18321 5622 1 5 . 1 1 40 40 ASP N N 40 122.330 122.330 119.579 2.751 18321 5623 1 5 . 1 1 40 40 ASP HA H 40 4.785 4.785 5.076 -0.291 18321 5624 1 5 . 1 1 40 40 ASP C C 40 176.332 176.332 175.779 0.553 18321 5625 1 5 . 1 1 40 40 ASP CA C 40 55.334 55.334 53.977 1.357 18321 5626 1 5 . 1 1 40 40 ASP CB C 40 40.650 40.650 42.180 -1.530 18321 5627 1 5 . 1 1 40 40 ASP H H 40 8.413 8.413 8.635 -0.222 18321 5628 1 5 . 1 1 41 41 SER N N 41 114.363 114.363 118.064 -3.701 18321 5629 1 5 . 1 1 41 41 SER HA H 41 4.506 4.506 4.404 0.102 18321 5630 1 5 . 1 1 41 41 SER CA C 41 57.525 57.525 58.411 -0.886 18321 5631 1 5 . 1 1 41 41 SER CB C 41 63.706 63.706 63.250 0.456 18321 5632 1 5 . 1 1 41 41 SER H H 41 7.791 7.791 8.258 -0.467 18321 5633 1 5 . 1 1 42 42 SER N N 42 126.932 126.932 123.356 3.576 18321 5634 1 5 . 1 1 42 42 SER HA H 42 4.410 4.410 4.416 -0.006 18321 5635 1 5 . 1 1 42 42 SER CA C 42 60.362 60.362 60.030 0.332 18321 5636 1 5 . 1 1 42 42 SER CB C 42 63.707 63.707 63.376 0.331 18321 5637 1 5 . 1 1 42 42 SER H H 42 10.519 10.519 8.482 2.037 18321 5638 1 5 . 1 1 43 43 THR HA H 43 4.097 4.097 4.470 -0.373 18321 5639 1 5 . 1 1 43 43 THR CA C 43 64.722 64.722 62.022 2.700 18321 5640 1 5 . 1 1 43 43 THR CB C 43 69.439 69.439 69.880 -0.441 18321 5641 1 5 . 1 1 44 44 CYS HA H 44 5.100 5.100 4.911 0.189 18321 5642 1 5 . 1 1 44 44 CYS CA C 44 51.779 51.779 55.450 -3.671 18321 5643 1 5 . 1 1 44 44 CYS CB C 44 41.314 41.314 29.866 11.448 18321 5644 1 5 . 1 1 45 45 PRO HA H 45 4.278 4.278 4.289 -0.011 18321 5645 1 5 . 1 1 45 45 PRO C C 45 178.127 178.127 177.474 0.653 18321 5646 1 5 . 1 1 45 45 PRO CA C 45 64.151 64.151 64.457 -0.306 18321 5647 1 5 . 1 1 45 45 PRO CB C 45 31.596 31.596 31.122 0.474 18321 5648 1 5 . 1 1 46 46 GLY N N 46 114.947 114.947 114.229 0.718 18321 5649 1 5 . 1 1 46 46 GLY C C 46 174.701 174.701 174.065 0.636 18321 5650 1 5 . 1 1 46 46 GLY CA C 46 45.225 45.225 44.824 0.401 18321 5651 1 5 . 1 1 46 46 GLY H H 46 8.812 8.812 8.705 0.107 18321 5652 1 5 . 1 1 47 47 ASP N N 47 120.862 120.862 121.225 -0.363 18321 5653 1 5 . 1 1 47 47 ASP HA H 47 5.235 5.235 4.637 0.598 18321 5654 1 5 . 1 1 47 47 ASP C C 47 176.480 176.480 175.263 1.217 18321 5655 1 5 . 1 1 47 47 ASP CA C 47 53.591 53.591 55.039 -1.448 18321 5656 1 5 . 1 1 47 47 ASP CB C 47 41.707 41.707 42.102 -0.396 18321 5657 1 5 . 1 1 47 47 ASP H H 47 7.997 7.997 7.493 0.504 18321 5658 1 5 . 1 1 48 48 TYR N N 48 118.473 118.473 115.947 2.526 18321 5659 1 5 . 1 1 48 48 TYR HA H 48 5.431 5.431 5.118 0.313 18321 5660 1 5 . 1 1 48 48 TYR C C 48 173.783 173.783 175.605 -1.822 18321 5661 1 5 . 1 1 48 48 TYR CA C 48 56.891 56.891 56.677 0.214 18321 5662 1 5 . 1 1 48 48 TYR CB C 48 43.274 43.274 42.541 0.733 18321 5663 1 5 . 1 1 48 48 TYR H H 48 8.892 8.892 9.017 -0.125 18321 5664 1 5 . 1 1 49 49 VAL N N 49 119.105 119.105 119.480 -0.375 18321 5665 1 5 . 1 1 49 49 VAL HA H 49 4.800 4.800 4.676 0.124 18321 5666 1 5 . 1 1 49 49 VAL C C 49 174.397 174.397 174.665 -0.268 18321 5667 1 5 . 1 1 49 49 VAL CA C 49 61.439 61.439 61.867 -0.428 18321 5668 1 5 . 1 1 49 49 VAL CB C 49 35.388 35.388 34.078 1.310 18321 5669 1 5 . 1 1 49 49 VAL H H 49 9.661 9.661 8.728 0.933 18321 5670 1 5 . 1 1 50 50 LEU N N 50 129.599 129.599 131.164 -1.565 18321 5671 1 5 . 1 1 50 50 LEU HA H 50 5.033 5.033 4.942 0.091 18321 5672 1 5 . 1 1 50 50 LEU C C 50 175.001 175.001 175.467 -0.466 18321 5673 1 5 . 1 1 50 50 LEU CA C 50 53.352 53.352 53.794 -0.442 18321 5674 1 5 . 1 1 50 50 LEU CB C 50 44.062 44.062 41.883 2.179 18321 5675 1 5 . 1 1 50 50 LEU H H 50 9.405 9.405 9.295 0.110 18321 5676 1 5 . 1 1 51 51 SER N N 51 126.895 126.895 124.689 2.206 18321 5677 1 5 . 1 1 51 51 SER HA H 51 5.731 5.731 4.992 0.740 18321 5678 1 5 . 1 1 51 51 SER C C 51 173.094 173.094 173.679 -0.585 18321 5679 1 5 . 1 1 51 51 SER CA C 51 58.834 58.834 57.547 1.287 18321 5680 1 5 . 1 1 51 51 SER CB C 51 64.977 64.977 63.662 1.315 18321 5681 1 5 . 1 1 51 51 SER H H 51 9.094 9.094 9.227 -0.133 18321 5682 1 5 . 1 1 52 52 VAL N N 52 121.777 121.777 127.283 -5.506 18321 5683 1 5 . 1 1 52 52 VAL HA H 52 5.066 5.066 4.659 0.407 18321 5684 1 5 . 1 1 52 52 VAL C C 52 174.573 174.573 175.086 -0.513 18321 5685 1 5 . 1 1 52 52 VAL CA C 52 59.535 59.535 61.047 -1.512 18321 5686 1 5 . 1 1 52 52 VAL CB C 52 36.834 36.834 35.099 1.734 18321 5687 1 5 . 1 1 52 52 VAL H H 52 8.816 8.816 8.952 -0.136 18321 5688 1 5 . 1 1 53 53 SER N N 53 120.489 120.489 121.890 -1.401 18321 5689 1 5 . 1 1 53 53 SER HA H 53 4.811 4.811 5.268 -0.457 18321 5690 1 5 . 1 1 53 53 SER C C 53 174.065 174.065 173.542 0.523 18321 5691 1 5 . 1 1 53 53 SER CA C 53 57.496 57.496 57.713 -0.217 18321 5692 1 5 . 1 1 53 53 SER CB C 53 62.623 62.623 63.544 -0.921 18321 5693 1 5 . 1 1 53 53 SER H H 53 8.780 8.780 9.099 -0.319 18321 5694 1 5 . 1 1 54 54 GLU N N 54 132.020 132.020 126.990 5.030 18321 5695 1 5 . 1 1 54 54 GLU HA H 54 4.250 4.250 4.060 0.190 18321 5696 1 5 . 1 1 54 54 GLU C C 54 175.387 175.387 174.551 0.836 18321 5697 1 5 . 1 1 54 54 GLU CA C 54 56.999 56.999 56.006 0.993 18321 5698 1 5 . 1 1 54 54 GLU CB C 54 32.556 32.556 32.585 -0.029 18321 5699 1 5 . 1 1 54 54 GLU H H 54 8.472 8.472 8.068 0.404 18321 5700 1 5 . 1 1 55 55 ASN N N 55 126.517 126.517 119.937 6.580 18321 5701 1 5 . 1 1 55 55 ASN HA H 55 4.220 4.220 4.267 -0.047 18321 5702 1 5 . 1 1 55 55 ASN C C 55 174.546 174.546 175.240 -0.694 18321 5703 1 5 . 1 1 55 55 ASN CA C 55 54.770 54.770 54.366 0.404 18321 5704 1 5 . 1 1 55 55 ASN CB C 55 37.314 37.314 37.209 0.105 18321 5705 1 5 . 1 1 55 55 ASN H H 55 8.853 8.853 8.660 0.193 18321 5706 1 5 . 1 1 56 56 SER N N 56 112.009 112.009 111.045 0.964 18321 5707 1 5 . 1 1 56 56 SER HA H 56 4.334 4.334 4.112 0.222 18321 5708 1 5 . 1 1 56 56 SER C C 56 173.354 173.354 173.561 -0.207 18321 5709 1 5 . 1 1 56 56 SER CA C 56 59.966 59.966 61.994 -2.028 18321 5710 1 5 . 1 1 56 56 SER CB C 56 62.242 62.242 62.899 -0.657 18321 5711 1 5 . 1 1 56 56 SER H H 56 10.418 10.418 9.404 1.014 18321 5712 1 5 . 1 1 57 57 ARG N N 57 121.764 121.764 114.846 6.918 18321 5713 1 5 . 1 1 57 57 ARG HA H 57 5.167 5.167 4.874 0.293 18321 5714 1 5 . 1 1 57 57 ARG C C 57 174.983 174.983 174.752 0.231 18321 5715 1 5 . 1 1 57 57 ARG CA C 57 54.550 54.550 56.583 -2.033 18321 5716 1 5 . 1 1 57 57 ARG CB C 57 31.886 31.886 31.969 -0.083 18321 5717 1 5 . 1 1 57 57 ARG H H 57 8.097 8.097 7.625 0.472 18321 5718 1 5 . 1 1 58 58 VAL N N 58 121.866 121.866 119.567 2.299 18321 5719 1 5 . 1 1 58 58 VAL HA H 58 4.768 4.768 5.085 -0.317 18321 5720 1 5 . 1 1 58 58 VAL C C 58 175.388 175.388 174.590 0.798 18321 5721 1 5 . 1 1 58 58 VAL CA C 58 61.818 61.818 60.600 1.218 18321 5722 1 5 . 1 1 58 58 VAL CB C 58 34.135 34.135 33.702 0.433 18321 5723 1 5 . 1 1 58 58 VAL H H 58 8.081 8.081 7.679 0.402 18321 5724 1 5 . 1 1 59 59 SER N N 59 124.445 124.445 122.628 1.817 18321 5725 1 5 . 1 1 59 59 SER HA H 59 4.462 4.462 4.645 -0.183 18321 5726 1 5 . 1 1 59 59 SER C C 59 172.185 172.185 173.563 -1.378 18321 5727 1 5 . 1 1 59 59 SER CA C 59 56.629 56.629 56.593 0.036 18321 5728 1 5 . 1 1 59 59 SER CB C 59 66.218 66.218 64.248 1.970 18321 5729 1 5 . 1 1 59 59 SER H H 59 9.082 9.082 9.049 0.033 18321 5730 1 5 . 1 1 60 60 HIS N N 60 121.224 121.224 126.440 -5.216 18321 5731 1 5 . 1 1 60 60 HIS HA H 60 4.885 4.885 4.803 0.082 18321 5732 1 5 . 1 1 60 60 HIS C C 60 174.674 174.674 173.977 0.697 18321 5733 1 5 . 1 1 60 60 HIS CA C 60 54.900 54.900 55.623 -0.723 18321 5734 1 5 . 1 1 60 60 HIS CB C 60 32.331 32.331 29.866 2.465 18321 5735 1 5 . 1 1 60 60 HIS H H 60 8.331 8.331 8.692 -0.361 18321 5736 1 5 . 1 1 61 61 TYR N N 61 124.780 124.780 124.490 0.290 18321 5737 1 5 . 1 1 61 61 TYR HA H 61 4.655 4.655 4.673 -0.018 18321 5738 1 5 . 1 1 61 61 TYR CA C 61 57.409 57.409 56.462 0.947 18321 5739 1 5 . 1 1 61 61 TYR CB C 61 39.785 39.785 40.024 -0.239 18321 5740 1 5 . 1 1 61 61 TYR H H 61 9.273 9.273 9.170 0.103 18321 5741 1 5 . 1 1 62 62 ILE HA H 62 4.298 4.298 4.408 -0.110 18321 5742 1 5 . 1 1 62 62 ILE C C 62 174.817 174.817 175.738 -0.921 18321 5743 1 5 . 1 1 62 62 ILE CA C 62 61.908 61.908 59.900 2.008 18321 5744 1 5 . 1 1 62 62 ILE CB C 62 38.321 38.321 37.773 0.548 18321 5745 1 5 . 1 1 63 63 ILE N N 63 128.552 128.552 129.430 -0.878 18321 5746 1 5 . 1 1 63 63 ILE HA H 63 4.788 4.788 4.529 0.259 18321 5747 1 5 . 1 1 63 63 ILE C C 63 175.982 175.982 174.615 1.367 18321 5748 1 5 . 1 1 63 63 ILE CA C 63 59.629 59.629 60.103 -0.474 18321 5749 1 5 . 1 1 63 63 ILE CB C 63 39.747 39.747 38.402 1.345 18321 5750 1 5 . 1 1 63 63 ILE H H 63 9.155 9.155 8.856 0.299 18321 5751 1 5 . 1 1 64 64 ASN N N 64 123.240 123.240 127.798 -4.558 18321 5752 1 5 . 1 1 64 64 ASN HA H 64 4.857 4.857 5.629 -0.772 18321 5753 1 5 . 1 1 64 64 ASN C C 64 175.324 175.324 174.831 0.493 18321 5754 1 5 . 1 1 64 64 ASN CA C 64 53.736 53.736 53.192 0.544 18321 5755 1 5 . 1 1 64 64 ASN CB C 64 41.531 41.531 40.463 1.068 18321 5756 1 5 . 1 1 64 64 ASN H H 64 9.379 9.379 8.804 0.575 18321 5757 1 5 . 1 1 65 65 SER N N 65 121.157 121.157 118.587 2.570 18321 5758 1 5 . 1 1 65 65 SER HA H 65 4.548 4.548 4.751 -0.203 18321 5759 1 5 . 1 1 65 65 SER C C 65 174.328 174.328 174.527 -0.199 18321 5760 1 5 . 1 1 65 65 SER CA C 65 58.306 58.306 57.865 0.441 18321 5761 1 5 . 1 1 65 65 SER CB C 65 62.878 62.878 62.808 0.070 18321 5762 1 5 . 1 1 65 65 SER H H 65 9.195 9.195 8.552 0.643 18321 5763 1 5 . 1 1 66 66 LEU N N 66 127.417 127.417 128.555 -1.138 18321 5764 1 5 . 1 1 66 66 LEU HA H 66 4.605 4.605 4.607 -0.002 18321 5765 1 5 . 1 1 66 66 LEU CA C 66 52.888 52.888 53.093 -0.205 18321 5766 1 5 . 1 1 66 66 LEU CB C 66 41.799 41.799 41.946 -0.147 18321 5767 1 5 . 1 1 66 66 LEU H H 66 8.143 8.143 8.463 -0.320 18321 5768 1 5 . 1 1 68 68 ASN HA H 68 4.386 4.386 4.665 -0.279 18321 5769 1 5 . 1 1 68 68 ASN C C 68 174.487 174.487 174.892 -0.405 18321 5770 1 5 . 1 1 68 68 ASN CA C 68 53.365 53.365 52.873 0.492 18321 5771 1 5 . 1 1 68 68 ASN CB C 68 36.778 36.778 37.947 -1.169 18321 5772 1 5 . 1 1 69 69 ARG N N 69 111.329 111.329 115.621 -4.292 18321 5773 1 5 . 1 1 69 69 ARG HA H 69 3.876 3.876 3.834 0.042 18321 5774 1 5 . 1 1 69 69 ARG CA C 69 57.393 57.393 57.238 0.155 18321 5775 1 5 . 1 1 69 69 ARG CB C 69 26.665 26.665 28.097 -1.432 18321 5776 1 5 . 1 1 69 69 ARG H H 69 8.191 8.191 7.632 0.559 18321 5777 1 5 . 1 1 70 70 ARG N N 70 116.120 116.120 114.867 1.253 18321 5778 1 5 . 1 1 70 70 ARG HA H 70 4.556 4.556 4.756 -0.200 18321 5779 1 5 . 1 1 70 70 ARG C C 70 174.882 174.882 173.898 0.984 18321 5780 1 5 . 1 1 70 70 ARG CA C 70 55.509 55.509 53.616 1.893 18321 5781 1 5 . 1 1 70 70 ARG CB C 70 31.771 31.771 33.714 -1.943 18321 5782 1 5 . 1 1 70 70 ARG H H 70 6.667 6.667 7.282 -0.615 18321 5783 1 5 . 1 1 71 71 PHE N N 71 116.313 116.313 117.840 -1.527 18321 5784 1 5 . 1 1 71 71 PHE HA H 71 5.540 5.540 5.659 -0.119 18321 5785 1 5 . 1 1 71 71 PHE C C 71 174.391 174.391 175.236 -0.845 18321 5786 1 5 . 1 1 71 71 PHE CA C 71 57.528 57.528 56.331 1.197 18321 5787 1 5 . 1 1 71 71 PHE CB C 71 44.115 44.115 42.659 1.456 18321 5788 1 5 . 1 1 71 71 PHE H H 71 8.700 8.700 8.341 0.359 18321 5789 1 5 . 1 1 72 72 LYS N N 72 122.770 122.770 125.532 -2.762 18321 5790 1 5 . 1 1 72 72 LYS HA H 72 5.483 5.483 4.933 0.550 18321 5791 1 5 . 1 1 72 72 LYS C C 72 173.923 173.923 175.124 -1.201 18321 5792 1 5 . 1 1 72 72 LYS CA C 72 54.855 54.855 55.180 -0.325 18321 5793 1 5 . 1 1 72 72 LYS CB C 72 37.710 37.710 35.352 2.358 18321 5794 1 5 . 1 1 72 72 LYS H H 72 9.138 9.138 8.775 0.363 18321 5795 1 5 . 1 1 73 73 ILE N N 73 124.576 124.576 129.256 -4.680 18321 5796 1 5 . 1 1 73 73 ILE HA H 73 4.955 4.955 5.188 -0.233 18321 5797 1 5 . 1 1 73 73 ILE C C 73 175.728 175.728 175.870 -0.142 18321 5798 1 5 . 1 1 73 73 ILE CA C 73 58.935 58.935 59.710 -0.775 18321 5799 1 5 . 1 1 73 73 ILE CB C 73 40.965 40.965 39.599 1.366 18321 5800 1 5 . 1 1 73 73 ILE H H 73 8.826 8.826 8.769 0.057 18321 5801 1 5 . 1 1 74 74 GLY N N 74 118.718 118.718 118.987 -0.269 18321 5802 1 5 . 1 1 74 74 GLY C C 74 174.436 174.436 175.012 -0.576 18321 5803 1 5 . 1 1 74 74 GLY CA C 74 47.401 47.401 45.618 1.783 18321 5804 1 5 . 1 1 74 74 GLY H H 74 9.317 9.317 8.814 0.503 18321 5805 1 5 . 1 1 75 75 ASP N N 75 125.691 125.691 116.133 9.558 18321 5806 1 5 . 1 1 75 75 ASP HA H 75 4.713 4.713 4.221 0.492 18321 5807 1 5 . 1 1 75 75 ASP C C 75 175.841 175.841 175.014 0.827 18321 5808 1 5 . 1 1 75 75 ASP CA C 75 53.815 53.815 56.499 -2.684 18321 5809 1 5 . 1 1 75 75 ASP CB C 75 41.288 41.288 40.306 0.982 18321 5810 1 5 . 1 1 75 75 ASP H H 75 8.665 8.665 8.859 -0.194 18321 5811 1 5 . 1 1 76 76 GLN N N 76 120.368 120.368 120.774 -0.406 18321 5812 1 5 . 1 1 76 76 GLN C C 76 173.630 173.630 174.736 -1.106 18321 5813 1 5 . 1 1 76 76 GLN CA C 76 54.254 54.254 54.667 -0.413 18321 5814 1 5 . 1 1 76 76 GLN CB C 76 31.248 31.248 28.723 2.526 18321 5815 1 5 . 1 1 76 76 GLN H H 76 8.289 8.289 7.733 0.556 18321 5816 1 5 . 1 1 77 77 GLU N N 77 120.435 120.435 121.776 -1.341 18321 5817 1 5 . 1 1 77 77 GLU C C 77 175.484 175.484 174.745 0.739 18321 5818 1 5 . 1 1 77 77 GLU CA C 77 54.203 54.203 54.840 -0.637 18321 5819 1 5 . 1 1 77 77 GLU CB C 77 33.141 33.141 31.217 1.924 18321 5820 1 5 . 1 1 77 77 GLU H H 77 7.732 7.732 8.157 -0.425 18321 5821 1 5 . 1 1 78 78 PHE N N 78 117.911 117.911 122.088 -4.177 18321 5822 1 5 . 1 1 78 78 PHE HA H 78 4.659 4.659 4.724 -0.065 18321 5823 1 5 . 1 1 78 78 PHE C C 78 175.673 175.673 176.410 -0.737 18321 5824 1 5 . 1 1 78 78 PHE CA C 78 57.160 57.160 56.550 0.610 18321 5825 1 5 . 1 1 78 78 PHE CB C 78 45.405 45.405 41.261 4.144 18321 5826 1 5 . 1 1 78 78 PHE H H 78 9.235 9.235 8.292 0.943 18321 5827 1 5 . 1 1 79 79 ASP N N 79 119.296 119.296 119.082 0.214 18321 5828 1 5 . 1 1 79 79 ASP HA H 79 4.462 4.462 4.354 0.108 18321 5829 1 5 . 1 1 79 79 ASP C C 79 174.482 174.482 175.541 -1.059 18321 5830 1 5 . 1 1 79 79 ASP CA C 79 56.629 56.629 57.182 -0.553 18321 5831 1 5 . 1 1 79 79 ASP CB C 79 41.697 41.697 40.698 0.999 18321 5832 1 5 . 1 1 79 79 ASP H H 79 9.187 9.187 8.783 0.404 18321 5833 1 5 . 1 1 80 80 HIS N N 80 107.631 107.631 109.613 -1.982 18321 5834 1 5 . 1 1 80 80 HIS HA H 80 5.022 5.022 4.954 0.068 18321 5835 1 5 . 1 1 80 80 HIS C C 80 174.626 174.626 174.689 -0.063 18321 5836 1 5 . 1 1 80 80 HIS CA C 80 54.223 54.223 55.342 -1.119 18321 5837 1 5 . 1 1 80 80 HIS CB C 80 32.205 32.205 30.935 1.270 18321 5838 1 5 . 1 1 80 80 HIS H H 80 7.200 7.200 7.065 0.135 18321 5839 1 5 . 1 1 81 81 LEU N N 81 120.710 120.710 120.865 -0.155 18321 5840 1 5 . 1 1 81 81 LEU HA H 81 3.804 3.804 4.151 -0.347 18321 5841 1 5 . 1 1 81 81 LEU CA C 81 58.709 58.709 60.296 -1.587 18321 5842 1 5 . 1 1 81 81 LEU CB C 81 39.646 39.646 39.999 -0.353 18321 5843 1 5 . 1 1 81 81 LEU H H 81 8.886 8.886 9.115 -0.229 18321 5844 1 5 . 1 1 82 82 PRO HA H 82 4.020 4.020 4.227 -0.207 18321 5845 1 5 . 1 1 82 82 PRO C C 82 175.619 175.619 177.670 -2.051 18321 5846 1 5 . 1 1 82 82 PRO CA C 82 67.025 67.025 65.350 1.675 18321 5847 1 5 . 1 1 82 82 PRO CB C 82 30.962 30.962 31.022 -0.060 18321 5848 1 5 . 1 1 83 83 ALA N N 83 124.281 124.281 120.865 3.416 18321 5849 1 5 . 1 1 83 83 ALA HA H 83 4.019 4.019 4.192 -0.173 18321 5850 1 5 . 1 1 83 83 ALA C C 83 179.709 179.709 178.645 1.064 18321 5851 1 5 . 1 1 83 83 ALA CA C 83 54.985 54.985 54.519 0.466 18321 5852 1 5 . 1 1 83 83 ALA CB C 83 18.425 18.425 19.058 -0.634 18321 5853 1 5 . 1 1 83 83 ALA H H 83 8.527 8.527 7.767 0.760 18321 5854 1 5 . 1 1 84 84 LEU N N 84 122.960 122.960 117.536 5.424 18321 5855 1 5 . 1 1 84 84 LEU HA H 84 1.917 1.917 3.092 -1.175 18321 5856 1 5 . 1 1 84 84 LEU C C 84 177.652 177.652 178.316 -0.664 18321 5857 1 5 . 1 1 84 84 LEU CA C 84 58.261 58.261 57.329 0.932 18321 5858 1 5 . 1 1 84 84 LEU CB C 84 42.544 42.544 41.022 1.522 18321 5859 1 5 . 1 1 84 84 LEU H H 84 6.982 6.982 7.511 -0.529 18321 5860 1 5 . 1 1 85 85 LEU N N 85 117.940 117.940 118.116 -0.176 18321 5861 1 5 . 1 1 85 85 LEU HA H 85 3.463 3.463 3.866 -0.403 18321 5862 1 5 . 1 1 85 85 LEU C C 85 178.809 178.809 178.124 0.685 18321 5863 1 5 . 1 1 85 85 LEU CA C 85 57.522 57.522 57.004 0.518 18321 5864 1 5 . 1 1 85 85 LEU CB C 85 41.242 41.242 41.227 0.015 18321 5865 1 5 . 1 1 85 85 LEU H H 85 7.773 7.773 7.530 0.243 18321 5866 1 5 . 1 1 86 86 GLU N N 86 115.762 115.762 117.874 -2.112 18321 5867 1 5 . 1 1 86 86 GLU HA H 86 3.540 3.540 4.045 -0.505 18321 5868 1 5 . 1 1 86 86 GLU C C 86 180.228 180.228 178.686 1.542 18321 5869 1 5 . 1 1 86 86 GLU CA C 86 58.943 58.943 58.336 0.608 18321 5870 1 5 . 1 1 86 86 GLU CB C 86 29.561 29.561 29.616 -0.056 18321 5871 1 5 . 1 1 86 86 GLU H H 86 8.300 8.300 7.329 0.971 18321 5872 1 5 . 1 1 87 87 PHE N N 87 121.135 121.135 121.087 0.048 18321 5873 1 5 . 1 1 87 87 PHE HA H 87 4.122 4.122 4.257 -0.135 18321 5874 1 5 . 1 1 87 87 PHE C C 87 179.497 179.497 176.831 2.666 18321 5875 1 5 . 1 1 87 87 PHE CA C 87 62.090 62.090 59.645 2.445 18321 5876 1 5 . 1 1 87 87 PHE CB C 87 40.103 40.103 38.942 1.161 18321 5877 1 5 . 1 1 87 87 PHE H H 87 7.717 7.717 7.442 0.275 18321 5878 1 5 . 1 1 88 88 TYR N N 88 116.579 116.579 117.884 -1.305 18321 5879 1 5 . 1 1 88 88 TYR HA H 88 4.933 4.933 4.248 0.685 18321 5880 1 5 . 1 1 88 88 TYR C C 88 174.799 174.799 176.591 -1.792 18321 5881 1 5 . 1 1 88 88 TYR CA C 88 61.333 61.333 58.778 2.555 18321 5882 1 5 . 1 1 88 88 TYR CB C 88 36.539 36.539 37.112 -0.573 18321 5883 1 5 . 1 1 88 88 TYR H H 88 7.478 7.478 7.787 -0.309 18321 5884 1 5 . 1 1 89 89 LYS N N 89 117.737 117.737 118.627 -0.890 18321 5885 1 5 . 1 1 89 89 LYS HA H 89 4.466 4.466 4.082 0.384 18321 5886 1 5 . 1 1 89 89 LYS C C 89 178.417 178.417 176.608 1.809 18321 5887 1 5 . 1 1 89 89 LYS CA C 89 59.486 59.486 58.813 0.673 18321 5888 1 5 . 1 1 89 89 LYS CB C 89 34.523 34.523 32.903 1.620 18321 5889 1 5 . 1 1 89 89 LYS H H 89 7.505 7.505 7.553 -0.048 18321 5890 1 5 . 1 1 90 90 ILE N N 90 110.972 110.972 112.031 -1.059 18321 5891 1 5 . 1 1 90 90 ILE HA H 90 4.181 4.181 4.177 0.004 18321 5892 1 5 . 1 1 90 90 ILE C C 90 174.571 174.571 176.069 -1.498 18321 5893 1 5 . 1 1 90 90 ILE CA C 90 60.516 60.516 61.191 -0.675 18321 5894 1 5 . 1 1 90 90 ILE CB C 90 39.979 39.979 38.187 1.792 18321 5895 1 5 . 1 1 90 90 ILE H H 90 6.710 6.710 7.223 -0.513 18321 5896 1 5 . 1 1 91 91 HIS N N 91 119.479 119.479 119.687 -0.208 18321 5897 1 5 . 1 1 91 91 HIS HA H 91 4.357 4.357 4.424 -0.067 18321 5898 1 5 . 1 1 91 91 HIS C C 91 172.751 172.751 174.707 -1.956 18321 5899 1 5 . 1 1 91 91 HIS CA C 91 55.066 55.066 56.602 -1.536 18321 5900 1 5 . 1 1 91 91 HIS CB C 91 29.756 29.756 31.780 -2.024 18321 5901 1 5 . 1 1 91 91 HIS H H 91 7.460 7.460 7.534 -0.074 18321 5902 1 5 . 1 1 92 92 TYR N N 92 117.642 117.642 113.946 3.696 18321 5903 1 5 . 1 1 92 92 TYR HA H 92 4.131 4.131 4.254 -0.123 18321 5904 1 5 . 1 1 92 92 TYR C C 92 177.348 177.348 175.312 2.036 18321 5905 1 5 . 1 1 92 92 TYR CA C 92 58.627 58.627 59.620 -0.993 18321 5906 1 5 . 1 1 92 92 TYR CB C 92 39.481 39.481 37.504 1.977 18321 5907 1 5 . 1 1 92 92 TYR H H 92 8.067 8.067 7.448 0.619 18321 5908 1 5 . 1 1 93 93 LEU N N 93 123.560 123.560 114.340 9.220 18321 5909 1 5 . 1 1 93 93 LEU HA H 93 4.104 4.104 5.134 -1.030 18321 5910 1 5 . 1 1 93 93 LEU C C 93 175.610 175.610 176.188 -0.578 18321 5911 1 5 . 1 1 93 93 LEU CA C 93 56.381 56.381 54.141 2.240 18321 5912 1 5 . 1 1 93 93 LEU CB C 93 38.896 38.896 42.562 -3.666 18321 5913 1 5 . 1 1 93 93 LEU H H 93 7.907 7.907 8.246 -0.339 18321 5914 1 5 . 1 1 94 94 ASP N N 94 118.194 118.194 120.137 -1.943 18321 5915 1 5 . 1 1 94 94 ASP HA H 94 4.940 4.940 4.782 0.158 18321 5916 1 5 . 1 1 94 94 ASP C C 94 176.123 176.123 175.460 0.663 18321 5917 1 5 . 1 1 94 94 ASP CA C 94 56.235 56.235 53.845 2.390 18321 5918 1 5 . 1 1 94 94 ASP CB C 94 42.078 42.078 41.560 0.518 18321 5919 1 5 . 1 1 94 94 ASP H H 94 8.640 8.640 7.782 0.858 18321 5920 1 5 . 1 1 95 95 THR N N 95 105.073 105.073 115.060 -9.987 18321 5921 1 5 . 1 1 95 95 THR HA H 95 4.318 4.318 4.282 0.036 18321 5922 1 5 . 1 1 95 95 THR C C 95 174.685 174.685 174.196 0.489 18321 5923 1 5 . 1 1 95 95 THR CA C 95 60.756 60.756 63.311 -2.555 18321 5924 1 5 . 1 1 95 95 THR CB C 95 71.058 71.058 68.885 2.173 18321 5925 1 5 . 1 1 95 95 THR H H 95 8.576 8.576 8.216 0.360 18321 5926 1 5 . 1 1 96 96 THR N N 96 116.817 116.817 113.426 3.391 18321 5927 1 5 . 1 1 96 96 THR HA H 96 5.129 5.129 4.742 0.387 18321 5928 1 5 . 1 1 96 96 THR C C 96 172.464 172.464 172.746 -0.282 18321 5929 1 5 . 1 1 96 96 THR CA C 96 60.762 60.762 59.826 0.936 18321 5930 1 5 . 1 1 96 96 THR CB C 96 71.425 71.425 70.074 1.351 18321 5931 1 5 . 1 1 96 96 THR H H 96 8.205 8.205 7.433 0.772 18321 5932 1 5 . 1 1 97 97 THR N N 97 114.324 114.324 113.394 0.930 18321 5933 1 5 . 1 1 97 97 THR HA H 97 5.128 5.128 4.377 0.751 18321 5934 1 5 . 1 1 97 97 THR C C 97 175.480 175.480 174.162 1.318 18321 5935 1 5 . 1 1 97 97 THR CA C 97 60.233 60.233 59.922 0.311 18321 5936 1 5 . 1 1 97 97 THR CB C 97 70.415 70.415 70.340 0.075 18321 5937 1 5 . 1 1 97 97 THR H H 97 7.128 7.128 8.144 -1.016 18321 5938 1 5 . 1 1 98 98 LEU N N 98 116.674 116.674 122.247 -5.573 18321 5939 1 5 . 1 1 98 98 LEU HA H 98 4.075 4.075 4.184 -0.109 18321 5940 1 5 . 1 1 98 98 LEU C C 98 177.892 177.892 176.881 1.011 18321 5941 1 5 . 1 1 98 98 LEU CA C 98 59.597 59.597 54.798 4.799 18321 5942 1 5 . 1 1 98 98 LEU CB C 98 41.172 41.172 40.042 1.130 18321 5943 1 5 . 1 1 98 98 LEU H H 98 8.743 8.743 7.864 0.879 18321 5944 1 5 . 1 1 99 99 ILE N N 99 122.988 122.988 122.660 0.328 18321 5945 1 5 . 1 1 99 99 ILE HA H 99 4.415 4.415 4.162 0.253 18321 5946 1 5 . 1 1 99 99 ILE C C 99 175.055 175.055 176.559 -1.504 18321 5947 1 5 . 1 1 99 99 ILE CA C 99 62.183 62.183 62.366 -0.183 18321 5948 1 5 . 1 1 99 99 ILE CB C 99 40.252 40.252 38.449 1.803 18321 5949 1 5 . 1 1 99 99 ILE H H 99 8.998 8.998 8.127 0.871 18321 5950 1 5 . 1 1 100 100 GLU N N 100 114.067 114.067 114.273 -0.206 18321 5951 1 5 . 1 1 100 100 GLU CA C 100 52.910 52.910 53.774 -0.864 18321 5952 1 5 . 1 1 100 100 GLU CB C 100 31.155 31.155 30.700 0.456 18321 5953 1 5 . 1 1 100 100 GLU H H 100 7.332 7.332 7.955 -0.623 18321 5954 1 5 . 1 1 101 101 PRO HA H 101 4.952 4.952 3.715 1.237 18321 5955 1 5 . 1 1 101 101 PRO C C 101 175.976 175.976 176.423 -0.447 18321 5956 1 5 . 1 1 101 101 PRO CA C 101 53.312 53.312 61.958 -8.646 18321 5957 1 5 . 1 1 101 101 PRO CB C 101 31.598 31.598 31.846 -0.248 18321 5958 1 5 . 1 1 102 102 ALA N N 102 125.968 125.968 126.127 -0.159 18321 5959 1 5 . 1 1 102 102 ALA HA H 102 4.516 4.516 4.300 0.216 18321 5960 1 5 . 1 1 102 102 ALA CA C 102 49.852 49.852 50.165 -0.313 18321 5961 1 5 . 1 1 102 102 ALA CB C 102 17.766 17.766 18.278 -0.512 18321 5962 1 5 . 1 1 102 102 ALA H H 102 8.232 8.232 7.956 0.276 18321 5963 1 5 . 1 1 103 103 PRO HA H 103 4.283 4.283 4.357 -0.074 18321 5964 1 5 . 1 1 103 103 PRO CA C 103 62.435 62.435 62.950 -0.515 18321 5965 1 5 . 1 1 103 103 PRO CB C 103 32.145 32.145 32.545 -0.400 18321 5966 1 5 . 1 1 104 104 ARG HA H 104 4.004 4.004 3.957 0.047 18321 5967 1 5 . 1 1 104 104 ARG CA C 104 56.660 56.660 56.789 -0.129 18321 5968 1 5 . 1 1 106 106 PRO C C 106 174.587 174.587 176.457 -1.870 18321 5969 1 5 . 1 1 106 106 PRO CA C 106 57.867 57.867 62.565 -4.698 18321 5970 1 5 . 1 1 106 106 PRO CB C 106 31.942 31.942 32.659 -0.717 18321 5971 1 5 . 1 1 107 107 SER N N 107 121.280 121.280 118.332 2.948 18321 5972 1 5 . 1 1 107 107 SER CA C 107 61.772 61.772 55.633 6.139 18321 5973 1 5 . 1 1 107 107 SER CB C 107 63.234 63.234 63.799 -0.565 18321 5974 1 5 . 1 1 107 107 SER H H 107 8.132 8.132 8.380 -0.248 18321 5975 1 5 . 1 1 109 109 PRO C C 109 177.129 177.129 175.620 1.509 18321 5976 1 5 . 1 1 109 109 PRO CA C 109 62.638 62.638 61.922 0.716 18321 5977 1 5 . 1 1 109 109 PRO CB C 109 30.970 30.970 32.942 -1.972 18321 5978 1 5 . 1 1 110 110 MET N N 110 120.772 120.772 118.778 1.994 18321 5979 1 5 . 1 1 110 110 MET C C 110 176.892 176.892 176.980 -0.088 18321 5980 1 5 . 1 1 110 110 MET CA C 110 55.310 55.310 55.341 -0.031 18321 5981 1 5 . 1 1 110 110 MET CB C 110 32.202 32.202 32.307 -0.105 18321 5982 1 5 . 1 1 110 110 MET H H 110 8.430 8.430 8.395 0.035 18321 5983 1 5 . 1 1 111 111 GLY N N 111 110.158 110.158 111.530 -1.372 18321 5984 1 5 . 1 1 111 111 GLY C C 111 177.430 177.430 174.344 3.086 18321 5985 1 5 . 1 1 111 111 GLY CA C 111 44.951 44.951 44.654 0.297 18321 5986 1 5 . 1 1 111 111 GLY H H 111 8.384 8.384 8.519 -0.135 18321 5987 1 5 . 1 1 112 112 SER N N 112 116.762 116.762 117.815 -1.053 18321 5988 1 5 . 1 1 112 112 SER CA C 112 55.948 55.948 58.265 -2.317 18321 5989 1 5 . 1 1 112 112 SER CB C 112 62.745 62.745 62.507 0.238 18321 5990 1 5 . 1 1 112 112 SER H H 112 8.161 8.161 8.193 -0.032 18321 5991 1 5 . 1 1 113 113 VAL C C 113 176.083 176.083 175.706 0.377 18321 5992 1 5 . 1 1 114 114 SER N N 114 119.151 119.151 123.100 -3.949 18321 5993 1 5 . 1 1 114 114 SER C C 114 173.638 173.638 172.359 1.279 18321 5994 1 5 . 1 1 114 114 SER CA C 114 58.005 58.005 57.536 0.469 18321 5995 1 5 . 1 1 114 114 SER CB C 114 63.169 63.169 65.311 -2.142 18321 5996 1 5 . 1 1 114 114 SER H H 114 8.319 8.319 8.451 -0.132 18321 5997 1 5 . 1 1 115 115 ALA N N 115 126.914 126.914 127.512 -0.598 18321 5998 1 5 . 1 1 115 115 ALA CA C 115 51.561 51.561 50.010 1.552 18321 5999 1 5 . 1 1 115 115 ALA CB C 115 17.714 17.714 19.582 -1.868 18321 6000 1 5 . 1 1 115 115 ALA H H 115 8.197 8.197 8.208 -0.011 18321 6001 1 5 . 1 1 119 119 PRO C C 119 177.065 177.065 176.884 0.181 18321 6002 1 5 . 1 1 120 120 THR N N 120 113.976 113.976 112.095 1.881 18321 6003 1 5 . 1 1 120 120 THR C C 120 174.461 174.461 172.644 1.817 18321 6004 1 5 . 1 1 120 120 THR CA C 120 61.215 61.215 61.430 -0.215 18321 6005 1 5 . 1 1 120 120 THR CB C 120 69.508 69.508 70.913 -1.405 18321 6006 1 5 . 1 1 120 120 THR H H 120 8.138 8.138 7.672 0.466 18321 6007 1 5 . 1 1 121 121 ALA N N 121 125.859 125.859 127.535 -1.676 18321 6008 1 5 . 1 1 121 121 ALA CA C 121 52.281 52.281 51.420 0.861 18321 6009 1 5 . 1 1 121 121 ALA CB C 121 18.623 18.623 21.392 -2.769 18321 6010 1 5 . 1 1 121 121 ALA H H 121 8.272 8.272 8.367 -0.095 18321 6011 1 5 . 1 1 122 122 GLU C C 122 176.316 176.316 176.367 -0.051 18321 6012 1 5 . 1 1 123 123 ASP N N 123 120.448 120.448 118.559 1.889 18321 6013 1 5 . 1 1 123 123 ASP C C 123 175.906 175.906 176.190 -0.284 18321 6014 1 5 . 1 1 123 123 ASP CA C 123 54.167 54.167 54.055 0.112 18321 6015 1 5 . 1 1 123 123 ASP CB C 123 40.695 40.695 41.365 -0.670 18321 6016 1 5 . 1 1 123 123 ASP H H 123 8.181 8.181 8.160 0.021 18321 6017 1 5 . 1 1 124 124 ASN N N 124 118.207 118.207 117.887 0.320 18321 6018 1 5 . 1 1 124 124 ASN C C 124 174.851 174.851 174.544 0.307 18321 6019 1 5 . 1 1 124 124 ASN CA C 124 52.771 52.771 53.465 -0.694 18321 6020 1 5 . 1 1 124 124 ASN CB C 124 38.304 38.304 39.835 -1.531 18321 6021 1 5 . 1 1 124 124 ASN H H 124 8.307 8.307 8.540 -0.233 18321 6022 1 5 . 1 1 125 125 LEU N N 125 121.311 121.311 120.593 0.718 18321 6023 1 5 . 1 1 125 125 LEU C C 125 175.750 175.750 175.170 0.580 18321 6024 1 5 . 1 1 125 125 LEU CA C 125 54.428 54.428 55.345 -0.917 18321 6025 1 5 . 1 1 125 125 LEU CB C 125 41.350 41.350 40.419 0.931 18321 6026 1 5 . 1 1 125 125 LEU H H 125 7.747 7.747 8.102 -0.355 18321 6027 1 5 . 1 1 126 126 GLU N N 126 122.485 122.485 120.753 1.732 18321 6028 1 5 . 1 1 126 126 GLU C C 126 174.008 174.008 173.946 0.062 18321 6029 1 5 . 1 1 126 126 GLU CA C 126 54.855 54.855 56.513 -1.658 18321 6030 1 5 . 1 1 126 126 GLU CB C 126 30.472 30.472 31.344 -0.872 18321 6031 1 5 . 1 1 126 126 GLU H H 126 8.453 8.453 8.239 0.214 18321 6032 1 5 . 1 1 127 127 TYR N N 127 122.713 122.713 120.072 2.641 18321 6033 1 5 . 1 1 127 127 TYR C C 127 176.859 176.859 174.783 2.076 18321 6034 1 5 . 1 1 127 127 TYR CA C 127 56.528 56.528 57.258 -0.730 18321 6035 1 5 . 1 1 127 127 TYR CB C 127 40.982 40.982 39.584 1.398 18321 6036 1 5 . 1 1 127 127 TYR H H 127 8.469 8.469 8.314 0.155 18321 6037 1 5 . 1 1 128 128 VAL N N 128 112.432 112.432 125.390 -12.958 18321 6038 1 5 . 1 1 128 128 VAL C C 128 173.150 173.150 174.140 -0.990 18321 6039 1 5 . 1 1 128 128 VAL CA C 128 57.940 57.940 60.689 -2.749 18321 6040 1 5 . 1 1 128 128 VAL CB C 128 34.935 34.935 34.778 0.157 18321 6041 1 5 . 1 1 128 128 VAL H H 128 9.078 9.078 9.206 -0.128 18321 6042 1 5 . 1 1 129 129 ARG N N 129 120.373 120.373 125.503 -5.130 18321 6043 1 5 . 1 1 129 129 ARG C C 129 176.539 176.539 175.740 0.799 18321 6044 1 5 . 1 1 129 129 ARG CA C 129 52.534 52.534 53.553 -1.019 18321 6045 1 5 . 1 1 129 129 ARG CB C 129 32.942 32.942 32.878 0.064 18321 6046 1 5 . 1 1 129 129 ARG H H 129 9.010 9.010 8.030 0.980 18321 6047 1 5 . 1 1 130 130 THR N N 130 116.637 116.637 112.420 4.217 18321 6048 1 5 . 1 1 130 130 THR CA C 130 60.618 60.618 60.698 -0.080 18321 6049 1 5 . 1 1 130 130 THR CB C 130 69.170 69.170 70.293 -1.123 18321 6050 1 5 . 1 1 130 130 THR H H 130 9.045 9.045 8.393 0.652 18321 6051 1 5 . 1 1 131 131 LEU N N 131 122.910 122.910 123.400 -0.490 18321 6052 1 5 . 1 1 131 131 LEU C C 131 175.269 175.269 177.357 -2.088 18321 6053 1 5 . 1 1 131 131 LEU CA C 131 55.122 55.122 55.562 -0.440 18321 6054 1 5 . 1 1 131 131 LEU CB C 131 43.108 43.108 42.505 0.603 18321 6055 1 5 . 1 1 131 131 LEU H H 131 9.224 9.224 8.635 0.589 18321 6056 1 5 . 1 1 132 132 TYR N N 132 112.885 112.885 119.472 -6.587 18321 6057 1 5 . 1 1 132 132 TYR C C 132 173.818 173.818 175.550 -1.732 18321 6058 1 5 . 1 1 132 132 TYR CA C 132 54.230 54.230 59.533 -5.303 18321 6059 1 5 . 1 1 132 132 TYR CB C 132 42.672 42.672 39.922 2.750 18321 6060 1 5 . 1 1 132 132 TYR H H 132 7.284 7.284 7.714 -0.430 18321 6061 1 5 . 1 1 133 133 ASP N N 133 118.003 118.003 119.371 -1.368 18321 6062 1 5 . 1 1 133 133 ASP C C 133 175.779 175.779 173.814 1.965 18321 6063 1 5 . 1 1 133 133 ASP CA C 133 54.351 54.351 55.410 -1.059 18321 6064 1 5 . 1 1 133 133 ASP CB C 133 41.241 41.241 40.399 0.842 18321 6065 1 5 . 1 1 133 133 ASP H H 133 8.399 8.399 8.605 -0.206 18321 6066 1 5 . 1 1 134 134 PHE N N 134 121.081 121.081 123.263 -2.182 18321 6067 1 5 . 1 1 134 134 PHE CA C 134 52.552 52.552 54.328 -1.776 18321 6068 1 5 . 1 1 134 134 PHE CB C 134 41.217 41.217 41.770 -0.553 18321 6069 1 5 . 1 1 134 134 PHE H H 134 8.797 8.797 7.167 1.630 18321 6070 1 5 . 1 1 136 136 GLY C C 136 171.616 171.616 174.895 -3.279 18321 6071 1 5 . 1 1 137 137 ASN N N 137 119.394 119.394 115.172 4.222 18321 6072 1 5 . 1 1 137 137 ASN C C 137 174.500 174.500 173.936 0.564 18321 6073 1 5 . 1 1 137 137 ASN CA C 137 44.670 44.670 54.001 -9.331 18321 6074 1 5 . 1 1 137 137 ASN H H 137 9.477 9.477 8.433 1.044 18321 6075 1 5 . 1 1 138 138 ASP N N 138 120.608 120.608 118.864 1.744 18321 6076 1 5 . 1 1 138 138 ASP C C 138 176.987 176.987 175.440 1.547 18321 6077 1 5 . 1 1 138 138 ASP CA C 138 52.992 52.992 52.810 0.182 18321 6078 1 5 . 1 1 138 138 ASP H H 138 8.216 8.216 8.191 0.025 18321 6079 1 5 . 1 1 139 139 ALA N N 139 124.371 124.371 121.534 2.837 18321 6080 1 5 . 1 1 139 139 ALA C C 139 178.472 178.472 178.240 0.232 18321 6081 1 5 . 1 1 139 139 ALA CA C 139 54.513 54.513 53.553 0.960 18321 6082 1 5 . 1 1 139 139 ALA CB C 139 18.045 18.045 19.358 -1.313 18321 6083 1 5 . 1 1 139 139 ALA H H 139 8.565 8.565 8.625 -0.060 18321 6084 1 5 . 1 1 140 140 GLU N N 140 115.022 115.022 116.565 -1.543 18321 6085 1 5 . 1 1 140 140 GLU C C 140 177.027 177.027 174.993 2.034 18321 6086 1 5 . 1 1 140 140 GLU CA C 140 56.181 56.181 56.522 -0.341 18321 6087 1 5 . 1 1 140 140 GLU CB C 140 28.619 28.619 31.219 -2.600 18321 6088 1 5 . 1 1 140 140 GLU H H 140 8.616 8.616 8.134 0.482 18321 6089 1 5 . 1 1 141 141 ASP N N 141 121.913 121.913 119.561 2.352 18321 6090 1 5 . 1 1 141 141 ASP C C 141 175.923 175.923 174.819 1.104 18321 6091 1 5 . 1 1 141 141 ASP CA C 141 54.736 54.736 53.775 0.961 18321 6092 1 5 . 1 1 141 141 ASP CB C 141 41.305 41.305 43.022 -1.717 18321 6093 1 5 . 1 1 141 141 ASP H H 141 7.636 7.636 7.871 -0.235 18321 6094 1 5 . 1 1 142 142 LEU N N 142 127.651 127.651 125.962 1.689 18321 6095 1 5 . 1 1 142 142 LEU CA C 142 50.955 50.955 52.755 -1.800 18321 6096 1 5 . 1 1 142 142 LEU CB C 142 42.343 42.343 44.068 -1.725 18321 6097 1 5 . 1 1 142 142 LEU H H 142 9.479 9.479 8.392 1.087 18321 6098 1 5 . 1 1 143 143 PRO C C 143 177.924 177.924 175.911 2.013 18321 6099 1 5 . 1 1 144 144 PHE N N 144 114.483 114.483 121.546 -7.063 18321 6100 1 5 . 1 1 144 144 PHE C C 144 175.055 175.055 175.071 -0.016 18321 6101 1 5 . 1 1 144 144 PHE CA C 144 55.543 55.543 55.967 -0.424 18321 6102 1 5 . 1 1 144 144 PHE CB C 144 40.581 40.581 40.905 -0.324 18321 6103 1 5 . 1 1 144 144 PHE H H 144 8.637 8.637 7.282 1.355 18321 6104 1 5 . 1 1 145 145 LYS N N 145 121.342 121.342 117.611 3.731 18321 6105 1 5 . 1 1 145 145 LYS C C 145 176.925 176.925 177.766 -0.841 18321 6106 1 5 . 1 1 145 145 LYS CA C 145 53.043 53.043 53.916 -0.873 18321 6107 1 5 . 1 1 145 145 LYS CB C 145 33.804 33.804 36.371 -2.567 18321 6108 1 5 . 1 1 145 145 LYS H H 145 9.418 9.418 8.593 0.825 18321 6109 1 5 . 1 1 146 146 LYS N N 146 123.378 123.378 120.253 3.125 18321 6110 1 5 . 1 1 146 146 LYS CA C 146 57.883 57.883 56.714 1.169 18321 6111 1 5 . 1 1 146 146 LYS CB C 146 32.008 32.008 31.549 0.459 18321 6112 1 5 . 1 1 146 146 LYS H H 146 9.002 9.002 8.790 0.212 18321 6113 1 5 . 1 1 147 147 GLY C C 147 174.315 174.315 173.070 1.245 18321 6114 1 5 . 1 1 148 148 GLU N N 148 121.392 121.392 120.467 0.925 18321 6115 1 5 . 1 1 148 148 GLU C C 148 174.998 174.998 175.268 -0.270 18321 6116 1 5 . 1 1 148 148 GLU CA C 148 56.867 56.867 55.062 1.805 18321 6117 1 5 . 1 1 148 148 GLU CB C 148 31.649 31.649 31.645 0.004 18321 6118 1 5 . 1 1 148 148 GLU H H 148 7.937 7.937 7.639 0.298 18321 6119 1 5 . 1 1 149 149 ILE N N 149 120.124 120.124 122.669 -2.545 18321 6120 1 5 . 1 1 149 149 ILE C C 149 176.647 176.647 175.038 1.609 18321 6121 1 5 . 1 1 149 149 ILE CA C 149 58.621 58.621 60.526 -1.905 18321 6122 1 5 . 1 1 149 149 ILE CB C 149 36.952 36.952 37.983 -1.031 18321 6123 1 5 . 1 1 149 149 ILE H H 149 8.346 8.346 8.647 -0.301 18321 6124 1 5 . 1 1 150 150 LEU N N 150 126.950 126.950 125.516 1.434 18321 6125 1 5 . 1 1 150 150 LEU CA C 150 51.967 51.967 52.827 -0.860 18321 6126 1 5 . 1 1 150 150 LEU CB C 150 44.182 44.182 45.612 -1.430 18321 6127 1 5 . 1 1 150 150 LEU H H 150 8.988 8.988 9.162 -0.174 18321 6128 1 5 . 1 1 151 151 VAL C C 151 175.670 175.670 175.766 -0.096 18321 6129 1 5 . 1 1 152 152 ILE N N 152 124.997 124.997 129.191 -4.194 18321 6130 1 5 . 1 1 152 152 ILE CA C 152 58.331 58.331 60.725 -2.394 18321 6131 1 5 . 1 1 152 152 ILE CB C 152 34.093 34.093 35.093 -1.000 18321 6132 1 5 . 1 1 152 152 ILE H H 152 8.673 8.673 8.180 0.493 18321 6133 1 5 . 1 1 153 153 ILE N N 153 124.710 124.710 127.997 -3.287 18321 6134 1 5 . 1 1 153 153 ILE C C 153 176.264 176.264 175.239 1.025 18321 6135 1 5 . 1 1 154 154 GLU N N 154 117.398 117.398 118.605 -1.207 18321 6136 1 5 . 1 1 154 154 GLU C C 154 173.959 173.959 174.242 -0.283 18321 6137 1 5 . 1 1 154 154 GLU CA C 154 55.289 55.289 55.384 -0.095 18321 6138 1 5 . 1 1 154 154 GLU CB C 154 32.842 32.842 32.401 0.441 18321 6139 1 5 . 1 1 154 154 GLU H H 154 7.818 7.818 8.155 -0.337 18321 6140 1 5 . 1 1 155 155 LYS N N 155 121.130 121.130 123.819 -2.689 18321 6141 1 5 . 1 1 155 155 LYS CA C 155 53.022 53.022 52.891 0.132 18321 6142 1 5 . 1 1 155 155 LYS CB C 155 32.663 32.663 33.055 -0.392 18321 6143 1 5 . 1 1 155 155 LYS H H 155 8.654 8.654 9.459 -0.805 18321 6144 1 5 . 1 1 157 157 GLU C C 157 175.190 175.190 176.184 -0.994 18321 6145 1 5 . 1 1 157 157 GLU CA C 157 53.785 53.785 54.215 -0.430 18321 6146 1 5 . 1 1 157 157 GLU CB C 157 32.685 32.685 31.705 0.980 18321 6147 1 5 . 1 1 158 158 GLU N N 158 117.425 117.425 119.313 -1.888 18321 6148 1 5 . 1 1 158 158 GLU C C 158 178.600 178.600 176.407 2.193 18321 6149 1 5 . 1 1 158 158 GLU CA C 158 59.044 59.044 57.118 1.926 18321 6150 1 5 . 1 1 158 158 GLU CB C 158 29.706 29.706 29.992 -0.286 18321 6151 1 5 . 1 1 158 158 GLU H H 158 8.678 8.678 8.869 -0.191 18321 6152 1 5 . 1 1 159 159 GLN N N 159 110.925 110.925 115.700 -4.775 18321 6153 1 5 . 1 1 159 159 GLN C C 159 175.539 175.539 175.047 0.492 18321 6154 1 5 . 1 1 159 159 GLN CA C 159 54.942 54.942 56.593 -1.651 18321 6155 1 5 . 1 1 159 159 GLN CB C 159 28.572 28.572 29.898 -1.326 18321 6156 1 5 . 1 1 159 159 GLN H H 159 8.483 8.483 8.230 0.253 18321 6157 1 5 . 1 1 160 160 TRP N N 160 120.171 120.171 119.759 0.412 18321 6158 1 5 . 1 1 160 160 TRP C C 160 173.444 173.444 174.787 -1.343 18321 6159 1 5 . 1 1 160 160 TRP CA C 160 56.175 56.175 56.601 -0.426 18321 6160 1 5 . 1 1 160 160 TRP CB C 160 31.796 31.796 32.831 -1.035 18321 6161 1 5 . 1 1 160 160 TRP H H 160 6.826 6.826 7.802 -0.976 18321 6162 1 5 . 1 1 161 161 TRP N N 161 120.687 120.687 121.025 -0.338 18321 6163 1 5 . 1 1 161 161 TRP C C 161 174.736 174.736 175.600 -0.864 18321 6164 1 5 . 1 1 161 161 TRP CA C 161 51.889 51.889 54.931 -3.042 18321 6165 1 5 . 1 1 161 161 TRP CB C 161 32.772 32.772 31.976 0.796 18321 6166 1 5 . 1 1 161 161 TRP H H 161 8.462 8.462 9.488 -1.026 18321 6167 1 5 . 1 1 162 162 SER N N 162 115.691 115.691 119.706 -4.015 18321 6168 1 5 . 1 1 162 162 SER C C 162 174.320 174.320 173.418 0.902 18321 6169 1 5 . 1 1 162 162 SER CA C 162 57.011 57.011 58.351 -1.340 18321 6170 1 5 . 1 1 162 162 SER CB C 162 63.948 63.948 63.657 0.291 18321 6171 1 5 . 1 1 162 162 SER H H 162 8.830 8.830 9.253 -0.423 18321 6172 1 5 . 1 1 163 163 ALA N N 163 130.630 130.630 128.443 2.187 18321 6173 1 5 . 1 1 163 163 ALA CA C 163 50.029 50.029 49.910 0.119 18321 6174 1 5 . 1 1 163 163 ALA CB C 163 25.500 25.500 22.655 2.845 18321 6175 1 5 . 1 1 163 163 ALA H H 163 9.585 9.585 9.218 0.367 18321 6176 1 5 . 1 1 164 164 ARG N N 164 117.526 117.526 120.295 -2.769 18321 6177 1 5 . 1 1 164 164 ARG C C 164 176.719 176.719 176.755 -0.036 18321 6178 1 5 . 1 1 164 164 ARG CA C 164 52.975 52.975 54.286 -1.312 18321 6179 1 5 . 1 1 164 164 ARG CB C 164 34.260 34.260 30.556 3.704 18321 6180 1 5 . 1 1 164 164 ARG H H 164 9.097 9.097 8.939 0.158 18321 6181 1 5 . 1 1 165 165 ASN N N 165 123.935 123.935 122.825 1.110 18321 6182 1 5 . 1 1 165 165 ASN C C 165 178.484 178.484 175.945 2.539 18321 6183 1 5 . 1 1 165 165 ASN CA C 165 50.332 50.332 54.196 -3.864 18321 6184 1 5 . 1 1 165 165 ASN CB C 165 39.487 39.487 39.746 -0.259 18321 6185 1 5 . 1 1 165 165 ASN H H 165 8.756 8.756 8.922 -0.166 18321 6186 1 5 . 1 1 166 166 LYS N N 166 118.464 118.464 119.819 -1.355 18321 6187 1 5 . 1 1 166 166 LYS C C 166 176.967 176.967 177.880 -0.913 18321 6188 1 5 . 1 1 166 166 LYS CA C 166 58.430 58.430 58.360 0.070 18321 6189 1 5 . 1 1 166 166 LYS CB C 166 30.918 30.918 32.434 -1.516 18321 6190 1 5 . 1 1 166 166 LYS H H 166 8.915 8.915 9.192 -0.277 18321 6191 1 5 . 1 1 167 167 ASP N N 167 118.138 118.138 116.851 1.287 18321 6192 1 5 . 1 1 167 167 ASP C C 167 176.464 176.464 176.825 -0.361 18321 6193 1 5 . 1 1 167 167 ASP CA C 167 54.212 54.212 55.173 -0.961 18321 6194 1 5 . 1 1 167 167 ASP CB C 167 41.178 41.178 41.137 0.041 18321 6195 1 5 . 1 1 167 167 ASP H H 167 7.508 7.508 8.316 -0.808 18321 6196 1 5 . 1 1 168 168 GLY N N 168 107.901 107.901 107.348 0.553 18321 6197 1 5 . 1 1 168 168 GLY C C 168 173.613 173.613 173.411 0.202 18321 6198 1 5 . 1 1 168 168 GLY CA C 168 44.783 44.783 45.077 -0.294 18321 6199 1 5 . 1 1 168 168 GLY H H 168 8.173 8.173 8.084 0.089 18321 6200 1 5 . 1 1 169 169 ARG N N 169 124.324 124.324 119.484 4.840 18321 6201 1 5 . 1 1 169 169 ARG CA C 169 56.106 56.106 55.281 0.826 18321 6202 1 5 . 1 1 169 169 ARG CB C 169 29.648 29.648 32.029 -2.381 18321 6203 1 5 . 1 1 169 169 ARG H H 169 7.998 7.998 8.041 -0.043 18321 6204 1 5 . 1 1 170 170 VAL C C 170 177.590 177.590 175.094 2.496 18321 6205 1 5 . 1 1 171 171 GLY N N 171 112.582 112.582 113.846 -1.264 18321 6206 1 5 . 1 1 171 171 GLY C C 171 170.991 170.991 172.186 -1.195 18321 6207 1 5 . 1 1 171 171 GLY CA C 171 45.361 45.361 44.637 0.724 18321 6208 1 5 . 1 1 171 171 GLY H H 171 9.013 9.013 8.610 0.403 18321 6209 1 5 . 1 1 172 172 MET N N 172 117.368 117.368 120.403 -3.035 18321 6210 1 5 . 1 1 172 172 MET C C 172 177.921 177.921 176.570 1.351 18321 6211 1 5 . 1 1 172 172 MET CA C 172 53.536 53.536 54.711 -1.175 18321 6212 1 5 . 1 1 172 172 MET CB C 172 30.838 30.838 33.155 -2.317 18321 6213 1 5 . 1 1 172 172 MET H H 172 8.885 8.885 8.534 0.351 18321 6214 1 5 . 1 1 173 173 ILE N N 173 113.130 113.130 117.990 -4.860 18321 6215 1 5 . 1 1 173 173 ILE CA C 173 56.284 56.284 57.996 -1.712 18321 6216 1 5 . 1 1 173 173 ILE CB C 173 40.870 40.870 40.756 0.114 18321 6217 1 5 . 1 1 173 173 ILE H H 173 9.704 9.704 9.377 0.327 18321 6218 1 5 . 1 1 174 174 PRO C C 174 176.714 176.714 177.473 -0.759 18321 6219 1 5 . 1 1 174 174 PRO CA C 174 66.290 66.290 61.376 4.914 18321 6220 1 5 . 1 1 174 174 PRO CB C 174 28.993 28.993 30.501 -1.508 18321 6221 1 5 . 1 1 175 175 VAL N N 175 128.066 128.066 125.051 3.015 18321 6222 1 5 . 1 1 175 175 VAL CA C 175 59.356 59.356 67.389 -8.033 18321 6223 1 5 . 1 1 175 175 VAL H H 175 7.327 7.327 8.170 -0.843 18321 6224 1 5 . 1 1 176 176 PRO C C 176 176.351 176.351 176.829 -0.478 18321 6225 1 5 . 1 1 177 177 TYR N N 177 115.756 115.756 114.832 0.924 18321 6226 1 5 . 1 1 177 177 TYR C C 177 175.011 175.011 175.545 -0.534 18321 6227 1 5 . 1 1 177 177 TYR CA C 177 56.756 56.756 56.843 -0.087 18321 6228 1 5 . 1 1 177 177 TYR CB C 177 37.507 37.507 38.806 -1.299 18321 6229 1 5 . 1 1 177 177 TYR H H 177 7.784 7.784 7.542 0.242 18321 6230 1 5 . 1 1 178 178 VAL N N 178 111.428 111.428 115.857 -4.429 18321 6231 1 5 . 1 1 178 178 VAL C C 178 173.417 173.417 175.830 -2.413 18321 6232 1 5 . 1 1 178 178 VAL CA C 178 58.307 58.307 59.386 -1.079 18321 6233 1 5 . 1 1 178 178 VAL CB C 178 34.602 34.602 34.162 0.440 18321 6234 1 5 . 1 1 178 178 VAL H H 178 7.801 7.801 7.496 0.305 18321 6235 1 5 . 1 1 179 179 GLU N N 179 118.581 118.581 120.348 -1.767 18321 6236 1 5 . 1 1 179 179 GLU C C 179 175.225 175.225 175.408 -0.183 18321 6237 1 5 . 1 1 179 179 GLU CA C 179 53.114 53.114 56.370 -3.256 18321 6238 1 5 . 1 1 179 179 GLU CB C 179 32.712 32.712 30.403 2.309 18321 6239 1 5 . 1 1 179 179 GLU H H 179 8.819 8.819 8.466 0.353 18321 6240 1 5 . 1 1 180 180 LYS N N 180 124.167 124.167 120.815 3.352 18321 6241 1 5 . 1 1 180 180 LYS C C 180 176.303 176.303 176.852 -0.549 18321 6242 1 5 . 1 1 180 180 LYS CA C 180 57.318 57.318 55.989 1.329 18321 6243 1 5 . 1 1 180 180 LYS CB C 180 31.675 31.675 32.386 -0.711 18321 6244 1 5 . 1 1 180 180 LYS H H 180 8.775 8.775 8.084 0.691 18321 6245 1 5 . 1 1 181 181 LEU N N 181 125.157 125.157 125.170 -0.013 18321 6246 1 5 . 1 1 181 181 LEU C C 181 176.462 176.462 178.631 -2.169 18321 6247 1 5 . 1 1 181 181 LEU CA C 181 54.470 54.470 55.366 -0.896 18321 6248 1 5 . 1 1 181 181 LEU CB C 181 41.625 41.625 42.945 -1.320 18321 6249 1 5 . 1 1 181 181 LEU H H 181 8.084 8.084 8.146 -0.062 18321 6250 1 5 . 1 1 182 182 VAL N N 182 123.167 123.167 121.928 1.239 18321 6251 1 5 . 1 1 182 182 VAL C C 182 175.983 175.983 175.370 0.613 18321 6252 1 5 . 1 1 182 182 VAL CA C 182 61.613 61.613 64.255 -2.642 18321 6253 1 5 . 1 1 182 182 VAL CB C 182 32.085 32.085 31.801 0.284 18321 6254 1 5 . 1 1 182 182 VAL H H 182 8.345 8.345 8.651 -0.306 18321 6255 1 5 . 1 1 183 183 ARG N N 183 125.775 125.775 120.145 5.630 18321 6256 1 5 . 1 1 183 183 ARG CA C 183 57.801 57.801 55.921 1.880 18321 6257 1 5 . 1 1 183 183 ARG CB C 183 30.091 30.091 29.951 0.140 18321 6258 1 5 . 1 1 183 183 ARG H H 183 8.530 8.530 8.106 0.424 18321 6259 1 5 . 1 1 184 184 SER C C 184 173.239 173.239 173.746 -0.507 18321 6260 1 5 . 1 1 185 185 SER N N 185 116.511 116.511 118.435 -1.924 18321 6261 1 5 . 1 1 185 185 SER CA C 185 58.428 58.428 57.530 0.898 18321 6262 1 5 . 1 1 185 185 SER CB C 185 69.737 69.737 62.958 6.779 18321 6263 1 5 . 1 1 185 185 SER H H 185 7.944 7.944 7.849 0.095 18321 6264 1 5 . 1 1 190 190 HIS C C 190 176.953 176.953 175.273 1.680 18321 6265 1 5 . 1 1 190 190 HIS CA C 190 54.229 54.229 55.977 -1.748 18321 6266 1 5 . 1 1 190 190 HIS CB C 190 35.112 35.112 31.929 3.183 18321 6267 1 5 . 1 1 191 191 GLY N N 191 109.491 109.491 110.200 -0.709 18321 6268 1 5 . 1 1 191 191 GLY C C 191 172.295 172.295 173.105 -0.810 18321 6269 1 5 . 1 1 191 191 GLY CA C 191 45.227 45.227 44.887 0.340 18321 6270 1 5 . 1 1 191 191 GLY H H 191 8.719 8.719 8.723 -0.004 18321 6271 1 5 . 1 1 192 192 ASN N N 192 118.700 118.700 118.369 0.331 18321 6272 1 5 . 1 1 192 192 ASN HA H 192 4.312 4.312 4.981 -0.669 18321 6273 1 5 . 1 1 192 192 ASN C C 192 176.369 176.369 174.502 1.867 18321 6274 1 5 . 1 1 192 192 ASN CA C 192 57.787 57.787 52.499 5.288 18321 6275 1 5 . 1 1 192 192 ASN H H 192 7.508 7.508 8.043 -0.535 18321 6276 1 5 . 1 1 193 193 ARG N N 193 120.743 120.743 122.231 -1.488 18321 6277 1 5 . 1 1 193 193 ARG H H 193 9.032 9.032 8.536 0.496 18321 6278 1 5 . 1 1 197 197 SER HA H 197 4.388 4.388 3.924 0.464 18321 6279 1 5 . 1 1 197 197 SER C C 197 174.133 174.133 173.240 0.893 18321 6280 1 5 . 1 1 197 197 SER CA C 197 58.128 58.128 59.199 -1.071 18321 6281 1 5 . 1 1 197 197 SER CB C 197 62.966 62.966 63.501 -0.535 18321 6282 1 5 . 1 1 198 198 TYR N N 198 121.435 121.435 119.450 1.985 18321 6283 1 5 . 1 1 198 198 TYR HA H 198 4.543 4.543 4.647 -0.104 18321 6284 1 5 . 1 1 198 198 TYR C C 198 176.230 176.230 176.826 -0.596 18321 6285 1 5 . 1 1 198 198 TYR CA C 198 57.536 57.536 58.150 -0.614 18321 6286 1 5 . 1 1 198 198 TYR CB C 198 38.279 38.279 39.342 -1.063 18321 6287 1 5 . 1 1 198 198 TYR H H 198 8.071 8.071 8.231 -0.160 18321 6288 1 5 . 1 1 199 199 GLY N N 199 110.039 110.039 111.503 -1.464 18321 6289 1 5 . 1 1 199 199 GLY C C 199 173.475 173.475 172.918 0.557 18321 6290 1 5 . 1 1 199 199 GLY CA C 199 44.805 44.805 45.258 -0.453 18321 6291 1 5 . 1 1 199 199 GLY H H 199 8.162 8.162 8.580 -0.418 18321 6292 1 5 . 1 1 200 200 ILE N N 200 121.530 121.530 120.527 1.003 18321 6293 1 5 . 1 1 200 200 ILE CA C 200 58.102 58.102 60.435 -2.333 18321 6294 1 5 . 1 1 200 200 ILE CB C 200 37.760 37.760 38.062 -0.302 18321 6295 1 5 . 1 1 200 200 ILE H H 200 7.851 7.851 8.438 -0.587 18321 6296 1 5 . 1 1 201 201 PRO C C 201 176.485 176.485 175.810 0.675 18321 6297 1 5 . 1 1 201 201 PRO CA C 201 53.893 53.893 62.823 -8.930 18321 6298 1 5 . 1 1 201 201 PRO CB C 201 29.042 29.042 31.987 -2.945 18321 6299 1 5 . 1 1 202 202 GLU N N 202 122.468 122.468 123.744 -1.276 18321 6300 1 5 . 1 1 202 202 GLU CA C 202 62.490 62.490 53.676 8.814 18321 6301 1 5 . 1 1 202 202 GLU CB C 202 31.170 31.170 31.317 -0.147 18321 6302 1 5 . 1 1 202 202 GLU H H 202 8.328 8.328 8.323 0.005 18321 6303 1 5 . 1 1 203 203 PRO CA C 203 62.803 62.803 62.897 -0.094 18321 6304 1 5 . 1 1 203 203 PRO CB C 203 31.220 31.220 31.894 -0.674 18321 6305 1 5 . 1 1 204 204 ALA N N 204 123.251 123.251 123.085 0.166 18321 6306 1 5 . 1 1 204 204 ALA HA H 204 4.180 4.180 4.364 -0.184 18321 6307 1 5 . 1 1 204 204 ALA CA C 204 52.124 52.124 52.457 -0.333 18321 6308 1 5 . 1 1 204 204 ALA CB C 204 18.892 18.892 19.249 -0.357 18321 6309 1 5 . 1 1 204 204 ALA H H 204 8.308 8.308 7.685 0.623 18321 6310 1 5 . 1 1 205 205 HIS N N 205 117.874 117.874 123.025 -5.151 18321 6311 1 5 . 1 1 205 205 HIS C C 205 173.282 173.282 175.025 -1.743 18321 6312 1 5 . 1 1 205 205 HIS H H 205 8.045 8.045 8.735 -0.690 18321 6313 1 5 . 1 1 206 206 ALA N N 206 125.519 125.519 128.821 -3.302 18321 6314 1 5 . 1 1 206 206 ALA HA H 206 4.204 4.204 4.324 -0.120 18321 6315 1 5 . 1 1 206 206 ALA CA C 206 40.196 40.196 52.637 -12.441 18321 6316 1 5 . 1 1 206 206 ALA CB C 206 19.407 19.407 19.170 0.237 18321 6317 1 5 . 1 1 206 206 ALA H H 206 8.061 8.061 8.694 -0.633 18321 6318 1 5 . 1 1 207 207 TYR N N 207 120.381 120.381 113.387 6.994 18321 6319 1 5 . 1 1 207 207 TYR HA H 207 4.570 4.570 4.025 0.545 18321 6320 1 5 . 1 1 207 207 TYR CA C 207 52.572 52.572 59.591 -7.019 18321 6321 1 5 . 1 1 207 207 TYR CB C 207 41.333 41.333 36.950 4.383 18321 6322 1 5 . 1 1 207 207 TYR H H 207 8.199 8.199 8.455 -0.256 18321 6323 1 5 . 1 1 208 208 ALA HA H 208 4.281 4.281 4.584 -0.303 18321 6324 1 5 . 1 1 208 208 ALA C C 208 177.736 177.736 176.731 1.005 18321 6325 1 5 . 1 1 208 208 ALA CA C 208 52.084 52.084 52.088 -0.004 18321 6326 1 5 . 1 1 208 208 ALA CB C 208 18.999 18.999 18.796 0.203 18321 6327 1 5 . 1 1 209 209 GLN N N 209 119.295 119.295 125.205 -5.910 18321 6328 1 5 . 1 1 209 209 GLN CA C 209 61.474 61.474 53.042 8.432 18321 6329 1 5 . 1 1 209 209 GLN CB C 209 32.039 32.039 28.804 3.235 18321 6330 1 5 . 1 1 209 209 GLN H H 209 8.125 8.125 8.200 -0.075 18321 6331 1 5 . 1 1 210 210 PRO HA H 210 4.395 4.395 4.450 -0.055 18321 6332 1 5 . 1 1 210 210 PRO CA C 210 62.584 62.584 63.396 -0.812 18321 6333 1 5 . 1 1 211 211 GLN HA H 211 4.377 4.377 4.522 -0.145 18321 6334 1 5 . 1 1 211 211 GLN CA C 211 55.859 55.859 54.763 1.096 18321 6335 1 5 . 1 1 211 211 GLN CB C 211 29.577 29.577 31.109 -1.532 18321 6336 1 5 . 1 1 212 212 THR C C 212 176.551 176.551 174.525 2.026 18321 6337 1 5 . 1 1 212 212 THR CB C 212 69.890 69.890 69.979 -0.089 18321 6338 1 5 . 1 1 213 213 THR N N 213 108.487 108.487 120.091 -11.604 18321 6339 1 5 . 1 1 213 213 THR CA C 213 61.236 61.236 63.268 -2.032 18321 6340 1 5 . 1 1 213 213 THR CB C 213 69.091 69.091 69.377 -0.286 18321 6341 1 5 . 1 1 213 213 THR H H 213 8.243 8.243 8.338 -0.095 18321 6342 1 5 . 1 1 214 214 THR N N 214 119.445 119.445 124.078 -4.633 18321 6343 1 5 . 1 1 214 214 THR CA C 214 59.425 59.425 60.321 -0.896 18321 6344 1 5 . 1 1 214 214 THR CB C 214 69.251 69.251 69.056 0.195 18321 6345 1 5 . 1 1 214 214 THR H H 214 8.188 8.188 8.309 -0.121 18321 6346 1 5 . 1 1 215 215 PRO HA H 215 4.361 4.361 4.507 -0.146 18321 6347 1 5 . 1 1 215 215 PRO C C 215 175.422 175.422 176.560 -1.138 18321 6348 1 5 . 1 1 215 215 PRO CA C 215 63.320 63.320 62.674 0.646 18321 6349 1 5 . 1 1 215 215 PRO CB C 215 31.918 31.918 32.374 -0.456 18321 6350 1 5 . 1 1 216 216 LEU N N 216 121.602 121.602 125.340 -3.738 18321 6351 1 5 . 1 1 216 216 LEU CA C 216 52.203 52.203 56.568 -4.365 18321 6352 1 5 . 1 1 216 216 LEU CB C 216 42.451 42.451 39.954 2.497 18321 6353 1 5 . 1 1 216 216 LEU H H 216 7.891 7.891 8.440 -0.549 18321 6354 1 5 . 1 1 217 217 PRO HA H 217 4.398 4.398 4.419 -0.021 18321 6355 1 5 . 1 1 217 217 PRO C C 217 176.577 176.577 175.428 1.149 18321 6356 1 5 . 1 1 217 217 PRO CA C 217 62.984 62.984 62.326 0.658 18321 6357 1 5 . 1 1 217 217 PRO CB C 217 32.056 32.056 32.136 -0.080 18321 6358 1 5 . 1 1 218 218 ALA N N 218 124.087 124.087 126.039 -1.952 18321 6359 1 5 . 1 1 218 218 ALA HA H 218 4.309 4.309 4.134 0.175 18321 6360 1 5 . 1 1 218 218 ALA C C 218 177.844 177.844 177.629 0.215 18321 6361 1 5 . 1 1 218 218 ALA CA C 218 52.379 52.379 51.904 0.475 18321 6362 1 5 . 1 1 218 218 ALA CB C 218 19.133 19.133 19.317 -0.184 18321 6363 1 5 . 1 1 218 218 ALA H H 218 8.261 8.261 8.032 0.229 18321 6364 1 5 . 1 1 219 219 VAL N N 219 118.942 118.942 123.699 -4.757 18321 6365 1 5 . 1 1 219 219 VAL HA H 219 4.142 4.142 3.808 0.334 18321 6366 1 5 . 1 1 219 219 VAL CA C 219 62.102 62.102 63.565 -1.463 18321 6367 1 5 . 1 1 219 219 VAL CB C 219 32.923 32.923 30.022 2.901 18321 6368 1 5 . 1 1 219 219 VAL H H 219 8.049 8.049 8.328 -0.279 18321 6369 1 5 . 1 1 220 220 SER N N 220 119.207 119.207 121.606 -2.399 18321 6370 1 5 . 1 1 220 220 SER HA H 220 4.436 4.436 4.454 -0.018 18321 6371 1 5 . 1 1 220 220 SER CA C 220 57.813 57.813 58.535 -0.722 18321 6372 1 5 . 1 1 220 220 SER CB C 220 63.375 63.375 63.519 -0.144 18321 6373 1 5 . 1 1 220 220 SER H H 220 8.275 8.275 8.395 -0.120 18321 6374 1 5 . 1 1 221 221 GLY N N 221 110.973 110.973 108.937 2.036 18321 6375 1 5 . 1 1 221 221 GLY C C 221 173.962 173.962 172.387 1.575 18321 6376 1 5 . 1 1 221 221 GLY CA C 221 45.286 45.286 44.975 0.311 18321 6377 1 5 . 1 1 221 221 GLY H H 221 8.374 8.374 7.769 0.605 18321 6378 1 5 . 1 1 222 222 SER N N 222 115.516 115.516 115.687 -0.171 18321 6379 1 5 . 1 1 222 222 SER HA H 222 4.763 4.763 4.931 -0.168 18321 6380 1 5 . 1 1 222 222 SER CA C 222 56.407 56.407 56.651 -0.244 18321 6381 1 5 . 1 1 222 222 SER CB C 222 63.993 63.993 64.070 -0.077 18321 6382 1 5 . 1 1 222 222 SER H H 222 8.155 8.155 8.166 -0.011 18321 6383 1 5 . 1 1 223 223 PRO HA H 223 4.417 4.417 4.555 -0.138 18321 6384 1 5 . 1 1 223 223 PRO CA C 223 63.805 63.805 62.882 0.923 18321 6385 1 5 . 1 1 223 223 PRO CB C 223 32.090 32.090 32.444 -0.354 18321 6386 1 5 . 1 1 224 224 GLY N N 224 109.149 109.149 112.678 -3.529 18321 6387 1 5 . 1 1 224 224 GLY C C 224 173.813 173.813 175.049 -1.236 18321 6388 1 5 . 1 1 224 224 GLY CA C 224 44.512 44.512 45.039 -0.527 18321 6389 1 5 . 1 1 224 224 GLY H H 224 8.376 8.376 8.563 -0.187 18321 6390 1 5 . 1 1 225 225 ALA N N 225 123.599 123.599 125.265 -1.666 18321 6391 1 5 . 1 1 225 225 ALA C C 225 177.341 177.341 177.314 0.027 18321 6392 1 5 . 1 1 225 225 ALA CA C 225 51.878 51.878 53.463 -1.585 18321 6393 1 5 . 1 1 225 225 ALA CB C 225 19.169 19.169 18.207 0.962 18321 6394 1 5 . 1 1 225 225 ALA H H 225 7.959 7.959 8.208 -0.249 18321 6395 1 5 . 1 1 226 226 ALA N N 226 123.218 123.218 120.935 2.283 18321 6396 1 5 . 1 1 226 226 ALA HA H 226 4.350 4.350 3.957 0.393 18321 6397 1 5 . 1 1 226 226 ALA C C 226 177.520 177.520 176.636 0.884 18321 6398 1 5 . 1 1 226 226 ALA CA C 226 52.535 52.535 52.395 0.140 18321 6399 1 5 . 1 1 226 226 ALA CB C 226 19.171 19.171 18.576 0.595 18321 6400 1 5 . 1 1 226 226 ALA H H 226 8.169 8.169 8.038 0.131 18321 6401 1 5 . 1 1 227 227 ILE N N 227 120.086 120.086 123.290 -3.204 18321 6402 1 5 . 1 1 227 227 ILE HA H 227 4.201 4.201 4.190 0.011 18321 6403 1 5 . 1 1 227 227 ILE C C 227 174.814 174.814 176.698 -1.884 18321 6404 1 5 . 1 1 227 227 ILE CA C 227 60.929 60.929 60.546 0.383 18321 6405 1 5 . 1 1 227 227 ILE CB C 227 38.872 38.872 36.575 2.297 18321 6406 1 5 . 1 1 227 227 ILE H H 227 8.037 8.037 8.240 -0.203 18321 6407 1 5 . 1 1 228 228 THR N N 228 117.224 117.224 123.976 -6.752 18321 6408 1 5 . 1 1 228 228 THR HA H 228 4.203 4.203 4.376 -0.173 18321 6409 1 5 . 1 1 228 228 THR CA C 228 57.108 57.108 60.921 -3.813 18321 6410 1 5 . 1 1 228 228 THR CB C 228 69.945 69.945 69.865 0.080 18321 6411 1 5 . 1 1 228 228 THR H H 228 7.775 7.775 8.302 -0.527 18321 6412 1 5 . 1 1 229 229 PRO HA H 229 4.750 4.750 4.518 0.232 18321 6413 1 5 . 1 1 229 229 PRO CA C 229 62.480 62.480 63.043 -0.563 18321 6414 1 5 . 1 1 229 229 PRO CB C 229 33.995 33.995 31.443 2.552 18321 6415 1 5 . 1 1 230 230 LEU N N 230 123.629 123.629 127.761 -4.132 18321 6416 1 5 . 1 1 230 230 LEU CA C 230 53.076 53.076 52.760 0.316 18321 6417 1 5 . 1 1 230 230 LEU CB C 230 40.608 40.608 42.124 -1.516 18321 6418 1 5 . 1 1 230 230 LEU H H 230 8.453 8.453 7.916 0.537 18321 6419 1 5 . 1 1 231 231 PRO HA H 231 4.412 4.412 4.255 0.157 18321 6420 1 5 . 1 1 231 231 PRO C C 231 176.571 176.571 176.949 -0.378 18321 6421 1 5 . 1 1 231 231 PRO CA C 231 63.225 63.225 64.842 -1.617 18321 6422 1 5 . 1 1 231 231 PRO CB C 231 31.191 31.191 32.136 -0.945 18321 6423 1 5 . 1 1 232 232 SER N N 232 115.169 115.169 108.849 6.320 18321 6424 1 5 . 1 1 232 232 SER HA H 232 4.450 4.450 4.608 -0.158 18321 6425 1 5 . 1 1 232 232 SER CA C 232 58.604 58.604 58.349 0.255 18321 6426 1 5 . 1 1 232 232 SER CB C 232 63.962 63.962 63.635 0.327 18321 6427 1 5 . 1 1 232 232 SER H H 232 8.280 8.280 7.584 0.696 18321 6428 1 5 . 1 1 233 233 THR N N 233 115.155 115.155 113.760 1.395 18321 6429 1 5 . 1 1 233 233 THR HA H 233 4.351 4.351 4.025 0.326 18321 6430 1 5 . 1 1 233 233 THR C C 233 177.237 177.237 173.700 3.537 18321 6431 1 5 . 1 1 233 233 THR CA C 233 61.939 61.939 62.959 -1.020 18321 6432 1 5 . 1 1 233 233 THR CB C 233 68.986 68.986 67.810 1.176 18321 6433 1 5 . 1 1 233 233 THR H H 233 8.096 8.096 8.037 0.059 18321 6434 1 5 . 1 1 234 234 GLN N N 234 122.040 122.040 120.173 1.867 18321 6435 1 5 . 1 1 234 234 GLN HA H 234 4.681 4.681 4.174 0.507 18321 6436 1 5 . 1 1 234 234 GLN C C 234 176.177 176.177 176.150 0.027 18321 6437 1 5 . 1 1 234 234 GLN CA C 234 55.861 55.861 56.359 -0.498 18321 6438 1 5 . 1 1 234 234 GLN CB C 234 28.583 28.583 28.552 0.031 18321 6439 1 5 . 1 1 234 234 GLN H H 234 8.256 8.256 8.228 0.028 18321 6440 1 5 . 1 1 235 235 ASN N N 235 119.506 119.506 121.514 -2.008 18321 6441 1 5 . 1 1 235 235 ASN HA H 235 4.775 4.775 4.731 0.044 18321 6442 1 5 . 1 1 235 235 ASN C C 235 174.974 174.974 174.795 0.179 18321 6443 1 5 . 1 1 235 235 ASN CA C 235 53.191 53.191 52.732 0.459 18321 6444 1 5 . 1 1 235 235 ASN CB C 235 38.511 38.511 38.833 -0.322 18321 6445 1 5 . 1 1 235 235 ASN H H 235 8.346 8.346 8.103 0.243 18321 6446 1 5 . 1 1 236 236 GLY N N 236 109.378 109.378 107.650 1.728 18321 6447 1 5 . 1 1 236 236 GLY CA C 236 44.023 44.023 44.180 -0.157 18321 6448 1 5 . 1 1 236 236 GLY H H 236 7.939 7.939 7.583 0.356 18321 6449 1 5 . 1 1 237 237 PRO HA H 237 4.336 4.336 4.492 -0.156 18321 6450 1 5 . 1 1 237 237 PRO C C 237 175.942 175.942 175.925 0.017 18321 6451 1 5 . 1 1 237 237 PRO CA C 237 62.797 62.797 62.550 0.247 18321 6452 1 5 . 1 1 237 237 PRO CB C 237 27.421 27.421 32.120 -4.699 18321 6453 1 5 . 1 1 238 238 VAL N N 238 120.535 120.535 123.371 -2.836 18321 6454 1 5 . 1 1 238 238 VAL HA H 238 4.195 4.195 4.319 -0.124 18321 6455 1 5 . 1 1 238 238 VAL C C 238 173.775 173.775 175.101 -1.326 18321 6456 1 5 . 1 1 238 238 VAL CA C 238 61.173 61.173 60.702 0.471 18321 6457 1 5 . 1 1 238 238 VAL CB C 238 38.328 38.328 32.834 5.494 18321 6458 1 5 . 1 1 238 238 VAL H H 238 7.986 7.986 8.607 -0.621 18321 6459 1 5 . 1 1 239 239 PHE N N 239 123.522 123.522 124.062 -0.540 18321 6460 1 5 . 1 1 239 239 PHE HA H 239 5.539 5.539 5.367 0.172 18321 6461 1 5 . 1 1 239 239 PHE C C 239 174.207 174.207 174.650 -0.443 18321 6462 1 5 . 1 1 239 239 PHE CA C 239 56.993 56.993 56.236 0.757 18321 6463 1 5 . 1 1 239 239 PHE CB C 239 41.743 41.743 41.730 0.014 18321 6464 1 5 . 1 1 239 239 PHE H H 239 8.927 8.927 9.120 -0.193 18321 6465 1 5 . 1 1 240 240 ALA N N 240 120.871 120.871 126.392 -5.521 18321 6466 1 5 . 1 1 240 240 ALA HA H 240 5.352 5.352 5.621 -0.269 18321 6467 1 5 . 1 1 240 240 ALA C C 240 174.639 174.639 175.568 -0.929 18321 6468 1 5 . 1 1 240 240 ALA CA C 240 49.736 49.736 50.055 -0.319 18321 6469 1 5 . 1 1 240 240 ALA CB C 240 23.480 23.480 22.841 0.639 18321 6470 1 5 . 1 1 240 240 ALA H H 240 9.398 9.398 9.341 0.057 18321 6471 1 5 . 1 1 241 241 LYS N N 241 121.227 121.227 122.766 -1.539 18321 6472 1 5 . 1 1 241 241 LYS HA H 241 5.373 5.373 5.386 -0.013 18321 6473 1 5 . 1 1 241 241 LYS C C 241 176.772 176.772 176.035 0.737 18321 6474 1 5 . 1 1 241 241 LYS CA C 241 53.128 53.128 54.214 -1.086 18321 6475 1 5 . 1 1 241 241 LYS CB C 241 34.850 34.850 35.456 -0.606 18321 6476 1 5 . 1 1 241 241 LYS H H 241 8.947 8.947 8.934 0.013 18321 6477 1 5 . 1 1 242 242 ALA N N 242 126.833 126.833 131.088 -4.255 18321 6478 1 5 . 1 1 242 242 ALA HA H 242 4.764 4.764 4.509 0.255 18321 6479 1 5 . 1 1 242 242 ALA C C 242 178.506 178.506 177.614 0.892 18321 6480 1 5 . 1 1 242 242 ALA CA C 242 52.788 52.788 52.162 0.626 18321 6481 1 5 . 1 1 242 242 ALA CB C 242 19.084 19.084 18.390 0.694 18321 6482 1 5 . 1 1 242 242 ALA H H 242 9.373 9.373 8.589 0.784 18321 6483 1 5 . 1 1 243 243 ILE N N 243 118.731 118.731 119.036 -0.305 18321 6484 1 5 . 1 1 243 243 ILE HA H 243 4.454 4.454 4.172 0.282 18321 6485 1 5 . 1 1 243 243 ILE C C 243 174.773 174.773 176.188 -1.415 18321 6486 1 5 . 1 1 243 243 ILE CA C 243 60.613 60.613 61.982 -1.369 18321 6487 1 5 . 1 1 243 243 ILE CB C 243 39.232 39.232 38.385 0.847 18321 6488 1 5 . 1 1 243 243 ILE H H 243 8.933 8.933 8.054 0.879 18321 6489 1 5 . 1 1 244 244 GLN N N 244 121.616 121.616 120.290 1.326 18321 6490 1 5 . 1 1 244 244 GLN HA H 244 4.283 4.283 4.444 -0.161 18321 6491 1 5 . 1 1 244 244 GLN C C 244 172.815 172.815 174.803 -1.988 18321 6492 1 5 . 1 1 244 244 GLN CA C 244 54.750 54.750 54.086 0.665 18321 6493 1 5 . 1 1 244 244 GLN CB C 244 31.469 31.469 31.363 0.106 18321 6494 1 5 . 1 1 244 244 GLN H H 244 7.438 7.438 7.855 -0.417 18321 6495 1 5 . 1 1 245 245 LYS N N 245 124.215 124.215 126.510 -2.295 18321 6496 1 5 . 1 1 245 245 LYS HA H 245 3.962 3.962 4.178 -0.216 18321 6497 1 5 . 1 1 245 245 LYS C C 245 175.679 175.679 176.437 -0.758 18321 6498 1 5 . 1 1 245 245 LYS CA C 245 56.413 56.413 57.553 -1.140 18321 6499 1 5 . 1 1 245 245 LYS CB C 245 32.847 32.847 33.090 -0.243 18321 6500 1 5 . 1 1 245 245 LYS H H 245 8.318 8.318 8.652 -0.334 18321 6501 1 5 . 1 1 246 246 ARG N N 246 127.327 127.327 127.367 -0.040 18321 6502 1 5 . 1 1 246 246 ARG HA H 246 4.221 4.221 4.800 -0.579 18321 6503 1 5 . 1 1 246 246 ARG CA C 246 56.279 56.279 54.349 1.930 18321 6504 1 5 . 1 1 246 246 ARG CB C 246 32.987 32.987 31.873 1.114 18321 6505 1 5 . 1 1 246 246 ARG H H 246 9.248 9.248 8.792 0.456 18321 6506 1 5 . 1 1 249 249 CYS HA H 249 4.260 4.260 4.157 0.103 18321 6507 1 5 . 1 1 249 249 CYS CA C 249 55.886 55.886 57.195 -1.309 18321 6508 1 5 . 1 1 249 249 CYS CB C 249 34.146 34.146 28.874 5.272 18321 6509 1 5 . 1 1 250 250 ALA HA H 250 3.926 3.926 4.063 -0.137 18321 6510 1 5 . 1 1 250 250 ALA CA C 250 54.344 54.344 54.188 0.156 18321 6511 1 5 . 1 1 250 250 ALA CB C 250 18.342 18.342 18.503 -0.161 18321 6512 1 5 . 1 1 251 251 TYR N N 251 110.618 110.618 110.363 0.255 18321 6513 1 5 . 1 1 251 251 TYR HA H 251 4.489 4.489 4.765 -0.276 18321 6514 1 5 . 1 1 251 251 TYR C C 251 175.286 175.286 174.416 0.870 18321 6515 1 5 . 1 1 251 251 TYR CA C 251 56.137 56.137 54.998 1.139 18321 6516 1 5 . 1 1 251 251 TYR CB C 251 37.203 37.203 38.198 -0.995 18321 6517 1 5 . 1 1 251 251 TYR H H 251 7.037 7.037 6.994 0.043 18321 6518 1 5 . 1 1 252 252 ASP N N 252 121.835 121.835 122.338 -0.503 18321 6519 1 5 . 1 1 252 252 ASP HA H 252 4.763 4.763 4.886 -0.123 18321 6520 1 5 . 1 1 252 252 ASP CA C 252 52.351 52.351 54.667 -2.316 18321 6521 1 5 . 1 1 252 252 ASP CB C 252 39.995 39.995 41.446 -1.451 18321 6522 1 5 . 1 1 252 252 ASP H H 252 7.339 7.339 7.527 -0.188 18321 6523 1 5 . 1 1 253 253 LYS N N 253 123.177 123.177 123.363 -0.186 18321 6524 1 5 . 1 1 253 253 LYS HA H 253 4.270 4.270 4.436 -0.166 18321 6525 1 5 . 1 1 253 253 LYS C C 253 177.724 177.724 177.498 0.226 18321 6526 1 5 . 1 1 253 253 LYS CA C 253 57.036 57.036 57.299 -0.263 18321 6527 1 5 . 1 1 253 253 LYS H H 253 8.396 8.396 8.578 -0.182 18321 6528 1 5 . 1 1 254 254 THR N N 254 108.317 108.317 111.472 -3.155 18321 6529 1 5 . 1 1 254 254 THR HA H 254 4.517 4.517 4.458 0.059 18321 6530 1 5 . 1 1 254 254 THR C C 254 174.012 174.012 173.574 0.438 18321 6531 1 5 . 1 1 254 254 THR CA C 254 61.036 61.036 60.764 0.272 18321 6532 1 5 . 1 1 254 254 THR CB C 254 69.307 69.307 68.781 0.526 18321 6533 1 5 . 1 1 254 254 THR H H 254 8.217 8.217 8.279 -0.062 18321 6534 1 5 . 1 1 255 255 ALA N N 255 124.762 124.762 124.640 0.122 18321 6535 1 5 . 1 1 255 255 ALA HA H 255 4.524 4.524 5.183 -0.659 18321 6536 1 5 . 1 1 255 255 ALA C C 255 176.630 176.630 175.938 0.692 18321 6537 1 5 . 1 1 255 255 ALA CA C 255 51.352 51.352 50.757 0.595 18321 6538 1 5 . 1 1 255 255 ALA CB C 255 20.135 20.135 20.827 -0.692 18321 6539 1 5 . 1 1 255 255 ALA H H 255 7.096 7.096 7.623 -0.527 18321 6540 1 5 . 1 1 256 256 LEU N N 256 124.379 124.379 122.529 1.850 18321 6541 1 5 . 1 1 256 256 LEU HA H 256 4.328 4.328 4.585 -0.257 18321 6542 1 5 . 1 1 256 256 LEU C C 256 176.007 176.007 175.494 0.513 18321 6543 1 5 . 1 1 256 256 LEU CA C 256 53.502 53.502 53.883 -0.382 18321 6544 1 5 . 1 1 256 256 LEU CB C 256 44.665 44.665 44.416 0.249 18321 6545 1 5 . 1 1 256 256 LEU H H 256 8.889 8.889 8.003 0.886 18321 6546 1 5 . 1 1 257 257 ALA N N 257 129.619 129.619 127.357 2.262 18321 6547 1 5 . 1 1 257 257 ALA HA H 257 4.445 4.445 4.844 -0.399 18321 6548 1 5 . 1 1 257 257 ALA C C 257 176.813 176.813 176.439 0.374 18321 6549 1 5 . 1 1 257 257 ALA CA C 257 51.179 51.179 51.108 0.071 18321 6550 1 5 . 1 1 257 257 ALA CB C 257 18.973 18.973 19.687 -0.714 18321 6551 1 5 . 1 1 257 257 ALA H H 257 8.529 8.529 8.279 0.250 18321 6552 1 5 . 1 1 258 258 LEU N N 258 119.300 119.300 125.189 -5.889 18321 6553 1 5 . 1 1 258 258 LEU HA H 258 4.782 4.782 4.717 0.065 18321 6554 1 5 . 1 1 258 258 LEU CA C 258 53.259 53.259 53.885 -0.626 18321 6555 1 5 . 1 1 258 258 LEU CB C 258 45.972 45.972 45.771 0.201 18321 6556 1 5 . 1 1 258 258 LEU H H 258 8.505 8.505 8.997 -0.492 18321 6557 1 5 . 1 1 259 259 GLU N N 259 123.919 123.919 123.733 0.186 18321 6558 1 5 . 1 1 259 259 GLU HA H 259 4.516 4.516 4.569 -0.053 18321 6559 1 5 . 1 1 259 259 GLU C C 259 175.795 175.795 175.725 0.070 18321 6560 1 5 . 1 1 259 259 GLU CA C 259 52.896 52.896 54.199 -1.303 18321 6561 1 5 . 1 1 259 259 GLU H H 259 8.943 8.943 8.640 0.303 18321 6562 1 5 . 1 1 260 260 VAL N N 260 122.122 122.122 121.523 0.599 18321 6563 1 5 . 1 1 260 260 VAL HA H 260 2.923 2.923 4.237 -1.314 18321 6564 1 5 . 1 1 260 260 VAL C C 260 177.964 177.964 177.104 0.860 18321 6565 1 5 . 1 1 260 260 VAL CA C 260 65.417 65.417 63.680 1.737 18321 6566 1 5 . 1 1 260 260 VAL CB C 260 30.668 30.668 30.778 -0.110 18321 6567 1 5 . 1 1 260 260 VAL H H 260 8.956 8.956 8.568 0.388 18321 6568 1 5 . 1 1 261 261 GLY N N 261 116.009 116.009 116.465 -0.456 18321 6569 1 5 . 1 1 261 261 GLY C C 261 176.288 176.288 173.889 2.399 18321 6570 1 5 . 1 1 261 261 GLY CA C 261 44.210 44.210 44.534 -0.324 18321 6571 1 5 . 1 1 261 261 GLY H H 261 8.799 8.799 8.811 -0.012 18321 6572 1 5 . 1 1 262 262 ASP N N 262 121.945 121.945 120.518 1.427 18321 6573 1 5 . 1 1 262 262 ASP HA H 262 4.423 4.423 4.864 -0.441 18321 6574 1 5 . 1 1 262 262 ASP C C 262 175.381 175.381 174.818 0.563 18321 6575 1 5 . 1 1 262 262 ASP CA C 262 55.243 55.243 53.446 1.797 18321 6576 1 5 . 1 1 262 262 ASP CB C 262 41.819 41.819 43.126 -1.307 18321 6577 1 5 . 1 1 262 262 ASP H H 262 8.180 8.180 7.717 0.463 18321 6578 1 5 . 1 1 263 263 ILE N N 263 121.452 121.452 122.271 -0.819 18321 6579 1 5 . 1 1 263 263 ILE HA H 263 4.707 4.707 4.760 -0.053 18321 6580 1 5 . 1 1 263 263 ILE C C 263 174.996 174.996 176.024 -1.028 18321 6581 1 5 . 1 1 263 263 ILE CA C 263 59.289 59.289 59.272 0.017 18321 6582 1 5 . 1 1 263 263 ILE CB C 263 36.987 36.987 37.826 -0.839 18321 6583 1 5 . 1 1 263 263 ILE H H 263 8.460 8.460 8.548 -0.088 18321 6584 1 5 . 1 1 264 264 VAL N N 264 128.756 128.756 129.655 -0.899 18321 6585 1 5 . 1 1 264 264 VAL HA H 264 4.309 4.309 4.137 0.172 18321 6586 1 5 . 1 1 264 264 VAL C C 264 175.486 175.486 174.775 0.711 18321 6587 1 5 . 1 1 264 264 VAL CA C 264 59.091 59.091 61.191 -2.100 18321 6588 1 5 . 1 1 264 264 VAL CB C 264 34.541 34.541 31.618 2.923 18321 6589 1 5 . 1 1 264 264 VAL H H 264 9.479 9.479 9.355 0.124 18321 6590 1 5 . 1 1 265 265 LYS N N 265 128.101 128.101 128.722 -0.621 18321 6591 1 5 . 1 1 265 265 LYS HA H 265 4.342 4.342 4.360 -0.018 18321 6592 1 5 . 1 1 265 265 LYS C C 265 175.531 175.531 175.201 0.330 18321 6593 1 5 . 1 1 265 265 LYS CA C 265 55.620 55.620 54.870 0.750 18321 6594 1 5 . 1 1 265 265 LYS CB C 265 33.149 33.149 32.079 1.070 18321 6595 1 5 . 1 1 265 265 LYS H H 265 8.715 8.715 8.571 0.144 18321 6596 1 5 . 1 1 266 266 VAL N N 266 129.537 129.537 127.483 2.054 18321 6597 1 5 . 1 1 266 266 VAL HA H 266 4.333 4.333 4.692 -0.359 18321 6598 1 5 . 1 1 266 266 VAL C C 266 176.166 176.166 175.435 0.731 18321 6599 1 5 . 1 1 266 266 VAL CA C 266 63.339 63.339 60.712 2.627 18321 6600 1 5 . 1 1 266 266 VAL CB C 266 30.712 30.712 34.815 -4.103 18321 6601 1 5 . 1 1 266 266 VAL H H 266 9.073 9.073 8.594 0.479 18321 6602 1 5 . 1 1 267 267 THR N N 267 120.020 120.020 122.581 -2.561 18321 6603 1 5 . 1 1 267 267 THR HA H 267 4.189 4.189 4.359 -0.170 18321 6604 1 5 . 1 1 267 267 THR C C 267 176.054 176.054 174.405 1.649 18321 6605 1 5 . 1 1 267 267 THR CA C 267 62.204 62.204 63.559 -1.355 18321 6606 1 5 . 1 1 267 267 THR CB C 267 68.200 68.200 69.783 -1.583 18321 6607 1 5 . 1 1 267 267 THR H H 267 9.130 9.130 8.525 0.605 18321 6608 1 5 . 1 1 268 268 ARG N N 268 120.839 120.839 120.398 0.441 18321 6609 1 5 . 1 1 268 268 ARG HA H 268 4.236 4.236 4.632 -0.396 18321 6610 1 5 . 1 1 268 268 ARG CA C 268 56.321 56.321 54.876 1.445 18321 6611 1 5 . 1 1 268 268 ARG CB C 268 33.049 33.049 33.252 -0.203 18321 6612 1 5 . 1 1 268 268 ARG H H 268 7.631 7.631 7.475 0.156 18321 6613 1 5 . 1 1 269 269 MET N N 269 125.443 125.443 122.032 3.411 18321 6614 1 5 . 1 1 269 269 MET C C 269 174.392 174.392 174.654 -0.262 18321 6615 1 5 . 1 1 269 269 MET H H 269 8.532 8.532 8.523 0.009 18321 6616 1 5 . 1 1 270 270 ASN N N 270 119.125 119.125 121.451 -2.326 18321 6617 1 5 . 1 1 270 270 ASN HA H 270 4.546 4.546 5.188 -0.642 18321 6618 1 5 . 1 1 270 270 ASN C C 270 172.133 172.133 175.103 -2.970 18321 6619 1 5 . 1 1 270 270 ASN CA C 270 53.639 53.639 52.490 1.149 18321 6620 1 5 . 1 1 270 270 ASN CB C 270 39.845 39.845 41.039 -1.194 18321 6621 1 5 . 1 1 270 270 ASN H H 270 6.631 6.631 8.754 -2.123 18321 6622 1 5 . 1 1 271 271 ILE N N 271 122.532 122.532 115.369 7.163 18321 6623 1 5 . 1 1 271 271 ILE HA H 271 4.417 4.417 4.375 0.042 18321 6624 1 5 . 1 1 271 271 ILE CA C 271 63.348 63.348 62.154 1.194 18321 6625 1 5 . 1 1 271 271 ILE CB C 271 38.198 38.198 37.465 0.733 18321 6626 1 5 . 1 1 271 271 ILE H H 271 8.565 8.565 8.352 0.213 18321 6627 1 5 . 1 1 272 272 ASN HA H 272 4.527 4.527 4.678 -0.151 18321 6628 1 5 . 1 1 272 272 ASN C C 272 176.259 176.259 176.442 -0.183 18321 6629 1 5 . 1 1 272 272 ASN CA C 272 53.225 53.225 53.238 -0.013 18321 6630 1 5 . 1 1 272 272 ASN CB C 272 37.565 37.565 38.329 -0.764 18321 6631 1 5 . 1 1 273 273 GLY N N 273 107.043 107.043 107.968 -0.925 18321 6632 1 5 . 1 1 273 273 GLY C C 273 173.216 173.216 172.713 0.503 18321 6633 1 5 . 1 1 273 273 GLY CA C 273 45.299 45.299 44.902 0.397 18321 6634 1 5 . 1 1 273 273 GLY H H 273 8.086 8.086 8.098 -0.012 18321 6635 1 5 . 1 1 274 274 GLN N N 274 120.624 120.624 120.391 0.233 18321 6636 1 5 . 1 1 274 274 GLN HA H 274 4.551 4.551 4.737 -0.186 18321 6637 1 5 . 1 1 274 274 GLN C C 274 175.039 175.039 175.139 -0.100 18321 6638 1 5 . 1 1 274 274 GLN CA C 274 54.556 54.556 54.539 0.017 18321 6639 1 5 . 1 1 274 274 GLN CB C 274 33.698 33.698 31.046 2.652 18321 6640 1 5 . 1 1 274 274 GLN H H 274 8.045 8.045 8.087 -0.042 18321 6641 1 5 . 1 1 275 275 TRP N N 275 125.596 125.596 123.523 2.073 18321 6642 1 5 . 1 1 275 275 TRP HA H 275 4.588 4.588 4.756 -0.168 18321 6643 1 5 . 1 1 275 275 TRP C C 275 172.832 172.832 175.838 -3.006 18321 6644 1 5 . 1 1 275 275 TRP CA C 275 55.296 55.296 54.167 1.129 18321 6645 1 5 . 1 1 275 275 TRP CB C 275 31.393 31.393 30.502 0.891 18321 6646 1 5 . 1 1 275 275 TRP H H 275 8.484 8.484 7.580 0.904 18321 6647 1 5 . 1 1 276 276 GLU N N 276 119.012 119.012 119.063 -0.051 18321 6648 1 5 . 1 1 276 276 GLU HA H 276 5.190 5.190 5.416 -0.226 18321 6649 1 5 . 1 1 276 276 GLU C C 276 176.553 176.553 176.511 0.042 18321 6650 1 5 . 1 1 276 276 GLU CA C 276 54.288 54.288 55.243 -0.955 18321 6651 1 5 . 1 1 276 276 GLU CB C 276 32.851 32.851 30.587 2.264 18321 6652 1 5 . 1 1 276 276 GLU H H 276 8.643 8.643 9.020 -0.377 18321 6653 1 5 . 1 1 277 277 GLY N N 277 111.364 111.364 111.465 -0.101 18321 6654 1 5 . 1 1 277 277 GLY C C 277 170.707 170.707 172.771 -2.064 18321 6655 1 5 . 1 1 277 277 GLY CA C 277 46.723 46.723 43.881 2.842 18321 6656 1 5 . 1 1 277 277 GLY H H 277 9.072 9.072 8.792 0.280 18321 6657 1 5 . 1 1 278 278 GLU N N 278 117.733 117.733 123.868 -6.135 18321 6658 1 5 . 1 1 278 278 GLU HA H 278 5.748 5.748 4.697 1.051 18321 6659 1 5 . 1 1 278 278 GLU C C 278 176.051 176.051 175.359 0.692 18321 6660 1 5 . 1 1 278 278 GLU CA C 278 53.620 53.620 55.487 -1.867 18321 6661 1 5 . 1 1 278 278 GLU CB C 278 33.742 33.742 30.929 2.813 18321 6662 1 5 . 1 1 278 278 GLU H H 278 8.810 8.810 8.190 0.620 18321 6663 1 5 . 1 1 279 279 VAL N N 279 123.834 123.834 124.701 -0.867 18321 6664 1 5 . 1 1 279 279 VAL HA H 279 4.404 4.404 4.331 0.073 18321 6665 1 5 . 1 1 279 279 VAL C C 279 175.289 175.289 175.579 -0.290 18321 6666 1 5 . 1 1 279 279 VAL CA C 279 61.166 61.166 60.894 0.272 18321 6667 1 5 . 1 1 279 279 VAL CB C 279 34.123 34.123 34.688 -0.565 18321 6668 1 5 . 1 1 279 279 VAL H H 279 8.887 8.887 8.922 -0.035 18321 6669 1 5 . 1 1 280 280 ASN N N 280 126.025 126.025 126.741 -0.716 18321 6670 1 5 . 1 1 280 280 ASN HA H 280 4.435 4.435 4.428 0.006 18321 6671 1 5 . 1 1 280 280 ASN C C 280 175.205 175.205 175.516 -0.311 18321 6672 1 5 . 1 1 280 280 ASN CA C 280 45.615 45.615 53.934 -8.319 18321 6673 1 5 . 1 1 280 280 ASN CB C 280 37.386 37.386 37.348 0.038 18321 6674 1 5 . 1 1 280 280 ASN H H 280 9.322 9.322 9.387 -0.065 18321 6675 1 5 . 1 1 281 281 GLY N N 281 104.588 104.588 102.770 1.818 18321 6676 1 5 . 1 1 281 281 GLY C C 281 173.944 173.944 173.649 0.295 18321 6677 1 5 . 1 1 281 281 GLY CA C 281 45.224 45.224 44.993 0.231 18321 6678 1 5 . 1 1 281 281 GLY H H 281 8.768 8.768 8.328 0.440 18321 6679 1 5 . 1 1 282 282 ARG N N 282 122.567 122.567 122.665 -0.098 18321 6680 1 5 . 1 1 282 282 ARG HA H 282 4.559 4.559 4.603 -0.044 18321 6681 1 5 . 1 1 282 282 ARG C C 282 174.350 174.350 174.884 -0.534 18321 6682 1 5 . 1 1 282 282 ARG CA C 282 54.933 54.933 54.791 0.142 18321 6683 1 5 . 1 1 282 282 ARG CB C 282 31.765 31.765 31.679 0.086 18321 6684 1 5 . 1 1 282 282 ARG H H 282 8.149 8.149 8.160 -0.011 18321 6685 1 5 . 1 1 283 283 LYS N N 283 121.565 121.565 125.020 -3.455 18321 6686 1 5 . 1 1 283 283 LYS HA H 283 5.584 5.584 5.504 0.080 18321 6687 1 5 . 1 1 283 283 LYS CA C 283 54.143 54.143 54.922 -0.779 18321 6688 1 5 . 1 1 283 283 LYS CB C 283 36.040 36.040 35.094 0.946 18321 6689 1 5 . 1 1 283 283 LYS H H 283 8.424 8.424 8.621 -0.197 18321 6690 1 5 . 1 1 284 284 GLY C C 284 173.006 173.006 172.225 0.781 18321 6691 1 5 . 1 1 284 284 GLY CA C 284 45.886 45.886 45.414 0.472 18321 6692 1 5 . 1 1 285 285 LEU N N 285 119.673 119.673 121.187 -1.514 18321 6693 1 5 . 1 1 285 285 LEU HA H 285 5.718 5.718 5.653 0.065 18321 6694 1 5 . 1 1 285 285 LEU C C 285 178.657 178.657 176.295 2.362 18321 6695 1 5 . 1 1 285 285 LEU CA C 285 53.656 53.656 54.022 -0.366 18321 6696 1 5 . 1 1 285 285 LEU CB C 285 44.813 44.813 43.390 1.423 18321 6697 1 5 . 1 1 285 285 LEU H H 285 8.734 8.734 8.667 0.067 18321 6698 1 5 . 1 1 286 286 PHE N N 286 118.785 118.785 119.437 -0.652 18321 6699 1 5 . 1 1 286 286 PHE HA H 286 4.521 4.521 5.091 -0.570 18321 6700 1 5 . 1 1 286 286 PHE CA C 286 57.592 57.592 54.287 3.305 18321 6701 1 5 . 1 1 286 286 PHE CB C 286 40.669 40.669 40.520 0.149 18321 6702 1 5 . 1 1 286 286 PHE H H 286 9.120 9.120 8.655 0.465 18321 6703 1 5 . 1 1 287 287 PRO HA H 287 4.385 4.385 4.667 -0.282 18321 6704 1 5 . 1 1 287 287 PRO CA C 287 62.814 62.814 61.848 0.966 18321 6705 1 5 . 1 1 287 287 PRO CB C 287 32.133 32.133 31.851 0.282 18321 6706 1 5 . 1 1 288 288 PHE C C 288 174.837 174.837 176.658 -1.821 18321 6707 1 5 . 1 1 288 288 PHE CA C 288 59.020 59.020 60.490 -1.470 18321 6708 1 5 . 1 1 288 288 PHE CB C 288 34.987 34.987 37.424 -2.437 18321 6709 1 5 . 1 1 289 289 THR N N 289 107.865 107.865 113.965 -6.100 18321 6710 1 5 . 1 1 289 289 THR HA H 289 3.589 3.589 3.758 -0.169 18321 6711 1 5 . 1 1 289 289 THR C C 289 176.125 176.125 175.165 0.960 18321 6712 1 5 . 1 1 289 289 THR CA C 289 62.243 62.243 65.301 -3.058 18321 6713 1 5 . 1 1 289 289 THR CB C 289 69.365 69.365 68.104 1.261 18321 6714 1 5 . 1 1 289 289 THR H H 289 6.453 6.453 7.656 -1.203 18321 6715 1 5 . 1 1 290 290 HIS N N 290 119.462 119.462 116.973 2.489 18321 6716 1 5 . 1 1 290 290 HIS HA H 290 4.196 4.196 4.701 -0.505 18321 6717 1 5 . 1 1 290 290 HIS C C 290 175.165 175.165 173.585 1.580 18321 6718 1 5 . 1 1 290 290 HIS CA C 290 57.635 57.635 56.003 1.632 18321 6719 1 5 . 1 1 290 290 HIS CB C 290 29.840 29.840 31.621 -1.781 18321 6720 1 5 . 1 1 290 290 HIS H H 290 7.835 7.835 7.820 0.015 18321 6721 1 5 . 1 1 291 291 VAL N N 291 110.050 110.050 114.066 -4.016 18321 6722 1 5 . 1 1 291 291 VAL HA H 291 5.445 5.445 4.756 0.689 18321 6723 1 5 . 1 1 291 291 VAL C C 291 173.386 173.386 174.833 -1.447 18321 6724 1 5 . 1 1 291 291 VAL CA C 291 57.794 57.794 59.028 -1.234 18321 6725 1 5 . 1 1 291 291 VAL CB C 291 35.784 35.784 34.566 1.218 18321 6726 1 5 . 1 1 291 291 VAL H H 291 7.562 7.562 7.406 0.156 18321 6727 1 5 . 1 1 292 292 LYS N N 292 119.445 119.445 121.904 -2.459 18321 6728 1 5 . 1 1 292 292 LYS HA H 292 4.857 4.857 4.803 0.054 18321 6729 1 5 . 1 1 292 292 LYS C C 292 176.512 176.512 175.603 0.909 18321 6730 1 5 . 1 1 292 292 LYS CA C 292 54.647 54.647 54.389 0.258 18321 6731 1 5 . 1 1 292 292 LYS CB C 292 35.665 35.665 34.330 1.335 18321 6732 1 5 . 1 1 292 292 LYS H H 292 8.753 8.753 8.399 0.354 18321 6733 1 5 . 1 1 293 293 ILE N N 293 128.707 128.707 128.508 0.199 18321 6734 1 5 . 1 1 293 293 ILE HA H 293 4.509 4.509 4.479 0.030 18321 6735 1 5 . 1 1 293 293 ILE C C 293 175.666 175.666 176.073 -0.407 18321 6736 1 5 . 1 1 293 293 ILE CA C 293 62.563 62.563 62.443 0.120 18321 6737 1 5 . 1 1 293 293 ILE CB C 293 38.076 38.076 39.229 -1.153 18321 6738 1 5 . 1 1 293 293 ILE H H 293 9.107 9.107 9.117 -0.010 18321 6739 1 5 . 1 1 294 294 PHE N N 294 126.638 126.638 124.737 1.901 18321 6740 1 5 . 1 1 294 294 PHE HA H 294 4.898 4.898 4.841 0.057 18321 6741 1 5 . 1 1 294 294 PHE C C 294 175.838 175.838 175.060 0.778 18321 6742 1 5 . 1 1 294 294 PHE CA C 294 56.335 56.335 57.610 -1.275 18321 6743 1 5 . 1 1 294 294 PHE CB C 294 41.196 41.196 40.637 0.559 18321 6744 1 5 . 1 1 294 294 PHE H H 294 8.716 8.716 9.024 -0.308 18321 6745 1 5 . 1 1 295 295 ASP N N 295 122.961 122.961 121.563 1.398 18321 6746 1 5 . 1 1 295 295 ASP HA H 295 5.003 5.003 4.251 0.752 18321 6747 1 5 . 1 1 295 295 ASP CA C 295 50.602 50.602 54.448 -3.846 18321 6748 1 5 . 1 1 295 295 ASP CB C 295 40.754 40.754 40.485 0.269 18321 6749 1 5 . 1 1 295 295 ASP H H 295 8.418 8.418 7.728 0.690 18321 6750 1 5 . 1 1 296 296 PRO HA H 296 4.524 4.524 4.209 0.315 18321 6751 1 5 . 1 1 296 296 PRO C C 296 176.807 176.807 176.035 0.772 18321 6752 1 5 . 1 1 296 296 PRO CA C 296 62.987 62.987 62.597 0.390 18321 6753 1 5 . 1 1 296 296 PRO CB C 296 32.033 32.033 29.872 2.161 18321 6754 1 5 . 1 1 297 297 GLN N N 297 120.729 120.729 115.955 4.774 18321 6755 1 5 . 1 1 297 297 GLN HA H 297 4.274 4.274 3.865 0.409 18321 6756 1 5 . 1 1 297 297 GLN CA C 297 56.427 56.427 56.146 0.281 18321 6757 1 5 . 1 1 297 297 GLN CB C 297 28.819 28.819 26.825 1.994 18321 6758 1 5 . 1 1 297 297 GLN H H 297 8.551 8.551 8.229 0.322 18321 6759 1 5 . 1 1 299 299 PRO C C 299 176.936 176.936 176.249 0.687 18321 6760 1 5 . 1 1 299 299 PRO CA C 299 63.406 63.406 62.877 0.529 18321 6761 1 5 . 1 1 299 299 PRO CB C 299 31.421 31.421 32.072 -0.651 18321 6762 1 5 . 1 1 300 300 ASP N N 300 119.609 119.609 120.811 -1.202 18321 6763 1 5 . 1 1 300 300 ASP C C 300 176.344 176.344 175.876 0.468 18321 6764 1 5 . 1 1 300 300 ASP CA C 300 54.178 54.178 55.550 -1.372 18321 6765 1 5 . 1 1 300 300 ASP CB C 300 40.661 40.661 40.758 -0.097 18321 6766 1 5 . 1 1 300 300 ASP H H 300 8.239 8.239 7.955 0.284 18321 6767 1 5 . 1 1 301 301 GLU N N 301 120.462 120.462 121.579 -1.117 18321 6768 1 5 . 1 1 301 301 GLU CA C 301 56.188 56.188 57.350 -1.162 18321 6769 1 5 . 1 1 301 301 GLU CB C 301 29.507 29.507 26.987 2.520 18321 6770 1 5 . 1 1 301 301 GLU H H 301 8.084 8.084 8.794 -0.710 18321 6771 1 6 . 1 1 2 2 SER HA H 2 4.521 4.521 4.855 -0.334 18321 6772 1 6 . 1 1 2 2 SER CA C 2 58.326 58.326 57.729 0.597 18321 6773 1 6 . 1 1 2 2 SER CB C 2 64.062 64.062 64.859 -0.797 18321 6774 1 6 . 1 1 3 3 SER HA H 3 4.465 4.465 4.293 0.172 18321 6775 1 6 . 1 1 3 3 SER C C 3 173.887 173.887 174.549 -0.662 18321 6776 1 6 . 1 1 3 3 SER CA C 3 58.374 58.374 59.657 -1.284 18321 6777 1 6 . 1 1 3 3 SER CB C 3 63.920 63.920 63.526 0.393 18321 6778 1 6 . 1 1 4 4 ALA N N 4 124.755 124.755 125.088 -0.333 18321 6779 1 6 . 1 1 4 4 ALA HA H 4 4.547 4.547 4.678 -0.131 18321 6780 1 6 . 1 1 4 4 ALA CA C 4 52.737 52.737 51.770 0.967 18321 6781 1 6 . 1 1 4 4 ALA CB C 4 19.636 19.636 18.705 0.931 18321 6782 1 6 . 1 1 4 4 ALA H H 4 8.244 8.244 8.023 0.221 18321 6783 1 6 . 1 1 5 5 ARG N N 5 120.383 120.383 124.641 -4.258 18321 6784 1 6 . 1 1 5 5 ARG HA H 5 4.524 4.524 4.691 -0.167 18321 6785 1 6 . 1 1 5 5 ARG C C 5 175.611 175.611 174.868 0.743 18321 6786 1 6 . 1 1 5 5 ARG CA C 5 56.082 56.082 55.663 0.419 18321 6787 1 6 . 1 1 5 5 ARG CB C 5 30.695 30.695 30.615 0.080 18321 6788 1 6 . 1 1 5 5 ARG H H 5 8.727 8.727 8.550 0.177 18321 6789 1 6 . 1 1 6 6 PHE N N 6 115.159 115.159 120.640 -5.481 18321 6790 1 6 . 1 1 6 6 PHE HA H 6 4.786 4.786 4.785 0.001 18321 6791 1 6 . 1 1 6 6 PHE C C 6 172.076 172.076 173.203 -1.127 18321 6792 1 6 . 1 1 6 6 PHE CA C 6 56.640 56.640 55.755 0.885 18321 6793 1 6 . 1 1 6 6 PHE CB C 6 40.378 40.378 40.785 -0.407 18321 6794 1 6 . 1 1 6 6 PHE H H 6 7.536 7.536 7.878 -0.342 18321 6795 1 6 . 1 1 7 7 ASP N N 7 121.846 121.846 121.401 0.445 18321 6796 1 6 . 1 1 7 7 ASP HA H 7 4.846 4.846 4.779 0.067 18321 6797 1 6 . 1 1 7 7 ASP CA C 7 52.327 52.327 53.702 -1.375 18321 6798 1 6 . 1 1 7 7 ASP CB C 7 41.298 41.298 41.525 -0.227 18321 6799 1 6 . 1 1 7 7 ASP H H 7 9.062 9.062 8.711 0.351 18321 6800 1 6 . 1 1 8 8 SER HA H 8 3.950 3.950 4.334 -0.384 18321 6801 1 6 . 1 1 8 8 SER C C 8 174.705 174.705 175.189 -0.484 18321 6802 1 6 . 1 1 8 8 SER CA C 8 61.937 61.937 60.129 1.808 18321 6803 1 6 . 1 1 8 8 SER CB C 8 62.260 62.260 63.251 -0.991 18321 6804 1 6 . 1 1 9 9 SER N N 9 114.373 114.373 114.807 -0.434 18321 6805 1 6 . 1 1 9 9 SER HA H 9 4.529 4.529 4.795 -0.266 18321 6806 1 6 . 1 1 9 9 SER C C 9 175.089 175.089 173.820 1.269 18321 6807 1 6 . 1 1 9 9 SER CA C 9 59.851 59.851 58.226 1.625 18321 6808 1 6 . 1 1 9 9 SER CB C 9 64.246 64.246 63.941 0.305 18321 6809 1 6 . 1 1 9 9 SER H H 9 8.722 8.722 8.061 0.661 18321 6810 1 6 . 1 1 10 10 ASP N N 10 121.818 121.818 123.765 -1.947 18321 6811 1 6 . 1 1 10 10 ASP HA H 10 4.730 4.730 4.548 0.182 18321 6812 1 6 . 1 1 10 10 ASP C C 10 174.455 174.455 176.988 -2.533 18321 6813 1 6 . 1 1 10 10 ASP CA C 10 52.432 52.432 54.948 -2.516 18321 6814 1 6 . 1 1 10 10 ASP CB C 10 39.607 39.607 41.229 -1.622 18321 6815 1 6 . 1 1 10 10 ASP H H 10 7.600 7.600 8.172 -0.572 18321 6816 1 6 . 1 1 11 11 ARG N N 11 125.238 125.238 126.457 -1.219 18321 6817 1 6 . 1 1 11 11 ARG HA H 11 1.936 1.936 3.021 -1.085 18321 6818 1 6 . 1 1 11 11 ARG C C 11 176.916 176.916 177.292 -0.376 18321 6819 1 6 . 1 1 11 11 ARG CA C 11 57.451 57.451 58.187 -0.736 18321 6820 1 6 . 1 1 11 11 ARG CB C 11 43.014 43.014 29.733 13.281 18321 6821 1 6 . 1 1 11 11 ARG H H 11 7.739 7.739 8.086 -0.347 18321 6822 1 6 . 1 1 12 12 SER N N 12 112.065 112.065 112.114 -0.049 18321 6823 1 6 . 1 1 12 12 SER HA H 12 4.695 4.695 4.263 0.432 18321 6824 1 6 . 1 1 12 12 SER C C 12 175.092 175.092 174.609 0.483 18321 6825 1 6 . 1 1 12 12 SER CA C 12 60.785 60.785 60.156 0.629 18321 6826 1 6 . 1 1 12 12 SER CB C 12 62.889 62.889 62.209 0.680 18321 6827 1 6 . 1 1 12 12 SER H H 12 7.888 7.888 8.218 -0.330 18321 6828 1 6 . 1 1 13 13 ALA N N 13 122.249 122.249 123.842 -1.593 18321 6829 1 6 . 1 1 13 13 ALA HA H 13 4.216 4.216 4.495 -0.279 18321 6830 1 6 . 1 1 13 13 ALA C C 13 178.069 178.069 177.241 0.828 18321 6831 1 6 . 1 1 13 13 ALA CA C 13 53.562 53.562 53.957 -0.395 18321 6832 1 6 . 1 1 13 13 ALA CB C 13 19.339 19.339 19.532 -0.192 18321 6833 1 6 . 1 1 13 13 ALA H H 13 7.418 7.418 7.671 -0.253 18321 6834 1 6 . 1 1 14 14 TRP N N 14 107.433 107.433 111.857 -4.424 18321 6835 1 6 . 1 1 14 14 TRP HA H 14 4.785 4.785 4.651 0.134 18321 6836 1 6 . 1 1 14 14 TRP C C 14 175.286 175.286 175.746 -0.460 18321 6837 1 6 . 1 1 14 14 TRP CA C 14 55.212 55.212 55.082 0.130 18321 6838 1 6 . 1 1 14 14 TRP CB C 14 32.776 32.776 31.110 1.667 18321 6839 1 6 . 1 1 14 14 TRP H H 14 6.273 6.273 6.883 -0.610 18321 6840 1 6 . 1 1 15 15 TYR N N 15 122.315 122.315 124.650 -2.335 18321 6841 1 6 . 1 1 15 15 TYR HA H 15 5.436 5.436 4.640 0.796 18321 6842 1 6 . 1 1 15 15 TYR C C 15 175.325 175.325 174.438 0.887 18321 6843 1 6 . 1 1 15 15 TYR CA C 15 56.609 56.609 58.634 -2.025 18321 6844 1 6 . 1 1 15 15 TYR CB C 15 36.940 36.940 37.323 -0.383 18321 6845 1 6 . 1 1 15 15 TYR H H 15 8.221 8.221 7.591 0.630 18321 6846 1 6 . 1 1 16 16 MET N N 16 126.031 126.031 126.132 -0.101 18321 6847 1 6 . 1 1 16 16 MET HA H 16 4.462 4.462 4.316 0.146 18321 6848 1 6 . 1 1 16 16 MET CA C 16 53.046 53.046 53.380 -0.334 18321 6849 1 6 . 1 1 16 16 MET CB C 16 41.114 41.114 33.078 8.036 18321 6850 1 6 . 1 1 16 16 MET H H 16 8.989 8.989 8.500 0.489 18321 6851 1 6 . 1 1 17 17 GLY CA C 17 45.803 45.803 45.528 0.275 18321 6852 1 6 . 1 1 18 18 PRO HA H 18 4.675 4.675 4.569 0.106 18321 6853 1 6 . 1 1 18 18 PRO C C 18 175.943 175.943 175.429 0.514 18321 6854 1 6 . 1 1 18 18 PRO CA C 18 63.647 63.647 63.739 -0.092 18321 6855 1 6 . 1 1 18 18 PRO CB C 18 29.276 29.276 30.583 -1.307 18321 6856 1 6 . 1 1 19 19 VAL N N 19 126.159 126.159 122.329 3.830 18321 6857 1 6 . 1 1 19 19 VAL HA H 19 4.011 4.011 4.437 -0.426 18321 6858 1 6 . 1 1 19 19 VAL C C 19 175.812 175.812 175.733 0.079 18321 6859 1 6 . 1 1 19 19 VAL CA C 19 62.355 62.355 61.262 1.093 18321 6860 1 6 . 1 1 19 19 VAL CB C 19 33.468 33.468 33.898 -0.430 18321 6861 1 6 . 1 1 19 19 VAL H H 19 7.851 7.851 7.700 0.151 18321 6862 1 6 . 1 1 20 20 SER N N 20 123.950 123.950 110.627 13.323 18321 6863 1 6 . 1 1 20 20 SER HA H 20 4.453 4.453 4.387 0.066 18321 6864 1 6 . 1 1 20 20 SER CA C 20 57.631 57.631 57.802 -0.171 18321 6865 1 6 . 1 1 20 20 SER CB C 20 65.951 65.951 64.289 1.662 18321 6866 1 6 . 1 1 20 20 SER H H 20 8.800 8.800 7.899 0.901 18321 6867 1 6 . 1 1 21 21 ARG N N 21 123.461 123.461 123.439 0.022 18321 6868 1 6 . 1 1 21 21 ARG HA H 21 3.489 3.489 3.971 -0.482 18321 6869 1 6 . 1 1 21 21 ARG C C 21 178.164 178.164 177.797 0.367 18321 6870 1 6 . 1 1 21 21 ARG CA C 21 60.025 60.025 59.418 0.607 18321 6871 1 6 . 1 1 21 21 ARG CB C 21 30.334 30.334 30.038 0.296 18321 6872 1 6 . 1 1 21 21 ARG H H 21 9.307 9.307 8.815 0.492 18321 6873 1 6 . 1 1 22 22 GLN N N 22 116.591 116.591 116.890 -0.299 18321 6874 1 6 . 1 1 22 22 GLN HA H 22 4.008 4.008 4.084 -0.076 18321 6875 1 6 . 1 1 22 22 GLN CA C 22 59.095 59.095 58.716 0.379 18321 6876 1 6 . 1 1 22 22 GLN CB C 22 29.249 29.249 28.364 0.885 18321 6877 1 6 . 1 1 22 22 GLN H H 22 8.394 8.394 8.260 0.134 18321 6878 1 6 . 1 1 23 23 GLU N N 23 122.191 122.191 120.253 1.938 18321 6879 1 6 . 1 1 23 23 GLU HA H 23 4.037 4.037 4.193 -0.156 18321 6880 1 6 . 1 1 23 23 GLU C C 23 178.986 178.986 178.263 0.723 18321 6881 1 6 . 1 1 23 23 GLU CA C 23 59.081 59.081 58.008 1.073 18321 6882 1 6 . 1 1 23 23 GLU CB C 23 31.896 31.896 29.480 2.416 18321 6883 1 6 . 1 1 23 23 GLU H H 23 8.106 8.106 8.240 -0.134 18321 6884 1 6 . 1 1 24 24 ALA N N 24 121.964 121.964 122.045 -0.081 18321 6885 1 6 . 1 1 24 24 ALA HA H 24 3.762 3.762 3.997 -0.235 18321 6886 1 6 . 1 1 24 24 ALA C C 24 178.653 178.653 179.883 -1.230 18321 6887 1 6 . 1 1 24 24 ALA CA C 24 55.480 55.480 55.185 0.295 18321 6888 1 6 . 1 1 24 24 ALA CB C 24 18.049 18.049 18.265 -0.216 18321 6889 1 6 . 1 1 24 24 ALA H H 24 8.732 8.732 8.418 0.314 18321 6890 1 6 . 1 1 25 25 GLN N N 25 116.229 116.229 117.063 -0.834 18321 6891 1 6 . 1 1 25 25 GLN HA H 25 3.950 3.950 4.164 -0.214 18321 6892 1 6 . 1 1 25 25 GLN C C 25 177.442 177.442 178.846 -1.404 18321 6893 1 6 . 1 1 25 25 GLN CA C 25 59.651 59.651 58.660 0.991 18321 6894 1 6 . 1 1 25 25 GLN CB C 25 29.308 29.308 28.404 0.905 18321 6895 1 6 . 1 1 25 25 GLN H H 25 8.391 8.391 8.020 0.371 18321 6896 1 6 . 1 1 26 26 THR N N 26 115.105 115.105 113.935 1.170 18321 6897 1 6 . 1 1 26 26 THR HA H 26 3.920 3.920 4.223 -0.303 18321 6898 1 6 . 1 1 26 26 THR C C 26 176.835 176.835 176.400 0.435 18321 6899 1 6 . 1 1 26 26 THR CA C 26 66.335 66.335 63.927 2.408 18321 6900 1 6 . 1 1 26 26 THR CB C 26 68.876 68.876 68.691 0.185 18321 6901 1 6 . 1 1 26 26 THR H H 26 8.223 8.223 7.603 0.620 18321 6902 1 6 . 1 1 27 27 ARG N N 27 119.096 119.096 118.526 0.570 18321 6903 1 6 . 1 1 27 27 ARG HA H 27 4.047 4.047 4.210 -0.163 18321 6904 1 6 . 1 1 27 27 ARG C C 27 177.245 177.245 176.710 0.535 18321 6905 1 6 . 1 1 27 27 ARG CA C 27 58.528 58.528 58.407 0.121 18321 6906 1 6 . 1 1 27 27 ARG CB C 27 30.184 30.184 30.670 -0.486 18321 6907 1 6 . 1 1 27 27 ARG H H 27 8.093 8.093 7.809 0.284 18321 6908 1 6 . 1 1 28 28 LEU N N 28 114.602 114.602 115.324 -0.722 18321 6909 1 6 . 1 1 28 28 LEU HA H 28 4.325 4.325 4.493 -0.168 18321 6910 1 6 . 1 1 28 28 LEU C C 28 177.197 177.197 176.208 0.989 18321 6911 1 6 . 1 1 28 28 LEU CA C 28 55.143 55.143 53.844 1.299 18321 6912 1 6 . 1 1 28 28 LEU CB C 28 44.902 44.902 42.997 1.905 18321 6913 1 6 . 1 1 28 28 LEU H H 28 7.438 7.438 7.251 0.187 18321 6914 1 6 . 1 1 29 29 GLN N N 29 121.312 121.312 121.106 0.206 18321 6915 1 6 . 1 1 29 29 GLN HA H 29 3.856 3.856 4.279 -0.423 18321 6916 1 6 . 1 1 29 29 GLN C C 29 178.048 178.048 176.492 1.556 18321 6917 1 6 . 1 1 29 29 GLN CA C 29 57.691 57.691 56.116 1.575 18321 6918 1 6 . 1 1 29 29 GLN CB C 29 27.293 27.293 28.031 -0.738 18321 6919 1 6 . 1 1 29 29 GLN H H 29 8.250 8.250 7.446 0.804 18321 6920 1 6 . 1 1 30 30 GLY N N 30 116.768 116.768 115.244 1.524 18321 6921 1 6 . 1 1 30 30 GLY C C 30 174.914 174.914 174.538 0.376 18321 6922 1 6 . 1 1 30 30 GLY CA C 30 45.491 45.491 45.429 0.062 18321 6923 1 6 . 1 1 30 30 GLY H H 30 9.135 9.135 8.568 0.567 18321 6924 1 6 . 1 1 31 31 GLN N N 31 117.979 117.979 118.212 -0.233 18321 6925 1 6 . 1 1 31 31 GLN HA H 31 4.329 4.329 4.507 -0.178 18321 6926 1 6 . 1 1 31 31 GLN C C 31 177.174 177.174 177.257 -0.083 18321 6927 1 6 . 1 1 31 31 GLN CA C 31 53.910 53.910 54.822 -0.912 18321 6928 1 6 . 1 1 31 31 GLN CB C 31 29.574 29.574 29.818 -0.244 18321 6929 1 6 . 1 1 31 31 GLN H H 31 7.695 7.695 7.463 0.232 18321 6930 1 6 . 1 1 32 32 ARG N N 32 123.918 123.918 119.182 4.736 18321 6931 1 6 . 1 1 32 32 ARG HA H 32 3.940 3.940 4.083 -0.143 18321 6932 1 6 . 1 1 32 32 ARG C C 32 175.810 175.810 176.546 -0.736 18321 6933 1 6 . 1 1 32 32 ARG CA C 32 56.770 56.770 56.851 -0.081 18321 6934 1 6 . 1 1 32 32 ARG CB C 32 30.074 30.074 30.484 -0.410 18321 6935 1 6 . 1 1 32 32 ARG H H 32 8.955 8.955 8.548 0.407 18321 6936 1 6 . 1 1 33 33 HIS N N 33 122.248 122.248 121.242 1.006 18321 6937 1 6 . 1 1 33 33 HIS HA H 33 4.627 4.627 4.878 -0.251 18321 6938 1 6 . 1 1 33 33 HIS C C 33 177.089 177.089 176.346 0.743 18321 6939 1 6 . 1 1 33 33 HIS CA C 33 55.858 55.858 55.826 0.032 18321 6940 1 6 . 1 1 33 33 HIS CB C 33 28.648 28.648 30.387 -1.739 18321 6941 1 6 . 1 1 33 33 HIS H H 33 8.302 8.302 8.067 0.235 18321 6942 1 6 . 1 1 34 34 GLY N N 34 109.518 109.518 112.852 -3.334 18321 6943 1 6 . 1 1 34 34 GLY C C 34 176.730 176.730 173.606 3.124 18321 6944 1 6 . 1 1 34 34 GLY CA C 34 45.967 45.967 44.925 1.042 18321 6945 1 6 . 1 1 34 34 GLY H H 34 9.496 9.496 9.155 0.341 18321 6946 1 6 . 1 1 35 35 MET N N 35 125.193 125.193 122.376 2.817 18321 6947 1 6 . 1 1 35 35 MET HA H 35 5.750 5.750 5.846 -0.096 18321 6948 1 6 . 1 1 35 35 MET C C 35 174.388 174.388 175.021 -0.633 18321 6949 1 6 . 1 1 35 35 MET CA C 35 55.762 55.762 56.204 -0.442 18321 6950 1 6 . 1 1 35 35 MET CB C 35 32.706 32.706 34.588 -1.882 18321 6951 1 6 . 1 1 35 35 MET H H 35 8.359 8.359 7.298 1.061 18321 6952 1 6 . 1 1 36 36 PHE N N 36 123.311 123.311 117.241 6.070 18321 6953 1 6 . 1 1 36 36 PHE HA H 36 5.985 5.985 5.767 0.218 18321 6954 1 6 . 1 1 36 36 PHE C C 36 172.140 172.140 172.800 -0.660 18321 6955 1 6 . 1 1 36 36 PHE CA C 36 55.755 55.755 55.580 0.175 18321 6956 1 6 . 1 1 36 36 PHE CB C 36 45.197 45.197 42.664 2.533 18321 6957 1 6 . 1 1 36 36 PHE H H 36 8.261 8.261 7.816 0.445 18321 6958 1 6 . 1 1 37 37 LEU N N 37 114.652 114.652 116.265 -1.613 18321 6959 1 6 . 1 1 37 37 LEU HA H 37 4.489 4.489 5.194 -0.705 18321 6960 1 6 . 1 1 37 37 LEU C C 37 174.033 174.033 174.927 -0.894 18321 6961 1 6 . 1 1 37 37 LEU CA C 37 55.382 55.382 54.611 0.771 18321 6962 1 6 . 1 1 37 37 LEU CB C 37 44.791 44.791 45.780 -0.989 18321 6963 1 6 . 1 1 37 37 LEU H H 37 9.292 9.292 9.311 -0.019 18321 6964 1 6 . 1 1 38 38 VAL N N 38 121.009 121.009 122.511 -1.502 18321 6965 1 6 . 1 1 38 38 VAL HA H 38 5.504 5.504 5.021 0.483 18321 6966 1 6 . 1 1 38 38 VAL C C 38 173.581 173.581 175.514 -1.933 18321 6967 1 6 . 1 1 38 38 VAL CA C 38 61.316 61.316 61.598 -0.282 18321 6968 1 6 . 1 1 38 38 VAL CB C 38 33.302 33.302 32.900 0.402 18321 6969 1 6 . 1 1 38 38 VAL H H 38 8.991 8.991 8.576 0.415 18321 6970 1 6 . 1 1 39 39 ARG N N 39 124.863 124.863 127.310 -2.447 18321 6971 1 6 . 1 1 39 39 ARG HA H 39 5.444 5.444 4.882 0.562 18321 6972 1 6 . 1 1 39 39 ARG C C 39 175.772 175.772 175.132 0.640 18321 6973 1 6 . 1 1 39 39 ARG CA C 39 52.558 52.558 52.270 0.287 18321 6974 1 6 . 1 1 39 39 ARG CB C 39 34.980 34.980 31.639 3.341 18321 6975 1 6 . 1 1 39 39 ARG H H 39 9.569 9.569 8.403 1.166 18321 6976 1 6 . 1 1 40 40 ASP N N 40 122.330 122.330 120.515 1.815 18321 6977 1 6 . 1 1 40 40 ASP HA H 40 4.785 4.785 4.947 -0.162 18321 6978 1 6 . 1 1 40 40 ASP C C 40 176.332 176.332 176.089 0.243 18321 6979 1 6 . 1 1 40 40 ASP CA C 40 55.334 55.334 56.182 -0.848 18321 6980 1 6 . 1 1 40 40 ASP CB C 40 40.650 40.650 41.448 -0.798 18321 6981 1 6 . 1 1 40 40 ASP H H 40 8.413 8.413 8.306 0.107 18321 6982 1 6 . 1 1 41 41 SER N N 41 114.363 114.363 119.739 -5.376 18321 6983 1 6 . 1 1 41 41 SER HA H 41 4.506 4.506 4.401 0.105 18321 6984 1 6 . 1 1 41 41 SER CA C 41 57.525 57.525 59.091 -1.566 18321 6985 1 6 . 1 1 41 41 SER CB C 41 63.706 63.706 63.649 0.057 18321 6986 1 6 . 1 1 41 41 SER H H 41 7.791 7.791 8.192 -0.401 18321 6987 1 6 . 1 1 42 42 SER N N 42 126.932 126.932 121.939 4.993 18321 6988 1 6 . 1 1 42 42 SER HA H 42 4.410 4.410 4.558 -0.148 18321 6989 1 6 . 1 1 42 42 SER CA C 42 60.362 60.362 60.319 0.043 18321 6990 1 6 . 1 1 42 42 SER CB C 42 63.707 63.707 63.232 0.475 18321 6991 1 6 . 1 1 42 42 SER H H 42 10.519 10.519 8.786 1.733 18321 6992 1 6 . 1 1 43 43 THR HA H 43 4.097 4.097 4.481 -0.384 18321 6993 1 6 . 1 1 43 43 THR CA C 43 64.722 64.722 62.109 2.613 18321 6994 1 6 . 1 1 43 43 THR CB C 43 69.439 69.439 70.481 -1.042 18321 6995 1 6 . 1 1 44 44 CYS HA H 44 5.100 5.100 5.308 -0.208 18321 6996 1 6 . 1 1 44 44 CYS CA C 44 51.779 51.779 55.644 -3.865 18321 6997 1 6 . 1 1 44 44 CYS CB C 44 41.314 41.314 29.167 12.147 18321 6998 1 6 . 1 1 45 45 PRO HA H 45 4.278 4.278 4.215 0.063 18321 6999 1 6 . 1 1 45 45 PRO C C 45 178.127 178.127 177.849 0.278 18321 7000 1 6 . 1 1 45 45 PRO CA C 45 64.151 64.151 64.329 -0.177 18321 7001 1 6 . 1 1 45 45 PRO CB C 45 31.596 31.596 31.424 0.172 18321 7002 1 6 . 1 1 46 46 GLY N N 46 114.947 114.947 112.789 2.158 18321 7003 1 6 . 1 1 46 46 GLY C C 46 174.701 174.701 174.047 0.654 18321 7004 1 6 . 1 1 46 46 GLY CA C 46 45.225 45.225 45.076 0.149 18321 7005 1 6 . 1 1 46 46 GLY H H 46 8.812 8.812 8.854 -0.042 18321 7006 1 6 . 1 1 47 47 ASP N N 47 120.862 120.862 121.467 -0.605 18321 7007 1 6 . 1 1 47 47 ASP HA H 47 5.235 5.235 4.778 0.457 18321 7008 1 6 . 1 1 47 47 ASP C C 47 176.480 176.480 175.342 1.138 18321 7009 1 6 . 1 1 47 47 ASP CA C 47 53.591 53.591 53.891 -0.300 18321 7010 1 6 . 1 1 47 47 ASP CB C 47 41.707 41.707 42.157 -0.450 18321 7011 1 6 . 1 1 47 47 ASP H H 47 7.997 7.997 7.649 0.348 18321 7012 1 6 . 1 1 48 48 TYR N N 48 118.473 118.473 116.095 2.378 18321 7013 1 6 . 1 1 48 48 TYR HA H 48 5.431 5.431 5.256 0.175 18321 7014 1 6 . 1 1 48 48 TYR C C 48 173.783 173.783 175.823 -2.040 18321 7015 1 6 . 1 1 48 48 TYR CA C 48 56.891 56.891 56.483 0.408 18321 7016 1 6 . 1 1 48 48 TYR CB C 48 43.274 43.274 43.213 0.061 18321 7017 1 6 . 1 1 48 48 TYR H H 48 8.892 8.892 8.979 -0.087 18321 7018 1 6 . 1 1 49 49 VAL N N 49 119.105 119.105 119.386 -0.281 18321 7019 1 6 . 1 1 49 49 VAL HA H 49 4.800 4.800 4.585 0.215 18321 7020 1 6 . 1 1 49 49 VAL C C 49 174.397 174.397 174.422 -0.025 18321 7021 1 6 . 1 1 49 49 VAL CA C 49 61.439 61.439 61.924 -0.485 18321 7022 1 6 . 1 1 49 49 VAL CB C 49 35.388 35.388 34.544 0.845 18321 7023 1 6 . 1 1 49 49 VAL H H 49 9.661 9.661 8.748 0.913 18321 7024 1 6 . 1 1 50 50 LEU N N 50 129.599 129.599 131.116 -1.517 18321 7025 1 6 . 1 1 50 50 LEU HA H 50 5.033 5.033 5.049 -0.016 18321 7026 1 6 . 1 1 50 50 LEU C C 50 175.001 175.001 175.297 -0.296 18321 7027 1 6 . 1 1 50 50 LEU CA C 50 53.352 53.352 53.924 -0.572 18321 7028 1 6 . 1 1 50 50 LEU CB C 50 44.062 44.062 42.276 1.786 18321 7029 1 6 . 1 1 50 50 LEU H H 50 9.405 9.405 9.222 0.183 18321 7030 1 6 . 1 1 51 51 SER N N 51 126.895 126.895 124.542 2.353 18321 7031 1 6 . 1 1 51 51 SER HA H 51 5.731 5.731 5.258 0.473 18321 7032 1 6 . 1 1 51 51 SER C C 51 173.094 173.094 173.656 -0.562 18321 7033 1 6 . 1 1 51 51 SER CA C 51 58.834 58.834 57.572 1.262 18321 7034 1 6 . 1 1 51 51 SER CB C 51 64.977 64.977 64.122 0.855 18321 7035 1 6 . 1 1 51 51 SER H H 51 9.094 9.094 9.362 -0.268 18321 7036 1 6 . 1 1 52 52 VAL N N 52 121.777 121.777 125.302 -3.525 18321 7037 1 6 . 1 1 52 52 VAL HA H 52 5.066 5.066 4.623 0.443 18321 7038 1 6 . 1 1 52 52 VAL C C 52 174.573 174.573 174.570 0.003 18321 7039 1 6 . 1 1 52 52 VAL CA C 52 59.535 59.535 60.794 -1.259 18321 7040 1 6 . 1 1 52 52 VAL CB C 52 36.834 36.834 35.630 1.204 18321 7041 1 6 . 1 1 52 52 VAL H H 52 8.816 8.816 8.801 0.015 18321 7042 1 6 . 1 1 53 53 SER N N 53 120.489 120.489 122.472 -1.983 18321 7043 1 6 . 1 1 53 53 SER HA H 53 4.811 4.811 4.622 0.189 18321 7044 1 6 . 1 1 53 53 SER C C 53 174.065 174.065 172.777 1.288 18321 7045 1 6 . 1 1 53 53 SER CA C 53 57.496 57.496 57.743 -0.247 18321 7046 1 6 . 1 1 53 53 SER CB C 53 62.623 62.623 63.260 -0.637 18321 7047 1 6 . 1 1 53 53 SER H H 53 8.780 8.780 9.140 -0.360 18321 7048 1 6 . 1 1 54 54 GLU N N 54 132.020 132.020 127.418 4.602 18321 7049 1 6 . 1 1 54 54 GLU HA H 54 4.250 4.250 4.152 0.098 18321 7050 1 6 . 1 1 54 54 GLU C C 54 175.387 175.387 175.508 -0.121 18321 7051 1 6 . 1 1 54 54 GLU CA C 54 56.999 56.999 55.474 1.524 18321 7052 1 6 . 1 1 54 54 GLU CB C 54 32.556 32.556 34.036 -1.480 18321 7053 1 6 . 1 1 54 54 GLU H H 54 8.472 8.472 7.670 0.802 18321 7054 1 6 . 1 1 55 55 ASN N N 55 126.517 126.517 117.854 8.663 18321 7055 1 6 . 1 1 55 55 ASN HA H 55 4.220 4.220 4.451 -0.231 18321 7056 1 6 . 1 1 55 55 ASN C C 55 174.546 174.546 174.641 -0.095 18321 7057 1 6 . 1 1 55 55 ASN CA C 55 54.770 54.770 54.265 0.505 18321 7058 1 6 . 1 1 55 55 ASN CB C 55 37.314 37.314 37.359 -0.045 18321 7059 1 6 . 1 1 55 55 ASN H H 55 8.853 8.853 8.246 0.607 18321 7060 1 6 . 1 1 56 56 SER N N 56 112.009 112.009 110.888 1.121 18321 7061 1 6 . 1 1 56 56 SER HA H 56 4.334 4.334 4.091 0.243 18321 7062 1 6 . 1 1 56 56 SER C C 56 173.354 173.354 172.790 0.564 18321 7063 1 6 . 1 1 56 56 SER CA C 56 59.966 59.966 59.564 0.402 18321 7064 1 6 . 1 1 56 56 SER CB C 56 62.242 62.242 62.218 0.024 18321 7065 1 6 . 1 1 56 56 SER H H 56 10.418 10.418 8.071 2.347 18321 7066 1 6 . 1 1 57 57 ARG N N 57 121.764 121.764 119.006 2.758 18321 7067 1 6 . 1 1 57 57 ARG HA H 57 5.167 5.167 4.382 0.785 18321 7068 1 6 . 1 1 57 57 ARG C C 57 174.983 174.983 173.832 1.151 18321 7069 1 6 . 1 1 57 57 ARG CA C 57 54.550 54.550 55.024 -0.474 18321 7070 1 6 . 1 1 57 57 ARG CB C 57 31.886 31.886 31.387 0.499 18321 7071 1 6 . 1 1 57 57 ARG H H 57 8.097 8.097 8.209 -0.112 18321 7072 1 6 . 1 1 58 58 VAL N N 58 121.866 121.866 122.912 -1.046 18321 7073 1 6 . 1 1 58 58 VAL HA H 58 4.768 4.768 4.256 0.512 18321 7074 1 6 . 1 1 58 58 VAL C C 58 175.388 175.388 175.867 -0.479 18321 7075 1 6 . 1 1 58 58 VAL CA C 58 61.818 61.818 62.503 -0.685 18321 7076 1 6 . 1 1 58 58 VAL CB C 58 34.135 34.135 31.044 3.091 18321 7077 1 6 . 1 1 58 58 VAL H H 58 8.081 8.081 8.070 0.011 18321 7078 1 6 . 1 1 59 59 SER N N 59 124.445 124.445 123.990 0.455 18321 7079 1 6 . 1 1 59 59 SER HA H 59 4.462 4.462 4.157 0.305 18321 7080 1 6 . 1 1 59 59 SER C C 59 172.185 172.185 173.214 -1.029 18321 7081 1 6 . 1 1 59 59 SER CA C 59 56.629 56.629 58.781 -2.152 18321 7082 1 6 . 1 1 59 59 SER CB C 59 66.218 66.218 63.362 2.856 18321 7083 1 6 . 1 1 59 59 SER H H 59 9.082 9.082 8.220 0.862 18321 7084 1 6 . 1 1 60 60 HIS N N 60 121.224 121.224 125.875 -4.651 18321 7085 1 6 . 1 1 60 60 HIS HA H 60 4.885 4.885 4.754 0.131 18321 7086 1 6 . 1 1 60 60 HIS C C 60 174.674 174.674 174.162 0.512 18321 7087 1 6 . 1 1 60 60 HIS CA C 60 54.900 54.900 55.190 -0.290 18321 7088 1 6 . 1 1 60 60 HIS CB C 60 32.331 32.331 29.803 2.528 18321 7089 1 6 . 1 1 60 60 HIS H H 60 8.331 8.331 8.520 -0.189 18321 7090 1 6 . 1 1 61 61 TYR N N 61 124.780 124.780 124.397 0.383 18321 7091 1 6 . 1 1 61 61 TYR HA H 61 4.655 4.655 4.755 -0.100 18321 7092 1 6 . 1 1 61 61 TYR CA C 61 57.409 57.409 56.347 1.062 18321 7093 1 6 . 1 1 61 61 TYR CB C 61 39.785 39.785 38.101 1.684 18321 7094 1 6 . 1 1 61 61 TYR H H 61 9.273 9.273 9.244 0.029 18321 7095 1 6 . 1 1 62 62 ILE HA H 62 4.298 4.298 4.379 -0.081 18321 7096 1 6 . 1 1 62 62 ILE C C 62 174.817 174.817 175.357 -0.540 18321 7097 1 6 . 1 1 62 62 ILE CA C 62 61.908 61.908 61.687 0.221 18321 7098 1 6 . 1 1 62 62 ILE CB C 62 38.321 38.321 38.875 -0.554 18321 7099 1 6 . 1 1 63 63 ILE N N 63 128.552 128.552 128.599 -0.047 18321 7100 1 6 . 1 1 63 63 ILE HA H 63 4.788 4.788 4.710 0.078 18321 7101 1 6 . 1 1 63 63 ILE C C 63 175.982 175.982 175.063 0.919 18321 7102 1 6 . 1 1 63 63 ILE CA C 63 59.629 59.629 59.942 -0.313 18321 7103 1 6 . 1 1 63 63 ILE CB C 63 39.747 39.747 38.623 1.124 18321 7104 1 6 . 1 1 63 63 ILE H H 63 9.155 9.155 8.773 0.382 18321 7105 1 6 . 1 1 64 64 ASN N N 64 123.240 123.240 127.966 -4.726 18321 7106 1 6 . 1 1 64 64 ASN HA H 64 4.857 4.857 5.270 -0.413 18321 7107 1 6 . 1 1 64 64 ASN C C 64 175.324 175.324 174.321 1.003 18321 7108 1 6 . 1 1 64 64 ASN CA C 64 53.736 53.736 53.270 0.466 18321 7109 1 6 . 1 1 64 64 ASN CB C 64 41.531 41.531 40.157 1.374 18321 7110 1 6 . 1 1 64 64 ASN H H 64 9.379 9.379 8.938 0.441 18321 7111 1 6 . 1 1 65 65 SER N N 65 121.157 121.157 118.772 2.385 18321 7112 1 6 . 1 1 65 65 SER HA H 65 4.548 4.548 4.692 -0.144 18321 7113 1 6 . 1 1 65 65 SER C C 65 174.328 174.328 174.765 -0.437 18321 7114 1 6 . 1 1 65 65 SER CA C 65 58.306 58.306 58.229 0.077 18321 7115 1 6 . 1 1 65 65 SER CB C 65 62.878 62.878 62.717 0.161 18321 7116 1 6 . 1 1 65 65 SER H H 65 9.195 9.195 9.237 -0.042 18321 7117 1 6 . 1 1 66 66 LEU N N 66 127.417 127.417 128.756 -1.339 18321 7118 1 6 . 1 1 66 66 LEU HA H 66 4.605 4.605 4.579 0.026 18321 7119 1 6 . 1 1 66 66 LEU CA C 66 52.888 52.888 53.423 -0.535 18321 7120 1 6 . 1 1 66 66 LEU CB C 66 41.799 41.799 41.392 0.407 18321 7121 1 6 . 1 1 66 66 LEU H H 66 8.143 8.143 8.643 -0.500 18321 7122 1 6 . 1 1 68 68 ASN HA H 68 4.386 4.386 4.616 -0.230 18321 7123 1 6 . 1 1 68 68 ASN C C 68 174.487 174.487 175.390 -0.903 18321 7124 1 6 . 1 1 68 68 ASN CA C 68 53.365 53.365 53.449 -0.084 18321 7125 1 6 . 1 1 68 68 ASN CB C 68 36.778 36.778 37.690 -0.912 18321 7126 1 6 . 1 1 69 69 ARG N N 69 111.329 111.329 113.081 -1.752 18321 7127 1 6 . 1 1 69 69 ARG HA H 69 3.876 3.876 3.805 0.071 18321 7128 1 6 . 1 1 69 69 ARG CA C 69 57.393 57.393 57.260 0.133 18321 7129 1 6 . 1 1 69 69 ARG CB C 69 26.665 26.665 27.179 -0.514 18321 7130 1 6 . 1 1 69 69 ARG H H 69 8.191 8.191 7.967 0.224 18321 7131 1 6 . 1 1 70 70 ARG N N 70 116.120 116.120 115.817 0.303 18321 7132 1 6 . 1 1 70 70 ARG HA H 70 4.556 4.556 4.777 -0.221 18321 7133 1 6 . 1 1 70 70 ARG C C 70 174.882 174.882 174.158 0.724 18321 7134 1 6 . 1 1 70 70 ARG CA C 70 55.509 55.509 53.648 1.861 18321 7135 1 6 . 1 1 70 70 ARG CB C 70 31.771 31.771 33.854 -2.083 18321 7136 1 6 . 1 1 70 70 ARG H H 70 6.667 6.667 7.191 -0.524 18321 7137 1 6 . 1 1 71 71 PHE N N 71 116.313 116.313 118.132 -1.819 18321 7138 1 6 . 1 1 71 71 PHE HA H 71 5.540 5.540 5.664 -0.124 18321 7139 1 6 . 1 1 71 71 PHE C C 71 174.391 174.391 175.340 -0.949 18321 7140 1 6 . 1 1 71 71 PHE CA C 71 57.528 57.528 55.930 1.598 18321 7141 1 6 . 1 1 71 71 PHE CB C 71 44.115 44.115 41.742 2.373 18321 7142 1 6 . 1 1 71 71 PHE H H 71 8.700 8.700 8.191 0.509 18321 7143 1 6 . 1 1 72 72 LYS N N 72 122.770 122.770 126.350 -3.580 18321 7144 1 6 . 1 1 72 72 LYS HA H 72 5.483 5.483 4.873 0.610 18321 7145 1 6 . 1 1 72 72 LYS C C 72 173.923 173.923 175.278 -1.355 18321 7146 1 6 . 1 1 72 72 LYS CA C 72 54.855 54.855 55.278 -0.423 18321 7147 1 6 . 1 1 72 72 LYS CB C 72 37.710 37.710 34.971 2.739 18321 7148 1 6 . 1 1 72 72 LYS H H 72 9.138 9.138 8.538 0.600 18321 7149 1 6 . 1 1 73 73 ILE N N 73 124.576 124.576 129.684 -5.108 18321 7150 1 6 . 1 1 73 73 ILE HA H 73 4.955 4.955 4.902 0.053 18321 7151 1 6 . 1 1 73 73 ILE C C 73 175.728 175.728 175.901 -0.173 18321 7152 1 6 . 1 1 73 73 ILE CA C 73 58.935 58.935 60.045 -1.110 18321 7153 1 6 . 1 1 73 73 ILE CB C 73 40.965 40.965 38.574 2.391 18321 7154 1 6 . 1 1 73 73 ILE H H 73 8.826 8.826 8.637 0.189 18321 7155 1 6 . 1 1 74 74 GLY N N 74 118.718 118.718 118.775 -0.057 18321 7156 1 6 . 1 1 74 74 GLY C C 74 174.436 174.436 174.964 -0.528 18321 7157 1 6 . 1 1 74 74 GLY CA C 74 47.401 47.401 45.637 1.764 18321 7158 1 6 . 1 1 74 74 GLY H H 74 9.317 9.317 9.075 0.242 18321 7159 1 6 . 1 1 75 75 ASP N N 75 125.691 125.691 118.537 7.154 18321 7160 1 6 . 1 1 75 75 ASP HA H 75 4.713 4.713 4.167 0.546 18321 7161 1 6 . 1 1 75 75 ASP C C 75 175.841 175.841 175.199 0.642 18321 7162 1 6 . 1 1 75 75 ASP CA C 75 53.815 53.815 56.896 -3.081 18321 7163 1 6 . 1 1 75 75 ASP CB C 75 41.288 41.288 40.284 1.004 18321 7164 1 6 . 1 1 75 75 ASP H H 75 8.665 8.665 8.833 -0.168 18321 7165 1 6 . 1 1 76 76 GLN N N 76 120.368 120.368 121.950 -1.582 18321 7166 1 6 . 1 1 76 76 GLN C C 76 173.630 173.630 174.457 -0.827 18321 7167 1 6 . 1 1 76 76 GLN CA C 76 54.254 54.254 54.972 -0.718 18321 7168 1 6 . 1 1 76 76 GLN CB C 76 31.248 31.248 29.264 1.984 18321 7169 1 6 . 1 1 76 76 GLN H H 76 8.289 8.289 7.835 0.454 18321 7170 1 6 . 1 1 77 77 GLU N N 77 120.435 120.435 124.250 -3.815 18321 7171 1 6 . 1 1 77 77 GLU C C 77 175.484 175.484 175.197 0.287 18321 7172 1 6 . 1 1 77 77 GLU CA C 77 54.203 54.203 55.344 -1.141 18321 7173 1 6 . 1 1 77 77 GLU CB C 77 33.141 33.141 30.626 2.515 18321 7174 1 6 . 1 1 77 77 GLU H H 77 7.732 7.732 8.195 -0.463 18321 7175 1 6 . 1 1 78 78 PHE N N 78 117.911 117.911 122.877 -4.966 18321 7176 1 6 . 1 1 78 78 PHE HA H 78 4.659 4.659 4.647 0.012 18321 7177 1 6 . 1 1 78 78 PHE C C 78 175.673 175.673 175.705 -0.032 18321 7178 1 6 . 1 1 78 78 PHE CA C 78 57.160 57.160 56.836 0.324 18321 7179 1 6 . 1 1 78 78 PHE CB C 78 45.405 45.405 41.400 4.005 18321 7180 1 6 . 1 1 78 78 PHE H H 78 9.235 9.235 8.332 0.903 18321 7181 1 6 . 1 1 79 79 ASP N N 79 119.296 119.296 118.391 0.905 18321 7182 1 6 . 1 1 79 79 ASP HA H 79 4.462 4.462 4.689 -0.227 18321 7183 1 6 . 1 1 79 79 ASP C C 79 174.482 174.482 175.238 -0.756 18321 7184 1 6 . 1 1 79 79 ASP CA C 79 56.629 56.629 56.216 0.413 18321 7185 1 6 . 1 1 79 79 ASP CB C 79 41.697 41.697 41.365 0.332 18321 7186 1 6 . 1 1 79 79 ASP H H 79 9.187 9.187 8.914 0.273 18321 7187 1 6 . 1 1 80 80 HIS N N 80 107.631 107.631 110.083 -2.452 18321 7188 1 6 . 1 1 80 80 HIS HA H 80 5.022 5.022 5.079 -0.057 18321 7189 1 6 . 1 1 80 80 HIS C C 80 174.626 174.626 175.237 -0.611 18321 7190 1 6 . 1 1 80 80 HIS CA C 80 54.223 54.223 54.761 -0.538 18321 7191 1 6 . 1 1 80 80 HIS CB C 80 32.205 32.205 31.356 0.849 18321 7192 1 6 . 1 1 80 80 HIS H H 80 7.200 7.200 7.110 0.090 18321 7193 1 6 . 1 1 81 81 LEU N N 81 120.710 120.710 120.917 -0.207 18321 7194 1 6 . 1 1 81 81 LEU HA H 81 3.804 3.804 4.165 -0.361 18321 7195 1 6 . 1 1 81 81 LEU CA C 81 58.709 58.709 60.151 -1.442 18321 7196 1 6 . 1 1 81 81 LEU CB C 81 39.646 39.646 40.299 -0.653 18321 7197 1 6 . 1 1 81 81 LEU H H 81 8.886 8.886 9.238 -0.352 18321 7198 1 6 . 1 1 82 82 PRO HA H 82 4.020 4.020 4.425 -0.405 18321 7199 1 6 . 1 1 82 82 PRO C C 82 175.619 175.619 176.188 -0.569 18321 7200 1 6 . 1 1 82 82 PRO CA C 82 67.025 67.025 64.347 2.679 18321 7201 1 6 . 1 1 82 82 PRO CB C 82 30.962 30.962 30.880 0.082 18321 7202 1 6 . 1 1 83 83 ALA N N 83 124.281 124.281 118.851 5.430 18321 7203 1 6 . 1 1 83 83 ALA HA H 83 4.019 4.019 4.215 -0.196 18321 7204 1 6 . 1 1 83 83 ALA C C 83 179.709 179.709 178.683 1.026 18321 7205 1 6 . 1 1 83 83 ALA CA C 83 54.985 54.985 53.588 1.397 18321 7206 1 6 . 1 1 83 83 ALA CB C 83 18.425 18.425 18.645 -0.220 18321 7207 1 6 . 1 1 83 83 ALA H H 83 8.527 8.527 7.502 1.025 18321 7208 1 6 . 1 1 84 84 LEU N N 84 122.960 122.960 117.875 5.085 18321 7209 1 6 . 1 1 84 84 LEU HA H 84 1.917 1.917 3.052 -1.135 18321 7210 1 6 . 1 1 84 84 LEU C C 84 177.652 177.652 178.048 -0.396 18321 7211 1 6 . 1 1 84 84 LEU CA C 84 58.261 58.261 57.106 1.155 18321 7212 1 6 . 1 1 84 84 LEU CB C 84 42.544 42.544 41.089 1.455 18321 7213 1 6 . 1 1 84 84 LEU H H 84 6.982 6.982 7.209 -0.227 18321 7214 1 6 . 1 1 85 85 LEU N N 85 117.940 117.940 117.727 0.213 18321 7215 1 6 . 1 1 85 85 LEU HA H 85 3.463 3.463 3.857 -0.394 18321 7216 1 6 . 1 1 85 85 LEU C C 85 178.809 178.809 177.954 0.855 18321 7217 1 6 . 1 1 85 85 LEU CA C 85 57.522 57.522 56.730 0.792 18321 7218 1 6 . 1 1 85 85 LEU CB C 85 41.242 41.242 41.272 -0.030 18321 7219 1 6 . 1 1 85 85 LEU H H 85 7.773 7.773 7.488 0.285 18321 7220 1 6 . 1 1 86 86 GLU N N 86 115.762 115.762 117.751 -1.989 18321 7221 1 6 . 1 1 86 86 GLU HA H 86 3.540 3.540 4.065 -0.525 18321 7222 1 6 . 1 1 86 86 GLU C C 86 180.228 180.228 178.555 1.673 18321 7223 1 6 . 1 1 86 86 GLU CA C 86 58.943 58.943 58.178 0.765 18321 7224 1 6 . 1 1 86 86 GLU CB C 86 29.561 29.561 29.792 -0.231 18321 7225 1 6 . 1 1 86 86 GLU H H 86 8.300 8.300 7.079 1.221 18321 7226 1 6 . 1 1 87 87 PHE N N 87 121.135 121.135 121.680 -0.545 18321 7227 1 6 . 1 1 87 87 PHE HA H 87 4.122 4.122 4.186 -0.064 18321 7228 1 6 . 1 1 87 87 PHE C C 87 179.497 179.497 177.100 2.397 18321 7229 1 6 . 1 1 87 87 PHE CA C 87 62.090 62.090 60.320 1.770 18321 7230 1 6 . 1 1 87 87 PHE CB C 87 40.103 40.103 39.316 0.788 18321 7231 1 6 . 1 1 87 87 PHE H H 87 7.717 7.717 7.413 0.304 18321 7232 1 6 . 1 1 88 88 TYR N N 88 116.579 116.579 116.706 -0.127 18321 7233 1 6 . 1 1 88 88 TYR HA H 88 4.933 4.933 4.290 0.643 18321 7234 1 6 . 1 1 88 88 TYR C C 88 174.799 174.799 176.625 -1.826 18321 7235 1 6 . 1 1 88 88 TYR CA C 88 61.333 61.333 58.693 2.640 18321 7236 1 6 . 1 1 88 88 TYR CB C 88 36.539 36.539 37.187 -0.648 18321 7237 1 6 . 1 1 88 88 TYR H H 88 7.478 7.478 7.692 -0.214 18321 7238 1 6 . 1 1 89 89 LYS N N 89 117.737 117.737 119.758 -2.021 18321 7239 1 6 . 1 1 89 89 LYS HA H 89 4.466 4.466 4.042 0.424 18321 7240 1 6 . 1 1 89 89 LYS C C 89 178.417 178.417 177.036 1.381 18321 7241 1 6 . 1 1 89 89 LYS CA C 89 59.486 59.486 58.430 1.056 18321 7242 1 6 . 1 1 89 89 LYS CB C 89 34.523 34.523 32.442 2.081 18321 7243 1 6 . 1 1 89 89 LYS H H 89 7.505 7.505 7.475 0.030 18321 7244 1 6 . 1 1 90 90 ILE N N 90 110.972 110.972 110.320 0.652 18321 7245 1 6 . 1 1 90 90 ILE HA H 90 4.181 4.181 4.135 0.046 18321 7246 1 6 . 1 1 90 90 ILE C C 90 174.571 174.571 175.693 -1.122 18321 7247 1 6 . 1 1 90 90 ILE CA C 90 60.516 60.516 61.436 -0.920 18321 7248 1 6 . 1 1 90 90 ILE CB C 90 39.979 39.979 38.414 1.565 18321 7249 1 6 . 1 1 90 90 ILE H H 90 6.710 6.710 7.128 -0.418 18321 7250 1 6 . 1 1 91 91 HIS N N 91 119.479 119.479 120.233 -0.754 18321 7251 1 6 . 1 1 91 91 HIS HA H 91 4.357 4.357 4.365 -0.008 18321 7252 1 6 . 1 1 91 91 HIS C C 91 172.751 172.751 174.505 -1.754 18321 7253 1 6 . 1 1 91 91 HIS CA C 91 55.066 55.066 57.313 -2.247 18321 7254 1 6 . 1 1 91 91 HIS CB C 91 29.756 29.756 31.556 -1.800 18321 7255 1 6 . 1 1 91 91 HIS H H 91 7.460 7.460 7.507 -0.047 18321 7256 1 6 . 1 1 92 92 TYR N N 92 117.642 117.642 114.057 3.585 18321 7257 1 6 . 1 1 92 92 TYR HA H 92 4.131 4.131 4.429 -0.298 18321 7258 1 6 . 1 1 92 92 TYR C C 92 177.348 177.348 175.508 1.840 18321 7259 1 6 . 1 1 92 92 TYR CA C 92 58.627 58.627 58.829 -0.202 18321 7260 1 6 . 1 1 92 92 TYR CB C 92 39.481 39.481 36.912 2.569 18321 7261 1 6 . 1 1 92 92 TYR H H 92 8.067 8.067 7.317 0.750 18321 7262 1 6 . 1 1 93 93 LEU N N 93 123.560 123.560 121.976 1.584 18321 7263 1 6 . 1 1 93 93 LEU HA H 93 4.104 4.104 4.364 -0.260 18321 7264 1 6 . 1 1 93 93 LEU C C 93 175.610 175.610 176.737 -1.127 18321 7265 1 6 . 1 1 93 93 LEU CA C 93 56.381 56.381 55.466 0.915 18321 7266 1 6 . 1 1 93 93 LEU CB C 93 38.896 38.896 42.391 -3.495 18321 7267 1 6 . 1 1 93 93 LEU H H 93 7.907 7.907 8.328 -0.421 18321 7268 1 6 . 1 1 94 94 ASP N N 94 118.194 118.194 116.357 1.837 18321 7269 1 6 . 1 1 94 94 ASP HA H 94 4.940 4.940 4.812 0.128 18321 7270 1 6 . 1 1 94 94 ASP C C 94 176.123 176.123 175.633 0.490 18321 7271 1 6 . 1 1 94 94 ASP CA C 94 56.235 56.235 54.284 1.951 18321 7272 1 6 . 1 1 94 94 ASP CB C 94 42.078 42.078 42.191 -0.113 18321 7273 1 6 . 1 1 94 94 ASP H H 94 8.640 8.640 7.573 1.067 18321 7274 1 6 . 1 1 95 95 THR N N 95 105.073 105.073 112.279 -7.206 18321 7275 1 6 . 1 1 95 95 THR HA H 95 4.318 4.318 4.479 -0.161 18321 7276 1 6 . 1 1 95 95 THR C C 95 174.685 174.685 173.439 1.246 18321 7277 1 6 . 1 1 95 95 THR CA C 95 60.756 60.756 61.875 -1.119 18321 7278 1 6 . 1 1 95 95 THR CB C 95 71.058 71.058 69.168 1.890 18321 7279 1 6 . 1 1 95 95 THR H H 95 8.576 8.576 7.986 0.590 18321 7280 1 6 . 1 1 96 96 THR N N 96 116.817 116.817 115.682 1.135 18321 7281 1 6 . 1 1 96 96 THR HA H 96 5.129 5.129 4.792 0.337 18321 7282 1 6 . 1 1 96 96 THR C C 96 172.464 172.464 172.793 -0.329 18321 7283 1 6 . 1 1 96 96 THR CA C 96 60.762 60.762 60.108 0.655 18321 7284 1 6 . 1 1 96 96 THR CB C 96 71.425 71.425 70.766 0.659 18321 7285 1 6 . 1 1 96 96 THR H H 96 8.205 8.205 7.702 0.503 18321 7286 1 6 . 1 1 97 97 THR N N 97 114.324 114.324 113.586 0.738 18321 7287 1 6 . 1 1 97 97 THR HA H 97 5.128 5.128 4.469 0.659 18321 7288 1 6 . 1 1 97 97 THR C C 97 175.480 175.480 174.354 1.126 18321 7289 1 6 . 1 1 97 97 THR CA C 97 60.233 60.233 59.483 0.750 18321 7290 1 6 . 1 1 97 97 THR CB C 97 70.415 70.415 70.766 -0.351 18321 7291 1 6 . 1 1 97 97 THR H H 97 7.128 7.128 8.272 -1.144 18321 7292 1 6 . 1 1 98 98 LEU N N 98 116.674 116.674 122.238 -5.564 18321 7293 1 6 . 1 1 98 98 LEU HA H 98 4.075 4.075 4.025 0.050 18321 7294 1 6 . 1 1 98 98 LEU C C 98 177.892 177.892 176.831 1.061 18321 7295 1 6 . 1 1 98 98 LEU CA C 98 59.597 59.597 55.290 4.307 18321 7296 1 6 . 1 1 98 98 LEU CB C 98 41.172 41.172 40.196 0.977 18321 7297 1 6 . 1 1 98 98 LEU H H 98 8.743 8.743 8.092 0.651 18321 7298 1 6 . 1 1 99 99 ILE N N 99 122.988 122.988 122.953 0.035 18321 7299 1 6 . 1 1 99 99 ILE HA H 99 4.415 4.415 4.062 0.353 18321 7300 1 6 . 1 1 99 99 ILE C C 99 175.055 175.055 175.927 -0.872 18321 7301 1 6 . 1 1 99 99 ILE CA C 99 62.183 62.183 61.892 0.291 18321 7302 1 6 . 1 1 99 99 ILE CB C 99 40.252 40.252 38.740 1.512 18321 7303 1 6 . 1 1 99 99 ILE H H 99 8.998 8.998 8.213 0.785 18321 7304 1 6 . 1 1 100 100 GLU N N 100 114.067 114.067 116.132 -2.065 18321 7305 1 6 . 1 1 100 100 GLU CA C 100 52.910 52.910 53.388 -0.478 18321 7306 1 6 . 1 1 100 100 GLU CB C 100 31.155 31.155 32.675 -1.520 18321 7307 1 6 . 1 1 100 100 GLU H H 100 7.332 7.332 7.978 -0.646 18321 7308 1 6 . 1 1 101 101 PRO HA H 101 4.952 4.952 3.620 1.332 18321 7309 1 6 . 1 1 101 101 PRO C C 101 175.976 175.976 175.823 0.153 18321 7310 1 6 . 1 1 101 101 PRO CA C 101 53.312 53.312 62.273 -8.961 18321 7311 1 6 . 1 1 101 101 PRO CB C 101 31.598 31.598 32.020 -0.422 18321 7312 1 6 . 1 1 102 102 ALA N N 102 125.968 125.968 123.063 2.905 18321 7313 1 6 . 1 1 102 102 ALA HA H 102 4.516 4.516 4.358 0.158 18321 7314 1 6 . 1 1 102 102 ALA CA C 102 49.852 49.852 49.893 -0.041 18321 7315 1 6 . 1 1 102 102 ALA CB C 102 17.766 17.766 18.191 -0.425 18321 7316 1 6 . 1 1 102 102 ALA H H 102 8.232 8.232 7.989 0.243 18321 7317 1 6 . 1 1 103 103 PRO HA H 103 4.283 4.283 4.334 -0.051 18321 7318 1 6 . 1 1 103 103 PRO CA C 103 62.435 62.435 63.154 -0.719 18321 7319 1 6 . 1 1 103 103 PRO CB C 103 32.145 32.145 32.384 -0.239 18321 7320 1 6 . 1 1 104 104 ARG HA H 104 4.004 4.004 4.225 -0.221 18321 7321 1 6 . 1 1 104 104 ARG CA C 104 56.660 56.660 58.248 -1.588 18321 7322 1 6 . 1 1 106 106 PRO C C 106 174.587 174.587 175.578 -0.991 18321 7323 1 6 . 1 1 106 106 PRO CA C 106 57.867 57.867 62.827 -4.960 18321 7324 1 6 . 1 1 106 106 PRO CB C 106 31.942 31.942 30.531 1.411 18321 7325 1 6 . 1 1 107 107 SER N N 107 121.280 121.280 118.845 2.435 18321 7326 1 6 . 1 1 107 107 SER CA C 107 61.772 61.772 59.816 1.956 18321 7327 1 6 . 1 1 107 107 SER CB C 107 63.234 63.234 62.221 1.014 18321 7328 1 6 . 1 1 107 107 SER H H 107 8.132 8.132 8.354 -0.222 18321 7329 1 6 . 1 1 109 109 PRO C C 109 177.129 177.129 175.511 1.618 18321 7330 1 6 . 1 1 109 109 PRO CA C 109 62.638 62.638 63.407 -0.769 18321 7331 1 6 . 1 1 109 109 PRO CB C 109 30.970 30.970 31.147 -0.177 18321 7332 1 6 . 1 1 110 110 MET N N 110 120.772 120.772 122.647 -1.875 18321 7333 1 6 . 1 1 110 110 MET C C 110 176.892 176.892 176.406 0.486 18321 7334 1 6 . 1 1 110 110 MET CA C 110 55.310 55.310 55.095 0.215 18321 7335 1 6 . 1 1 110 110 MET CB C 110 32.202 32.202 35.544 -3.342 18321 7336 1 6 . 1 1 110 110 MET H H 110 8.430 8.430 8.132 0.298 18321 7337 1 6 . 1 1 111 111 GLY N N 111 110.158 110.158 112.236 -2.078 18321 7338 1 6 . 1 1 111 111 GLY C C 111 177.430 177.430 175.037 2.393 18321 7339 1 6 . 1 1 111 111 GLY CA C 111 44.951 44.951 45.543 -0.592 18321 7340 1 6 . 1 1 111 111 GLY H H 111 8.384 8.384 8.699 -0.315 18321 7341 1 6 . 1 1 112 112 SER N N 112 116.762 116.762 119.941 -3.179 18321 7342 1 6 . 1 1 112 112 SER CA C 112 55.948 55.948 57.713 -1.765 18321 7343 1 6 . 1 1 112 112 SER CB C 112 62.745 62.745 62.204 0.541 18321 7344 1 6 . 1 1 112 112 SER H H 112 8.161 8.161 8.303 -0.142 18321 7345 1 6 . 1 1 113 113 VAL C C 113 176.083 176.083 175.999 0.084 18321 7346 1 6 . 1 1 114 114 SER N N 114 119.151 119.151 112.794 6.357 18321 7347 1 6 . 1 1 114 114 SER C C 114 173.638 173.638 173.349 0.289 18321 7348 1 6 . 1 1 114 114 SER CA C 114 58.005 58.005 56.948 1.057 18321 7349 1 6 . 1 1 114 114 SER CB C 114 63.169 63.169 62.737 0.432 18321 7350 1 6 . 1 1 114 114 SER H H 114 8.319 8.319 8.204 0.115 18321 7351 1 6 . 1 1 115 115 ALA N N 115 126.914 126.914 125.794 1.120 18321 7352 1 6 . 1 1 115 115 ALA CA C 115 51.561 51.561 49.398 2.163 18321 7353 1 6 . 1 1 115 115 ALA CB C 115 17.714 17.714 18.979 -1.265 18321 7354 1 6 . 1 1 115 115 ALA H H 115 8.197 8.197 7.306 0.891 18321 7355 1 6 . 1 1 119 119 PRO C C 119 177.065 177.065 176.632 0.433 18321 7356 1 6 . 1 1 120 120 THR N N 120 113.976 113.976 118.862 -4.886 18321 7357 1 6 . 1 1 120 120 THR C C 120 174.461 174.461 173.005 1.456 18321 7358 1 6 . 1 1 120 120 THR CA C 120 61.215 61.215 63.437 -2.222 18321 7359 1 6 . 1 1 120 120 THR CB C 120 69.508 69.508 67.753 1.755 18321 7360 1 6 . 1 1 120 120 THR H H 120 8.138 8.138 8.130 0.008 18321 7361 1 6 . 1 1 121 121 ALA N N 121 125.859 125.859 127.376 -1.517 18321 7362 1 6 . 1 1 121 121 ALA CA C 121 52.281 52.281 51.799 0.482 18321 7363 1 6 . 1 1 121 121 ALA CB C 121 18.623 18.623 21.073 -2.450 18321 7364 1 6 . 1 1 121 121 ALA H H 121 8.272 8.272 7.947 0.325 18321 7365 1 6 . 1 1 122 122 GLU C C 122 176.316 176.316 176.558 -0.242 18321 7366 1 6 . 1 1 123 123 ASP N N 123 120.448 120.448 118.310 2.138 18321 7367 1 6 . 1 1 123 123 ASP C C 123 175.906 175.906 175.768 0.138 18321 7368 1 6 . 1 1 123 123 ASP CA C 123 54.167 54.167 56.631 -2.464 18321 7369 1 6 . 1 1 123 123 ASP CB C 123 40.695 40.695 40.164 0.530 18321 7370 1 6 . 1 1 123 123 ASP H H 123 8.181 8.181 8.737 -0.556 18321 7371 1 6 . 1 1 124 124 ASN N N 124 118.207 118.207 114.876 3.331 18321 7372 1 6 . 1 1 124 124 ASN C C 124 174.851 174.851 173.702 1.149 18321 7373 1 6 . 1 1 124 124 ASN CA C 124 52.771 52.771 53.143 -0.372 18321 7374 1 6 . 1 1 124 124 ASN CB C 124 38.304 38.304 39.292 -0.988 18321 7375 1 6 . 1 1 124 124 ASN H H 124 8.307 8.307 8.194 0.113 18321 7376 1 6 . 1 1 125 125 LEU N N 125 121.311 121.311 121.351 -0.040 18321 7377 1 6 . 1 1 125 125 LEU C C 125 175.750 175.750 175.141 0.609 18321 7378 1 6 . 1 1 125 125 LEU CA C 125 54.428 54.428 55.479 -1.051 18321 7379 1 6 . 1 1 125 125 LEU CB C 125 41.350 41.350 39.262 2.088 18321 7380 1 6 . 1 1 125 125 LEU H H 125 7.747 7.747 8.387 -0.640 18321 7381 1 6 . 1 1 126 126 GLU N N 126 122.485 122.485 119.209 3.276 18321 7382 1 6 . 1 1 126 126 GLU C C 126 174.008 174.008 173.941 0.067 18321 7383 1 6 . 1 1 126 126 GLU CA C 126 54.855 54.855 56.526 -1.671 18321 7384 1 6 . 1 1 126 126 GLU CB C 126 30.472 30.472 31.416 -0.944 18321 7385 1 6 . 1 1 126 126 GLU H H 126 8.453 8.453 8.418 0.035 18321 7386 1 6 . 1 1 127 127 TYR N N 127 122.713 122.713 119.039 3.674 18321 7387 1 6 . 1 1 127 127 TYR C C 127 176.859 176.859 175.140 1.719 18321 7388 1 6 . 1 1 127 127 TYR CA C 127 56.528 56.528 56.816 -0.288 18321 7389 1 6 . 1 1 127 127 TYR CB C 127 40.982 40.982 41.245 -0.263 18321 7390 1 6 . 1 1 127 127 TYR H H 127 8.469 8.469 8.116 0.353 18321 7391 1 6 . 1 1 128 128 VAL N N 128 112.432 112.432 121.876 -9.444 18321 7392 1 6 . 1 1 128 128 VAL C C 128 173.150 173.150 174.356 -1.206 18321 7393 1 6 . 1 1 128 128 VAL CA C 128 57.940 57.940 60.366 -2.426 18321 7394 1 6 . 1 1 128 128 VAL CB C 128 34.935 34.935 36.435 -1.500 18321 7395 1 6 . 1 1 128 128 VAL H H 128 9.078 9.078 9.218 -0.140 18321 7396 1 6 . 1 1 129 129 ARG N N 129 120.373 120.373 120.023 0.350 18321 7397 1 6 . 1 1 129 129 ARG C C 129 176.539 176.539 175.515 1.024 18321 7398 1 6 . 1 1 129 129 ARG CA C 129 52.534 52.534 54.123 -1.589 18321 7399 1 6 . 1 1 129 129 ARG CB C 129 32.942 32.942 34.058 -1.116 18321 7400 1 6 . 1 1 129 129 ARG H H 129 9.010 9.010 8.153 0.857 18321 7401 1 6 . 1 1 130 130 THR N N 130 116.637 116.637 114.708 1.929 18321 7402 1 6 . 1 1 130 130 THR CA C 130 60.618 60.618 60.691 -0.072 18321 7403 1 6 . 1 1 130 130 THR CB C 130 69.170 69.170 70.331 -1.161 18321 7404 1 6 . 1 1 130 130 THR H H 130 9.045 9.045 9.593 -0.548 18321 7405 1 6 . 1 1 131 131 LEU N N 131 122.910 122.910 123.148 -0.238 18321 7406 1 6 . 1 1 131 131 LEU C C 131 175.269 175.269 177.090 -1.821 18321 7407 1 6 . 1 1 131 131 LEU CA C 131 55.122 55.122 55.824 -0.702 18321 7408 1 6 . 1 1 131 131 LEU CB C 131 43.108 43.108 42.628 0.480 18321 7409 1 6 . 1 1 131 131 LEU H H 131 9.224 9.224 8.950 0.274 18321 7410 1 6 . 1 1 132 132 TYR N N 132 112.885 112.885 119.531 -6.646 18321 7411 1 6 . 1 1 132 132 TYR C C 132 173.818 173.818 175.397 -1.579 18321 7412 1 6 . 1 1 132 132 TYR CA C 132 54.230 54.230 58.663 -4.433 18321 7413 1 6 . 1 1 132 132 TYR CB C 132 42.672 42.672 40.928 1.744 18321 7414 1 6 . 1 1 132 132 TYR H H 132 7.284 7.284 7.734 -0.450 18321 7415 1 6 . 1 1 133 133 ASP N N 133 118.003 118.003 119.814 -1.811 18321 7416 1 6 . 1 1 133 133 ASP C C 133 175.779 175.779 174.048 1.731 18321 7417 1 6 . 1 1 133 133 ASP CA C 133 54.351 54.351 55.316 -0.965 18321 7418 1 6 . 1 1 133 133 ASP CB C 133 41.241 41.241 40.360 0.881 18321 7419 1 6 . 1 1 133 133 ASP H H 133 8.399 8.399 8.528 -0.129 18321 7420 1 6 . 1 1 134 134 PHE N N 134 121.081 121.081 123.311 -2.230 18321 7421 1 6 . 1 1 134 134 PHE CA C 134 52.552 52.552 54.322 -1.770 18321 7422 1 6 . 1 1 134 134 PHE CB C 134 41.217 41.217 41.426 -0.209 18321 7423 1 6 . 1 1 134 134 PHE H H 134 8.797 8.797 7.266 1.531 18321 7424 1 6 . 1 1 136 136 GLY C C 136 171.616 171.616 174.401 -2.785 18321 7425 1 6 . 1 1 137 137 ASN N N 137 119.394 119.394 116.756 2.638 18321 7426 1 6 . 1 1 137 137 ASN C C 137 174.500 174.500 173.586 0.914 18321 7427 1 6 . 1 1 137 137 ASN CA C 137 44.670 44.670 54.528 -9.858 18321 7428 1 6 . 1 1 137 137 ASN H H 137 9.477 9.477 8.265 1.212 18321 7429 1 6 . 1 1 138 138 ASP N N 138 120.608 120.608 118.948 1.660 18321 7430 1 6 . 1 1 138 138 ASP C C 138 176.987 176.987 174.826 2.161 18321 7431 1 6 . 1 1 138 138 ASP CA C 138 52.992 52.992 52.741 0.251 18321 7432 1 6 . 1 1 138 138 ASP H H 138 8.216 8.216 7.758 0.458 18321 7433 1 6 . 1 1 139 139 ALA N N 139 124.371 124.371 121.079 3.292 18321 7434 1 6 . 1 1 139 139 ALA C C 139 178.472 178.472 177.266 1.206 18321 7435 1 6 . 1 1 139 139 ALA CA C 139 54.513 54.513 53.260 1.253 18321 7436 1 6 . 1 1 139 139 ALA CB C 139 18.045 18.045 19.216 -1.171 18321 7437 1 6 . 1 1 139 139 ALA H H 139 8.565 8.565 8.549 0.016 18321 7438 1 6 . 1 1 140 140 GLU N N 140 115.022 115.022 116.602 -1.580 18321 7439 1 6 . 1 1 140 140 GLU C C 140 177.027 177.027 175.327 1.700 18321 7440 1 6 . 1 1 140 140 GLU CA C 140 56.181 56.181 56.788 -0.607 18321 7441 1 6 . 1 1 140 140 GLU CB C 140 28.619 28.619 31.733 -3.114 18321 7442 1 6 . 1 1 140 140 GLU H H 140 8.616 8.616 8.458 0.158 18321 7443 1 6 . 1 1 141 141 ASP N N 141 121.913 121.913 120.062 1.851 18321 7444 1 6 . 1 1 141 141 ASP C C 141 175.923 175.923 174.723 1.200 18321 7445 1 6 . 1 1 141 141 ASP CA C 141 54.736 54.736 53.280 1.456 18321 7446 1 6 . 1 1 141 141 ASP CB C 141 41.305 41.305 42.743 -1.438 18321 7447 1 6 . 1 1 141 141 ASP H H 141 7.636 7.636 8.127 -0.491 18321 7448 1 6 . 1 1 142 142 LEU N N 142 127.651 127.651 125.683 1.968 18321 7449 1 6 . 1 1 142 142 LEU CA C 142 50.955 50.955 51.992 -1.037 18321 7450 1 6 . 1 1 142 142 LEU CB C 142 42.343 42.343 44.175 -1.831 18321 7451 1 6 . 1 1 142 142 LEU H H 142 9.479 9.479 8.112 1.367 18321 7452 1 6 . 1 1 143 143 PRO C C 143 177.924 177.924 176.066 1.858 18321 7453 1 6 . 1 1 144 144 PHE N N 144 114.483 114.483 121.750 -7.267 18321 7454 1 6 . 1 1 144 144 PHE C C 144 175.055 175.055 175.068 -0.013 18321 7455 1 6 . 1 1 144 144 PHE CA C 144 55.543 55.543 56.182 -0.639 18321 7456 1 6 . 1 1 144 144 PHE CB C 144 40.581 40.581 40.530 0.051 18321 7457 1 6 . 1 1 144 144 PHE H H 144 8.637 8.637 7.167 1.470 18321 7458 1 6 . 1 1 145 145 LYS N N 145 121.342 121.342 117.165 4.177 18321 7459 1 6 . 1 1 145 145 LYS C C 145 176.925 176.925 177.790 -0.865 18321 7460 1 6 . 1 1 145 145 LYS CA C 145 53.043 53.043 53.654 -0.611 18321 7461 1 6 . 1 1 145 145 LYS CB C 145 33.804 33.804 36.698 -2.894 18321 7462 1 6 . 1 1 145 145 LYS H H 145 9.418 9.418 8.208 1.210 18321 7463 1 6 . 1 1 146 146 LYS N N 146 123.378 123.378 121.725 1.653 18321 7464 1 6 . 1 1 146 146 LYS CA C 146 57.883 57.883 56.412 1.471 18321 7465 1 6 . 1 1 146 146 LYS CB C 146 32.008 32.008 29.918 2.090 18321 7466 1 6 . 1 1 146 146 LYS H H 146 9.002 9.002 8.806 0.196 18321 7467 1 6 . 1 1 147 147 GLY C C 147 174.315 174.315 173.389 0.926 18321 7468 1 6 . 1 1 148 148 GLU N N 148 121.392 121.392 118.648 2.744 18321 7469 1 6 . 1 1 148 148 GLU C C 148 174.998 174.998 175.362 -0.364 18321 7470 1 6 . 1 1 148 148 GLU CA C 148 56.867 56.867 54.188 2.679 18321 7471 1 6 . 1 1 148 148 GLU CB C 148 31.649 31.649 31.011 0.638 18321 7472 1 6 . 1 1 148 148 GLU H H 148 7.937 7.937 7.711 0.226 18321 7473 1 6 . 1 1 149 149 ILE N N 149 120.124 120.124 119.868 0.256 18321 7474 1 6 . 1 1 149 149 ILE C C 149 176.647 176.647 174.527 2.120 18321 7475 1 6 . 1 1 149 149 ILE CA C 149 58.621 58.621 60.280 -1.659 18321 7476 1 6 . 1 1 149 149 ILE CB C 149 36.952 36.952 39.883 -2.932 18321 7477 1 6 . 1 1 149 149 ILE H H 149 8.346 8.346 8.339 0.007 18321 7478 1 6 . 1 1 150 150 LEU N N 150 126.950 126.950 126.054 0.896 18321 7479 1 6 . 1 1 150 150 LEU CA C 150 51.967 51.967 52.966 -0.999 18321 7480 1 6 . 1 1 150 150 LEU CB C 150 44.182 44.182 45.895 -1.712 18321 7481 1 6 . 1 1 150 150 LEU H H 150 8.988 8.988 9.246 -0.258 18321 7482 1 6 . 1 1 151 151 VAL C C 151 175.670 175.670 175.642 0.028 18321 7483 1 6 . 1 1 152 152 ILE N N 152 124.997 124.997 128.844 -3.847 18321 7484 1 6 . 1 1 152 152 ILE CA C 152 58.331 58.331 59.670 -1.339 18321 7485 1 6 . 1 1 152 152 ILE CB C 152 34.093 34.093 34.963 -0.870 18321 7486 1 6 . 1 1 152 152 ILE H H 152 8.673 8.673 8.662 0.011 18321 7487 1 6 . 1 1 153 153 ILE N N 153 124.710 124.710 126.873 -2.163 18321 7488 1 6 . 1 1 153 153 ILE C C 153 176.264 176.264 175.031 1.233 18321 7489 1 6 . 1 1 154 154 GLU N N 154 117.398 117.398 116.943 0.455 18321 7490 1 6 . 1 1 154 154 GLU C C 154 173.959 173.959 174.037 -0.078 18321 7491 1 6 . 1 1 154 154 GLU CA C 154 55.289 55.289 55.134 0.155 18321 7492 1 6 . 1 1 154 154 GLU CB C 154 32.842 32.842 32.844 -0.002 18321 7493 1 6 . 1 1 154 154 GLU H H 154 7.818 7.818 8.270 -0.452 18321 7494 1 6 . 1 1 155 155 LYS N N 155 121.130 121.130 123.530 -2.400 18321 7495 1 6 . 1 1 155 155 LYS CA C 155 53.022 53.022 52.521 0.501 18321 7496 1 6 . 1 1 155 155 LYS CB C 155 32.663 32.663 32.840 -0.177 18321 7497 1 6 . 1 1 155 155 LYS H H 155 8.654 8.654 8.517 0.137 18321 7498 1 6 . 1 1 157 157 GLU C C 157 175.190 175.190 176.152 -0.962 18321 7499 1 6 . 1 1 157 157 GLU CA C 157 53.785 53.785 54.487 -0.702 18321 7500 1 6 . 1 1 157 157 GLU CB C 157 32.685 32.685 30.676 2.009 18321 7501 1 6 . 1 1 158 158 GLU N N 158 117.425 117.425 120.664 -3.239 18321 7502 1 6 . 1 1 158 158 GLU C C 158 178.600 178.600 178.202 0.398 18321 7503 1 6 . 1 1 158 158 GLU CA C 158 59.044 59.044 59.140 -0.096 18321 7504 1 6 . 1 1 158 158 GLU CB C 158 29.706 29.706 30.160 -0.454 18321 7505 1 6 . 1 1 158 158 GLU H H 158 8.678 8.678 8.808 -0.130 18321 7506 1 6 . 1 1 159 159 GLN N N 159 110.925 110.925 117.508 -6.583 18321 7507 1 6 . 1 1 159 159 GLN C C 159 175.539 175.539 174.854 0.685 18321 7508 1 6 . 1 1 159 159 GLN CA C 159 54.942 54.942 56.764 -1.822 18321 7509 1 6 . 1 1 159 159 GLN CB C 159 28.572 28.572 29.181 -0.609 18321 7510 1 6 . 1 1 159 159 GLN H H 159 8.483 8.483 8.579 -0.096 18321 7511 1 6 . 1 1 160 160 TRP N N 160 120.171 120.171 119.332 0.839 18321 7512 1 6 . 1 1 160 160 TRP C C 160 173.444 173.444 175.110 -1.666 18321 7513 1 6 . 1 1 160 160 TRP CA C 160 56.175 56.175 55.908 0.267 18321 7514 1 6 . 1 1 160 160 TRP CB C 160 31.796 31.796 31.869 -0.073 18321 7515 1 6 . 1 1 160 160 TRP H H 160 6.826 6.826 7.577 -0.751 18321 7516 1 6 . 1 1 161 161 TRP N N 161 120.687 120.687 122.822 -2.135 18321 7517 1 6 . 1 1 161 161 TRP C C 161 174.736 174.736 176.108 -1.372 18321 7518 1 6 . 1 1 161 161 TRP CA C 161 51.889 51.889 54.350 -2.461 18321 7519 1 6 . 1 1 161 161 TRP CB C 161 32.772 32.772 31.480 1.292 18321 7520 1 6 . 1 1 161 161 TRP H H 161 8.462 8.462 9.564 -1.102 18321 7521 1 6 . 1 1 162 162 SER N N 162 115.691 115.691 120.049 -4.358 18321 7522 1 6 . 1 1 162 162 SER C C 162 174.320 174.320 173.265 1.055 18321 7523 1 6 . 1 1 162 162 SER CA C 162 57.011 57.011 58.430 -1.419 18321 7524 1 6 . 1 1 162 162 SER CB C 162 63.948 63.948 63.602 0.346 18321 7525 1 6 . 1 1 162 162 SER H H 162 8.830 8.830 9.085 -0.255 18321 7526 1 6 . 1 1 163 163 ALA N N 163 130.630 130.630 128.339 2.291 18321 7527 1 6 . 1 1 163 163 ALA CA C 163 50.029 50.029 50.016 0.013 18321 7528 1 6 . 1 1 163 163 ALA CB C 163 25.500 25.500 22.953 2.547 18321 7529 1 6 . 1 1 163 163 ALA H H 163 9.585 9.585 9.290 0.295 18321 7530 1 6 . 1 1 164 164 ARG N N 164 117.526 117.526 120.137 -2.611 18321 7531 1 6 . 1 1 164 164 ARG C C 164 176.719 176.719 176.694 0.025 18321 7532 1 6 . 1 1 164 164 ARG CA C 164 52.975 52.975 54.282 -1.307 18321 7533 1 6 . 1 1 164 164 ARG CB C 164 34.260 34.260 30.966 3.294 18321 7534 1 6 . 1 1 164 164 ARG H H 164 9.097 9.097 8.945 0.152 18321 7535 1 6 . 1 1 165 165 ASN N N 165 123.935 123.935 122.318 1.617 18321 7536 1 6 . 1 1 165 165 ASN C C 165 178.484 178.484 177.278 1.206 18321 7537 1 6 . 1 1 165 165 ASN CA C 165 50.332 50.332 53.125 -2.793 18321 7538 1 6 . 1 1 165 165 ASN CB C 165 39.487 39.487 39.682 -0.195 18321 7539 1 6 . 1 1 165 165 ASN H H 165 8.756 8.756 8.859 -0.103 18321 7540 1 6 . 1 1 166 166 LYS N N 166 118.464 118.464 120.095 -1.631 18321 7541 1 6 . 1 1 166 166 LYS C C 166 176.967 176.967 176.308 0.659 18321 7542 1 6 . 1 1 166 166 LYS CA C 166 58.430 58.430 58.958 -0.528 18321 7543 1 6 . 1 1 166 166 LYS CB C 166 30.918 30.918 32.386 -1.468 18321 7544 1 6 . 1 1 166 166 LYS H H 166 8.915 8.915 8.857 0.058 18321 7545 1 6 . 1 1 167 167 ASP N N 167 118.138 118.138 115.662 2.476 18321 7546 1 6 . 1 1 167 167 ASP C C 167 176.464 176.464 176.770 -0.306 18321 7547 1 6 . 1 1 167 167 ASP CA C 167 54.212 54.212 54.601 -0.389 18321 7548 1 6 . 1 1 167 167 ASP CB C 167 41.178 41.178 40.817 0.361 18321 7549 1 6 . 1 1 167 167 ASP H H 167 7.508 7.508 7.908 -0.400 18321 7550 1 6 . 1 1 168 168 GLY N N 168 107.901 107.901 107.693 0.208 18321 7551 1 6 . 1 1 168 168 GLY C C 168 173.613 173.613 173.663 -0.050 18321 7552 1 6 . 1 1 168 168 GLY CA C 168 44.783 44.783 44.920 -0.137 18321 7553 1 6 . 1 1 168 168 GLY H H 168 8.173 8.173 7.912 0.261 18321 7554 1 6 . 1 1 169 169 ARG N N 169 124.324 124.324 120.941 3.383 18321 7555 1 6 . 1 1 169 169 ARG CA C 169 56.106 56.106 55.924 0.182 18321 7556 1 6 . 1 1 169 169 ARG CB C 169 29.648 29.648 31.460 -1.812 18321 7557 1 6 . 1 1 169 169 ARG H H 169 7.998 7.998 8.038 -0.040 18321 7558 1 6 . 1 1 170 170 VAL C C 170 177.590 177.590 174.896 2.694 18321 7559 1 6 . 1 1 171 171 GLY N N 171 112.582 112.582 113.142 -0.560 18321 7560 1 6 . 1 1 171 171 GLY C C 171 170.991 170.991 172.546 -1.555 18321 7561 1 6 . 1 1 171 171 GLY CA C 171 45.361 45.361 44.829 0.532 18321 7562 1 6 . 1 1 171 171 GLY H H 171 9.013 9.013 8.591 0.422 18321 7563 1 6 . 1 1 172 172 MET N N 172 117.368 117.368 121.233 -3.865 18321 7564 1 6 . 1 1 172 172 MET C C 172 177.921 177.921 176.421 1.500 18321 7565 1 6 . 1 1 172 172 MET CA C 172 53.536 53.536 56.780 -3.244 18321 7566 1 6 . 1 1 172 172 MET CB C 172 30.838 30.838 33.974 -3.136 18321 7567 1 6 . 1 1 172 172 MET H H 172 8.885 8.885 9.055 -0.170 18321 7568 1 6 . 1 1 173 173 ILE N N 173 113.130 113.130 117.578 -4.448 18321 7569 1 6 . 1 1 173 173 ILE CA C 173 56.284 56.284 57.885 -1.601 18321 7570 1 6 . 1 1 173 173 ILE CB C 173 40.870 40.870 40.258 0.612 18321 7571 1 6 . 1 1 173 173 ILE H H 173 9.704 9.704 9.354 0.350 18321 7572 1 6 . 1 1 174 174 PRO C C 174 176.714 176.714 177.911 -1.197 18321 7573 1 6 . 1 1 174 174 PRO CA C 174 66.290 66.290 61.390 4.900 18321 7574 1 6 . 1 1 174 174 PRO CB C 174 28.993 28.993 30.839 -1.846 18321 7575 1 6 . 1 1 175 175 VAL N N 175 128.066 128.066 124.303 3.763 18321 7576 1 6 . 1 1 175 175 VAL CA C 175 59.356 59.356 67.379 -8.023 18321 7577 1 6 . 1 1 175 175 VAL H H 175 7.327 7.327 8.291 -0.964 18321 7578 1 6 . 1 1 176 176 PRO C C 176 176.351 176.351 176.515 -0.164 18321 7579 1 6 . 1 1 177 177 TYR N N 177 115.756 115.756 115.992 -0.236 18321 7580 1 6 . 1 1 177 177 TYR C C 177 175.011 175.011 175.126 -0.115 18321 7581 1 6 . 1 1 177 177 TYR CA C 177 56.756 56.756 58.019 -1.263 18321 7582 1 6 . 1 1 177 177 TYR CB C 177 37.507 37.507 39.430 -1.923 18321 7583 1 6 . 1 1 177 177 TYR H H 177 7.784 7.784 7.781 0.003 18321 7584 1 6 . 1 1 178 178 VAL N N 178 111.428 111.428 113.754 -2.326 18321 7585 1 6 . 1 1 178 178 VAL C C 178 173.417 173.417 174.488 -1.071 18321 7586 1 6 . 1 1 178 178 VAL CA C 178 58.307 58.307 58.482 -0.175 18321 7587 1 6 . 1 1 178 178 VAL CB C 178 34.602 34.602 35.199 -0.597 18321 7588 1 6 . 1 1 178 178 VAL H H 178 7.801 7.801 7.356 0.445 18321 7589 1 6 . 1 1 179 179 GLU N N 179 118.581 118.581 116.726 1.855 18321 7590 1 6 . 1 1 179 179 GLU C C 179 175.225 175.225 175.676 -0.451 18321 7591 1 6 . 1 1 179 179 GLU CA C 179 53.114 53.114 56.511 -3.397 18321 7592 1 6 . 1 1 179 179 GLU CB C 179 32.712 32.712 31.422 1.290 18321 7593 1 6 . 1 1 179 179 GLU H H 179 8.819 8.819 8.893 -0.074 18321 7594 1 6 . 1 1 180 180 LYS N N 180 124.167 124.167 118.381 5.786 18321 7595 1 6 . 1 1 180 180 LYS C C 180 176.303 176.303 174.780 1.523 18321 7596 1 6 . 1 1 180 180 LYS CA C 180 57.318 57.318 55.160 2.158 18321 7597 1 6 . 1 1 180 180 LYS CB C 180 31.675 31.675 36.063 -4.388 18321 7598 1 6 . 1 1 180 180 LYS H H 180 8.775 8.775 7.881 0.894 18321 7599 1 6 . 1 1 181 181 LEU N N 181 125.157 125.157 119.844 5.313 18321 7600 1 6 . 1 1 181 181 LEU C C 181 176.462 176.462 176.001 0.461 18321 7601 1 6 . 1 1 181 181 LEU CA C 181 54.470 54.470 55.831 -1.361 18321 7602 1 6 . 1 1 181 181 LEU CB C 181 41.625 41.625 43.839 -2.213 18321 7603 1 6 . 1 1 181 181 LEU H H 181 8.084 8.084 8.598 -0.514 18321 7604 1 6 . 1 1 182 182 VAL N N 182 123.167 123.167 120.463 2.704 18321 7605 1 6 . 1 1 182 182 VAL C C 182 175.983 175.983 174.562 1.421 18321 7606 1 6 . 1 1 182 182 VAL CA C 182 61.613 61.613 60.909 0.704 18321 7607 1 6 . 1 1 182 182 VAL CB C 182 32.085 32.085 32.150 -0.065 18321 7608 1 6 . 1 1 182 182 VAL H H 182 8.345 8.345 8.060 0.285 18321 7609 1 6 . 1 1 183 183 ARG N N 183 125.775 125.775 129.536 -3.761 18321 7610 1 6 . 1 1 183 183 ARG CA C 183 57.801 57.801 55.760 2.041 18321 7611 1 6 . 1 1 183 183 ARG CB C 183 30.091 30.091 30.177 -0.086 18321 7612 1 6 . 1 1 183 183 ARG H H 183 8.530 8.530 8.611 -0.081 18321 7613 1 6 . 1 1 184 184 SER C C 184 173.239 173.239 174.214 -0.975 18321 7614 1 6 . 1 1 185 185 SER N N 185 116.511 116.511 121.112 -4.601 18321 7615 1 6 . 1 1 185 185 SER CA C 185 58.428 58.428 56.003 2.425 18321 7616 1 6 . 1 1 185 185 SER CB C 185 69.737 69.737 62.845 6.892 18321 7617 1 6 . 1 1 185 185 SER H H 185 7.944 7.944 7.720 0.224 18321 7618 1 6 . 1 1 190 190 HIS C C 190 176.953 176.953 175.454 1.499 18321 7619 1 6 . 1 1 190 190 HIS CA C 190 54.229 54.229 56.638 -2.409 18321 7620 1 6 . 1 1 190 190 HIS CB C 190 35.112 35.112 30.497 4.615 18321 7621 1 6 . 1 1 191 191 GLY N N 191 109.491 109.491 109.683 -0.192 18321 7622 1 6 . 1 1 191 191 GLY C C 191 172.295 172.295 172.940 -0.645 18321 7623 1 6 . 1 1 191 191 GLY CA C 191 45.227 45.227 44.373 0.854 18321 7624 1 6 . 1 1 191 191 GLY H H 191 8.719 8.719 8.204 0.515 18321 7625 1 6 . 1 1 192 192 ASN N N 192 118.700 118.700 121.728 -3.028 18321 7626 1 6 . 1 1 192 192 ASN HA H 192 4.312 4.312 4.862 -0.550 18321 7627 1 6 . 1 1 192 192 ASN C C 192 176.369 176.369 175.982 0.387 18321 7628 1 6 . 1 1 192 192 ASN CA C 192 57.787 57.787 52.398 5.389 18321 7629 1 6 . 1 1 192 192 ASN H H 192 7.508 7.508 8.550 -1.042 18321 7630 1 6 . 1 1 193 193 ARG N N 193 120.743 120.743 125.512 -4.769 18321 7631 1 6 . 1 1 193 193 ARG H H 193 9.032 9.032 8.626 0.406 18321 7632 1 6 . 1 1 197 197 SER HA H 197 4.388 4.388 4.404 -0.016 18321 7633 1 6 . 1 1 197 197 SER C C 197 174.133 174.133 173.043 1.090 18321 7634 1 6 . 1 1 197 197 SER CA C 197 58.128 58.128 57.910 0.218 18321 7635 1 6 . 1 1 197 197 SER CB C 197 62.966 62.966 63.747 -0.781 18321 7636 1 6 . 1 1 198 198 TYR N N 198 121.435 121.435 117.539 3.896 18321 7637 1 6 . 1 1 198 198 TYR HA H 198 4.543 4.543 4.226 0.317 18321 7638 1 6 . 1 1 198 198 TYR C C 198 176.230 176.230 175.049 1.181 18321 7639 1 6 . 1 1 198 198 TYR CA C 198 57.536 57.536 58.807 -1.271 18321 7640 1 6 . 1 1 198 198 TYR CB C 198 38.279 38.279 37.687 0.592 18321 7641 1 6 . 1 1 198 198 TYR H H 198 8.071 8.071 8.187 -0.116 18321 7642 1 6 . 1 1 199 199 GLY N N 199 110.039 110.039 106.392 3.647 18321 7643 1 6 . 1 1 199 199 GLY C C 199 173.475 173.475 173.262 0.213 18321 7644 1 6 . 1 1 199 199 GLY CA C 199 44.805 44.805 44.929 -0.124 18321 7645 1 6 . 1 1 199 199 GLY H H 199 8.162 8.162 8.343 -0.181 18321 7646 1 6 . 1 1 200 200 ILE N N 200 121.530 121.530 119.721 1.809 18321 7647 1 6 . 1 1 200 200 ILE CA C 200 58.102 58.102 58.092 0.010 18321 7648 1 6 . 1 1 200 200 ILE CB C 200 37.760 37.760 38.325 -0.565 18321 7649 1 6 . 1 1 200 200 ILE H H 200 7.851 7.851 7.905 -0.054 18321 7650 1 6 . 1 1 201 201 PRO C C 201 176.485 176.485 177.015 -0.530 18321 7651 1 6 . 1 1 201 201 PRO CA C 201 53.893 53.893 63.007 -9.114 18321 7652 1 6 . 1 1 201 201 PRO CB C 201 29.042 29.042 32.588 -3.546 18321 7653 1 6 . 1 1 202 202 GLU N N 202 122.468 122.468 120.375 2.093 18321 7654 1 6 . 1 1 202 202 GLU CA C 202 62.490 62.490 55.903 6.587 18321 7655 1 6 . 1 1 202 202 GLU CB C 202 31.170 31.170 29.916 1.254 18321 7656 1 6 . 1 1 202 202 GLU H H 202 8.328 8.328 8.223 0.105 18321 7657 1 6 . 1 1 203 203 PRO CA C 203 62.803 62.803 63.208 -0.405 18321 7658 1 6 . 1 1 203 203 PRO CB C 203 31.220 31.220 32.072 -0.852 18321 7659 1 6 . 1 1 204 204 ALA N N 204 123.251 123.251 127.847 -4.596 18321 7660 1 6 . 1 1 204 204 ALA HA H 204 4.180 4.180 4.397 -0.217 18321 7661 1 6 . 1 1 204 204 ALA CA C 204 52.124 52.124 52.920 -0.796 18321 7662 1 6 . 1 1 204 204 ALA CB C 204 18.892 18.892 19.715 -0.823 18321 7663 1 6 . 1 1 204 204 ALA H H 204 8.308 8.308 8.625 -0.317 18321 7664 1 6 . 1 1 205 205 HIS N N 205 117.874 117.874 119.753 -1.879 18321 7665 1 6 . 1 1 205 205 HIS C C 205 173.282 173.282 174.182 -0.900 18321 7666 1 6 . 1 1 205 205 HIS H H 205 8.045 8.045 8.647 -0.602 18321 7667 1 6 . 1 1 206 206 ALA N N 206 125.519 125.519 129.296 -3.777 18321 7668 1 6 . 1 1 206 206 ALA HA H 206 4.204 4.204 4.367 -0.163 18321 7669 1 6 . 1 1 206 206 ALA CA C 206 40.196 40.196 51.863 -11.667 18321 7670 1 6 . 1 1 206 206 ALA CB C 206 19.407 19.407 20.529 -1.122 18321 7671 1 6 . 1 1 206 206 ALA H H 206 8.061 8.061 7.940 0.121 18321 7672 1 6 . 1 1 207 207 TYR N N 207 120.381 120.381 119.853 0.528 18321 7673 1 6 . 1 1 207 207 TYR HA H 207 4.570 4.570 4.538 0.032 18321 7674 1 6 . 1 1 207 207 TYR CA C 207 52.572 52.572 57.702 -5.130 18321 7675 1 6 . 1 1 207 207 TYR CB C 207 41.333 41.333 38.916 2.417 18321 7676 1 6 . 1 1 207 207 TYR H H 207 8.199 8.199 7.857 0.342 18321 7677 1 6 . 1 1 208 208 ALA HA H 208 4.281 4.281 4.745 -0.464 18321 7678 1 6 . 1 1 208 208 ALA C C 208 177.736 177.736 175.786 1.950 18321 7679 1 6 . 1 1 208 208 ALA CA C 208 52.084 52.084 52.307 -0.223 18321 7680 1 6 . 1 1 208 208 ALA CB C 208 18.999 18.999 20.791 -1.792 18321 7681 1 6 . 1 1 209 209 GLN N N 209 119.295 119.295 124.229 -4.934 18321 7682 1 6 . 1 1 209 209 GLN CA C 209 61.474 61.474 52.741 8.733 18321 7683 1 6 . 1 1 209 209 GLN CB C 209 32.039 32.039 29.622 2.417 18321 7684 1 6 . 1 1 209 209 GLN H H 209 8.125 8.125 8.407 -0.282 18321 7685 1 6 . 1 1 210 210 PRO HA H 210 4.395 4.395 4.578 -0.183 18321 7686 1 6 . 1 1 210 210 PRO CA C 210 62.584 62.584 63.134 -0.550 18321 7687 1 6 . 1 1 211 211 GLN HA H 211 4.377 4.377 4.506 -0.129 18321 7688 1 6 . 1 1 211 211 GLN CA C 211 55.859 55.859 55.650 0.209 18321 7689 1 6 . 1 1 211 211 GLN CB C 211 29.577 29.577 29.266 0.311 18321 7690 1 6 . 1 1 212 212 THR C C 212 176.551 176.551 174.196 2.355 18321 7691 1 6 . 1 1 212 212 THR CB C 212 69.890 69.890 68.133 1.757 18321 7692 1 6 . 1 1 213 213 THR N N 213 108.487 108.487 117.429 -8.942 18321 7693 1 6 . 1 1 213 213 THR CA C 213 61.236 61.236 63.412 -2.176 18321 7694 1 6 . 1 1 213 213 THR CB C 213 69.091 69.091 70.072 -0.981 18321 7695 1 6 . 1 1 213 213 THR H H 213 8.243 8.243 8.165 0.078 18321 7696 1 6 . 1 1 214 214 THR N N 214 119.445 119.445 113.655 5.790 18321 7697 1 6 . 1 1 214 214 THR CA C 214 59.425 59.425 60.228 -0.803 18321 7698 1 6 . 1 1 214 214 THR CB C 214 69.251 69.251 69.038 0.213 18321 7699 1 6 . 1 1 214 214 THR H H 214 8.188 8.188 8.341 -0.153 18321 7700 1 6 . 1 1 215 215 PRO HA H 215 4.361 4.361 4.712 -0.351 18321 7701 1 6 . 1 1 215 215 PRO C C 215 175.422 175.422 175.447 -0.025 18321 7702 1 6 . 1 1 215 215 PRO CA C 215 63.320 63.320 63.054 0.266 18321 7703 1 6 . 1 1 215 215 PRO CB C 215 31.918 31.918 31.861 0.057 18321 7704 1 6 . 1 1 216 216 LEU N N 216 121.602 121.602 116.736 4.866 18321 7705 1 6 . 1 1 216 216 LEU CA C 216 52.203 52.203 52.489 -0.286 18321 7706 1 6 . 1 1 216 216 LEU CB C 216 42.451 42.451 41.371 1.080 18321 7707 1 6 . 1 1 216 216 LEU H H 216 7.891 7.891 7.349 0.542 18321 7708 1 6 . 1 1 217 217 PRO HA H 217 4.398 4.398 4.195 0.203 18321 7709 1 6 . 1 1 217 217 PRO C C 217 176.577 176.577 177.142 -0.565 18321 7710 1 6 . 1 1 217 217 PRO CA C 217 62.984 62.984 64.483 -1.499 18321 7711 1 6 . 1 1 217 217 PRO CB C 217 32.056 32.056 31.887 0.169 18321 7712 1 6 . 1 1 218 218 ALA N N 218 124.087 124.087 118.697 5.390 18321 7713 1 6 . 1 1 218 218 ALA HA H 218 4.309 4.309 4.045 0.264 18321 7714 1 6 . 1 1 218 218 ALA C C 218 177.844 177.844 178.191 -0.347 18321 7715 1 6 . 1 1 218 218 ALA CA C 218 52.379 52.379 52.972 -0.593 18321 7716 1 6 . 1 1 218 218 ALA CB C 218 19.133 19.133 16.855 2.278 18321 7717 1 6 . 1 1 218 218 ALA H H 218 8.261 8.261 8.057 0.204 18321 7718 1 6 . 1 1 219 219 VAL N N 219 118.942 118.942 116.956 1.986 18321 7719 1 6 . 1 1 219 219 VAL HA H 219 4.142 4.142 3.909 0.233 18321 7720 1 6 . 1 1 219 219 VAL CA C 219 62.102 62.102 64.094 -1.992 18321 7721 1 6 . 1 1 219 219 VAL CB C 219 32.923 32.923 32.015 0.908 18321 7722 1 6 . 1 1 219 219 VAL H H 219 8.049 8.049 7.987 0.062 18321 7723 1 6 . 1 1 220 220 SER N N 220 119.207 119.207 112.266 6.941 18321 7724 1 6 . 1 1 220 220 SER HA H 220 4.436 4.436 4.692 -0.256 18321 7725 1 6 . 1 1 220 220 SER CA C 220 57.813 57.813 57.013 0.800 18321 7726 1 6 . 1 1 220 220 SER CB C 220 63.375 63.375 65.108 -1.733 18321 7727 1 6 . 1 1 220 220 SER H H 220 8.275 8.275 7.597 0.678 18321 7728 1 6 . 1 1 221 221 GLY N N 221 110.973 110.973 110.097 0.876 18321 7729 1 6 . 1 1 221 221 GLY C C 221 173.962 173.962 174.734 -0.772 18321 7730 1 6 . 1 1 221 221 GLY CA C 221 45.286 45.286 45.591 -0.305 18321 7731 1 6 . 1 1 221 221 GLY H H 221 8.374 8.374 8.604 -0.230 18321 7732 1 6 . 1 1 222 222 SER N N 222 115.516 115.516 117.614 -2.098 18321 7733 1 6 . 1 1 222 222 SER HA H 222 4.763 4.763 4.732 0.031 18321 7734 1 6 . 1 1 222 222 SER CA C 222 56.407 56.407 55.584 0.823 18321 7735 1 6 . 1 1 222 222 SER CB C 222 63.993 63.993 63.591 0.402 18321 7736 1 6 . 1 1 222 222 SER H H 222 8.155 8.155 7.856 0.299 18321 7737 1 6 . 1 1 223 223 PRO HA H 223 4.417 4.417 4.462 -0.045 18321 7738 1 6 . 1 1 223 223 PRO CA C 223 63.805 63.805 63.094 0.711 18321 7739 1 6 . 1 1 223 223 PRO CB C 223 32.090 32.090 31.718 0.372 18321 7740 1 6 . 1 1 224 224 GLY N N 224 109.149 109.149 111.697 -2.548 18321 7741 1 6 . 1 1 224 224 GLY C C 224 173.813 173.813 174.330 -0.517 18321 7742 1 6 . 1 1 224 224 GLY CA C 224 44.512 44.512 45.832 -1.320 18321 7743 1 6 . 1 1 224 224 GLY H H 224 8.376 8.376 8.487 -0.111 18321 7744 1 6 . 1 1 225 225 ALA N N 225 123.599 123.599 122.188 1.411 18321 7745 1 6 . 1 1 225 225 ALA C C 225 177.341 177.341 178.498 -1.157 18321 7746 1 6 . 1 1 225 225 ALA CA C 225 51.878 51.878 52.291 -0.413 18321 7747 1 6 . 1 1 225 225 ALA CB C 225 19.169 19.169 19.512 -0.342 18321 7748 1 6 . 1 1 225 225 ALA H H 225 7.959 7.959 8.052 -0.093 18321 7749 1 6 . 1 1 226 226 ALA N N 226 123.218 123.218 123.912 -0.694 18321 7750 1 6 . 1 1 226 226 ALA HA H 226 4.350 4.350 4.556 -0.206 18321 7751 1 6 . 1 1 226 226 ALA C C 226 177.520 177.520 178.238 -0.718 18321 7752 1 6 . 1 1 226 226 ALA CA C 226 52.535 52.535 51.752 0.784 18321 7753 1 6 . 1 1 226 226 ALA CB C 226 19.171 19.171 16.908 2.263 18321 7754 1 6 . 1 1 226 226 ALA H H 226 8.169 8.169 8.572 -0.403 18321 7755 1 6 . 1 1 227 227 ILE N N 227 120.086 120.086 121.633 -1.547 18321 7756 1 6 . 1 1 227 227 ILE HA H 227 4.201 4.201 3.919 0.282 18321 7757 1 6 . 1 1 227 227 ILE C C 227 174.814 174.814 176.171 -1.357 18321 7758 1 6 . 1 1 227 227 ILE CA C 227 60.929 60.929 62.480 -1.551 18321 7759 1 6 . 1 1 227 227 ILE CB C 227 38.872 38.872 38.392 0.479 18321 7760 1 6 . 1 1 227 227 ILE H H 227 8.037 8.037 8.105 -0.068 18321 7761 1 6 . 1 1 228 228 THR N N 228 117.224 117.224 113.349 3.875 18321 7762 1 6 . 1 1 228 228 THR HA H 228 4.203 4.203 4.176 0.027 18321 7763 1 6 . 1 1 228 228 THR CA C 228 57.108 57.108 62.121 -5.013 18321 7764 1 6 . 1 1 228 228 THR CB C 228 69.945 69.945 68.308 1.637 18321 7765 1 6 . 1 1 228 228 THR H H 228 7.775 7.775 8.290 -0.515 18321 7766 1 6 . 1 1 229 229 PRO HA H 229 4.750 4.750 4.445 0.305 18321 7767 1 6 . 1 1 229 229 PRO CA C 229 62.480 62.480 63.031 -0.551 18321 7768 1 6 . 1 1 229 229 PRO CB C 229 33.995 33.995 32.053 1.942 18321 7769 1 6 . 1 1 230 230 LEU N N 230 123.629 123.629 122.522 1.107 18321 7770 1 6 . 1 1 230 230 LEU CA C 230 53.076 53.076 53.368 -0.292 18321 7771 1 6 . 1 1 230 230 LEU CB C 230 40.608 40.608 41.155 -0.547 18321 7772 1 6 . 1 1 230 230 LEU H H 230 8.453 8.453 7.951 0.502 18321 7773 1 6 . 1 1 231 231 PRO HA H 231 4.412 4.412 4.550 -0.138 18321 7774 1 6 . 1 1 231 231 PRO C C 231 176.571 176.571 176.754 -0.183 18321 7775 1 6 . 1 1 231 231 PRO CA C 231 63.225 63.225 62.432 0.793 18321 7776 1 6 . 1 1 231 231 PRO CB C 231 31.191 31.191 32.409 -1.218 18321 7777 1 6 . 1 1 232 232 SER N N 232 115.169 115.169 116.179 -1.010 18321 7778 1 6 . 1 1 232 232 SER HA H 232 4.450 4.450 4.513 -0.063 18321 7779 1 6 . 1 1 232 232 SER CA C 232 58.604 58.604 58.037 0.567 18321 7780 1 6 . 1 1 232 232 SER CB C 232 63.962 63.962 61.771 2.191 18321 7781 1 6 . 1 1 232 232 SER H H 232 8.280 8.280 8.585 -0.305 18321 7782 1 6 . 1 1 233 233 THR N N 233 115.155 115.155 115.496 -0.341 18321 7783 1 6 . 1 1 233 233 THR HA H 233 4.351 4.351 4.207 0.144 18321 7784 1 6 . 1 1 233 233 THR C C 233 177.237 177.237 174.239 2.998 18321 7785 1 6 . 1 1 233 233 THR CA C 233 61.939 61.939 61.878 0.061 18321 7786 1 6 . 1 1 233 233 THR CB C 233 68.986 68.986 69.150 -0.164 18321 7787 1 6 . 1 1 233 233 THR H H 233 8.096 8.096 7.596 0.500 18321 7788 1 6 . 1 1 234 234 GLN N N 234 122.040 122.040 127.235 -5.195 18321 7789 1 6 . 1 1 234 234 GLN HA H 234 4.681 4.681 4.248 0.433 18321 7790 1 6 . 1 1 234 234 GLN C C 234 176.177 176.177 175.476 0.701 18321 7791 1 6 . 1 1 234 234 GLN CA C 234 55.861 55.861 56.149 -0.288 18321 7792 1 6 . 1 1 234 234 GLN CB C 234 28.583 28.583 28.544 0.039 18321 7793 1 6 . 1 1 234 234 GLN H H 234 8.256 8.256 8.733 -0.477 18321 7794 1 6 . 1 1 235 235 ASN N N 235 119.506 119.506 122.597 -3.091 18321 7795 1 6 . 1 1 235 235 ASN HA H 235 4.775 4.775 4.777 -0.002 18321 7796 1 6 . 1 1 235 235 ASN C C 235 174.974 174.974 174.829 0.145 18321 7797 1 6 . 1 1 235 235 ASN CA C 235 53.191 53.191 52.765 0.426 18321 7798 1 6 . 1 1 235 235 ASN CB C 235 38.511 38.511 39.042 -0.531 18321 7799 1 6 . 1 1 235 235 ASN H H 235 8.346 8.346 8.229 0.117 18321 7800 1 6 . 1 1 236 236 GLY N N 236 109.378 109.378 109.888 -0.510 18321 7801 1 6 . 1 1 236 236 GLY CA C 236 44.023 44.023 44.312 -0.289 18321 7802 1 6 . 1 1 236 236 GLY H H 236 7.939 7.939 8.148 -0.209 18321 7803 1 6 . 1 1 237 237 PRO HA H 237 4.336 4.336 4.266 0.070 18321 7804 1 6 . 1 1 237 237 PRO C C 237 175.942 175.942 175.720 0.222 18321 7805 1 6 . 1 1 237 237 PRO CA C 237 62.797 62.797 62.098 0.699 18321 7806 1 6 . 1 1 237 237 PRO CB C 237 27.421 27.421 32.154 -4.733 18321 7807 1 6 . 1 1 238 238 VAL N N 238 120.535 120.535 121.369 -0.834 18321 7808 1 6 . 1 1 238 238 VAL HA H 238 4.195 4.195 3.847 0.348 18321 7809 1 6 . 1 1 238 238 VAL C C 238 173.775 173.775 175.043 -1.268 18321 7810 1 6 . 1 1 238 238 VAL CA C 238 61.173 61.173 62.594 -1.421 18321 7811 1 6 . 1 1 238 238 VAL CB C 238 38.328 38.328 31.248 7.080 18321 7812 1 6 . 1 1 238 238 VAL H H 238 7.986 7.986 7.752 0.234 18321 7813 1 6 . 1 1 239 239 PHE N N 239 123.522 123.522 127.188 -3.666 18321 7814 1 6 . 1 1 239 239 PHE HA H 239 5.539 5.539 4.686 0.853 18321 7815 1 6 . 1 1 239 239 PHE C C 239 174.207 174.207 174.319 -0.112 18321 7816 1 6 . 1 1 239 239 PHE CA C 239 56.993 56.993 56.506 0.487 18321 7817 1 6 . 1 1 239 239 PHE CB C 239 41.743 41.743 39.227 2.516 18321 7818 1 6 . 1 1 239 239 PHE H H 239 8.927 8.927 8.523 0.404 18321 7819 1 6 . 1 1 240 240 ALA N N 240 120.871 120.871 127.687 -6.816 18321 7820 1 6 . 1 1 240 240 ALA HA H 240 5.352 5.352 5.514 -0.162 18321 7821 1 6 . 1 1 240 240 ALA C C 240 174.639 174.639 175.811 -1.172 18321 7822 1 6 . 1 1 240 240 ALA CA C 240 49.736 49.736 50.330 -0.593 18321 7823 1 6 . 1 1 240 240 ALA CB C 240 23.480 23.480 21.566 1.914 18321 7824 1 6 . 1 1 240 240 ALA H H 240 9.398 9.398 8.696 0.702 18321 7825 1 6 . 1 1 241 241 LYS N N 241 121.227 121.227 126.520 -5.293 18321 7826 1 6 . 1 1 241 241 LYS HA H 241 5.373 5.373 4.879 0.494 18321 7827 1 6 . 1 1 241 241 LYS C C 241 176.772 176.772 176.037 0.735 18321 7828 1 6 . 1 1 241 241 LYS CA C 241 53.128 53.128 55.132 -2.004 18321 7829 1 6 . 1 1 241 241 LYS CB C 241 34.850 34.850 34.040 0.810 18321 7830 1 6 . 1 1 241 241 LYS H H 241 8.947 8.947 8.891 0.056 18321 7831 1 6 . 1 1 242 242 ALA N N 242 126.833 126.833 130.156 -3.323 18321 7832 1 6 . 1 1 242 242 ALA HA H 242 4.764 4.764 4.489 0.275 18321 7833 1 6 . 1 1 242 242 ALA C C 242 178.506 178.506 177.258 1.248 18321 7834 1 6 . 1 1 242 242 ALA CA C 242 52.788 52.788 51.667 1.121 18321 7835 1 6 . 1 1 242 242 ALA CB C 242 19.084 19.084 18.636 0.448 18321 7836 1 6 . 1 1 242 242 ALA H H 242 9.373 9.373 8.974 0.399 18321 7837 1 6 . 1 1 243 243 ILE N N 243 118.731 118.731 117.987 0.744 18321 7838 1 6 . 1 1 243 243 ILE HA H 243 4.454 4.454 4.139 0.315 18321 7839 1 6 . 1 1 243 243 ILE C C 243 174.773 174.773 175.656 -0.883 18321 7840 1 6 . 1 1 243 243 ILE CA C 243 60.613 60.613 62.043 -1.430 18321 7841 1 6 . 1 1 243 243 ILE CB C 243 39.232 39.232 37.912 1.320 18321 7842 1 6 . 1 1 243 243 ILE H H 243 8.933 8.933 8.036 0.897 18321 7843 1 6 . 1 1 244 244 GLN N N 244 121.616 121.616 119.072 2.544 18321 7844 1 6 . 1 1 244 244 GLN HA H 244 4.283 4.283 4.517 -0.234 18321 7845 1 6 . 1 1 244 244 GLN C C 244 172.815 172.815 174.390 -1.575 18321 7846 1 6 . 1 1 244 244 GLN CA C 244 54.750 54.750 54.476 0.274 18321 7847 1 6 . 1 1 244 244 GLN CB C 244 31.469 31.469 32.659 -1.190 18321 7848 1 6 . 1 1 244 244 GLN H H 244 7.438 7.438 7.701 -0.263 18321 7849 1 6 . 1 1 245 245 LYS N N 245 124.215 124.215 121.367 2.848 18321 7850 1 6 . 1 1 245 245 LYS HA H 245 3.962 3.962 4.747 -0.785 18321 7851 1 6 . 1 1 245 245 LYS C C 245 175.679 175.679 175.424 0.255 18321 7852 1 6 . 1 1 245 245 LYS CA C 245 56.413 56.413 56.033 0.380 18321 7853 1 6 . 1 1 245 245 LYS CB C 245 32.847 32.847 33.466 -0.619 18321 7854 1 6 . 1 1 245 245 LYS H H 245 8.318 8.318 8.558 -0.240 18321 7855 1 6 . 1 1 246 246 ARG N N 246 127.327 127.327 118.648 8.679 18321 7856 1 6 . 1 1 246 246 ARG HA H 246 4.221 4.221 4.621 -0.400 18321 7857 1 6 . 1 1 246 246 ARG CA C 246 56.279 56.279 55.715 0.564 18321 7858 1 6 . 1 1 246 246 ARG CB C 246 32.987 32.987 33.230 -0.243 18321 7859 1 6 . 1 1 246 246 ARG H H 246 9.248 9.248 8.452 0.796 18321 7860 1 6 . 1 1 249 249 CYS HA H 249 4.260 4.260 4.167 0.093 18321 7861 1 6 . 1 1 249 249 CYS CA C 249 55.886 55.886 57.507 -1.621 18321 7862 1 6 . 1 1 249 249 CYS CB C 249 34.146 34.146 29.048 5.098 18321 7863 1 6 . 1 1 250 250 ALA HA H 250 3.926 3.926 4.147 -0.221 18321 7864 1 6 . 1 1 250 250 ALA CA C 250 54.344 54.344 54.433 -0.089 18321 7865 1 6 . 1 1 250 250 ALA CB C 250 18.342 18.342 18.702 -0.360 18321 7866 1 6 . 1 1 251 251 TYR N N 251 110.618 110.618 112.164 -1.546 18321 7867 1 6 . 1 1 251 251 TYR HA H 251 4.489 4.489 4.791 -0.302 18321 7868 1 6 . 1 1 251 251 TYR C C 251 175.286 175.286 174.530 0.756 18321 7869 1 6 . 1 1 251 251 TYR CA C 251 56.137 56.137 56.759 -0.622 18321 7870 1 6 . 1 1 251 251 TYR CB C 251 37.203 37.203 38.612 -1.409 18321 7871 1 6 . 1 1 251 251 TYR H H 251 7.037 7.037 7.578 -0.541 18321 7872 1 6 . 1 1 252 252 ASP N N 252 121.835 121.835 121.393 0.442 18321 7873 1 6 . 1 1 252 252 ASP HA H 252 4.763 4.763 4.759 0.004 18321 7874 1 6 . 1 1 252 252 ASP CA C 252 52.351 52.351 53.487 -1.136 18321 7875 1 6 . 1 1 252 252 ASP CB C 252 39.995 39.995 39.074 0.921 18321 7876 1 6 . 1 1 252 252 ASP H H 252 7.339 7.339 8.115 -0.776 18321 7877 1 6 . 1 1 253 253 LYS N N 253 123.177 123.177 121.206 1.971 18321 7878 1 6 . 1 1 253 253 LYS HA H 253 4.270 4.270 4.154 0.116 18321 7879 1 6 . 1 1 253 253 LYS C C 253 177.724 177.724 177.179 0.545 18321 7880 1 6 . 1 1 253 253 LYS CA C 253 57.036 57.036 59.112 -2.076 18321 7881 1 6 . 1 1 253 253 LYS H H 253 8.396 8.396 7.603 0.793 18321 7882 1 6 . 1 1 254 254 THR N N 254 108.317 108.317 110.786 -2.469 18321 7883 1 6 . 1 1 254 254 THR HA H 254 4.517 4.517 4.390 0.127 18321 7884 1 6 . 1 1 254 254 THR C C 254 174.012 174.012 173.709 0.303 18321 7885 1 6 . 1 1 254 254 THR CA C 254 61.036 61.036 61.044 -0.008 18321 7886 1 6 . 1 1 254 254 THR CB C 254 69.307 69.307 68.462 0.845 18321 7887 1 6 . 1 1 254 254 THR H H 254 8.217 8.217 8.254 -0.037 18321 7888 1 6 . 1 1 255 255 ALA N N 255 124.762 124.762 125.158 -0.396 18321 7889 1 6 . 1 1 255 255 ALA HA H 255 4.524 4.524 4.726 -0.202 18321 7890 1 6 . 1 1 255 255 ALA C C 255 176.630 176.630 176.936 -0.306 18321 7891 1 6 . 1 1 255 255 ALA CA C 255 51.352 51.352 51.431 -0.079 18321 7892 1 6 . 1 1 255 255 ALA CB C 255 20.135 20.135 19.709 0.426 18321 7893 1 6 . 1 1 255 255 ALA H H 255 7.096 7.096 7.205 -0.109 18321 7894 1 6 . 1 1 256 256 LEU N N 256 124.379 124.379 124.475 -0.096 18321 7895 1 6 . 1 1 256 256 LEU HA H 256 4.328 4.328 4.313 0.015 18321 7896 1 6 . 1 1 256 256 LEU C C 256 176.007 176.007 176.023 -0.016 18321 7897 1 6 . 1 1 256 256 LEU CA C 256 53.502 53.502 54.624 -1.122 18321 7898 1 6 . 1 1 256 256 LEU CB C 256 44.665 44.665 43.430 1.235 18321 7899 1 6 . 1 1 256 256 LEU H H 256 8.889 8.889 8.344 0.545 18321 7900 1 6 . 1 1 257 257 ALA N N 257 129.619 129.619 127.776 1.843 18321 7901 1 6 . 1 1 257 257 ALA HA H 257 4.445 4.445 4.517 -0.072 18321 7902 1 6 . 1 1 257 257 ALA C C 257 176.813 176.813 176.038 0.775 18321 7903 1 6 . 1 1 257 257 ALA CA C 257 51.179 51.179 51.566 -0.387 18321 7904 1 6 . 1 1 257 257 ALA CB C 257 18.973 18.973 19.678 -0.705 18321 7905 1 6 . 1 1 257 257 ALA H H 257 8.529 8.529 8.188 0.341 18321 7906 1 6 . 1 1 258 258 LEU N N 258 119.300 119.300 122.732 -3.432 18321 7907 1 6 . 1 1 258 258 LEU HA H 258 4.782 4.782 4.784 -0.002 18321 7908 1 6 . 1 1 258 258 LEU CA C 258 53.259 53.259 53.400 -0.141 18321 7909 1 6 . 1 1 258 258 LEU CB C 258 45.972 45.972 46.376 -0.404 18321 7910 1 6 . 1 1 258 258 LEU H H 258 8.505 8.505 8.133 0.372 18321 7911 1 6 . 1 1 259 259 GLU N N 259 123.919 123.919 119.193 4.726 18321 7912 1 6 . 1 1 259 259 GLU HA H 259 4.516 4.516 4.627 -0.111 18321 7913 1 6 . 1 1 259 259 GLU C C 259 175.795 175.795 175.547 0.248 18321 7914 1 6 . 1 1 259 259 GLU CA C 259 52.896 52.896 54.218 -1.322 18321 7915 1 6 . 1 1 259 259 GLU H H 259 8.943 8.943 8.301 0.642 18321 7916 1 6 . 1 1 260 260 VAL N N 260 122.122 122.122 119.231 2.891 18321 7917 1 6 . 1 1 260 260 VAL HA H 260 2.923 2.923 3.992 -1.069 18321 7918 1 6 . 1 1 260 260 VAL C C 260 177.964 177.964 177.500 0.464 18321 7919 1 6 . 1 1 260 260 VAL CA C 260 65.417 65.417 63.677 1.740 18321 7920 1 6 . 1 1 260 260 VAL CB C 260 30.668 30.668 31.755 -1.087 18321 7921 1 6 . 1 1 260 260 VAL H H 260 8.956 8.956 8.438 0.518 18321 7922 1 6 . 1 1 261 261 GLY N N 261 116.009 116.009 116.623 -0.614 18321 7923 1 6 . 1 1 261 261 GLY C C 261 176.288 176.288 173.934 2.354 18321 7924 1 6 . 1 1 261 261 GLY CA C 261 44.210 44.210 44.968 -0.758 18321 7925 1 6 . 1 1 261 261 GLY H H 261 8.799 8.799 9.054 -0.255 18321 7926 1 6 . 1 1 262 262 ASP N N 262 121.945 121.945 120.716 1.229 18321 7927 1 6 . 1 1 262 262 ASP HA H 262 4.423 4.423 4.824 -0.401 18321 7928 1 6 . 1 1 262 262 ASP C C 262 175.381 175.381 175.414 -0.033 18321 7929 1 6 . 1 1 262 262 ASP CA C 262 55.243 55.243 52.916 2.326 18321 7930 1 6 . 1 1 262 262 ASP CB C 262 41.819 41.819 42.323 -0.504 18321 7931 1 6 . 1 1 262 262 ASP H H 262 8.180 8.180 7.569 0.611 18321 7932 1 6 . 1 1 263 263 ILE N N 263 121.452 121.452 124.461 -3.009 18321 7933 1 6 . 1 1 263 263 ILE HA H 263 4.707 4.707 4.308 0.399 18321 7934 1 6 . 1 1 263 263 ILE C C 263 174.996 174.996 176.064 -1.068 18321 7935 1 6 . 1 1 263 263 ILE CA C 263 59.289 59.289 59.847 -0.558 18321 7936 1 6 . 1 1 263 263 ILE CB C 263 36.987 36.987 37.233 -0.246 18321 7937 1 6 . 1 1 263 263 ILE H H 263 8.460 8.460 8.602 -0.142 18321 7938 1 6 . 1 1 264 264 VAL N N 264 128.756 128.756 130.043 -1.287 18321 7939 1 6 . 1 1 264 264 VAL HA H 264 4.309 4.309 3.983 0.326 18321 7940 1 6 . 1 1 264 264 VAL C C 264 175.486 175.486 174.774 0.712 18321 7941 1 6 . 1 1 264 264 VAL CA C 264 59.091 59.091 61.828 -2.737 18321 7942 1 6 . 1 1 264 264 VAL CB C 264 34.541 34.541 31.547 2.994 18321 7943 1 6 . 1 1 264 264 VAL H H 264 9.479 9.479 8.885 0.594 18321 7944 1 6 . 1 1 265 265 LYS N N 265 128.101 128.101 130.107 -2.006 18321 7945 1 6 . 1 1 265 265 LYS HA H 265 4.342 4.342 4.345 -0.003 18321 7946 1 6 . 1 1 265 265 LYS C C 265 175.531 175.531 174.890 0.641 18321 7947 1 6 . 1 1 265 265 LYS CA C 265 55.620 55.620 55.148 0.472 18321 7948 1 6 . 1 1 265 265 LYS CB C 265 33.149 33.149 31.824 1.325 18321 7949 1 6 . 1 1 265 265 LYS H H 265 8.715 8.715 8.451 0.264 18321 7950 1 6 . 1 1 266 266 VAL N N 266 129.537 129.537 126.832 2.705 18321 7951 1 6 . 1 1 266 266 VAL HA H 266 4.333 4.333 4.640 -0.307 18321 7952 1 6 . 1 1 266 266 VAL C C 266 176.166 176.166 174.765 1.401 18321 7953 1 6 . 1 1 266 266 VAL CA C 266 63.339 63.339 60.824 2.515 18321 7954 1 6 . 1 1 266 266 VAL CB C 266 30.712 30.712 33.666 -2.954 18321 7955 1 6 . 1 1 266 266 VAL H H 266 9.073 9.073 7.904 1.169 18321 7956 1 6 . 1 1 267 267 THR N N 267 120.020 120.020 122.921 -2.901 18321 7957 1 6 . 1 1 267 267 THR HA H 267 4.189 4.189 4.466 -0.277 18321 7958 1 6 . 1 1 267 267 THR C C 267 176.054 176.054 175.230 0.824 18321 7959 1 6 . 1 1 267 267 THR CA C 267 62.204 62.204 62.039 0.165 18321 7960 1 6 . 1 1 267 267 THR CB C 267 68.200 68.200 69.532 -1.332 18321 7961 1 6 . 1 1 267 267 THR H H 267 9.130 9.130 8.469 0.661 18321 7962 1 6 . 1 1 268 268 ARG N N 268 120.839 120.839 122.104 -1.265 18321 7963 1 6 . 1 1 268 268 ARG HA H 268 4.236 4.236 4.687 -0.451 18321 7964 1 6 . 1 1 268 268 ARG CA C 268 56.321 56.321 54.980 1.341 18321 7965 1 6 . 1 1 268 268 ARG CB C 268 33.049 33.049 30.056 2.993 18321 7966 1 6 . 1 1 268 268 ARG H H 268 7.631 7.631 7.732 -0.101 18321 7967 1 6 . 1 1 269 269 MET N N 269 125.443 125.443 120.604 4.839 18321 7968 1 6 . 1 1 269 269 MET C C 269 174.392 174.392 174.082 0.310 18321 7969 1 6 . 1 1 269 269 MET H H 269 8.532 8.532 8.153 0.379 18321 7970 1 6 . 1 1 270 270 ASN N N 270 119.125 119.125 120.513 -1.388 18321 7971 1 6 . 1 1 270 270 ASN HA H 270 4.546 4.546 5.005 -0.459 18321 7972 1 6 . 1 1 270 270 ASN C C 270 172.133 172.133 176.702 -4.569 18321 7973 1 6 . 1 1 270 270 ASN CA C 270 53.639 53.639 52.251 1.389 18321 7974 1 6 . 1 1 270 270 ASN CB C 270 39.845 39.845 40.718 -0.873 18321 7975 1 6 . 1 1 270 270 ASN H H 270 6.631 6.631 8.650 -2.019 18321 7976 1 6 . 1 1 271 271 ILE N N 271 122.532 122.532 117.753 4.779 18321 7977 1 6 . 1 1 271 271 ILE HA H 271 4.417 4.417 4.088 0.329 18321 7978 1 6 . 1 1 271 271 ILE CA C 271 63.348 63.348 62.454 0.894 18321 7979 1 6 . 1 1 271 271 ILE CB C 271 38.198 38.198 37.526 0.672 18321 7980 1 6 . 1 1 271 271 ILE H H 271 8.565 8.565 8.522 0.043 18321 7981 1 6 . 1 1 272 272 ASN HA H 272 4.527 4.527 4.629 -0.102 18321 7982 1 6 . 1 1 272 272 ASN C C 272 176.259 176.259 176.315 -0.056 18321 7983 1 6 . 1 1 272 272 ASN CA C 272 53.225 53.225 53.855 -0.630 18321 7984 1 6 . 1 1 272 272 ASN CB C 272 37.565 37.565 39.083 -1.518 18321 7985 1 6 . 1 1 273 273 GLY N N 273 107.043 107.043 107.187 -0.144 18321 7986 1 6 . 1 1 273 273 GLY C C 273 173.216 173.216 172.751 0.465 18321 7987 1 6 . 1 1 273 273 GLY CA C 273 45.299 45.299 44.942 0.357 18321 7988 1 6 . 1 1 273 273 GLY H H 273 8.086 8.086 7.775 0.311 18321 7989 1 6 . 1 1 274 274 GLN N N 274 120.624 120.624 122.014 -1.390 18321 7990 1 6 . 1 1 274 274 GLN HA H 274 4.551 4.551 4.063 0.488 18321 7991 1 6 . 1 1 274 274 GLN C C 274 175.039 175.039 175.455 -0.416 18321 7992 1 6 . 1 1 274 274 GLN CA C 274 54.556 54.556 55.637 -1.081 18321 7993 1 6 . 1 1 274 274 GLN CB C 274 33.698 33.698 29.082 4.616 18321 7994 1 6 . 1 1 274 274 GLN H H 274 8.045 8.045 8.031 0.014 18321 7995 1 6 . 1 1 275 275 TRP N N 275 125.596 125.596 125.330 0.266 18321 7996 1 6 . 1 1 275 275 TRP HA H 275 4.588 4.588 4.641 -0.053 18321 7997 1 6 . 1 1 275 275 TRP C C 275 172.832 172.832 175.414 -2.582 18321 7998 1 6 . 1 1 275 275 TRP CA C 275 55.296 55.296 53.509 1.787 18321 7999 1 6 . 1 1 275 275 TRP CB C 275 31.393 31.393 30.551 0.842 18321 8000 1 6 . 1 1 275 275 TRP H H 275 8.484 8.484 8.307 0.177 18321 8001 1 6 . 1 1 276 276 GLU N N 276 119.012 119.012 122.257 -3.245 18321 8002 1 6 . 1 1 276 276 GLU HA H 276 5.190 5.190 5.387 -0.197 18321 8003 1 6 . 1 1 276 276 GLU C C 276 176.553 176.553 175.855 0.698 18321 8004 1 6 . 1 1 276 276 GLU CA C 276 54.288 54.288 55.078 -0.791 18321 8005 1 6 . 1 1 276 276 GLU CB C 276 32.851 32.851 32.075 0.776 18321 8006 1 6 . 1 1 276 276 GLU H H 276 8.643 8.643 9.055 -0.412 18321 8007 1 6 . 1 1 277 277 GLY N N 277 111.364 111.364 112.963 -1.599 18321 8008 1 6 . 1 1 277 277 GLY C C 277 170.707 170.707 172.224 -1.517 18321 8009 1 6 . 1 1 277 277 GLY CA C 277 46.723 46.723 44.671 2.052 18321 8010 1 6 . 1 1 277 277 GLY H H 277 9.072 9.072 8.562 0.510 18321 8011 1 6 . 1 1 278 278 GLU N N 278 117.733 117.733 120.852 -3.119 18321 8012 1 6 . 1 1 278 278 GLU HA H 278 5.748 5.748 5.134 0.614 18321 8013 1 6 . 1 1 278 278 GLU C C 278 176.051 176.051 175.475 0.576 18321 8014 1 6 . 1 1 278 278 GLU CA C 278 53.620 53.620 55.684 -2.064 18321 8015 1 6 . 1 1 278 278 GLU CB C 278 33.742 33.742 31.543 2.199 18321 8016 1 6 . 1 1 278 278 GLU H H 278 8.810 8.810 8.055 0.755 18321 8017 1 6 . 1 1 279 279 VAL N N 279 123.834 123.834 123.045 0.789 18321 8018 1 6 . 1 1 279 279 VAL HA H 279 4.404 4.404 4.241 0.163 18321 8019 1 6 . 1 1 279 279 VAL C C 279 175.289 175.289 176.322 -1.033 18321 8020 1 6 . 1 1 279 279 VAL CA C 279 61.166 61.166 62.823 -1.657 18321 8021 1 6 . 1 1 279 279 VAL CB C 279 34.123 34.123 33.410 0.713 18321 8022 1 6 . 1 1 279 279 VAL H H 279 8.887 8.887 8.045 0.842 18321 8023 1 6 . 1 1 280 280 ASN N N 280 126.025 126.025 119.887 6.138 18321 8024 1 6 . 1 1 280 280 ASN HA H 280 4.435 4.435 4.736 -0.301 18321 8025 1 6 . 1 1 280 280 ASN C C 280 175.205 175.205 175.811 -0.606 18321 8026 1 6 . 1 1 280 280 ASN CA C 280 45.615 45.615 53.173 -7.558 18321 8027 1 6 . 1 1 280 280 ASN CB C 280 37.386 37.386 37.299 0.087 18321 8028 1 6 . 1 1 280 280 ASN H H 280 9.322 9.322 8.552 0.770 18321 8029 1 6 . 1 1 281 281 GLY N N 281 104.588 104.588 108.566 -3.978 18321 8030 1 6 . 1 1 281 281 GLY C C 281 173.944 173.944 173.468 0.476 18321 8031 1 6 . 1 1 281 281 GLY CA C 281 45.224 45.224 45.901 -0.677 18321 8032 1 6 . 1 1 281 281 GLY H H 281 8.768 8.768 7.927 0.841 18321 8033 1 6 . 1 1 282 282 ARG N N 282 122.567 122.567 118.482 4.085 18321 8034 1 6 . 1 1 282 282 ARG HA H 282 4.559 4.559 4.425 0.134 18321 8035 1 6 . 1 1 282 282 ARG C C 282 174.350 174.350 174.070 0.280 18321 8036 1 6 . 1 1 282 282 ARG CA C 282 54.933 54.933 55.527 -0.594 18321 8037 1 6 . 1 1 282 282 ARG CB C 282 31.765 31.765 32.634 -0.869 18321 8038 1 6 . 1 1 282 282 ARG H H 282 8.149 8.149 7.947 0.202 18321 8039 1 6 . 1 1 283 283 LYS N N 283 121.565 121.565 126.443 -4.878 18321 8040 1 6 . 1 1 283 283 LYS HA H 283 5.584 5.584 5.455 0.129 18321 8041 1 6 . 1 1 283 283 LYS CA C 283 54.143 54.143 55.279 -1.136 18321 8042 1 6 . 1 1 283 283 LYS CB C 283 36.040 36.040 34.027 2.013 18321 8043 1 6 . 1 1 283 283 LYS H H 283 8.424 8.424 8.505 -0.081 18321 8044 1 6 . 1 1 284 284 GLY C C 284 173.006 173.006 172.231 0.775 18321 8045 1 6 . 1 1 284 284 GLY CA C 284 45.886 45.886 45.101 0.785 18321 8046 1 6 . 1 1 285 285 LEU N N 285 119.673 119.673 121.676 -2.003 18321 8047 1 6 . 1 1 285 285 LEU HA H 285 5.718 5.718 5.377 0.341 18321 8048 1 6 . 1 1 285 285 LEU C C 285 178.657 178.657 176.046 2.611 18321 8049 1 6 . 1 1 285 285 LEU CA C 285 53.656 53.656 53.698 -0.042 18321 8050 1 6 . 1 1 285 285 LEU CB C 285 44.813 44.813 42.996 1.817 18321 8051 1 6 . 1 1 285 285 LEU H H 285 8.734 8.734 8.596 0.138 18321 8052 1 6 . 1 1 286 286 PHE N N 286 118.785 118.785 121.616 -2.831 18321 8053 1 6 . 1 1 286 286 PHE HA H 286 4.521 4.521 5.154 -0.633 18321 8054 1 6 . 1 1 286 286 PHE CA C 286 57.592 57.592 53.892 3.700 18321 8055 1 6 . 1 1 286 286 PHE CB C 286 40.669 40.669 39.909 0.760 18321 8056 1 6 . 1 1 286 286 PHE H H 286 9.120 9.120 9.114 0.006 18321 8057 1 6 . 1 1 287 287 PRO HA H 287 4.385 4.385 4.173 0.212 18321 8058 1 6 . 1 1 287 287 PRO CA C 287 62.814 62.814 62.227 0.587 18321 8059 1 6 . 1 1 287 287 PRO CB C 287 32.133 32.133 28.841 3.292 18321 8060 1 6 . 1 1 288 288 PHE C C 288 174.837 174.837 174.831 0.006 18321 8061 1 6 . 1 1 288 288 PHE CA C 288 59.020 59.020 56.558 2.462 18321 8062 1 6 . 1 1 288 288 PHE CB C 288 34.987 34.987 35.404 -0.417 18321 8063 1 6 . 1 1 289 289 THR N N 289 107.865 107.865 118.288 -10.423 18321 8064 1 6 . 1 1 289 289 THR HA H 289 3.589 3.589 3.439 0.150 18321 8065 1 6 . 1 1 289 289 THR C C 289 176.125 176.125 174.347 1.778 18321 8066 1 6 . 1 1 289 289 THR CA C 289 62.243 62.243 64.535 -2.292 18321 8067 1 6 . 1 1 289 289 THR CB C 289 69.365 69.365 67.048 2.317 18321 8068 1 6 . 1 1 289 289 THR H H 289 6.453 6.453 8.551 -2.098 18321 8069 1 6 . 1 1 290 290 HIS N N 290 119.462 119.462 114.077 5.385 18321 8070 1 6 . 1 1 290 290 HIS HA H 290 4.196 4.196 4.150 0.046 18321 8071 1 6 . 1 1 290 290 HIS C C 290 175.165 175.165 174.704 0.461 18321 8072 1 6 . 1 1 290 290 HIS CA C 290 57.635 57.635 56.877 0.758 18321 8073 1 6 . 1 1 290 290 HIS CB C 290 29.840 29.840 27.519 2.321 18321 8074 1 6 . 1 1 290 290 HIS H H 290 7.835 7.835 8.180 -0.345 18321 8075 1 6 . 1 1 291 291 VAL N N 291 110.050 110.050 113.737 -3.687 18321 8076 1 6 . 1 1 291 291 VAL HA H 291 5.445 5.445 4.744 0.701 18321 8077 1 6 . 1 1 291 291 VAL C C 291 173.386 173.386 175.799 -2.413 18321 8078 1 6 . 1 1 291 291 VAL CA C 291 57.794 57.794 60.280 -2.486 18321 8079 1 6 . 1 1 291 291 VAL CB C 291 35.784 35.784 32.980 2.804 18321 8080 1 6 . 1 1 291 291 VAL H H 291 7.562 7.562 8.138 -0.576 18321 8081 1 6 . 1 1 292 292 LYS N N 292 119.445 119.445 122.393 -2.948 18321 8082 1 6 . 1 1 292 292 LYS HA H 292 4.857 4.857 4.723 0.134 18321 8083 1 6 . 1 1 292 292 LYS C C 292 176.512 176.512 175.644 0.868 18321 8084 1 6 . 1 1 292 292 LYS CA C 292 54.647 54.647 54.397 0.251 18321 8085 1 6 . 1 1 292 292 LYS CB C 292 35.665 35.665 34.079 1.586 18321 8086 1 6 . 1 1 292 292 LYS H H 292 8.753 8.753 8.146 0.607 18321 8087 1 6 . 1 1 293 293 ILE N N 293 128.707 128.707 128.073 0.634 18321 8088 1 6 . 1 1 293 293 ILE HA H 293 4.509 4.509 4.674 -0.165 18321 8089 1 6 . 1 1 293 293 ILE C C 293 175.666 175.666 176.228 -0.562 18321 8090 1 6 . 1 1 293 293 ILE CA C 293 62.563 62.563 60.964 1.599 18321 8091 1 6 . 1 1 293 293 ILE CB C 293 38.076 38.076 36.254 1.822 18321 8092 1 6 . 1 1 293 293 ILE H H 293 9.107 9.107 8.862 0.245 18321 8093 1 6 . 1 1 294 294 PHE N N 294 126.638 126.638 125.451 1.187 18321 8094 1 6 . 1 1 294 294 PHE HA H 294 4.898 4.898 4.960 -0.062 18321 8095 1 6 . 1 1 294 294 PHE C C 294 175.838 175.838 172.746 3.092 18321 8096 1 6 . 1 1 294 294 PHE CA C 294 56.335 56.335 56.025 0.310 18321 8097 1 6 . 1 1 294 294 PHE CB C 294 41.196 41.196 40.799 0.397 18321 8098 1 6 . 1 1 294 294 PHE H H 294 8.716 8.716 9.142 -0.426 18321 8099 1 6 . 1 1 295 295 ASP N N 295 122.961 122.961 118.774 4.187 18321 8100 1 6 . 1 1 295 295 ASP HA H 295 5.003 5.003 4.809 0.194 18321 8101 1 6 . 1 1 295 295 ASP CA C 295 50.602 50.602 49.880 0.722 18321 8102 1 6 . 1 1 295 295 ASP CB C 295 40.754 40.754 43.656 -2.902 18321 8103 1 6 . 1 1 295 295 ASP H H 295 8.418 8.418 8.607 -0.190 18321 8104 1 6 . 1 1 296 296 PRO HA H 296 4.524 4.524 4.437 0.087 18321 8105 1 6 . 1 1 296 296 PRO C C 296 176.807 176.807 176.961 -0.154 18321 8106 1 6 . 1 1 296 296 PRO CA C 296 62.987 62.987 64.140 -1.153 18321 8107 1 6 . 1 1 296 296 PRO CB C 296 32.033 32.033 31.673 0.360 18321 8108 1 6 . 1 1 297 297 GLN N N 297 120.729 120.729 118.224 2.505 18321 8109 1 6 . 1 1 297 297 GLN HA H 297 4.274 4.274 4.093 0.181 18321 8110 1 6 . 1 1 297 297 GLN CA C 297 56.427 56.427 57.263 -0.836 18321 8111 1 6 . 1 1 297 297 GLN CB C 297 28.819 28.819 29.191 -0.372 18321 8112 1 6 . 1 1 297 297 GLN H H 297 8.551 8.551 8.191 0.360 18321 8113 1 6 . 1 1 299 299 PRO C C 299 176.936 176.936 175.791 1.145 18321 8114 1 6 . 1 1 299 299 PRO CA C 299 63.406 63.406 62.868 0.537 18321 8115 1 6 . 1 1 299 299 PRO CB C 299 31.421 31.421 30.708 0.713 18321 8116 1 6 . 1 1 300 300 ASP N N 300 119.609 119.609 120.532 -0.923 18321 8117 1 6 . 1 1 300 300 ASP C C 300 176.344 176.344 176.960 -0.616 18321 8118 1 6 . 1 1 300 300 ASP CA C 300 54.178 54.178 56.794 -2.616 18321 8119 1 6 . 1 1 300 300 ASP CB C 300 40.661 40.661 41.370 -0.709 18321 8120 1 6 . 1 1 300 300 ASP H H 300 8.239 8.239 8.267 -0.028 18321 8121 1 6 . 1 1 301 301 GLU N N 301 120.462 120.462 121.270 -0.808 18321 8122 1 6 . 1 1 301 301 GLU CA C 301 56.188 56.188 55.480 0.708 18321 8123 1 6 . 1 1 301 301 GLU CB C 301 29.507 29.507 28.697 0.810 18321 8124 1 6 . 1 1 301 301 GLU H H 301 8.084 8.084 8.474 -0.390 18321 8125 1 7 . 1 1 2 2 SER HA H 2 4.521 4.521 4.680 -0.159 18321 8126 1 7 . 1 1 2 2 SER CA C 2 58.326 58.326 58.370 -0.044 18321 8127 1 7 . 1 1 2 2 SER CB C 2 64.062 64.062 63.540 0.522 18321 8128 1 7 . 1 1 3 3 SER HA H 3 4.465 4.465 4.228 0.237 18321 8129 1 7 . 1 1 3 3 SER C C 3 173.887 173.887 173.746 0.141 18321 8130 1 7 . 1 1 3 3 SER CA C 3 58.374 58.374 60.636 -2.262 18321 8131 1 7 . 1 1 3 3 SER CB C 3 63.920 63.920 63.654 0.266 18321 8132 1 7 . 1 1 4 4 ALA N N 4 124.755 124.755 123.095 1.660 18321 8133 1 7 . 1 1 4 4 ALA HA H 4 4.547 4.547 4.531 0.016 18321 8134 1 7 . 1 1 4 4 ALA CA C 4 52.737 52.737 52.209 0.527 18321 8135 1 7 . 1 1 4 4 ALA CB C 4 19.636 19.636 18.803 0.833 18321 8136 1 7 . 1 1 4 4 ALA H H 4 8.244 8.244 7.920 0.324 18321 8137 1 7 . 1 1 5 5 ARG N N 5 120.383 120.383 127.030 -6.647 18321 8138 1 7 . 1 1 5 5 ARG HA H 5 4.524 4.524 4.706 -0.182 18321 8139 1 7 . 1 1 5 5 ARG C C 5 175.611 175.611 174.313 1.298 18321 8140 1 7 . 1 1 5 5 ARG CA C 5 56.082 56.082 56.099 -0.017 18321 8141 1 7 . 1 1 5 5 ARG CB C 5 30.695 30.695 31.515 -0.820 18321 8142 1 7 . 1 1 5 5 ARG H H 5 8.727 8.727 8.643 0.084 18321 8143 1 7 . 1 1 6 6 PHE N N 6 115.159 115.159 121.099 -5.940 18321 8144 1 7 . 1 1 6 6 PHE HA H 6 4.786 4.786 4.727 0.059 18321 8145 1 7 . 1 1 6 6 PHE C C 6 172.076 172.076 173.427 -1.351 18321 8146 1 7 . 1 1 6 6 PHE CA C 6 56.640 56.640 55.929 0.711 18321 8147 1 7 . 1 1 6 6 PHE CB C 6 40.378 40.378 40.647 -0.269 18321 8148 1 7 . 1 1 6 6 PHE H H 6 7.536 7.536 8.001 -0.465 18321 8149 1 7 . 1 1 7 7 ASP N N 7 121.846 121.846 122.094 -0.248 18321 8150 1 7 . 1 1 7 7 ASP HA H 7 4.846 4.846 4.765 0.081 18321 8151 1 7 . 1 1 7 7 ASP CA C 7 52.327 52.327 54.235 -1.908 18321 8152 1 7 . 1 1 7 7 ASP CB C 7 41.298 41.298 41.634 -0.336 18321 8153 1 7 . 1 1 7 7 ASP H H 7 9.062 9.062 8.712 0.350 18321 8154 1 7 . 1 1 8 8 SER HA H 8 3.950 3.950 4.393 -0.443 18321 8155 1 7 . 1 1 8 8 SER C C 8 174.705 174.705 175.306 -0.601 18321 8156 1 7 . 1 1 8 8 SER CA C 8 61.937 61.937 60.276 1.661 18321 8157 1 7 . 1 1 8 8 SER CB C 8 62.260 62.260 63.228 -0.968 18321 8158 1 7 . 1 1 9 9 SER N N 9 114.373 114.373 113.596 0.777 18321 8159 1 7 . 1 1 9 9 SER HA H 9 4.529 4.529 4.875 -0.346 18321 8160 1 7 . 1 1 9 9 SER C C 9 175.089 175.089 173.449 1.640 18321 8161 1 7 . 1 1 9 9 SER CA C 9 59.851 59.851 57.768 2.083 18321 8162 1 7 . 1 1 9 9 SER CB C 9 64.246 64.246 63.224 1.022 18321 8163 1 7 . 1 1 9 9 SER H H 9 8.722 8.722 8.213 0.509 18321 8164 1 7 . 1 1 10 10 ASP N N 10 121.818 121.818 123.808 -1.990 18321 8165 1 7 . 1 1 10 10 ASP HA H 10 4.730 4.730 4.648 0.082 18321 8166 1 7 . 1 1 10 10 ASP C C 10 174.455 174.455 175.781 -1.326 18321 8167 1 7 . 1 1 10 10 ASP CA C 10 52.432 52.432 53.608 -1.176 18321 8168 1 7 . 1 1 10 10 ASP CB C 10 39.607 39.607 40.958 -1.351 18321 8169 1 7 . 1 1 10 10 ASP H H 10 7.600 7.600 7.952 -0.352 18321 8170 1 7 . 1 1 11 11 ARG N N 11 125.238 125.238 124.257 0.981 18321 8171 1 7 . 1 1 11 11 ARG HA H 11 1.936 1.936 2.970 -1.034 18321 8172 1 7 . 1 1 11 11 ARG C C 11 176.916 176.916 177.718 -0.802 18321 8173 1 7 . 1 1 11 11 ARG CA C 11 57.451 57.451 57.620 -0.169 18321 8174 1 7 . 1 1 11 11 ARG CB C 11 43.014 43.014 29.932 13.082 18321 8175 1 7 . 1 1 11 11 ARG H H 11 7.739 7.739 7.915 -0.176 18321 8176 1 7 . 1 1 12 12 SER N N 12 112.065 112.065 112.142 -0.077 18321 8177 1 7 . 1 1 12 12 SER HA H 12 4.695 4.695 4.246 0.449 18321 8178 1 7 . 1 1 12 12 SER C C 12 175.092 175.092 174.521 0.571 18321 8179 1 7 . 1 1 12 12 SER CA C 12 60.785 60.785 58.972 1.813 18321 8180 1 7 . 1 1 12 12 SER CB C 12 62.889 62.889 62.980 -0.091 18321 8181 1 7 . 1 1 12 12 SER H H 12 7.888 7.888 7.644 0.244 18321 8182 1 7 . 1 1 13 13 ALA N N 13 122.249 122.249 122.103 0.146 18321 8183 1 7 . 1 1 13 13 ALA HA H 13 4.216 4.216 4.609 -0.393 18321 8184 1 7 . 1 1 13 13 ALA C C 13 178.069 178.069 177.596 0.473 18321 8185 1 7 . 1 1 13 13 ALA CA C 13 53.562 53.562 52.924 0.638 18321 8186 1 7 . 1 1 13 13 ALA CB C 13 19.339 19.339 20.052 -0.713 18321 8187 1 7 . 1 1 13 13 ALA H H 13 7.418 7.418 7.642 -0.224 18321 8188 1 7 . 1 1 14 14 TRP N N 14 107.433 107.433 112.489 -5.056 18321 8189 1 7 . 1 1 14 14 TRP HA H 14 4.785 4.785 4.603 0.182 18321 8190 1 7 . 1 1 14 14 TRP C C 14 175.286 175.286 175.517 -0.231 18321 8191 1 7 . 1 1 14 14 TRP CA C 14 55.212 55.212 55.172 0.040 18321 8192 1 7 . 1 1 14 14 TRP CB C 14 32.776 32.776 31.080 1.696 18321 8193 1 7 . 1 1 14 14 TRP H H 14 6.273 6.273 7.079 -0.806 18321 8194 1 7 . 1 1 15 15 TYR N N 15 122.315 122.315 123.942 -1.627 18321 8195 1 7 . 1 1 15 15 TYR HA H 15 5.436 5.436 4.762 0.674 18321 8196 1 7 . 1 1 15 15 TYR C C 15 175.325 175.325 174.698 0.627 18321 8197 1 7 . 1 1 15 15 TYR CA C 15 56.609 56.609 58.140 -1.531 18321 8198 1 7 . 1 1 15 15 TYR CB C 15 36.940 36.940 37.467 -0.527 18321 8199 1 7 . 1 1 15 15 TYR H H 15 8.221 8.221 6.914 1.307 18321 8200 1 7 . 1 1 16 16 MET N N 16 126.031 126.031 127.543 -1.512 18321 8201 1 7 . 1 1 16 16 MET HA H 16 4.462 4.462 4.305 0.157 18321 8202 1 7 . 1 1 16 16 MET CA C 16 53.046 53.046 53.371 -0.325 18321 8203 1 7 . 1 1 16 16 MET CB C 16 41.114 41.114 33.602 7.512 18321 8204 1 7 . 1 1 16 16 MET H H 16 8.989 8.989 8.338 0.651 18321 8205 1 7 . 1 1 17 17 GLY CA C 17 45.803 45.803 45.364 0.439 18321 8206 1 7 . 1 1 18 18 PRO HA H 18 4.675 4.675 4.449 0.226 18321 8207 1 7 . 1 1 18 18 PRO C C 18 175.943 175.943 175.422 0.521 18321 8208 1 7 . 1 1 18 18 PRO CA C 18 63.647 63.647 63.456 0.190 18321 8209 1 7 . 1 1 18 18 PRO CB C 18 29.276 29.276 30.071 -0.795 18321 8210 1 7 . 1 1 19 19 VAL N N 19 126.159 126.159 121.474 4.685 18321 8211 1 7 . 1 1 19 19 VAL HA H 19 4.011 4.011 4.327 -0.316 18321 8212 1 7 . 1 1 19 19 VAL C C 19 175.812 175.812 174.508 1.304 18321 8213 1 7 . 1 1 19 19 VAL CA C 19 62.355 62.355 60.648 1.707 18321 8214 1 7 . 1 1 19 19 VAL CB C 19 33.468 33.468 35.966 -2.498 18321 8215 1 7 . 1 1 19 19 VAL H H 19 7.851 7.851 7.813 0.038 18321 8216 1 7 . 1 1 20 20 SER N N 20 123.950 123.950 115.838 8.112 18321 8217 1 7 . 1 1 20 20 SER HA H 20 4.453 4.453 4.925 -0.472 18321 8218 1 7 . 1 1 20 20 SER CA C 20 57.631 57.631 56.885 0.746 18321 8219 1 7 . 1 1 20 20 SER CB C 20 65.951 65.951 66.112 -0.161 18321 8220 1 7 . 1 1 20 20 SER H H 20 8.800 8.800 8.247 0.553 18321 8221 1 7 . 1 1 21 21 ARG N N 21 123.461 123.461 121.962 1.499 18321 8222 1 7 . 1 1 21 21 ARG HA H 21 3.489 3.489 4.004 -0.515 18321 8223 1 7 . 1 1 21 21 ARG C C 21 178.164 178.164 178.616 -0.452 18321 8224 1 7 . 1 1 21 21 ARG CA C 21 60.025 60.025 60.785 -0.760 18321 8225 1 7 . 1 1 21 21 ARG CB C 21 30.334 30.334 29.848 0.486 18321 8226 1 7 . 1 1 21 21 ARG H H 21 9.307 9.307 8.841 0.466 18321 8227 1 7 . 1 1 22 22 GLN N N 22 116.591 116.591 118.478 -1.887 18321 8228 1 7 . 1 1 22 22 GLN HA H 22 4.008 4.008 4.065 -0.057 18321 8229 1 7 . 1 1 22 22 GLN CA C 22 59.095 59.095 59.384 -0.289 18321 8230 1 7 . 1 1 22 22 GLN CB C 22 29.249 29.249 27.846 1.403 18321 8231 1 7 . 1 1 22 22 GLN H H 22 8.394 8.394 8.693 -0.299 18321 8232 1 7 . 1 1 23 23 GLU N N 23 122.191 122.191 119.062 3.129 18321 8233 1 7 . 1 1 23 23 GLU HA H 23 4.037 4.037 3.988 0.049 18321 8234 1 7 . 1 1 23 23 GLU C C 23 178.986 178.986 178.520 0.466 18321 8235 1 7 . 1 1 23 23 GLU CA C 23 59.081 59.081 59.224 -0.143 18321 8236 1 7 . 1 1 23 23 GLU CB C 23 31.896 31.896 29.327 2.569 18321 8237 1 7 . 1 1 23 23 GLU H H 23 8.106 8.106 8.530 -0.424 18321 8238 1 7 . 1 1 24 24 ALA N N 24 121.964 121.964 122.162 -0.198 18321 8239 1 7 . 1 1 24 24 ALA HA H 24 3.762 3.762 3.867 -0.105 18321 8240 1 7 . 1 1 24 24 ALA C C 24 178.653 178.653 179.416 -0.763 18321 8241 1 7 . 1 1 24 24 ALA CA C 24 55.480 55.480 55.404 0.076 18321 8242 1 7 . 1 1 24 24 ALA CB C 24 18.049 18.049 18.225 -0.176 18321 8243 1 7 . 1 1 24 24 ALA H H 24 8.732 8.732 8.368 0.364 18321 8244 1 7 . 1 1 25 25 GLN N N 25 116.229 116.229 117.520 -1.291 18321 8245 1 7 . 1 1 25 25 GLN HA H 25 3.950 3.950 4.017 -0.067 18321 8246 1 7 . 1 1 25 25 GLN C C 25 177.442 177.442 178.532 -1.090 18321 8247 1 7 . 1 1 25 25 GLN CA C 25 59.651 59.651 58.709 0.942 18321 8248 1 7 . 1 1 25 25 GLN CB C 25 29.308 29.308 28.895 0.412 18321 8249 1 7 . 1 1 25 25 GLN H H 25 8.391 8.391 8.229 0.162 18321 8250 1 7 . 1 1 26 26 THR N N 26 115.105 115.105 115.578 -0.473 18321 8251 1 7 . 1 1 26 26 THR HA H 26 3.920 3.920 4.065 -0.145 18321 8252 1 7 . 1 1 26 26 THR C C 26 176.835 176.835 176.903 -0.068 18321 8253 1 7 . 1 1 26 26 THR CA C 26 66.335 66.335 66.151 0.184 18321 8254 1 7 . 1 1 26 26 THR CB C 26 68.876 68.876 68.561 0.314 18321 8255 1 7 . 1 1 26 26 THR H H 26 8.223 8.223 8.154 0.069 18321 8256 1 7 . 1 1 27 27 ARG N N 27 119.096 119.096 117.683 1.413 18321 8257 1 7 . 1 1 27 27 ARG HA H 27 4.047 4.047 4.151 -0.104 18321 8258 1 7 . 1 1 27 27 ARG C C 27 177.245 177.245 176.828 0.417 18321 8259 1 7 . 1 1 27 27 ARG CA C 27 58.528 58.528 58.391 0.137 18321 8260 1 7 . 1 1 27 27 ARG CB C 27 30.184 30.184 30.395 -0.211 18321 8261 1 7 . 1 1 27 27 ARG H H 27 8.093 8.093 7.810 0.283 18321 8262 1 7 . 1 1 28 28 LEU N N 28 114.602 114.602 115.306 -0.704 18321 8263 1 7 . 1 1 28 28 LEU HA H 28 4.325 4.325 4.540 -0.215 18321 8264 1 7 . 1 1 28 28 LEU C C 28 177.197 177.197 176.372 0.825 18321 8265 1 7 . 1 1 28 28 LEU CA C 28 55.143 55.143 54.067 1.076 18321 8266 1 7 . 1 1 28 28 LEU CB C 28 44.902 44.902 43.298 1.604 18321 8267 1 7 . 1 1 28 28 LEU H H 28 7.438 7.438 7.361 0.077 18321 8268 1 7 . 1 1 29 29 GLN N N 29 121.312 121.312 120.244 1.068 18321 8269 1 7 . 1 1 29 29 GLN HA H 29 3.856 3.856 4.152 -0.296 18321 8270 1 7 . 1 1 29 29 GLN C C 29 178.048 178.048 176.797 1.251 18321 8271 1 7 . 1 1 29 29 GLN CA C 29 57.691 57.691 57.268 0.423 18321 8272 1 7 . 1 1 29 29 GLN CB C 29 27.293 27.293 28.086 -0.793 18321 8273 1 7 . 1 1 29 29 GLN H H 29 8.250 8.250 7.918 0.332 18321 8274 1 7 . 1 1 30 30 GLY N N 30 116.768 116.768 115.858 0.910 18321 8275 1 7 . 1 1 30 30 GLY C C 30 174.914 174.914 174.705 0.209 18321 8276 1 7 . 1 1 30 30 GLY CA C 30 45.491 45.491 45.674 -0.183 18321 8277 1 7 . 1 1 30 30 GLY H H 30 9.135 9.135 8.476 0.659 18321 8278 1 7 . 1 1 31 31 GLN N N 31 117.979 117.979 119.910 -1.931 18321 8279 1 7 . 1 1 31 31 GLN HA H 31 4.329 4.329 4.248 0.081 18321 8280 1 7 . 1 1 31 31 GLN C C 31 177.174 177.174 176.503 0.671 18321 8281 1 7 . 1 1 31 31 GLN CA C 31 53.910 53.910 54.365 -0.455 18321 8282 1 7 . 1 1 31 31 GLN CB C 31 29.574 29.574 29.268 0.306 18321 8283 1 7 . 1 1 31 31 GLN H H 31 7.695 7.695 7.521 0.174 18321 8284 1 7 . 1 1 32 32 ARG N N 32 123.918 123.918 120.451 3.467 18321 8285 1 7 . 1 1 32 32 ARG HA H 32 3.940 3.940 4.019 -0.079 18321 8286 1 7 . 1 1 32 32 ARG C C 32 175.810 175.810 175.858 -0.048 18321 8287 1 7 . 1 1 32 32 ARG CA C 32 56.770 56.770 56.504 0.266 18321 8288 1 7 . 1 1 32 32 ARG CB C 32 30.074 30.074 30.024 0.050 18321 8289 1 7 . 1 1 32 32 ARG H H 32 8.955 8.955 8.557 0.398 18321 8290 1 7 . 1 1 33 33 HIS N N 33 122.248 122.248 122.436 -0.188 18321 8291 1 7 . 1 1 33 33 HIS HA H 33 4.627 4.627 4.566 0.061 18321 8292 1 7 . 1 1 33 33 HIS C C 33 177.089 177.089 176.551 0.538 18321 8293 1 7 . 1 1 33 33 HIS CA C 33 55.858 55.858 56.868 -1.010 18321 8294 1 7 . 1 1 33 33 HIS CB C 33 28.648 28.648 29.869 -1.221 18321 8295 1 7 . 1 1 33 33 HIS H H 33 8.302 8.302 8.324 -0.022 18321 8296 1 7 . 1 1 34 34 GLY N N 34 109.518 109.518 112.800 -3.282 18321 8297 1 7 . 1 1 34 34 GLY C C 34 176.730 176.730 173.723 3.007 18321 8298 1 7 . 1 1 34 34 GLY CA C 34 45.967 45.967 44.870 1.097 18321 8299 1 7 . 1 1 34 34 GLY H H 34 9.496 9.496 9.331 0.165 18321 8300 1 7 . 1 1 35 35 MET N N 35 125.193 125.193 121.881 3.312 18321 8301 1 7 . 1 1 35 35 MET HA H 35 5.750 5.750 5.808 -0.058 18321 8302 1 7 . 1 1 35 35 MET C C 35 174.388 174.388 175.060 -0.672 18321 8303 1 7 . 1 1 35 35 MET CA C 35 55.762 55.762 56.286 -0.524 18321 8304 1 7 . 1 1 35 35 MET CB C 35 32.706 32.706 34.171 -1.465 18321 8305 1 7 . 1 1 35 35 MET H H 35 8.359 8.359 7.404 0.955 18321 8306 1 7 . 1 1 36 36 PHE N N 36 123.311 123.311 116.894 6.417 18321 8307 1 7 . 1 1 36 36 PHE HA H 36 5.985 5.985 5.801 0.184 18321 8308 1 7 . 1 1 36 36 PHE C C 36 172.140 172.140 172.856 -0.716 18321 8309 1 7 . 1 1 36 36 PHE CA C 36 55.755 55.755 55.377 0.378 18321 8310 1 7 . 1 1 36 36 PHE CB C 36 45.197 45.197 42.758 2.439 18321 8311 1 7 . 1 1 36 36 PHE H H 36 8.261 8.261 7.914 0.347 18321 8312 1 7 . 1 1 37 37 LEU N N 37 114.652 114.652 116.019 -1.367 18321 8313 1 7 . 1 1 37 37 LEU HA H 37 4.489 4.489 4.990 -0.501 18321 8314 1 7 . 1 1 37 37 LEU C C 37 174.033 174.033 174.991 -0.958 18321 8315 1 7 . 1 1 37 37 LEU CA C 37 55.382 55.382 54.467 0.915 18321 8316 1 7 . 1 1 37 37 LEU CB C 37 44.791 44.791 45.680 -0.889 18321 8317 1 7 . 1 1 37 37 LEU H H 37 9.292 9.292 8.979 0.313 18321 8318 1 7 . 1 1 38 38 VAL N N 38 121.009 121.009 122.691 -1.682 18321 8319 1 7 . 1 1 38 38 VAL HA H 38 5.504 5.504 4.748 0.756 18321 8320 1 7 . 1 1 38 38 VAL C C 38 173.581 173.581 175.848 -2.267 18321 8321 1 7 . 1 1 38 38 VAL CA C 38 61.316 61.316 61.549 -0.233 18321 8322 1 7 . 1 1 38 38 VAL CB C 38 33.302 33.302 31.946 1.356 18321 8323 1 7 . 1 1 38 38 VAL H H 38 8.991 8.991 8.556 0.435 18321 8324 1 7 . 1 1 39 39 ARG N N 39 124.863 124.863 128.048 -3.185 18321 8325 1 7 . 1 1 39 39 ARG HA H 39 5.444 5.444 4.925 0.519 18321 8326 1 7 . 1 1 39 39 ARG C C 39 175.772 175.772 174.769 1.003 18321 8327 1 7 . 1 1 39 39 ARG CA C 39 52.558 52.558 53.580 -1.022 18321 8328 1 7 . 1 1 39 39 ARG CB C 39 34.980 34.980 32.488 2.492 18321 8329 1 7 . 1 1 39 39 ARG H H 39 9.569 9.569 8.479 1.090 18321 8330 1 7 . 1 1 40 40 ASP N N 40 122.330 122.330 120.584 1.746 18321 8331 1 7 . 1 1 40 40 ASP HA H 40 4.785 4.785 5.046 -0.261 18321 8332 1 7 . 1 1 40 40 ASP C C 40 176.332 176.332 175.713 0.619 18321 8333 1 7 . 1 1 40 40 ASP CA C 40 55.334 55.334 55.146 0.188 18321 8334 1 7 . 1 1 40 40 ASP CB C 40 40.650 40.650 42.265 -1.615 18321 8335 1 7 . 1 1 40 40 ASP H H 40 8.413 8.413 8.467 -0.054 18321 8336 1 7 . 1 1 41 41 SER N N 41 114.363 114.363 120.992 -6.629 18321 8337 1 7 . 1 1 41 41 SER HA H 41 4.506 4.506 4.788 -0.282 18321 8338 1 7 . 1 1 41 41 SER CA C 41 57.525 57.525 57.352 0.173 18321 8339 1 7 . 1 1 41 41 SER CB C 41 63.706 63.706 64.701 -0.995 18321 8340 1 7 . 1 1 41 41 SER H H 41 7.791 7.791 8.242 -0.451 18321 8341 1 7 . 1 1 42 42 SER N N 42 126.932 126.932 116.767 10.165 18321 8342 1 7 . 1 1 42 42 SER HA H 42 4.410 4.410 4.803 -0.393 18321 8343 1 7 . 1 1 42 42 SER CA C 42 60.362 60.362 57.733 2.629 18321 8344 1 7 . 1 1 42 42 SER CB C 42 63.707 63.707 63.289 0.418 18321 8345 1 7 . 1 1 42 42 SER H H 42 10.519 10.519 8.779 1.740 18321 8346 1 7 . 1 1 43 43 THR HA H 43 4.097 4.097 4.214 -0.117 18321 8347 1 7 . 1 1 43 43 THR CA C 43 64.722 64.722 64.893 -0.171 18321 8348 1 7 . 1 1 43 43 THR CB C 43 69.439 69.439 69.730 -0.291 18321 8349 1 7 . 1 1 44 44 CYS HA H 44 5.100 5.100 4.811 0.289 18321 8350 1 7 . 1 1 44 44 CYS CA C 44 51.779 51.779 56.729 -4.950 18321 8351 1 7 . 1 1 44 44 CYS CB C 44 41.314 41.314 29.913 11.401 18321 8352 1 7 . 1 1 45 45 PRO HA H 45 4.278 4.278 4.161 0.117 18321 8353 1 7 . 1 1 45 45 PRO C C 45 178.127 178.127 176.980 1.147 18321 8354 1 7 . 1 1 45 45 PRO CA C 45 64.151 64.151 64.728 -0.577 18321 8355 1 7 . 1 1 45 45 PRO CB C 45 31.596 31.596 30.477 1.119 18321 8356 1 7 . 1 1 46 46 GLY N N 46 114.947 114.947 112.801 2.146 18321 8357 1 7 . 1 1 46 46 GLY C C 46 174.701 174.701 173.142 1.559 18321 8358 1 7 . 1 1 46 46 GLY CA C 46 45.225 45.225 44.773 0.452 18321 8359 1 7 . 1 1 46 46 GLY H H 46 8.812 8.812 8.669 0.143 18321 8360 1 7 . 1 1 47 47 ASP N N 47 120.862 120.862 122.150 -1.288 18321 8361 1 7 . 1 1 47 47 ASP HA H 47 5.235 5.235 4.728 0.507 18321 8362 1 7 . 1 1 47 47 ASP C C 47 176.480 176.480 174.854 1.626 18321 8363 1 7 . 1 1 47 47 ASP CA C 47 53.591 53.591 53.634 -0.043 18321 8364 1 7 . 1 1 47 47 ASP CB C 47 41.707 41.707 42.488 -0.781 18321 8365 1 7 . 1 1 47 47 ASP H H 47 7.997 7.997 8.078 -0.081 18321 8366 1 7 . 1 1 48 48 TYR N N 48 118.473 118.473 116.211 2.262 18321 8367 1 7 . 1 1 48 48 TYR HA H 48 5.431 5.431 5.265 0.166 18321 8368 1 7 . 1 1 48 48 TYR C C 48 173.783 173.783 175.336 -1.553 18321 8369 1 7 . 1 1 48 48 TYR CA C 48 56.891 56.891 56.238 0.653 18321 8370 1 7 . 1 1 48 48 TYR CB C 48 43.274 43.274 42.858 0.416 18321 8371 1 7 . 1 1 48 48 TYR H H 48 8.892 8.892 8.976 -0.084 18321 8372 1 7 . 1 1 49 49 VAL N N 49 119.105 119.105 119.222 -0.117 18321 8373 1 7 . 1 1 49 49 VAL HA H 49 4.800 4.800 4.751 0.049 18321 8374 1 7 . 1 1 49 49 VAL C C 49 174.397 174.397 174.913 -0.516 18321 8375 1 7 . 1 1 49 49 VAL CA C 49 61.439 61.439 61.643 -0.204 18321 8376 1 7 . 1 1 49 49 VAL CB C 49 35.388 35.388 34.123 1.265 18321 8377 1 7 . 1 1 49 49 VAL H H 49 9.661 9.661 8.580 1.081 18321 8378 1 7 . 1 1 50 50 LEU N N 50 129.599 129.599 131.533 -1.934 18321 8379 1 7 . 1 1 50 50 LEU HA H 50 5.033 5.033 5.099 -0.066 18321 8380 1 7 . 1 1 50 50 LEU C C 50 175.001 175.001 175.341 -0.340 18321 8381 1 7 . 1 1 50 50 LEU CA C 50 53.352 53.352 53.584 -0.232 18321 8382 1 7 . 1 1 50 50 LEU CB C 50 44.062 44.062 42.033 2.029 18321 8383 1 7 . 1 1 50 50 LEU H H 50 9.405 9.405 9.275 0.130 18321 8384 1 7 . 1 1 51 51 SER N N 51 126.895 126.895 124.425 2.470 18321 8385 1 7 . 1 1 51 51 SER HA H 51 5.731 5.731 5.188 0.543 18321 8386 1 7 . 1 1 51 51 SER C C 51 173.094 173.094 173.616 -0.522 18321 8387 1 7 . 1 1 51 51 SER CA C 51 58.834 58.834 57.377 1.457 18321 8388 1 7 . 1 1 51 51 SER CB C 51 64.977 64.977 63.998 0.979 18321 8389 1 7 . 1 1 51 51 SER H H 51 9.094 9.094 9.026 0.068 18321 8390 1 7 . 1 1 52 52 VAL N N 52 121.777 121.777 126.151 -4.374 18321 8391 1 7 . 1 1 52 52 VAL HA H 52 5.066 5.066 4.672 0.394 18321 8392 1 7 . 1 1 52 52 VAL C C 52 174.573 174.573 174.515 0.058 18321 8393 1 7 . 1 1 52 52 VAL CA C 52 59.535 59.535 61.148 -1.613 18321 8394 1 7 . 1 1 52 52 VAL CB C 52 36.834 36.834 35.454 1.380 18321 8395 1 7 . 1 1 52 52 VAL H H 52 8.816 8.816 8.817 -0.001 18321 8396 1 7 . 1 1 53 53 SER N N 53 120.489 120.489 120.581 -0.092 18321 8397 1 7 . 1 1 53 53 SER HA H 53 4.811 4.811 4.727 0.084 18321 8398 1 7 . 1 1 53 53 SER C C 53 174.065 174.065 172.682 1.383 18321 8399 1 7 . 1 1 53 53 SER CA C 53 57.496 57.496 57.624 -0.128 18321 8400 1 7 . 1 1 53 53 SER CB C 53 62.623 62.623 63.574 -0.951 18321 8401 1 7 . 1 1 53 53 SER H H 53 8.780 8.780 9.139 -0.359 18321 8402 1 7 . 1 1 54 54 GLU N N 54 132.020 132.020 128.031 3.989 18321 8403 1 7 . 1 1 54 54 GLU HA H 54 4.250 4.250 4.547 -0.297 18321 8404 1 7 . 1 1 54 54 GLU C C 54 175.387 175.387 174.800 0.587 18321 8405 1 7 . 1 1 54 54 GLU CA C 54 56.999 56.999 55.457 1.542 18321 8406 1 7 . 1 1 54 54 GLU CB C 54 32.556 32.556 33.542 -0.986 18321 8407 1 7 . 1 1 54 54 GLU H H 54 8.472 8.472 7.680 0.792 18321 8408 1 7 . 1 1 55 55 ASN N N 55 126.517 126.517 116.908 9.609 18321 8409 1 7 . 1 1 55 55 ASN HA H 55 4.220 4.220 4.114 0.106 18321 8410 1 7 . 1 1 55 55 ASN C C 55 174.546 174.546 174.552 -0.006 18321 8411 1 7 . 1 1 55 55 ASN CA C 55 54.770 54.770 54.097 0.673 18321 8412 1 7 . 1 1 55 55 ASN CB C 55 37.314 37.314 37.423 -0.110 18321 8413 1 7 . 1 1 55 55 ASN H H 55 8.853 8.853 8.265 0.588 18321 8414 1 7 . 1 1 56 56 SER N N 56 112.009 112.009 110.674 1.335 18321 8415 1 7 . 1 1 56 56 SER HA H 56 4.334 4.334 4.302 0.032 18321 8416 1 7 . 1 1 56 56 SER C C 56 173.354 173.354 173.625 -0.271 18321 8417 1 7 . 1 1 56 56 SER CA C 56 59.966 59.966 59.559 0.407 18321 8418 1 7 . 1 1 56 56 SER CB C 56 62.242 62.242 62.720 -0.478 18321 8419 1 7 . 1 1 56 56 SER H H 56 10.418 10.418 7.959 2.459 18321 8420 1 7 . 1 1 57 57 ARG N N 57 121.764 121.764 119.438 2.326 18321 8421 1 7 . 1 1 57 57 ARG HA H 57 5.167 5.167 4.394 0.773 18321 8422 1 7 . 1 1 57 57 ARG C C 57 174.983 174.983 174.366 0.617 18321 8423 1 7 . 1 1 57 57 ARG CA C 57 54.550 54.550 55.247 -0.697 18321 8424 1 7 . 1 1 57 57 ARG CB C 57 31.886 31.886 30.739 1.147 18321 8425 1 7 . 1 1 57 57 ARG H H 57 8.097 8.097 7.720 0.377 18321 8426 1 7 . 1 1 58 58 VAL N N 58 121.866 121.866 122.096 -0.230 18321 8427 1 7 . 1 1 58 58 VAL HA H 58 4.768 4.768 4.411 0.357 18321 8428 1 7 . 1 1 58 58 VAL C C 58 175.388 175.388 176.066 -0.678 18321 8429 1 7 . 1 1 58 58 VAL CA C 58 61.818 61.818 62.504 -0.686 18321 8430 1 7 . 1 1 58 58 VAL CB C 58 34.135 34.135 31.331 2.804 18321 8431 1 7 . 1 1 58 58 VAL H H 58 8.081 8.081 8.060 0.021 18321 8432 1 7 . 1 1 59 59 SER N N 59 124.445 124.445 123.620 0.825 18321 8433 1 7 . 1 1 59 59 SER HA H 59 4.462 4.462 4.326 0.136 18321 8434 1 7 . 1 1 59 59 SER C C 59 172.185 172.185 173.614 -1.429 18321 8435 1 7 . 1 1 59 59 SER CA C 59 56.629 56.629 58.639 -2.010 18321 8436 1 7 . 1 1 59 59 SER CB C 59 66.218 66.218 63.584 2.634 18321 8437 1 7 . 1 1 59 59 SER H H 59 9.082 9.082 8.008 1.074 18321 8438 1 7 . 1 1 60 60 HIS N N 60 121.224 121.224 125.952 -4.728 18321 8439 1 7 . 1 1 60 60 HIS HA H 60 4.885 4.885 4.714 0.171 18321 8440 1 7 . 1 1 60 60 HIS C C 60 174.674 174.674 173.931 0.743 18321 8441 1 7 . 1 1 60 60 HIS CA C 60 54.900 54.900 55.664 -0.764 18321 8442 1 7 . 1 1 60 60 HIS CB C 60 32.331 32.331 29.806 2.525 18321 8443 1 7 . 1 1 60 60 HIS H H 60 8.331 8.331 8.705 -0.374 18321 8444 1 7 . 1 1 61 61 TYR N N 61 124.780 124.780 124.489 0.291 18321 8445 1 7 . 1 1 61 61 TYR HA H 61 4.655 4.655 4.731 -0.076 18321 8446 1 7 . 1 1 61 61 TYR CA C 61 57.409 57.409 56.594 0.815 18321 8447 1 7 . 1 1 61 61 TYR CB C 61 39.785 39.785 39.160 0.625 18321 8448 1 7 . 1 1 61 61 TYR H H 61 9.273 9.273 9.164 0.109 18321 8449 1 7 . 1 1 62 62 ILE HA H 62 4.298 4.298 4.356 -0.058 18321 8450 1 7 . 1 1 62 62 ILE C C 62 174.817 174.817 175.596 -0.779 18321 8451 1 7 . 1 1 62 62 ILE CA C 62 61.908 61.908 61.959 -0.051 18321 8452 1 7 . 1 1 62 62 ILE CB C 62 38.321 38.321 39.332 -1.011 18321 8453 1 7 . 1 1 63 63 ILE N N 63 128.552 128.552 126.365 2.187 18321 8454 1 7 . 1 1 63 63 ILE HA H 63 4.788 4.788 4.824 -0.036 18321 8455 1 7 . 1 1 63 63 ILE C C 63 175.982 175.982 174.720 1.262 18321 8456 1 7 . 1 1 63 63 ILE CA C 63 59.629 59.629 59.953 -0.324 18321 8457 1 7 . 1 1 63 63 ILE CB C 63 39.747 39.747 39.191 0.556 18321 8458 1 7 . 1 1 63 63 ILE H H 63 9.155 9.155 9.015 0.140 18321 8459 1 7 . 1 1 64 64 ASN N N 64 123.240 123.240 127.029 -3.789 18321 8460 1 7 . 1 1 64 64 ASN HA H 64 4.857 4.857 5.072 -0.215 18321 8461 1 7 . 1 1 64 64 ASN C C 64 175.324 175.324 174.550 0.774 18321 8462 1 7 . 1 1 64 64 ASN CA C 64 53.736 53.736 52.716 1.020 18321 8463 1 7 . 1 1 64 64 ASN CB C 64 41.531 41.531 41.096 0.435 18321 8464 1 7 . 1 1 64 64 ASN H H 64 9.379 9.379 8.511 0.868 18321 8465 1 7 . 1 1 65 65 SER N N 65 121.157 121.157 118.137 3.020 18321 8466 1 7 . 1 1 65 65 SER HA H 65 4.548 4.548 4.614 -0.066 18321 8467 1 7 . 1 1 65 65 SER C C 65 174.328 174.328 174.541 -0.213 18321 8468 1 7 . 1 1 65 65 SER CA C 65 58.306 58.306 58.099 0.207 18321 8469 1 7 . 1 1 65 65 SER CB C 65 62.878 62.878 62.577 0.301 18321 8470 1 7 . 1 1 65 65 SER H H 65 9.195 9.195 8.599 0.596 18321 8471 1 7 . 1 1 66 66 LEU N N 66 127.417 127.417 128.885 -1.468 18321 8472 1 7 . 1 1 66 66 LEU HA H 66 4.605 4.605 4.550 0.055 18321 8473 1 7 . 1 1 66 66 LEU CA C 66 52.888 52.888 53.209 -0.321 18321 8474 1 7 . 1 1 66 66 LEU CB C 66 41.799 41.799 41.579 0.220 18321 8475 1 7 . 1 1 66 66 LEU H H 66 8.143 8.143 8.418 -0.275 18321 8476 1 7 . 1 1 68 68 ASN HA H 68 4.386 4.386 4.601 -0.215 18321 8477 1 7 . 1 1 68 68 ASN C C 68 174.487 174.487 175.532 -1.045 18321 8478 1 7 . 1 1 68 68 ASN CA C 68 53.365 53.365 52.508 0.857 18321 8479 1 7 . 1 1 68 68 ASN CB C 68 36.778 36.778 37.010 -0.232 18321 8480 1 7 . 1 1 69 69 ARG N N 69 111.329 111.329 117.326 -5.997 18321 8481 1 7 . 1 1 69 69 ARG HA H 69 3.876 3.876 3.863 0.013 18321 8482 1 7 . 1 1 69 69 ARG CA C 69 57.393 57.393 57.250 0.143 18321 8483 1 7 . 1 1 69 69 ARG CB C 69 26.665 26.665 27.929 -1.264 18321 8484 1 7 . 1 1 69 69 ARG H H 69 8.191 8.191 8.007 0.184 18321 8485 1 7 . 1 1 70 70 ARG N N 70 116.120 116.120 114.538 1.582 18321 8486 1 7 . 1 1 70 70 ARG HA H 70 4.556 4.556 5.155 -0.599 18321 8487 1 7 . 1 1 70 70 ARG C C 70 174.882 174.882 174.581 0.301 18321 8488 1 7 . 1 1 70 70 ARG CA C 70 55.509 55.509 54.004 1.505 18321 8489 1 7 . 1 1 70 70 ARG CB C 70 31.771 31.771 32.997 -1.226 18321 8490 1 7 . 1 1 70 70 ARG H H 70 6.667 6.667 7.685 -1.018 18321 8491 1 7 . 1 1 71 71 PHE N N 71 116.313 116.313 116.860 -0.547 18321 8492 1 7 . 1 1 71 71 PHE HA H 71 5.540 5.540 5.689 -0.149 18321 8493 1 7 . 1 1 71 71 PHE C C 71 174.391 174.391 174.753 -0.362 18321 8494 1 7 . 1 1 71 71 PHE CA C 71 57.528 57.528 56.169 1.359 18321 8495 1 7 . 1 1 71 71 PHE CB C 71 44.115 44.115 42.913 1.202 18321 8496 1 7 . 1 1 71 71 PHE H H 71 8.700 8.700 8.951 -0.251 18321 8497 1 7 . 1 1 72 72 LYS N N 72 122.770 122.770 125.235 -2.465 18321 8498 1 7 . 1 1 72 72 LYS HA H 72 5.483 5.483 4.924 0.559 18321 8499 1 7 . 1 1 72 72 LYS C C 72 173.923 173.923 175.666 -1.743 18321 8500 1 7 . 1 1 72 72 LYS CA C 72 54.855 54.855 55.055 -0.200 18321 8501 1 7 . 1 1 72 72 LYS CB C 72 37.710 37.710 33.067 4.643 18321 8502 1 7 . 1 1 72 72 LYS H H 72 9.138 9.138 8.720 0.418 18321 8503 1 7 . 1 1 73 73 ILE N N 73 124.576 124.576 130.827 -6.251 18321 8504 1 7 . 1 1 73 73 ILE HA H 73 4.955 4.955 5.238 -0.283 18321 8505 1 7 . 1 1 73 73 ILE C C 73 175.728 175.728 176.029 -0.301 18321 8506 1 7 . 1 1 73 73 ILE CA C 73 58.935 58.935 59.653 -0.718 18321 8507 1 7 . 1 1 73 73 ILE CB C 73 40.965 40.965 36.922 4.043 18321 8508 1 7 . 1 1 73 73 ILE H H 73 8.826 8.826 8.662 0.164 18321 8509 1 7 . 1 1 74 74 GLY N N 74 118.718 118.718 119.422 -0.704 18321 8510 1 7 . 1 1 74 74 GLY C C 74 174.436 174.436 173.579 0.857 18321 8511 1 7 . 1 1 74 74 GLY CA C 74 47.401 47.401 46.249 1.152 18321 8512 1 7 . 1 1 74 74 GLY H H 74 9.317 9.317 9.080 0.237 18321 8513 1 7 . 1 1 75 75 ASP N N 75 125.691 125.691 126.037 -0.346 18321 8514 1 7 . 1 1 75 75 ASP HA H 75 4.713 4.713 4.795 -0.082 18321 8515 1 7 . 1 1 75 75 ASP C C 75 175.841 175.841 176.045 -0.204 18321 8516 1 7 . 1 1 75 75 ASP CA C 75 53.815 53.815 54.572 -0.757 18321 8517 1 7 . 1 1 75 75 ASP CB C 75 41.288 41.288 42.050 -0.762 18321 8518 1 7 . 1 1 75 75 ASP H H 75 8.665 8.665 8.636 0.029 18321 8519 1 7 . 1 1 76 76 GLN N N 76 120.368 120.368 119.655 0.713 18321 8520 1 7 . 1 1 76 76 GLN C C 76 173.630 173.630 174.550 -0.920 18321 8521 1 7 . 1 1 76 76 GLN CA C 76 54.254 54.254 54.886 -0.632 18321 8522 1 7 . 1 1 76 76 GLN CB C 76 31.248 31.248 29.738 1.510 18321 8523 1 7 . 1 1 76 76 GLN H H 76 8.289 8.289 7.744 0.545 18321 8524 1 7 . 1 1 77 77 GLU N N 77 120.435 120.435 121.922 -1.487 18321 8525 1 7 . 1 1 77 77 GLU C C 77 175.484 175.484 174.805 0.679 18321 8526 1 7 . 1 1 77 77 GLU CA C 77 54.203 54.203 54.488 -0.285 18321 8527 1 7 . 1 1 77 77 GLU CB C 77 33.141 33.141 31.066 2.075 18321 8528 1 7 . 1 1 77 77 GLU H H 77 7.732 7.732 8.221 -0.489 18321 8529 1 7 . 1 1 78 78 PHE N N 78 117.911 117.911 123.448 -5.537 18321 8530 1 7 . 1 1 78 78 PHE HA H 78 4.659 4.659 4.812 -0.153 18321 8531 1 7 . 1 1 78 78 PHE C C 78 175.673 175.673 176.223 -0.550 18321 8532 1 7 . 1 1 78 78 PHE CA C 78 57.160 57.160 56.113 1.047 18321 8533 1 7 . 1 1 78 78 PHE CB C 78 45.405 45.405 41.655 3.750 18321 8534 1 7 . 1 1 78 78 PHE H H 78 9.235 9.235 8.793 0.442 18321 8535 1 7 . 1 1 79 79 ASP N N 79 119.296 119.296 118.565 0.731 18321 8536 1 7 . 1 1 79 79 ASP HA H 79 4.462 4.462 4.538 -0.076 18321 8537 1 7 . 1 1 79 79 ASP C C 79 174.482 174.482 175.862 -1.380 18321 8538 1 7 . 1 1 79 79 ASP CA C 79 56.629 56.629 56.737 -0.108 18321 8539 1 7 . 1 1 79 79 ASP CB C 79 41.697 41.697 41.442 0.255 18321 8540 1 7 . 1 1 79 79 ASP H H 79 9.187 9.187 8.789 0.398 18321 8541 1 7 . 1 1 80 80 HIS N N 80 107.631 107.631 110.294 -2.663 18321 8542 1 7 . 1 1 80 80 HIS HA H 80 5.022 5.022 5.122 -0.100 18321 8543 1 7 . 1 1 80 80 HIS C C 80 174.626 174.626 174.770 -0.144 18321 8544 1 7 . 1 1 80 80 HIS CA C 80 54.223 54.223 54.957 -0.734 18321 8545 1 7 . 1 1 80 80 HIS CB C 80 32.205 32.205 31.458 0.747 18321 8546 1 7 . 1 1 80 80 HIS H H 80 7.200 7.200 7.177 0.023 18321 8547 1 7 . 1 1 81 81 LEU N N 81 120.710 120.710 121.213 -0.503 18321 8548 1 7 . 1 1 81 81 LEU HA H 81 3.804 3.804 4.128 -0.324 18321 8549 1 7 . 1 1 81 81 LEU CA C 81 58.709 58.709 60.097 -1.388 18321 8550 1 7 . 1 1 81 81 LEU CB C 81 39.646 39.646 40.014 -0.368 18321 8551 1 7 . 1 1 81 81 LEU H H 81 8.886 8.886 9.143 -0.257 18321 8552 1 7 . 1 1 82 82 PRO HA H 82 4.020 4.020 4.407 -0.387 18321 8553 1 7 . 1 1 82 82 PRO C C 82 175.619 175.619 176.711 -1.092 18321 8554 1 7 . 1 1 82 82 PRO CA C 82 67.025 67.025 64.508 2.517 18321 8555 1 7 . 1 1 82 82 PRO CB C 82 30.962 30.962 31.263 -0.301 18321 8556 1 7 . 1 1 83 83 ALA N N 83 124.281 124.281 118.536 5.745 18321 8557 1 7 . 1 1 83 83 ALA HA H 83 4.019 4.019 4.227 -0.208 18321 8558 1 7 . 1 1 83 83 ALA C C 83 179.709 179.709 179.113 0.596 18321 8559 1 7 . 1 1 83 83 ALA CA C 83 54.985 54.985 53.464 1.521 18321 8560 1 7 . 1 1 83 83 ALA CB C 83 18.425 18.425 19.437 -1.012 18321 8561 1 7 . 1 1 83 83 ALA H H 83 8.527 8.527 7.451 1.076 18321 8562 1 7 . 1 1 84 84 LEU N N 84 122.960 122.960 117.752 5.208 18321 8563 1 7 . 1 1 84 84 LEU HA H 84 1.917 1.917 3.101 -1.184 18321 8564 1 7 . 1 1 84 84 LEU C C 84 177.652 177.652 178.209 -0.557 18321 8565 1 7 . 1 1 84 84 LEU CA C 84 58.261 58.261 57.276 0.985 18321 8566 1 7 . 1 1 84 84 LEU CB C 84 42.544 42.544 41.044 1.500 18321 8567 1 7 . 1 1 84 84 LEU H H 84 6.982 6.982 7.353 -0.371 18321 8568 1 7 . 1 1 85 85 LEU N N 85 117.940 117.940 118.742 -0.802 18321 8569 1 7 . 1 1 85 85 LEU HA H 85 3.463 3.463 3.818 -0.355 18321 8570 1 7 . 1 1 85 85 LEU C C 85 178.809 178.809 178.670 0.139 18321 8571 1 7 . 1 1 85 85 LEU CA C 85 57.522 57.522 57.543 -0.021 18321 8572 1 7 . 1 1 85 85 LEU CB C 85 41.242 41.242 41.195 0.047 18321 8573 1 7 . 1 1 85 85 LEU H H 85 7.773 7.773 7.827 -0.054 18321 8574 1 7 . 1 1 86 86 GLU N N 86 115.762 115.762 116.909 -1.147 18321 8575 1 7 . 1 1 86 86 GLU HA H 86 3.540 3.540 4.017 -0.477 18321 8576 1 7 . 1 1 86 86 GLU C C 86 180.228 180.228 177.339 2.889 18321 8577 1 7 . 1 1 86 86 GLU CA C 86 58.943 58.943 58.003 0.940 18321 8578 1 7 . 1 1 86 86 GLU CB C 86 29.561 29.561 29.583 -0.022 18321 8579 1 7 . 1 1 86 86 GLU H H 86 8.300 8.300 7.893 0.407 18321 8580 1 7 . 1 1 87 87 PHE N N 87 121.135 121.135 119.305 1.830 18321 8581 1 7 . 1 1 87 87 PHE HA H 87 4.122 4.122 4.180 -0.058 18321 8582 1 7 . 1 1 87 87 PHE C C 87 179.497 179.497 176.749 2.748 18321 8583 1 7 . 1 1 87 87 PHE CA C 87 62.090 62.090 60.024 2.066 18321 8584 1 7 . 1 1 87 87 PHE CB C 87 40.103 40.103 39.499 0.604 18321 8585 1 7 . 1 1 87 87 PHE H H 87 7.717 7.717 7.322 0.395 18321 8586 1 7 . 1 1 88 88 TYR N N 88 116.579 116.579 117.039 -0.460 18321 8587 1 7 . 1 1 88 88 TYR HA H 88 4.933 4.933 4.239 0.694 18321 8588 1 7 . 1 1 88 88 TYR C C 88 174.799 174.799 176.665 -1.866 18321 8589 1 7 . 1 1 88 88 TYR CA C 88 61.333 61.333 58.297 3.036 18321 8590 1 7 . 1 1 88 88 TYR CB C 88 36.539 36.539 37.129 -0.590 18321 8591 1 7 . 1 1 88 88 TYR H H 88 7.478 7.478 7.407 0.071 18321 8592 1 7 . 1 1 89 89 LYS N N 89 117.737 117.737 118.788 -1.051 18321 8593 1 7 . 1 1 89 89 LYS HA H 89 4.466 4.466 4.021 0.445 18321 8594 1 7 . 1 1 89 89 LYS C C 89 178.417 178.417 176.968 1.449 18321 8595 1 7 . 1 1 89 89 LYS CA C 89 59.486 59.486 58.435 1.051 18321 8596 1 7 . 1 1 89 89 LYS CB C 89 34.523 34.523 32.344 2.179 18321 8597 1 7 . 1 1 89 89 LYS H H 89 7.505 7.505 7.574 -0.069 18321 8598 1 7 . 1 1 90 90 ILE N N 90 110.972 110.972 111.211 -0.239 18321 8599 1 7 . 1 1 90 90 ILE HA H 90 4.181 4.181 4.171 0.010 18321 8600 1 7 . 1 1 90 90 ILE C C 90 174.571 174.571 175.926 -1.355 18321 8601 1 7 . 1 1 90 90 ILE CA C 90 60.516 60.516 61.468 -0.952 18321 8602 1 7 . 1 1 90 90 ILE CB C 90 39.979 39.979 37.802 2.177 18321 8603 1 7 . 1 1 90 90 ILE H H 90 6.710 6.710 7.253 -0.543 18321 8604 1 7 . 1 1 91 91 HIS N N 91 119.479 119.479 119.656 -0.177 18321 8605 1 7 . 1 1 91 91 HIS HA H 91 4.357 4.357 4.319 0.038 18321 8606 1 7 . 1 1 91 91 HIS C C 91 172.751 172.751 175.077 -2.326 18321 8607 1 7 . 1 1 91 91 HIS CA C 91 55.066 55.066 56.077 -1.011 18321 8608 1 7 . 1 1 91 91 HIS CB C 91 29.756 29.756 31.115 -1.359 18321 8609 1 7 . 1 1 91 91 HIS H H 91 7.460 7.460 7.244 0.216 18321 8610 1 7 . 1 1 92 92 TYR N N 92 117.642 117.642 115.464 2.178 18321 8611 1 7 . 1 1 92 92 TYR HA H 92 4.131 4.131 4.352 -0.221 18321 8612 1 7 . 1 1 92 92 TYR C C 92 177.348 177.348 175.684 1.664 18321 8613 1 7 . 1 1 92 92 TYR CA C 92 58.627 58.627 58.007 0.620 18321 8614 1 7 . 1 1 92 92 TYR CB C 92 39.481 39.481 35.694 3.787 18321 8615 1 7 . 1 1 92 92 TYR H H 92 8.067 8.067 7.498 0.569 18321 8616 1 7 . 1 1 93 93 LEU N N 93 123.560 123.560 115.144 8.416 18321 8617 1 7 . 1 1 93 93 LEU HA H 93 4.104 4.104 4.739 -0.635 18321 8618 1 7 . 1 1 93 93 LEU C C 93 175.610 175.610 176.799 -1.189 18321 8619 1 7 . 1 1 93 93 LEU CA C 93 56.381 56.381 54.353 2.028 18321 8620 1 7 . 1 1 93 93 LEU CB C 93 38.896 38.896 40.476 -1.580 18321 8621 1 7 . 1 1 93 93 LEU H H 93 7.907 7.907 8.034 -0.127 18321 8622 1 7 . 1 1 94 94 ASP N N 94 118.194 118.194 117.877 0.317 18321 8623 1 7 . 1 1 94 94 ASP HA H 94 4.940 4.940 4.841 0.099 18321 8624 1 7 . 1 1 94 94 ASP C C 94 176.123 176.123 176.080 0.043 18321 8625 1 7 . 1 1 94 94 ASP CA C 94 56.235 56.235 54.603 1.632 18321 8626 1 7 . 1 1 94 94 ASP CB C 94 42.078 42.078 41.080 0.998 18321 8627 1 7 . 1 1 94 94 ASP H H 94 8.640 8.640 7.746 0.894 18321 8628 1 7 . 1 1 95 95 THR N N 95 105.073 105.073 115.076 -10.003 18321 8629 1 7 . 1 1 95 95 THR HA H 95 4.318 4.318 3.918 0.400 18321 8630 1 7 . 1 1 95 95 THR C C 95 174.685 174.685 174.229 0.456 18321 8631 1 7 . 1 1 95 95 THR CA C 95 60.756 60.756 65.056 -4.300 18321 8632 1 7 . 1 1 95 95 THR CB C 95 71.058 71.058 68.421 2.637 18321 8633 1 7 . 1 1 95 95 THR H H 95 8.576 8.576 8.427 0.149 18321 8634 1 7 . 1 1 96 96 THR N N 96 116.817 116.817 114.618 2.199 18321 8635 1 7 . 1 1 96 96 THR HA H 96 5.129 5.129 4.808 0.321 18321 8636 1 7 . 1 1 96 96 THR C C 96 172.464 172.464 173.072 -0.608 18321 8637 1 7 . 1 1 96 96 THR CA C 96 60.762 60.762 60.295 0.467 18321 8638 1 7 . 1 1 96 96 THR CB C 96 71.425 71.425 70.304 1.121 18321 8639 1 7 . 1 1 96 96 THR H H 96 8.205 8.205 7.982 0.223 18321 8640 1 7 . 1 1 97 97 THR N N 97 114.324 114.324 113.996 0.328 18321 8641 1 7 . 1 1 97 97 THR HA H 97 5.128 5.128 4.282 0.846 18321 8642 1 7 . 1 1 97 97 THR C C 97 175.480 175.480 174.413 1.067 18321 8643 1 7 . 1 1 97 97 THR CA C 97 60.233 60.233 60.192 0.041 18321 8644 1 7 . 1 1 97 97 THR CB C 97 70.415 70.415 70.144 0.271 18321 8645 1 7 . 1 1 97 97 THR H H 97 7.128 7.128 8.205 -1.077 18321 8646 1 7 . 1 1 98 98 LEU N N 98 116.674 116.674 122.101 -5.427 18321 8647 1 7 . 1 1 98 98 LEU HA H 98 4.075 4.075 4.031 0.044 18321 8648 1 7 . 1 1 98 98 LEU C C 98 177.892 177.892 176.723 1.169 18321 8649 1 7 . 1 1 98 98 LEU CA C 98 59.597 59.597 54.880 4.717 18321 8650 1 7 . 1 1 98 98 LEU CB C 98 41.172 41.172 40.075 1.097 18321 8651 1 7 . 1 1 98 98 LEU H H 98 8.743 8.743 7.736 1.007 18321 8652 1 7 . 1 1 99 99 ILE N N 99 122.988 122.988 122.811 0.177 18321 8653 1 7 . 1 1 99 99 ILE HA H 99 4.415 4.415 4.040 0.375 18321 8654 1 7 . 1 1 99 99 ILE C C 99 175.055 175.055 176.073 -1.018 18321 8655 1 7 . 1 1 99 99 ILE CA C 99 62.183 62.183 62.331 -0.148 18321 8656 1 7 . 1 1 99 99 ILE CB C 99 40.252 40.252 38.798 1.454 18321 8657 1 7 . 1 1 99 99 ILE H H 99 8.998 8.998 8.193 0.805 18321 8658 1 7 . 1 1 100 100 GLU N N 100 114.067 114.067 113.926 0.141 18321 8659 1 7 . 1 1 100 100 GLU CA C 100 52.910 52.910 53.666 -0.756 18321 8660 1 7 . 1 1 100 100 GLU CB C 100 31.155 31.155 30.902 0.253 18321 8661 1 7 . 1 1 100 100 GLU H H 100 7.332 7.332 8.103 -0.771 18321 8662 1 7 . 1 1 101 101 PRO HA H 101 4.952 4.952 4.014 0.938 18321 8663 1 7 . 1 1 101 101 PRO C C 101 175.976 175.976 176.169 -0.193 18321 8664 1 7 . 1 1 101 101 PRO CA C 101 53.312 53.312 61.944 -8.633 18321 8665 1 7 . 1 1 101 101 PRO CB C 101 31.598 31.598 32.149 -0.551 18321 8666 1 7 . 1 1 102 102 ALA N N 102 125.968 125.968 124.004 1.964 18321 8667 1 7 . 1 1 102 102 ALA HA H 102 4.516 4.516 4.369 0.147 18321 8668 1 7 . 1 1 102 102 ALA CA C 102 49.852 49.852 49.653 0.200 18321 8669 1 7 . 1 1 102 102 ALA CB C 102 17.766 17.766 18.461 -0.695 18321 8670 1 7 . 1 1 102 102 ALA H H 102 8.232 8.232 7.993 0.239 18321 8671 1 7 . 1 1 103 103 PRO HA H 103 4.283 4.283 4.485 -0.202 18321 8672 1 7 . 1 1 103 103 PRO CA C 103 62.435 62.435 63.152 -0.717 18321 8673 1 7 . 1 1 103 103 PRO CB C 103 32.145 32.145 32.417 -0.272 18321 8674 1 7 . 1 1 104 104 ARG HA H 104 4.004 4.004 4.216 -0.212 18321 8675 1 7 . 1 1 104 104 ARG CA C 104 56.660 56.660 56.021 0.639 18321 8676 1 7 . 1 1 106 106 PRO C C 106 174.587 174.587 176.319 -1.732 18321 8677 1 7 . 1 1 106 106 PRO CA C 106 57.867 57.867 63.401 -5.535 18321 8678 1 7 . 1 1 106 106 PRO CB C 106 31.942 31.942 31.701 0.241 18321 8679 1 7 . 1 1 107 107 SER N N 107 121.280 121.280 115.063 6.217 18321 8680 1 7 . 1 1 107 107 SER CA C 107 61.772 61.772 57.809 3.963 18321 8681 1 7 . 1 1 107 107 SER CB C 107 63.234 63.234 62.579 0.655 18321 8682 1 7 . 1 1 107 107 SER H H 107 8.132 8.132 8.426 -0.294 18321 8683 1 7 . 1 1 109 109 PRO C C 109 177.129 177.129 176.281 0.848 18321 8684 1 7 . 1 1 109 109 PRO CA C 109 62.638 62.638 62.774 -0.136 18321 8685 1 7 . 1 1 109 109 PRO CB C 109 30.970 30.970 32.220 -1.250 18321 8686 1 7 . 1 1 110 110 MET N N 110 120.772 120.772 123.420 -2.648 18321 8687 1 7 . 1 1 110 110 MET C C 110 176.892 176.892 176.529 0.363 18321 8688 1 7 . 1 1 110 110 MET CA C 110 55.310 55.310 55.182 0.128 18321 8689 1 7 . 1 1 110 110 MET CB C 110 32.202 32.202 31.691 0.511 18321 8690 1 7 . 1 1 110 110 MET H H 110 8.430 8.430 8.305 0.125 18321 8691 1 7 . 1 1 111 111 GLY N N 111 110.158 110.158 113.314 -3.156 18321 8692 1 7 . 1 1 111 111 GLY C C 111 177.430 177.430 173.622 3.808 18321 8693 1 7 . 1 1 111 111 GLY CA C 111 44.951 44.951 44.406 0.545 18321 8694 1 7 . 1 1 111 111 GLY H H 111 8.384 8.384 7.952 0.432 18321 8695 1 7 . 1 1 112 112 SER N N 112 116.762 116.762 113.590 3.172 18321 8696 1 7 . 1 1 112 112 SER CA C 112 55.948 55.948 58.590 -2.642 18321 8697 1 7 . 1 1 112 112 SER CB C 112 62.745 62.745 62.851 -0.106 18321 8698 1 7 . 1 1 112 112 SER H H 112 8.161 8.161 8.155 0.006 18321 8699 1 7 . 1 1 113 113 VAL C C 113 176.083 176.083 175.752 0.331 18321 8700 1 7 . 1 1 114 114 SER N N 114 119.151 119.151 123.891 -4.740 18321 8701 1 7 . 1 1 114 114 SER C C 114 173.638 173.638 174.854 -1.216 18321 8702 1 7 . 1 1 114 114 SER CA C 114 58.005 58.005 57.273 0.732 18321 8703 1 7 . 1 1 114 114 SER CB C 114 63.169 63.169 64.346 -1.177 18321 8704 1 7 . 1 1 114 114 SER H H 114 8.319 8.319 8.249 0.070 18321 8705 1 7 . 1 1 115 115 ALA N N 115 126.914 126.914 124.433 2.481 18321 8706 1 7 . 1 1 115 115 ALA CA C 115 51.561 51.561 53.496 -1.935 18321 8707 1 7 . 1 1 115 115 ALA CB C 115 17.714 17.714 16.745 0.969 18321 8708 1 7 . 1 1 115 115 ALA H H 115 8.197 8.197 8.550 -0.353 18321 8709 1 7 . 1 1 119 119 PRO C C 119 177.065 177.065 178.562 -1.497 18321 8710 1 7 . 1 1 120 120 THR N N 120 113.976 113.976 104.753 9.223 18321 8711 1 7 . 1 1 120 120 THR C C 120 174.461 174.461 173.564 0.897 18321 8712 1 7 . 1 1 120 120 THR CA C 120 61.215 61.215 64.175 -2.960 18321 8713 1 7 . 1 1 120 120 THR CB C 120 69.508 69.508 67.849 1.659 18321 8714 1 7 . 1 1 120 120 THR H H 120 8.138 8.138 8.459 -0.321 18321 8715 1 7 . 1 1 121 121 ALA N N 121 125.859 125.859 122.701 3.158 18321 8716 1 7 . 1 1 121 121 ALA CA C 121 52.281 52.281 50.801 1.480 18321 8717 1 7 . 1 1 121 121 ALA CB C 121 18.623 18.623 21.539 -2.916 18321 8718 1 7 . 1 1 121 121 ALA H H 121 8.272 8.272 7.831 0.441 18321 8719 1 7 . 1 1 122 122 GLU C C 122 176.316 176.316 175.533 0.783 18321 8720 1 7 . 1 1 123 123 ASP N N 123 120.448 120.448 122.478 -2.030 18321 8721 1 7 . 1 1 123 123 ASP C C 123 175.906 175.906 174.935 0.971 18321 8722 1 7 . 1 1 123 123 ASP CA C 123 54.167 54.167 54.672 -0.506 18321 8723 1 7 . 1 1 123 123 ASP CB C 123 40.695 40.695 40.263 0.432 18321 8724 1 7 . 1 1 123 123 ASP H H 123 8.181 8.181 8.321 -0.140 18321 8725 1 7 . 1 1 124 124 ASN N N 124 118.207 118.207 120.848 -2.641 18321 8726 1 7 . 1 1 124 124 ASN C C 124 174.851 174.851 173.208 1.643 18321 8727 1 7 . 1 1 124 124 ASN CA C 124 52.771 52.771 53.213 -0.442 18321 8728 1 7 . 1 1 124 124 ASN CB C 124 38.304 38.304 40.238 -1.934 18321 8729 1 7 . 1 1 124 124 ASN H H 124 8.307 8.307 7.845 0.462 18321 8730 1 7 . 1 1 125 125 LEU N N 125 121.311 121.311 122.442 -1.131 18321 8731 1 7 . 1 1 125 125 LEU C C 125 175.750 175.750 175.487 0.263 18321 8732 1 7 . 1 1 125 125 LEU CA C 125 54.428 54.428 55.812 -1.384 18321 8733 1 7 . 1 1 125 125 LEU CB C 125 41.350 41.350 40.246 1.104 18321 8734 1 7 . 1 1 125 125 LEU H H 125 7.747 7.747 8.560 -0.813 18321 8735 1 7 . 1 1 126 126 GLU N N 126 122.485 122.485 119.813 2.672 18321 8736 1 7 . 1 1 126 126 GLU C C 126 174.008 174.008 174.178 -0.170 18321 8737 1 7 . 1 1 126 126 GLU CA C 126 54.855 54.855 56.472 -1.617 18321 8738 1 7 . 1 1 126 126 GLU CB C 126 30.472 30.472 31.421 -0.949 18321 8739 1 7 . 1 1 126 126 GLU H H 126 8.453 8.453 8.366 0.087 18321 8740 1 7 . 1 1 127 127 TYR N N 127 122.713 122.713 119.741 2.972 18321 8741 1 7 . 1 1 127 127 TYR C C 127 176.859 176.859 174.543 2.316 18321 8742 1 7 . 1 1 127 127 TYR CA C 127 56.528 56.528 57.281 -0.752 18321 8743 1 7 . 1 1 127 127 TYR CB C 127 40.982 40.982 40.707 0.275 18321 8744 1 7 . 1 1 127 127 TYR H H 127 8.469 8.469 7.974 0.495 18321 8745 1 7 . 1 1 128 128 VAL N N 128 112.432 112.432 123.214 -10.782 18321 8746 1 7 . 1 1 128 128 VAL C C 128 173.150 173.150 174.615 -1.465 18321 8747 1 7 . 1 1 128 128 VAL CA C 128 57.940 57.940 60.002 -2.062 18321 8748 1 7 . 1 1 128 128 VAL CB C 128 34.935 34.935 36.581 -1.645 18321 8749 1 7 . 1 1 128 128 VAL H H 128 9.078 9.078 8.897 0.181 18321 8750 1 7 . 1 1 129 129 ARG N N 129 120.373 120.373 121.550 -1.177 18321 8751 1 7 . 1 1 129 129 ARG C C 129 176.539 176.539 175.723 0.816 18321 8752 1 7 . 1 1 129 129 ARG CA C 129 52.534 52.534 54.125 -1.591 18321 8753 1 7 . 1 1 129 129 ARG CB C 129 32.942 32.942 32.930 0.012 18321 8754 1 7 . 1 1 129 129 ARG H H 129 9.010 9.010 8.624 0.386 18321 8755 1 7 . 1 1 130 130 THR N N 130 116.637 116.637 116.022 0.615 18321 8756 1 7 . 1 1 130 130 THR CA C 130 60.618 60.618 62.124 -1.506 18321 8757 1 7 . 1 1 130 130 THR CB C 130 69.170 69.170 69.399 -0.229 18321 8758 1 7 . 1 1 130 130 THR H H 130 9.045 9.045 8.332 0.713 18321 8759 1 7 . 1 1 131 131 LEU N N 131 122.910 122.910 123.493 -0.583 18321 8760 1 7 . 1 1 131 131 LEU C C 131 175.269 175.269 176.551 -1.282 18321 8761 1 7 . 1 1 131 131 LEU CA C 131 55.122 55.122 55.123 -0.001 18321 8762 1 7 . 1 1 131 131 LEU CB C 131 43.108 43.108 42.427 0.681 18321 8763 1 7 . 1 1 131 131 LEU H H 131 9.224 9.224 8.663 0.561 18321 8764 1 7 . 1 1 132 132 TYR N N 132 112.885 112.885 119.641 -6.756 18321 8765 1 7 . 1 1 132 132 TYR C C 132 173.818 173.818 175.370 -1.552 18321 8766 1 7 . 1 1 132 132 TYR CA C 132 54.230 54.230 58.499 -4.269 18321 8767 1 7 . 1 1 132 132 TYR CB C 132 42.672 42.672 41.609 1.063 18321 8768 1 7 . 1 1 132 132 TYR H H 132 7.284 7.284 7.957 -0.673 18321 8769 1 7 . 1 1 133 133 ASP N N 133 118.003 118.003 120.453 -2.450 18321 8770 1 7 . 1 1 133 133 ASP C C 133 175.779 175.779 174.390 1.389 18321 8771 1 7 . 1 1 133 133 ASP CA C 133 54.351 54.351 55.677 -1.326 18321 8772 1 7 . 1 1 133 133 ASP CB C 133 41.241 41.241 40.252 0.989 18321 8773 1 7 . 1 1 133 133 ASP H H 133 8.399 8.399 8.450 -0.051 18321 8774 1 7 . 1 1 134 134 PHE N N 134 121.081 121.081 124.031 -2.950 18321 8775 1 7 . 1 1 134 134 PHE CA C 134 52.552 52.552 55.213 -2.661 18321 8776 1 7 . 1 1 134 134 PHE CB C 134 41.217 41.217 42.109 -0.892 18321 8777 1 7 . 1 1 134 134 PHE H H 134 8.797 8.797 7.446 1.351 18321 8778 1 7 . 1 1 136 136 GLY C C 136 171.616 171.616 174.976 -3.360 18321 8779 1 7 . 1 1 137 137 ASN N N 137 119.394 119.394 115.649 3.745 18321 8780 1 7 . 1 1 137 137 ASN C C 137 174.500 174.500 173.776 0.724 18321 8781 1 7 . 1 1 137 137 ASN CA C 137 44.670 44.670 53.916 -9.245 18321 8782 1 7 . 1 1 137 137 ASN H H 137 9.477 9.477 8.416 1.061 18321 8783 1 7 . 1 1 138 138 ASP N N 138 120.608 120.608 118.387 2.221 18321 8784 1 7 . 1 1 138 138 ASP C C 138 176.987 176.987 174.609 2.378 18321 8785 1 7 . 1 1 138 138 ASP CA C 138 52.992 52.992 53.377 -0.385 18321 8786 1 7 . 1 1 138 138 ASP H H 138 8.216 8.216 7.914 0.302 18321 8787 1 7 . 1 1 139 139 ALA N N 139 124.371 124.371 121.359 3.012 18321 8788 1 7 . 1 1 139 139 ALA C C 139 178.472 178.472 179.115 -0.643 18321 8789 1 7 . 1 1 139 139 ALA CA C 139 54.513 54.513 53.779 0.734 18321 8790 1 7 . 1 1 139 139 ALA CB C 139 18.045 18.045 19.428 -1.383 18321 8791 1 7 . 1 1 139 139 ALA H H 139 8.565 8.565 8.547 0.018 18321 8792 1 7 . 1 1 140 140 GLU N N 140 115.022 115.022 117.531 -2.509 18321 8793 1 7 . 1 1 140 140 GLU C C 140 177.027 177.027 176.037 0.990 18321 8794 1 7 . 1 1 140 140 GLU CA C 140 56.181 56.181 57.868 -1.688 18321 8795 1 7 . 1 1 140 140 GLU CB C 140 28.619 28.619 30.605 -1.986 18321 8796 1 7 . 1 1 140 140 GLU H H 140 8.616 8.616 8.415 0.201 18321 8797 1 7 . 1 1 141 141 ASP N N 141 121.913 121.913 119.847 2.066 18321 8798 1 7 . 1 1 141 141 ASP C C 141 175.923 175.923 174.925 0.998 18321 8799 1 7 . 1 1 141 141 ASP CA C 141 54.736 54.736 53.304 1.432 18321 8800 1 7 . 1 1 141 141 ASP CB C 141 41.305 41.305 42.489 -1.184 18321 8801 1 7 . 1 1 141 141 ASP H H 141 7.636 7.636 7.894 -0.258 18321 8802 1 7 . 1 1 142 142 LEU N N 142 127.651 127.651 126.325 1.326 18321 8803 1 7 . 1 1 142 142 LEU CA C 142 50.955 50.955 53.063 -2.108 18321 8804 1 7 . 1 1 142 142 LEU CB C 142 42.343 42.343 43.574 -1.231 18321 8805 1 7 . 1 1 142 142 LEU H H 142 9.479 9.479 8.152 1.327 18321 8806 1 7 . 1 1 143 143 PRO C C 143 177.924 177.924 175.883 2.041 18321 8807 1 7 . 1 1 144 144 PHE N N 144 114.483 114.483 122.162 -7.679 18321 8808 1 7 . 1 1 144 144 PHE C C 144 175.055 175.055 174.644 0.411 18321 8809 1 7 . 1 1 144 144 PHE CA C 144 55.543 55.543 54.679 0.864 18321 8810 1 7 . 1 1 144 144 PHE CB C 144 40.581 40.581 41.914 -1.333 18321 8811 1 7 . 1 1 144 144 PHE H H 144 8.637 8.637 7.704 0.933 18321 8812 1 7 . 1 1 145 145 LYS N N 145 121.342 121.342 119.541 1.801 18321 8813 1 7 . 1 1 145 145 LYS C C 145 176.925 176.925 178.206 -1.281 18321 8814 1 7 . 1 1 145 145 LYS CA C 145 53.043 53.043 54.513 -1.470 18321 8815 1 7 . 1 1 145 145 LYS CB C 145 33.804 33.804 34.328 -0.524 18321 8816 1 7 . 1 1 145 145 LYS H H 145 9.418 9.418 8.753 0.665 18321 8817 1 7 . 1 1 146 146 LYS N N 146 123.378 123.378 118.879 4.499 18321 8818 1 7 . 1 1 146 146 LYS CA C 146 57.883 57.883 57.025 0.858 18321 8819 1 7 . 1 1 146 146 LYS CB C 146 32.008 32.008 32.477 -0.469 18321 8820 1 7 . 1 1 146 146 LYS H H 146 9.002 9.002 8.705 0.297 18321 8821 1 7 . 1 1 147 147 GLY C C 147 174.315 174.315 173.302 1.013 18321 8822 1 7 . 1 1 148 148 GLU N N 148 121.392 121.392 119.943 1.449 18321 8823 1 7 . 1 1 148 148 GLU C C 148 174.998 174.998 175.166 -0.168 18321 8824 1 7 . 1 1 148 148 GLU CA C 148 56.867 56.867 54.911 1.956 18321 8825 1 7 . 1 1 148 148 GLU CB C 148 31.649 31.649 32.137 -0.488 18321 8826 1 7 . 1 1 148 148 GLU H H 148 7.937 7.937 7.625 0.312 18321 8827 1 7 . 1 1 149 149 ILE N N 149 120.124 120.124 121.400 -1.276 18321 8828 1 7 . 1 1 149 149 ILE C C 149 176.647 176.647 174.940 1.707 18321 8829 1 7 . 1 1 149 149 ILE CA C 149 58.621 58.621 60.014 -1.393 18321 8830 1 7 . 1 1 149 149 ILE CB C 149 36.952 36.952 38.746 -1.794 18321 8831 1 7 . 1 1 149 149 ILE H H 149 8.346 8.346 8.563 -0.217 18321 8832 1 7 . 1 1 150 150 LEU N N 150 126.950 126.950 125.185 1.765 18321 8833 1 7 . 1 1 150 150 LEU CA C 150 51.967 51.967 52.972 -1.005 18321 8834 1 7 . 1 1 150 150 LEU CB C 150 44.182 44.182 45.975 -1.793 18321 8835 1 7 . 1 1 150 150 LEU H H 150 8.988 8.988 9.143 -0.155 18321 8836 1 7 . 1 1 151 151 VAL C C 151 175.670 175.670 175.431 0.239 18321 8837 1 7 . 1 1 152 152 ILE N N 152 124.997 124.997 128.445 -3.448 18321 8838 1 7 . 1 1 152 152 ILE CA C 152 58.331 58.331 60.283 -1.952 18321 8839 1 7 . 1 1 152 152 ILE CB C 152 34.093 34.093 35.197 -1.104 18321 8840 1 7 . 1 1 152 152 ILE H H 152 8.673 8.673 8.666 0.007 18321 8841 1 7 . 1 1 153 153 ILE N N 153 124.710 124.710 129.162 -4.452 18321 8842 1 7 . 1 1 153 153 ILE C C 153 176.264 176.264 175.458 0.806 18321 8843 1 7 . 1 1 154 154 GLU N N 154 117.398 117.398 119.314 -1.916 18321 8844 1 7 . 1 1 154 154 GLU C C 154 173.959 173.959 174.213 -0.254 18321 8845 1 7 . 1 1 154 154 GLU CA C 154 55.289 55.289 54.827 0.462 18321 8846 1 7 . 1 1 154 154 GLU CB C 154 32.842 32.842 33.072 -0.230 18321 8847 1 7 . 1 1 154 154 GLU H H 154 7.818 7.818 8.450 -0.632 18321 8848 1 7 . 1 1 155 155 LYS N N 155 121.130 121.130 123.917 -2.787 18321 8849 1 7 . 1 1 155 155 LYS CA C 155 53.022 53.022 52.646 0.376 18321 8850 1 7 . 1 1 155 155 LYS CB C 155 32.663 32.663 32.929 -0.266 18321 8851 1 7 . 1 1 155 155 LYS H H 155 8.654 8.654 9.317 -0.663 18321 8852 1 7 . 1 1 157 157 GLU C C 157 175.190 175.190 176.858 -1.668 18321 8853 1 7 . 1 1 157 157 GLU CA C 157 53.785 53.785 54.858 -1.073 18321 8854 1 7 . 1 1 157 157 GLU CB C 157 32.685 32.685 31.342 1.343 18321 8855 1 7 . 1 1 158 158 GLU N N 158 117.425 117.425 118.014 -0.589 18321 8856 1 7 . 1 1 158 158 GLU C C 158 178.600 178.600 177.611 0.989 18321 8857 1 7 . 1 1 158 158 GLU CA C 158 59.044 59.044 58.034 1.010 18321 8858 1 7 . 1 1 158 158 GLU CB C 158 29.706 29.706 30.182 -0.476 18321 8859 1 7 . 1 1 158 158 GLU H H 158 8.678 8.678 8.802 -0.124 18321 8860 1 7 . 1 1 159 159 GLN N N 159 110.925 110.925 117.935 -7.010 18321 8861 1 7 . 1 1 159 159 GLN C C 159 175.539 175.539 174.345 1.194 18321 8862 1 7 . 1 1 159 159 GLN CA C 159 54.942 54.942 55.964 -1.022 18321 8863 1 7 . 1 1 159 159 GLN CB C 159 28.572 28.572 29.421 -0.849 18321 8864 1 7 . 1 1 159 159 GLN H H 159 8.483 8.483 8.258 0.225 18321 8865 1 7 . 1 1 160 160 TRP N N 160 120.171 120.171 119.252 0.919 18321 8866 1 7 . 1 1 160 160 TRP C C 160 173.444 173.444 174.929 -1.485 18321 8867 1 7 . 1 1 160 160 TRP CA C 160 56.175 56.175 55.641 0.534 18321 8868 1 7 . 1 1 160 160 TRP CB C 160 31.796 31.796 32.709 -0.913 18321 8869 1 7 . 1 1 160 160 TRP H H 160 6.826 6.826 7.491 -0.665 18321 8870 1 7 . 1 1 161 161 TRP N N 161 120.687 120.687 120.959 -0.272 18321 8871 1 7 . 1 1 161 161 TRP C C 161 174.736 174.736 175.796 -1.060 18321 8872 1 7 . 1 1 161 161 TRP CA C 161 51.889 51.889 54.532 -2.643 18321 8873 1 7 . 1 1 161 161 TRP CB C 161 32.772 32.772 32.442 0.330 18321 8874 1 7 . 1 1 161 161 TRP H H 161 8.462 8.462 9.252 -0.790 18321 8875 1 7 . 1 1 162 162 SER N N 162 115.691 115.691 119.361 -3.670 18321 8876 1 7 . 1 1 162 162 SER C C 162 174.320 174.320 173.474 0.846 18321 8877 1 7 . 1 1 162 162 SER CA C 162 57.011 57.011 58.693 -1.682 18321 8878 1 7 . 1 1 162 162 SER CB C 162 63.948 63.948 63.017 0.931 18321 8879 1 7 . 1 1 162 162 SER H H 162 8.830 8.830 9.023 -0.193 18321 8880 1 7 . 1 1 163 163 ALA N N 163 130.630 130.630 128.496 2.134 18321 8881 1 7 . 1 1 163 163 ALA CA C 163 50.029 50.029 49.993 0.036 18321 8882 1 7 . 1 1 163 163 ALA CB C 163 25.500 25.500 22.275 3.225 18321 8883 1 7 . 1 1 163 163 ALA H H 163 9.585 9.585 9.188 0.397 18321 8884 1 7 . 1 1 164 164 ARG N N 164 117.526 117.526 120.679 -3.153 18321 8885 1 7 . 1 1 164 164 ARG C C 164 176.719 176.719 176.785 -0.066 18321 8886 1 7 . 1 1 164 164 ARG CA C 164 52.975 52.975 54.036 -1.061 18321 8887 1 7 . 1 1 164 164 ARG CB C 164 34.260 34.260 30.668 3.592 18321 8888 1 7 . 1 1 164 164 ARG H H 164 9.097 9.097 9.092 0.005 18321 8889 1 7 . 1 1 165 165 ASN N N 165 123.935 123.935 123.020 0.915 18321 8890 1 7 . 1 1 165 165 ASN C C 165 178.484 178.484 177.263 1.221 18321 8891 1 7 . 1 1 165 165 ASN CA C 165 50.332 50.332 54.261 -3.929 18321 8892 1 7 . 1 1 165 165 ASN CB C 165 39.487 39.487 39.590 -0.103 18321 8893 1 7 . 1 1 165 165 ASN H H 165 8.756 8.756 9.050 -0.294 18321 8894 1 7 . 1 1 166 166 LYS N N 166 118.464 118.464 122.124 -3.660 18321 8895 1 7 . 1 1 166 166 LYS C C 166 176.967 176.967 177.058 -0.091 18321 8896 1 7 . 1 1 166 166 LYS CA C 166 58.430 58.430 58.213 0.217 18321 8897 1 7 . 1 1 166 166 LYS CB C 166 30.918 30.918 32.294 -1.375 18321 8898 1 7 . 1 1 166 166 LYS H H 166 8.915 8.915 9.560 -0.645 18321 8899 1 7 . 1 1 167 167 ASP N N 167 118.138 118.138 114.957 3.181 18321 8900 1 7 . 1 1 167 167 ASP C C 167 176.464 176.464 176.390 0.074 18321 8901 1 7 . 1 1 167 167 ASP CA C 167 54.212 54.212 54.407 -0.195 18321 8902 1 7 . 1 1 167 167 ASP CB C 167 41.178 41.178 41.423 -0.245 18321 8903 1 7 . 1 1 167 167 ASP H H 167 7.508 7.508 8.540 -1.032 18321 8904 1 7 . 1 1 168 168 GLY N N 168 107.901 107.901 108.319 -0.418 18321 8905 1 7 . 1 1 168 168 GLY C C 168 173.613 173.613 173.111 0.502 18321 8906 1 7 . 1 1 168 168 GLY CA C 168 44.783 44.783 45.112 -0.329 18321 8907 1 7 . 1 1 168 168 GLY H H 168 8.173 8.173 8.080 0.093 18321 8908 1 7 . 1 1 169 169 ARG N N 169 124.324 124.324 119.457 4.867 18321 8909 1 7 . 1 1 169 169 ARG CA C 169 56.106 56.106 54.400 1.706 18321 8910 1 7 . 1 1 169 169 ARG CB C 169 29.648 29.648 32.985 -3.337 18321 8911 1 7 . 1 1 169 169 ARG H H 169 7.998 7.998 8.131 -0.133 18321 8912 1 7 . 1 1 170 170 VAL C C 170 177.590 177.590 175.084 2.506 18321 8913 1 7 . 1 1 171 171 GLY N N 171 112.582 112.582 113.441 -0.859 18321 8914 1 7 . 1 1 171 171 GLY C C 171 170.991 170.991 172.478 -1.487 18321 8915 1 7 . 1 1 171 171 GLY CA C 171 45.361 45.361 45.144 0.217 18321 8916 1 7 . 1 1 171 171 GLY H H 171 9.013 9.013 8.675 0.338 18321 8917 1 7 . 1 1 172 172 MET N N 172 117.368 117.368 121.533 -4.165 18321 8918 1 7 . 1 1 172 172 MET C C 172 177.921 177.921 176.514 1.407 18321 8919 1 7 . 1 1 172 172 MET CA C 172 53.536 53.536 56.939 -3.403 18321 8920 1 7 . 1 1 172 172 MET CB C 172 30.838 30.838 33.869 -3.031 18321 8921 1 7 . 1 1 172 172 MET H H 172 8.885 8.885 8.769 0.116 18321 8922 1 7 . 1 1 173 173 ILE N N 173 113.130 113.130 117.430 -4.300 18321 8923 1 7 . 1 1 173 173 ILE CA C 173 56.284 56.284 57.378 -1.094 18321 8924 1 7 . 1 1 173 173 ILE CB C 173 40.870 40.870 39.759 1.111 18321 8925 1 7 . 1 1 173 173 ILE H H 173 9.704 9.704 9.383 0.321 18321 8926 1 7 . 1 1 174 174 PRO C C 174 176.714 176.714 177.504 -0.790 18321 8927 1 7 . 1 1 174 174 PRO CA C 174 66.290 66.290 60.636 5.654 18321 8928 1 7 . 1 1 174 174 PRO CB C 174 28.993 28.993 30.643 -1.650 18321 8929 1 7 . 1 1 175 175 VAL N N 175 128.066 128.066 123.643 4.423 18321 8930 1 7 . 1 1 175 175 VAL CA C 175 59.356 59.356 67.676 -8.320 18321 8931 1 7 . 1 1 175 175 VAL H H 175 7.327 7.327 8.023 -0.696 18321 8932 1 7 . 1 1 176 176 PRO C C 176 176.351 176.351 176.976 -0.625 18321 8933 1 7 . 1 1 177 177 TYR N N 177 115.756 115.756 114.086 1.670 18321 8934 1 7 . 1 1 177 177 TYR C C 177 175.011 175.011 176.460 -1.449 18321 8935 1 7 . 1 1 177 177 TYR CA C 177 56.756 56.756 58.484 -1.728 18321 8936 1 7 . 1 1 177 177 TYR CB C 177 37.507 37.507 38.890 -1.383 18321 8937 1 7 . 1 1 177 177 TYR H H 177 7.784 7.784 7.710 0.074 18321 8938 1 7 . 1 1 178 178 VAL N N 178 111.428 111.428 113.432 -2.004 18321 8939 1 7 . 1 1 178 178 VAL C C 178 173.417 173.417 174.709 -1.292 18321 8940 1 7 . 1 1 178 178 VAL CA C 178 58.307 58.307 59.116 -0.809 18321 8941 1 7 . 1 1 178 178 VAL CB C 178 34.602 34.602 34.913 -0.310 18321 8942 1 7 . 1 1 178 178 VAL H H 178 7.801 7.801 7.285 0.516 18321 8943 1 7 . 1 1 179 179 GLU N N 179 118.581 118.581 116.721 1.860 18321 8944 1 7 . 1 1 179 179 GLU C C 179 175.225 175.225 176.113 -0.888 18321 8945 1 7 . 1 1 179 179 GLU CA C 179 53.114 53.114 56.419 -3.305 18321 8946 1 7 . 1 1 179 179 GLU CB C 179 32.712 32.712 30.908 1.804 18321 8947 1 7 . 1 1 179 179 GLU H H 179 8.819 8.819 9.013 -0.194 18321 8948 1 7 . 1 1 180 180 LYS N N 180 124.167 124.167 118.112 6.055 18321 8949 1 7 . 1 1 180 180 LYS C C 180 176.303 176.303 174.409 1.894 18321 8950 1 7 . 1 1 180 180 LYS CA C 180 57.318 57.318 55.648 1.670 18321 8951 1 7 . 1 1 180 180 LYS CB C 180 31.675 31.675 36.142 -4.467 18321 8952 1 7 . 1 1 180 180 LYS H H 180 8.775 8.775 7.760 1.015 18321 8953 1 7 . 1 1 181 181 LEU N N 181 125.157 125.157 119.557 5.600 18321 8954 1 7 . 1 1 181 181 LEU C C 181 176.462 176.462 176.907 -0.445 18321 8955 1 7 . 1 1 181 181 LEU CA C 181 54.470 54.470 56.313 -1.843 18321 8956 1 7 . 1 1 181 181 LEU CB C 181 41.625 41.625 43.526 -1.901 18321 8957 1 7 . 1 1 181 181 LEU H H 181 8.084 8.084 8.623 -0.539 18321 8958 1 7 . 1 1 182 182 VAL N N 182 123.167 123.167 118.029 5.138 18321 8959 1 7 . 1 1 182 182 VAL C C 182 175.983 175.983 176.149 -0.166 18321 8960 1 7 . 1 1 182 182 VAL CA C 182 61.613 61.613 62.440 -0.827 18321 8961 1 7 . 1 1 182 182 VAL CB C 182 32.085 32.085 32.437 -0.352 18321 8962 1 7 . 1 1 182 182 VAL H H 182 8.345 8.345 7.924 0.421 18321 8963 1 7 . 1 1 183 183 ARG N N 183 125.775 125.775 119.766 6.009 18321 8964 1 7 . 1 1 183 183 ARG CA C 183 57.801 57.801 56.944 0.857 18321 8965 1 7 . 1 1 183 183 ARG CB C 183 30.091 30.091 30.097 -0.006 18321 8966 1 7 . 1 1 183 183 ARG H H 183 8.530 8.530 8.439 0.091 18321 8967 1 7 . 1 1 184 184 SER C C 184 173.239 173.239 174.027 -0.788 18321 8968 1 7 . 1 1 185 185 SER N N 185 116.511 116.511 114.657 1.854 18321 8969 1 7 . 1 1 185 185 SER CA C 185 58.428 58.428 57.200 1.228 18321 8970 1 7 . 1 1 185 185 SER CB C 185 69.737 69.737 62.896 6.841 18321 8971 1 7 . 1 1 185 185 SER H H 185 7.944 7.944 7.958 -0.014 18321 8972 1 7 . 1 1 190 190 HIS C C 190 176.953 176.953 175.289 1.664 18321 8973 1 7 . 1 1 190 190 HIS CA C 190 54.229 54.229 54.041 0.188 18321 8974 1 7 . 1 1 190 190 HIS CB C 190 35.112 35.112 29.065 6.047 18321 8975 1 7 . 1 1 191 191 GLY N N 191 109.491 109.491 111.113 -1.622 18321 8976 1 7 . 1 1 191 191 GLY C C 191 172.295 172.295 172.901 -0.606 18321 8977 1 7 . 1 1 191 191 GLY CA C 191 45.227 45.227 44.862 0.365 18321 8978 1 7 . 1 1 191 191 GLY H H 191 8.719 8.719 8.256 0.463 18321 8979 1 7 . 1 1 192 192 ASN N N 192 118.700 118.700 117.705 0.995 18321 8980 1 7 . 1 1 192 192 ASN HA H 192 4.312 4.312 4.486 -0.174 18321 8981 1 7 . 1 1 192 192 ASN C C 192 176.369 176.369 174.245 2.124 18321 8982 1 7 . 1 1 192 192 ASN CA C 192 57.787 57.787 53.589 4.198 18321 8983 1 7 . 1 1 192 192 ASN H H 192 7.508 7.508 8.580 -1.072 18321 8984 1 7 . 1 1 193 193 ARG N N 193 120.743 120.743 121.697 -0.954 18321 8985 1 7 . 1 1 193 193 ARG H H 193 9.032 9.032 8.586 0.446 18321 8986 1 7 . 1 1 197 197 SER HA H 197 4.388 4.388 4.045 0.343 18321 8987 1 7 . 1 1 197 197 SER C C 197 174.133 174.133 173.777 0.356 18321 8988 1 7 . 1 1 197 197 SER CA C 197 58.128 58.128 58.624 -0.497 18321 8989 1 7 . 1 1 197 197 SER CB C 197 62.966 62.966 63.500 -0.534 18321 8990 1 7 . 1 1 198 198 TYR N N 198 121.435 121.435 119.306 2.129 18321 8991 1 7 . 1 1 198 198 TYR HA H 198 4.543 4.543 4.623 -0.080 18321 8992 1 7 . 1 1 198 198 TYR C C 198 176.230 176.230 176.980 -0.750 18321 8993 1 7 . 1 1 198 198 TYR CA C 198 57.536 57.536 58.315 -0.779 18321 8994 1 7 . 1 1 198 198 TYR CB C 198 38.279 38.279 39.596 -1.317 18321 8995 1 7 . 1 1 198 198 TYR H H 198 8.071 8.071 8.342 -0.271 18321 8996 1 7 . 1 1 199 199 GLY N N 199 110.039 110.039 110.428 -0.389 18321 8997 1 7 . 1 1 199 199 GLY C C 199 173.475 173.475 174.042 -0.567 18321 8998 1 7 . 1 1 199 199 GLY CA C 199 44.805 44.805 46.390 -1.585 18321 8999 1 7 . 1 1 199 199 GLY H H 199 8.162 8.162 7.935 0.227 18321 9000 1 7 . 1 1 200 200 ILE N N 200 121.530 121.530 124.646 -3.116 18321 9001 1 7 . 1 1 200 200 ILE CA C 200 58.102 58.102 57.566 0.535 18321 9002 1 7 . 1 1 200 200 ILE CB C 200 37.760 37.760 39.376 -1.615 18321 9003 1 7 . 1 1 200 200 ILE H H 200 7.851 7.851 7.857 -0.006 18321 9004 1 7 . 1 1 201 201 PRO C C 201 176.485 176.485 175.153 1.332 18321 9005 1 7 . 1 1 201 201 PRO CA C 201 53.893 53.893 62.550 -8.657 18321 9006 1 7 . 1 1 201 201 PRO CB C 201 29.042 29.042 32.308 -3.266 18321 9007 1 7 . 1 1 202 202 GLU N N 202 122.468 122.468 120.987 1.481 18321 9008 1 7 . 1 1 202 202 GLU CA C 202 62.490 62.490 54.934 7.556 18321 9009 1 7 . 1 1 202 202 GLU CB C 202 31.170 31.170 29.543 1.627 18321 9010 1 7 . 1 1 202 202 GLU H H 202 8.328 8.328 8.669 -0.341 18321 9011 1 7 . 1 1 203 203 PRO CA C 203 62.803 62.803 63.231 -0.428 18321 9012 1 7 . 1 1 203 203 PRO CB C 203 31.220 31.220 32.218 -0.998 18321 9013 1 7 . 1 1 204 204 ALA N N 204 123.251 123.251 121.980 1.271 18321 9014 1 7 . 1 1 204 204 ALA HA H 204 4.180 4.180 4.311 -0.131 18321 9015 1 7 . 1 1 204 204 ALA CA C 204 52.124 52.124 51.939 0.185 18321 9016 1 7 . 1 1 204 204 ALA CB C 204 18.892 18.892 19.196 -0.304 18321 9017 1 7 . 1 1 204 204 ALA H H 204 8.308 8.308 7.787 0.521 18321 9018 1 7 . 1 1 205 205 HIS N N 205 117.874 117.874 119.914 -2.040 18321 9019 1 7 . 1 1 205 205 HIS C C 205 173.282 173.282 174.057 -0.775 18321 9020 1 7 . 1 1 205 205 HIS H H 205 8.045 8.045 8.637 -0.592 18321 9021 1 7 . 1 1 206 206 ALA N N 206 125.519 125.519 123.014 2.505 18321 9022 1 7 . 1 1 206 206 ALA HA H 206 4.204 4.204 4.465 -0.261 18321 9023 1 7 . 1 1 206 206 ALA CA C 206 40.196 40.196 52.111 -11.915 18321 9024 1 7 . 1 1 206 206 ALA CB C 206 19.407 19.407 20.787 -1.380 18321 9025 1 7 . 1 1 206 206 ALA H H 206 8.061 8.061 7.764 0.297 18321 9026 1 7 . 1 1 207 207 TYR N N 207 120.381 120.381 119.291 1.090 18321 9027 1 7 . 1 1 207 207 TYR HA H 207 4.570 4.570 4.079 0.491 18321 9028 1 7 . 1 1 207 207 TYR CA C 207 52.572 52.572 58.322 -5.750 18321 9029 1 7 . 1 1 207 207 TYR CB C 207 41.333 41.333 35.672 5.661 18321 9030 1 7 . 1 1 207 207 TYR H H 207 8.199 8.199 7.347 0.852 18321 9031 1 7 . 1 1 208 208 ALA HA H 208 4.281 4.281 4.448 -0.167 18321 9032 1 7 . 1 1 208 208 ALA C C 208 177.736 177.736 177.226 0.510 18321 9033 1 7 . 1 1 208 208 ALA CA C 208 52.084 52.084 52.044 0.040 18321 9034 1 7 . 1 1 208 208 ALA CB C 208 18.999 18.999 18.570 0.430 18321 9035 1 7 . 1 1 209 209 GLN N N 209 119.295 119.295 124.674 -5.379 18321 9036 1 7 . 1 1 209 209 GLN CA C 209 61.474 61.474 52.280 9.194 18321 9037 1 7 . 1 1 209 209 GLN CB C 209 32.039 32.039 28.797 3.242 18321 9038 1 7 . 1 1 209 209 GLN H H 209 8.125 8.125 7.832 0.293 18321 9039 1 7 . 1 1 210 210 PRO HA H 210 4.395 4.395 4.387 0.008 18321 9040 1 7 . 1 1 210 210 PRO CA C 210 62.584 62.584 63.372 -0.788 18321 9041 1 7 . 1 1 211 211 GLN HA H 211 4.377 4.377 4.619 -0.241 18321 9042 1 7 . 1 1 211 211 GLN CA C 211 55.859 55.859 54.655 1.204 18321 9043 1 7 . 1 1 211 211 GLN CB C 211 29.577 29.577 31.419 -1.842 18321 9044 1 7 . 1 1 212 212 THR C C 212 176.551 176.551 175.456 1.095 18321 9045 1 7 . 1 1 212 212 THR CB C 212 69.890 69.890 69.061 0.829 18321 9046 1 7 . 1 1 213 213 THR N N 213 108.487 108.487 117.806 -9.319 18321 9047 1 7 . 1 1 213 213 THR CA C 213 61.236 61.236 61.073 0.163 18321 9048 1 7 . 1 1 213 213 THR CB C 213 69.091 69.091 68.911 0.180 18321 9049 1 7 . 1 1 213 213 THR H H 213 8.243 8.243 8.047 0.196 18321 9050 1 7 . 1 1 214 214 THR N N 214 119.445 119.445 122.589 -3.144 18321 9051 1 7 . 1 1 214 214 THR CA C 214 59.425 59.425 60.629 -1.204 18321 9052 1 7 . 1 1 214 214 THR CB C 214 69.251 69.251 69.093 0.158 18321 9053 1 7 . 1 1 214 214 THR H H 214 8.188 8.188 8.160 0.028 18321 9054 1 7 . 1 1 215 215 PRO HA H 215 4.361 4.361 4.602 -0.241 18321 9055 1 7 . 1 1 215 215 PRO C C 215 175.422 175.422 175.695 -0.273 18321 9056 1 7 . 1 1 215 215 PRO CA C 215 63.320 63.320 62.987 0.333 18321 9057 1 7 . 1 1 215 215 PRO CB C 215 31.918 31.918 31.232 0.686 18321 9058 1 7 . 1 1 216 216 LEU N N 216 121.602 121.602 122.757 -1.155 18321 9059 1 7 . 1 1 216 216 LEU CA C 216 52.203 52.203 55.732 -3.529 18321 9060 1 7 . 1 1 216 216 LEU CB C 216 42.451 42.451 40.576 1.875 18321 9061 1 7 . 1 1 216 216 LEU H H 216 7.891 7.891 7.888 0.003 18321 9062 1 7 . 1 1 217 217 PRO HA H 217 4.398 4.398 4.393 0.005 18321 9063 1 7 . 1 1 217 217 PRO C C 217 176.577 176.577 175.855 0.722 18321 9064 1 7 . 1 1 217 217 PRO CA C 217 62.984 62.984 63.736 -0.752 18321 9065 1 7 . 1 1 217 217 PRO CB C 217 32.056 32.056 32.218 -0.162 18321 9066 1 7 . 1 1 218 218 ALA N N 218 124.087 124.087 117.306 6.781 18321 9067 1 7 . 1 1 218 218 ALA HA H 218 4.309 4.309 4.444 -0.135 18321 9068 1 7 . 1 1 218 218 ALA C C 218 177.844 177.844 177.430 0.414 18321 9069 1 7 . 1 1 218 218 ALA CA C 218 52.379 52.379 51.810 0.569 18321 9070 1 7 . 1 1 218 218 ALA CB C 218 19.133 19.133 20.458 -1.325 18321 9071 1 7 . 1 1 218 218 ALA H H 218 8.261 8.261 7.353 0.908 18321 9072 1 7 . 1 1 219 219 VAL N N 219 118.942 118.942 121.228 -2.286 18321 9073 1 7 . 1 1 219 219 VAL HA H 219 4.142 4.142 3.852 0.290 18321 9074 1 7 . 1 1 219 219 VAL CA C 219 62.102 62.102 64.733 -2.631 18321 9075 1 7 . 1 1 219 219 VAL CB C 219 32.923 32.923 31.585 1.338 18321 9076 1 7 . 1 1 219 219 VAL H H 219 8.049 8.049 8.628 -0.579 18321 9077 1 7 . 1 1 220 220 SER N N 220 119.207 119.207 113.802 5.405 18321 9078 1 7 . 1 1 220 220 SER HA H 220 4.436 4.436 4.475 -0.039 18321 9079 1 7 . 1 1 220 220 SER CA C 220 57.813 57.813 58.718 -0.905 18321 9080 1 7 . 1 1 220 220 SER CB C 220 63.375 63.375 63.448 -0.073 18321 9081 1 7 . 1 1 220 220 SER H H 220 8.275 8.275 7.995 0.280 18321 9082 1 7 . 1 1 221 221 GLY N N 221 110.973 110.973 111.312 -0.339 18321 9083 1 7 . 1 1 221 221 GLY C C 221 173.962 173.962 173.632 0.330 18321 9084 1 7 . 1 1 221 221 GLY CA C 221 45.286 45.286 44.706 0.580 18321 9085 1 7 . 1 1 221 221 GLY H H 221 8.374 8.374 7.378 0.996 18321 9086 1 7 . 1 1 222 222 SER N N 222 115.516 115.516 119.508 -3.992 18321 9087 1 7 . 1 1 222 222 SER HA H 222 4.763 4.763 4.589 0.174 18321 9088 1 7 . 1 1 222 222 SER CA C 222 56.407 56.407 57.127 -0.720 18321 9089 1 7 . 1 1 222 222 SER CB C 222 63.993 63.993 63.528 0.465 18321 9090 1 7 . 1 1 222 222 SER H H 222 8.155 8.155 8.503 -0.348 18321 9091 1 7 . 1 1 223 223 PRO HA H 223 4.417 4.417 4.297 0.120 18321 9092 1 7 . 1 1 223 223 PRO CA C 223 63.805 63.805 64.032 -0.227 18321 9093 1 7 . 1 1 223 223 PRO CB C 223 32.090 32.090 31.783 0.307 18321 9094 1 7 . 1 1 224 224 GLY N N 224 109.149 109.149 113.215 -4.066 18321 9095 1 7 . 1 1 224 224 GLY C C 224 173.813 173.813 174.102 -0.289 18321 9096 1 7 . 1 1 224 224 GLY CA C 224 44.512 44.512 45.358 -0.846 18321 9097 1 7 . 1 1 224 224 GLY H H 224 8.376 8.376 8.548 -0.172 18321 9098 1 7 . 1 1 225 225 ALA N N 225 123.599 123.599 124.868 -1.269 18321 9099 1 7 . 1 1 225 225 ALA C C 225 177.341 177.341 178.007 -0.666 18321 9100 1 7 . 1 1 225 225 ALA CA C 225 51.878 51.878 53.120 -1.242 18321 9101 1 7 . 1 1 225 225 ALA CB C 225 19.169 19.169 19.998 -0.829 18321 9102 1 7 . 1 1 225 225 ALA H H 225 7.959 7.959 7.757 0.202 18321 9103 1 7 . 1 1 226 226 ALA N N 226 123.218 123.218 120.804 2.414 18321 9104 1 7 . 1 1 226 226 ALA HA H 226 4.350 4.350 4.520 -0.170 18321 9105 1 7 . 1 1 226 226 ALA C C 226 177.520 177.520 176.616 0.904 18321 9106 1 7 . 1 1 226 226 ALA CA C 226 52.535 52.535 51.592 0.943 18321 9107 1 7 . 1 1 226 226 ALA CB C 226 19.171 19.171 19.291 -0.120 18321 9108 1 7 . 1 1 226 226 ALA H H 226 8.169 8.169 8.218 -0.049 18321 9109 1 7 . 1 1 227 227 ILE N N 227 120.086 120.086 114.765 5.321 18321 9110 1 7 . 1 1 227 227 ILE HA H 227 4.201 4.201 4.383 -0.182 18321 9111 1 7 . 1 1 227 227 ILE C C 227 174.814 174.814 175.686 -0.872 18321 9112 1 7 . 1 1 227 227 ILE CA C 227 60.929 60.929 59.894 1.035 18321 9113 1 7 . 1 1 227 227 ILE CB C 227 38.872 38.872 38.933 -0.061 18321 9114 1 7 . 1 1 227 227 ILE H H 227 8.037 8.037 7.529 0.508 18321 9115 1 7 . 1 1 228 228 THR N N 228 117.224 117.224 118.100 -0.876 18321 9116 1 7 . 1 1 228 228 THR HA H 228 4.203 4.203 4.764 -0.561 18321 9117 1 7 . 1 1 228 228 THR CA C 228 57.108 57.108 59.871 -2.764 18321 9118 1 7 . 1 1 228 228 THR CB C 228 69.945 69.945 68.964 0.981 18321 9119 1 7 . 1 1 228 228 THR H H 228 7.775 7.775 8.632 -0.857 18321 9120 1 7 . 1 1 229 229 PRO HA H 229 4.750 4.750 4.652 0.098 18321 9121 1 7 . 1 1 229 229 PRO CA C 229 62.480 62.480 61.915 0.565 18321 9122 1 7 . 1 1 229 229 PRO CB C 229 33.995 33.995 32.638 1.357 18321 9123 1 7 . 1 1 230 230 LEU N N 230 123.629 123.629 117.316 6.313 18321 9124 1 7 . 1 1 230 230 LEU CA C 230 53.076 53.076 52.572 0.504 18321 9125 1 7 . 1 1 230 230 LEU CB C 230 40.608 40.608 41.694 -1.087 18321 9126 1 7 . 1 1 230 230 LEU H H 230 8.453 8.453 7.975 0.478 18321 9127 1 7 . 1 1 231 231 PRO HA H 231 4.412 4.412 4.671 -0.259 18321 9128 1 7 . 1 1 231 231 PRO C C 231 176.571 176.571 176.685 -0.114 18321 9129 1 7 . 1 1 231 231 PRO CA C 231 63.225 63.225 62.522 0.703 18321 9130 1 7 . 1 1 231 231 PRO CB C 231 31.191 31.191 30.869 0.322 18321 9131 1 7 . 1 1 232 232 SER N N 232 115.169 115.169 121.037 -5.868 18321 9132 1 7 . 1 1 232 232 SER HA H 232 4.450 4.450 3.971 0.479 18321 9133 1 7 . 1 1 232 232 SER CA C 232 58.604 58.604 60.963 -2.359 18321 9134 1 7 . 1 1 232 232 SER CB C 232 63.962 63.962 62.670 1.292 18321 9135 1 7 . 1 1 232 232 SER H H 232 8.280 8.280 8.610 -0.330 18321 9136 1 7 . 1 1 233 233 THR N N 233 115.155 115.155 114.936 0.219 18321 9137 1 7 . 1 1 233 233 THR HA H 233 4.351 4.351 3.853 0.498 18321 9138 1 7 . 1 1 233 233 THR C C 233 177.237 177.237 174.981 2.256 18321 9139 1 7 . 1 1 233 233 THR CA C 233 61.939 61.939 64.978 -3.039 18321 9140 1 7 . 1 1 233 233 THR CB C 233 68.986 68.986 67.640 1.346 18321 9141 1 7 . 1 1 233 233 THR H H 233 8.096 8.096 8.431 -0.335 18321 9142 1 7 . 1 1 234 234 GLN N N 234 122.040 122.040 121.799 0.241 18321 9143 1 7 . 1 1 234 234 GLN HA H 234 4.681 4.681 4.367 0.314 18321 9144 1 7 . 1 1 234 234 GLN C C 234 176.177 176.177 175.389 0.788 18321 9145 1 7 . 1 1 234 234 GLN CA C 234 55.861 55.861 56.871 -1.010 18321 9146 1 7 . 1 1 234 234 GLN CB C 234 28.583 28.583 29.691 -1.108 18321 9147 1 7 . 1 1 234 234 GLN H H 234 8.256 8.256 8.347 -0.091 18321 9148 1 7 . 1 1 235 235 ASN N N 235 119.506 119.506 117.871 1.635 18321 9149 1 7 . 1 1 235 235 ASN HA H 235 4.775 4.775 4.888 -0.113 18321 9150 1 7 . 1 1 235 235 ASN C C 235 174.974 174.974 176.417 -1.443 18321 9151 1 7 . 1 1 235 235 ASN CA C 235 53.191 53.191 52.733 0.458 18321 9152 1 7 . 1 1 235 235 ASN CB C 235 38.511 38.511 39.004 -0.493 18321 9153 1 7 . 1 1 235 235 ASN H H 235 8.346 8.346 7.950 0.396 18321 9154 1 7 . 1 1 236 236 GLY N N 236 109.378 109.378 109.254 0.124 18321 9155 1 7 . 1 1 236 236 GLY CA C 236 44.023 44.023 45.723 -1.700 18321 9156 1 7 . 1 1 236 236 GLY H H 236 7.939 7.939 7.870 0.069 18321 9157 1 7 . 1 1 237 237 PRO HA H 237 4.336 4.336 4.447 -0.111 18321 9158 1 7 . 1 1 237 237 PRO C C 237 175.942 175.942 175.819 0.123 18321 9159 1 7 . 1 1 237 237 PRO CA C 237 62.797 62.797 62.466 0.331 18321 9160 1 7 . 1 1 237 237 PRO CB C 237 27.421 27.421 31.446 -4.025 18321 9161 1 7 . 1 1 238 238 VAL N N 238 120.535 120.535 123.667 -3.132 18321 9162 1 7 . 1 1 238 238 VAL HA H 238 4.195 4.195 4.156 0.039 18321 9163 1 7 . 1 1 238 238 VAL C C 238 173.775 173.775 174.729 -0.954 18321 9164 1 7 . 1 1 238 238 VAL CA C 238 61.173 61.173 61.673 -0.500 18321 9165 1 7 . 1 1 238 238 VAL CB C 238 38.328 38.328 32.577 5.751 18321 9166 1 7 . 1 1 238 238 VAL H H 238 7.986 7.986 7.944 0.042 18321 9167 1 7 . 1 1 239 239 PHE N N 239 123.522 123.522 124.069 -0.547 18321 9168 1 7 . 1 1 239 239 PHE HA H 239 5.539 5.539 5.399 0.140 18321 9169 1 7 . 1 1 239 239 PHE C C 239 174.207 174.207 174.856 -0.649 18321 9170 1 7 . 1 1 239 239 PHE CA C 239 56.993 56.993 56.476 0.517 18321 9171 1 7 . 1 1 239 239 PHE CB C 239 41.743 41.743 41.050 0.693 18321 9172 1 7 . 1 1 239 239 PHE H H 239 8.927 8.927 8.878 0.049 18321 9173 1 7 . 1 1 240 240 ALA N N 240 120.871 120.871 126.162 -5.291 18321 9174 1 7 . 1 1 240 240 ALA HA H 240 5.352 5.352 5.545 -0.193 18321 9175 1 7 . 1 1 240 240 ALA C C 240 174.639 174.639 175.726 -1.087 18321 9176 1 7 . 1 1 240 240 ALA CA C 240 49.736 49.736 50.245 -0.508 18321 9177 1 7 . 1 1 240 240 ALA CB C 240 23.480 23.480 22.618 0.862 18321 9178 1 7 . 1 1 240 240 ALA H H 240 9.398 9.398 9.056 0.342 18321 9179 1 7 . 1 1 241 241 LYS N N 241 121.227 121.227 123.682 -2.455 18321 9180 1 7 . 1 1 241 241 LYS HA H 241 5.373 5.373 4.956 0.417 18321 9181 1 7 . 1 1 241 241 LYS C C 241 176.772 176.772 176.280 0.492 18321 9182 1 7 . 1 1 241 241 LYS CA C 241 53.128 53.128 53.905 -0.777 18321 9183 1 7 . 1 1 241 241 LYS CB C 241 34.850 34.850 33.533 1.317 18321 9184 1 7 . 1 1 241 241 LYS H H 241 8.947 8.947 8.653 0.294 18321 9185 1 7 . 1 1 242 242 ALA N N 242 126.833 126.833 131.336 -4.503 18321 9186 1 7 . 1 1 242 242 ALA HA H 242 4.764 4.764 4.556 0.208 18321 9187 1 7 . 1 1 242 242 ALA C C 242 178.506 178.506 177.855 0.651 18321 9188 1 7 . 1 1 242 242 ALA CA C 242 52.788 52.788 52.069 0.718 18321 9189 1 7 . 1 1 242 242 ALA CB C 242 19.084 19.084 18.327 0.757 18321 9190 1 7 . 1 1 242 242 ALA H H 242 9.373 9.373 8.467 0.906 18321 9191 1 7 . 1 1 243 243 ILE N N 243 118.731 118.731 119.961 -1.230 18321 9192 1 7 . 1 1 243 243 ILE HA H 243 4.454 4.454 4.128 0.326 18321 9193 1 7 . 1 1 243 243 ILE C C 243 174.773 174.773 176.330 -1.557 18321 9194 1 7 . 1 1 243 243 ILE CA C 243 60.613 60.613 62.479 -1.866 18321 9195 1 7 . 1 1 243 243 ILE CB C 243 39.232 39.232 38.470 0.762 18321 9196 1 7 . 1 1 243 243 ILE H H 243 8.933 8.933 8.119 0.814 18321 9197 1 7 . 1 1 244 244 GLN N N 244 121.616 121.616 119.971 1.645 18321 9198 1 7 . 1 1 244 244 GLN HA H 244 4.283 4.283 4.471 -0.188 18321 9199 1 7 . 1 1 244 244 GLN C C 244 172.815 172.815 174.717 -1.902 18321 9200 1 7 . 1 1 244 244 GLN CA C 244 54.750 54.750 54.109 0.640 18321 9201 1 7 . 1 1 244 244 GLN CB C 244 31.469 31.469 32.049 -0.580 18321 9202 1 7 . 1 1 244 244 GLN H H 244 7.438 7.438 7.675 -0.237 18321 9203 1 7 . 1 1 245 245 LYS N N 245 124.215 124.215 126.403 -2.188 18321 9204 1 7 . 1 1 245 245 LYS HA H 245 3.962 3.962 4.279 -0.317 18321 9205 1 7 . 1 1 245 245 LYS C C 245 175.679 175.679 176.575 -0.896 18321 9206 1 7 . 1 1 245 245 LYS CA C 245 56.413 56.413 57.621 -1.208 18321 9207 1 7 . 1 1 245 245 LYS CB C 245 32.847 32.847 33.056 -0.209 18321 9208 1 7 . 1 1 245 245 LYS H H 245 8.318 8.318 8.645 -0.327 18321 9209 1 7 . 1 1 246 246 ARG N N 246 127.327 127.327 127.605 -0.278 18321 9210 1 7 . 1 1 246 246 ARG HA H 246 4.221 4.221 4.671 -0.450 18321 9211 1 7 . 1 1 246 246 ARG CA C 246 56.279 56.279 54.662 1.617 18321 9212 1 7 . 1 1 246 246 ARG CB C 246 32.987 32.987 31.576 1.411 18321 9213 1 7 . 1 1 246 246 ARG H H 246 9.248 9.248 8.826 0.422 18321 9214 1 7 . 1 1 249 249 CYS HA H 249 4.260 4.260 4.221 0.039 18321 9215 1 7 . 1 1 249 249 CYS CA C 249 55.886 55.886 57.333 -1.446 18321 9216 1 7 . 1 1 249 249 CYS CB C 249 34.146 34.146 29.270 4.876 18321 9217 1 7 . 1 1 250 250 ALA HA H 250 3.926 3.926 4.040 -0.114 18321 9218 1 7 . 1 1 250 250 ALA CA C 250 54.344 54.344 54.525 -0.181 18321 9219 1 7 . 1 1 250 250 ALA CB C 250 18.342 18.342 18.670 -0.328 18321 9220 1 7 . 1 1 251 251 TYR N N 251 110.618 110.618 111.972 -1.354 18321 9221 1 7 . 1 1 251 251 TYR HA H 251 4.489 4.489 4.737 -0.248 18321 9222 1 7 . 1 1 251 251 TYR C C 251 175.286 175.286 175.741 -0.455 18321 9223 1 7 . 1 1 251 251 TYR CA C 251 56.137 56.137 56.332 -0.195 18321 9224 1 7 . 1 1 251 251 TYR CB C 251 37.203 37.203 37.732 -0.529 18321 9225 1 7 . 1 1 251 251 TYR H H 251 7.037 7.037 7.011 0.026 18321 9226 1 7 . 1 1 252 252 ASP N N 252 121.835 121.835 121.995 -0.160 18321 9227 1 7 . 1 1 252 252 ASP HA H 252 4.763 4.763 4.711 0.052 18321 9228 1 7 . 1 1 252 252 ASP CA C 252 52.351 52.351 55.618 -3.267 18321 9229 1 7 . 1 1 252 252 ASP CB C 252 39.995 39.995 42.414 -2.419 18321 9230 1 7 . 1 1 252 252 ASP H H 252 7.339 7.339 7.677 -0.338 18321 9231 1 7 . 1 1 253 253 LYS N N 253 123.177 123.177 115.283 7.894 18321 9232 1 7 . 1 1 253 253 LYS HA H 253 4.270 4.270 3.829 0.441 18321 9233 1 7 . 1 1 253 253 LYS C C 253 177.724 177.724 177.693 0.031 18321 9234 1 7 . 1 1 253 253 LYS CA C 253 57.036 57.036 59.079 -2.043 18321 9235 1 7 . 1 1 253 253 LYS H H 253 8.396 8.396 7.960 0.436 18321 9236 1 7 . 1 1 254 254 THR N N 254 108.317 108.317 111.927 -3.610 18321 9237 1 7 . 1 1 254 254 THR HA H 254 4.517 4.517 4.135 0.382 18321 9238 1 7 . 1 1 254 254 THR C C 254 174.012 174.012 174.780 -0.768 18321 9239 1 7 . 1 1 254 254 THR CA C 254 61.036 61.036 64.242 -3.206 18321 9240 1 7 . 1 1 254 254 THR CB C 254 69.307 69.307 68.763 0.544 18321 9241 1 7 . 1 1 254 254 THR H H 254 8.217 8.217 8.229 -0.012 18321 9242 1 7 . 1 1 255 255 ALA N N 255 124.762 124.762 124.299 0.463 18321 9243 1 7 . 1 1 255 255 ALA HA H 255 4.524 4.524 4.810 -0.286 18321 9244 1 7 . 1 1 255 255 ALA C C 255 176.630 176.630 176.434 0.196 18321 9245 1 7 . 1 1 255 255 ALA CA C 255 51.352 51.352 51.406 -0.054 18321 9246 1 7 . 1 1 255 255 ALA CB C 255 20.135 20.135 19.255 0.880 18321 9247 1 7 . 1 1 255 255 ALA H H 255 7.096 7.096 7.672 -0.576 18321 9248 1 7 . 1 1 256 256 LEU N N 256 124.379 124.379 124.698 -0.319 18321 9249 1 7 . 1 1 256 256 LEU HA H 256 4.328 4.328 4.418 -0.090 18321 9250 1 7 . 1 1 256 256 LEU C C 256 176.007 176.007 176.000 0.007 18321 9251 1 7 . 1 1 256 256 LEU CA C 256 53.502 53.502 54.389 -0.887 18321 9252 1 7 . 1 1 256 256 LEU CB C 256 44.665 44.665 43.798 0.867 18321 9253 1 7 . 1 1 256 256 LEU H H 256 8.889 8.889 8.088 0.801 18321 9254 1 7 . 1 1 257 257 ALA N N 257 129.619 129.619 128.303 1.316 18321 9255 1 7 . 1 1 257 257 ALA HA H 257 4.445 4.445 4.921 -0.476 18321 9256 1 7 . 1 1 257 257 ALA C C 257 176.813 176.813 176.781 0.032 18321 9257 1 7 . 1 1 257 257 ALA CA C 257 51.179 51.179 51.248 -0.069 18321 9258 1 7 . 1 1 257 257 ALA CB C 257 18.973 18.973 18.835 0.138 18321 9259 1 7 . 1 1 257 257 ALA H H 257 8.529 8.529 8.287 0.242 18321 9260 1 7 . 1 1 258 258 LEU N N 258 119.300 119.300 125.910 -6.610 18321 9261 1 7 . 1 1 258 258 LEU HA H 258 4.782 4.782 4.598 0.184 18321 9262 1 7 . 1 1 258 258 LEU CA C 258 53.259 53.259 53.892 -0.633 18321 9263 1 7 . 1 1 258 258 LEU CB C 258 45.972 45.972 44.128 1.844 18321 9264 1 7 . 1 1 258 258 LEU H H 258 8.505 8.505 8.367 0.138 18321 9265 1 7 . 1 1 259 259 GLU N N 259 123.919 123.919 123.113 0.806 18321 9266 1 7 . 1 1 259 259 GLU HA H 259 4.516 4.516 4.493 0.023 18321 9267 1 7 . 1 1 259 259 GLU C C 259 175.795 175.795 175.493 0.302 18321 9268 1 7 . 1 1 259 259 GLU CA C 259 52.896 52.896 54.703 -1.806 18321 9269 1 7 . 1 1 259 259 GLU H H 259 8.943 8.943 8.675 0.268 18321 9270 1 7 . 1 1 260 260 VAL N N 260 122.122 122.122 121.350 0.772 18321 9271 1 7 . 1 1 260 260 VAL HA H 260 2.923 2.923 3.884 -0.961 18321 9272 1 7 . 1 1 260 260 VAL C C 260 177.964 177.964 177.760 0.204 18321 9273 1 7 . 1 1 260 260 VAL CA C 260 65.417 65.417 63.797 1.620 18321 9274 1 7 . 1 1 260 260 VAL CB C 260 30.668 30.668 30.441 0.227 18321 9275 1 7 . 1 1 260 260 VAL H H 260 8.956 8.956 8.469 0.487 18321 9276 1 7 . 1 1 261 261 GLY N N 261 116.009 116.009 117.375 -1.366 18321 9277 1 7 . 1 1 261 261 GLY C C 261 176.288 176.288 173.621 2.667 18321 9278 1 7 . 1 1 261 261 GLY CA C 261 44.210 44.210 44.798 -0.588 18321 9279 1 7 . 1 1 261 261 GLY H H 261 8.799 8.799 9.116 -0.317 18321 9280 1 7 . 1 1 262 262 ASP N N 262 121.945 121.945 119.798 2.147 18321 9281 1 7 . 1 1 262 262 ASP HA H 262 4.423 4.423 4.970 -0.547 18321 9282 1 7 . 1 1 262 262 ASP C C 262 175.381 175.381 175.193 0.188 18321 9283 1 7 . 1 1 262 262 ASP CA C 262 55.243 55.243 52.491 2.752 18321 9284 1 7 . 1 1 262 262 ASP CB C 262 41.819 41.819 43.083 -1.264 18321 9285 1 7 . 1 1 262 262 ASP H H 262 8.180 8.180 7.613 0.567 18321 9286 1 7 . 1 1 263 263 ILE N N 263 121.452 121.452 121.772 -0.320 18321 9287 1 7 . 1 1 263 263 ILE HA H 263 4.707 4.707 4.609 0.098 18321 9288 1 7 . 1 1 263 263 ILE C C 263 174.996 174.996 176.039 -1.043 18321 9289 1 7 . 1 1 263 263 ILE CA C 263 59.289 59.289 59.592 -0.303 18321 9290 1 7 . 1 1 263 263 ILE CB C 263 36.987 36.987 38.017 -1.030 18321 9291 1 7 . 1 1 263 263 ILE H H 263 8.460 8.460 8.355 0.105 18321 9292 1 7 . 1 1 264 264 VAL N N 264 128.756 128.756 129.438 -0.682 18321 9293 1 7 . 1 1 264 264 VAL HA H 264 4.309 4.309 4.094 0.215 18321 9294 1 7 . 1 1 264 264 VAL C C 264 175.486 175.486 175.098 0.388 18321 9295 1 7 . 1 1 264 264 VAL CA C 264 59.091 59.091 60.991 -1.900 18321 9296 1 7 . 1 1 264 264 VAL CB C 264 34.541 34.541 31.116 3.425 18321 9297 1 7 . 1 1 264 264 VAL H H 264 9.479 9.479 9.276 0.203 18321 9298 1 7 . 1 1 265 265 LYS N N 265 128.101 128.101 130.436 -2.335 18321 9299 1 7 . 1 1 265 265 LYS HA H 265 4.342 4.342 4.192 0.150 18321 9300 1 7 . 1 1 265 265 LYS C C 265 175.531 175.531 174.974 0.557 18321 9301 1 7 . 1 1 265 265 LYS CA C 265 55.620 55.620 55.649 -0.029 18321 9302 1 7 . 1 1 265 265 LYS CB C 265 33.149 33.149 32.014 1.135 18321 9303 1 7 . 1 1 265 265 LYS H H 265 8.715 8.715 8.592 0.123 18321 9304 1 7 . 1 1 266 266 VAL N N 266 129.537 129.537 127.732 1.805 18321 9305 1 7 . 1 1 266 266 VAL HA H 266 4.333 4.333 4.416 -0.083 18321 9306 1 7 . 1 1 266 266 VAL C C 266 176.166 176.166 174.717 1.449 18321 9307 1 7 . 1 1 266 266 VAL CA C 266 63.339 63.339 61.013 2.326 18321 9308 1 7 . 1 1 266 266 VAL CB C 266 30.712 30.712 34.205 -3.493 18321 9309 1 7 . 1 1 266 266 VAL H H 266 9.073 9.073 8.394 0.679 18321 9310 1 7 . 1 1 267 267 THR N N 267 120.020 120.020 122.463 -2.443 18321 9311 1 7 . 1 1 267 267 THR HA H 267 4.189 4.189 4.406 -0.217 18321 9312 1 7 . 1 1 267 267 THR C C 267 176.054 176.054 175.184 0.870 18321 9313 1 7 . 1 1 267 267 THR CA C 267 62.204 62.204 62.474 -0.270 18321 9314 1 7 . 1 1 267 267 THR CB C 267 68.200 68.200 69.672 -1.472 18321 9315 1 7 . 1 1 267 267 THR H H 267 9.130 9.130 8.272 0.858 18321 9316 1 7 . 1 1 268 268 ARG N N 268 120.839 120.839 123.600 -2.761 18321 9317 1 7 . 1 1 268 268 ARG HA H 268 4.236 4.236 4.605 -0.369 18321 9318 1 7 . 1 1 268 268 ARG CA C 268 56.321 56.321 54.731 1.590 18321 9319 1 7 . 1 1 268 268 ARG CB C 268 33.049 33.049 30.698 2.351 18321 9320 1 7 . 1 1 268 268 ARG H H 268 7.631 7.631 7.689 -0.058 18321 9321 1 7 . 1 1 269 269 MET N N 269 125.443 125.443 125.190 0.253 18321 9322 1 7 . 1 1 269 269 MET C C 269 174.392 174.392 174.616 -0.224 18321 9323 1 7 . 1 1 269 269 MET H H 269 8.532 8.532 8.534 -0.002 18321 9324 1 7 . 1 1 270 270 ASN N N 270 119.125 119.125 120.608 -1.483 18321 9325 1 7 . 1 1 270 270 ASN HA H 270 4.546 4.546 4.955 -0.409 18321 9326 1 7 . 1 1 270 270 ASN C C 270 172.133 172.133 176.156 -4.023 18321 9327 1 7 . 1 1 270 270 ASN CA C 270 53.639 53.639 52.542 1.097 18321 9328 1 7 . 1 1 270 270 ASN CB C 270 39.845 39.845 41.028 -1.183 18321 9329 1 7 . 1 1 270 270 ASN H H 270 6.631 6.631 8.786 -2.155 18321 9330 1 7 . 1 1 271 271 ILE N N 271 122.532 122.532 120.896 1.636 18321 9331 1 7 . 1 1 271 271 ILE HA H 271 4.417 4.417 3.997 0.420 18321 9332 1 7 . 1 1 271 271 ILE CA C 271 63.348 63.348 62.695 0.653 18321 9333 1 7 . 1 1 271 271 ILE CB C 271 38.198 38.198 38.267 -0.069 18321 9334 1 7 . 1 1 271 271 ILE H H 271 8.565 8.565 8.540 0.025 18321 9335 1 7 . 1 1 272 272 ASN HA H 272 4.527 4.527 4.705 -0.178 18321 9336 1 7 . 1 1 272 272 ASN C C 272 176.259 176.259 176.387 -0.128 18321 9337 1 7 . 1 1 272 272 ASN CA C 272 53.225 53.225 54.572 -1.347 18321 9338 1 7 . 1 1 272 272 ASN CB C 272 37.565 37.565 38.789 -1.224 18321 9339 1 7 . 1 1 273 273 GLY N N 273 107.043 107.043 105.393 1.650 18321 9340 1 7 . 1 1 273 273 GLY C C 273 173.216 173.216 173.005 0.211 18321 9341 1 7 . 1 1 273 273 GLY CA C 273 45.299 45.299 44.896 0.403 18321 9342 1 7 . 1 1 273 273 GLY H H 273 8.086 8.086 7.991 0.095 18321 9343 1 7 . 1 1 274 274 GLN N N 274 120.624 120.624 121.133 -0.509 18321 9344 1 7 . 1 1 274 274 GLN HA H 274 4.551 4.551 4.274 0.277 18321 9345 1 7 . 1 1 274 274 GLN C C 274 175.039 175.039 175.340 -0.301 18321 9346 1 7 . 1 1 274 274 GLN CA C 274 54.556 54.556 55.514 -0.958 18321 9347 1 7 . 1 1 274 274 GLN CB C 274 33.698 33.698 29.288 4.410 18321 9348 1 7 . 1 1 274 274 GLN H H 274 8.045 8.045 7.972 0.073 18321 9349 1 7 . 1 1 275 275 TRP N N 275 125.596 125.596 125.107 0.489 18321 9350 1 7 . 1 1 275 275 TRP HA H 275 4.588 4.588 4.761 -0.173 18321 9351 1 7 . 1 1 275 275 TRP C C 275 172.832 172.832 175.593 -2.761 18321 9352 1 7 . 1 1 275 275 TRP CA C 275 55.296 55.296 53.964 1.332 18321 9353 1 7 . 1 1 275 275 TRP CB C 275 31.393 31.393 30.713 0.680 18321 9354 1 7 . 1 1 275 275 TRP H H 275 8.484 8.484 7.998 0.486 18321 9355 1 7 . 1 1 276 276 GLU N N 276 119.012 119.012 120.127 -1.115 18321 9356 1 7 . 1 1 276 276 GLU HA H 276 5.190 5.190 5.576 -0.386 18321 9357 1 7 . 1 1 276 276 GLU C C 276 176.553 176.553 176.348 0.205 18321 9358 1 7 . 1 1 276 276 GLU CA C 276 54.288 54.288 55.314 -1.026 18321 9359 1 7 . 1 1 276 276 GLU CB C 276 32.851 32.851 32.320 0.531 18321 9360 1 7 . 1 1 276 276 GLU H H 276 8.643 8.643 9.093 -0.450 18321 9361 1 7 . 1 1 277 277 GLY N N 277 111.364 111.364 111.271 0.093 18321 9362 1 7 . 1 1 277 277 GLY C C 277 170.707 170.707 172.985 -2.278 18321 9363 1 7 . 1 1 277 277 GLY CA C 277 46.723 46.723 43.786 2.937 18321 9364 1 7 . 1 1 277 277 GLY H H 277 9.072 9.072 8.596 0.476 18321 9365 1 7 . 1 1 278 278 GLU N N 278 117.733 117.733 122.918 -5.185 18321 9366 1 7 . 1 1 278 278 GLU HA H 278 5.748 5.748 4.726 1.022 18321 9367 1 7 . 1 1 278 278 GLU C C 278 176.051 176.051 175.541 0.510 18321 9368 1 7 . 1 1 278 278 GLU CA C 278 53.620 53.620 55.965 -2.345 18321 9369 1 7 . 1 1 278 278 GLU CB C 278 33.742 33.742 30.814 2.929 18321 9370 1 7 . 1 1 278 278 GLU H H 278 8.810 8.810 8.260 0.550 18321 9371 1 7 . 1 1 279 279 VAL N N 279 123.834 123.834 124.422 -0.588 18321 9372 1 7 . 1 1 279 279 VAL HA H 279 4.404 4.404 4.408 -0.004 18321 9373 1 7 . 1 1 279 279 VAL C C 279 175.289 175.289 176.220 -0.931 18321 9374 1 7 . 1 1 279 279 VAL CA C 279 61.166 61.166 60.396 0.770 18321 9375 1 7 . 1 1 279 279 VAL CB C 279 34.123 34.123 34.075 0.048 18321 9376 1 7 . 1 1 279 279 VAL H H 279 8.887 8.887 8.952 -0.065 18321 9377 1 7 . 1 1 280 280 ASN N N 280 126.025 126.025 126.606 -0.581 18321 9378 1 7 . 1 1 280 280 ASN HA H 280 4.435 4.435 4.300 0.135 18321 9379 1 7 . 1 1 280 280 ASN C C 280 175.205 175.205 175.465 -0.260 18321 9380 1 7 . 1 1 280 280 ASN CA C 280 45.615 45.615 53.683 -8.068 18321 9381 1 7 . 1 1 280 280 ASN CB C 280 37.386 37.386 37.256 0.130 18321 9382 1 7 . 1 1 280 280 ASN H H 280 9.322 9.322 9.174 0.148 18321 9383 1 7 . 1 1 281 281 GLY N N 281 104.588 104.588 103.361 1.227 18321 9384 1 7 . 1 1 281 281 GLY C C 281 173.944 173.944 173.633 0.311 18321 9385 1 7 . 1 1 281 281 GLY CA C 281 45.224 45.224 44.700 0.524 18321 9386 1 7 . 1 1 281 281 GLY H H 281 8.768 8.768 8.227 0.541 18321 9387 1 7 . 1 1 282 282 ARG N N 282 122.567 122.567 123.386 -0.819 18321 9388 1 7 . 1 1 282 282 ARG HA H 282 4.559 4.559 4.546 0.013 18321 9389 1 7 . 1 1 282 282 ARG C C 282 174.350 174.350 174.556 -0.206 18321 9390 1 7 . 1 1 282 282 ARG CA C 282 54.933 54.933 54.899 0.034 18321 9391 1 7 . 1 1 282 282 ARG CB C 282 31.765 31.765 31.871 -0.106 18321 9392 1 7 . 1 1 282 282 ARG H H 282 8.149 8.149 8.201 -0.052 18321 9393 1 7 . 1 1 283 283 LYS N N 283 121.565 121.565 127.245 -5.680 18321 9394 1 7 . 1 1 283 283 LYS HA H 283 5.584 5.584 5.582 0.002 18321 9395 1 7 . 1 1 283 283 LYS CA C 283 54.143 54.143 55.101 -0.958 18321 9396 1 7 . 1 1 283 283 LYS CB C 283 36.040 36.040 34.106 1.934 18321 9397 1 7 . 1 1 283 283 LYS H H 283 8.424 8.424 8.552 -0.128 18321 9398 1 7 . 1 1 284 284 GLY C C 284 173.006 173.006 172.873 0.133 18321 9399 1 7 . 1 1 284 284 GLY CA C 284 45.886 45.886 45.100 0.786 18321 9400 1 7 . 1 1 285 285 LEU N N 285 119.673 119.673 122.143 -2.470 18321 9401 1 7 . 1 1 285 285 LEU HA H 285 5.718 5.718 5.493 0.225 18321 9402 1 7 . 1 1 285 285 LEU C C 285 178.657 178.657 176.426 2.231 18321 9403 1 7 . 1 1 285 285 LEU CA C 285 53.656 53.656 54.574 -0.918 18321 9404 1 7 . 1 1 285 285 LEU CB C 285 44.813 44.813 43.142 1.671 18321 9405 1 7 . 1 1 285 285 LEU H H 285 8.734 8.734 8.800 -0.066 18321 9406 1 7 . 1 1 286 286 PHE N N 286 118.785 118.785 120.549 -1.764 18321 9407 1 7 . 1 1 286 286 PHE HA H 286 4.521 4.521 5.099 -0.578 18321 9408 1 7 . 1 1 286 286 PHE CA C 286 57.592 57.592 54.524 3.068 18321 9409 1 7 . 1 1 286 286 PHE CB C 286 40.669 40.669 40.387 0.282 18321 9410 1 7 . 1 1 286 286 PHE H H 286 9.120 9.120 8.979 0.141 18321 9411 1 7 . 1 1 287 287 PRO HA H 287 4.385 4.385 4.400 -0.015 18321 9412 1 7 . 1 1 287 287 PRO CA C 287 62.814 62.814 61.991 0.823 18321 9413 1 7 . 1 1 287 287 PRO CB C 287 32.133 32.133 32.045 0.088 18321 9414 1 7 . 1 1 288 288 PHE C C 288 174.837 174.837 175.671 -0.834 18321 9415 1 7 . 1 1 288 288 PHE CA C 288 59.020 59.020 59.336 -0.316 18321 9416 1 7 . 1 1 288 288 PHE CB C 288 34.987 34.987 37.265 -2.278 18321 9417 1 7 . 1 1 289 289 THR N N 289 107.865 107.865 111.116 -3.251 18321 9418 1 7 . 1 1 289 289 THR HA H 289 3.589 3.589 3.959 -0.370 18321 9419 1 7 . 1 1 289 289 THR C C 289 176.125 176.125 174.911 1.214 18321 9420 1 7 . 1 1 289 289 THR CA C 289 62.243 62.243 62.852 -0.609 18321 9421 1 7 . 1 1 289 289 THR CB C 289 69.365 69.365 68.357 1.008 18321 9422 1 7 . 1 1 289 289 THR H H 289 6.453 6.453 7.400 -0.947 18321 9423 1 7 . 1 1 290 290 HIS N N 290 119.462 119.462 117.940 1.522 18321 9424 1 7 . 1 1 290 290 HIS HA H 290 4.196 4.196 4.660 -0.464 18321 9425 1 7 . 1 1 290 290 HIS C C 290 175.165 175.165 174.480 0.685 18321 9426 1 7 . 1 1 290 290 HIS CA C 290 57.635 57.635 56.663 0.972 18321 9427 1 7 . 1 1 290 290 HIS CB C 290 29.840 29.840 31.407 -1.567 18321 9428 1 7 . 1 1 290 290 HIS H H 290 7.835 7.835 8.146 -0.311 18321 9429 1 7 . 1 1 291 291 VAL N N 291 110.050 110.050 111.031 -0.981 18321 9430 1 7 . 1 1 291 291 VAL HA H 291 5.445 5.445 5.122 0.323 18321 9431 1 7 . 1 1 291 291 VAL C C 291 173.386 173.386 174.821 -1.435 18321 9432 1 7 . 1 1 291 291 VAL CA C 291 57.794 57.794 58.702 -0.908 18321 9433 1 7 . 1 1 291 291 VAL CB C 291 35.784 35.784 35.193 0.591 18321 9434 1 7 . 1 1 291 291 VAL H H 291 7.562 7.562 7.110 0.452 18321 9435 1 7 . 1 1 292 292 LYS N N 292 119.445 119.445 120.667 -1.222 18321 9436 1 7 . 1 1 292 292 LYS HA H 292 4.857 4.857 4.728 0.129 18321 9437 1 7 . 1 1 292 292 LYS C C 292 176.512 176.512 175.719 0.793 18321 9438 1 7 . 1 1 292 292 LYS CA C 292 54.647 54.647 54.294 0.353 18321 9439 1 7 . 1 1 292 292 LYS CB C 292 35.665 35.665 34.897 0.768 18321 9440 1 7 . 1 1 292 292 LYS H H 292 8.753 8.753 8.180 0.573 18321 9441 1 7 . 1 1 293 293 ILE N N 293 128.707 128.707 128.069 0.638 18321 9442 1 7 . 1 1 293 293 ILE HA H 293 4.509 4.509 4.343 0.166 18321 9443 1 7 . 1 1 293 293 ILE C C 293 175.666 175.666 176.350 -0.684 18321 9444 1 7 . 1 1 293 293 ILE CA C 293 62.563 62.563 61.697 0.866 18321 9445 1 7 . 1 1 293 293 ILE CB C 293 38.076 38.076 35.903 2.173 18321 9446 1 7 . 1 1 293 293 ILE H H 293 9.107 9.107 8.957 0.150 18321 9447 1 7 . 1 1 294 294 PHE N N 294 126.638 126.638 127.968 -1.330 18321 9448 1 7 . 1 1 294 294 PHE HA H 294 4.898 4.898 4.960 -0.062 18321 9449 1 7 . 1 1 294 294 PHE C C 294 175.838 175.838 173.666 2.172 18321 9450 1 7 . 1 1 294 294 PHE CA C 294 56.335 56.335 55.392 0.943 18321 9451 1 7 . 1 1 294 294 PHE CB C 294 41.196 41.196 40.491 0.705 18321 9452 1 7 . 1 1 294 294 PHE H H 294 8.716 8.716 8.484 0.232 18321 9453 1 7 . 1 1 295 295 ASP N N 295 122.961 122.961 120.346 2.615 18321 9454 1 7 . 1 1 295 295 ASP HA H 295 5.003 5.003 4.814 0.189 18321 9455 1 7 . 1 1 295 295 ASP CA C 295 50.602 50.602 51.149 -0.547 18321 9456 1 7 . 1 1 295 295 ASP CB C 295 40.754 40.754 41.140 -0.386 18321 9457 1 7 . 1 1 295 295 ASP H H 295 8.418 8.418 8.421 -0.003 18321 9458 1 7 . 1 1 296 296 PRO HA H 296 4.524 4.524 4.159 0.365 18321 9459 1 7 . 1 1 296 296 PRO C C 296 176.807 176.807 176.662 0.145 18321 9460 1 7 . 1 1 296 296 PRO CA C 296 62.987 62.987 63.786 -0.799 18321 9461 1 7 . 1 1 296 296 PRO CB C 296 32.033 32.033 31.899 0.134 18321 9462 1 7 . 1 1 297 297 GLN N N 297 120.729 120.729 118.901 1.828 18321 9463 1 7 . 1 1 297 297 GLN HA H 297 4.274 4.274 4.409 -0.135 18321 9464 1 7 . 1 1 297 297 GLN CA C 297 56.427 56.427 54.615 1.812 18321 9465 1 7 . 1 1 297 297 GLN CB C 297 28.819 28.819 27.325 1.494 18321 9466 1 7 . 1 1 297 297 GLN H H 297 8.551 8.551 8.088 0.463 18321 9467 1 7 . 1 1 299 299 PRO C C 299 176.936 176.936 178.286 -1.350 18321 9468 1 7 . 1 1 299 299 PRO CA C 299 63.406 63.406 65.228 -1.823 18321 9469 1 7 . 1 1 299 299 PRO CB C 299 31.421 31.421 31.720 -0.299 18321 9470 1 7 . 1 1 300 300 ASP N N 300 119.609 119.609 118.213 1.396 18321 9471 1 7 . 1 1 300 300 ASP C C 300 176.344 176.344 177.035 -0.691 18321 9472 1 7 . 1 1 300 300 ASP CA C 300 54.178 54.178 56.797 -2.619 18321 9473 1 7 . 1 1 300 300 ASP CB C 300 40.661 40.661 40.655 0.006 18321 9474 1 7 . 1 1 300 300 ASP H H 300 8.239 8.239 8.846 -0.607 18321 9475 1 7 . 1 1 301 301 GLU N N 301 120.462 120.462 115.874 4.588 18321 9476 1 7 . 1 1 301 301 GLU CA C 301 56.188 56.188 55.110 1.078 18321 9477 1 7 . 1 1 301 301 GLU CB C 301 29.507 29.507 29.285 0.222 18321 9478 1 7 . 1 1 301 301 GLU H H 301 8.084 8.084 7.773 0.311 18321 9479 1 8 . 1 1 2 2 SER HA H 2 4.521 4.521 4.774 -0.253 18321 9480 1 8 . 1 1 2 2 SER CA C 2 58.326 58.326 57.637 0.689 18321 9481 1 8 . 1 1 2 2 SER CB C 2 64.062 64.062 64.013 0.049 18321 9482 1 8 . 1 1 3 3 SER HA H 3 4.465 4.465 4.287 0.178 18321 9483 1 8 . 1 1 3 3 SER C C 3 173.887 173.887 174.802 -0.915 18321 9484 1 8 . 1 1 3 3 SER CA C 3 58.374 58.374 59.471 -1.097 18321 9485 1 8 . 1 1 3 3 SER CB C 3 63.920 63.920 63.402 0.518 18321 9486 1 8 . 1 1 4 4 ALA N N 4 124.755 124.755 124.547 0.208 18321 9487 1 8 . 1 1 4 4 ALA HA H 4 4.547 4.547 4.835 -0.288 18321 9488 1 8 . 1 1 4 4 ALA CA C 4 52.737 52.737 52.216 0.521 18321 9489 1 8 . 1 1 4 4 ALA CB C 4 19.636 19.636 18.720 0.916 18321 9490 1 8 . 1 1 4 4 ALA H H 4 8.244 8.244 7.909 0.335 18321 9491 1 8 . 1 1 5 5 ARG N N 5 120.383 120.383 124.159 -3.776 18321 9492 1 8 . 1 1 5 5 ARG HA H 5 4.524 4.524 4.567 -0.043 18321 9493 1 8 . 1 1 5 5 ARG C C 5 175.611 175.611 176.667 -1.056 18321 9494 1 8 . 1 1 5 5 ARG CA C 5 56.082 56.082 55.895 0.187 18321 9495 1 8 . 1 1 5 5 ARG CB C 5 30.695 30.695 31.626 -0.931 18321 9496 1 8 . 1 1 5 5 ARG H H 5 8.727 8.727 8.703 0.024 18321 9497 1 8 . 1 1 6 6 PHE N N 6 115.159 115.159 119.276 -4.117 18321 9498 1 8 . 1 1 6 6 PHE HA H 6 4.786 4.786 4.850 -0.064 18321 9499 1 8 . 1 1 6 6 PHE C C 6 172.076 172.076 175.336 -3.260 18321 9500 1 8 . 1 1 6 6 PHE CA C 6 56.640 56.640 54.928 1.712 18321 9501 1 8 . 1 1 6 6 PHE CB C 6 40.378 40.378 39.693 0.685 18321 9502 1 8 . 1 1 6 6 PHE H H 6 7.536 7.536 8.051 -0.515 18321 9503 1 8 . 1 1 7 7 ASP N N 7 121.846 121.846 122.145 -0.299 18321 9504 1 8 . 1 1 7 7 ASP HA H 7 4.846 4.846 4.305 0.541 18321 9505 1 8 . 1 1 7 7 ASP CA C 7 52.327 52.327 56.705 -4.378 18321 9506 1 8 . 1 1 7 7 ASP CB C 7 41.298 41.298 41.124 0.174 18321 9507 1 8 . 1 1 7 7 ASP H H 7 9.062 9.062 8.824 0.238 18321 9508 1 8 . 1 1 8 8 SER HA H 8 3.950 3.950 4.173 -0.223 18321 9509 1 8 . 1 1 8 8 SER C C 8 174.705 174.705 174.776 -0.071 18321 9510 1 8 . 1 1 8 8 SER CA C 8 61.937 61.937 59.656 2.281 18321 9511 1 8 . 1 1 8 8 SER CB C 8 62.260 62.260 62.337 -0.076 18321 9512 1 8 . 1 1 9 9 SER N N 9 114.373 114.373 114.405 -0.032 18321 9513 1 8 . 1 1 9 9 SER HA H 9 4.529 4.529 4.768 -0.239 18321 9514 1 8 . 1 1 9 9 SER C C 9 175.089 175.089 173.902 1.187 18321 9515 1 8 . 1 1 9 9 SER CA C 9 59.851 59.851 59.367 0.484 18321 9516 1 8 . 1 1 9 9 SER CB C 9 64.246 64.246 63.575 0.672 18321 9517 1 8 . 1 1 9 9 SER H H 9 8.722 8.722 8.056 0.666 18321 9518 1 8 . 1 1 10 10 ASP N N 10 121.818 121.818 122.063 -0.245 18321 9519 1 8 . 1 1 10 10 ASP HA H 10 4.730 4.730 4.660 0.070 18321 9520 1 8 . 1 1 10 10 ASP C C 10 174.455 174.455 177.099 -2.644 18321 9521 1 8 . 1 1 10 10 ASP CA C 10 52.432 52.432 54.285 -1.853 18321 9522 1 8 . 1 1 10 10 ASP CB C 10 39.607 39.607 41.365 -1.758 18321 9523 1 8 . 1 1 10 10 ASP H H 10 7.600 7.600 8.661 -1.061 18321 9524 1 8 . 1 1 11 11 ARG N N 11 125.238 125.238 126.568 -1.330 18321 9525 1 8 . 1 1 11 11 ARG HA H 11 1.936 1.936 2.901 -0.965 18321 9526 1 8 . 1 1 11 11 ARG C C 11 176.916 176.916 177.478 -0.562 18321 9527 1 8 . 1 1 11 11 ARG CA C 11 57.451 57.451 57.754 -0.303 18321 9528 1 8 . 1 1 11 11 ARG CB C 11 43.014 43.014 29.024 13.990 18321 9529 1 8 . 1 1 11 11 ARG H H 11 7.739 7.739 8.352 -0.614 18321 9530 1 8 . 1 1 12 12 SER N N 12 112.065 112.065 113.157 -1.092 18321 9531 1 8 . 1 1 12 12 SER HA H 12 4.695 4.695 4.169 0.526 18321 9532 1 8 . 1 1 12 12 SER C C 12 175.092 175.092 176.021 -0.929 18321 9533 1 8 . 1 1 12 12 SER CA C 12 60.785 60.785 60.683 0.102 18321 9534 1 8 . 1 1 12 12 SER CB C 12 62.889 62.889 62.315 0.574 18321 9535 1 8 . 1 1 12 12 SER H H 12 7.888 7.888 8.444 -0.556 18321 9536 1 8 . 1 1 13 13 ALA N N 13 122.249 122.249 125.352 -3.103 18321 9537 1 8 . 1 1 13 13 ALA HA H 13 4.216 4.216 4.281 -0.065 18321 9538 1 8 . 1 1 13 13 ALA C C 13 178.069 178.069 177.939 0.130 18321 9539 1 8 . 1 1 13 13 ALA CA C 13 53.562 53.562 54.112 -0.550 18321 9540 1 8 . 1 1 13 13 ALA CB C 13 19.339 19.339 19.144 0.195 18321 9541 1 8 . 1 1 13 13 ALA H H 13 7.418 7.418 7.769 -0.351 18321 9542 1 8 . 1 1 14 14 TRP N N 14 107.433 107.433 112.795 -5.362 18321 9543 1 8 . 1 1 14 14 TRP HA H 14 4.785 4.785 4.595 0.190 18321 9544 1 8 . 1 1 14 14 TRP C C 14 175.286 175.286 175.425 -0.139 18321 9545 1 8 . 1 1 14 14 TRP CA C 14 55.212 55.212 55.840 -0.628 18321 9546 1 8 . 1 1 14 14 TRP CB C 14 32.776 32.776 31.036 1.740 18321 9547 1 8 . 1 1 14 14 TRP H H 14 6.273 6.273 6.843 -0.570 18321 9548 1 8 . 1 1 15 15 TYR N N 15 122.315 122.315 124.160 -1.845 18321 9549 1 8 . 1 1 15 15 TYR HA H 15 5.436 5.436 4.950 0.486 18321 9550 1 8 . 1 1 15 15 TYR C C 15 175.325 175.325 175.344 -0.019 18321 9551 1 8 . 1 1 15 15 TYR CA C 15 56.609 56.609 57.985 -1.376 18321 9552 1 8 . 1 1 15 15 TYR CB C 15 36.940 36.940 38.949 -2.009 18321 9553 1 8 . 1 1 15 15 TYR H H 15 8.221 8.221 7.894 0.327 18321 9554 1 8 . 1 1 16 16 MET N N 16 126.031 126.031 126.189 -0.158 18321 9555 1 8 . 1 1 16 16 MET HA H 16 4.462 4.462 4.436 0.026 18321 9556 1 8 . 1 1 16 16 MET CA C 16 53.046 53.046 53.220 -0.174 18321 9557 1 8 . 1 1 16 16 MET CB C 16 41.114 41.114 32.496 8.618 18321 9558 1 8 . 1 1 16 16 MET H H 16 8.989 8.989 8.574 0.415 18321 9559 1 8 . 1 1 17 17 GLY CA C 17 45.803 45.803 45.436 0.367 18321 9560 1 8 . 1 1 18 18 PRO HA H 18 4.675 4.675 4.468 0.207 18321 9561 1 8 . 1 1 18 18 PRO C C 18 175.943 175.943 175.130 0.813 18321 9562 1 8 . 1 1 18 18 PRO CA C 18 63.647 63.647 63.352 0.295 18321 9563 1 8 . 1 1 18 18 PRO CB C 18 29.276 29.276 31.150 -1.874 18321 9564 1 8 . 1 1 19 19 VAL N N 19 126.159 126.159 124.378 1.781 18321 9565 1 8 . 1 1 19 19 VAL HA H 19 4.011 4.011 4.398 -0.387 18321 9566 1 8 . 1 1 19 19 VAL C C 19 175.812 175.812 174.837 0.975 18321 9567 1 8 . 1 1 19 19 VAL CA C 19 62.355 62.355 61.460 0.895 18321 9568 1 8 . 1 1 19 19 VAL CB C 19 33.468 33.468 34.165 -0.697 18321 9569 1 8 . 1 1 19 19 VAL H H 19 7.851 7.851 7.641 0.210 18321 9570 1 8 . 1 1 20 20 SER N N 20 123.950 123.950 110.407 13.543 18321 9571 1 8 . 1 1 20 20 SER HA H 20 4.453 4.453 4.188 0.265 18321 9572 1 8 . 1 1 20 20 SER CA C 20 57.631 57.631 58.771 -1.140 18321 9573 1 8 . 1 1 20 20 SER CB C 20 65.951 65.951 62.980 2.971 18321 9574 1 8 . 1 1 20 20 SER H H 20 8.800 8.800 7.986 0.814 18321 9575 1 8 . 1 1 21 21 ARG N N 21 123.461 123.461 122.281 1.180 18321 9576 1 8 . 1 1 21 21 ARG HA H 21 3.489 3.489 4.042 -0.553 18321 9577 1 8 . 1 1 21 21 ARG C C 21 178.164 178.164 178.636 -0.472 18321 9578 1 8 . 1 1 21 21 ARG CA C 21 60.025 60.025 60.458 -0.433 18321 9579 1 8 . 1 1 21 21 ARG CB C 21 30.334 30.334 30.355 -0.021 18321 9580 1 8 . 1 1 21 21 ARG H H 21 9.307 9.307 8.903 0.404 18321 9581 1 8 . 1 1 22 22 GLN N N 22 116.591 116.591 118.064 -1.473 18321 9582 1 8 . 1 1 22 22 GLN HA H 22 4.008 4.008 4.000 0.008 18321 9583 1 8 . 1 1 22 22 GLN CA C 22 59.095 59.095 58.966 0.129 18321 9584 1 8 . 1 1 22 22 GLN CB C 22 29.249 29.249 28.259 0.990 18321 9585 1 8 . 1 1 22 22 GLN H H 22 8.394 8.394 8.393 0.001 18321 9586 1 8 . 1 1 23 23 GLU N N 23 122.191 122.191 119.274 2.917 18321 9587 1 8 . 1 1 23 23 GLU HA H 23 4.037 4.037 4.022 0.015 18321 9588 1 8 . 1 1 23 23 GLU C C 23 178.986 178.986 179.038 -0.052 18321 9589 1 8 . 1 1 23 23 GLU CA C 23 59.081 59.081 59.048 0.033 18321 9590 1 8 . 1 1 23 23 GLU CB C 23 31.896 31.896 29.649 2.247 18321 9591 1 8 . 1 1 23 23 GLU H H 23 8.106 8.106 7.786 0.320 18321 9592 1 8 . 1 1 24 24 ALA N N 24 121.964 121.964 122.182 -0.218 18321 9593 1 8 . 1 1 24 24 ALA HA H 24 3.762 3.762 3.913 -0.151 18321 9594 1 8 . 1 1 24 24 ALA C C 24 178.653 178.653 179.334 -0.681 18321 9595 1 8 . 1 1 24 24 ALA CA C 24 55.480 55.480 55.665 -0.185 18321 9596 1 8 . 1 1 24 24 ALA CB C 24 18.049 18.049 18.329 -0.280 18321 9597 1 8 . 1 1 24 24 ALA H H 24 8.732 8.732 8.643 0.089 18321 9598 1 8 . 1 1 25 25 GLN N N 25 116.229 116.229 117.628 -1.399 18321 9599 1 8 . 1 1 25 25 GLN HA H 25 3.950 3.950 4.016 -0.066 18321 9600 1 8 . 1 1 25 25 GLN C C 25 177.442 177.442 178.391 -0.949 18321 9601 1 8 . 1 1 25 25 GLN CA C 25 59.651 59.651 58.761 0.890 18321 9602 1 8 . 1 1 25 25 GLN CB C 25 29.308 29.308 28.877 0.431 18321 9603 1 8 . 1 1 25 25 GLN H H 25 8.391 8.391 7.925 0.466 18321 9604 1 8 . 1 1 26 26 THR N N 26 115.105 115.105 114.419 0.686 18321 9605 1 8 . 1 1 26 26 THR HA H 26 3.920 3.920 4.099 -0.179 18321 9606 1 8 . 1 1 26 26 THR C C 26 176.835 176.835 176.199 0.636 18321 9607 1 8 . 1 1 26 26 THR CA C 26 66.335 66.335 65.380 0.955 18321 9608 1 8 . 1 1 26 26 THR CB C 26 68.876 68.876 68.794 0.082 18321 9609 1 8 . 1 1 26 26 THR H H 26 8.223 8.223 7.624 0.599 18321 9610 1 8 . 1 1 27 27 ARG N N 27 119.096 119.096 117.814 1.282 18321 9611 1 8 . 1 1 27 27 ARG HA H 27 4.047 4.047 4.241 -0.194 18321 9612 1 8 . 1 1 27 27 ARG C C 27 177.245 177.245 176.472 0.773 18321 9613 1 8 . 1 1 27 27 ARG CA C 27 58.528 58.528 57.438 1.090 18321 9614 1 8 . 1 1 27 27 ARG CB C 27 30.184 30.184 30.619 -0.435 18321 9615 1 8 . 1 1 27 27 ARG H H 27 8.093 8.093 7.777 0.316 18321 9616 1 8 . 1 1 28 28 LEU N N 28 114.602 114.602 115.729 -1.127 18321 9617 1 8 . 1 1 28 28 LEU HA H 28 4.325 4.325 4.517 -0.192 18321 9618 1 8 . 1 1 28 28 LEU C C 28 177.197 177.197 176.272 0.925 18321 9619 1 8 . 1 1 28 28 LEU CA C 28 55.143 55.143 54.115 1.028 18321 9620 1 8 . 1 1 28 28 LEU CB C 28 44.902 44.902 43.269 1.633 18321 9621 1 8 . 1 1 28 28 LEU H H 28 7.438 7.438 7.286 0.152 18321 9622 1 8 . 1 1 29 29 GLN N N 29 121.312 121.312 121.087 0.225 18321 9623 1 8 . 1 1 29 29 GLN HA H 29 3.856 3.856 4.137 -0.281 18321 9624 1 8 . 1 1 29 29 GLN C C 29 178.048 178.048 176.796 1.252 18321 9625 1 8 . 1 1 29 29 GLN CA C 29 57.691 57.691 56.535 1.156 18321 9626 1 8 . 1 1 29 29 GLN CB C 29 27.293 27.293 28.157 -0.864 18321 9627 1 8 . 1 1 29 29 GLN H H 29 8.250 8.250 8.079 0.171 18321 9628 1 8 . 1 1 30 30 GLY N N 30 116.768 116.768 115.751 1.017 18321 9629 1 8 . 1 1 30 30 GLY C C 30 174.914 174.914 173.883 1.031 18321 9630 1 8 . 1 1 30 30 GLY CA C 30 45.491 45.491 45.598 -0.107 18321 9631 1 8 . 1 1 30 30 GLY H H 30 9.135 9.135 8.508 0.627 18321 9632 1 8 . 1 1 31 31 GLN N N 31 117.979 117.979 117.736 0.243 18321 9633 1 8 . 1 1 31 31 GLN HA H 31 4.329 4.329 4.351 -0.022 18321 9634 1 8 . 1 1 31 31 GLN C C 31 177.174 177.174 175.559 1.615 18321 9635 1 8 . 1 1 31 31 GLN CA C 31 53.910 53.910 52.909 1.001 18321 9636 1 8 . 1 1 31 31 GLN CB C 31 29.574 29.574 30.747 -1.173 18321 9637 1 8 . 1 1 31 31 GLN H H 31 7.695 7.695 7.604 0.091 18321 9638 1 8 . 1 1 32 32 ARG N N 32 123.918 123.918 120.475 3.443 18321 9639 1 8 . 1 1 32 32 ARG HA H 32 3.940 3.940 3.872 0.068 18321 9640 1 8 . 1 1 32 32 ARG C C 32 175.810 175.810 175.898 -0.088 18321 9641 1 8 . 1 1 32 32 ARG CA C 32 56.770 56.770 56.446 0.324 18321 9642 1 8 . 1 1 32 32 ARG CB C 32 30.074 30.074 29.961 0.113 18321 9643 1 8 . 1 1 32 32 ARG H H 32 8.955 8.955 8.458 0.497 18321 9644 1 8 . 1 1 33 33 HIS N N 33 122.248 122.248 123.367 -1.119 18321 9645 1 8 . 1 1 33 33 HIS HA H 33 4.627 4.627 4.523 0.104 18321 9646 1 8 . 1 1 33 33 HIS C C 33 177.089 177.089 175.945 1.144 18321 9647 1 8 . 1 1 33 33 HIS CA C 33 55.858 55.858 57.157 -1.299 18321 9648 1 8 . 1 1 33 33 HIS CB C 33 28.648 28.648 29.150 -0.502 18321 9649 1 8 . 1 1 33 33 HIS H H 33 8.302 8.302 8.299 0.003 18321 9650 1 8 . 1 1 34 34 GLY N N 34 109.518 109.518 113.097 -3.579 18321 9651 1 8 . 1 1 34 34 GLY C C 34 176.730 176.730 173.767 2.963 18321 9652 1 8 . 1 1 34 34 GLY CA C 34 45.967 45.967 44.831 1.136 18321 9653 1 8 . 1 1 34 34 GLY H H 34 9.496 9.496 9.063 0.433 18321 9654 1 8 . 1 1 35 35 MET N N 35 125.193 125.193 122.866 2.327 18321 9655 1 8 . 1 1 35 35 MET HA H 35 5.750 5.750 5.688 0.062 18321 9656 1 8 . 1 1 35 35 MET C C 35 174.388 174.388 175.137 -0.749 18321 9657 1 8 . 1 1 35 35 MET CA C 35 55.762 55.762 56.720 -0.958 18321 9658 1 8 . 1 1 35 35 MET CB C 35 32.706 32.706 33.914 -1.208 18321 9659 1 8 . 1 1 35 35 MET H H 35 8.359 8.359 7.772 0.587 18321 9660 1 8 . 1 1 36 36 PHE N N 36 123.311 123.311 117.600 5.711 18321 9661 1 8 . 1 1 36 36 PHE HA H 36 5.985 5.985 5.775 0.210 18321 9662 1 8 . 1 1 36 36 PHE C C 36 172.140 172.140 172.864 -0.724 18321 9663 1 8 . 1 1 36 36 PHE CA C 36 55.755 55.755 55.222 0.533 18321 9664 1 8 . 1 1 36 36 PHE CB C 36 45.197 45.197 42.827 2.370 18321 9665 1 8 . 1 1 36 36 PHE H H 36 8.261 8.261 7.811 0.450 18321 9666 1 8 . 1 1 37 37 LEU N N 37 114.652 114.652 115.665 -1.013 18321 9667 1 8 . 1 1 37 37 LEU HA H 37 4.489 4.489 4.814 -0.325 18321 9668 1 8 . 1 1 37 37 LEU C C 37 174.033 174.033 174.755 -0.722 18321 9669 1 8 . 1 1 37 37 LEU CA C 37 55.382 55.382 54.680 0.702 18321 9670 1 8 . 1 1 37 37 LEU CB C 37 44.791 44.791 45.815 -1.024 18321 9671 1 8 . 1 1 37 37 LEU H H 37 9.292 9.292 8.875 0.417 18321 9672 1 8 . 1 1 38 38 VAL N N 38 121.009 121.009 122.791 -1.782 18321 9673 1 8 . 1 1 38 38 VAL HA H 38 5.504 5.504 4.815 0.689 18321 9674 1 8 . 1 1 38 38 VAL C C 38 173.581 173.581 175.245 -1.664 18321 9675 1 8 . 1 1 38 38 VAL CA C 38 61.316 61.316 61.396 -0.080 18321 9676 1 8 . 1 1 38 38 VAL CB C 38 33.302 33.302 32.599 0.703 18321 9677 1 8 . 1 1 38 38 VAL H H 38 8.991 8.991 8.546 0.445 18321 9678 1 8 . 1 1 39 39 ARG N N 39 124.863 124.863 128.398 -3.535 18321 9679 1 8 . 1 1 39 39 ARG HA H 39 5.444 5.444 4.922 0.522 18321 9680 1 8 . 1 1 39 39 ARG C C 39 175.772 175.772 174.521 1.251 18321 9681 1 8 . 1 1 39 39 ARG CA C 39 52.558 52.558 52.893 -0.335 18321 9682 1 8 . 1 1 39 39 ARG CB C 39 34.980 34.980 32.738 2.242 18321 9683 1 8 . 1 1 39 39 ARG H H 39 9.569 9.569 7.951 1.618 18321 9684 1 8 . 1 1 40 40 ASP N N 40 122.330 122.330 120.248 2.082 18321 9685 1 8 . 1 1 40 40 ASP HA H 40 4.785 4.785 4.861 -0.076 18321 9686 1 8 . 1 1 40 40 ASP C C 40 176.332 176.332 175.803 0.529 18321 9687 1 8 . 1 1 40 40 ASP CA C 40 55.334 55.334 55.604 -0.270 18321 9688 1 8 . 1 1 40 40 ASP CB C 40 40.650 40.650 41.575 -0.925 18321 9689 1 8 . 1 1 40 40 ASP H H 40 8.413 8.413 8.423 -0.010 18321 9690 1 8 . 1 1 41 41 SER N N 41 114.363 114.363 120.836 -6.473 18321 9691 1 8 . 1 1 41 41 SER HA H 41 4.506 4.506 4.629 -0.123 18321 9692 1 8 . 1 1 41 41 SER CA C 41 57.525 57.525 58.152 -0.627 18321 9693 1 8 . 1 1 41 41 SER CB C 41 63.706 63.706 64.058 -0.352 18321 9694 1 8 . 1 1 41 41 SER H H 41 7.791 7.791 8.364 -0.573 18321 9695 1 8 . 1 1 42 42 SER N N 42 126.932 126.932 119.288 7.644 18321 9696 1 8 . 1 1 42 42 SER HA H 42 4.410 4.410 4.639 -0.229 18321 9697 1 8 . 1 1 42 42 SER CA C 42 60.362 60.362 59.621 0.741 18321 9698 1 8 . 1 1 42 42 SER CB C 42 63.707 63.707 63.069 0.638 18321 9699 1 8 . 1 1 42 42 SER H H 42 10.519 10.519 8.861 1.658 18321 9700 1 8 . 1 1 43 43 THR HA H 43 4.097 4.097 4.230 -0.133 18321 9701 1 8 . 1 1 43 43 THR CA C 43 64.722 64.722 64.983 -0.261 18321 9702 1 8 . 1 1 43 43 THR CB C 43 69.439 69.439 69.698 -0.259 18321 9703 1 8 . 1 1 44 44 CYS HA H 44 5.100 5.100 4.759 0.341 18321 9704 1 8 . 1 1 44 44 CYS CA C 44 51.779 51.779 56.233 -4.454 18321 9705 1 8 . 1 1 44 44 CYS CB C 44 41.314 41.314 29.887 11.427 18321 9706 1 8 . 1 1 45 45 PRO HA H 45 4.278 4.278 4.600 -0.322 18321 9707 1 8 . 1 1 45 45 PRO C C 45 178.127 178.127 176.699 1.428 18321 9708 1 8 . 1 1 45 45 PRO CA C 45 64.151 64.151 64.454 -0.303 18321 9709 1 8 . 1 1 45 45 PRO CB C 45 31.596 31.596 30.874 0.722 18321 9710 1 8 . 1 1 46 46 GLY N N 46 114.947 114.947 113.450 1.497 18321 9711 1 8 . 1 1 46 46 GLY C C 46 174.701 174.701 173.484 1.217 18321 9712 1 8 . 1 1 46 46 GLY CA C 46 45.225 45.225 44.662 0.563 18321 9713 1 8 . 1 1 46 46 GLY H H 46 8.812 8.812 8.423 0.389 18321 9714 1 8 . 1 1 47 47 ASP N N 47 120.862 120.862 122.854 -1.992 18321 9715 1 8 . 1 1 47 47 ASP HA H 47 5.235 5.235 4.697 0.538 18321 9716 1 8 . 1 1 47 47 ASP C C 47 176.480 176.480 174.925 1.555 18321 9717 1 8 . 1 1 47 47 ASP CA C 47 53.591 53.591 54.359 -0.768 18321 9718 1 8 . 1 1 47 47 ASP CB C 47 41.707 41.707 42.521 -0.814 18321 9719 1 8 . 1 1 47 47 ASP H H 47 7.997 7.997 7.860 0.137 18321 9720 1 8 . 1 1 48 48 TYR N N 48 118.473 118.473 119.845 -1.372 18321 9721 1 8 . 1 1 48 48 TYR HA H 48 5.431 5.431 5.365 0.066 18321 9722 1 8 . 1 1 48 48 TYR C C 48 173.783 173.783 175.103 -1.320 18321 9723 1 8 . 1 1 48 48 TYR CA C 48 56.891 56.891 55.857 1.034 18321 9724 1 8 . 1 1 48 48 TYR CB C 48 43.274 43.274 42.762 0.512 18321 9725 1 8 . 1 1 48 48 TYR H H 48 8.892 8.892 8.871 0.021 18321 9726 1 8 . 1 1 49 49 VAL N N 49 119.105 119.105 120.279 -1.174 18321 9727 1 8 . 1 1 49 49 VAL HA H 49 4.800 4.800 4.749 0.051 18321 9728 1 8 . 1 1 49 49 VAL C C 49 174.397 174.397 174.784 -0.387 18321 9729 1 8 . 1 1 49 49 VAL CA C 49 61.439 61.439 61.267 0.172 18321 9730 1 8 . 1 1 49 49 VAL CB C 49 35.388 35.388 33.364 2.024 18321 9731 1 8 . 1 1 49 49 VAL H H 49 9.661 9.661 8.582 1.079 18321 9732 1 8 . 1 1 50 50 LEU N N 50 129.599 129.599 131.156 -1.557 18321 9733 1 8 . 1 1 50 50 LEU HA H 50 5.033 5.033 4.874 0.159 18321 9734 1 8 . 1 1 50 50 LEU C C 50 175.001 175.001 175.433 -0.432 18321 9735 1 8 . 1 1 50 50 LEU CA C 50 53.352 53.352 54.024 -0.672 18321 9736 1 8 . 1 1 50 50 LEU CB C 50 44.062 44.062 41.831 2.231 18321 9737 1 8 . 1 1 50 50 LEU H H 50 9.405 9.405 9.170 0.235 18321 9738 1 8 . 1 1 51 51 SER N N 51 126.895 126.895 124.257 2.638 18321 9739 1 8 . 1 1 51 51 SER HA H 51 5.731 5.731 5.505 0.226 18321 9740 1 8 . 1 1 51 51 SER C C 51 173.094 173.094 173.586 -0.492 18321 9741 1 8 . 1 1 51 51 SER CA C 51 58.834 58.834 57.158 1.676 18321 9742 1 8 . 1 1 51 51 SER CB C 51 64.977 64.977 64.290 0.687 18321 9743 1 8 . 1 1 51 51 SER H H 51 9.094 9.094 8.755 0.339 18321 9744 1 8 . 1 1 52 52 VAL N N 52 121.777 121.777 125.159 -3.382 18321 9745 1 8 . 1 1 52 52 VAL HA H 52 5.066 5.066 4.661 0.405 18321 9746 1 8 . 1 1 52 52 VAL C C 52 174.573 174.573 174.691 -0.118 18321 9747 1 8 . 1 1 52 52 VAL CA C 52 59.535 59.535 61.163 -1.629 18321 9748 1 8 . 1 1 52 52 VAL CB C 52 36.834 36.834 35.716 1.118 18321 9749 1 8 . 1 1 52 52 VAL H H 52 8.816 8.816 8.531 0.285 18321 9750 1 8 . 1 1 53 53 SER N N 53 120.489 120.489 121.723 -1.234 18321 9751 1 8 . 1 1 53 53 SER HA H 53 4.811 4.811 4.652 0.159 18321 9752 1 8 . 1 1 53 53 SER C C 53 174.065 174.065 173.017 1.048 18321 9753 1 8 . 1 1 53 53 SER CA C 53 57.496 57.496 58.066 -0.570 18321 9754 1 8 . 1 1 53 53 SER CB C 53 62.623 62.623 62.869 -0.246 18321 9755 1 8 . 1 1 53 53 SER H H 53 8.780 8.780 9.211 -0.431 18321 9756 1 8 . 1 1 54 54 GLU N N 54 132.020 132.020 128.292 3.728 18321 9757 1 8 . 1 1 54 54 GLU HA H 54 4.250 4.250 4.564 -0.314 18321 9758 1 8 . 1 1 54 54 GLU C C 54 175.387 175.387 175.138 0.249 18321 9759 1 8 . 1 1 54 54 GLU CA C 54 56.999 56.999 55.792 1.207 18321 9760 1 8 . 1 1 54 54 GLU CB C 54 32.556 32.556 33.589 -1.032 18321 9761 1 8 . 1 1 54 54 GLU H H 54 8.472 8.472 7.748 0.724 18321 9762 1 8 . 1 1 55 55 ASN N N 55 126.517 126.517 121.024 5.493 18321 9763 1 8 . 1 1 55 55 ASN HA H 55 4.220 4.220 3.999 0.221 18321 9764 1 8 . 1 1 55 55 ASN C C 55 174.546 174.546 174.957 -0.411 18321 9765 1 8 . 1 1 55 55 ASN CA C 55 54.770 54.770 54.059 0.711 18321 9766 1 8 . 1 1 55 55 ASN CB C 55 37.314 37.314 37.372 -0.058 18321 9767 1 8 . 1 1 55 55 ASN H H 55 8.853 8.853 8.566 0.287 18321 9768 1 8 . 1 1 56 56 SER N N 56 112.009 112.009 110.288 1.721 18321 9769 1 8 . 1 1 56 56 SER HA H 56 4.334 4.334 4.093 0.241 18321 9770 1 8 . 1 1 56 56 SER C C 56 173.354 173.354 173.271 0.083 18321 9771 1 8 . 1 1 56 56 SER CA C 56 59.966 59.966 59.459 0.507 18321 9772 1 8 . 1 1 56 56 SER CB C 56 62.242 62.242 62.717 -0.474 18321 9773 1 8 . 1 1 56 56 SER H H 56 10.418 10.418 8.180 2.238 18321 9774 1 8 . 1 1 57 57 ARG N N 57 121.764 121.764 120.855 0.909 18321 9775 1 8 . 1 1 57 57 ARG HA H 57 5.167 5.167 4.462 0.705 18321 9776 1 8 . 1 1 57 57 ARG C C 57 174.983 174.983 174.083 0.900 18321 9777 1 8 . 1 1 57 57 ARG CA C 57 54.550 54.550 55.329 -0.779 18321 9778 1 8 . 1 1 57 57 ARG CB C 57 31.886 31.886 31.485 0.401 18321 9779 1 8 . 1 1 57 57 ARG H H 57 8.097 8.097 8.137 -0.040 18321 9780 1 8 . 1 1 58 58 VAL N N 58 121.866 121.866 123.997 -2.131 18321 9781 1 8 . 1 1 58 58 VAL HA H 58 4.768 4.768 4.204 0.564 18321 9782 1 8 . 1 1 58 58 VAL C C 58 175.388 175.388 175.716 -0.328 18321 9783 1 8 . 1 1 58 58 VAL CA C 58 61.818 61.818 62.855 -1.037 18321 9784 1 8 . 1 1 58 58 VAL CB C 58 34.135 34.135 30.872 3.263 18321 9785 1 8 . 1 1 58 58 VAL H H 58 8.081 8.081 8.262 -0.181 18321 9786 1 8 . 1 1 59 59 SER N N 59 124.445 124.445 122.677 1.768 18321 9787 1 8 . 1 1 59 59 SER HA H 59 4.462 4.462 4.164 0.298 18321 9788 1 8 . 1 1 59 59 SER C C 59 172.185 172.185 173.429 -1.244 18321 9789 1 8 . 1 1 59 59 SER CA C 59 56.629 56.629 58.805 -2.176 18321 9790 1 8 . 1 1 59 59 SER CB C 59 66.218 66.218 63.357 2.861 18321 9791 1 8 . 1 1 59 59 SER H H 59 9.082 9.082 8.028 1.054 18321 9792 1 8 . 1 1 60 60 HIS N N 60 121.224 121.224 125.976 -4.752 18321 9793 1 8 . 1 1 60 60 HIS HA H 60 4.885 4.885 4.599 0.286 18321 9794 1 8 . 1 1 60 60 HIS C C 60 174.674 174.674 173.937 0.737 18321 9795 1 8 . 1 1 60 60 HIS CA C 60 54.900 54.900 55.346 -0.446 18321 9796 1 8 . 1 1 60 60 HIS CB C 60 32.331 32.331 29.356 2.975 18321 9797 1 8 . 1 1 60 60 HIS H H 60 8.331 8.331 8.396 -0.065 18321 9798 1 8 . 1 1 61 61 TYR N N 61 124.780 124.780 124.088 0.692 18321 9799 1 8 . 1 1 61 61 TYR HA H 61 4.655 4.655 4.660 -0.005 18321 9800 1 8 . 1 1 61 61 TYR CA C 61 57.409 57.409 56.970 0.439 18321 9801 1 8 . 1 1 61 61 TYR CB C 61 39.785 39.785 38.371 1.414 18321 9802 1 8 . 1 1 61 61 TYR H H 61 9.273 9.273 8.982 0.291 18321 9803 1 8 . 1 1 62 62 ILE HA H 62 4.298 4.298 4.386 -0.088 18321 9804 1 8 . 1 1 62 62 ILE C C 62 174.817 174.817 175.719 -0.902 18321 9805 1 8 . 1 1 62 62 ILE CA C 62 61.908 61.908 61.965 -0.057 18321 9806 1 8 . 1 1 62 62 ILE CB C 62 38.321 38.321 39.367 -1.046 18321 9807 1 8 . 1 1 63 63 ILE N N 63 128.552 128.552 126.127 2.425 18321 9808 1 8 . 1 1 63 63 ILE HA H 63 4.788 4.788 4.807 -0.019 18321 9809 1 8 . 1 1 63 63 ILE C C 63 175.982 175.982 174.635 1.347 18321 9810 1 8 . 1 1 63 63 ILE CA C 63 59.629 59.629 60.113 -0.484 18321 9811 1 8 . 1 1 63 63 ILE CB C 63 39.747 39.747 39.548 0.199 18321 9812 1 8 . 1 1 63 63 ILE H H 63 9.155 9.155 9.093 0.062 18321 9813 1 8 . 1 1 64 64 ASN N N 64 123.240 123.240 127.544 -4.304 18321 9814 1 8 . 1 1 64 64 ASN HA H 64 4.857 4.857 5.332 -0.475 18321 9815 1 8 . 1 1 64 64 ASN C C 64 175.324 175.324 175.141 0.183 18321 9816 1 8 . 1 1 64 64 ASN CA C 64 53.736 53.736 52.974 0.762 18321 9817 1 8 . 1 1 64 64 ASN CB C 64 41.531 41.531 39.934 1.597 18321 9818 1 8 . 1 1 64 64 ASN H H 64 9.379 9.379 8.745 0.634 18321 9819 1 8 . 1 1 65 65 SER N N 65 121.157 121.157 118.485 2.672 18321 9820 1 8 . 1 1 65 65 SER HA H 65 4.548 4.548 4.321 0.227 18321 9821 1 8 . 1 1 65 65 SER C C 65 174.328 174.328 174.466 -0.138 18321 9822 1 8 . 1 1 65 65 SER CA C 65 58.306 58.306 58.227 0.079 18321 9823 1 8 . 1 1 65 65 SER CB C 65 62.878 62.878 62.833 0.045 18321 9824 1 8 . 1 1 65 65 SER H H 65 9.195 9.195 8.623 0.572 18321 9825 1 8 . 1 1 66 66 LEU N N 66 127.417 127.417 129.374 -1.957 18321 9826 1 8 . 1 1 66 66 LEU HA H 66 4.605 4.605 4.550 0.055 18321 9827 1 8 . 1 1 66 66 LEU CA C 66 52.888 52.888 52.739 0.149 18321 9828 1 8 . 1 1 66 66 LEU CB C 66 41.799 41.799 41.634 0.165 18321 9829 1 8 . 1 1 66 66 LEU H H 66 8.143 8.143 8.427 -0.284 18321 9830 1 8 . 1 1 68 68 ASN HA H 68 4.386 4.386 4.581 -0.195 18321 9831 1 8 . 1 1 68 68 ASN C C 68 174.487 174.487 175.063 -0.576 18321 9832 1 8 . 1 1 68 68 ASN CA C 68 53.365 53.365 53.287 0.078 18321 9833 1 8 . 1 1 68 68 ASN CB C 68 36.778 36.778 37.554 -0.776 18321 9834 1 8 . 1 1 69 69 ARG N N 69 111.329 111.329 113.091 -1.762 18321 9835 1 8 . 1 1 69 69 ARG HA H 69 3.876 3.876 3.801 0.075 18321 9836 1 8 . 1 1 69 69 ARG CA C 69 57.393 57.393 57.098 0.295 18321 9837 1 8 . 1 1 69 69 ARG CB C 69 26.665 26.665 26.913 -0.248 18321 9838 1 8 . 1 1 69 69 ARG H H 69 8.191 8.191 7.917 0.274 18321 9839 1 8 . 1 1 70 70 ARG N N 70 116.120 116.120 115.042 1.078 18321 9840 1 8 . 1 1 70 70 ARG HA H 70 4.556 4.556 4.952 -0.396 18321 9841 1 8 . 1 1 70 70 ARG C C 70 174.882 174.882 174.275 0.607 18321 9842 1 8 . 1 1 70 70 ARG CA C 70 55.509 55.509 53.675 1.834 18321 9843 1 8 . 1 1 70 70 ARG CB C 70 31.771 31.771 33.328 -1.557 18321 9844 1 8 . 1 1 70 70 ARG H H 70 6.667 6.667 7.235 -0.568 18321 9845 1 8 . 1 1 71 71 PHE N N 71 116.313 116.313 118.368 -2.055 18321 9846 1 8 . 1 1 71 71 PHE HA H 71 5.540 5.540 5.438 0.102 18321 9847 1 8 . 1 1 71 71 PHE C C 71 174.391 174.391 175.142 -0.751 18321 9848 1 8 . 1 1 71 71 PHE CA C 71 57.528 57.528 56.801 0.727 18321 9849 1 8 . 1 1 71 71 PHE CB C 71 44.115 44.115 41.976 2.139 18321 9850 1 8 . 1 1 71 71 PHE H H 71 8.700 8.700 8.416 0.284 18321 9851 1 8 . 1 1 72 72 LYS N N 72 122.770 122.770 125.963 -3.193 18321 9852 1 8 . 1 1 72 72 LYS HA H 72 5.483 5.483 4.798 0.685 18321 9853 1 8 . 1 1 72 72 LYS C C 72 173.923 173.923 175.376 -1.453 18321 9854 1 8 . 1 1 72 72 LYS CA C 72 54.855 54.855 55.469 -0.614 18321 9855 1 8 . 1 1 72 72 LYS CB C 72 37.710 37.710 34.098 3.612 18321 9856 1 8 . 1 1 72 72 LYS H H 72 9.138 9.138 9.106 0.032 18321 9857 1 8 . 1 1 73 73 ILE N N 73 124.576 124.576 129.865 -5.289 18321 9858 1 8 . 1 1 73 73 ILE HA H 73 4.955 4.955 4.770 0.185 18321 9859 1 8 . 1 1 73 73 ILE C C 73 175.728 175.728 175.446 0.282 18321 9860 1 8 . 1 1 73 73 ILE CA C 73 58.935 58.935 59.986 -1.051 18321 9861 1 8 . 1 1 73 73 ILE CB C 73 40.965 40.965 37.557 3.408 18321 9862 1 8 . 1 1 73 73 ILE H H 73 8.826 8.826 8.292 0.534 18321 9863 1 8 . 1 1 74 74 GLY N N 74 118.718 118.718 117.226 1.492 18321 9864 1 8 . 1 1 74 74 GLY C C 74 174.436 174.436 175.100 -0.664 18321 9865 1 8 . 1 1 74 74 GLY CA C 74 47.401 47.401 45.187 2.214 18321 9866 1 8 . 1 1 74 74 GLY H H 74 9.317 9.317 8.389 0.928 18321 9867 1 8 . 1 1 75 75 ASP N N 75 125.691 125.691 119.209 6.482 18321 9868 1 8 . 1 1 75 75 ASP HA H 75 4.713 4.713 4.239 0.474 18321 9869 1 8 . 1 1 75 75 ASP C C 75 175.841 175.841 175.222 0.619 18321 9870 1 8 . 1 1 75 75 ASP CA C 75 53.815 53.815 56.647 -2.832 18321 9871 1 8 . 1 1 75 75 ASP CB C 75 41.288 41.288 40.246 1.042 18321 9872 1 8 . 1 1 75 75 ASP H H 75 8.665 8.665 8.861 -0.196 18321 9873 1 8 . 1 1 76 76 GLN N N 76 120.368 120.368 121.474 -1.106 18321 9874 1 8 . 1 1 76 76 GLN C C 76 173.630 173.630 174.320 -0.690 18321 9875 1 8 . 1 1 76 76 GLN CA C 76 54.254 54.254 55.183 -0.929 18321 9876 1 8 . 1 1 76 76 GLN CB C 76 31.248 31.248 29.814 1.434 18321 9877 1 8 . 1 1 76 76 GLN H H 76 8.289 8.289 8.090 0.199 18321 9878 1 8 . 1 1 77 77 GLU N N 77 120.435 120.435 123.667 -3.232 18321 9879 1 8 . 1 1 77 77 GLU C C 77 175.484 175.484 175.233 0.251 18321 9880 1 8 . 1 1 77 77 GLU CA C 77 54.203 54.203 54.617 -0.414 18321 9881 1 8 . 1 1 77 77 GLU CB C 77 33.141 33.141 31.216 1.925 18321 9882 1 8 . 1 1 77 77 GLU H H 77 7.732 7.732 8.346 -0.614 18321 9883 1 8 . 1 1 78 78 PHE N N 78 117.911 117.911 121.903 -3.992 18321 9884 1 8 . 1 1 78 78 PHE HA H 78 4.659 4.659 4.779 -0.120 18321 9885 1 8 . 1 1 78 78 PHE C C 78 175.673 175.673 176.362 -0.689 18321 9886 1 8 . 1 1 78 78 PHE CA C 78 57.160 57.160 56.093 1.067 18321 9887 1 8 . 1 1 78 78 PHE CB C 78 45.405 45.405 41.539 3.866 18321 9888 1 8 . 1 1 78 78 PHE H H 78 9.235 9.235 8.685 0.550 18321 9889 1 8 . 1 1 79 79 ASP N N 79 119.296 119.296 117.617 1.679 18321 9890 1 8 . 1 1 79 79 ASP HA H 79 4.462 4.462 4.385 0.077 18321 9891 1 8 . 1 1 79 79 ASP C C 79 174.482 174.482 175.518 -1.036 18321 9892 1 8 . 1 1 79 79 ASP CA C 79 56.629 56.629 56.012 0.617 18321 9893 1 8 . 1 1 79 79 ASP CB C 79 41.697 41.697 40.691 1.006 18321 9894 1 8 . 1 1 79 79 ASP H H 79 9.187 9.187 8.794 0.393 18321 9895 1 8 . 1 1 80 80 HIS N N 80 107.631 107.631 112.012 -4.381 18321 9896 1 8 . 1 1 80 80 HIS HA H 80 5.022 5.022 5.037 -0.015 18321 9897 1 8 . 1 1 80 80 HIS C C 80 174.626 174.626 175.047 -0.421 18321 9898 1 8 . 1 1 80 80 HIS CA C 80 54.223 54.223 54.779 -0.556 18321 9899 1 8 . 1 1 80 80 HIS CB C 80 32.205 32.205 30.474 1.731 18321 9900 1 8 . 1 1 80 80 HIS H H 80 7.200 7.200 7.295 -0.095 18321 9901 1 8 . 1 1 81 81 LEU N N 81 120.710 120.710 121.738 -1.028 18321 9902 1 8 . 1 1 81 81 LEU HA H 81 3.804 3.804 4.093 -0.289 18321 9903 1 8 . 1 1 81 81 LEU CA C 81 58.709 58.709 60.092 -1.383 18321 9904 1 8 . 1 1 81 81 LEU CB C 81 39.646 39.646 39.749 -0.103 18321 9905 1 8 . 1 1 81 81 LEU H H 81 8.886 8.886 9.001 -0.115 18321 9906 1 8 . 1 1 82 82 PRO HA H 82 4.020 4.020 4.333 -0.313 18321 9907 1 8 . 1 1 82 82 PRO C C 82 175.619 175.619 177.437 -1.818 18321 9908 1 8 . 1 1 82 82 PRO CA C 82 67.025 67.025 64.754 2.271 18321 9909 1 8 . 1 1 82 82 PRO CB C 82 30.962 30.962 30.704 0.258 18321 9910 1 8 . 1 1 83 83 ALA N N 83 124.281 124.281 120.777 3.504 18321 9911 1 8 . 1 1 83 83 ALA HA H 83 4.019 4.019 4.399 -0.380 18321 9912 1 8 . 1 1 83 83 ALA C C 83 179.709 179.709 178.886 0.823 18321 9913 1 8 . 1 1 83 83 ALA CA C 83 54.985 54.985 54.350 0.635 18321 9914 1 8 . 1 1 83 83 ALA CB C 83 18.425 18.425 19.043 -0.618 18321 9915 1 8 . 1 1 83 83 ALA H H 83 8.527 8.527 8.034 0.493 18321 9916 1 8 . 1 1 84 84 LEU N N 84 122.960 122.960 117.993 4.967 18321 9917 1 8 . 1 1 84 84 LEU HA H 84 1.917 1.917 2.807 -0.890 18321 9918 1 8 . 1 1 84 84 LEU C C 84 177.652 177.652 178.086 -0.434 18321 9919 1 8 . 1 1 84 84 LEU CA C 84 58.261 58.261 57.156 1.105 18321 9920 1 8 . 1 1 84 84 LEU CB C 84 42.544 42.544 41.118 1.426 18321 9921 1 8 . 1 1 84 84 LEU H H 84 6.982 6.982 7.326 -0.344 18321 9922 1 8 . 1 1 85 85 LEU N N 85 117.940 117.940 118.671 -0.731 18321 9923 1 8 . 1 1 85 85 LEU HA H 85 3.463 3.463 3.808 -0.345 18321 9924 1 8 . 1 1 85 85 LEU C C 85 178.809 178.809 178.910 -0.101 18321 9925 1 8 . 1 1 85 85 LEU CA C 85 57.522 57.522 57.480 0.042 18321 9926 1 8 . 1 1 85 85 LEU CB C 85 41.242 41.242 41.122 0.120 18321 9927 1 8 . 1 1 85 85 LEU H H 85 7.773 7.773 7.580 0.193 18321 9928 1 8 . 1 1 86 86 GLU N N 86 115.762 115.762 117.313 -1.551 18321 9929 1 8 . 1 1 86 86 GLU HA H 86 3.540 3.540 3.911 -0.371 18321 9930 1 8 . 1 1 86 86 GLU C C 86 180.228 180.228 177.747 2.481 18321 9931 1 8 . 1 1 86 86 GLU CA C 86 58.943 58.943 58.709 0.234 18321 9932 1 8 . 1 1 86 86 GLU CB C 86 29.561 29.561 29.297 0.264 18321 9933 1 8 . 1 1 86 86 GLU H H 86 8.300 8.300 8.017 0.283 18321 9934 1 8 . 1 1 87 87 PHE N N 87 121.135 121.135 118.597 2.538 18321 9935 1 8 . 1 1 87 87 PHE HA H 87 4.122 4.122 4.236 -0.114 18321 9936 1 8 . 1 1 87 87 PHE C C 87 179.497 179.497 176.903 2.594 18321 9937 1 8 . 1 1 87 87 PHE CA C 87 62.090 62.090 59.791 2.299 18321 9938 1 8 . 1 1 87 87 PHE CB C 87 40.103 40.103 39.444 0.659 18321 9939 1 8 . 1 1 87 87 PHE H H 87 7.717 7.717 7.234 0.483 18321 9940 1 8 . 1 1 88 88 TYR N N 88 116.579 116.579 116.773 -0.194 18321 9941 1 8 . 1 1 88 88 TYR HA H 88 4.933 4.933 4.263 0.670 18321 9942 1 8 . 1 1 88 88 TYR C C 88 174.799 174.799 176.503 -1.704 18321 9943 1 8 . 1 1 88 88 TYR CA C 88 61.333 61.333 58.320 3.013 18321 9944 1 8 . 1 1 88 88 TYR CB C 88 36.539 36.539 36.930 -0.391 18321 9945 1 8 . 1 1 88 88 TYR H H 88 7.478 7.478 7.351 0.127 18321 9946 1 8 . 1 1 89 89 LYS N N 89 117.737 117.737 119.524 -1.787 18321 9947 1 8 . 1 1 89 89 LYS HA H 89 4.466 4.466 4.070 0.396 18321 9948 1 8 . 1 1 89 89 LYS C C 89 178.417 178.417 176.882 1.535 18321 9949 1 8 . 1 1 89 89 LYS CA C 89 59.486 59.486 58.390 1.096 18321 9950 1 8 . 1 1 89 89 LYS CB C 89 34.523 34.523 32.652 1.871 18321 9951 1 8 . 1 1 89 89 LYS H H 89 7.505 7.505 7.404 0.101 18321 9952 1 8 . 1 1 90 90 ILE N N 90 110.972 110.972 111.126 -0.154 18321 9953 1 8 . 1 1 90 90 ILE HA H 90 4.181 4.181 4.286 -0.105 18321 9954 1 8 . 1 1 90 90 ILE C C 90 174.571 174.571 176.081 -1.510 18321 9955 1 8 . 1 1 90 90 ILE CA C 90 60.516 60.516 61.342 -0.826 18321 9956 1 8 . 1 1 90 90 ILE CB C 90 39.979 39.979 38.441 1.538 18321 9957 1 8 . 1 1 90 90 ILE H H 90 6.710 6.710 7.171 -0.461 18321 9958 1 8 . 1 1 91 91 HIS N N 91 119.479 119.479 120.783 -1.304 18321 9959 1 8 . 1 1 91 91 HIS HA H 91 4.357 4.357 4.319 0.038 18321 9960 1 8 . 1 1 91 91 HIS C C 91 172.751 172.751 175.102 -2.351 18321 9961 1 8 . 1 1 91 91 HIS CA C 91 55.066 55.066 56.770 -1.704 18321 9962 1 8 . 1 1 91 91 HIS CB C 91 29.756 29.756 31.383 -1.627 18321 9963 1 8 . 1 1 91 91 HIS H H 91 7.460 7.460 7.375 0.085 18321 9964 1 8 . 1 1 92 92 TYR N N 92 117.642 117.642 115.819 1.823 18321 9965 1 8 . 1 1 92 92 TYR HA H 92 4.131 4.131 4.303 -0.172 18321 9966 1 8 . 1 1 92 92 TYR C C 92 177.348 177.348 176.484 0.864 18321 9967 1 8 . 1 1 92 92 TYR CA C 92 58.627 58.627 58.188 0.439 18321 9968 1 8 . 1 1 92 92 TYR CB C 92 39.481 39.481 35.779 3.702 18321 9969 1 8 . 1 1 92 92 TYR H H 92 8.067 8.067 7.431 0.636 18321 9970 1 8 . 1 1 93 93 LEU N N 93 123.560 123.560 122.068 1.492 18321 9971 1 8 . 1 1 93 93 LEU HA H 93 4.104 4.104 4.066 0.038 18321 9972 1 8 . 1 1 93 93 LEU C C 93 175.610 175.610 177.662 -2.052 18321 9973 1 8 . 1 1 93 93 LEU CA C 93 56.381 56.381 57.127 -0.746 18321 9974 1 8 . 1 1 93 93 LEU CB C 93 38.896 38.896 42.313 -3.417 18321 9975 1 8 . 1 1 93 93 LEU H H 93 7.907 7.907 8.114 -0.207 18321 9976 1 8 . 1 1 94 94 ASP N N 94 118.194 118.194 117.108 1.086 18321 9977 1 8 . 1 1 94 94 ASP HA H 94 4.940 4.940 4.851 0.089 18321 9978 1 8 . 1 1 94 94 ASP C C 94 176.123 176.123 175.961 0.162 18321 9979 1 8 . 1 1 94 94 ASP CA C 94 56.235 56.235 53.446 2.789 18321 9980 1 8 . 1 1 94 94 ASP CB C 94 42.078 42.078 41.086 0.992 18321 9981 1 8 . 1 1 94 94 ASP H H 94 8.640 8.640 8.781 -0.141 18321 9982 1 8 . 1 1 95 95 THR N N 95 105.073 105.073 116.496 -11.423 18321 9983 1 8 . 1 1 95 95 THR HA H 95 4.318 4.318 3.885 0.433 18321 9984 1 8 . 1 1 95 95 THR C C 95 174.685 174.685 173.329 1.356 18321 9985 1 8 . 1 1 95 95 THR CA C 95 60.756 60.756 64.362 -3.606 18321 9986 1 8 . 1 1 95 95 THR CB C 95 71.058 71.058 68.675 2.383 18321 9987 1 8 . 1 1 95 95 THR H H 95 8.576 8.576 8.517 0.059 18321 9988 1 8 . 1 1 96 96 THR N N 96 116.817 116.817 115.299 1.518 18321 9989 1 8 . 1 1 96 96 THR HA H 96 5.129 5.129 4.812 0.317 18321 9990 1 8 . 1 1 96 96 THR C C 96 172.464 172.464 173.736 -1.272 18321 9991 1 8 . 1 1 96 96 THR CA C 96 60.762 60.762 61.863 -1.101 18321 9992 1 8 . 1 1 96 96 THR CB C 96 71.425 71.425 72.105 -0.680 18321 9993 1 8 . 1 1 96 96 THR H H 96 8.205 8.205 7.424 0.781 18321 9994 1 8 . 1 1 97 97 THR N N 97 114.324 114.324 114.531 -0.207 18321 9995 1 8 . 1 1 97 97 THR HA H 97 5.128 5.128 4.496 0.632 18321 9996 1 8 . 1 1 97 97 THR C C 97 175.480 175.480 174.517 0.963 18321 9997 1 8 . 1 1 97 97 THR CA C 97 60.233 60.233 59.532 0.701 18321 9998 1 8 . 1 1 97 97 THR CB C 97 70.415 70.415 70.321 0.094 18321 9999 1 8 . 1 1 97 97 THR H H 97 7.128 7.128 8.223 -1.095 18321 10000 1 8 . 1 1 98 98 LEU N N 98 116.674 116.674 122.863 -6.189 18321 10001 1 8 . 1 1 98 98 LEU HA H 98 4.075 4.075 4.019 0.056 18321 10002 1 8 . 1 1 98 98 LEU C C 98 177.892 177.892 177.024 0.868 18321 10003 1 8 . 1 1 98 98 LEU CA C 98 59.597 59.597 55.285 4.312 18321 10004 1 8 . 1 1 98 98 LEU CB C 98 41.172 41.172 40.146 1.026 18321 10005 1 8 . 1 1 98 98 LEU H H 98 8.743 8.743 7.926 0.817 18321 10006 1 8 . 1 1 99 99 ILE N N 99 122.988 122.988 123.228 -0.240 18321 10007 1 8 . 1 1 99 99 ILE HA H 99 4.415 4.415 4.197 0.218 18321 10008 1 8 . 1 1 99 99 ILE C C 99 175.055 175.055 176.380 -1.325 18321 10009 1 8 . 1 1 99 99 ILE CA C 99 62.183 62.183 62.170 0.013 18321 10010 1 8 . 1 1 99 99 ILE CB C 99 40.252 40.252 38.499 1.753 18321 10011 1 8 . 1 1 99 99 ILE H H 99 8.998 8.998 8.196 0.802 18321 10012 1 8 . 1 1 100 100 GLU N N 100 114.067 114.067 113.524 0.543 18321 10013 1 8 . 1 1 100 100 GLU CA C 100 52.910 52.910 53.630 -0.720 18321 10014 1 8 . 1 1 100 100 GLU CB C 100 31.155 31.155 30.829 0.326 18321 10015 1 8 . 1 1 100 100 GLU H H 100 7.332 7.332 7.763 -0.431 18321 10016 1 8 . 1 1 101 101 PRO HA H 101 4.952 4.952 3.922 1.030 18321 10017 1 8 . 1 1 101 101 PRO C C 101 175.976 175.976 175.851 0.125 18321 10018 1 8 . 1 1 101 101 PRO CA C 101 53.312 53.312 62.001 -8.689 18321 10019 1 8 . 1 1 101 101 PRO CB C 101 31.598 31.598 32.166 -0.568 18321 10020 1 8 . 1 1 102 102 ALA N N 102 125.968 125.968 122.835 3.133 18321 10021 1 8 . 1 1 102 102 ALA HA H 102 4.516 4.516 4.369 0.147 18321 10022 1 8 . 1 1 102 102 ALA CA C 102 49.852 49.852 49.740 0.112 18321 10023 1 8 . 1 1 102 102 ALA CB C 102 17.766 17.766 18.591 -0.825 18321 10024 1 8 . 1 1 102 102 ALA H H 102 8.232 8.232 7.973 0.259 18321 10025 1 8 . 1 1 103 103 PRO HA H 103 4.283 4.283 4.303 -0.020 18321 10026 1 8 . 1 1 103 103 PRO CA C 103 62.435 62.435 62.809 -0.374 18321 10027 1 8 . 1 1 103 103 PRO CB C 103 32.145 32.145 32.508 -0.363 18321 10028 1 8 . 1 1 104 104 ARG HA H 104 4.004 4.004 4.339 -0.335 18321 10029 1 8 . 1 1 104 104 ARG CA C 104 56.660 56.660 56.074 0.586 18321 10030 1 8 . 1 1 106 106 PRO C C 106 174.587 174.587 176.228 -1.641 18321 10031 1 8 . 1 1 106 106 PRO CA C 106 57.867 57.867 63.056 -5.189 18321 10032 1 8 . 1 1 106 106 PRO CB C 106 31.942 31.942 31.528 0.414 18321 10033 1 8 . 1 1 107 107 SER N N 107 121.280 121.280 122.513 -1.233 18321 10034 1 8 . 1 1 107 107 SER CA C 107 61.772 61.772 56.021 5.751 18321 10035 1 8 . 1 1 107 107 SER CB C 107 63.234 63.234 63.165 0.069 18321 10036 1 8 . 1 1 107 107 SER H H 107 8.132 8.132 8.861 -0.729 18321 10037 1 8 . 1 1 109 109 PRO C C 109 177.129 177.129 175.824 1.305 18321 10038 1 8 . 1 1 109 109 PRO CA C 109 62.638 62.638 62.668 -0.030 18321 10039 1 8 . 1 1 109 109 PRO CB C 109 30.970 30.970 31.977 -1.007 18321 10040 1 8 . 1 1 110 110 MET N N 110 120.772 120.772 125.495 -4.723 18321 10041 1 8 . 1 1 110 110 MET C C 110 176.892 176.892 175.368 1.524 18321 10042 1 8 . 1 1 110 110 MET CA C 110 55.310 55.310 55.640 -0.330 18321 10043 1 8 . 1 1 110 110 MET CB C 110 32.202 32.202 32.505 -0.303 18321 10044 1 8 . 1 1 110 110 MET H H 110 8.430 8.430 8.741 -0.310 18321 10045 1 8 . 1 1 111 111 GLY N N 111 110.158 110.158 114.246 -4.088 18321 10046 1 8 . 1 1 111 111 GLY C C 111 177.430 177.430 174.377 3.053 18321 10047 1 8 . 1 1 111 111 GLY CA C 111 44.951 44.951 45.287 -0.336 18321 10048 1 8 . 1 1 111 111 GLY H H 111 8.384 8.384 8.486 -0.102 18321 10049 1 8 . 1 1 112 112 SER N N 112 116.762 116.762 119.402 -2.640 18321 10050 1 8 . 1 1 112 112 SER CA C 112 55.948 55.948 58.366 -2.418 18321 10051 1 8 . 1 1 112 112 SER CB C 112 62.745 62.745 63.921 -1.176 18321 10052 1 8 . 1 1 112 112 SER H H 112 8.161 8.161 8.184 -0.023 18321 10053 1 8 . 1 1 113 113 VAL C C 113 176.083 176.083 174.161 1.922 18321 10054 1 8 . 1 1 114 114 SER N N 114 119.151 119.151 122.716 -3.565 18321 10055 1 8 . 1 1 114 114 SER C C 114 173.638 173.638 172.837 0.801 18321 10056 1 8 . 1 1 114 114 SER CA C 114 58.005 58.005 57.960 0.045 18321 10057 1 8 . 1 1 114 114 SER CB C 114 63.169 63.169 64.119 -0.950 18321 10058 1 8 . 1 1 114 114 SER H H 114 8.319 8.319 8.633 -0.314 18321 10059 1 8 . 1 1 115 115 ALA N N 115 126.914 126.914 128.945 -2.031 18321 10060 1 8 . 1 1 115 115 ALA CA C 115 51.561 51.561 52.610 -1.049 18321 10061 1 8 . 1 1 115 115 ALA CB C 115 17.714 17.714 17.722 -0.008 18321 10062 1 8 . 1 1 115 115 ALA H H 115 8.197 8.197 8.429 -0.232 18321 10063 1 8 . 1 1 119 119 PRO C C 119 177.065 177.065 176.259 0.806 18321 10064 1 8 . 1 1 120 120 THR N N 120 113.976 113.976 113.040 0.936 18321 10065 1 8 . 1 1 120 120 THR C C 120 174.461 174.461 173.908 0.553 18321 10066 1 8 . 1 1 120 120 THR CA C 120 61.215 61.215 61.952 -0.737 18321 10067 1 8 . 1 1 120 120 THR CB C 120 69.508 69.508 70.841 -1.333 18321 10068 1 8 . 1 1 120 120 THR H H 120 8.138 8.138 7.760 0.378 18321 10069 1 8 . 1 1 121 121 ALA N N 121 125.859 125.859 130.901 -5.042 18321 10070 1 8 . 1 1 121 121 ALA CA C 121 52.281 52.281 52.204 0.077 18321 10071 1 8 . 1 1 121 121 ALA CB C 121 18.623 18.623 17.790 0.833 18321 10072 1 8 . 1 1 121 121 ALA H H 121 8.272 8.272 9.184 -0.912 18321 10073 1 8 . 1 1 122 122 GLU C C 122 176.316 176.316 176.588 -0.272 18321 10074 1 8 . 1 1 123 123 ASP N N 123 120.448 120.448 114.244 6.204 18321 10075 1 8 . 1 1 123 123 ASP C C 123 175.906 175.906 175.116 0.790 18321 10076 1 8 . 1 1 123 123 ASP CA C 123 54.167 54.167 54.928 -0.761 18321 10077 1 8 . 1 1 123 123 ASP CB C 123 40.695 40.695 41.987 -1.292 18321 10078 1 8 . 1 1 123 123 ASP H H 123 8.181 8.181 8.294 -0.113 18321 10079 1 8 . 1 1 124 124 ASN N N 124 118.207 118.207 115.786 2.421 18321 10080 1 8 . 1 1 124 124 ASN C C 124 174.851 174.851 173.582 1.269 18321 10081 1 8 . 1 1 124 124 ASN CA C 124 52.771 52.771 52.730 0.041 18321 10082 1 8 . 1 1 124 124 ASN CB C 124 38.304 38.304 40.356 -2.052 18321 10083 1 8 . 1 1 124 124 ASN H H 124 8.307 8.307 7.828 0.479 18321 10084 1 8 . 1 1 125 125 LEU N N 125 121.311 121.311 119.208 2.103 18321 10085 1 8 . 1 1 125 125 LEU C C 125 175.750 175.750 175.662 0.088 18321 10086 1 8 . 1 1 125 125 LEU CA C 125 54.428 54.428 55.527 -1.099 18321 10087 1 8 . 1 1 125 125 LEU CB C 125 41.350 41.350 40.408 0.942 18321 10088 1 8 . 1 1 125 125 LEU H H 125 7.747 7.747 8.648 -0.901 18321 10089 1 8 . 1 1 126 126 GLU N N 126 122.485 122.485 119.697 2.788 18321 10090 1 8 . 1 1 126 126 GLU C C 126 174.008 174.008 174.265 -0.257 18321 10091 1 8 . 1 1 126 126 GLU CA C 126 54.855 54.855 56.342 -1.487 18321 10092 1 8 . 1 1 126 126 GLU CB C 126 30.472 30.472 30.380 0.092 18321 10093 1 8 . 1 1 126 126 GLU H H 126 8.453 8.453 7.916 0.537 18321 10094 1 8 . 1 1 127 127 TYR N N 127 122.713 122.713 121.752 0.961 18321 10095 1 8 . 1 1 127 127 TYR C C 127 176.859 176.859 174.858 2.001 18321 10096 1 8 . 1 1 127 127 TYR CA C 127 56.528 56.528 57.754 -1.226 18321 10097 1 8 . 1 1 127 127 TYR CB C 127 40.982 40.982 38.591 2.391 18321 10098 1 8 . 1 1 127 127 TYR H H 127 8.469 8.469 8.341 0.128 18321 10099 1 8 . 1 1 128 128 VAL N N 128 112.432 112.432 125.258 -12.826 18321 10100 1 8 . 1 1 128 128 VAL C C 128 173.150 173.150 174.277 -1.127 18321 10101 1 8 . 1 1 128 128 VAL CA C 128 57.940 57.940 60.587 -2.647 18321 10102 1 8 . 1 1 128 128 VAL CB C 128 34.935 34.935 35.000 -0.065 18321 10103 1 8 . 1 1 128 128 VAL H H 128 9.078 9.078 9.070 0.008 18321 10104 1 8 . 1 1 129 129 ARG N N 129 120.373 120.373 124.426 -4.053 18321 10105 1 8 . 1 1 129 129 ARG C C 129 176.539 176.539 175.499 1.040 18321 10106 1 8 . 1 1 129 129 ARG CA C 129 52.534 52.534 53.827 -1.293 18321 10107 1 8 . 1 1 129 129 ARG CB C 129 32.942 32.942 32.841 0.101 18321 10108 1 8 . 1 1 129 129 ARG H H 129 9.010 9.010 8.189 0.821 18321 10109 1 8 . 1 1 130 130 THR N N 130 116.637 116.637 112.281 4.356 18321 10110 1 8 . 1 1 130 130 THR CA C 130 60.618 60.618 60.894 -0.276 18321 10111 1 8 . 1 1 130 130 THR CB C 130 69.170 69.170 70.355 -1.185 18321 10112 1 8 . 1 1 130 130 THR H H 130 9.045 9.045 8.422 0.623 18321 10113 1 8 . 1 1 131 131 LEU N N 131 122.910 122.910 124.039 -1.129 18321 10114 1 8 . 1 1 131 131 LEU C C 131 175.269 175.269 176.774 -1.505 18321 10115 1 8 . 1 1 131 131 LEU CA C 131 55.122 55.122 55.085 0.037 18321 10116 1 8 . 1 1 131 131 LEU CB C 131 43.108 43.108 42.877 0.231 18321 10117 1 8 . 1 1 131 131 LEU H H 131 9.224 9.224 8.666 0.558 18321 10118 1 8 . 1 1 132 132 TYR N N 132 112.885 112.885 118.195 -5.310 18321 10119 1 8 . 1 1 132 132 TYR C C 132 173.818 173.818 175.337 -1.519 18321 10120 1 8 . 1 1 132 132 TYR CA C 132 54.230 54.230 59.504 -5.274 18321 10121 1 8 . 1 1 132 132 TYR CB C 132 42.672 42.672 40.575 2.097 18321 10122 1 8 . 1 1 132 132 TYR H H 132 7.284 7.284 7.619 -0.335 18321 10123 1 8 . 1 1 133 133 ASP N N 133 118.003 118.003 118.056 -0.053 18321 10124 1 8 . 1 1 133 133 ASP C C 133 175.779 175.779 174.640 1.139 18321 10125 1 8 . 1 1 133 133 ASP CA C 133 54.351 54.351 55.521 -1.170 18321 10126 1 8 . 1 1 133 133 ASP CB C 133 41.241 41.241 39.504 1.737 18321 10127 1 8 . 1 1 133 133 ASP H H 133 8.399 8.399 8.187 0.212 18321 10128 1 8 . 1 1 134 134 PHE N N 134 121.081 121.081 122.734 -1.653 18321 10129 1 8 . 1 1 134 134 PHE CA C 134 52.552 52.552 55.425 -2.873 18321 10130 1 8 . 1 1 134 134 PHE CB C 134 41.217 41.217 42.090 -0.873 18321 10131 1 8 . 1 1 134 134 PHE H H 134 8.797 8.797 7.458 1.339 18321 10132 1 8 . 1 1 136 136 GLY C C 136 171.616 171.616 174.275 -2.659 18321 10133 1 8 . 1 1 137 137 ASN N N 137 119.394 119.394 117.021 2.373 18321 10134 1 8 . 1 1 137 137 ASN C C 137 174.500 174.500 173.942 0.558 18321 10135 1 8 . 1 1 137 137 ASN CA C 137 44.670 44.670 54.069 -9.399 18321 10136 1 8 . 1 1 137 137 ASN H H 137 9.477 9.477 8.257 1.220 18321 10137 1 8 . 1 1 138 138 ASP N N 138 120.608 120.608 118.310 2.298 18321 10138 1 8 . 1 1 138 138 ASP C C 138 176.987 176.987 174.633 2.354 18321 10139 1 8 . 1 1 138 138 ASP CA C 138 52.992 52.992 52.619 0.373 18321 10140 1 8 . 1 1 138 138 ASP H H 138 8.216 8.216 7.648 0.568 18321 10141 1 8 . 1 1 139 139 ALA N N 139 124.371 124.371 121.088 3.283 18321 10142 1 8 . 1 1 139 139 ALA C C 139 178.472 178.472 177.183 1.289 18321 10143 1 8 . 1 1 139 139 ALA CA C 139 54.513 54.513 52.535 1.978 18321 10144 1 8 . 1 1 139 139 ALA CB C 139 18.045 18.045 19.570 -1.525 18321 10145 1 8 . 1 1 139 139 ALA H H 139 8.565 8.565 8.519 0.046 18321 10146 1 8 . 1 1 140 140 GLU N N 140 115.022 115.022 118.634 -3.612 18321 10147 1 8 . 1 1 140 140 GLU C C 140 177.027 177.027 175.080 1.947 18321 10148 1 8 . 1 1 140 140 GLU CA C 140 56.181 56.181 56.841 -0.660 18321 10149 1 8 . 1 1 140 140 GLU CB C 140 28.619 28.619 31.683 -3.064 18321 10150 1 8 . 1 1 140 140 GLU H H 140 8.616 8.616 8.305 0.311 18321 10151 1 8 . 1 1 141 141 ASP N N 141 121.913 121.913 120.154 1.759 18321 10152 1 8 . 1 1 141 141 ASP C C 141 175.923 175.923 174.889 1.034 18321 10153 1 8 . 1 1 141 141 ASP CA C 141 54.736 54.736 53.636 1.100 18321 10154 1 8 . 1 1 141 141 ASP CB C 141 41.305 41.305 41.821 -0.516 18321 10155 1 8 . 1 1 141 141 ASP H H 141 7.636 7.636 8.384 -0.748 18321 10156 1 8 . 1 1 142 142 LEU N N 142 127.651 127.651 126.027 1.624 18321 10157 1 8 . 1 1 142 142 LEU CA C 142 50.955 50.955 52.257 -1.302 18321 10158 1 8 . 1 1 142 142 LEU CB C 142 42.343 42.343 43.932 -1.589 18321 10159 1 8 . 1 1 142 142 LEU H H 142 9.479 9.479 8.129 1.350 18321 10160 1 8 . 1 1 143 143 PRO C C 143 177.924 177.924 175.653 2.271 18321 10161 1 8 . 1 1 144 144 PHE N N 144 114.483 114.483 120.926 -6.443 18321 10162 1 8 . 1 1 144 144 PHE C C 144 175.055 175.055 174.842 0.213 18321 10163 1 8 . 1 1 144 144 PHE CA C 144 55.543 55.543 54.660 0.883 18321 10164 1 8 . 1 1 144 144 PHE CB C 144 40.581 40.581 41.149 -0.568 18321 10165 1 8 . 1 1 144 144 PHE H H 144 8.637 8.637 7.233 1.404 18321 10166 1 8 . 1 1 145 145 LYS N N 145 121.342 121.342 119.968 1.374 18321 10167 1 8 . 1 1 145 145 LYS C C 145 176.925 176.925 176.979 -0.054 18321 10168 1 8 . 1 1 145 145 LYS CA C 145 53.043 53.043 54.662 -1.619 18321 10169 1 8 . 1 1 145 145 LYS CB C 145 33.804 33.804 34.639 -0.835 18321 10170 1 8 . 1 1 145 145 LYS H H 145 9.418 9.418 8.646 0.772 18321 10171 1 8 . 1 1 146 146 LYS N N 146 123.378 123.378 118.076 5.302 18321 10172 1 8 . 1 1 146 146 LYS CA C 146 57.883 57.883 57.567 0.316 18321 10173 1 8 . 1 1 146 146 LYS CB C 146 32.008 32.008 32.514 -0.506 18321 10174 1 8 . 1 1 146 146 LYS H H 146 9.002 9.002 8.675 0.327 18321 10175 1 8 . 1 1 147 147 GLY C C 147 174.315 174.315 172.716 1.599 18321 10176 1 8 . 1 1 148 148 GLU N N 148 121.392 121.392 119.712 1.680 18321 10177 1 8 . 1 1 148 148 GLU C C 148 174.998 174.998 174.976 0.022 18321 10178 1 8 . 1 1 148 148 GLU CA C 148 56.867 56.867 54.548 2.319 18321 10179 1 8 . 1 1 148 148 GLU CB C 148 31.649 31.649 32.492 -0.843 18321 10180 1 8 . 1 1 148 148 GLU H H 148 7.937 7.937 7.673 0.264 18321 10181 1 8 . 1 1 149 149 ILE N N 149 120.124 120.124 122.378 -2.254 18321 10182 1 8 . 1 1 149 149 ILE C C 149 176.647 176.647 175.075 1.572 18321 10183 1 8 . 1 1 149 149 ILE CA C 149 58.621 58.621 60.508 -1.887 18321 10184 1 8 . 1 1 149 149 ILE CB C 149 36.952 36.952 38.322 -1.371 18321 10185 1 8 . 1 1 149 149 ILE H H 149 8.346 8.346 8.632 -0.286 18321 10186 1 8 . 1 1 150 150 LEU N N 150 126.950 126.950 124.956 1.994 18321 10187 1 8 . 1 1 150 150 LEU CA C 150 51.967 51.967 53.022 -1.055 18321 10188 1 8 . 1 1 150 150 LEU CB C 150 44.182 44.182 46.166 -1.984 18321 10189 1 8 . 1 1 150 150 LEU H H 150 8.988 8.988 9.074 -0.086 18321 10190 1 8 . 1 1 151 151 VAL C C 151 175.670 175.670 175.941 -0.271 18321 10191 1 8 . 1 1 152 152 ILE N N 152 124.997 124.997 129.411 -4.414 18321 10192 1 8 . 1 1 152 152 ILE CA C 152 58.331 58.331 60.066 -1.735 18321 10193 1 8 . 1 1 152 152 ILE CB C 152 34.093 34.093 34.520 -0.427 18321 10194 1 8 . 1 1 152 152 ILE H H 152 8.673 8.673 8.736 -0.063 18321 10195 1 8 . 1 1 153 153 ILE N N 153 124.710 124.710 125.332 -0.622 18321 10196 1 8 . 1 1 153 153 ILE C C 153 176.264 176.264 175.803 0.461 18321 10197 1 8 . 1 1 154 154 GLU N N 154 117.398 117.398 118.395 -0.997 18321 10198 1 8 . 1 1 154 154 GLU C C 154 173.959 173.959 174.021 -0.062 18321 10199 1 8 . 1 1 154 154 GLU CA C 154 55.289 55.289 55.473 -0.184 18321 10200 1 8 . 1 1 154 154 GLU CB C 154 32.842 32.842 33.311 -0.469 18321 10201 1 8 . 1 1 154 154 GLU H H 154 7.818 7.818 8.375 -0.557 18321 10202 1 8 . 1 1 155 155 LYS N N 155 121.130 121.130 123.206 -2.076 18321 10203 1 8 . 1 1 155 155 LYS CA C 155 53.022 53.022 53.234 -0.212 18321 10204 1 8 . 1 1 155 155 LYS CB C 155 32.663 32.663 33.719 -1.056 18321 10205 1 8 . 1 1 155 155 LYS H H 155 8.654 8.654 9.101 -0.447 18321 10206 1 8 . 1 1 157 157 GLU C C 157 175.190 175.190 175.771 -0.581 18321 10207 1 8 . 1 1 157 157 GLU CA C 157 53.785 53.785 54.309 -0.524 18321 10208 1 8 . 1 1 157 157 GLU CB C 157 32.685 32.685 31.795 0.890 18321 10209 1 8 . 1 1 158 158 GLU N N 158 117.425 117.425 119.375 -1.950 18321 10210 1 8 . 1 1 158 158 GLU C C 158 178.600 178.600 177.291 1.309 18321 10211 1 8 . 1 1 158 158 GLU CA C 158 59.044 59.044 57.862 1.181 18321 10212 1 8 . 1 1 158 158 GLU CB C 158 29.706 29.706 30.299 -0.593 18321 10213 1 8 . 1 1 158 158 GLU H H 158 8.678 8.678 8.872 -0.194 18321 10214 1 8 . 1 1 159 159 GLN N N 159 110.925 110.925 116.848 -5.923 18321 10215 1 8 . 1 1 159 159 GLN C C 159 175.539 175.539 175.172 0.367 18321 10216 1 8 . 1 1 159 159 GLN CA C 159 54.942 54.942 56.414 -1.472 18321 10217 1 8 . 1 1 159 159 GLN CB C 159 28.572 28.572 29.241 -0.669 18321 10218 1 8 . 1 1 159 159 GLN H H 159 8.483 8.483 8.499 -0.016 18321 10219 1 8 . 1 1 160 160 TRP N N 160 120.171 120.171 118.780 1.391 18321 10220 1 8 . 1 1 160 160 TRP C C 160 173.444 173.444 175.081 -1.637 18321 10221 1 8 . 1 1 160 160 TRP CA C 160 56.175 56.175 55.895 0.279 18321 10222 1 8 . 1 1 160 160 TRP CB C 160 31.796 31.796 32.035 -0.239 18321 10223 1 8 . 1 1 160 160 TRP H H 160 6.826 6.826 7.569 -0.743 18321 10224 1 8 . 1 1 161 161 TRP N N 161 120.687 120.687 122.109 -1.422 18321 10225 1 8 . 1 1 161 161 TRP C C 161 174.736 174.736 176.437 -1.701 18321 10226 1 8 . 1 1 161 161 TRP CA C 161 51.889 51.889 54.359 -2.470 18321 10227 1 8 . 1 1 161 161 TRP CB C 161 32.772 32.772 31.397 1.375 18321 10228 1 8 . 1 1 161 161 TRP H H 161 8.462 8.462 9.448 -0.986 18321 10229 1 8 . 1 1 162 162 SER N N 162 115.691 115.691 120.709 -5.018 18321 10230 1 8 . 1 1 162 162 SER C C 162 174.320 174.320 173.295 1.025 18321 10231 1 8 . 1 1 162 162 SER CA C 162 57.011 57.011 58.495 -1.484 18321 10232 1 8 . 1 1 162 162 SER CB C 162 63.948 63.948 62.770 1.178 18321 10233 1 8 . 1 1 162 162 SER H H 162 8.830 8.830 8.875 -0.045 18321 10234 1 8 . 1 1 163 163 ALA N N 163 130.630 130.630 127.631 2.999 18321 10235 1 8 . 1 1 163 163 ALA CA C 163 50.029 50.029 50.077 -0.048 18321 10236 1 8 . 1 1 163 163 ALA CB C 163 25.500 25.500 22.058 3.442 18321 10237 1 8 . 1 1 163 163 ALA H H 163 9.585 9.585 9.162 0.423 18321 10238 1 8 . 1 1 164 164 ARG N N 164 117.526 117.526 121.680 -4.154 18321 10239 1 8 . 1 1 164 164 ARG C C 164 176.719 176.719 176.643 0.076 18321 10240 1 8 . 1 1 164 164 ARG CA C 164 52.975 52.975 54.343 -1.369 18321 10241 1 8 . 1 1 164 164 ARG CB C 164 34.260 34.260 30.790 3.470 18321 10242 1 8 . 1 1 164 164 ARG H H 164 9.097 9.097 9.106 -0.009 18321 10243 1 8 . 1 1 165 165 ASN N N 165 123.935 123.935 122.556 1.379 18321 10244 1 8 . 1 1 165 165 ASN C C 165 178.484 178.484 175.887 2.597 18321 10245 1 8 . 1 1 165 165 ASN CA C 165 50.332 50.332 54.412 -4.080 18321 10246 1 8 . 1 1 165 165 ASN CB C 165 39.487 39.487 39.727 -0.240 18321 10247 1 8 . 1 1 165 165 ASN H H 165 8.756 8.756 8.922 -0.166 18321 10248 1 8 . 1 1 166 166 LYS N N 166 118.464 118.464 120.049 -1.585 18321 10249 1 8 . 1 1 166 166 LYS C C 166 176.967 176.967 177.624 -0.657 18321 10250 1 8 . 1 1 166 166 LYS CA C 166 58.430 58.430 58.508 -0.078 18321 10251 1 8 . 1 1 166 166 LYS CB C 166 30.918 30.918 32.434 -1.516 18321 10252 1 8 . 1 1 166 166 LYS H H 166 8.915 8.915 9.025 -0.110 18321 10253 1 8 . 1 1 167 167 ASP N N 167 118.138 118.138 116.922 1.216 18321 10254 1 8 . 1 1 167 167 ASP C C 167 176.464 176.464 176.523 -0.059 18321 10255 1 8 . 1 1 167 167 ASP CA C 167 54.212 54.212 55.978 -1.766 18321 10256 1 8 . 1 1 167 167 ASP CB C 167 41.178 41.178 41.464 -0.285 18321 10257 1 8 . 1 1 167 167 ASP H H 167 7.508 7.508 8.409 -0.901 18321 10258 1 8 . 1 1 168 168 GLY N N 168 107.901 107.901 103.912 3.989 18321 10259 1 8 . 1 1 168 168 GLY C C 168 173.613 173.613 173.410 0.203 18321 10260 1 8 . 1 1 168 168 GLY CA C 168 44.783 44.783 44.778 0.006 18321 10261 1 8 . 1 1 168 168 GLY H H 168 8.173 8.173 8.216 -0.043 18321 10262 1 8 . 1 1 169 169 ARG N N 169 124.324 124.324 122.094 2.230 18321 10263 1 8 . 1 1 169 169 ARG CA C 169 56.106 56.106 56.273 -0.167 18321 10264 1 8 . 1 1 169 169 ARG CB C 169 29.648 29.648 31.076 -1.428 18321 10265 1 8 . 1 1 169 169 ARG H H 169 7.998 7.998 7.896 0.102 18321 10266 1 8 . 1 1 170 170 VAL C C 170 177.590 177.590 175.551 2.039 18321 10267 1 8 . 1 1 171 171 GLY N N 171 112.582 112.582 113.326 -0.744 18321 10268 1 8 . 1 1 171 171 GLY C C 171 170.991 170.991 172.784 -1.793 18321 10269 1 8 . 1 1 171 171 GLY CA C 171 45.361 45.361 44.866 0.495 18321 10270 1 8 . 1 1 171 171 GLY H H 171 9.013 9.013 8.745 0.268 18321 10271 1 8 . 1 1 172 172 MET N N 172 117.368 117.368 121.657 -4.289 18321 10272 1 8 . 1 1 172 172 MET C C 172 177.921 177.921 176.544 1.377 18321 10273 1 8 . 1 1 172 172 MET CA C 172 53.536 53.536 57.029 -3.493 18321 10274 1 8 . 1 1 172 172 MET CB C 172 30.838 30.838 33.705 -2.866 18321 10275 1 8 . 1 1 172 172 MET H H 172 8.885 8.885 9.295 -0.410 18321 10276 1 8 . 1 1 173 173 ILE N N 173 113.130 113.130 117.576 -4.446 18321 10277 1 8 . 1 1 173 173 ILE CA C 173 56.284 56.284 58.087 -1.803 18321 10278 1 8 . 1 1 173 173 ILE CB C 173 40.870 40.870 40.704 0.166 18321 10279 1 8 . 1 1 173 173 ILE H H 173 9.704 9.704 9.363 0.341 18321 10280 1 8 . 1 1 174 174 PRO C C 174 176.714 176.714 177.697 -0.983 18321 10281 1 8 . 1 1 174 174 PRO CA C 174 66.290 66.290 61.551 4.739 18321 10282 1 8 . 1 1 174 174 PRO CB C 174 28.993 28.993 30.382 -1.389 18321 10283 1 8 . 1 1 175 175 VAL N N 175 128.066 128.066 124.939 3.127 18321 10284 1 8 . 1 1 175 175 VAL CA C 175 59.356 59.356 67.118 -7.762 18321 10285 1 8 . 1 1 175 175 VAL H H 175 7.327 7.327 8.035 -0.708 18321 10286 1 8 . 1 1 176 176 PRO C C 176 176.351 176.351 176.923 -0.572 18321 10287 1 8 . 1 1 177 177 TYR N N 177 115.756 115.756 114.660 1.096 18321 10288 1 8 . 1 1 177 177 TYR C C 177 175.011 175.011 175.485 -0.474 18321 10289 1 8 . 1 1 177 177 TYR CA C 177 56.756 56.756 56.601 0.155 18321 10290 1 8 . 1 1 177 177 TYR CB C 177 37.507 37.507 38.752 -1.245 18321 10291 1 8 . 1 1 177 177 TYR H H 177 7.784 7.784 7.508 0.276 18321 10292 1 8 . 1 1 178 178 VAL N N 178 111.428 111.428 114.249 -2.821 18321 10293 1 8 . 1 1 178 178 VAL C C 178 173.417 173.417 175.667 -2.250 18321 10294 1 8 . 1 1 178 178 VAL CA C 178 58.307 58.307 59.610 -1.303 18321 10295 1 8 . 1 1 178 178 VAL CB C 178 34.602 34.602 33.916 0.686 18321 10296 1 8 . 1 1 178 178 VAL H H 178 7.801 7.801 7.426 0.375 18321 10297 1 8 . 1 1 179 179 GLU N N 179 118.581 118.581 120.364 -1.783 18321 10298 1 8 . 1 1 179 179 GLU C C 179 175.225 175.225 174.971 0.254 18321 10299 1 8 . 1 1 179 179 GLU CA C 179 53.114 53.114 56.022 -2.908 18321 10300 1 8 . 1 1 179 179 GLU CB C 179 32.712 32.712 30.703 2.009 18321 10301 1 8 . 1 1 179 179 GLU H H 179 8.819 8.819 8.384 0.435 18321 10302 1 8 . 1 1 180 180 LYS N N 180 124.167 124.167 120.932 3.235 18321 10303 1 8 . 1 1 180 180 LYS C C 180 176.303 176.303 176.610 -0.307 18321 10304 1 8 . 1 1 180 180 LYS CA C 180 57.318 57.318 56.932 0.386 18321 10305 1 8 . 1 1 180 180 LYS CB C 180 31.675 31.675 32.456 -0.781 18321 10306 1 8 . 1 1 180 180 LYS H H 180 8.775 8.775 7.947 0.828 18321 10307 1 8 . 1 1 181 181 LEU N N 181 125.157 125.157 126.510 -1.353 18321 10308 1 8 . 1 1 181 181 LEU C C 181 176.462 176.462 177.424 -0.962 18321 10309 1 8 . 1 1 181 181 LEU CA C 181 54.470 54.470 56.081 -1.611 18321 10310 1 8 . 1 1 181 181 LEU CB C 181 41.625 41.625 42.979 -1.354 18321 10311 1 8 . 1 1 181 181 LEU H H 181 8.084 8.084 8.536 -0.452 18321 10312 1 8 . 1 1 182 182 VAL N N 182 123.167 123.167 119.873 3.294 18321 10313 1 8 . 1 1 182 182 VAL C C 182 175.983 175.983 174.429 1.554 18321 10314 1 8 . 1 1 182 182 VAL CA C 182 61.613 61.613 61.983 -0.370 18321 10315 1 8 . 1 1 182 182 VAL CB C 182 32.085 32.085 32.071 0.014 18321 10316 1 8 . 1 1 182 182 VAL H H 182 8.345 8.345 8.138 0.207 18321 10317 1 8 . 1 1 183 183 ARG N N 183 125.775 125.775 126.211 -0.436 18321 10318 1 8 . 1 1 183 183 ARG CA C 183 57.801 57.801 55.617 2.184 18321 10319 1 8 . 1 1 183 183 ARG CB C 183 30.091 30.091 33.067 -2.976 18321 10320 1 8 . 1 1 183 183 ARG H H 183 8.530 8.530 8.305 0.225 18321 10321 1 8 . 1 1 184 184 SER C C 184 173.239 173.239 174.666 -1.427 18321 10322 1 8 . 1 1 185 185 SER N N 185 116.511 116.511 120.697 -4.186 18321 10323 1 8 . 1 1 185 185 SER CA C 185 58.428 58.428 56.150 2.278 18321 10324 1 8 . 1 1 185 185 SER CB C 185 69.737 69.737 62.436 7.301 18321 10325 1 8 . 1 1 185 185 SER H H 185 7.944 7.944 8.339 -0.395 18321 10326 1 8 . 1 1 190 190 HIS C C 190 176.953 176.953 174.850 2.103 18321 10327 1 8 . 1 1 190 190 HIS CA C 190 54.229 54.229 55.859 -1.630 18321 10328 1 8 . 1 1 190 190 HIS CB C 190 35.112 35.112 29.610 5.502 18321 10329 1 8 . 1 1 191 191 GLY N N 191 109.491 109.491 115.868 -6.377 18321 10330 1 8 . 1 1 191 191 GLY C C 191 172.295 172.295 173.539 -1.244 18321 10331 1 8 . 1 1 191 191 GLY CA C 191 45.227 45.227 44.681 0.546 18321 10332 1 8 . 1 1 191 191 GLY H H 191 8.719 8.719 8.289 0.430 18321 10333 1 8 . 1 1 192 192 ASN N N 192 118.700 118.700 120.702 -2.002 18321 10334 1 8 . 1 1 192 192 ASN HA H 192 4.312 4.312 4.829 -0.517 18321 10335 1 8 . 1 1 192 192 ASN C C 192 176.369 176.369 174.707 1.662 18321 10336 1 8 . 1 1 192 192 ASN CA C 192 57.787 57.787 52.687 5.100 18321 10337 1 8 . 1 1 192 192 ASN H H 192 7.508 7.508 8.545 -1.037 18321 10338 1 8 . 1 1 193 193 ARG N N 193 120.743 120.743 126.050 -5.307 18321 10339 1 8 . 1 1 193 193 ARG H H 193 9.032 9.032 8.575 0.457 18321 10340 1 8 . 1 1 197 197 SER HA H 197 4.388 4.388 4.638 -0.250 18321 10341 1 8 . 1 1 197 197 SER C C 197 174.133 174.133 173.942 0.191 18321 10342 1 8 . 1 1 197 197 SER CA C 197 58.128 58.128 58.476 -0.348 18321 10343 1 8 . 1 1 197 197 SER CB C 197 62.966 62.966 63.222 -0.256 18321 10344 1 8 . 1 1 198 198 TYR N N 198 121.435 121.435 125.996 -4.561 18321 10345 1 8 . 1 1 198 198 TYR HA H 198 4.543 4.543 4.506 0.037 18321 10346 1 8 . 1 1 198 198 TYR C C 198 176.230 176.230 176.284 -0.054 18321 10347 1 8 . 1 1 198 198 TYR CA C 198 57.536 57.536 58.039 -0.503 18321 10348 1 8 . 1 1 198 198 TYR CB C 198 38.279 38.279 38.780 -0.501 18321 10349 1 8 . 1 1 198 198 TYR H H 198 8.071 8.071 8.552 -0.481 18321 10350 1 8 . 1 1 199 199 GLY N N 199 110.039 110.039 111.939 -1.900 18321 10351 1 8 . 1 1 199 199 GLY C C 199 173.475 173.475 174.361 -0.886 18321 10352 1 8 . 1 1 199 199 GLY CA C 199 44.805 44.805 44.225 0.580 18321 10353 1 8 . 1 1 199 199 GLY H H 199 8.162 8.162 8.574 -0.412 18321 10354 1 8 . 1 1 200 200 ILE N N 200 121.530 121.530 122.323 -0.793 18321 10355 1 8 . 1 1 200 200 ILE CA C 200 58.102 58.102 59.296 -1.194 18321 10356 1 8 . 1 1 200 200 ILE CB C 200 37.760 37.760 36.663 1.097 18321 10357 1 8 . 1 1 200 200 ILE H H 200 7.851 7.851 8.305 -0.454 18321 10358 1 8 . 1 1 201 201 PRO C C 201 176.485 176.485 176.312 0.173 18321 10359 1 8 . 1 1 201 201 PRO CA C 201 53.893 53.893 62.597 -8.704 18321 10360 1 8 . 1 1 201 201 PRO CB C 201 29.042 29.042 32.281 -3.239 18321 10361 1 8 . 1 1 202 202 GLU N N 202 122.468 122.468 122.154 0.314 18321 10362 1 8 . 1 1 202 202 GLU CA C 202 62.490 62.490 54.106 8.384 18321 10363 1 8 . 1 1 202 202 GLU CB C 202 31.170 31.170 29.097 2.073 18321 10364 1 8 . 1 1 202 202 GLU H H 202 8.328 8.328 8.414 -0.086 18321 10365 1 8 . 1 1 203 203 PRO CA C 203 62.803 62.803 62.666 0.137 18321 10366 1 8 . 1 1 203 203 PRO CB C 203 31.220 31.220 31.611 -0.391 18321 10367 1 8 . 1 1 204 204 ALA N N 204 123.251 123.251 127.003 -3.752 18321 10368 1 8 . 1 1 204 204 ALA HA H 204 4.180 4.180 4.272 -0.092 18321 10369 1 8 . 1 1 204 204 ALA CA C 204 52.124 52.124 51.852 0.272 18321 10370 1 8 . 1 1 204 204 ALA CB C 204 18.892 18.892 19.828 -0.936 18321 10371 1 8 . 1 1 204 204 ALA H H 204 8.308 8.308 8.389 -0.081 18321 10372 1 8 . 1 1 205 205 HIS N N 205 117.874 117.874 119.759 -1.885 18321 10373 1 8 . 1 1 205 205 HIS C C 205 173.282 173.282 174.066 -0.784 18321 10374 1 8 . 1 1 205 205 HIS H H 205 8.045 8.045 8.526 -0.481 18321 10375 1 8 . 1 1 206 206 ALA N N 206 125.519 125.519 122.811 2.708 18321 10376 1 8 . 1 1 206 206 ALA HA H 206 4.204 4.204 4.416 -0.212 18321 10377 1 8 . 1 1 206 206 ALA CA C 206 40.196 40.196 51.525 -11.329 18321 10378 1 8 . 1 1 206 206 ALA CB C 206 19.407 19.407 18.810 0.597 18321 10379 1 8 . 1 1 206 206 ALA H H 206 8.061 8.061 7.709 0.352 18321 10380 1 8 . 1 1 207 207 TYR N N 207 120.381 120.381 122.343 -1.962 18321 10381 1 8 . 1 1 207 207 TYR HA H 207 4.570 4.570 4.577 -0.007 18321 10382 1 8 . 1 1 207 207 TYR CA C 207 52.572 52.572 56.994 -4.422 18321 10383 1 8 . 1 1 207 207 TYR CB C 207 41.333 41.333 40.671 0.662 18321 10384 1 8 . 1 1 207 207 TYR H H 207 8.199 8.199 8.476 -0.277 18321 10385 1 8 . 1 1 208 208 ALA HA H 208 4.281 4.281 4.428 -0.147 18321 10386 1 8 . 1 1 208 208 ALA C C 208 177.736 177.736 179.096 -1.360 18321 10387 1 8 . 1 1 208 208 ALA CA C 208 52.084 52.084 54.136 -2.051 18321 10388 1 8 . 1 1 208 208 ALA CB C 208 18.999 18.999 19.075 -0.076 18321 10389 1 8 . 1 1 209 209 GLN N N 209 119.295 119.295 117.846 1.449 18321 10390 1 8 . 1 1 209 209 GLN CA C 209 61.474 61.474 59.711 1.763 18321 10391 1 8 . 1 1 209 209 GLN CB C 209 32.039 32.039 26.274 5.765 18321 10392 1 8 . 1 1 209 209 GLN H H 209 8.125 8.125 8.695 -0.570 18321 10393 1 8 . 1 1 210 210 PRO HA H 210 4.395 4.395 4.292 0.103 18321 10394 1 8 . 1 1 210 210 PRO CA C 210 62.584 62.584 64.877 -2.293 18321 10395 1 8 . 1 1 211 211 GLN HA H 211 4.377 4.377 4.428 -0.051 18321 10396 1 8 . 1 1 211 211 GLN CA C 211 55.859 55.859 57.048 -1.189 18321 10397 1 8 . 1 1 211 211 GLN CB C 211 29.577 29.577 29.049 0.528 18321 10398 1 8 . 1 1 212 212 THR C C 212 176.551 176.551 174.586 1.965 18321 10399 1 8 . 1 1 212 212 THR CB C 212 69.890 69.890 69.708 0.182 18321 10400 1 8 . 1 1 213 213 THR N N 213 108.487 108.487 120.069 -11.582 18321 10401 1 8 . 1 1 213 213 THR CA C 213 61.236 61.236 61.547 -0.311 18321 10402 1 8 . 1 1 213 213 THR CB C 213 69.091 69.091 70.102 -1.011 18321 10403 1 8 . 1 1 213 213 THR H H 213 8.243 8.243 7.458 0.785 18321 10404 1 8 . 1 1 214 214 THR N N 214 119.445 119.445 119.257 0.188 18321 10405 1 8 . 1 1 214 214 THR CA C 214 59.425 59.425 58.722 0.703 18321 10406 1 8 . 1 1 214 214 THR CB C 214 69.251 69.251 68.827 0.424 18321 10407 1 8 . 1 1 214 214 THR H H 214 8.188 8.188 8.273 -0.085 18321 10408 1 8 . 1 1 215 215 PRO HA H 215 4.361 4.361 4.579 -0.218 18321 10409 1 8 . 1 1 215 215 PRO C C 215 175.422 175.422 176.113 -0.691 18321 10410 1 8 . 1 1 215 215 PRO CA C 215 63.320 63.320 62.480 0.840 18321 10411 1 8 . 1 1 215 215 PRO CB C 215 31.918 31.918 32.552 -0.634 18321 10412 1 8 . 1 1 216 216 LEU N N 216 121.602 121.602 125.728 -4.126 18321 10413 1 8 . 1 1 216 216 LEU CA C 216 52.203 52.203 52.316 -0.112 18321 10414 1 8 . 1 1 216 216 LEU CB C 216 42.451 42.451 40.905 1.546 18321 10415 1 8 . 1 1 216 216 LEU H H 216 7.891 7.891 8.497 -0.606 18321 10416 1 8 . 1 1 217 217 PRO HA H 217 4.398 4.398 4.418 -0.020 18321 10417 1 8 . 1 1 217 217 PRO C C 217 176.577 176.577 176.331 0.246 18321 10418 1 8 . 1 1 217 217 PRO CA C 217 62.984 62.984 63.697 -0.713 18321 10419 1 8 . 1 1 217 217 PRO CB C 217 32.056 32.056 32.203 -0.147 18321 10420 1 8 . 1 1 218 218 ALA N N 218 124.087 124.087 121.008 3.079 18321 10421 1 8 . 1 1 218 218 ALA HA H 218 4.309 4.309 4.497 -0.188 18321 10422 1 8 . 1 1 218 218 ALA C C 218 177.844 177.844 176.987 0.857 18321 10423 1 8 . 1 1 218 218 ALA CA C 218 52.379 52.379 51.864 0.515 18321 10424 1 8 . 1 1 218 218 ALA CB C 218 19.133 19.133 19.220 -0.087 18321 10425 1 8 . 1 1 218 218 ALA H H 218 8.261 8.261 7.905 0.356 18321 10426 1 8 . 1 1 219 219 VAL N N 219 118.942 118.942 117.551 1.391 18321 10427 1 8 . 1 1 219 219 VAL HA H 219 4.142 4.142 4.266 -0.124 18321 10428 1 8 . 1 1 219 219 VAL CA C 219 62.102 62.102 62.341 -0.239 18321 10429 1 8 . 1 1 219 219 VAL CB C 219 32.923 32.923 32.327 0.596 18321 10430 1 8 . 1 1 219 219 VAL H H 219 8.049 8.049 8.374 -0.325 18321 10431 1 8 . 1 1 220 220 SER N N 220 119.207 119.207 117.558 1.649 18321 10432 1 8 . 1 1 220 220 SER HA H 220 4.436 4.436 4.505 -0.069 18321 10433 1 8 . 1 1 220 220 SER CA C 220 57.813 57.813 57.906 -0.093 18321 10434 1 8 . 1 1 220 220 SER CB C 220 63.375 63.375 64.288 -0.913 18321 10435 1 8 . 1 1 220 220 SER H H 220 8.275 8.275 7.699 0.576 18321 10436 1 8 . 1 1 221 221 GLY N N 221 110.973 110.973 110.034 0.939 18321 10437 1 8 . 1 1 221 221 GLY C C 221 173.962 173.962 174.052 -0.090 18321 10438 1 8 . 1 1 221 221 GLY CA C 221 45.286 45.286 44.994 0.292 18321 10439 1 8 . 1 1 221 221 GLY H H 221 8.374 8.374 8.462 -0.088 18321 10440 1 8 . 1 1 222 222 SER N N 222 115.516 115.516 118.067 -2.551 18321 10441 1 8 . 1 1 222 222 SER HA H 222 4.763 4.763 4.933 -0.170 18321 10442 1 8 . 1 1 222 222 SER CA C 222 56.407 56.407 55.292 1.115 18321 10443 1 8 . 1 1 222 222 SER CB C 222 63.993 63.993 64.316 -0.323 18321 10444 1 8 . 1 1 222 222 SER H H 222 8.155 8.155 8.163 -0.008 18321 10445 1 8 . 1 1 223 223 PRO HA H 223 4.417 4.417 4.458 -0.041 18321 10446 1 8 . 1 1 223 223 PRO CA C 223 63.805 63.805 62.988 0.817 18321 10447 1 8 . 1 1 223 223 PRO CB C 223 32.090 32.090 32.107 -0.017 18321 10448 1 8 . 1 1 224 224 GLY N N 224 109.149 109.149 110.034 -0.885 18321 10449 1 8 . 1 1 224 224 GLY C C 224 173.813 173.813 174.365 -0.552 18321 10450 1 8 . 1 1 224 224 GLY CA C 224 44.512 44.512 44.833 -0.321 18321 10451 1 8 . 1 1 224 224 GLY H H 224 8.376 8.376 8.441 -0.065 18321 10452 1 8 . 1 1 225 225 ALA N N 225 123.599 123.599 127.728 -4.129 18321 10453 1 8 . 1 1 225 225 ALA C C 225 177.341 177.341 177.483 -0.142 18321 10454 1 8 . 1 1 225 225 ALA CA C 225 51.878 51.878 51.212 0.666 18321 10455 1 8 . 1 1 225 225 ALA CB C 225 19.169 19.169 18.174 0.996 18321 10456 1 8 . 1 1 225 225 ALA H H 225 7.959 7.959 8.563 -0.604 18321 10457 1 8 . 1 1 226 226 ALA N N 226 123.218 123.218 127.584 -4.366 18321 10458 1 8 . 1 1 226 226 ALA HA H 226 4.350 4.350 3.982 0.368 18321 10459 1 8 . 1 1 226 226 ALA C C 226 177.520 177.520 176.208 1.312 18321 10460 1 8 . 1 1 226 226 ALA CA C 226 52.535 52.535 54.161 -1.626 18321 10461 1 8 . 1 1 226 226 ALA CB C 226 19.171 19.171 17.882 1.289 18321 10462 1 8 . 1 1 226 226 ALA H H 226 8.169 8.169 8.369 -0.200 18321 10463 1 8 . 1 1 227 227 ILE N N 227 120.086 120.086 122.540 -2.454 18321 10464 1 8 . 1 1 227 227 ILE HA H 227 4.201 4.201 4.318 -0.117 18321 10465 1 8 . 1 1 227 227 ILE C C 227 174.814 174.814 175.510 -0.696 18321 10466 1 8 . 1 1 227 227 ILE CA C 227 60.929 60.929 59.919 1.010 18321 10467 1 8 . 1 1 227 227 ILE CB C 227 38.872 38.872 38.080 0.792 18321 10468 1 8 . 1 1 227 227 ILE H H 227 8.037 8.037 8.193 -0.156 18321 10469 1 8 . 1 1 228 228 THR N N 228 117.224 117.224 125.663 -8.439 18321 10470 1 8 . 1 1 228 228 THR HA H 228 4.203 4.203 4.533 -0.330 18321 10471 1 8 . 1 1 228 228 THR CA C 228 57.108 57.108 61.176 -4.068 18321 10472 1 8 . 1 1 228 228 THR CB C 228 69.945 69.945 68.738 1.207 18321 10473 1 8 . 1 1 228 228 THR H H 228 7.775 7.775 8.348 -0.573 18321 10474 1 8 . 1 1 229 229 PRO HA H 229 4.750 4.750 4.528 0.222 18321 10475 1 8 . 1 1 229 229 PRO CA C 229 62.480 62.480 62.243 0.237 18321 10476 1 8 . 1 1 229 229 PRO CB C 229 33.995 33.995 32.357 1.638 18321 10477 1 8 . 1 1 230 230 LEU N N 230 123.629 123.629 114.702 8.927 18321 10478 1 8 . 1 1 230 230 LEU CA C 230 53.076 53.076 54.111 -1.036 18321 10479 1 8 . 1 1 230 230 LEU CB C 230 40.608 40.608 40.546 0.062 18321 10480 1 8 . 1 1 230 230 LEU H H 230 8.453 8.453 8.557 -0.104 18321 10481 1 8 . 1 1 231 231 PRO HA H 231 4.412 4.412 4.432 -0.020 18321 10482 1 8 . 1 1 231 231 PRO C C 231 176.571 176.571 177.050 -0.479 18321 10483 1 8 . 1 1 231 231 PRO CA C 231 63.225 63.225 64.264 -1.039 18321 10484 1 8 . 1 1 231 231 PRO CB C 231 31.191 31.191 32.072 -0.880 18321 10485 1 8 . 1 1 232 232 SER N N 232 115.169 115.169 109.563 5.606 18321 10486 1 8 . 1 1 232 232 SER HA H 232 4.450 4.450 4.560 -0.110 18321 10487 1 8 . 1 1 232 232 SER CA C 232 58.604 58.604 58.210 0.394 18321 10488 1 8 . 1 1 232 232 SER CB C 232 63.962 63.962 64.400 -0.438 18321 10489 1 8 . 1 1 232 232 SER H H 232 8.280 8.280 7.941 0.339 18321 10490 1 8 . 1 1 233 233 THR N N 233 115.155 115.155 114.731 0.424 18321 10491 1 8 . 1 1 233 233 THR HA H 233 4.351 4.351 4.468 -0.117 18321 10492 1 8 . 1 1 233 233 THR C C 233 177.237 177.237 173.825 3.412 18321 10493 1 8 . 1 1 233 233 THR CA C 233 61.939 61.939 60.473 1.466 18321 10494 1 8 . 1 1 233 233 THR CB C 233 68.986 68.986 69.787 -0.801 18321 10495 1 8 . 1 1 233 233 THR H H 233 8.096 8.096 7.534 0.562 18321 10496 1 8 . 1 1 234 234 GLN N N 234 122.040 122.040 126.360 -4.320 18321 10497 1 8 . 1 1 234 234 GLN HA H 234 4.681 4.681 4.444 0.237 18321 10498 1 8 . 1 1 234 234 GLN C C 234 176.177 176.177 174.989 1.188 18321 10499 1 8 . 1 1 234 234 GLN CA C 234 55.861 55.861 54.702 1.159 18321 10500 1 8 . 1 1 234 234 GLN CB C 234 28.583 28.583 27.956 0.627 18321 10501 1 8 . 1 1 234 234 GLN H H 234 8.256 8.256 8.640 -0.384 18321 10502 1 8 . 1 1 235 235 ASN N N 235 119.506 119.506 124.540 -5.034 18321 10503 1 8 . 1 1 235 235 ASN HA H 235 4.775 4.775 4.873 -0.098 18321 10504 1 8 . 1 1 235 235 ASN C C 235 174.974 174.974 174.274 0.700 18321 10505 1 8 . 1 1 235 235 ASN CA C 235 53.191 53.191 53.176 0.015 18321 10506 1 8 . 1 1 235 235 ASN CB C 235 38.511 38.511 38.906 -0.395 18321 10507 1 8 . 1 1 235 235 ASN H H 235 8.346 8.346 8.259 0.087 18321 10508 1 8 . 1 1 236 236 GLY N N 236 109.378 109.378 111.694 -2.316 18321 10509 1 8 . 1 1 236 236 GLY CA C 236 44.023 44.023 44.813 -0.790 18321 10510 1 8 . 1 1 236 236 GLY H H 236 7.939 7.939 7.678 0.261 18321 10511 1 8 . 1 1 237 237 PRO HA H 237 4.336 4.336 4.334 0.002 18321 10512 1 8 . 1 1 237 237 PRO C C 237 175.942 175.942 176.264 -0.322 18321 10513 1 8 . 1 1 237 237 PRO CA C 237 62.797 62.797 62.210 0.587 18321 10514 1 8 . 1 1 237 237 PRO CB C 237 27.421 27.421 32.510 -5.089 18321 10515 1 8 . 1 1 238 238 VAL N N 238 120.535 120.535 120.111 0.424 18321 10516 1 8 . 1 1 238 238 VAL HA H 238 4.195 4.195 4.065 0.130 18321 10517 1 8 . 1 1 238 238 VAL C C 238 173.775 173.775 174.578 -0.803 18321 10518 1 8 . 1 1 238 238 VAL CA C 238 61.173 61.173 62.255 -1.082 18321 10519 1 8 . 1 1 238 238 VAL CB C 238 38.328 38.328 30.966 7.362 18321 10520 1 8 . 1 1 238 238 VAL H H 238 7.986 7.986 7.926 0.060 18321 10521 1 8 . 1 1 239 239 PHE N N 239 123.522 123.522 127.708 -4.186 18321 10522 1 8 . 1 1 239 239 PHE HA H 239 5.539 5.539 4.991 0.548 18321 10523 1 8 . 1 1 239 239 PHE C C 239 174.207 174.207 174.575 -0.368 18321 10524 1 8 . 1 1 239 239 PHE CA C 239 56.993 56.993 56.533 0.460 18321 10525 1 8 . 1 1 239 239 PHE CB C 239 41.743 41.743 40.137 1.606 18321 10526 1 8 . 1 1 239 239 PHE H H 239 8.927 8.927 8.505 0.422 18321 10527 1 8 . 1 1 240 240 ALA N N 240 120.871 120.871 127.633 -6.762 18321 10528 1 8 . 1 1 240 240 ALA HA H 240 5.352 5.352 5.491 -0.139 18321 10529 1 8 . 1 1 240 240 ALA C C 240 174.639 174.639 175.695 -1.056 18321 10530 1 8 . 1 1 240 240 ALA CA C 240 49.736 49.736 50.358 -0.622 18321 10531 1 8 . 1 1 240 240 ALA CB C 240 23.480 23.480 22.168 1.312 18321 10532 1 8 . 1 1 240 240 ALA H H 240 9.398 9.398 8.835 0.563 18321 10533 1 8 . 1 1 241 241 LYS N N 241 121.227 121.227 125.220 -3.993 18321 10534 1 8 . 1 1 241 241 LYS HA H 241 5.373 5.373 5.010 0.363 18321 10535 1 8 . 1 1 241 241 LYS C C 241 176.772 176.772 175.905 0.867 18321 10536 1 8 . 1 1 241 241 LYS CA C 241 53.128 53.128 54.714 -1.586 18321 10537 1 8 . 1 1 241 241 LYS CB C 241 34.850 34.850 34.561 0.289 18321 10538 1 8 . 1 1 241 241 LYS H H 241 8.947 8.947 8.390 0.557 18321 10539 1 8 . 1 1 242 242 ALA N N 242 126.833 126.833 130.796 -3.963 18321 10540 1 8 . 1 1 242 242 ALA HA H 242 4.764 4.764 4.587 0.177 18321 10541 1 8 . 1 1 242 242 ALA C C 242 178.506 178.506 177.866 0.640 18321 10542 1 8 . 1 1 242 242 ALA CA C 242 52.788 52.788 51.557 1.231 18321 10543 1 8 . 1 1 242 242 ALA CB C 242 19.084 19.084 18.437 0.647 18321 10544 1 8 . 1 1 242 242 ALA H H 242 9.373 9.373 8.830 0.543 18321 10545 1 8 . 1 1 243 243 ILE N N 243 118.731 118.731 119.295 -0.564 18321 10546 1 8 . 1 1 243 243 ILE HA H 243 4.454 4.454 4.069 0.385 18321 10547 1 8 . 1 1 243 243 ILE C C 243 174.773 174.773 176.156 -1.383 18321 10548 1 8 . 1 1 243 243 ILE CA C 243 60.613 60.613 62.322 -1.709 18321 10549 1 8 . 1 1 243 243 ILE CB C 243 39.232 39.232 38.256 0.976 18321 10550 1 8 . 1 1 243 243 ILE H H 243 8.933 8.933 8.088 0.845 18321 10551 1 8 . 1 1 244 244 GLN N N 244 121.616 121.616 119.998 1.618 18321 10552 1 8 . 1 1 244 244 GLN HA H 244 4.283 4.283 4.502 -0.219 18321 10553 1 8 . 1 1 244 244 GLN C C 244 172.815 172.815 174.921 -2.106 18321 10554 1 8 . 1 1 244 244 GLN CA C 244 54.750 54.750 54.277 0.473 18321 10555 1 8 . 1 1 244 244 GLN CB C 244 31.469 31.469 32.275 -0.806 18321 10556 1 8 . 1 1 244 244 GLN H H 244 7.438 7.438 7.640 -0.202 18321 10557 1 8 . 1 1 245 245 LYS N N 245 124.215 124.215 121.778 2.437 18321 10558 1 8 . 1 1 245 245 LYS HA H 245 3.962 3.962 4.321 -0.359 18321 10559 1 8 . 1 1 245 245 LYS C C 245 175.679 175.679 175.790 -0.111 18321 10560 1 8 . 1 1 245 245 LYS CA C 245 56.413 56.413 56.722 -0.309 18321 10561 1 8 . 1 1 245 245 LYS CB C 245 32.847 32.847 33.288 -0.441 18321 10562 1 8 . 1 1 245 245 LYS H H 245 8.318 8.318 8.585 -0.267 18321 10563 1 8 . 1 1 246 246 ARG N N 246 127.327 127.327 121.388 5.939 18321 10564 1 8 . 1 1 246 246 ARG HA H 246 4.221 4.221 4.654 -0.433 18321 10565 1 8 . 1 1 246 246 ARG CA C 246 56.279 56.279 55.517 0.762 18321 10566 1 8 . 1 1 246 246 ARG CB C 246 32.987 32.987 31.868 1.119 18321 10567 1 8 . 1 1 246 246 ARG H H 246 9.248 9.248 8.832 0.416 18321 10568 1 8 . 1 1 249 249 CYS HA H 249 4.260 4.260 4.142 0.118 18321 10569 1 8 . 1 1 249 249 CYS CA C 249 55.886 55.886 57.370 -1.484 18321 10570 1 8 . 1 1 249 249 CYS CB C 249 34.146 34.146 29.201 4.945 18321 10571 1 8 . 1 1 250 250 ALA HA H 250 3.926 3.926 4.072 -0.146 18321 10572 1 8 . 1 1 250 250 ALA CA C 250 54.344 54.344 54.566 -0.222 18321 10573 1 8 . 1 1 250 250 ALA CB C 250 18.342 18.342 18.799 -0.457 18321 10574 1 8 . 1 1 251 251 TYR N N 251 110.618 110.618 111.341 -0.723 18321 10575 1 8 . 1 1 251 251 TYR HA H 251 4.489 4.489 4.785 -0.296 18321 10576 1 8 . 1 1 251 251 TYR C C 251 175.286 175.286 175.063 0.223 18321 10577 1 8 . 1 1 251 251 TYR CA C 251 56.137 56.137 55.277 0.860 18321 10578 1 8 . 1 1 251 251 TYR CB C 251 37.203 37.203 37.850 -0.647 18321 10579 1 8 . 1 1 251 251 TYR H H 251 7.037 7.037 7.079 -0.042 18321 10580 1 8 . 1 1 252 252 ASP N N 252 121.835 121.835 120.509 1.326 18321 10581 1 8 . 1 1 252 252 ASP HA H 252 4.763 4.763 4.920 -0.157 18321 10582 1 8 . 1 1 252 252 ASP CA C 252 52.351 52.351 54.102 -1.751 18321 10583 1 8 . 1 1 252 252 ASP CB C 252 39.995 39.995 41.818 -1.823 18321 10584 1 8 . 1 1 252 252 ASP H H 252 7.339 7.339 7.811 -0.472 18321 10585 1 8 . 1 1 253 253 LYS N N 253 123.177 123.177 119.690 3.487 18321 10586 1 8 . 1 1 253 253 LYS HA H 253 4.270 4.270 4.207 0.063 18321 10587 1 8 . 1 1 253 253 LYS C C 253 177.724 177.724 177.065 0.659 18321 10588 1 8 . 1 1 253 253 LYS CA C 253 57.036 57.036 58.545 -1.509 18321 10589 1 8 . 1 1 253 253 LYS H H 253 8.396 8.396 8.455 -0.059 18321 10590 1 8 . 1 1 254 254 THR N N 254 108.317 108.317 108.056 0.261 18321 10591 1 8 . 1 1 254 254 THR HA H 254 4.517 4.517 4.351 0.166 18321 10592 1 8 . 1 1 254 254 THR C C 254 174.012 174.012 173.954 0.058 18321 10593 1 8 . 1 1 254 254 THR CA C 254 61.036 61.036 60.777 0.259 18321 10594 1 8 . 1 1 254 254 THR CB C 254 69.307 69.307 68.134 1.173 18321 10595 1 8 . 1 1 254 254 THR H H 254 8.217 8.217 7.714 0.503 18321 10596 1 8 . 1 1 255 255 ALA N N 255 124.762 124.762 123.991 0.771 18321 10597 1 8 . 1 1 255 255 ALA HA H 255 4.524 4.524 5.025 -0.501 18321 10598 1 8 . 1 1 255 255 ALA C C 255 176.630 176.630 176.368 0.262 18321 10599 1 8 . 1 1 255 255 ALA CA C 255 51.352 51.352 50.498 0.854 18321 10600 1 8 . 1 1 255 255 ALA CB C 255 20.135 20.135 20.288 -0.153 18321 10601 1 8 . 1 1 255 255 ALA H H 255 7.096 7.096 7.487 -0.391 18321 10602 1 8 . 1 1 256 256 LEU N N 256 124.379 124.379 122.481 1.898 18321 10603 1 8 . 1 1 256 256 LEU HA H 256 4.328 4.328 4.524 -0.196 18321 10604 1 8 . 1 1 256 256 LEU C C 256 176.007 176.007 175.772 0.235 18321 10605 1 8 . 1 1 256 256 LEU CA C 256 53.502 53.502 53.737 -0.235 18321 10606 1 8 . 1 1 256 256 LEU CB C 256 44.665 44.665 43.977 0.688 18321 10607 1 8 . 1 1 256 256 LEU H H 256 8.889 8.889 8.488 0.401 18321 10608 1 8 . 1 1 257 257 ALA N N 257 129.619 129.619 129.153 0.466 18321 10609 1 8 . 1 1 257 257 ALA HA H 257 4.445 4.445 4.581 -0.136 18321 10610 1 8 . 1 1 257 257 ALA C C 257 176.813 176.813 176.778 0.035 18321 10611 1 8 . 1 1 257 257 ALA CA C 257 51.179 51.179 52.035 -0.856 18321 10612 1 8 . 1 1 257 257 ALA CB C 257 18.973 18.973 18.414 0.559 18321 10613 1 8 . 1 1 257 257 ALA H H 257 8.529 8.529 8.427 0.102 18321 10614 1 8 . 1 1 258 258 LEU N N 258 119.300 119.300 125.920 -6.620 18321 10615 1 8 . 1 1 258 258 LEU HA H 258 4.782 4.782 4.690 0.092 18321 10616 1 8 . 1 1 258 258 LEU CA C 258 53.259 53.259 53.492 -0.233 18321 10617 1 8 . 1 1 258 258 LEU CB C 258 45.972 45.972 45.018 0.954 18321 10618 1 8 . 1 1 258 258 LEU H H 258 8.505 8.505 8.560 -0.055 18321 10619 1 8 . 1 1 259 259 GLU N N 259 123.919 123.919 121.138 2.781 18321 10620 1 8 . 1 1 259 259 GLU HA H 259 4.516 4.516 4.605 -0.089 18321 10621 1 8 . 1 1 259 259 GLU C C 259 175.795 175.795 174.871 0.924 18321 10622 1 8 . 1 1 259 259 GLU CA C 259 52.896 52.896 54.375 -1.479 18321 10623 1 8 . 1 1 259 259 GLU H H 259 8.943 8.943 8.401 0.542 18321 10624 1 8 . 1 1 260 260 VAL N N 260 122.122 122.122 122.326 -0.204 18321 10625 1 8 . 1 1 260 260 VAL HA H 260 2.923 2.923 4.389 -1.466 18321 10626 1 8 . 1 1 260 260 VAL C C 260 177.964 177.964 177.350 0.614 18321 10627 1 8 . 1 1 260 260 VAL CA C 260 65.417 65.417 63.851 1.566 18321 10628 1 8 . 1 1 260 260 VAL CB C 260 30.668 30.668 29.875 0.793 18321 10629 1 8 . 1 1 260 260 VAL H H 260 8.956 8.956 8.575 0.381 18321 10630 1 8 . 1 1 261 261 GLY N N 261 116.009 116.009 117.137 -1.128 18321 10631 1 8 . 1 1 261 261 GLY C C 261 176.288 176.288 173.917 2.371 18321 10632 1 8 . 1 1 261 261 GLY CA C 261 44.210 44.210 44.949 -0.739 18321 10633 1 8 . 1 1 261 261 GLY H H 261 8.799 8.799 9.113 -0.314 18321 10634 1 8 . 1 1 262 262 ASP N N 262 121.945 121.945 121.816 0.129 18321 10635 1 8 . 1 1 262 262 ASP HA H 262 4.423 4.423 4.798 -0.375 18321 10636 1 8 . 1 1 262 262 ASP C C 262 175.381 175.381 175.292 0.089 18321 10637 1 8 . 1 1 262 262 ASP CA C 262 55.243 55.243 53.435 1.808 18321 10638 1 8 . 1 1 262 262 ASP CB C 262 41.819 41.819 42.126 -0.307 18321 10639 1 8 . 1 1 262 262 ASP H H 262 8.180 8.180 7.974 0.206 18321 10640 1 8 . 1 1 263 263 ILE N N 263 121.452 121.452 124.618 -3.166 18321 10641 1 8 . 1 1 263 263 ILE HA H 263 4.707 4.707 4.322 0.385 18321 10642 1 8 . 1 1 263 263 ILE C C 263 174.996 174.996 176.151 -1.155 18321 10643 1 8 . 1 1 263 263 ILE CA C 263 59.289 59.289 59.862 -0.573 18321 10644 1 8 . 1 1 263 263 ILE CB C 263 36.987 36.987 37.346 -0.359 18321 10645 1 8 . 1 1 263 263 ILE H H 263 8.460 8.460 8.477 -0.017 18321 10646 1 8 . 1 1 264 264 VAL N N 264 128.756 128.756 129.765 -1.009 18321 10647 1 8 . 1 1 264 264 VAL HA H 264 4.309 4.309 3.951 0.357 18321 10648 1 8 . 1 1 264 264 VAL C C 264 175.486 175.486 174.856 0.630 18321 10649 1 8 . 1 1 264 264 VAL CA C 264 59.091 59.091 61.917 -2.826 18321 10650 1 8 . 1 1 264 264 VAL CB C 264 34.541 34.541 31.049 3.491 18321 10651 1 8 . 1 1 264 264 VAL H H 264 9.479 9.479 9.234 0.245 18321 10652 1 8 . 1 1 265 265 LYS N N 265 128.101 128.101 130.249 -2.148 18321 10653 1 8 . 1 1 265 265 LYS HA H 265 4.342 4.342 4.032 0.310 18321 10654 1 8 . 1 1 265 265 LYS C C 265 175.531 175.531 174.856 0.675 18321 10655 1 8 . 1 1 265 265 LYS CA C 265 55.620 55.620 55.815 -0.195 18321 10656 1 8 . 1 1 265 265 LYS CB C 265 33.149 33.149 32.039 1.109 18321 10657 1 8 . 1 1 265 265 LYS H H 265 8.715 8.715 8.329 0.386 18321 10658 1 8 . 1 1 266 266 VAL N N 266 129.537 129.537 127.308 2.229 18321 10659 1 8 . 1 1 266 266 VAL HA H 266 4.333 4.333 4.427 -0.094 18321 10660 1 8 . 1 1 266 266 VAL C C 266 176.166 176.166 174.710 1.456 18321 10661 1 8 . 1 1 266 266 VAL CA C 266 63.339 63.339 60.632 2.707 18321 10662 1 8 . 1 1 266 266 VAL CB C 266 30.712 30.712 34.538 -3.826 18321 10663 1 8 . 1 1 266 266 VAL H H 266 9.073 9.073 7.806 1.268 18321 10664 1 8 . 1 1 267 267 THR N N 267 120.020 120.020 121.315 -1.295 18321 10665 1 8 . 1 1 267 267 THR HA H 267 4.189 4.189 4.364 -0.175 18321 10666 1 8 . 1 1 267 267 THR C C 267 176.054 176.054 174.870 1.184 18321 10667 1 8 . 1 1 267 267 THR CA C 267 62.204 62.204 63.073 -0.869 18321 10668 1 8 . 1 1 267 267 THR CB C 267 68.200 68.200 69.750 -1.550 18321 10669 1 8 . 1 1 267 267 THR H H 267 9.130 9.130 8.205 0.925 18321 10670 1 8 . 1 1 268 268 ARG N N 268 120.839 120.839 122.508 -1.669 18321 10671 1 8 . 1 1 268 268 ARG HA H 268 4.236 4.236 4.640 -0.404 18321 10672 1 8 . 1 1 268 268 ARG CA C 268 56.321 56.321 54.636 1.685 18321 10673 1 8 . 1 1 268 268 ARG CB C 268 33.049 33.049 31.552 1.497 18321 10674 1 8 . 1 1 268 268 ARG H H 268 7.631 7.631 7.442 0.189 18321 10675 1 8 . 1 1 269 269 MET N N 269 125.443 125.443 122.759 2.684 18321 10676 1 8 . 1 1 269 269 MET C C 269 174.392 174.392 175.001 -0.609 18321 10677 1 8 . 1 1 269 269 MET H H 269 8.532 8.532 8.441 0.091 18321 10678 1 8 . 1 1 270 270 ASN N N 270 119.125 119.125 122.702 -3.577 18321 10679 1 8 . 1 1 270 270 ASN HA H 270 4.546 4.546 4.797 -0.251 18321 10680 1 8 . 1 1 270 270 ASN C C 270 172.133 172.133 176.813 -4.680 18321 10681 1 8 . 1 1 270 270 ASN CA C 270 53.639 53.639 53.038 0.601 18321 10682 1 8 . 1 1 270 270 ASN CB C 270 39.845 39.845 39.384 0.461 18321 10683 1 8 . 1 1 270 270 ASN H H 270 6.631 6.631 8.449 -1.818 18321 10684 1 8 . 1 1 271 271 ILE N N 271 122.532 122.532 122.891 -0.359 18321 10685 1 8 . 1 1 271 271 ILE HA H 271 4.417 4.417 3.957 0.460 18321 10686 1 8 . 1 1 271 271 ILE CA C 271 63.348 63.348 62.653 0.695 18321 10687 1 8 . 1 1 271 271 ILE CB C 271 38.198 38.198 38.132 0.066 18321 10688 1 8 . 1 1 271 271 ILE H H 271 8.565 8.565 8.569 -0.004 18321 10689 1 8 . 1 1 272 272 ASN HA H 272 4.527 4.527 4.632 -0.105 18321 10690 1 8 . 1 1 272 272 ASN C C 272 176.259 176.259 176.294 -0.035 18321 10691 1 8 . 1 1 272 272 ASN CA C 272 53.225 53.225 53.535 -0.310 18321 10692 1 8 . 1 1 272 272 ASN CB C 272 37.565 37.565 38.775 -1.210 18321 10693 1 8 . 1 1 273 273 GLY N N 273 107.043 107.043 107.543 -0.500 18321 10694 1 8 . 1 1 273 273 GLY C C 273 173.216 173.216 173.217 -0.001 18321 10695 1 8 . 1 1 273 273 GLY CA C 273 45.299 45.299 44.880 0.419 18321 10696 1 8 . 1 1 273 273 GLY H H 273 8.086 8.086 8.123 -0.037 18321 10697 1 8 . 1 1 274 274 GLN N N 274 120.624 120.624 121.860 -1.236 18321 10698 1 8 . 1 1 274 274 GLN HA H 274 4.551 4.551 4.269 0.282 18321 10699 1 8 . 1 1 274 274 GLN C C 274 175.039 175.039 175.567 -0.528 18321 10700 1 8 . 1 1 274 274 GLN CA C 274 54.556 54.556 55.764 -1.208 18321 10701 1 8 . 1 1 274 274 GLN CB C 274 33.698 33.698 28.888 4.810 18321 10702 1 8 . 1 1 274 274 GLN H H 274 8.045 8.045 7.999 0.046 18321 10703 1 8 . 1 1 275 275 TRP N N 275 125.596 125.596 125.286 0.310 18321 10704 1 8 . 1 1 275 275 TRP HA H 275 4.588 4.588 4.573 0.015 18321 10705 1 8 . 1 1 275 275 TRP C C 275 172.832 172.832 175.538 -2.706 18321 10706 1 8 . 1 1 275 275 TRP CA C 275 55.296 55.296 54.155 1.141 18321 10707 1 8 . 1 1 275 275 TRP CB C 275 31.393 31.393 30.287 1.107 18321 10708 1 8 . 1 1 275 275 TRP H H 275 8.484 8.484 8.262 0.222 18321 10709 1 8 . 1 1 276 276 GLU N N 276 119.012 119.012 121.642 -2.630 18321 10710 1 8 . 1 1 276 276 GLU HA H 276 5.190 5.190 5.359 -0.169 18321 10711 1 8 . 1 1 276 276 GLU C C 276 176.553 176.553 175.820 0.733 18321 10712 1 8 . 1 1 276 276 GLU CA C 276 54.288 54.288 55.040 -0.752 18321 10713 1 8 . 1 1 276 276 GLU CB C 276 32.851 32.851 31.947 0.904 18321 10714 1 8 . 1 1 276 276 GLU H H 276 8.643 8.643 8.293 0.350 18321 10715 1 8 . 1 1 277 277 GLY N N 277 111.364 111.364 112.735 -1.371 18321 10716 1 8 . 1 1 277 277 GLY C C 277 170.707 170.707 172.117 -1.410 18321 10717 1 8 . 1 1 277 277 GLY CA C 277 46.723 46.723 43.944 2.779 18321 10718 1 8 . 1 1 277 277 GLY H H 277 9.072 9.072 8.426 0.646 18321 10719 1 8 . 1 1 278 278 GLU N N 278 117.733 117.733 122.755 -5.022 18321 10720 1 8 . 1 1 278 278 GLU HA H 278 5.748 5.748 4.992 0.756 18321 10721 1 8 . 1 1 278 278 GLU C C 278 176.051 176.051 175.338 0.713 18321 10722 1 8 . 1 1 278 278 GLU CA C 278 53.620 53.620 54.941 -1.321 18321 10723 1 8 . 1 1 278 278 GLU CB C 278 33.742 33.742 32.154 1.589 18321 10724 1 8 . 1 1 278 278 GLU H H 278 8.810 8.810 8.250 0.560 18321 10725 1 8 . 1 1 279 279 VAL N N 279 123.834 123.834 126.850 -3.016 18321 10726 1 8 . 1 1 279 279 VAL HA H 279 4.404 4.404 4.454 -0.050 18321 10727 1 8 . 1 1 279 279 VAL C C 279 175.289 175.289 175.863 -0.574 18321 10728 1 8 . 1 1 279 279 VAL CA C 279 61.166 61.166 60.012 1.154 18321 10729 1 8 . 1 1 279 279 VAL CB C 279 34.123 34.123 33.253 0.870 18321 10730 1 8 . 1 1 279 279 VAL H H 279 8.887 8.887 9.066 -0.179 18321 10731 1 8 . 1 1 280 280 ASN N N 280 126.025 126.025 126.228 -0.203 18321 10732 1 8 . 1 1 280 280 ASN HA H 280 4.435 4.435 4.305 0.130 18321 10733 1 8 . 1 1 280 280 ASN C C 280 175.205 175.205 175.356 -0.151 18321 10734 1 8 . 1 1 280 280 ASN CA C 280 45.615 45.615 53.703 -8.088 18321 10735 1 8 . 1 1 280 280 ASN CB C 280 37.386 37.386 37.301 0.085 18321 10736 1 8 . 1 1 280 280 ASN H H 280 9.322 9.322 9.164 0.158 18321 10737 1 8 . 1 1 281 281 GLY N N 281 104.588 104.588 103.712 0.876 18321 10738 1 8 . 1 1 281 281 GLY C C 281 173.944 173.944 173.897 0.047 18321 10739 1 8 . 1 1 281 281 GLY CA C 281 45.224 45.224 44.767 0.457 18321 10740 1 8 . 1 1 281 281 GLY H H 281 8.768 8.768 8.180 0.588 18321 10741 1 8 . 1 1 282 282 ARG N N 282 122.567 122.567 123.297 -0.730 18321 10742 1 8 . 1 1 282 282 ARG HA H 282 4.559 4.559 4.577 -0.018 18321 10743 1 8 . 1 1 282 282 ARG C C 282 174.350 174.350 174.472 -0.122 18321 10744 1 8 . 1 1 282 282 ARG CA C 282 54.933 54.933 55.018 -0.085 18321 10745 1 8 . 1 1 282 282 ARG CB C 282 31.765 31.765 31.558 0.206 18321 10746 1 8 . 1 1 282 282 ARG H H 282 8.149 8.149 8.180 -0.031 18321 10747 1 8 . 1 1 283 283 LYS N N 283 121.565 121.565 125.020 -3.455 18321 10748 1 8 . 1 1 283 283 LYS HA H 283 5.584 5.584 5.462 0.122 18321 10749 1 8 . 1 1 283 283 LYS CA C 283 54.143 54.143 55.026 -0.883 18321 10750 1 8 . 1 1 283 283 LYS CB C 283 36.040 36.040 35.217 0.823 18321 10751 1 8 . 1 1 283 283 LYS H H 283 8.424 8.424 8.590 -0.166 18321 10752 1 8 . 1 1 284 284 GLY C C 284 173.006 173.006 172.324 0.682 18321 10753 1 8 . 1 1 284 284 GLY CA C 284 45.886 45.886 44.931 0.955 18321 10754 1 8 . 1 1 285 285 LEU N N 285 119.673 119.673 121.440 -1.767 18321 10755 1 8 . 1 1 285 285 LEU HA H 285 5.718 5.718 5.470 0.248 18321 10756 1 8 . 1 1 285 285 LEU C C 285 178.657 178.657 176.484 2.173 18321 10757 1 8 . 1 1 285 285 LEU CA C 285 53.656 53.656 54.048 -0.392 18321 10758 1 8 . 1 1 285 285 LEU CB C 285 44.813 44.813 42.751 2.062 18321 10759 1 8 . 1 1 285 285 LEU H H 285 8.734 8.734 8.779 -0.045 18321 10760 1 8 . 1 1 286 286 PHE N N 286 118.785 118.785 122.095 -3.310 18321 10761 1 8 . 1 1 286 286 PHE HA H 286 4.521 4.521 5.085 -0.564 18321 10762 1 8 . 1 1 286 286 PHE CA C 286 57.592 57.592 54.137 3.455 18321 10763 1 8 . 1 1 286 286 PHE CB C 286 40.669 40.669 39.593 1.077 18321 10764 1 8 . 1 1 286 286 PHE H H 286 9.120 9.120 8.974 0.146 18321 10765 1 8 . 1 1 287 287 PRO HA H 287 4.385 4.385 4.607 -0.222 18321 10766 1 8 . 1 1 287 287 PRO CA C 287 62.814 62.814 61.910 0.904 18321 10767 1 8 . 1 1 287 287 PRO CB C 287 32.133 32.133 31.863 0.270 18321 10768 1 8 . 1 1 288 288 PHE C C 288 174.837 174.837 175.692 -0.855 18321 10769 1 8 . 1 1 288 288 PHE CA C 288 59.020 59.020 59.213 -0.193 18321 10770 1 8 . 1 1 288 288 PHE CB C 288 34.987 34.987 37.349 -2.362 18321 10771 1 8 . 1 1 289 289 THR N N 289 107.865 107.865 110.674 -2.809 18321 10772 1 8 . 1 1 289 289 THR HA H 289 3.589 3.589 3.912 -0.323 18321 10773 1 8 . 1 1 289 289 THR C C 289 176.125 176.125 174.749 1.376 18321 10774 1 8 . 1 1 289 289 THR CA C 289 62.243 62.243 63.999 -1.756 18321 10775 1 8 . 1 1 289 289 THR CB C 289 69.365 69.365 68.326 1.039 18321 10776 1 8 . 1 1 289 289 THR H H 289 6.453 6.453 7.539 -1.086 18321 10777 1 8 . 1 1 290 290 HIS N N 290 119.462 119.462 119.346 0.116 18321 10778 1 8 . 1 1 290 290 HIS HA H 290 4.196 4.196 4.713 -0.517 18321 10779 1 8 . 1 1 290 290 HIS C C 290 175.165 175.165 174.169 0.996 18321 10780 1 8 . 1 1 290 290 HIS CA C 290 57.635 57.635 56.857 0.778 18321 10781 1 8 . 1 1 290 290 HIS CB C 290 29.840 29.840 31.745 -1.905 18321 10782 1 8 . 1 1 290 290 HIS H H 290 7.835 7.835 7.749 0.086 18321 10783 1 8 . 1 1 291 291 VAL N N 291 110.050 110.050 113.658 -3.608 18321 10784 1 8 . 1 1 291 291 VAL HA H 291 5.445 5.445 4.875 0.570 18321 10785 1 8 . 1 1 291 291 VAL C C 291 173.386 173.386 174.997 -1.611 18321 10786 1 8 . 1 1 291 291 VAL CA C 291 57.794 57.794 59.052 -1.258 18321 10787 1 8 . 1 1 291 291 VAL CB C 291 35.784 35.784 33.575 2.209 18321 10788 1 8 . 1 1 291 291 VAL H H 291 7.562 7.562 7.473 0.089 18321 10789 1 8 . 1 1 292 292 LYS N N 292 119.445 119.445 121.821 -2.376 18321 10790 1 8 . 1 1 292 292 LYS HA H 292 4.857 4.857 4.786 0.071 18321 10791 1 8 . 1 1 292 292 LYS C C 292 176.512 176.512 175.767 0.745 18321 10792 1 8 . 1 1 292 292 LYS CA C 292 54.647 54.647 53.946 0.702 18321 10793 1 8 . 1 1 292 292 LYS CB C 292 35.665 35.665 35.509 0.156 18321 10794 1 8 . 1 1 292 292 LYS H H 292 8.753 8.753 8.411 0.342 18321 10795 1 8 . 1 1 293 293 ILE N N 293 128.707 128.707 125.142 3.565 18321 10796 1 8 . 1 1 293 293 ILE HA H 293 4.509 4.509 4.298 0.211 18321 10797 1 8 . 1 1 293 293 ILE C C 293 175.666 175.666 176.480 -0.814 18321 10798 1 8 . 1 1 293 293 ILE CA C 293 62.563 62.563 61.281 1.282 18321 10799 1 8 . 1 1 293 293 ILE CB C 293 38.076 38.076 36.835 1.241 18321 10800 1 8 . 1 1 293 293 ILE H H 293 9.107 9.107 8.834 0.273 18321 10801 1 8 . 1 1 294 294 PHE N N 294 126.638 126.638 127.019 -0.381 18321 10802 1 8 . 1 1 294 294 PHE HA H 294 4.898 4.898 4.884 0.014 18321 10803 1 8 . 1 1 294 294 PHE C C 294 175.838 175.838 172.966 2.872 18321 10804 1 8 . 1 1 294 294 PHE CA C 294 56.335 56.335 55.950 0.385 18321 10805 1 8 . 1 1 294 294 PHE CB C 294 41.196 41.196 41.306 -0.110 18321 10806 1 8 . 1 1 294 294 PHE H H 294 8.716 8.716 8.649 0.067 18321 10807 1 8 . 1 1 295 295 ASP N N 295 122.961 122.961 121.098 1.863 18321 10808 1 8 . 1 1 295 295 ASP HA H 295 5.003 5.003 4.835 0.168 18321 10809 1 8 . 1 1 295 295 ASP CA C 295 50.602 50.602 51.884 -1.282 18321 10810 1 8 . 1 1 295 295 ASP CB C 295 40.754 40.754 41.405 -0.651 18321 10811 1 8 . 1 1 295 295 ASP H H 295 8.418 8.418 8.453 -0.035 18321 10812 1 8 . 1 1 296 296 PRO HA H 296 4.524 4.524 4.185 0.339 18321 10813 1 8 . 1 1 296 296 PRO C C 296 176.807 176.807 176.817 -0.010 18321 10814 1 8 . 1 1 296 296 PRO CA C 296 62.987 62.987 64.414 -1.427 18321 10815 1 8 . 1 1 296 296 PRO CB C 296 32.033 32.033 31.881 0.152 18321 10816 1 8 . 1 1 297 297 GLN N N 297 120.729 120.729 114.436 6.293 18321 10817 1 8 . 1 1 297 297 GLN HA H 297 4.274 4.274 4.303 -0.029 18321 10818 1 8 . 1 1 297 297 GLN CA C 297 56.427 56.427 54.933 1.494 18321 10819 1 8 . 1 1 297 297 GLN CB C 297 28.819 28.819 29.669 -0.850 18321 10820 1 8 . 1 1 297 297 GLN H H 297 8.551 8.551 8.130 0.421 18321 10821 1 8 . 1 1 299 299 PRO C C 299 176.936 176.936 176.378 0.558 18321 10822 1 8 . 1 1 299 299 PRO CA C 299 63.406 63.406 62.681 0.725 18321 10823 1 8 . 1 1 299 299 PRO CB C 299 31.421 31.421 30.963 0.458 18321 10824 1 8 . 1 1 300 300 ASP N N 300 119.609 119.609 120.383 -0.774 18321 10825 1 8 . 1 1 300 300 ASP C C 300 176.344 176.344 176.422 -0.078 18321 10826 1 8 . 1 1 300 300 ASP CA C 300 54.178 54.178 56.600 -2.422 18321 10827 1 8 . 1 1 300 300 ASP CB C 300 40.661 40.661 41.821 -1.160 18321 10828 1 8 . 1 1 300 300 ASP H H 300 8.239 8.239 8.333 -0.094 18321 10829 1 8 . 1 1 301 301 GLU N N 301 120.462 120.462 113.018 7.444 18321 10830 1 8 . 1 1 301 301 GLU CA C 301 56.188 56.188 55.433 0.755 18321 10831 1 8 . 1 1 301 301 GLU CB C 301 29.507 29.507 30.788 -1.281 18321 10832 1 8 . 1 1 301 301 GLU H H 301 8.084 8.084 7.881 0.203 18321 10833 1 9 . 1 1 2 2 SER HA H 2 4.521 4.521 4.396 0.125 18321 10834 1 9 . 1 1 2 2 SER CA C 2 58.326 58.326 58.558 -0.232 18321 10835 1 9 . 1 1 2 2 SER CB C 2 64.062 64.062 64.031 0.031 18321 10836 1 9 . 1 1 3 3 SER HA H 3 4.465 4.465 4.456 0.009 18321 10837 1 9 . 1 1 3 3 SER C C 3 173.887 173.887 172.848 1.039 18321 10838 1 9 . 1 1 3 3 SER CA C 3 58.374 58.374 58.921 -0.547 18321 10839 1 9 . 1 1 3 3 SER CB C 3 63.920 63.920 63.966 -0.046 18321 10840 1 9 . 1 1 4 4 ALA N N 4 124.755 124.755 125.457 -0.702 18321 10841 1 9 . 1 1 4 4 ALA HA H 4 4.547 4.547 4.569 -0.022 18321 10842 1 9 . 1 1 4 4 ALA CA C 4 52.737 52.737 52.362 0.375 18321 10843 1 9 . 1 1 4 4 ALA CB C 4 19.636 19.636 19.122 0.514 18321 10844 1 9 . 1 1 4 4 ALA H H 4 8.244 8.244 8.154 0.090 18321 10845 1 9 . 1 1 5 5 ARG N N 5 120.383 120.383 126.537 -6.154 18321 10846 1 9 . 1 1 5 5 ARG HA H 5 4.524 4.524 4.789 -0.265 18321 10847 1 9 . 1 1 5 5 ARG C C 5 175.611 175.611 174.732 0.879 18321 10848 1 9 . 1 1 5 5 ARG CA C 5 56.082 56.082 55.417 0.665 18321 10849 1 9 . 1 1 5 5 ARG CB C 5 30.695 30.695 30.362 0.333 18321 10850 1 9 . 1 1 5 5 ARG H H 5 8.727 8.727 8.488 0.239 18321 10851 1 9 . 1 1 6 6 PHE N N 6 115.159 115.159 118.696 -3.537 18321 10852 1 9 . 1 1 6 6 PHE HA H 6 4.786 4.786 4.867 -0.081 18321 10853 1 9 . 1 1 6 6 PHE C C 6 172.076 172.076 173.839 -1.763 18321 10854 1 9 . 1 1 6 6 PHE CA C 6 56.640 56.640 56.196 0.444 18321 10855 1 9 . 1 1 6 6 PHE CB C 6 40.378 40.378 40.529 -0.151 18321 10856 1 9 . 1 1 6 6 PHE H H 6 7.536 7.536 7.827 -0.291 18321 10857 1 9 . 1 1 7 7 ASP N N 7 121.846 121.846 120.763 1.083 18321 10858 1 9 . 1 1 7 7 ASP HA H 7 4.846 4.846 4.712 0.134 18321 10859 1 9 . 1 1 7 7 ASP CA C 7 52.327 52.327 53.224 -0.897 18321 10860 1 9 . 1 1 7 7 ASP CB C 7 41.298 41.298 42.507 -1.209 18321 10861 1 9 . 1 1 7 7 ASP H H 7 9.062 9.062 8.654 0.408 18321 10862 1 9 . 1 1 8 8 SER HA H 8 3.950 3.950 4.318 -0.368 18321 10863 1 9 . 1 1 8 8 SER C C 8 174.705 174.705 175.340 -0.635 18321 10864 1 9 . 1 1 8 8 SER CA C 8 61.937 61.937 60.482 1.455 18321 10865 1 9 . 1 1 8 8 SER CB C 8 62.260 62.260 63.463 -1.203 18321 10866 1 9 . 1 1 9 9 SER N N 9 114.373 114.373 114.859 -0.486 18321 10867 1 9 . 1 1 9 9 SER HA H 9 4.529 4.529 4.817 -0.288 18321 10868 1 9 . 1 1 9 9 SER C C 9 175.089 175.089 173.873 1.216 18321 10869 1 9 . 1 1 9 9 SER CA C 9 59.851 59.851 58.679 1.171 18321 10870 1 9 . 1 1 9 9 SER CB C 9 64.246 64.246 64.058 0.188 18321 10871 1 9 . 1 1 9 9 SER H H 9 8.722 8.722 8.585 0.137 18321 10872 1 9 . 1 1 10 10 ASP N N 10 121.818 121.818 124.132 -2.314 18321 10873 1 9 . 1 1 10 10 ASP HA H 10 4.730 4.730 4.557 0.173 18321 10874 1 9 . 1 1 10 10 ASP C C 10 174.455 174.455 176.962 -2.507 18321 10875 1 9 . 1 1 10 10 ASP CA C 10 52.432 52.432 54.888 -2.456 18321 10876 1 9 . 1 1 10 10 ASP CB C 10 39.607 39.607 41.053 -1.446 18321 10877 1 9 . 1 1 10 10 ASP H H 10 7.600 7.600 8.527 -0.927 18321 10878 1 9 . 1 1 11 11 ARG N N 11 125.238 125.238 126.726 -1.488 18321 10879 1 9 . 1 1 11 11 ARG HA H 11 1.936 1.936 3.045 -1.109 18321 10880 1 9 . 1 1 11 11 ARG C C 11 176.916 176.916 177.414 -0.498 18321 10881 1 9 . 1 1 11 11 ARG CA C 11 57.451 57.451 58.218 -0.767 18321 10882 1 9 . 1 1 11 11 ARG CB C 11 43.014 43.014 29.867 13.147 18321 10883 1 9 . 1 1 11 11 ARG H H 11 7.739 7.739 8.132 -0.393 18321 10884 1 9 . 1 1 12 12 SER N N 12 112.065 112.065 112.217 -0.152 18321 10885 1 9 . 1 1 12 12 SER HA H 12 4.695 4.695 4.249 0.446 18321 10886 1 9 . 1 1 12 12 SER C C 12 175.092 175.092 174.368 0.724 18321 10887 1 9 . 1 1 12 12 SER CA C 12 60.785 60.785 59.980 0.805 18321 10888 1 9 . 1 1 12 12 SER CB C 12 62.889 62.889 62.741 0.148 18321 10889 1 9 . 1 1 12 12 SER H H 12 7.888 7.888 8.223 -0.335 18321 10890 1 9 . 1 1 13 13 ALA N N 13 122.249 122.249 122.755 -0.506 18321 10891 1 9 . 1 1 13 13 ALA HA H 13 4.216 4.216 4.454 -0.238 18321 10892 1 9 . 1 1 13 13 ALA C C 13 178.069 178.069 177.811 0.258 18321 10893 1 9 . 1 1 13 13 ALA CA C 13 53.562 53.562 53.767 -0.205 18321 10894 1 9 . 1 1 13 13 ALA CB C 13 19.339 19.339 19.563 -0.224 18321 10895 1 9 . 1 1 13 13 ALA H H 13 7.418 7.418 7.658 -0.240 18321 10896 1 9 . 1 1 14 14 TRP N N 14 107.433 107.433 112.615 -5.182 18321 10897 1 9 . 1 1 14 14 TRP HA H 14 4.785 4.785 4.644 0.141 18321 10898 1 9 . 1 1 14 14 TRP C C 14 175.286 175.286 176.055 -0.769 18321 10899 1 9 . 1 1 14 14 TRP CA C 14 55.212 55.212 55.149 0.063 18321 10900 1 9 . 1 1 14 14 TRP CB C 14 32.776 32.776 31.088 1.688 18321 10901 1 9 . 1 1 14 14 TRP H H 14 6.273 6.273 6.887 -0.614 18321 10902 1 9 . 1 1 15 15 TYR N N 15 122.315 122.315 124.483 -2.168 18321 10903 1 9 . 1 1 15 15 TYR HA H 15 5.436 5.436 4.596 0.840 18321 10904 1 9 . 1 1 15 15 TYR C C 15 175.325 175.325 174.679 0.646 18321 10905 1 9 . 1 1 15 15 TYR CA C 15 56.609 56.609 58.824 -2.215 18321 10906 1 9 . 1 1 15 15 TYR CB C 15 36.940 36.940 37.716 -0.776 18321 10907 1 9 . 1 1 15 15 TYR H H 15 8.221 8.221 7.703 0.518 18321 10908 1 9 . 1 1 16 16 MET N N 16 126.031 126.031 127.989 -1.958 18321 10909 1 9 . 1 1 16 16 MET HA H 16 4.462 4.462 4.332 0.130 18321 10910 1 9 . 1 1 16 16 MET CA C 16 53.046 53.046 52.776 0.270 18321 10911 1 9 . 1 1 16 16 MET CB C 16 41.114 41.114 33.409 7.705 18321 10912 1 9 . 1 1 16 16 MET H H 16 8.989 8.989 8.418 0.571 18321 10913 1 9 . 1 1 17 17 GLY CA C 17 45.803 45.803 45.517 0.286 18321 10914 1 9 . 1 1 18 18 PRO HA H 18 4.675 4.675 4.332 0.343 18321 10915 1 9 . 1 1 18 18 PRO C C 18 175.943 175.943 174.969 0.974 18321 10916 1 9 . 1 1 18 18 PRO CA C 18 63.647 63.647 63.345 0.302 18321 10917 1 9 . 1 1 18 18 PRO CB C 18 29.276 29.276 30.103 -0.827 18321 10918 1 9 . 1 1 19 19 VAL N N 19 126.159 126.159 122.498 3.661 18321 10919 1 9 . 1 1 19 19 VAL HA H 19 4.011 4.011 4.356 -0.345 18321 10920 1 9 . 1 1 19 19 VAL C C 19 175.812 175.812 173.939 1.873 18321 10921 1 9 . 1 1 19 19 VAL CA C 19 62.355 62.355 60.931 1.424 18321 10922 1 9 . 1 1 19 19 VAL CB C 19 33.468 33.468 35.297 -1.829 18321 10923 1 9 . 1 1 19 19 VAL H H 19 7.851 7.851 7.723 0.128 18321 10924 1 9 . 1 1 20 20 SER N N 20 123.950 123.950 118.502 5.448 18321 10925 1 9 . 1 1 20 20 SER HA H 20 4.453 4.453 5.004 -0.551 18321 10926 1 9 . 1 1 20 20 SER CA C 20 57.631 57.631 57.084 0.547 18321 10927 1 9 . 1 1 20 20 SER CB C 20 65.951 65.951 65.423 0.528 18321 10928 1 9 . 1 1 20 20 SER H H 20 8.800 8.800 8.161 0.639 18321 10929 1 9 . 1 1 21 21 ARG N N 21 123.461 123.461 120.450 3.011 18321 10930 1 9 . 1 1 21 21 ARG HA H 21 3.489 3.489 4.079 -0.590 18321 10931 1 9 . 1 1 21 21 ARG C C 21 178.164 178.164 178.513 -0.349 18321 10932 1 9 . 1 1 21 21 ARG CA C 21 60.025 60.025 60.257 -0.231 18321 10933 1 9 . 1 1 21 21 ARG CB C 21 30.334 30.334 30.239 0.095 18321 10934 1 9 . 1 1 21 21 ARG H H 21 9.307 9.307 8.701 0.606 18321 10935 1 9 . 1 1 22 22 GLN N N 22 116.591 116.591 119.185 -2.594 18321 10936 1 9 . 1 1 22 22 GLN HA H 22 4.008 4.008 4.076 -0.068 18321 10937 1 9 . 1 1 22 22 GLN CA C 22 59.095 59.095 59.021 0.074 18321 10938 1 9 . 1 1 22 22 GLN CB C 22 29.249 29.249 27.404 1.845 18321 10939 1 9 . 1 1 22 22 GLN H H 22 8.394 8.394 8.486 -0.092 18321 10940 1 9 . 1 1 23 23 GLU N N 23 122.191 122.191 120.174 2.017 18321 10941 1 9 . 1 1 23 23 GLU HA H 23 4.037 4.037 3.998 0.039 18321 10942 1 9 . 1 1 23 23 GLU C C 23 178.986 178.986 178.703 0.283 18321 10943 1 9 . 1 1 23 23 GLU CA C 23 59.081 59.081 59.399 -0.318 18321 10944 1 9 . 1 1 23 23 GLU CB C 23 31.896 31.896 28.739 3.157 18321 10945 1 9 . 1 1 23 23 GLU H H 23 8.106 8.106 8.452 -0.346 18321 10946 1 9 . 1 1 24 24 ALA N N 24 121.964 121.964 121.069 0.895 18321 10947 1 9 . 1 1 24 24 ALA HA H 24 3.762 3.762 3.915 -0.153 18321 10948 1 9 . 1 1 24 24 ALA C C 24 178.653 178.653 179.560 -0.907 18321 10949 1 9 . 1 1 24 24 ALA CA C 24 55.480 55.480 55.315 0.165 18321 10950 1 9 . 1 1 24 24 ALA CB C 24 18.049 18.049 18.149 -0.100 18321 10951 1 9 . 1 1 24 24 ALA H H 24 8.732 8.732 8.145 0.587 18321 10952 1 9 . 1 1 25 25 GLN N N 25 116.229 116.229 117.838 -1.609 18321 10953 1 9 . 1 1 25 25 GLN HA H 25 3.950 3.950 4.108 -0.158 18321 10954 1 9 . 1 1 25 25 GLN C C 25 177.442 177.442 177.952 -0.510 18321 10955 1 9 . 1 1 25 25 GLN CA C 25 59.651 59.651 58.446 1.205 18321 10956 1 9 . 1 1 25 25 GLN CB C 25 29.308 29.308 28.291 1.017 18321 10957 1 9 . 1 1 25 25 GLN H H 25 8.391 8.391 7.862 0.529 18321 10958 1 9 . 1 1 26 26 THR N N 26 115.105 115.105 111.669 3.436 18321 10959 1 9 . 1 1 26 26 THR HA H 26 3.920 3.920 4.297 -0.377 18321 10960 1 9 . 1 1 26 26 THR C C 26 176.835 176.835 176.828 0.007 18321 10961 1 9 . 1 1 26 26 THR CA C 26 66.335 66.335 64.023 2.312 18321 10962 1 9 . 1 1 26 26 THR CB C 26 68.876 68.876 69.068 -0.192 18321 10963 1 9 . 1 1 26 26 THR H H 26 8.223 8.223 7.659 0.564 18321 10964 1 9 . 1 1 27 27 ARG N N 27 119.096 119.096 120.873 -1.777 18321 10965 1 9 . 1 1 27 27 ARG HA H 27 4.047 4.047 4.210 -0.163 18321 10966 1 9 . 1 1 27 27 ARG C C 27 177.245 177.245 177.546 -0.301 18321 10967 1 9 . 1 1 27 27 ARG CA C 27 58.528 58.528 59.201 -0.673 18321 10968 1 9 . 1 1 27 27 ARG CB C 27 30.184 30.184 30.607 -0.423 18321 10969 1 9 . 1 1 27 27 ARG H H 27 8.093 8.093 7.846 0.247 18321 10970 1 9 . 1 1 28 28 LEU N N 28 114.602 114.602 116.245 -1.643 18321 10971 1 9 . 1 1 28 28 LEU HA H 28 4.325 4.325 4.501 -0.176 18321 10972 1 9 . 1 1 28 28 LEU C C 28 177.197 177.197 176.045 1.152 18321 10973 1 9 . 1 1 28 28 LEU CA C 28 55.143 55.143 53.804 1.339 18321 10974 1 9 . 1 1 28 28 LEU CB C 28 44.902 44.902 42.202 2.700 18321 10975 1 9 . 1 1 28 28 LEU H H 28 7.438 7.438 7.625 -0.187 18321 10976 1 9 . 1 1 29 29 GLN N N 29 121.312 121.312 120.727 0.585 18321 10977 1 9 . 1 1 29 29 GLN HA H 29 3.856 3.856 4.192 -0.336 18321 10978 1 9 . 1 1 29 29 GLN C C 29 178.048 178.048 176.813 1.235 18321 10979 1 9 . 1 1 29 29 GLN CA C 29 57.691 57.691 56.060 1.631 18321 10980 1 9 . 1 1 29 29 GLN CB C 29 27.293 27.293 27.052 0.240 18321 10981 1 9 . 1 1 29 29 GLN H H 29 8.250 8.250 7.340 0.910 18321 10982 1 9 . 1 1 30 30 GLY N N 30 116.768 116.768 115.177 1.591 18321 10983 1 9 . 1 1 30 30 GLY C C 30 174.914 174.914 174.433 0.481 18321 10984 1 9 . 1 1 30 30 GLY CA C 30 45.491 45.491 45.839 -0.347 18321 10985 1 9 . 1 1 30 30 GLY H H 30 9.135 9.135 8.496 0.639 18321 10986 1 9 . 1 1 31 31 GLN N N 31 117.979 117.979 119.682 -1.703 18321 10987 1 9 . 1 1 31 31 GLN HA H 31 4.329 4.329 4.239 0.090 18321 10988 1 9 . 1 1 31 31 GLN C C 31 177.174 177.174 176.086 1.088 18321 10989 1 9 . 1 1 31 31 GLN CA C 31 53.910 53.910 57.298 -3.389 18321 10990 1 9 . 1 1 31 31 GLN CB C 31 29.574 29.574 30.100 -0.526 18321 10991 1 9 . 1 1 31 31 GLN H H 31 7.695 7.695 7.900 -0.205 18321 10992 1 9 . 1 1 32 32 ARG N N 32 123.918 123.918 118.725 5.193 18321 10993 1 9 . 1 1 32 32 ARG HA H 32 3.940 3.940 4.483 -0.543 18321 10994 1 9 . 1 1 32 32 ARG C C 32 175.810 175.810 175.083 0.727 18321 10995 1 9 . 1 1 32 32 ARG CA C 32 56.770 56.770 54.723 2.047 18321 10996 1 9 . 1 1 32 32 ARG CB C 32 30.074 30.074 33.189 -3.115 18321 10997 1 9 . 1 1 32 32 ARG H H 32 8.955 8.955 7.713 1.242 18321 10998 1 9 . 1 1 33 33 HIS N N 33 122.248 122.248 122.818 -0.570 18321 10999 1 9 . 1 1 33 33 HIS HA H 33 4.627 4.627 4.696 -0.069 18321 11000 1 9 . 1 1 33 33 HIS C C 33 177.089 177.089 176.107 0.982 18321 11001 1 9 . 1 1 33 33 HIS CA C 33 55.858 55.858 56.813 -0.955 18321 11002 1 9 . 1 1 33 33 HIS CB C 33 28.648 28.648 29.744 -1.096 18321 11003 1 9 . 1 1 33 33 HIS H H 33 8.302 8.302 8.694 -0.392 18321 11004 1 9 . 1 1 34 34 GLY N N 34 109.518 109.518 113.274 -3.756 18321 11005 1 9 . 1 1 34 34 GLY C C 34 176.730 176.730 174.094 2.636 18321 11006 1 9 . 1 1 34 34 GLY CA C 34 45.967 45.967 44.818 1.149 18321 11007 1 9 . 1 1 34 34 GLY H H 34 9.496 9.496 9.305 0.191 18321 11008 1 9 . 1 1 35 35 MET N N 35 125.193 125.193 123.600 1.593 18321 11009 1 9 . 1 1 35 35 MET HA H 35 5.750 5.750 5.388 0.362 18321 11010 1 9 . 1 1 35 35 MET C C 35 174.388 174.388 175.260 -0.872 18321 11011 1 9 . 1 1 35 35 MET CA C 35 55.762 55.762 56.687 -0.925 18321 11012 1 9 . 1 1 35 35 MET CB C 35 32.706 32.706 32.841 -0.135 18321 11013 1 9 . 1 1 35 35 MET H H 35 8.359 8.359 7.511 0.848 18321 11014 1 9 . 1 1 36 36 PHE N N 36 123.311 123.311 119.818 3.493 18321 11015 1 9 . 1 1 36 36 PHE HA H 36 5.985 5.985 5.800 0.185 18321 11016 1 9 . 1 1 36 36 PHE C C 36 172.140 172.140 173.054 -0.914 18321 11017 1 9 . 1 1 36 36 PHE CA C 36 55.755 55.755 54.927 0.828 18321 11018 1 9 . 1 1 36 36 PHE CB C 36 45.197 45.197 42.892 2.305 18321 11019 1 9 . 1 1 36 36 PHE H H 36 8.261 8.261 8.490 -0.229 18321 11020 1 9 . 1 1 37 37 LEU N N 37 114.652 114.652 115.153 -0.501 18321 11021 1 9 . 1 1 37 37 LEU HA H 37 4.489 4.489 5.144 -0.655 18321 11022 1 9 . 1 1 37 37 LEU C C 37 174.033 174.033 175.058 -1.025 18321 11023 1 9 . 1 1 37 37 LEU CA C 37 55.382 55.382 54.539 0.843 18321 11024 1 9 . 1 1 37 37 LEU CB C 37 44.791 44.791 45.495 -0.704 18321 11025 1 9 . 1 1 37 37 LEU H H 37 9.292 9.292 9.010 0.282 18321 11026 1 9 . 1 1 38 38 VAL N N 38 121.009 121.009 121.761 -0.752 18321 11027 1 9 . 1 1 38 38 VAL HA H 38 5.504 5.504 4.470 1.034 18321 11028 1 9 . 1 1 38 38 VAL C C 38 173.581 173.581 175.647 -2.066 18321 11029 1 9 . 1 1 38 38 VAL CA C 38 61.316 61.316 61.978 -0.662 18321 11030 1 9 . 1 1 38 38 VAL CB C 38 33.302 33.302 32.847 0.455 18321 11031 1 9 . 1 1 38 38 VAL H H 38 8.991 8.991 8.448 0.542 18321 11032 1 9 . 1 1 39 39 ARG N N 39 124.863 124.863 126.958 -2.095 18321 11033 1 9 . 1 1 39 39 ARG HA H 39 5.444 5.444 4.534 0.910 18321 11034 1 9 . 1 1 39 39 ARG C C 39 175.772 175.772 175.374 0.398 18321 11035 1 9 . 1 1 39 39 ARG CA C 39 52.558 52.558 54.043 -1.485 18321 11036 1 9 . 1 1 39 39 ARG CB C 39 34.980 34.980 32.598 2.382 18321 11037 1 9 . 1 1 39 39 ARG H H 39 9.569 9.569 8.148 1.421 18321 11038 1 9 . 1 1 40 40 ASP N N 40 122.330 122.330 121.551 0.779 18321 11039 1 9 . 1 1 40 40 ASP HA H 40 4.785 4.785 5.062 -0.277 18321 11040 1 9 . 1 1 40 40 ASP C C 40 176.332 176.332 176.107 0.225 18321 11041 1 9 . 1 1 40 40 ASP CA C 40 55.334 55.334 54.206 1.128 18321 11042 1 9 . 1 1 40 40 ASP CB C 40 40.650 40.650 40.848 -0.198 18321 11043 1 9 . 1 1 40 40 ASP H H 40 8.413 8.413 7.925 0.488 18321 11044 1 9 . 1 1 41 41 SER N N 41 114.363 114.363 119.774 -5.411 18321 11045 1 9 . 1 1 41 41 SER HA H 41 4.506 4.506 4.119 0.387 18321 11046 1 9 . 1 1 41 41 SER CA C 41 57.525 57.525 60.879 -3.354 18321 11047 1 9 . 1 1 41 41 SER CB C 41 63.706 63.706 63.441 0.265 18321 11048 1 9 . 1 1 41 41 SER H H 41 7.791 7.791 8.412 -0.621 18321 11049 1 9 . 1 1 42 42 SER N N 42 126.932 126.932 110.603 16.329 18321 11050 1 9 . 1 1 42 42 SER HA H 42 4.410 4.410 4.487 -0.077 18321 11051 1 9 . 1 1 42 42 SER CA C 42 60.362 60.362 59.581 0.781 18321 11052 1 9 . 1 1 42 42 SER CB C 42 63.707 63.707 63.792 -0.085 18321 11053 1 9 . 1 1 42 42 SER H H 42 10.519 10.519 8.613 1.906 18321 11054 1 9 . 1 1 43 43 THR HA H 43 4.097 4.097 4.604 -0.507 18321 11055 1 9 . 1 1 43 43 THR CA C 43 64.722 64.722 61.949 2.773 18321 11056 1 9 . 1 1 43 43 THR CB C 43 69.439 69.439 70.610 -1.171 18321 11057 1 9 . 1 1 44 44 CYS HA H 44 5.100 5.100 4.932 0.168 18321 11058 1 9 . 1 1 44 44 CYS CA C 44 51.779 51.779 56.610 -4.831 18321 11059 1 9 . 1 1 44 44 CYS CB C 44 41.314 41.314 29.710 11.604 18321 11060 1 9 . 1 1 45 45 PRO HA H 45 4.278 4.278 4.263 0.015 18321 11061 1 9 . 1 1 45 45 PRO C C 45 178.127 178.127 177.496 0.631 18321 11062 1 9 . 1 1 45 45 PRO CA C 45 64.151 64.151 64.475 -0.324 18321 11063 1 9 . 1 1 45 45 PRO CB C 45 31.596 31.596 30.940 0.656 18321 11064 1 9 . 1 1 46 46 GLY N N 46 114.947 114.947 113.943 1.004 18321 11065 1 9 . 1 1 46 46 GLY C C 46 174.701 174.701 173.973 0.728 18321 11066 1 9 . 1 1 46 46 GLY CA C 46 45.225 45.225 44.799 0.426 18321 11067 1 9 . 1 1 46 46 GLY H H 46 8.812 8.812 8.600 0.212 18321 11068 1 9 . 1 1 47 47 ASP N N 47 120.862 120.862 121.498 -0.636 18321 11069 1 9 . 1 1 47 47 ASP HA H 47 5.235 5.235 4.619 0.616 18321 11070 1 9 . 1 1 47 47 ASP C C 47 176.480 176.480 175.007 1.473 18321 11071 1 9 . 1 1 47 47 ASP CA C 47 53.591 53.591 53.965 -0.374 18321 11072 1 9 . 1 1 47 47 ASP CB C 47 41.707 41.707 42.261 -0.554 18321 11073 1 9 . 1 1 47 47 ASP H H 47 7.997 7.997 7.850 0.147 18321 11074 1 9 . 1 1 48 48 TYR N N 48 118.473 118.473 115.467 3.006 18321 11075 1 9 . 1 1 48 48 TYR HA H 48 5.431 5.431 5.054 0.377 18321 11076 1 9 . 1 1 48 48 TYR C C 48 173.783 173.783 175.730 -1.947 18321 11077 1 9 . 1 1 48 48 TYR CA C 48 56.891 56.891 56.667 0.224 18321 11078 1 9 . 1 1 48 48 TYR CB C 48 43.274 43.274 42.599 0.675 18321 11079 1 9 . 1 1 48 48 TYR H H 48 8.892 8.892 9.148 -0.256 18321 11080 1 9 . 1 1 49 49 VAL N N 49 119.105 119.105 120.152 -1.047 18321 11081 1 9 . 1 1 49 49 VAL HA H 49 4.800 4.800 4.385 0.415 18321 11082 1 9 . 1 1 49 49 VAL C C 49 174.397 174.397 174.726 -0.329 18321 11083 1 9 . 1 1 49 49 VAL CA C 49 61.439 61.439 62.044 -0.605 18321 11084 1 9 . 1 1 49 49 VAL CB C 49 35.388 35.388 33.643 1.745 18321 11085 1 9 . 1 1 49 49 VAL H H 49 9.661 9.661 8.476 1.185 18321 11086 1 9 . 1 1 50 50 LEU N N 50 129.599 129.599 130.804 -1.205 18321 11087 1 9 . 1 1 50 50 LEU HA H 50 5.033 5.033 4.946 0.087 18321 11088 1 9 . 1 1 50 50 LEU C C 50 175.001 175.001 175.590 -0.589 18321 11089 1 9 . 1 1 50 50 LEU CA C 50 53.352 53.352 54.394 -1.042 18321 11090 1 9 . 1 1 50 50 LEU CB C 50 44.062 44.062 42.106 1.956 18321 11091 1 9 . 1 1 50 50 LEU H H 50 9.405 9.405 8.721 0.684 18321 11092 1 9 . 1 1 51 51 SER N N 51 126.895 126.895 124.144 2.751 18321 11093 1 9 . 1 1 51 51 SER HA H 51 5.731 5.731 5.316 0.415 18321 11094 1 9 . 1 1 51 51 SER C C 51 173.094 173.094 173.804 -0.710 18321 11095 1 9 . 1 1 51 51 SER CA C 51 58.834 58.834 57.362 1.472 18321 11096 1 9 . 1 1 51 51 SER CB C 51 64.977 64.977 64.122 0.855 18321 11097 1 9 . 1 1 51 51 SER H H 51 9.094 9.094 9.049 0.045 18321 11098 1 9 . 1 1 52 52 VAL N N 52 121.777 121.777 125.049 -3.272 18321 11099 1 9 . 1 1 52 52 VAL HA H 52 5.066 5.066 4.657 0.409 18321 11100 1 9 . 1 1 52 52 VAL C C 52 174.573 174.573 174.382 0.191 18321 11101 1 9 . 1 1 52 52 VAL CA C 52 59.535 59.535 60.644 -1.109 18321 11102 1 9 . 1 1 52 52 VAL CB C 52 36.834 36.834 35.836 0.998 18321 11103 1 9 . 1 1 52 52 VAL H H 52 8.816 8.816 8.904 -0.088 18321 11104 1 9 . 1 1 53 53 SER N N 53 120.489 120.489 120.317 0.172 18321 11105 1 9 . 1 1 53 53 SER HA H 53 4.811 4.811 4.901 -0.090 18321 11106 1 9 . 1 1 53 53 SER C C 53 174.065 174.065 173.184 0.881 18321 11107 1 9 . 1 1 53 53 SER CA C 53 57.496 57.496 57.961 -0.465 18321 11108 1 9 . 1 1 53 53 SER CB C 53 62.623 62.623 63.412 -0.789 18321 11109 1 9 . 1 1 53 53 SER H H 53 8.780 8.780 9.105 -0.325 18321 11110 1 9 . 1 1 54 54 GLU N N 54 132.020 132.020 126.250 5.770 18321 11111 1 9 . 1 1 54 54 GLU HA H 54 4.250 4.250 4.190 0.060 18321 11112 1 9 . 1 1 54 54 GLU C C 54 175.387 175.387 175.687 -0.300 18321 11113 1 9 . 1 1 54 54 GLU CA C 54 56.999 56.999 55.463 1.536 18321 11114 1 9 . 1 1 54 54 GLU CB C 54 32.556 32.556 32.805 -0.249 18321 11115 1 9 . 1 1 54 54 GLU H H 54 8.472 8.472 9.025 -0.553 18321 11116 1 9 . 1 1 55 55 ASN N N 55 126.517 126.517 122.422 4.095 18321 11117 1 9 . 1 1 55 55 ASN HA H 55 4.220 4.220 4.134 0.086 18321 11118 1 9 . 1 1 55 55 ASN C C 55 174.546 174.546 174.562 -0.016 18321 11119 1 9 . 1 1 55 55 ASN CA C 55 54.770 54.770 54.604 0.166 18321 11120 1 9 . 1 1 55 55 ASN CB C 55 37.314 37.314 37.397 -0.083 18321 11121 1 9 . 1 1 55 55 ASN H H 55 8.853 8.853 8.507 0.346 18321 11122 1 9 . 1 1 56 56 SER N N 56 112.009 112.009 106.668 5.341 18321 11123 1 9 . 1 1 56 56 SER HA H 56 4.334 4.334 4.010 0.324 18321 11124 1 9 . 1 1 56 56 SER C C 56 173.354 173.354 173.239 0.115 18321 11125 1 9 . 1 1 56 56 SER CA C 56 59.966 59.966 60.366 -0.400 18321 11126 1 9 . 1 1 56 56 SER CB C 56 62.242 62.242 62.442 -0.200 18321 11127 1 9 . 1 1 56 56 SER H H 56 10.418 10.418 8.047 2.371 18321 11128 1 9 . 1 1 57 57 ARG N N 57 121.764 121.764 116.485 5.279 18321 11129 1 9 . 1 1 57 57 ARG HA H 57 5.167 5.167 4.716 0.451 18321 11130 1 9 . 1 1 57 57 ARG C C 57 174.983 174.983 174.203 0.780 18321 11131 1 9 . 1 1 57 57 ARG CA C 57 54.550 54.550 53.593 0.957 18321 11132 1 9 . 1 1 57 57 ARG CB C 57 31.886 31.886 32.743 -0.857 18321 11133 1 9 . 1 1 57 57 ARG H H 57 8.097 8.097 7.523 0.574 18321 11134 1 9 . 1 1 58 58 VAL N N 58 121.866 121.866 121.191 0.675 18321 11135 1 9 . 1 1 58 58 VAL HA H 58 4.768 4.768 4.671 0.097 18321 11136 1 9 . 1 1 58 58 VAL C C 58 175.388 175.388 175.156 0.232 18321 11137 1 9 . 1 1 58 58 VAL CA C 58 61.818 61.818 61.043 0.775 18321 11138 1 9 . 1 1 58 58 VAL CB C 58 34.135 34.135 32.230 1.905 18321 11139 1 9 . 1 1 58 58 VAL H H 58 8.081 8.081 8.513 -0.432 18321 11140 1 9 . 1 1 59 59 SER N N 59 124.445 124.445 121.956 2.489 18321 11141 1 9 . 1 1 59 59 SER HA H 59 4.462 4.462 4.265 0.197 18321 11142 1 9 . 1 1 59 59 SER C C 59 172.185 172.185 173.113 -0.928 18321 11143 1 9 . 1 1 59 59 SER CA C 59 56.629 56.629 57.168 -0.539 18321 11144 1 9 . 1 1 59 59 SER CB C 59 66.218 66.218 63.604 2.614 18321 11145 1 9 . 1 1 59 59 SER H H 59 9.082 9.082 8.255 0.827 18321 11146 1 9 . 1 1 60 60 HIS N N 60 121.224 121.224 127.424 -6.200 18321 11147 1 9 . 1 1 60 60 HIS HA H 60 4.885 4.885 4.560 0.325 18321 11148 1 9 . 1 1 60 60 HIS C C 60 174.674 174.674 174.325 0.349 18321 11149 1 9 . 1 1 60 60 HIS CA C 60 54.900 54.900 55.265 -0.365 18321 11150 1 9 . 1 1 60 60 HIS CB C 60 32.331 32.331 29.209 3.122 18321 11151 1 9 . 1 1 60 60 HIS H H 60 8.331 8.331 8.650 -0.319 18321 11152 1 9 . 1 1 61 61 TYR N N 61 124.780 124.780 125.723 -0.943 18321 11153 1 9 . 1 1 61 61 TYR HA H 61 4.655 4.655 4.745 -0.090 18321 11154 1 9 . 1 1 61 61 TYR CA C 61 57.409 57.409 57.204 0.205 18321 11155 1 9 . 1 1 61 61 TYR CB C 61 39.785 39.785 37.495 2.290 18321 11156 1 9 . 1 1 61 61 TYR H H 61 9.273 9.273 9.116 0.157 18321 11157 1 9 . 1 1 62 62 ILE HA H 62 4.298 4.298 4.293 0.005 18321 11158 1 9 . 1 1 62 62 ILE C C 62 174.817 174.817 175.268 -0.451 18321 11159 1 9 . 1 1 62 62 ILE CA C 62 61.908 61.908 61.760 0.148 18321 11160 1 9 . 1 1 62 62 ILE CB C 62 38.321 38.321 39.078 -0.757 18321 11161 1 9 . 1 1 63 63 ILE N N 63 128.552 128.552 126.803 1.749 18321 11162 1 9 . 1 1 63 63 ILE HA H 63 4.788 4.788 4.803 -0.015 18321 11163 1 9 . 1 1 63 63 ILE C C 63 175.982 175.982 174.723 1.259 18321 11164 1 9 . 1 1 63 63 ILE CA C 63 59.629 59.629 59.734 -0.105 18321 11165 1 9 . 1 1 63 63 ILE CB C 63 39.747 39.747 39.458 0.289 18321 11166 1 9 . 1 1 63 63 ILE H H 63 9.155 9.155 8.870 0.285 18321 11167 1 9 . 1 1 64 64 ASN N N 64 123.240 123.240 126.876 -3.636 18321 11168 1 9 . 1 1 64 64 ASN HA H 64 4.857 4.857 5.294 -0.437 18321 11169 1 9 . 1 1 64 64 ASN C C 64 175.324 175.324 174.413 0.911 18321 11170 1 9 . 1 1 64 64 ASN CA C 64 53.736 53.736 52.817 0.919 18321 11171 1 9 . 1 1 64 64 ASN CB C 64 41.531 41.531 40.742 0.789 18321 11172 1 9 . 1 1 64 64 ASN H H 64 9.379 9.379 8.915 0.464 18321 11173 1 9 . 1 1 65 65 SER N N 65 121.157 121.157 118.384 2.773 18321 11174 1 9 . 1 1 65 65 SER HA H 65 4.548 4.548 4.810 -0.262 18321 11175 1 9 . 1 1 65 65 SER C C 65 174.328 174.328 174.542 -0.214 18321 11176 1 9 . 1 1 65 65 SER CA C 65 58.306 58.306 58.301 0.005 18321 11177 1 9 . 1 1 65 65 SER CB C 65 62.878 62.878 63.202 -0.324 18321 11178 1 9 . 1 1 65 65 SER H H 65 9.195 9.195 9.205 -0.010 18321 11179 1 9 . 1 1 66 66 LEU N N 66 127.417 127.417 129.531 -2.114 18321 11180 1 9 . 1 1 66 66 LEU HA H 66 4.605 4.605 4.568 0.037 18321 11181 1 9 . 1 1 66 66 LEU CA C 66 52.888 52.888 52.902 -0.014 18321 11182 1 9 . 1 1 66 66 LEU CB C 66 41.799 41.799 41.672 0.127 18321 11183 1 9 . 1 1 66 66 LEU H H 66 8.143 8.143 8.407 -0.264 18321 11184 1 9 . 1 1 68 68 ASN HA H 68 4.386 4.386 4.674 -0.288 18321 11185 1 9 . 1 1 68 68 ASN C C 68 174.487 174.487 174.966 -0.479 18321 11186 1 9 . 1 1 68 68 ASN CA C 68 53.365 53.365 52.494 0.871 18321 11187 1 9 . 1 1 68 68 ASN CB C 68 36.778 36.778 37.880 -1.102 18321 11188 1 9 . 1 1 69 69 ARG N N 69 111.329 111.329 114.639 -3.310 18321 11189 1 9 . 1 1 69 69 ARG HA H 69 3.876 3.876 3.844 0.032 18321 11190 1 9 . 1 1 69 69 ARG CA C 69 57.393 57.393 57.309 0.084 18321 11191 1 9 . 1 1 69 69 ARG CB C 69 26.665 26.665 27.031 -0.366 18321 11192 1 9 . 1 1 69 69 ARG H H 69 8.191 8.191 8.038 0.153 18321 11193 1 9 . 1 1 70 70 ARG N N 70 116.120 116.120 115.294 0.826 18321 11194 1 9 . 1 1 70 70 ARG HA H 70 4.556 4.556 5.238 -0.682 18321 11195 1 9 . 1 1 70 70 ARG C C 70 174.882 174.882 174.602 0.280 18321 11196 1 9 . 1 1 70 70 ARG CA C 70 55.509 55.509 53.770 1.739 18321 11197 1 9 . 1 1 70 70 ARG CB C 70 31.771 31.771 33.477 -1.706 18321 11198 1 9 . 1 1 70 70 ARG H H 70 6.667 6.667 7.277 -0.610 18321 11199 1 9 . 1 1 71 71 PHE N N 71 116.313 116.313 117.446 -1.133 18321 11200 1 9 . 1 1 71 71 PHE HA H 71 5.540 5.540 5.414 0.126 18321 11201 1 9 . 1 1 71 71 PHE C C 71 174.391 174.391 174.830 -0.439 18321 11202 1 9 . 1 1 71 71 PHE CA C 71 57.528 57.528 56.781 0.747 18321 11203 1 9 . 1 1 71 71 PHE CB C 71 44.115 44.115 42.684 1.431 18321 11204 1 9 . 1 1 71 71 PHE H H 71 8.700 8.700 8.756 -0.056 18321 11205 1 9 . 1 1 72 72 LYS N N 72 122.770 122.770 126.095 -3.325 18321 11206 1 9 . 1 1 72 72 LYS HA H 72 5.483 5.483 5.080 0.403 18321 11207 1 9 . 1 1 72 72 LYS C C 72 173.923 173.923 175.266 -1.343 18321 11208 1 9 . 1 1 72 72 LYS CA C 72 54.855 54.855 55.022 -0.167 18321 11209 1 9 . 1 1 72 72 LYS CB C 72 37.710 37.710 35.198 2.512 18321 11210 1 9 . 1 1 72 72 LYS H H 72 9.138 9.138 8.943 0.195 18321 11211 1 9 . 1 1 73 73 ILE N N 73 124.576 124.576 129.655 -5.079 18321 11212 1 9 . 1 1 73 73 ILE HA H 73 4.955 4.955 4.977 -0.022 18321 11213 1 9 . 1 1 73 73 ILE C C 73 175.728 175.728 175.932 -0.204 18321 11214 1 9 . 1 1 73 73 ILE CA C 73 58.935 58.935 60.127 -1.192 18321 11215 1 9 . 1 1 73 73 ILE CB C 73 40.965 40.965 38.934 2.031 18321 11216 1 9 . 1 1 73 73 ILE H H 73 8.826 8.826 8.858 -0.032 18321 11217 1 9 . 1 1 74 74 GLY N N 74 118.718 118.718 119.224 -0.506 18321 11218 1 9 . 1 1 74 74 GLY C C 74 174.436 174.436 174.955 -0.519 18321 11219 1 9 . 1 1 74 74 GLY CA C 74 47.401 47.401 45.943 1.458 18321 11220 1 9 . 1 1 74 74 GLY H H 74 9.317 9.317 8.957 0.360 18321 11221 1 9 . 1 1 75 75 ASP N N 75 125.691 125.691 117.945 7.746 18321 11222 1 9 . 1 1 75 75 ASP HA H 75 4.713 4.713 4.239 0.474 18321 11223 1 9 . 1 1 75 75 ASP C C 75 175.841 175.841 175.544 0.297 18321 11224 1 9 . 1 1 75 75 ASP CA C 75 53.815 53.815 56.434 -2.619 18321 11225 1 9 . 1 1 75 75 ASP CB C 75 41.288 41.288 40.149 1.139 18321 11226 1 9 . 1 1 75 75 ASP H H 75 8.665 8.665 8.877 -0.212 18321 11227 1 9 . 1 1 76 76 GLN N N 76 120.368 120.368 121.174 -0.806 18321 11228 1 9 . 1 1 76 76 GLN C C 76 173.630 173.630 174.961 -1.331 18321 11229 1 9 . 1 1 76 76 GLN CA C 76 54.254 54.254 55.864 -1.610 18321 11230 1 9 . 1 1 76 76 GLN CB C 76 31.248 31.248 28.571 2.677 18321 11231 1 9 . 1 1 76 76 GLN H H 76 8.289 8.289 7.895 0.394 18321 11232 1 9 . 1 1 77 77 GLU N N 77 120.435 120.435 121.717 -1.282 18321 11233 1 9 . 1 1 77 77 GLU C C 77 175.484 175.484 175.069 0.415 18321 11234 1 9 . 1 1 77 77 GLU CA C 77 54.203 54.203 55.436 -1.233 18321 11235 1 9 . 1 1 77 77 GLU CB C 77 33.141 33.141 30.945 2.196 18321 11236 1 9 . 1 1 77 77 GLU H H 77 7.732 7.732 8.104 -0.372 18321 11237 1 9 . 1 1 78 78 PHE N N 78 117.911 117.911 122.678 -4.767 18321 11238 1 9 . 1 1 78 78 PHE HA H 78 4.659 4.659 4.678 -0.019 18321 11239 1 9 . 1 1 78 78 PHE C C 78 175.673 175.673 175.309 0.364 18321 11240 1 9 . 1 1 78 78 PHE CA C 78 57.160 57.160 56.717 0.443 18321 11241 1 9 . 1 1 78 78 PHE CB C 78 45.405 45.405 42.075 3.329 18321 11242 1 9 . 1 1 78 78 PHE H H 78 9.235 9.235 8.513 0.722 18321 11243 1 9 . 1 1 79 79 ASP N N 79 119.296 119.296 118.850 0.446 18321 11244 1 9 . 1 1 79 79 ASP HA H 79 4.462 4.462 4.529 -0.067 18321 11245 1 9 . 1 1 79 79 ASP C C 79 174.482 174.482 175.925 -1.443 18321 11246 1 9 . 1 1 79 79 ASP CA C 79 56.629 56.629 56.518 0.111 18321 11247 1 9 . 1 1 79 79 ASP CB C 79 41.697 41.697 41.382 0.315 18321 11248 1 9 . 1 1 79 79 ASP H H 79 9.187 9.187 8.764 0.423 18321 11249 1 9 . 1 1 80 80 HIS N N 80 107.631 107.631 110.458 -2.827 18321 11250 1 9 . 1 1 80 80 HIS HA H 80 5.022 5.022 5.074 -0.052 18321 11251 1 9 . 1 1 80 80 HIS C C 80 174.626 174.626 174.615 0.011 18321 11252 1 9 . 1 1 80 80 HIS CA C 80 54.223 54.223 55.101 -0.878 18321 11253 1 9 . 1 1 80 80 HIS CB C 80 32.205 32.205 31.146 1.059 18321 11254 1 9 . 1 1 80 80 HIS H H 80 7.200 7.200 7.107 0.093 18321 11255 1 9 . 1 1 81 81 LEU N N 81 120.710 120.710 120.673 0.037 18321 11256 1 9 . 1 1 81 81 LEU HA H 81 3.804 3.804 4.200 -0.396 18321 11257 1 9 . 1 1 81 81 LEU CA C 81 58.709 58.709 60.064 -1.355 18321 11258 1 9 . 1 1 81 81 LEU CB C 81 39.646 39.646 40.201 -0.555 18321 11259 1 9 . 1 1 81 81 LEU H H 81 8.886 8.886 9.207 -0.321 18321 11260 1 9 . 1 1 82 82 PRO HA H 82 4.020 4.020 4.392 -0.372 18321 11261 1 9 . 1 1 82 82 PRO C C 82 175.619 175.619 176.309 -0.690 18321 11262 1 9 . 1 1 82 82 PRO CA C 82 67.025 67.025 64.840 2.185 18321 11263 1 9 . 1 1 82 82 PRO CB C 82 30.962 30.962 31.193 -0.231 18321 11264 1 9 . 1 1 83 83 ALA N N 83 124.281 124.281 117.032 7.249 18321 11265 1 9 . 1 1 83 83 ALA HA H 83 4.019 4.019 4.179 -0.160 18321 11266 1 9 . 1 1 83 83 ALA C C 83 179.709 179.709 179.011 0.698 18321 11267 1 9 . 1 1 83 83 ALA CA C 83 54.985 54.985 53.727 1.258 18321 11268 1 9 . 1 1 83 83 ALA CB C 83 18.425 18.425 18.812 -0.387 18321 11269 1 9 . 1 1 83 83 ALA H H 83 8.527 8.527 7.494 1.033 18321 11270 1 9 . 1 1 84 84 LEU N N 84 122.960 122.960 117.585 5.375 18321 11271 1 9 . 1 1 84 84 LEU HA H 84 1.917 1.917 2.816 -0.899 18321 11272 1 9 . 1 1 84 84 LEU C C 84 177.652 177.652 178.036 -0.384 18321 11273 1 9 . 1 1 84 84 LEU CA C 84 58.261 58.261 57.108 1.153 18321 11274 1 9 . 1 1 84 84 LEU CB C 84 42.544 42.544 41.111 1.433 18321 11275 1 9 . 1 1 84 84 LEU H H 84 6.982 6.982 7.232 -0.250 18321 11276 1 9 . 1 1 85 85 LEU N N 85 117.940 117.940 119.545 -1.605 18321 11277 1 9 . 1 1 85 85 LEU HA H 85 3.463 3.463 3.822 -0.359 18321 11278 1 9 . 1 1 85 85 LEU C C 85 178.809 178.809 179.171 -0.362 18321 11279 1 9 . 1 1 85 85 LEU CA C 85 57.522 57.522 57.404 0.118 18321 11280 1 9 . 1 1 85 85 LEU CB C 85 41.242 41.242 40.590 0.652 18321 11281 1 9 . 1 1 85 85 LEU H H 85 7.773 7.773 7.696 0.077 18321 11282 1 9 . 1 1 86 86 GLU N N 86 115.762 115.762 120.255 -4.493 18321 11283 1 9 . 1 1 86 86 GLU HA H 86 3.540 3.540 4.056 -0.516 18321 11284 1 9 . 1 1 86 86 GLU C C 86 180.228 180.228 178.575 1.653 18321 11285 1 9 . 1 1 86 86 GLU CA C 86 58.943 58.943 58.407 0.536 18321 11286 1 9 . 1 1 86 86 GLU CB C 86 29.561 29.561 29.337 0.224 18321 11287 1 9 . 1 1 86 86 GLU H H 86 8.300 8.300 7.826 0.474 18321 11288 1 9 . 1 1 87 87 PHE N N 87 121.135 121.135 122.086 -0.951 18321 11289 1 9 . 1 1 87 87 PHE HA H 87 4.122 4.122 4.123 -0.001 18321 11290 1 9 . 1 1 87 87 PHE C C 87 179.497 179.497 177.168 2.329 18321 11291 1 9 . 1 1 87 87 PHE CA C 87 62.090 62.090 60.593 1.497 18321 11292 1 9 . 1 1 87 87 PHE CB C 87 40.103 40.103 39.372 0.731 18321 11293 1 9 . 1 1 87 87 PHE H H 87 7.717 7.717 7.444 0.273 18321 11294 1 9 . 1 1 88 88 TYR N N 88 116.579 116.579 116.810 -0.231 18321 11295 1 9 . 1 1 88 88 TYR HA H 88 4.933 4.933 4.148 0.785 18321 11296 1 9 . 1 1 88 88 TYR C C 88 174.799 174.799 176.707 -1.908 18321 11297 1 9 . 1 1 88 88 TYR CA C 88 61.333 61.333 58.987 2.346 18321 11298 1 9 . 1 1 88 88 TYR CB C 88 36.539 36.539 36.574 -0.035 18321 11299 1 9 . 1 1 88 88 TYR H H 88 7.478 7.478 8.130 -0.652 18321 11300 1 9 . 1 1 89 89 LYS N N 89 117.737 117.737 117.919 -0.182 18321 11301 1 9 . 1 1 89 89 LYS HA H 89 4.466 4.466 4.039 0.427 18321 11302 1 9 . 1 1 89 89 LYS C C 89 178.417 178.417 176.860 1.557 18321 11303 1 9 . 1 1 89 89 LYS CA C 89 59.486 59.486 58.107 1.379 18321 11304 1 9 . 1 1 89 89 LYS CB C 89 34.523 34.523 32.620 1.903 18321 11305 1 9 . 1 1 89 89 LYS H H 89 7.505 7.505 7.276 0.229 18321 11306 1 9 . 1 1 90 90 ILE N N 90 110.972 110.972 111.373 -0.401 18321 11307 1 9 . 1 1 90 90 ILE HA H 90 4.181 4.181 3.889 0.292 18321 11308 1 9 . 1 1 90 90 ILE C C 90 174.571 174.571 175.693 -1.122 18321 11309 1 9 . 1 1 90 90 ILE CA C 90 60.516 60.516 61.579 -1.063 18321 11310 1 9 . 1 1 90 90 ILE CB C 90 39.979 39.979 38.697 1.282 18321 11311 1 9 . 1 1 90 90 ILE H H 90 6.710 6.710 7.029 -0.319 18321 11312 1 9 . 1 1 91 91 HIS N N 91 119.479 119.479 119.886 -0.407 18321 11313 1 9 . 1 1 91 91 HIS HA H 91 4.357 4.357 4.563 -0.206 18321 11314 1 9 . 1 1 91 91 HIS C C 91 172.751 172.751 174.027 -1.276 18321 11315 1 9 . 1 1 91 91 HIS CA C 91 55.066 55.066 54.740 0.326 18321 11316 1 9 . 1 1 91 91 HIS CB C 91 29.756 29.756 30.636 -0.880 18321 11317 1 9 . 1 1 91 91 HIS H H 91 7.460 7.460 7.046 0.414 18321 11318 1 9 . 1 1 92 92 TYR N N 92 117.642 117.642 125.896 -8.254 18321 11319 1 9 . 1 1 92 92 TYR HA H 92 4.131 4.131 4.551 -0.420 18321 11320 1 9 . 1 1 92 92 TYR C C 92 177.348 177.348 176.078 1.270 18321 11321 1 9 . 1 1 92 92 TYR CA C 92 58.627 58.627 57.979 0.648 18321 11322 1 9 . 1 1 92 92 TYR CB C 92 39.481 39.481 36.364 3.116 18321 11323 1 9 . 1 1 92 92 TYR H H 92 8.067 8.067 9.165 -1.098 18321 11324 1 9 . 1 1 93 93 LEU N N 93 123.560 123.560 122.962 0.598 18321 11325 1 9 . 1 1 93 93 LEU HA H 93 4.104 4.104 4.072 0.032 18321 11326 1 9 . 1 1 93 93 LEU C C 93 175.610 175.610 177.053 -1.443 18321 11327 1 9 . 1 1 93 93 LEU CA C 93 56.381 56.381 57.442 -1.061 18321 11328 1 9 . 1 1 93 93 LEU CB C 93 38.896 38.896 42.220 -3.324 18321 11329 1 9 . 1 1 93 93 LEU H H 93 7.907 7.907 8.085 -0.178 18321 11330 1 9 . 1 1 94 94 ASP N N 94 118.194 118.194 115.047 3.147 18321 11331 1 9 . 1 1 94 94 ASP HA H 94 4.940 4.940 4.821 0.119 18321 11332 1 9 . 1 1 94 94 ASP C C 94 176.123 176.123 175.515 0.608 18321 11333 1 9 . 1 1 94 94 ASP CA C 94 56.235 56.235 53.818 2.417 18321 11334 1 9 . 1 1 94 94 ASP CB C 94 42.078 42.078 41.942 0.136 18321 11335 1 9 . 1 1 94 94 ASP H H 94 8.640 8.640 7.634 1.006 18321 11336 1 9 . 1 1 95 95 THR N N 95 105.073 105.073 116.174 -11.101 18321 11337 1 9 . 1 1 95 95 THR HA H 95 4.318 4.318 3.968 0.350 18321 11338 1 9 . 1 1 95 95 THR C C 95 174.685 174.685 173.572 1.113 18321 11339 1 9 . 1 1 95 95 THR CA C 95 60.756 60.756 64.004 -3.248 18321 11340 1 9 . 1 1 95 95 THR CB C 95 71.058 71.058 68.648 2.410 18321 11341 1 9 . 1 1 95 95 THR H H 95 8.576 8.576 8.534 0.042 18321 11342 1 9 . 1 1 96 96 THR N N 96 116.817 116.817 111.447 5.370 18321 11343 1 9 . 1 1 96 96 THR HA H 96 5.129 5.129 4.765 0.364 18321 11344 1 9 . 1 1 96 96 THR C C 96 172.464 172.464 172.678 -0.214 18321 11345 1 9 . 1 1 96 96 THR CA C 96 60.762 60.762 60.538 0.224 18321 11346 1 9 . 1 1 96 96 THR CB C 96 71.425 71.425 70.241 1.184 18321 11347 1 9 . 1 1 96 96 THR H H 96 8.205 8.205 7.649 0.556 18321 11348 1 9 . 1 1 97 97 THR N N 97 114.324 114.324 114.156 0.168 18321 11349 1 9 . 1 1 97 97 THR HA H 97 5.128 5.128 4.763 0.365 18321 11350 1 9 . 1 1 97 97 THR C C 97 175.480 175.480 174.447 1.033 18321 11351 1 9 . 1 1 97 97 THR CA C 97 60.233 60.233 59.203 1.030 18321 11352 1 9 . 1 1 97 97 THR CB C 97 70.415 70.415 70.817 -0.402 18321 11353 1 9 . 1 1 97 97 THR H H 97 7.128 7.128 8.350 -1.222 18321 11354 1 9 . 1 1 98 98 LEU N N 98 116.674 116.674 121.549 -4.875 18321 11355 1 9 . 1 1 98 98 LEU HA H 98 4.075 4.075 3.925 0.150 18321 11356 1 9 . 1 1 98 98 LEU C C 98 177.892 177.892 176.436 1.456 18321 11357 1 9 . 1 1 98 98 LEU CA C 98 59.597 59.597 55.858 3.739 18321 11358 1 9 . 1 1 98 98 LEU CB C 98 41.172 41.172 40.498 0.674 18321 11359 1 9 . 1 1 98 98 LEU H H 98 8.743 8.743 7.941 0.802 18321 11360 1 9 . 1 1 99 99 ILE N N 99 122.988 122.988 122.841 0.147 18321 11361 1 9 . 1 1 99 99 ILE HA H 99 4.415 4.415 4.393 0.022 18321 11362 1 9 . 1 1 99 99 ILE C C 99 175.055 175.055 175.643 -0.588 18321 11363 1 9 . 1 1 99 99 ILE CA C 99 62.183 62.183 61.417 0.766 18321 11364 1 9 . 1 1 99 99 ILE CB C 99 40.252 40.252 39.456 0.796 18321 11365 1 9 . 1 1 99 99 ILE H H 99 8.998 8.998 8.116 0.882 18321 11366 1 9 . 1 1 100 100 GLU N N 100 114.067 114.067 115.625 -1.558 18321 11367 1 9 . 1 1 100 100 GLU CA C 100 52.910 52.910 53.409 -0.499 18321 11368 1 9 . 1 1 100 100 GLU CB C 100 31.155 31.155 30.842 0.313 18321 11369 1 9 . 1 1 100 100 GLU H H 100 7.332 7.332 7.889 -0.557 18321 11370 1 9 . 1 1 101 101 PRO HA H 101 4.952 4.952 4.492 0.460 18321 11371 1 9 . 1 1 101 101 PRO C C 101 175.976 175.976 175.954 0.022 18321 11372 1 9 . 1 1 101 101 PRO CA C 101 53.312 53.312 61.369 -8.057 18321 11373 1 9 . 1 1 101 101 PRO CB C 101 31.598 31.598 32.493 -0.895 18321 11374 1 9 . 1 1 102 102 ALA N N 102 125.968 125.968 123.088 2.880 18321 11375 1 9 . 1 1 102 102 ALA HA H 102 4.516 4.516 4.556 -0.040 18321 11376 1 9 . 1 1 102 102 ALA CA C 102 49.852 49.852 49.952 -0.100 18321 11377 1 9 . 1 1 102 102 ALA CB C 102 17.766 17.766 18.296 -0.529 18321 11378 1 9 . 1 1 102 102 ALA H H 102 8.232 8.232 7.826 0.406 18321 11379 1 9 . 1 1 103 103 PRO HA H 103 4.283 4.283 4.542 -0.259 18321 11380 1 9 . 1 1 103 103 PRO CA C 103 62.435 62.435 62.306 0.129 18321 11381 1 9 . 1 1 103 103 PRO CB C 103 32.145 32.145 32.432 -0.287 18321 11382 1 9 . 1 1 104 104 ARG HA H 104 4.004 4.004 4.421 -0.417 18321 11383 1 9 . 1 1 104 104 ARG CA C 104 56.660 56.660 56.008 0.652 18321 11384 1 9 . 1 1 106 106 PRO C C 106 174.587 174.587 175.904 -1.317 18321 11385 1 9 . 1 1 106 106 PRO CA C 106 57.867 57.867 61.902 -4.035 18321 11386 1 9 . 1 1 106 106 PRO CB C 106 31.942 31.942 33.097 -1.155 18321 11387 1 9 . 1 1 107 107 SER N N 107 121.280 121.280 114.851 6.429 18321 11388 1 9 . 1 1 107 107 SER CA C 107 61.772 61.772 58.837 2.935 18321 11389 1 9 . 1 1 107 107 SER CB C 107 63.234 63.234 62.671 0.563 18321 11390 1 9 . 1 1 107 107 SER H H 107 8.132 8.132 9.376 -1.244 18321 11391 1 9 . 1 1 109 109 PRO C C 109 177.129 177.129 176.317 0.812 18321 11392 1 9 . 1 1 109 109 PRO CA C 109 62.638 62.638 64.262 -1.624 18321 11393 1 9 . 1 1 109 109 PRO CB C 109 30.970 30.970 32.387 -1.417 18321 11394 1 9 . 1 1 110 110 MET N N 110 120.772 120.772 114.004 6.768 18321 11395 1 9 . 1 1 110 110 MET C C 110 176.892 176.892 174.018 2.874 18321 11396 1 9 . 1 1 110 110 MET CA C 110 55.310 55.310 55.187 0.123 18321 11397 1 9 . 1 1 110 110 MET CB C 110 32.202 32.202 34.962 -2.760 18321 11398 1 9 . 1 1 110 110 MET H H 110 8.430 8.430 7.742 0.688 18321 11399 1 9 . 1 1 111 111 GLY N N 111 110.158 110.158 109.877 0.281 18321 11400 1 9 . 1 1 111 111 GLY C C 111 177.430 177.430 173.479 3.951 18321 11401 1 9 . 1 1 111 111 GLY CA C 111 44.951 44.951 44.913 0.038 18321 11402 1 9 . 1 1 111 111 GLY H H 111 8.384 8.384 8.387 -0.003 18321 11403 1 9 . 1 1 112 112 SER N N 112 116.762 116.762 116.956 -0.194 18321 11404 1 9 . 1 1 112 112 SER CA C 112 55.948 55.948 57.092 -1.144 18321 11405 1 9 . 1 1 112 112 SER CB C 112 62.745 62.745 63.968 -1.223 18321 11406 1 9 . 1 1 112 112 SER H H 112 8.161 8.161 7.961 0.200 18321 11407 1 9 . 1 1 113 113 VAL C C 113 176.083 176.083 175.468 0.615 18321 11408 1 9 . 1 1 114 114 SER N N 114 119.151 119.151 115.261 3.890 18321 11409 1 9 . 1 1 114 114 SER C C 114 173.638 173.638 173.243 0.395 18321 11410 1 9 . 1 1 114 114 SER CA C 114 58.005 58.005 58.670 -0.665 18321 11411 1 9 . 1 1 114 114 SER CB C 114 63.169 63.169 63.405 -0.236 18321 11412 1 9 . 1 1 114 114 SER H H 114 8.319 8.319 8.047 0.272 18321 11413 1 9 . 1 1 115 115 ALA N N 115 126.914 126.914 122.745 4.169 18321 11414 1 9 . 1 1 115 115 ALA CA C 115 51.561 51.561 52.027 -0.466 18321 11415 1 9 . 1 1 115 115 ALA CB C 115 17.714 17.714 17.932 -0.218 18321 11416 1 9 . 1 1 115 115 ALA H H 115 8.197 8.197 8.314 -0.117 18321 11417 1 9 . 1 1 119 119 PRO C C 119 177.065 177.065 176.360 0.705 18321 11418 1 9 . 1 1 120 120 THR N N 120 113.976 113.976 117.981 -4.005 18321 11419 1 9 . 1 1 120 120 THR C C 120 174.461 174.461 175.778 -1.317 18321 11420 1 9 . 1 1 120 120 THR CA C 120 61.215 61.215 64.078 -2.863 18321 11421 1 9 . 1 1 120 120 THR CB C 120 69.508 69.508 69.262 0.246 18321 11422 1 9 . 1 1 120 120 THR H H 120 8.138 8.138 8.656 -0.518 18321 11423 1 9 . 1 1 121 121 ALA N N 121 125.859 125.859 123.701 2.158 18321 11424 1 9 . 1 1 121 121 ALA CA C 121 52.281 52.281 54.554 -2.273 18321 11425 1 9 . 1 1 121 121 ALA CB C 121 18.623 18.623 17.116 1.506 18321 11426 1 9 . 1 1 121 121 ALA H H 121 8.272 8.272 8.541 -0.269 18321 11427 1 9 . 1 1 122 122 GLU C C 122 176.316 176.316 176.143 0.173 18321 11428 1 9 . 1 1 123 123 ASP N N 123 120.448 120.448 119.858 0.590 18321 11429 1 9 . 1 1 123 123 ASP C C 123 175.906 175.906 175.007 0.899 18321 11430 1 9 . 1 1 123 123 ASP CA C 123 54.167 54.167 57.131 -2.964 18321 11431 1 9 . 1 1 123 123 ASP CB C 123 40.695 40.695 41.916 -1.220 18321 11432 1 9 . 1 1 123 123 ASP H H 123 8.181 8.181 8.089 0.092 18321 11433 1 9 . 1 1 124 124 ASN N N 124 118.207 118.207 114.227 3.980 18321 11434 1 9 . 1 1 124 124 ASN C C 124 174.851 174.851 174.169 0.682 18321 11435 1 9 . 1 1 124 124 ASN CA C 124 52.771 52.771 52.807 -0.036 18321 11436 1 9 . 1 1 124 124 ASN CB C 124 38.304 38.304 40.242 -1.938 18321 11437 1 9 . 1 1 124 124 ASN H H 124 8.307 8.307 8.297 0.010 18321 11438 1 9 . 1 1 125 125 LEU N N 125 121.311 121.311 119.940 1.371 18321 11439 1 9 . 1 1 125 125 LEU C C 125 175.750 175.750 176.270 -0.520 18321 11440 1 9 . 1 1 125 125 LEU CA C 125 54.428 54.428 55.642 -1.214 18321 11441 1 9 . 1 1 125 125 LEU CB C 125 41.350 41.350 40.394 0.956 18321 11442 1 9 . 1 1 125 125 LEU H H 125 7.747 7.747 8.625 -0.878 18321 11443 1 9 . 1 1 126 126 GLU N N 126 122.485 122.485 119.448 3.037 18321 11444 1 9 . 1 1 126 126 GLU C C 126 174.008 174.008 174.512 -0.504 18321 11445 1 9 . 1 1 126 126 GLU CA C 126 54.855 54.855 57.301 -2.446 18321 11446 1 9 . 1 1 126 126 GLU CB C 126 30.472 30.472 31.040 -0.568 18321 11447 1 9 . 1 1 126 126 GLU H H 126 8.453 8.453 8.252 0.201 18321 11448 1 9 . 1 1 127 127 TYR N N 127 122.713 122.713 118.976 3.737 18321 11449 1 9 . 1 1 127 127 TYR C C 127 176.859 176.859 174.624 2.235 18321 11450 1 9 . 1 1 127 127 TYR CA C 127 56.528 56.528 57.647 -1.119 18321 11451 1 9 . 1 1 127 127 TYR CB C 127 40.982 40.982 41.355 -0.374 18321 11452 1 9 . 1 1 127 127 TYR H H 127 8.469 8.469 7.962 0.507 18321 11453 1 9 . 1 1 128 128 VAL N N 128 112.432 112.432 122.439 -10.007 18321 11454 1 9 . 1 1 128 128 VAL C C 128 173.150 173.150 174.400 -1.250 18321 11455 1 9 . 1 1 128 128 VAL CA C 128 57.940 57.940 60.498 -2.558 18321 11456 1 9 . 1 1 128 128 VAL CB C 128 34.935 34.935 37.280 -2.345 18321 11457 1 9 . 1 1 128 128 VAL H H 128 9.078 9.078 8.465 0.613 18321 11458 1 9 . 1 1 129 129 ARG N N 129 120.373 120.373 121.061 -0.688 18321 11459 1 9 . 1 1 129 129 ARG C C 129 176.539 176.539 175.461 1.078 18321 11460 1 9 . 1 1 129 129 ARG CA C 129 52.534 52.534 54.255 -1.720 18321 11461 1 9 . 1 1 129 129 ARG CB C 129 32.942 32.942 33.298 -0.356 18321 11462 1 9 . 1 1 129 129 ARG H H 129 9.010 9.010 9.397 -0.387 18321 11463 1 9 . 1 1 130 130 THR N N 130 116.637 116.637 114.486 2.151 18321 11464 1 9 . 1 1 130 130 THR CA C 130 60.618 60.618 61.344 -0.726 18321 11465 1 9 . 1 1 130 130 THR CB C 130 69.170 69.170 70.461 -1.291 18321 11466 1 9 . 1 1 130 130 THR H H 130 9.045 9.045 8.413 0.632 18321 11467 1 9 . 1 1 131 131 LEU N N 131 122.910 122.910 123.433 -0.523 18321 11468 1 9 . 1 1 131 131 LEU C C 131 175.269 175.269 177.955 -2.686 18321 11469 1 9 . 1 1 131 131 LEU CA C 131 55.122 55.122 56.216 -1.094 18321 11470 1 9 . 1 1 131 131 LEU CB C 131 43.108 43.108 42.633 0.475 18321 11471 1 9 . 1 1 131 131 LEU H H 131 9.224 9.224 8.762 0.462 18321 11472 1 9 . 1 1 132 132 TYR N N 132 112.885 112.885 118.340 -5.455 18321 11473 1 9 . 1 1 132 132 TYR C C 132 173.818 173.818 175.404 -1.586 18321 11474 1 9 . 1 1 132 132 TYR CA C 132 54.230 54.230 59.528 -5.298 18321 11475 1 9 . 1 1 132 132 TYR CB C 132 42.672 42.672 39.856 2.816 18321 11476 1 9 . 1 1 132 132 TYR H H 132 7.284 7.284 7.747 -0.463 18321 11477 1 9 . 1 1 133 133 ASP N N 133 118.003 118.003 116.510 1.493 18321 11478 1 9 . 1 1 133 133 ASP C C 133 175.779 175.779 174.137 1.642 18321 11479 1 9 . 1 1 133 133 ASP CA C 133 54.351 54.351 55.273 -0.922 18321 11480 1 9 . 1 1 133 133 ASP CB C 133 41.241 41.241 40.270 0.971 18321 11481 1 9 . 1 1 133 133 ASP H H 133 8.399 8.399 8.464 -0.065 18321 11482 1 9 . 1 1 134 134 PHE N N 134 121.081 121.081 122.017 -0.936 18321 11483 1 9 . 1 1 134 134 PHE CA C 134 52.552 52.552 55.755 -3.203 18321 11484 1 9 . 1 1 134 134 PHE CB C 134 41.217 41.217 42.798 -1.581 18321 11485 1 9 . 1 1 134 134 PHE H H 134 8.797 8.797 7.848 0.949 18321 11486 1 9 . 1 1 136 136 GLY C C 136 171.616 171.616 174.525 -2.909 18321 11487 1 9 . 1 1 137 137 ASN N N 137 119.394 119.394 117.467 1.927 18321 11488 1 9 . 1 1 137 137 ASN C C 137 174.500 174.500 173.476 1.024 18321 11489 1 9 . 1 1 137 137 ASN CA C 137 44.670 44.670 54.566 -9.896 18321 11490 1 9 . 1 1 137 137 ASN H H 137 9.477 9.477 8.241 1.236 18321 11491 1 9 . 1 1 138 138 ASP N N 138 120.608 120.608 117.575 3.033 18321 11492 1 9 . 1 1 138 138 ASP C C 138 176.987 176.987 174.345 2.642 18321 11493 1 9 . 1 1 138 138 ASP CA C 138 52.992 52.992 52.939 0.053 18321 11494 1 9 . 1 1 138 138 ASP H H 138 8.216 8.216 8.109 0.107 18321 11495 1 9 . 1 1 139 139 ALA N N 139 124.371 124.371 121.331 3.040 18321 11496 1 9 . 1 1 139 139 ALA C C 139 178.472 178.472 178.313 0.159 18321 11497 1 9 . 1 1 139 139 ALA CA C 139 54.513 54.513 53.237 1.276 18321 11498 1 9 . 1 1 139 139 ALA CB C 139 18.045 18.045 19.850 -1.805 18321 11499 1 9 . 1 1 139 139 ALA H H 139 8.565 8.565 8.566 -0.001 18321 11500 1 9 . 1 1 140 140 GLU N N 140 115.022 115.022 116.167 -1.145 18321 11501 1 9 . 1 1 140 140 GLU C C 140 177.027 177.027 175.415 1.612 18321 11502 1 9 . 1 1 140 140 GLU CA C 140 56.181 56.181 56.381 -0.200 18321 11503 1 9 . 1 1 140 140 GLU CB C 140 28.619 28.619 31.058 -2.438 18321 11504 1 9 . 1 1 140 140 GLU H H 140 8.616 8.616 8.204 0.412 18321 11505 1 9 . 1 1 141 141 ASP N N 141 121.913 121.913 120.937 0.976 18321 11506 1 9 . 1 1 141 141 ASP C C 141 175.923 175.923 174.303 1.620 18321 11507 1 9 . 1 1 141 141 ASP CA C 141 54.736 54.736 53.786 0.950 18321 11508 1 9 . 1 1 141 141 ASP CB C 141 41.305 41.305 43.463 -2.158 18321 11509 1 9 . 1 1 141 141 ASP H H 141 7.636 7.636 7.849 -0.213 18321 11510 1 9 . 1 1 142 142 LEU N N 142 127.651 127.651 125.742 1.909 18321 11511 1 9 . 1 1 142 142 LEU CA C 142 50.955 50.955 52.285 -1.330 18321 11512 1 9 . 1 1 142 142 LEU CB C 142 42.343 42.343 43.859 -1.516 18321 11513 1 9 . 1 1 142 142 LEU H H 142 9.479 9.479 7.969 1.510 18321 11514 1 9 . 1 1 143 143 PRO C C 143 177.924 177.924 175.555 2.369 18321 11515 1 9 . 1 1 144 144 PHE N N 144 114.483 114.483 117.499 -3.016 18321 11516 1 9 . 1 1 144 144 PHE C C 144 175.055 175.055 175.200 -0.145 18321 11517 1 9 . 1 1 144 144 PHE CA C 144 55.543 55.543 55.450 0.093 18321 11518 1 9 . 1 1 144 144 PHE CB C 144 40.581 40.581 40.416 0.165 18321 11519 1 9 . 1 1 144 144 PHE H H 144 8.637 8.637 7.612 1.025 18321 11520 1 9 . 1 1 145 145 LYS N N 145 121.342 121.342 119.507 1.835 18321 11521 1 9 . 1 1 145 145 LYS C C 145 176.925 176.925 177.048 -0.123 18321 11522 1 9 . 1 1 145 145 LYS CA C 145 53.043 53.043 54.670 -1.627 18321 11523 1 9 . 1 1 145 145 LYS CB C 145 33.804 33.804 35.906 -2.102 18321 11524 1 9 . 1 1 145 145 LYS H H 145 9.418 9.418 8.229 1.189 18321 11525 1 9 . 1 1 146 146 LYS N N 146 123.378 123.378 119.309 4.069 18321 11526 1 9 . 1 1 146 146 LYS CA C 146 57.883 57.883 56.788 1.095 18321 11527 1 9 . 1 1 146 146 LYS CB C 146 32.008 32.008 31.150 0.858 18321 11528 1 9 . 1 1 146 146 LYS H H 146 9.002 9.002 8.690 0.312 18321 11529 1 9 . 1 1 147 147 GLY C C 147 174.315 174.315 172.798 1.517 18321 11530 1 9 . 1 1 148 148 GLU N N 148 121.392 121.392 119.024 2.368 18321 11531 1 9 . 1 1 148 148 GLU C C 148 174.998 174.998 174.914 0.084 18321 11532 1 9 . 1 1 148 148 GLU CA C 148 56.867 56.867 54.062 2.805 18321 11533 1 9 . 1 1 148 148 GLU CB C 148 31.649 31.649 32.099 -0.450 18321 11534 1 9 . 1 1 148 148 GLU H H 148 7.937 7.937 7.685 0.252 18321 11535 1 9 . 1 1 149 149 ILE N N 149 120.124 120.124 120.300 -0.176 18321 11536 1 9 . 1 1 149 149 ILE C C 149 176.647 176.647 175.429 1.218 18321 11537 1 9 . 1 1 149 149 ILE CA C 149 58.621 58.621 59.579 -0.958 18321 11538 1 9 . 1 1 149 149 ILE CB C 149 36.952 36.952 37.784 -0.832 18321 11539 1 9 . 1 1 149 149 ILE H H 149 8.346 8.346 8.563 -0.217 18321 11540 1 9 . 1 1 150 150 LEU N N 150 126.950 126.950 124.915 2.035 18321 11541 1 9 . 1 1 150 150 LEU CA C 150 51.967 51.967 52.500 -0.533 18321 11542 1 9 . 1 1 150 150 LEU CB C 150 44.182 44.182 45.431 -1.250 18321 11543 1 9 . 1 1 150 150 LEU H H 150 8.988 8.988 9.148 -0.160 18321 11544 1 9 . 1 1 151 151 VAL C C 151 175.670 175.670 175.247 0.423 18321 11545 1 9 . 1 1 152 152 ILE N N 152 124.997 124.997 128.162 -3.165 18321 11546 1 9 . 1 1 152 152 ILE CA C 152 58.331 58.331 59.376 -1.045 18321 11547 1 9 . 1 1 152 152 ILE CB C 152 34.093 34.093 34.633 -0.540 18321 11548 1 9 . 1 1 152 152 ILE H H 152 8.673 8.673 8.663 0.010 18321 11549 1 9 . 1 1 153 153 ILE N N 153 124.710 124.710 127.292 -2.582 18321 11550 1 9 . 1 1 153 153 ILE C C 153 176.264 176.264 175.537 0.727 18321 11551 1 9 . 1 1 154 154 GLU N N 154 117.398 117.398 117.684 -0.286 18321 11552 1 9 . 1 1 154 154 GLU C C 154 173.959 173.959 174.843 -0.884 18321 11553 1 9 . 1 1 154 154 GLU CA C 154 55.289 55.289 54.733 0.556 18321 11554 1 9 . 1 1 154 154 GLU CB C 154 32.842 32.842 32.361 0.481 18321 11555 1 9 . 1 1 154 154 GLU H H 154 7.818 7.818 8.317 -0.499 18321 11556 1 9 . 1 1 155 155 LYS N N 155 121.130 121.130 124.409 -3.279 18321 11557 1 9 . 1 1 155 155 LYS CA C 155 53.022 53.022 52.550 0.472 18321 11558 1 9 . 1 1 155 155 LYS CB C 155 32.663 32.663 32.919 -0.257 18321 11559 1 9 . 1 1 155 155 LYS H H 155 8.654 8.654 8.414 0.240 18321 11560 1 9 . 1 1 157 157 GLU C C 157 175.190 175.190 176.029 -0.839 18321 11561 1 9 . 1 1 157 157 GLU CA C 157 53.785 53.785 54.393 -0.608 18321 11562 1 9 . 1 1 157 157 GLU CB C 157 32.685 32.685 31.993 0.692 18321 11563 1 9 . 1 1 158 158 GLU N N 158 117.425 117.425 119.198 -1.773 18321 11564 1 9 . 1 1 158 158 GLU C C 158 178.600 178.600 178.251 0.349 18321 11565 1 9 . 1 1 158 158 GLU CA C 158 59.044 59.044 58.187 0.857 18321 11566 1 9 . 1 1 158 158 GLU CB C 158 29.706 29.706 30.326 -0.620 18321 11567 1 9 . 1 1 158 158 GLU H H 158 8.678 8.678 8.809 -0.131 18321 11568 1 9 . 1 1 159 159 GLN N N 159 110.925 110.925 117.609 -6.684 18321 11569 1 9 . 1 1 159 159 GLN C C 159 175.539 175.539 175.285 0.254 18321 11570 1 9 . 1 1 159 159 GLN CA C 159 54.942 54.942 57.139 -2.197 18321 11571 1 9 . 1 1 159 159 GLN CB C 159 28.572 28.572 29.633 -1.061 18321 11572 1 9 . 1 1 159 159 GLN H H 159 8.483 8.483 8.332 0.151 18321 11573 1 9 . 1 1 160 160 TRP N N 160 120.171 120.171 119.395 0.776 18321 11574 1 9 . 1 1 160 160 TRP C C 160 173.444 173.444 174.598 -1.154 18321 11575 1 9 . 1 1 160 160 TRP CA C 160 56.175 56.175 56.146 0.029 18321 11576 1 9 . 1 1 160 160 TRP CB C 160 31.796 31.796 32.142 -0.347 18321 11577 1 9 . 1 1 160 160 TRP H H 160 6.826 6.826 7.755 -0.929 18321 11578 1 9 . 1 1 161 161 TRP N N 161 120.687 120.687 122.231 -1.544 18321 11579 1 9 . 1 1 161 161 TRP C C 161 174.736 174.736 175.837 -1.101 18321 11580 1 9 . 1 1 161 161 TRP CA C 161 51.889 51.889 54.129 -2.240 18321 11581 1 9 . 1 1 161 161 TRP CB C 161 32.772 32.772 31.542 1.230 18321 11582 1 9 . 1 1 161 161 TRP H H 161 8.462 8.462 8.982 -0.520 18321 11583 1 9 . 1 1 162 162 SER N N 162 115.691 115.691 120.556 -4.865 18321 11584 1 9 . 1 1 162 162 SER C C 162 174.320 174.320 173.682 0.638 18321 11585 1 9 . 1 1 162 162 SER CA C 162 57.011 57.011 58.687 -1.675 18321 11586 1 9 . 1 1 162 162 SER CB C 162 63.948 63.948 62.870 1.078 18321 11587 1 9 . 1 1 162 162 SER H H 162 8.830 8.830 8.923 -0.093 18321 11588 1 9 . 1 1 163 163 ALA N N 163 130.630 130.630 128.600 2.030 18321 11589 1 9 . 1 1 163 163 ALA CA C 163 50.029 50.029 49.872 0.157 18321 11590 1 9 . 1 1 163 163 ALA CB C 163 25.500 25.500 22.259 3.241 18321 11591 1 9 . 1 1 163 163 ALA H H 163 9.585 9.585 8.869 0.716 18321 11592 1 9 . 1 1 164 164 ARG N N 164 117.526 117.526 120.377 -2.851 18321 11593 1 9 . 1 1 164 164 ARG C C 164 176.719 176.719 176.568 0.151 18321 11594 1 9 . 1 1 164 164 ARG CA C 164 52.975 52.975 53.634 -0.659 18321 11595 1 9 . 1 1 164 164 ARG CB C 164 34.260 34.260 31.863 2.397 18321 11596 1 9 . 1 1 164 164 ARG H H 164 9.097 9.097 8.707 0.390 18321 11597 1 9 . 1 1 165 165 ASN N N 165 123.935 123.935 122.421 1.514 18321 11598 1 9 . 1 1 165 165 ASN C C 165 178.484 178.484 177.346 1.138 18321 11599 1 9 . 1 1 165 165 ASN CA C 165 50.332 50.332 52.681 -2.349 18321 11600 1 9 . 1 1 165 165 ASN CB C 165 39.487 39.487 39.441 0.046 18321 11601 1 9 . 1 1 165 165 ASN H H 165 8.756 8.756 8.946 -0.190 18321 11602 1 9 . 1 1 166 166 LYS N N 166 118.464 118.464 119.016 -0.552 18321 11603 1 9 . 1 1 166 166 LYS C C 166 176.967 176.967 177.773 -0.806 18321 11604 1 9 . 1 1 166 166 LYS CA C 166 58.430 58.430 59.401 -0.972 18321 11605 1 9 . 1 1 166 166 LYS CB C 166 30.918 30.918 32.421 -1.503 18321 11606 1 9 . 1 1 166 166 LYS H H 166 8.915 8.915 8.905 0.010 18321 11607 1 9 . 1 1 167 167 ASP N N 167 118.138 118.138 113.856 4.282 18321 11608 1 9 . 1 1 167 167 ASP C C 167 176.464 176.464 176.983 -0.519 18321 11609 1 9 . 1 1 167 167 ASP CA C 167 54.212 54.212 53.681 0.531 18321 11610 1 9 . 1 1 167 167 ASP CB C 167 41.178 41.178 39.995 1.183 18321 11611 1 9 . 1 1 167 167 ASP H H 167 7.508 7.508 7.943 -0.435 18321 11612 1 9 . 1 1 168 168 GLY N N 168 107.901 107.901 108.265 -0.364 18321 11613 1 9 . 1 1 168 168 GLY C C 168 173.613 173.613 174.128 -0.515 18321 11614 1 9 . 1 1 168 168 GLY CA C 168 44.783 44.783 44.938 -0.155 18321 11615 1 9 . 1 1 168 168 GLY H H 168 8.173 8.173 8.070 0.103 18321 11616 1 9 . 1 1 169 169 ARG N N 169 124.324 124.324 121.644 2.680 18321 11617 1 9 . 1 1 169 169 ARG CA C 169 56.106 56.106 56.419 -0.313 18321 11618 1 9 . 1 1 169 169 ARG CB C 169 29.648 29.648 31.330 -1.682 18321 11619 1 9 . 1 1 169 169 ARG H H 169 7.998 7.998 7.989 0.009 18321 11620 1 9 . 1 1 170 170 VAL C C 170 177.590 177.590 175.369 2.221 18321 11621 1 9 . 1 1 171 171 GLY N N 171 112.582 112.582 111.387 1.195 18321 11622 1 9 . 1 1 171 171 GLY C C 171 170.991 170.991 172.472 -1.481 18321 11623 1 9 . 1 1 171 171 GLY CA C 171 45.361 45.361 45.070 0.291 18321 11624 1 9 . 1 1 171 171 GLY H H 171 9.013 9.013 8.645 0.368 18321 11625 1 9 . 1 1 172 172 MET N N 172 117.368 117.368 121.073 -3.705 18321 11626 1 9 . 1 1 172 172 MET C C 172 177.921 177.921 176.546 1.375 18321 11627 1 9 . 1 1 172 172 MET CA C 172 53.536 53.536 54.780 -1.244 18321 11628 1 9 . 1 1 172 172 MET CB C 172 30.838 30.838 32.526 -1.688 18321 11629 1 9 . 1 1 172 172 MET H H 172 8.885 8.885 8.279 0.606 18321 11630 1 9 . 1 1 173 173 ILE N N 173 113.130 113.130 120.113 -6.983 18321 11631 1 9 . 1 1 173 173 ILE CA C 173 56.284 56.284 57.678 -1.394 18321 11632 1 9 . 1 1 173 173 ILE CB C 173 40.870 40.870 40.527 0.343 18321 11633 1 9 . 1 1 173 173 ILE H H 173 9.704 9.704 9.328 0.376 18321 11634 1 9 . 1 1 174 174 PRO C C 174 176.714 176.714 177.264 -0.550 18321 11635 1 9 . 1 1 174 174 PRO CA C 174 66.290 66.290 61.507 4.784 18321 11636 1 9 . 1 1 174 174 PRO CB C 174 28.993 28.993 30.682 -1.689 18321 11637 1 9 . 1 1 175 175 VAL N N 175 128.066 128.066 124.524 3.542 18321 11638 1 9 . 1 1 175 175 VAL CA C 175 59.356 59.356 66.331 -6.975 18321 11639 1 9 . 1 1 175 175 VAL H H 175 7.327 7.327 7.625 -0.298 18321 11640 1 9 . 1 1 176 176 PRO C C 176 176.351 176.351 176.846 -0.495 18321 11641 1 9 . 1 1 177 177 TYR N N 177 115.756 115.756 115.638 0.118 18321 11642 1 9 . 1 1 177 177 TYR C C 177 175.011 175.011 175.307 -0.296 18321 11643 1 9 . 1 1 177 177 TYR CA C 177 56.756 56.756 57.141 -0.385 18321 11644 1 9 . 1 1 177 177 TYR CB C 177 37.507 37.507 39.030 -1.523 18321 11645 1 9 . 1 1 177 177 TYR H H 177 7.784 7.784 7.565 0.219 18321 11646 1 9 . 1 1 178 178 VAL N N 178 111.428 111.428 113.201 -1.773 18321 11647 1 9 . 1 1 178 178 VAL C C 178 173.417 173.417 175.162 -1.745 18321 11648 1 9 . 1 1 178 178 VAL CA C 178 58.307 58.307 58.798 -0.491 18321 11649 1 9 . 1 1 178 178 VAL CB C 178 34.602 34.602 34.954 -0.352 18321 11650 1 9 . 1 1 178 178 VAL H H 178 7.801 7.801 7.467 0.334 18321 11651 1 9 . 1 1 179 179 GLU N N 179 118.581 118.581 118.387 0.194 18321 11652 1 9 . 1 1 179 179 GLU C C 179 175.225 175.225 175.155 0.070 18321 11653 1 9 . 1 1 179 179 GLU CA C 179 53.114 53.114 53.821 -0.707 18321 11654 1 9 . 1 1 179 179 GLU CB C 179 32.712 32.712 34.417 -1.705 18321 11655 1 9 . 1 1 179 179 GLU H H 179 8.819 8.819 8.984 -0.165 18321 11656 1 9 . 1 1 180 180 LYS N N 180 124.167 124.167 120.097 4.070 18321 11657 1 9 . 1 1 180 180 LYS C C 180 176.303 176.303 176.247 0.056 18321 11658 1 9 . 1 1 180 180 LYS CA C 180 57.318 57.318 55.518 1.800 18321 11659 1 9 . 1 1 180 180 LYS CB C 180 31.675 31.675 32.884 -1.209 18321 11660 1 9 . 1 1 180 180 LYS H H 180 8.775 8.775 8.597 0.178 18321 11661 1 9 . 1 1 181 181 LEU N N 181 125.157 125.157 124.603 0.554 18321 11662 1 9 . 1 1 181 181 LEU C C 181 176.462 176.462 177.761 -1.299 18321 11663 1 9 . 1 1 181 181 LEU CA C 181 54.470 54.470 57.065 -2.595 18321 11664 1 9 . 1 1 181 181 LEU CB C 181 41.625 41.625 42.776 -1.151 18321 11665 1 9 . 1 1 181 181 LEU H H 181 8.084 8.084 8.484 -0.400 18321 11666 1 9 . 1 1 182 182 VAL N N 182 123.167 123.167 114.723 8.444 18321 11667 1 9 . 1 1 182 182 VAL C C 182 175.983 175.983 175.029 0.954 18321 11668 1 9 . 1 1 182 182 VAL CA C 182 61.613 61.613 61.560 0.053 18321 11669 1 9 . 1 1 182 182 VAL CB C 182 32.085 32.085 29.501 2.584 18321 11670 1 9 . 1 1 182 182 VAL H H 182 8.345 8.345 8.176 0.169 18321 11671 1 9 . 1 1 183 183 ARG N N 183 125.775 125.775 122.959 2.816 18321 11672 1 9 . 1 1 183 183 ARG CA C 183 57.801 57.801 55.568 2.233 18321 11673 1 9 . 1 1 183 183 ARG CB C 183 30.091 30.091 29.985 0.106 18321 11674 1 9 . 1 1 183 183 ARG H H 183 8.530 8.530 7.631 0.899 18321 11675 1 9 . 1 1 184 184 SER C C 184 173.239 173.239 174.294 -1.055 18321 11676 1 9 . 1 1 185 185 SER N N 185 116.511 116.511 122.492 -5.981 18321 11677 1 9 . 1 1 185 185 SER CA C 185 58.428 58.428 55.693 2.735 18321 11678 1 9 . 1 1 185 185 SER CB C 185 69.737 69.737 62.989 6.748 18321 11679 1 9 . 1 1 185 185 SER H H 185 7.944 7.944 8.357 -0.413 18321 11680 1 9 . 1 1 190 190 HIS C C 190 176.953 176.953 175.322 1.631 18321 11681 1 9 . 1 1 190 190 HIS CA C 190 54.229 54.229 56.650 -2.421 18321 11682 1 9 . 1 1 190 190 HIS CB C 190 35.112 35.112 29.189 5.923 18321 11683 1 9 . 1 1 191 191 GLY N N 191 109.491 109.491 105.520 3.971 18321 11684 1 9 . 1 1 191 191 GLY C C 191 172.295 172.295 173.495 -1.200 18321 11685 1 9 . 1 1 191 191 GLY CA C 191 45.227 45.227 44.616 0.611 18321 11686 1 9 . 1 1 191 191 GLY H H 191 8.719 8.719 7.639 1.080 18321 11687 1 9 . 1 1 192 192 ASN N N 192 118.700 118.700 118.257 0.443 18321 11688 1 9 . 1 1 192 192 ASN HA H 192 4.312 4.312 4.456 -0.144 18321 11689 1 9 . 1 1 192 192 ASN C C 192 176.369 176.369 175.771 0.598 18321 11690 1 9 . 1 1 192 192 ASN CA C 192 57.787 57.787 54.817 2.970 18321 11691 1 9 . 1 1 192 192 ASN H H 192 7.508 7.508 8.463 -0.955 18321 11692 1 9 . 1 1 193 193 ARG N N 193 120.743 120.743 120.268 0.475 18321 11693 1 9 . 1 1 193 193 ARG H H 193 9.032 9.032 8.158 0.874 18321 11694 1 9 . 1 1 197 197 SER HA H 197 4.388 4.388 4.601 -0.213 18321 11695 1 9 . 1 1 197 197 SER C C 197 174.133 174.133 174.202 -0.069 18321 11696 1 9 . 1 1 197 197 SER CA C 197 58.128 58.128 57.498 0.630 18321 11697 1 9 . 1 1 197 197 SER CB C 197 62.966 62.966 63.552 -0.586 18321 11698 1 9 . 1 1 198 198 TYR N N 198 121.435 121.435 124.364 -2.929 18321 11699 1 9 . 1 1 198 198 TYR HA H 198 4.543 4.543 4.646 -0.103 18321 11700 1 9 . 1 1 198 198 TYR C C 198 176.230 176.230 176.772 -0.542 18321 11701 1 9 . 1 1 198 198 TYR CA C 198 57.536 57.536 57.626 -0.090 18321 11702 1 9 . 1 1 198 198 TYR CB C 198 38.279 38.279 38.447 -0.168 18321 11703 1 9 . 1 1 198 198 TYR H H 198 8.071 8.071 8.386 -0.315 18321 11704 1 9 . 1 1 199 199 GLY N N 199 110.039 110.039 114.783 -4.744 18321 11705 1 9 . 1 1 199 199 GLY C C 199 173.475 173.475 173.570 -0.095 18321 11706 1 9 . 1 1 199 199 GLY CA C 199 44.805 44.805 44.911 -0.106 18321 11707 1 9 . 1 1 199 199 GLY H H 199 8.162 8.162 8.926 -0.764 18321 11708 1 9 . 1 1 200 200 ILE N N 200 121.530 121.530 122.237 -0.707 18321 11709 1 9 . 1 1 200 200 ILE CA C 200 58.102 58.102 57.204 0.898 18321 11710 1 9 . 1 1 200 200 ILE CB C 200 37.760 37.760 40.661 -2.901 18321 11711 1 9 . 1 1 200 200 ILE H H 200 7.851 7.851 7.576 0.275 18321 11712 1 9 . 1 1 201 201 PRO C C 201 176.485 176.485 175.978 0.507 18321 11713 1 9 . 1 1 201 201 PRO CA C 201 53.893 53.893 62.857 -8.964 18321 11714 1 9 . 1 1 201 201 PRO CB C 201 29.042 29.042 31.976 -2.934 18321 11715 1 9 . 1 1 202 202 GLU N N 202 122.468 122.468 125.159 -2.691 18321 11716 1 9 . 1 1 202 202 GLU CA C 202 62.490 62.490 54.569 7.921 18321 11717 1 9 . 1 1 202 202 GLU CB C 202 31.170 31.170 29.210 1.960 18321 11718 1 9 . 1 1 202 202 GLU H H 202 8.328 8.328 8.544 -0.216 18321 11719 1 9 . 1 1 203 203 PRO CA C 203 62.803 62.803 62.708 0.095 18321 11720 1 9 . 1 1 203 203 PRO CB C 203 31.220 31.220 32.737 -1.518 18321 11721 1 9 . 1 1 204 204 ALA N N 204 123.251 123.251 127.342 -4.091 18321 11722 1 9 . 1 1 204 204 ALA HA H 204 4.180 4.180 4.188 -0.008 18321 11723 1 9 . 1 1 204 204 ALA CA C 204 52.124 52.124 53.660 -1.536 18321 11724 1 9 . 1 1 204 204 ALA CB C 204 18.892 18.892 18.909 -0.017 18321 11725 1 9 . 1 1 204 204 ALA H H 204 8.308 8.308 8.588 -0.280 18321 11726 1 9 . 1 1 205 205 HIS N N 205 117.874 117.874 116.336 1.538 18321 11727 1 9 . 1 1 205 205 HIS C C 205 173.282 173.282 174.353 -1.071 18321 11728 1 9 . 1 1 205 205 HIS H H 205 8.045 8.045 8.358 -0.313 18321 11729 1 9 . 1 1 206 206 ALA N N 206 125.519 125.519 125.389 0.130 18321 11730 1 9 . 1 1 206 206 ALA HA H 206 4.204 4.204 4.245 -0.041 18321 11731 1 9 . 1 1 206 206 ALA CA C 206 40.196 40.196 51.998 -11.803 18321 11732 1 9 . 1 1 206 206 ALA CB C 206 19.407 19.407 17.686 1.721 18321 11733 1 9 . 1 1 206 206 ALA H H 206 8.061 8.061 8.186 -0.125 18321 11734 1 9 . 1 1 207 207 TYR N N 207 120.381 120.381 122.968 -2.587 18321 11735 1 9 . 1 1 207 207 TYR HA H 207 4.570 4.570 4.737 -0.167 18321 11736 1 9 . 1 1 207 207 TYR CA C 207 52.572 52.572 55.827 -3.255 18321 11737 1 9 . 1 1 207 207 TYR CB C 207 41.333 41.333 39.407 1.926 18321 11738 1 9 . 1 1 207 207 TYR H H 207 8.199 8.199 7.504 0.695 18321 11739 1 9 . 1 1 208 208 ALA HA H 208 4.281 4.281 4.499 -0.218 18321 11740 1 9 . 1 1 208 208 ALA C C 208 177.736 177.736 177.135 0.601 18321 11741 1 9 . 1 1 208 208 ALA CA C 208 52.084 52.084 51.721 0.363 18321 11742 1 9 . 1 1 208 208 ALA CB C 208 18.999 18.999 19.343 -0.344 18321 11743 1 9 . 1 1 209 209 GLN N N 209 119.295 119.295 120.524 -1.229 18321 11744 1 9 . 1 1 209 209 GLN CA C 209 61.474 61.474 52.824 8.650 18321 11745 1 9 . 1 1 209 209 GLN CB C 209 32.039 32.039 28.723 3.316 18321 11746 1 9 . 1 1 209 209 GLN H H 209 8.125 8.125 8.456 -0.331 18321 11747 1 9 . 1 1 210 210 PRO HA H 210 4.395 4.395 4.495 -0.100 18321 11748 1 9 . 1 1 210 210 PRO CA C 210 62.584 62.584 63.058 -0.474 18321 11749 1 9 . 1 1 211 211 GLN HA H 211 4.377 4.377 4.480 -0.103 18321 11750 1 9 . 1 1 211 211 GLN CA C 211 55.859 55.859 56.223 -0.364 18321 11751 1 9 . 1 1 211 211 GLN CB C 211 29.577 29.577 29.135 0.442 18321 11752 1 9 . 1 1 212 212 THR C C 212 176.551 176.551 173.686 2.865 18321 11753 1 9 . 1 1 212 212 THR CB C 212 69.890 69.890 68.988 0.902 18321 11754 1 9 . 1 1 213 213 THR N N 213 108.487 108.487 115.726 -7.239 18321 11755 1 9 . 1 1 213 213 THR CA C 213 61.236 61.236 62.934 -1.698 18321 11756 1 9 . 1 1 213 213 THR CB C 213 69.091 69.091 69.310 -0.219 18321 11757 1 9 . 1 1 213 213 THR H H 213 8.243 8.243 7.558 0.685 18321 11758 1 9 . 1 1 214 214 THR N N 214 119.445 119.445 113.975 5.470 18321 11759 1 9 . 1 1 214 214 THR CA C 214 59.425 59.425 61.612 -2.187 18321 11760 1 9 . 1 1 214 214 THR CB C 214 69.251 69.251 68.574 0.677 18321 11761 1 9 . 1 1 214 214 THR H H 214 8.188 8.188 8.155 0.033 18321 11762 1 9 . 1 1 215 215 PRO HA H 215 4.361 4.361 4.437 -0.076 18321 11763 1 9 . 1 1 215 215 PRO C C 215 175.422 175.422 176.574 -1.152 18321 11764 1 9 . 1 1 215 215 PRO CA C 215 63.320 63.320 63.558 -0.238 18321 11765 1 9 . 1 1 215 215 PRO CB C 215 31.918 31.918 31.881 0.036 18321 11766 1 9 . 1 1 216 216 LEU N N 216 121.602 121.602 120.451 1.151 18321 11767 1 9 . 1 1 216 216 LEU CA C 216 52.203 52.203 53.340 -1.137 18321 11768 1 9 . 1 1 216 216 LEU CB C 216 42.451 42.451 42.258 0.193 18321 11769 1 9 . 1 1 216 216 LEU H H 216 7.891 7.891 7.836 0.055 18321 11770 1 9 . 1 1 217 217 PRO HA H 217 4.398 4.398 4.277 0.121 18321 11771 1 9 . 1 1 217 217 PRO C C 217 176.577 176.577 176.453 0.124 18321 11772 1 9 . 1 1 217 217 PRO CA C 217 62.984 62.984 63.746 -0.762 18321 11773 1 9 . 1 1 217 217 PRO CB C 217 32.056 32.056 32.095 -0.039 18321 11774 1 9 . 1 1 218 218 ALA N N 218 124.087 124.087 117.946 6.141 18321 11775 1 9 . 1 1 218 218 ALA HA H 218 4.309 4.309 4.074 0.235 18321 11776 1 9 . 1 1 218 218 ALA C C 218 177.844 177.844 176.437 1.407 18321 11777 1 9 . 1 1 218 218 ALA CA C 218 52.379 52.379 52.330 0.049 18321 11778 1 9 . 1 1 218 218 ALA CB C 218 19.133 19.133 17.764 1.369 18321 11779 1 9 . 1 1 218 218 ALA H H 218 8.261 8.261 7.914 0.347 18321 11780 1 9 . 1 1 219 219 VAL N N 219 118.942 118.942 117.650 1.292 18321 11781 1 9 . 1 1 219 219 VAL HA H 219 4.142 4.142 4.204 -0.062 18321 11782 1 9 . 1 1 219 219 VAL CA C 219 62.102 62.102 63.065 -0.963 18321 11783 1 9 . 1 1 219 219 VAL CB C 219 32.923 32.923 31.350 1.573 18321 11784 1 9 . 1 1 219 219 VAL H H 219 8.049 8.049 7.863 0.186 18321 11785 1 9 . 1 1 220 220 SER N N 220 119.207 119.207 124.041 -4.834 18321 11786 1 9 . 1 1 220 220 SER HA H 220 4.436 4.436 4.642 -0.206 18321 11787 1 9 . 1 1 220 220 SER CA C 220 57.813 57.813 58.072 -0.259 18321 11788 1 9 . 1 1 220 220 SER CB C 220 63.375 63.375 64.329 -0.954 18321 11789 1 9 . 1 1 220 220 SER H H 220 8.275 8.275 9.040 -0.765 18321 11790 1 9 . 1 1 221 221 GLY N N 221 110.973 110.973 111.061 -0.088 18321 11791 1 9 . 1 1 221 221 GLY C C 221 173.962 173.962 173.394 0.568 18321 11792 1 9 . 1 1 221 221 GLY CA C 221 45.286 45.286 44.496 0.790 18321 11793 1 9 . 1 1 221 221 GLY H H 221 8.374 8.374 7.625 0.749 18321 11794 1 9 . 1 1 222 222 SER N N 222 115.516 115.516 115.838 -0.322 18321 11795 1 9 . 1 1 222 222 SER HA H 222 4.763 4.763 4.344 0.419 18321 11796 1 9 . 1 1 222 222 SER CA C 222 56.407 56.407 58.145 -1.738 18321 11797 1 9 . 1 1 222 222 SER CB C 222 63.993 63.993 63.883 0.110 18321 11798 1 9 . 1 1 222 222 SER H H 222 8.155 8.155 8.479 -0.324 18321 11799 1 9 . 1 1 223 223 PRO HA H 223 4.417 4.417 4.607 -0.190 18321 11800 1 9 . 1 1 223 223 PRO CA C 223 63.805 63.805 62.789 1.016 18321 11801 1 9 . 1 1 223 223 PRO CB C 223 32.090 32.090 31.575 0.515 18321 11802 1 9 . 1 1 224 224 GLY N N 224 109.149 109.149 108.700 0.449 18321 11803 1 9 . 1 1 224 224 GLY C C 224 173.813 173.813 173.868 -0.055 18321 11804 1 9 . 1 1 224 224 GLY CA C 224 44.512 44.512 45.020 -0.508 18321 11805 1 9 . 1 1 224 224 GLY H H 224 8.376 8.376 7.477 0.899 18321 11806 1 9 . 1 1 225 225 ALA N N 225 123.599 123.599 126.618 -3.019 18321 11807 1 9 . 1 1 225 225 ALA C C 225 177.341 177.341 177.844 -0.503 18321 11808 1 9 . 1 1 225 225 ALA CA C 225 51.878 51.878 53.148 -1.270 18321 11809 1 9 . 1 1 225 225 ALA CB C 225 19.169 19.169 19.021 0.148 18321 11810 1 9 . 1 1 225 225 ALA H H 225 7.959 7.959 8.413 -0.454 18321 11811 1 9 . 1 1 226 226 ALA N N 226 123.218 123.218 121.975 1.243 18321 11812 1 9 . 1 1 226 226 ALA HA H 226 4.350 4.350 4.561 -0.211 18321 11813 1 9 . 1 1 226 226 ALA C C 226 177.520 177.520 176.636 0.884 18321 11814 1 9 . 1 1 226 226 ALA CA C 226 52.535 52.535 51.477 1.058 18321 11815 1 9 . 1 1 226 226 ALA CB C 226 19.171 19.171 19.641 -0.470 18321 11816 1 9 . 1 1 226 226 ALA H H 226 8.169 8.169 7.946 0.223 18321 11817 1 9 . 1 1 227 227 ILE N N 227 120.086 120.086 121.276 -1.190 18321 11818 1 9 . 1 1 227 227 ILE HA H 227 4.201 4.201 4.077 0.124 18321 11819 1 9 . 1 1 227 227 ILE C C 227 174.814 174.814 175.540 -0.726 18321 11820 1 9 . 1 1 227 227 ILE CA C 227 60.929 60.929 61.003 -0.074 18321 11821 1 9 . 1 1 227 227 ILE CB C 227 38.872 38.872 38.266 0.606 18321 11822 1 9 . 1 1 227 227 ILE H H 227 8.037 8.037 7.742 0.295 18321 11823 1 9 . 1 1 228 228 THR N N 228 117.224 117.224 119.954 -2.730 18321 11824 1 9 . 1 1 228 228 THR HA H 228 4.203 4.203 4.214 -0.011 18321 11825 1 9 . 1 1 228 228 THR CA C 228 57.108 57.108 61.990 -4.883 18321 11826 1 9 . 1 1 228 228 THR CB C 228 69.945 69.945 67.191 2.754 18321 11827 1 9 . 1 1 228 228 THR H H 228 7.775 7.775 8.422 -0.647 18321 11828 1 9 . 1 1 229 229 PRO HA H 229 4.750 4.750 4.433 0.317 18321 11829 1 9 . 1 1 229 229 PRO CA C 229 62.480 62.480 62.756 -0.276 18321 11830 1 9 . 1 1 229 229 PRO CB C 229 33.995 33.995 32.347 1.648 18321 11831 1 9 . 1 1 230 230 LEU N N 230 123.629 123.629 125.783 -2.154 18321 11832 1 9 . 1 1 230 230 LEU CA C 230 53.076 53.076 52.008 1.068 18321 11833 1 9 . 1 1 230 230 LEU CB C 230 40.608 40.608 41.911 -1.303 18321 11834 1 9 . 1 1 230 230 LEU H H 230 8.453 8.453 8.289 0.164 18321 11835 1 9 . 1 1 231 231 PRO HA H 231 4.412 4.412 4.563 -0.151 18321 11836 1 9 . 1 1 231 231 PRO C C 231 176.571 176.571 175.724 0.847 18321 11837 1 9 . 1 1 231 231 PRO CA C 231 63.225 63.225 62.593 0.632 18321 11838 1 9 . 1 1 231 231 PRO CB C 231 31.191 31.191 30.488 0.703 18321 11839 1 9 . 1 1 232 232 SER N N 232 115.169 115.169 112.224 2.945 18321 11840 1 9 . 1 1 232 232 SER HA H 232 4.450 4.450 4.119 0.331 18321 11841 1 9 . 1 1 232 232 SER CA C 232 58.604 58.604 59.264 -0.659 18321 11842 1 9 . 1 1 232 232 SER CB C 232 63.962 63.962 62.804 1.158 18321 11843 1 9 . 1 1 232 232 SER H H 232 8.280 8.280 8.323 -0.043 18321 11844 1 9 . 1 1 233 233 THR N N 233 115.155 115.155 112.007 3.148 18321 11845 1 9 . 1 1 233 233 THR HA H 233 4.351 4.351 4.213 0.138 18321 11846 1 9 . 1 1 233 233 THR C C 233 177.237 177.237 175.110 2.127 18321 11847 1 9 . 1 1 233 233 THR CA C 233 61.939 61.939 62.035 -0.097 18321 11848 1 9 . 1 1 233 233 THR CB C 233 68.986 68.986 69.011 -0.025 18321 11849 1 9 . 1 1 233 233 THR H H 233 8.096 8.096 7.623 0.473 18321 11850 1 9 . 1 1 234 234 GLN N N 234 122.040 122.040 126.335 -4.295 18321 11851 1 9 . 1 1 234 234 GLN HA H 234 4.681 4.681 4.372 0.309 18321 11852 1 9 . 1 1 234 234 GLN C C 234 176.177 176.177 174.557 1.620 18321 11853 1 9 . 1 1 234 234 GLN CA C 234 55.861 55.861 55.253 0.608 18321 11854 1 9 . 1 1 234 234 GLN CB C 234 28.583 28.583 26.441 2.142 18321 11855 1 9 . 1 1 234 234 GLN H H 234 8.256 8.256 8.837 -0.581 18321 11856 1 9 . 1 1 235 235 ASN N N 235 119.506 119.506 120.596 -1.090 18321 11857 1 9 . 1 1 235 235 ASN HA H 235 4.775 4.775 4.810 -0.035 18321 11858 1 9 . 1 1 235 235 ASN C C 235 174.974 174.974 173.726 1.248 18321 11859 1 9 . 1 1 235 235 ASN CA C 235 53.191 53.191 53.183 0.008 18321 11860 1 9 . 1 1 235 235 ASN CB C 235 38.511 38.511 39.704 -1.193 18321 11861 1 9 . 1 1 235 235 ASN H H 235 8.346 8.346 7.858 0.488 18321 11862 1 9 . 1 1 236 236 GLY N N 236 109.378 109.378 106.898 2.480 18321 11863 1 9 . 1 1 236 236 GLY CA C 236 44.023 44.023 44.909 -0.886 18321 11864 1 9 . 1 1 236 236 GLY H H 236 7.939 7.939 8.315 -0.376 18321 11865 1 9 . 1 1 237 237 PRO HA H 237 4.336 4.336 4.587 -0.251 18321 11866 1 9 . 1 1 237 237 PRO C C 237 175.942 175.942 175.812 0.130 18321 11867 1 9 . 1 1 237 237 PRO CA C 237 62.797 62.797 62.287 0.510 18321 11868 1 9 . 1 1 237 237 PRO CB C 237 27.421 27.421 31.995 -4.574 18321 11869 1 9 . 1 1 238 238 VAL N N 238 120.535 120.535 124.804 -4.269 18321 11870 1 9 . 1 1 238 238 VAL HA H 238 4.195 4.195 4.096 0.099 18321 11871 1 9 . 1 1 238 238 VAL C C 238 173.775 173.775 175.054 -1.279 18321 11872 1 9 . 1 1 238 238 VAL CA C 238 61.173 61.173 61.764 -0.591 18321 11873 1 9 . 1 1 238 238 VAL CB C 238 38.328 38.328 33.446 4.882 18321 11874 1 9 . 1 1 238 238 VAL H H 238 7.986 7.986 8.796 -0.810 18321 11875 1 9 . 1 1 239 239 PHE N N 239 123.522 123.522 127.101 -3.579 18321 11876 1 9 . 1 1 239 239 PHE HA H 239 5.539 5.539 4.812 0.727 18321 11877 1 9 . 1 1 239 239 PHE C C 239 174.207 174.207 174.679 -0.472 18321 11878 1 9 . 1 1 239 239 PHE CA C 239 56.993 56.993 57.023 -0.029 18321 11879 1 9 . 1 1 239 239 PHE CB C 239 41.743 41.743 39.241 2.502 18321 11880 1 9 . 1 1 239 239 PHE H H 239 8.927 8.927 8.674 0.253 18321 11881 1 9 . 1 1 240 240 ALA N N 240 120.871 120.871 127.727 -6.856 18321 11882 1 9 . 1 1 240 240 ALA HA H 240 5.352 5.352 5.469 -0.117 18321 11883 1 9 . 1 1 240 240 ALA C C 240 174.639 174.639 175.716 -1.077 18321 11884 1 9 . 1 1 240 240 ALA CA C 240 49.736 49.736 50.452 -0.716 18321 11885 1 9 . 1 1 240 240 ALA CB C 240 23.480 23.480 22.161 1.319 18321 11886 1 9 . 1 1 240 240 ALA H H 240 9.398 9.398 9.470 -0.072 18321 11887 1 9 . 1 1 241 241 LYS N N 241 121.227 121.227 126.407 -5.180 18321 11888 1 9 . 1 1 241 241 LYS HA H 241 5.373 5.373 4.867 0.506 18321 11889 1 9 . 1 1 241 241 LYS C C 241 176.772 176.772 176.106 0.666 18321 11890 1 9 . 1 1 241 241 LYS CA C 241 53.128 53.128 55.201 -2.073 18321 11891 1 9 . 1 1 241 241 LYS CB C 241 34.850 34.850 34.038 0.812 18321 11892 1 9 . 1 1 241 241 LYS H H 241 8.947 8.947 9.085 -0.138 18321 11893 1 9 . 1 1 242 242 ALA N N 242 126.833 126.833 131.154 -4.321 18321 11894 1 9 . 1 1 242 242 ALA HA H 242 4.764 4.764 4.607 0.157 18321 11895 1 9 . 1 1 242 242 ALA C C 242 178.506 178.506 177.697 0.809 18321 11896 1 9 . 1 1 242 242 ALA CA C 242 52.788 52.788 52.067 0.721 18321 11897 1 9 . 1 1 242 242 ALA CB C 242 19.084 19.084 18.402 0.682 18321 11898 1 9 . 1 1 242 242 ALA H H 242 9.373 9.373 8.501 0.872 18321 11899 1 9 . 1 1 243 243 ILE N N 243 118.731 118.731 119.514 -0.783 18321 11900 1 9 . 1 1 243 243 ILE HA H 243 4.454 4.454 4.181 0.273 18321 11901 1 9 . 1 1 243 243 ILE C C 243 174.773 174.773 176.114 -1.341 18321 11902 1 9 . 1 1 243 243 ILE CA C 243 60.613 60.613 62.118 -1.505 18321 11903 1 9 . 1 1 243 243 ILE CB C 243 39.232 39.232 38.560 0.672 18321 11904 1 9 . 1 1 243 243 ILE H H 243 8.933 8.933 8.272 0.661 18321 11905 1 9 . 1 1 244 244 GLN N N 244 121.616 121.616 120.492 1.124 18321 11906 1 9 . 1 1 244 244 GLN HA H 244 4.283 4.283 4.559 -0.276 18321 11907 1 9 . 1 1 244 244 GLN C C 244 172.815 172.815 174.985 -2.170 18321 11908 1 9 . 1 1 244 244 GLN CA C 244 54.750 54.750 54.287 0.463 18321 11909 1 9 . 1 1 244 244 GLN CB C 244 31.469 31.469 32.451 -0.982 18321 11910 1 9 . 1 1 244 244 GLN H H 244 7.438 7.438 7.754 -0.316 18321 11911 1 9 . 1 1 245 245 LYS N N 245 124.215 124.215 123.717 0.498 18321 11912 1 9 . 1 1 245 245 LYS HA H 245 3.962 3.962 4.320 -0.358 18321 11913 1 9 . 1 1 245 245 LYS C C 245 175.679 175.679 176.717 -1.038 18321 11914 1 9 . 1 1 245 245 LYS CA C 245 56.413 56.413 57.419 -1.006 18321 11915 1 9 . 1 1 245 245 LYS CB C 245 32.847 32.847 32.287 0.560 18321 11916 1 9 . 1 1 245 245 LYS H H 245 8.318 8.318 8.687 -0.369 18321 11917 1 9 . 1 1 246 246 ARG N N 246 127.327 127.327 127.459 -0.132 18321 11918 1 9 . 1 1 246 246 ARG HA H 246 4.221 4.221 4.608 -0.387 18321 11919 1 9 . 1 1 246 246 ARG CA C 246 56.279 56.279 54.533 1.746 18321 11920 1 9 . 1 1 246 246 ARG CB C 246 32.987 32.987 30.463 2.524 18321 11921 1 9 . 1 1 246 246 ARG H H 246 9.248 9.248 9.094 0.154 18321 11922 1 9 . 1 1 249 249 CYS HA H 249 4.260 4.260 4.435 -0.175 18321 11923 1 9 . 1 1 249 249 CYS CA C 249 55.886 55.886 56.950 -1.064 18321 11924 1 9 . 1 1 249 249 CYS CB C 249 34.146 34.146 29.273 4.873 18321 11925 1 9 . 1 1 250 250 ALA HA H 250 3.926 3.926 4.081 -0.155 18321 11926 1 9 . 1 1 250 250 ALA CA C 250 54.344 54.344 54.720 -0.376 18321 11927 1 9 . 1 1 250 250 ALA CB C 250 18.342 18.342 18.046 0.296 18321 11928 1 9 . 1 1 251 251 TYR N N 251 110.618 110.618 112.834 -2.216 18321 11929 1 9 . 1 1 251 251 TYR HA H 251 4.489 4.489 4.769 -0.280 18321 11930 1 9 . 1 1 251 251 TYR C C 251 175.286 175.286 174.944 0.342 18321 11931 1 9 . 1 1 251 251 TYR CA C 251 56.137 56.137 55.872 0.265 18321 11932 1 9 . 1 1 251 251 TYR CB C 251 37.203 37.203 38.336 -1.133 18321 11933 1 9 . 1 1 251 251 TYR H H 251 7.037 7.037 8.099 -1.062 18321 11934 1 9 . 1 1 252 252 ASP N N 252 121.835 121.835 122.191 -0.356 18321 11935 1 9 . 1 1 252 252 ASP HA H 252 4.763 4.763 4.363 0.400 18321 11936 1 9 . 1 1 252 252 ASP CA C 252 52.351 52.351 54.652 -2.301 18321 11937 1 9 . 1 1 252 252 ASP CB C 252 39.995 39.995 40.735 -0.740 18321 11938 1 9 . 1 1 252 252 ASP H H 252 7.339 7.339 7.234 0.105 18321 11939 1 9 . 1 1 253 253 LYS N N 253 123.177 123.177 124.448 -1.271 18321 11940 1 9 . 1 1 253 253 LYS HA H 253 4.270 4.270 4.405 -0.135 18321 11941 1 9 . 1 1 253 253 LYS C C 253 177.724 177.724 176.574 1.150 18321 11942 1 9 . 1 1 253 253 LYS CA C 253 57.036 57.036 55.673 1.363 18321 11943 1 9 . 1 1 253 253 LYS H H 253 8.396 8.396 8.150 0.246 18321 11944 1 9 . 1 1 254 254 THR N N 254 108.317 108.317 109.930 -1.613 18321 11945 1 9 . 1 1 254 254 THR HA H 254 4.517 4.517 3.930 0.587 18321 11946 1 9 . 1 1 254 254 THR C C 254 174.012 174.012 173.140 0.872 18321 11947 1 9 . 1 1 254 254 THR CA C 254 61.036 61.036 62.346 -1.310 18321 11948 1 9 . 1 1 254 254 THR CB C 254 69.307 69.307 68.291 1.016 18321 11949 1 9 . 1 1 254 254 THR H H 254 8.217 8.217 8.453 -0.235 18321 11950 1 9 . 1 1 255 255 ALA N N 255 124.762 124.762 123.386 1.376 18321 11951 1 9 . 1 1 255 255 ALA HA H 255 4.524 4.524 4.666 -0.142 18321 11952 1 9 . 1 1 255 255 ALA C C 255 176.630 176.630 176.817 -0.187 18321 11953 1 9 . 1 1 255 255 ALA CA C 255 51.352 51.352 50.877 0.476 18321 11954 1 9 . 1 1 255 255 ALA CB C 255 20.135 20.135 19.831 0.304 18321 11955 1 9 . 1 1 255 255 ALA H H 255 7.096 7.096 7.788 -0.692 18321 11956 1 9 . 1 1 256 256 LEU N N 256 124.379 124.379 124.396 -0.017 18321 11957 1 9 . 1 1 256 256 LEU HA H 256 4.328 4.328 4.456 -0.128 18321 11958 1 9 . 1 1 256 256 LEU C C 256 176.007 176.007 175.925 0.082 18321 11959 1 9 . 1 1 256 256 LEU CA C 256 53.502 53.502 54.075 -0.573 18321 11960 1 9 . 1 1 256 256 LEU CB C 256 44.665 44.665 43.954 0.711 18321 11961 1 9 . 1 1 256 256 LEU H H 256 8.889 8.889 8.086 0.803 18321 11962 1 9 . 1 1 257 257 ALA N N 257 129.619 129.619 129.029 0.590 18321 11963 1 9 . 1 1 257 257 ALA HA H 257 4.445 4.445 4.558 -0.113 18321 11964 1 9 . 1 1 257 257 ALA C C 257 176.813 176.813 176.723 0.090 18321 11965 1 9 . 1 1 257 257 ALA CA C 257 51.179 51.179 51.433 -0.254 18321 11966 1 9 . 1 1 257 257 ALA CB C 257 18.973 18.973 18.449 0.524 18321 11967 1 9 . 1 1 257 257 ALA H H 257 8.529 8.529 8.472 0.057 18321 11968 1 9 . 1 1 258 258 LEU N N 258 119.300 119.300 127.122 -7.822 18321 11969 1 9 . 1 1 258 258 LEU HA H 258 4.782 4.782 4.471 0.311 18321 11970 1 9 . 1 1 258 258 LEU CA C 258 53.259 53.259 53.829 -0.570 18321 11971 1 9 . 1 1 258 258 LEU CB C 258 45.972 45.972 42.694 3.278 18321 11972 1 9 . 1 1 258 258 LEU H H 258 8.505 8.505 8.914 -0.409 18321 11973 1 9 . 1 1 259 259 GLU N N 259 123.919 123.919 124.932 -1.013 18321 11974 1 9 . 1 1 259 259 GLU HA H 259 4.516 4.516 4.402 0.114 18321 11975 1 9 . 1 1 259 259 GLU C C 259 175.795 175.795 175.467 0.328 18321 11976 1 9 . 1 1 259 259 GLU CA C 259 52.896 52.896 55.184 -2.288 18321 11977 1 9 . 1 1 259 259 GLU H H 259 8.943 8.943 8.513 0.430 18321 11978 1 9 . 1 1 260 260 VAL N N 260 122.122 122.122 120.997 1.125 18321 11979 1 9 . 1 1 260 260 VAL HA H 260 2.923 2.923 3.853 -0.930 18321 11980 1 9 . 1 1 260 260 VAL C C 260 177.964 177.964 177.477 0.487 18321 11981 1 9 . 1 1 260 260 VAL CA C 260 65.417 65.417 63.854 1.563 18321 11982 1 9 . 1 1 260 260 VAL CB C 260 30.668 30.668 31.293 -0.625 18321 11983 1 9 . 1 1 260 260 VAL H H 260 8.956 8.956 8.375 0.581 18321 11984 1 9 . 1 1 261 261 GLY N N 261 116.009 116.009 116.543 -0.534 18321 11985 1 9 . 1 1 261 261 GLY C C 261 176.288 176.288 173.241 3.047 18321 11986 1 9 . 1 1 261 261 GLY CA C 261 44.210 44.210 44.856 -0.646 18321 11987 1 9 . 1 1 261 261 GLY H H 261 8.799 8.799 8.706 0.093 18321 11988 1 9 . 1 1 262 262 ASP N N 262 121.945 121.945 119.023 2.922 18321 11989 1 9 . 1 1 262 262 ASP HA H 262 4.423 4.423 5.008 -0.585 18321 11990 1 9 . 1 1 262 262 ASP C C 262 175.381 175.381 174.569 0.812 18321 11991 1 9 . 1 1 262 262 ASP CA C 262 55.243 55.243 52.731 2.512 18321 11992 1 9 . 1 1 262 262 ASP CB C 262 41.819 41.819 43.788 -1.969 18321 11993 1 9 . 1 1 262 262 ASP H H 262 8.180 8.180 7.997 0.183 18321 11994 1 9 . 1 1 263 263 ILE N N 263 121.452 121.452 120.754 0.698 18321 11995 1 9 . 1 1 263 263 ILE HA H 263 4.707 4.707 4.539 0.168 18321 11996 1 9 . 1 1 263 263 ILE C C 263 174.996 174.996 175.921 -0.925 18321 11997 1 9 . 1 1 263 263 ILE CA C 263 59.289 59.289 59.501 -0.212 18321 11998 1 9 . 1 1 263 263 ILE CB C 263 36.987 36.987 38.761 -1.774 18321 11999 1 9 . 1 1 263 263 ILE H H 263 8.460 8.460 8.418 0.042 18321 12000 1 9 . 1 1 264 264 VAL N N 264 128.756 128.756 127.238 1.518 18321 12001 1 9 . 1 1 264 264 VAL HA H 264 4.309 4.309 4.340 -0.031 18321 12002 1 9 . 1 1 264 264 VAL C C 264 175.486 175.486 174.560 0.926 18321 12003 1 9 . 1 1 264 264 VAL CA C 264 59.091 59.091 61.269 -2.178 18321 12004 1 9 . 1 1 264 264 VAL CB C 264 34.541 34.541 33.279 1.262 18321 12005 1 9 . 1 1 264 264 VAL H H 264 9.479 9.479 9.245 0.234 18321 12006 1 9 . 1 1 265 265 LYS N N 265 128.101 128.101 129.913 -1.812 18321 12007 1 9 . 1 1 265 265 LYS HA H 265 4.342 4.342 4.930 -0.588 18321 12008 1 9 . 1 1 265 265 LYS C C 265 175.531 175.531 175.259 0.272 18321 12009 1 9 . 1 1 265 265 LYS CA C 265 55.620 55.620 55.457 0.163 18321 12010 1 9 . 1 1 265 265 LYS CB C 265 33.149 33.149 33.271 -0.122 18321 12011 1 9 . 1 1 265 265 LYS H H 265 8.715 8.715 8.790 -0.075 18321 12012 1 9 . 1 1 266 266 VAL N N 266 129.537 129.537 127.424 2.113 18321 12013 1 9 . 1 1 266 266 VAL HA H 266 4.333 4.333 4.484 -0.151 18321 12014 1 9 . 1 1 266 266 VAL C C 266 176.166 176.166 174.818 1.348 18321 12015 1 9 . 1 1 266 266 VAL CA C 266 63.339 63.339 60.620 2.719 18321 12016 1 9 . 1 1 266 266 VAL CB C 266 30.712 30.712 34.888 -4.176 18321 12017 1 9 . 1 1 266 266 VAL H H 266 9.073 9.073 8.582 0.491 18321 12018 1 9 . 1 1 267 267 THR N N 267 120.020 120.020 120.588 -0.568 18321 12019 1 9 . 1 1 267 267 THR HA H 267 4.189 4.189 4.552 -0.363 18321 12020 1 9 . 1 1 267 267 THR C C 267 176.054 176.054 175.195 0.859 18321 12021 1 9 . 1 1 267 267 THR CA C 267 62.204 62.204 62.045 0.159 18321 12022 1 9 . 1 1 267 267 THR CB C 267 68.200 68.200 70.203 -2.003 18321 12023 1 9 . 1 1 267 267 THR H H 267 9.130 9.130 8.275 0.855 18321 12024 1 9 . 1 1 268 268 ARG N N 268 120.839 120.839 123.179 -2.340 18321 12025 1 9 . 1 1 268 268 ARG HA H 268 4.236 4.236 4.618 -0.382 18321 12026 1 9 . 1 1 268 268 ARG CA C 268 56.321 56.321 55.118 1.203 18321 12027 1 9 . 1 1 268 268 ARG CB C 268 33.049 33.049 32.064 0.985 18321 12028 1 9 . 1 1 268 268 ARG H H 268 7.631 7.631 7.777 -0.146 18321 12029 1 9 . 1 1 269 269 MET N N 269 125.443 125.443 123.524 1.919 18321 12030 1 9 . 1 1 269 269 MET C C 269 174.392 174.392 175.243 -0.851 18321 12031 1 9 . 1 1 269 269 MET H H 269 8.532 8.532 8.709 -0.177 18321 12032 1 9 . 1 1 270 270 ASN N N 270 119.125 119.125 123.136 -4.011 18321 12033 1 9 . 1 1 270 270 ASN HA H 270 4.546 4.546 4.786 -0.240 18321 12034 1 9 . 1 1 270 270 ASN C C 270 172.133 172.133 176.278 -4.145 18321 12035 1 9 . 1 1 270 270 ASN CA C 270 53.639 53.639 54.307 -0.668 18321 12036 1 9 . 1 1 270 270 ASN CB C 270 39.845 39.845 39.000 0.845 18321 12037 1 9 . 1 1 270 270 ASN H H 270 6.631 6.631 9.013 -2.382 18321 12038 1 9 . 1 1 271 271 ILE N N 271 122.532 122.532 116.011 6.521 18321 12039 1 9 . 1 1 271 271 ILE HA H 271 4.417 4.417 3.742 0.675 18321 12040 1 9 . 1 1 271 271 ILE CA C 271 63.348 63.348 63.663 -0.315 18321 12041 1 9 . 1 1 271 271 ILE CB C 271 38.198 38.198 36.041 2.157 18321 12042 1 9 . 1 1 271 271 ILE H H 271 8.565 8.565 8.306 0.259 18321 12043 1 9 . 1 1 272 272 ASN HA H 272 4.527 4.527 4.766 -0.239 18321 12044 1 9 . 1 1 272 272 ASN C C 272 176.259 176.259 176.354 -0.095 18321 12045 1 9 . 1 1 272 272 ASN CA C 272 53.225 53.225 53.581 -0.356 18321 12046 1 9 . 1 1 272 272 ASN CB C 272 37.565 37.565 39.011 -1.446 18321 12047 1 9 . 1 1 273 273 GLY N N 273 107.043 107.043 106.915 0.128 18321 12048 1 9 . 1 1 273 273 GLY C C 273 173.216 173.216 174.026 -0.810 18321 12049 1 9 . 1 1 273 273 GLY CA C 273 45.299 45.299 45.598 -0.299 18321 12050 1 9 . 1 1 273 273 GLY H H 273 8.086 8.086 8.346 -0.260 18321 12051 1 9 . 1 1 274 274 GLN N N 274 120.624 120.624 122.007 -1.383 18321 12052 1 9 . 1 1 274 274 GLN HA H 274 4.551 4.551 4.152 0.399 18321 12053 1 9 . 1 1 274 274 GLN C C 274 175.039 175.039 175.327 -0.288 18321 12054 1 9 . 1 1 274 274 GLN CA C 274 54.556 54.556 55.420 -0.864 18321 12055 1 9 . 1 1 274 274 GLN CB C 274 33.698 33.698 28.515 5.184 18321 12056 1 9 . 1 1 274 274 GLN H H 274 8.045 8.045 7.293 0.752 18321 12057 1 9 . 1 1 275 275 TRP N N 275 125.596 125.596 125.633 -0.037 18321 12058 1 9 . 1 1 275 275 TRP HA H 275 4.588 4.588 4.869 -0.281 18321 12059 1 9 . 1 1 275 275 TRP C C 275 172.832 172.832 175.675 -2.843 18321 12060 1 9 . 1 1 275 275 TRP CA C 275 55.296 55.296 53.642 1.654 18321 12061 1 9 . 1 1 275 275 TRP CB C 275 31.393 31.393 30.891 0.502 18321 12062 1 9 . 1 1 275 275 TRP H H 275 8.484 8.484 8.652 -0.168 18321 12063 1 9 . 1 1 276 276 GLU N N 276 119.012 119.012 121.607 -2.595 18321 12064 1 9 . 1 1 276 276 GLU HA H 276 5.190 5.190 5.617 -0.427 18321 12065 1 9 . 1 1 276 276 GLU C C 276 176.553 176.553 175.578 0.975 18321 12066 1 9 . 1 1 276 276 GLU CA C 276 54.288 54.288 54.816 -0.528 18321 12067 1 9 . 1 1 276 276 GLU CB C 276 32.851 32.851 33.100 -0.249 18321 12068 1 9 . 1 1 276 276 GLU H H 276 8.643 8.643 9.164 -0.521 18321 12069 1 9 . 1 1 277 277 GLY N N 277 111.364 111.364 112.141 -0.777 18321 12070 1 9 . 1 1 277 277 GLY C C 277 170.707 170.707 172.321 -1.614 18321 12071 1 9 . 1 1 277 277 GLY CA C 277 46.723 46.723 44.373 2.350 18321 12072 1 9 . 1 1 277 277 GLY H H 277 9.072 9.072 8.295 0.777 18321 12073 1 9 . 1 1 278 278 GLU N N 278 117.733 117.733 121.159 -3.426 18321 12074 1 9 . 1 1 278 278 GLU HA H 278 5.748 5.748 4.783 0.965 18321 12075 1 9 . 1 1 278 278 GLU C C 278 176.051 176.051 175.493 0.558 18321 12076 1 9 . 1 1 278 278 GLU CA C 278 53.620 53.620 54.651 -1.031 18321 12077 1 9 . 1 1 278 278 GLU CB C 278 33.742 33.742 31.096 2.646 18321 12078 1 9 . 1 1 278 278 GLU H H 278 8.810 8.810 8.193 0.617 18321 12079 1 9 . 1 1 279 279 VAL N N 279 123.834 123.834 127.716 -3.882 18321 12080 1 9 . 1 1 279 279 VAL HA H 279 4.404 4.404 4.307 0.097 18321 12081 1 9 . 1 1 279 279 VAL C C 279 175.289 175.289 175.360 -0.071 18321 12082 1 9 . 1 1 279 279 VAL CA C 279 61.166 61.166 60.117 1.049 18321 12083 1 9 . 1 1 279 279 VAL CB C 279 34.123 34.123 31.775 2.348 18321 12084 1 9 . 1 1 279 279 VAL H H 279 8.887 8.887 8.018 0.869 18321 12085 1 9 . 1 1 280 280 ASN N N 280 126.025 126.025 124.971 1.054 18321 12086 1 9 . 1 1 280 280 ASN HA H 280 4.435 4.435 4.325 0.110 18321 12087 1 9 . 1 1 280 280 ASN C C 280 175.205 175.205 174.715 0.490 18321 12088 1 9 . 1 1 280 280 ASN CA C 280 45.615 45.615 54.545 -8.931 18321 12089 1 9 . 1 1 280 280 ASN CB C 280 37.386 37.386 36.743 0.643 18321 12090 1 9 . 1 1 280 280 ASN H H 280 9.322 9.322 9.341 -0.019 18321 12091 1 9 . 1 1 281 281 GLY N N 281 104.588 104.588 106.007 -1.419 18321 12092 1 9 . 1 1 281 281 GLY C C 281 173.944 173.944 173.077 0.867 18321 12093 1 9 . 1 1 281 281 GLY CA C 281 45.224 45.224 45.169 0.055 18321 12094 1 9 . 1 1 281 281 GLY H H 281 8.768 8.768 8.900 -0.132 18321 12095 1 9 . 1 1 282 282 ARG N N 282 122.567 122.567 118.510 4.057 18321 12096 1 9 . 1 1 282 282 ARG HA H 282 4.559 4.559 4.569 -0.010 18321 12097 1 9 . 1 1 282 282 ARG C C 282 174.350 174.350 173.569 0.781 18321 12098 1 9 . 1 1 282 282 ARG CA C 282 54.933 54.933 54.593 0.340 18321 12099 1 9 . 1 1 282 282 ARG CB C 282 31.765 31.765 31.377 0.388 18321 12100 1 9 . 1 1 282 282 ARG H H 282 8.149 8.149 7.762 0.387 18321 12101 1 9 . 1 1 283 283 LYS N N 283 121.565 121.565 120.779 0.786 18321 12102 1 9 . 1 1 283 283 LYS HA H 283 5.584 5.584 5.415 0.169 18321 12103 1 9 . 1 1 283 283 LYS CA C 283 54.143 54.143 54.935 -0.792 18321 12104 1 9 . 1 1 283 283 LYS CB C 283 36.040 36.040 33.081 2.959 18321 12105 1 9 . 1 1 283 283 LYS H H 283 8.424 8.424 8.388 0.036 18321 12106 1 9 . 1 1 284 284 GLY C C 284 173.006 173.006 172.880 0.126 18321 12107 1 9 . 1 1 284 284 GLY CA C 284 45.886 45.886 44.812 1.073 18321 12108 1 9 . 1 1 285 285 LEU N N 285 119.673 119.673 121.969 -2.296 18321 12109 1 9 . 1 1 285 285 LEU HA H 285 5.718 5.718 5.629 0.089 18321 12110 1 9 . 1 1 285 285 LEU C C 285 178.657 178.657 176.276 2.381 18321 12111 1 9 . 1 1 285 285 LEU CA C 285 53.656 53.656 54.134 -0.478 18321 12112 1 9 . 1 1 285 285 LEU CB C 285 44.813 44.813 42.841 1.972 18321 12113 1 9 . 1 1 285 285 LEU H H 285 8.734 8.734 8.843 -0.109 18321 12114 1 9 . 1 1 286 286 PHE N N 286 118.785 118.785 121.093 -2.308 18321 12115 1 9 . 1 1 286 286 PHE HA H 286 4.521 4.521 5.064 -0.543 18321 12116 1 9 . 1 1 286 286 PHE CA C 286 57.592 57.592 54.248 3.344 18321 12117 1 9 . 1 1 286 286 PHE CB C 286 40.669 40.669 39.922 0.747 18321 12118 1 9 . 1 1 286 286 PHE H H 286 9.120 9.120 8.911 0.209 18321 12119 1 9 . 1 1 287 287 PRO HA H 287 4.385 4.385 4.796 -0.411 18321 12120 1 9 . 1 1 287 287 PRO CA C 287 62.814 62.814 61.775 1.039 18321 12121 1 9 . 1 1 287 287 PRO CB C 287 32.133 32.133 31.824 0.309 18321 12122 1 9 . 1 1 288 288 PHE C C 288 174.837 174.837 176.452 -1.615 18321 12123 1 9 . 1 1 288 288 PHE CA C 288 59.020 59.020 60.529 -1.510 18321 12124 1 9 . 1 1 288 288 PHE CB C 288 34.987 34.987 36.983 -1.996 18321 12125 1 9 . 1 1 289 289 THR N N 289 107.865 107.865 110.685 -2.820 18321 12126 1 9 . 1 1 289 289 THR HA H 289 3.589 3.589 3.957 -0.368 18321 12127 1 9 . 1 1 289 289 THR C C 289 176.125 176.125 174.814 1.311 18321 12128 1 9 . 1 1 289 289 THR CA C 289 62.243 62.243 63.781 -1.538 18321 12129 1 9 . 1 1 289 289 THR CB C 289 69.365 69.365 67.723 1.642 18321 12130 1 9 . 1 1 289 289 THR H H 289 6.453 6.453 7.446 -0.993 18321 12131 1 9 . 1 1 290 290 HIS N N 290 119.462 119.462 119.519 -0.057 18321 12132 1 9 . 1 1 290 290 HIS HA H 290 4.196 4.196 4.782 -0.586 18321 12133 1 9 . 1 1 290 290 HIS C C 290 175.165 175.165 174.158 1.007 18321 12134 1 9 . 1 1 290 290 HIS CA C 290 57.635 57.635 57.178 0.457 18321 12135 1 9 . 1 1 290 290 HIS CB C 290 29.840 29.840 31.518 -1.678 18321 12136 1 9 . 1 1 290 290 HIS H H 290 7.835 7.835 7.903 -0.068 18321 12137 1 9 . 1 1 291 291 VAL N N 291 110.050 110.050 112.666 -2.616 18321 12138 1 9 . 1 1 291 291 VAL HA H 291 5.445 5.445 5.360 0.085 18321 12139 1 9 . 1 1 291 291 VAL C C 291 173.386 173.386 174.261 -0.875 18321 12140 1 9 . 1 1 291 291 VAL CA C 291 57.794 57.794 58.790 -0.996 18321 12141 1 9 . 1 1 291 291 VAL CB C 291 35.784 35.784 35.446 0.338 18321 12142 1 9 . 1 1 291 291 VAL H H 291 7.562 7.562 7.552 0.010 18321 12143 1 9 . 1 1 292 292 LYS N N 292 119.445 119.445 120.433 -0.988 18321 12144 1 9 . 1 1 292 292 LYS HA H 292 4.857 4.857 4.716 0.141 18321 12145 1 9 . 1 1 292 292 LYS C C 292 176.512 176.512 176.024 0.488 18321 12146 1 9 . 1 1 292 292 LYS CA C 292 54.647 54.647 54.527 0.120 18321 12147 1 9 . 1 1 292 292 LYS CB C 292 35.665 35.665 35.657 0.008 18321 12148 1 9 . 1 1 292 292 LYS H H 292 8.753 8.753 8.231 0.522 18321 12149 1 9 . 1 1 293 293 ILE N N 293 128.707 128.707 126.365 2.342 18321 12150 1 9 . 1 1 293 293 ILE HA H 293 4.509 4.509 5.174 -0.665 18321 12151 1 9 . 1 1 293 293 ILE C C 293 175.666 175.666 177.032 -1.366 18321 12152 1 9 . 1 1 293 293 ILE CA C 293 62.563 62.563 62.086 0.477 18321 12153 1 9 . 1 1 293 293 ILE CB C 293 38.076 38.076 37.070 1.006 18321 12154 1 9 . 1 1 293 293 ILE H H 293 9.107 9.107 8.861 0.246 18321 12155 1 9 . 1 1 294 294 PHE N N 294 126.638 126.638 123.913 2.725 18321 12156 1 9 . 1 1 294 294 PHE HA H 294 4.898 4.898 4.840 0.058 18321 12157 1 9 . 1 1 294 294 PHE C C 294 175.838 175.838 172.534 3.304 18321 12158 1 9 . 1 1 294 294 PHE CA C 294 56.335 56.335 57.079 -0.744 18321 12159 1 9 . 1 1 294 294 PHE CB C 294 41.196 41.196 41.197 -0.001 18321 12160 1 9 . 1 1 294 294 PHE H H 294 8.716 8.716 8.998 -0.282 18321 12161 1 9 . 1 1 295 295 ASP N N 295 122.961 122.961 118.842 4.119 18321 12162 1 9 . 1 1 295 295 ASP HA H 295 5.003 5.003 4.429 0.574 18321 12163 1 9 . 1 1 295 295 ASP CA C 295 50.602 50.602 51.107 -0.505 18321 12164 1 9 . 1 1 295 295 ASP CB C 295 40.754 40.754 43.847 -3.093 18321 12165 1 9 . 1 1 295 295 ASP H H 295 8.418 8.418 8.331 0.087 18321 12166 1 9 . 1 1 296 296 PRO HA H 296 4.524 4.524 4.255 0.269 18321 12167 1 9 . 1 1 296 296 PRO C C 296 176.807 176.807 176.349 0.458 18321 12168 1 9 . 1 1 296 296 PRO CA C 296 62.987 62.987 64.326 -1.339 18321 12169 1 9 . 1 1 296 296 PRO CB C 296 32.033 32.033 32.215 -0.182 18321 12170 1 9 . 1 1 297 297 GLN N N 297 120.729 120.729 114.474 6.255 18321 12171 1 9 . 1 1 297 297 GLN HA H 297 4.274 4.274 4.401 -0.127 18321 12172 1 9 . 1 1 297 297 GLN CA C 297 56.427 56.427 56.253 0.174 18321 12173 1 9 . 1 1 297 297 GLN CB C 297 28.819 28.819 32.525 -3.706 18321 12174 1 9 . 1 1 297 297 GLN H H 297 8.551 8.551 8.809 -0.258 18321 12175 1 9 . 1 1 299 299 PRO C C 299 176.936 176.936 175.287 1.649 18321 12176 1 9 . 1 1 299 299 PRO CA C 299 63.406 63.406 62.762 0.644 18321 12177 1 9 . 1 1 299 299 PRO CB C 299 31.421 31.421 30.139 1.282 18321 12178 1 9 . 1 1 300 300 ASP N N 300 119.609 119.609 123.552 -3.943 18321 12179 1 9 . 1 1 300 300 ASP C C 300 176.344 176.344 176.556 -0.212 18321 12180 1 9 . 1 1 300 300 ASP CA C 300 54.178 54.178 53.053 1.125 18321 12181 1 9 . 1 1 300 300 ASP CB C 300 40.661 40.661 42.663 -2.002 18321 12182 1 9 . 1 1 300 300 ASP H H 300 8.239 8.239 8.103 0.136 18321 12183 1 9 . 1 1 301 301 GLU N N 301 120.462 120.462 121.537 -1.075 18321 12184 1 9 . 1 1 301 301 GLU CA C 301 56.188 56.188 58.397 -2.209 18321 12185 1 9 . 1 1 301 301 GLU CB C 301 29.507 29.507 30.056 -0.549 18321 12186 1 9 . 1 1 301 301 GLU H H 301 8.084 8.084 8.743 -0.659 18321 12187 1 10 . 1 1 2 2 SER HA H 2 4.521 4.521 4.823 -0.302 18321 12188 1 10 . 1 1 2 2 SER CA C 2 58.326 58.326 56.931 1.395 18321 12189 1 10 . 1 1 2 2 SER CB C 2 64.062 64.062 63.829 0.233 18321 12190 1 10 . 1 1 3 3 SER HA H 3 4.465 4.465 4.432 0.033 18321 12191 1 10 . 1 1 3 3 SER C C 3 173.887 173.887 174.484 -0.597 18321 12192 1 10 . 1 1 3 3 SER CA C 3 58.374 58.374 58.955 -0.581 18321 12193 1 10 . 1 1 3 3 SER CB C 3 63.920 63.920 63.827 0.093 18321 12194 1 10 . 1 1 4 4 ALA N N 4 124.755 124.755 124.585 0.170 18321 12195 1 10 . 1 1 4 4 ALA HA H 4 4.547 4.547 4.462 0.085 18321 12196 1 10 . 1 1 4 4 ALA CA C 4 52.737 52.737 52.532 0.205 18321 12197 1 10 . 1 1 4 4 ALA CB C 4 19.636 19.636 19.900 -0.264 18321 12198 1 10 . 1 1 4 4 ALA H H 4 8.244 8.244 7.877 0.367 18321 12199 1 10 . 1 1 5 5 ARG N N 5 120.383 120.383 126.391 -6.008 18321 12200 1 10 . 1 1 5 5 ARG HA H 5 4.524 4.524 4.675 -0.151 18321 12201 1 10 . 1 1 5 5 ARG C C 5 175.611 175.611 174.408 1.203 18321 12202 1 10 . 1 1 5 5 ARG CA C 5 56.082 56.082 56.548 -0.466 18321 12203 1 10 . 1 1 5 5 ARG CB C 5 30.695 30.695 32.080 -1.385 18321 12204 1 10 . 1 1 5 5 ARG H H 5 8.727 8.727 8.912 -0.185 18321 12205 1 10 . 1 1 6 6 PHE N N 6 115.159 115.159 119.238 -4.079 18321 12206 1 10 . 1 1 6 6 PHE HA H 6 4.786 4.786 4.841 -0.055 18321 12207 1 10 . 1 1 6 6 PHE C C 6 172.076 172.076 173.556 -1.480 18321 12208 1 10 . 1 1 6 6 PHE CA C 6 56.640 56.640 56.253 0.387 18321 12209 1 10 . 1 1 6 6 PHE CB C 6 40.378 40.378 39.998 0.380 18321 12210 1 10 . 1 1 6 6 PHE H H 6 7.536 7.536 7.878 -0.342 18321 12211 1 10 . 1 1 7 7 ASP N N 7 121.846 121.846 120.859 0.987 18321 12212 1 10 . 1 1 7 7 ASP HA H 7 4.846 4.846 4.792 0.054 18321 12213 1 10 . 1 1 7 7 ASP CA C 7 52.327 52.327 53.397 -1.069 18321 12214 1 10 . 1 1 7 7 ASP CB C 7 41.298 41.298 42.191 -0.893 18321 12215 1 10 . 1 1 7 7 ASP H H 7 9.062 9.062 8.873 0.189 18321 12216 1 10 . 1 1 8 8 SER HA H 8 3.950 3.950 4.563 -0.613 18321 12217 1 10 . 1 1 8 8 SER C C 8 174.705 174.705 174.089 0.616 18321 12218 1 10 . 1 1 8 8 SER CA C 8 61.937 61.937 59.525 2.412 18321 12219 1 10 . 1 1 8 8 SER CB C 8 62.260 62.260 63.856 -1.596 18321 12220 1 10 . 1 1 9 9 SER N N 9 114.373 114.373 116.193 -1.820 18321 12221 1 10 . 1 1 9 9 SER HA H 9 4.529 4.529 5.373 -0.844 18321 12222 1 10 . 1 1 9 9 SER C C 9 175.089 175.089 173.786 1.303 18321 12223 1 10 . 1 1 9 9 SER CA C 9 59.851 59.851 59.069 0.782 18321 12224 1 10 . 1 1 9 9 SER CB C 9 64.246 64.246 64.598 -0.352 18321 12225 1 10 . 1 1 9 9 SER H H 9 8.722 8.722 8.531 0.191 18321 12226 1 10 . 1 1 10 10 ASP N N 10 121.818 121.818 124.281 -2.463 18321 12227 1 10 . 1 1 10 10 ASP HA H 10 4.730 4.730 4.337 0.393 18321 12228 1 10 . 1 1 10 10 ASP C C 10 174.455 174.455 177.375 -2.920 18321 12229 1 10 . 1 1 10 10 ASP CA C 10 52.432 52.432 55.363 -2.931 18321 12230 1 10 . 1 1 10 10 ASP CB C 10 39.607 39.607 40.625 -1.018 18321 12231 1 10 . 1 1 10 10 ASP H H 10 7.600 7.600 8.366 -0.766 18321 12232 1 10 . 1 1 11 11 ARG N N 11 125.238 125.238 121.443 3.795 18321 12233 1 10 . 1 1 11 11 ARG HA H 11 1.936 1.936 3.043 -1.107 18321 12234 1 10 . 1 1 11 11 ARG C C 11 176.916 176.916 177.137 -0.221 18321 12235 1 10 . 1 1 11 11 ARG CA C 11 57.451 57.451 58.703 -1.252 18321 12236 1 10 . 1 1 11 11 ARG CB C 11 43.014 43.014 28.487 14.527 18321 12237 1 10 . 1 1 11 11 ARG H H 11 7.739 7.739 8.640 -0.901 18321 12238 1 10 . 1 1 12 12 SER N N 12 112.065 112.065 114.004 -1.939 18321 12239 1 10 . 1 1 12 12 SER HA H 12 4.695 4.695 4.476 0.219 18321 12240 1 10 . 1 1 12 12 SER C C 12 175.092 175.092 174.984 0.108 18321 12241 1 10 . 1 1 12 12 SER CA C 12 60.785 60.785 59.615 1.170 18321 12242 1 10 . 1 1 12 12 SER CB C 12 62.889 62.889 62.537 0.352 18321 12243 1 10 . 1 1 12 12 SER H H 12 7.888 7.888 7.908 -0.020 18321 12244 1 10 . 1 1 13 13 ALA N N 13 122.249 122.249 124.283 -2.034 18321 12245 1 10 . 1 1 13 13 ALA HA H 13 4.216 4.216 4.340 -0.124 18321 12246 1 10 . 1 1 13 13 ALA C C 13 178.069 178.069 177.331 0.738 18321 12247 1 10 . 1 1 13 13 ALA CA C 13 53.562 53.562 53.471 0.091 18321 12248 1 10 . 1 1 13 13 ALA CB C 13 19.339 19.339 19.557 -0.218 18321 12249 1 10 . 1 1 13 13 ALA H H 13 7.418 7.418 7.562 -0.144 18321 12250 1 10 . 1 1 14 14 TRP N N 14 107.433 107.433 113.212 -5.779 18321 12251 1 10 . 1 1 14 14 TRP HA H 14 4.785 4.785 4.672 0.113 18321 12252 1 10 . 1 1 14 14 TRP C C 14 175.286 175.286 175.492 -0.206 18321 12253 1 10 . 1 1 14 14 TRP CA C 14 55.212 55.212 56.348 -1.136 18321 12254 1 10 . 1 1 14 14 TRP CB C 14 32.776 32.776 31.081 1.695 18321 12255 1 10 . 1 1 14 14 TRP H H 14 6.273 6.273 7.386 -1.113 18321 12256 1 10 . 1 1 15 15 TYR N N 15 122.315 122.315 125.151 -2.836 18321 12257 1 10 . 1 1 15 15 TYR HA H 15 5.436 5.436 4.852 0.584 18321 12258 1 10 . 1 1 15 15 TYR C C 15 175.325 175.325 174.749 0.576 18321 12259 1 10 . 1 1 15 15 TYR CA C 15 56.609 56.609 59.258 -2.650 18321 12260 1 10 . 1 1 15 15 TYR CB C 15 36.940 36.940 37.932 -0.993 18321 12261 1 10 . 1 1 15 15 TYR H H 15 8.221 8.221 7.872 0.349 18321 12262 1 10 . 1 1 16 16 MET N N 16 126.031 126.031 128.273 -2.242 18321 12263 1 10 . 1 1 16 16 MET HA H 16 4.462 4.462 4.439 0.023 18321 12264 1 10 . 1 1 16 16 MET CA C 16 53.046 53.046 52.294 0.752 18321 12265 1 10 . 1 1 16 16 MET CB C 16 41.114 41.114 33.674 7.440 18321 12266 1 10 . 1 1 16 16 MET H H 16 8.989 8.989 8.494 0.495 18321 12267 1 10 . 1 1 17 17 GLY CA C 17 45.803 45.803 45.397 0.406 18321 12268 1 10 . 1 1 18 18 PRO HA H 18 4.675 4.675 4.531 0.144 18321 12269 1 10 . 1 1 18 18 PRO C C 18 175.943 175.943 175.233 0.710 18321 12270 1 10 . 1 1 18 18 PRO CA C 18 63.647 63.647 63.375 0.272 18321 12271 1 10 . 1 1 18 18 PRO CB C 18 29.276 29.276 31.362 -2.086 18321 12272 1 10 . 1 1 19 19 VAL N N 19 126.159 126.159 123.613 2.546 18321 12273 1 10 . 1 1 19 19 VAL HA H 19 4.011 4.011 4.120 -0.109 18321 12274 1 10 . 1 1 19 19 VAL C C 19 175.812 175.812 175.575 0.237 18321 12275 1 10 . 1 1 19 19 VAL CA C 19 62.355 62.355 61.778 0.577 18321 12276 1 10 . 1 1 19 19 VAL CB C 19 33.468 33.468 34.048 -0.580 18321 12277 1 10 . 1 1 19 19 VAL H H 19 7.851 7.851 7.915 -0.064 18321 12278 1 10 . 1 1 20 20 SER N N 20 123.950 123.950 111.450 12.500 18321 12279 1 10 . 1 1 20 20 SER HA H 20 4.453 4.453 4.047 0.406 18321 12280 1 10 . 1 1 20 20 SER CA C 20 57.631 57.631 58.534 -0.903 18321 12281 1 10 . 1 1 20 20 SER CB C 20 65.951 65.951 63.031 2.920 18321 12282 1 10 . 1 1 20 20 SER H H 20 8.800 8.800 8.392 0.408 18321 12283 1 10 . 1 1 21 21 ARG N N 21 123.461 123.461 121.670 1.791 18321 12284 1 10 . 1 1 21 21 ARG HA H 21 3.489 3.489 3.949 -0.460 18321 12285 1 10 . 1 1 21 21 ARG C C 21 178.164 178.164 178.572 -0.408 18321 12286 1 10 . 1 1 21 21 ARG CA C 21 60.025 60.025 59.083 0.942 18321 12287 1 10 . 1 1 21 21 ARG CB C 21 30.334 30.334 29.960 0.374 18321 12288 1 10 . 1 1 21 21 ARG H H 21 9.307 9.307 8.828 0.479 18321 12289 1 10 . 1 1 22 22 GLN N N 22 116.591 116.591 119.040 -2.449 18321 12290 1 10 . 1 1 22 22 GLN HA H 22 4.008 4.008 4.073 -0.065 18321 12291 1 10 . 1 1 22 22 GLN CA C 22 59.095 59.095 58.628 0.467 18321 12292 1 10 . 1 1 22 22 GLN CB C 22 29.249 29.249 27.857 1.392 18321 12293 1 10 . 1 1 22 22 GLN H H 22 8.394 8.394 8.168 0.226 18321 12294 1 10 . 1 1 23 23 GLU N N 23 122.191 122.191 120.304 1.887 18321 12295 1 10 . 1 1 23 23 GLU HA H 23 4.037 4.037 4.031 0.006 18321 12296 1 10 . 1 1 23 23 GLU C C 23 178.986 178.986 179.070 -0.084 18321 12297 1 10 . 1 1 23 23 GLU CA C 23 59.081 59.081 58.518 0.563 18321 12298 1 10 . 1 1 23 23 GLU CB C 23 31.896 31.896 29.087 2.809 18321 12299 1 10 . 1 1 23 23 GLU H H 23 8.106 8.106 7.666 0.440 18321 12300 1 10 . 1 1 24 24 ALA N N 24 121.964 121.964 121.190 0.774 18321 12301 1 10 . 1 1 24 24 ALA HA H 24 3.762 3.762 3.981 -0.219 18321 12302 1 10 . 1 1 24 24 ALA C C 24 178.653 178.653 179.641 -0.988 18321 12303 1 10 . 1 1 24 24 ALA CA C 24 55.480 55.480 55.303 0.177 18321 12304 1 10 . 1 1 24 24 ALA CB C 24 18.049 18.049 18.377 -0.328 18321 12305 1 10 . 1 1 24 24 ALA H H 24 8.732 8.732 7.852 0.880 18321 12306 1 10 . 1 1 25 25 GLN N N 25 116.229 116.229 118.036 -1.807 18321 12307 1 10 . 1 1 25 25 GLN HA H 25 3.950 3.950 4.129 -0.179 18321 12308 1 10 . 1 1 25 25 GLN C C 25 177.442 177.442 178.867 -1.425 18321 12309 1 10 . 1 1 25 25 GLN CA C 25 59.651 59.651 58.345 1.306 18321 12310 1 10 . 1 1 25 25 GLN CB C 25 29.308 29.308 28.277 1.031 18321 12311 1 10 . 1 1 25 25 GLN H H 25 8.391 8.391 7.801 0.590 18321 12312 1 10 . 1 1 26 26 THR N N 26 115.105 115.105 115.353 -0.248 18321 12313 1 10 . 1 1 26 26 THR HA H 26 3.920 3.920 4.175 -0.255 18321 12314 1 10 . 1 1 26 26 THR C C 26 176.835 176.835 176.029 0.806 18321 12315 1 10 . 1 1 26 26 THR CA C 26 66.335 66.335 64.435 1.900 18321 12316 1 10 . 1 1 26 26 THR CB C 26 68.876 68.876 68.815 0.061 18321 12317 1 10 . 1 1 26 26 THR H H 26 8.223 8.223 7.940 0.283 18321 12318 1 10 . 1 1 27 27 ARG N N 27 119.096 119.096 116.534 2.562 18321 12319 1 10 . 1 1 27 27 ARG HA H 27 4.047 4.047 4.452 -0.405 18321 12320 1 10 . 1 1 27 27 ARG C C 27 177.245 177.245 176.407 0.838 18321 12321 1 10 . 1 1 27 27 ARG CA C 27 58.528 58.528 57.092 1.436 18321 12322 1 10 . 1 1 27 27 ARG CB C 27 30.184 30.184 30.932 -0.748 18321 12323 1 10 . 1 1 27 27 ARG H H 27 8.093 8.093 7.905 0.188 18321 12324 1 10 . 1 1 28 28 LEU N N 28 114.602 114.602 119.355 -4.753 18321 12325 1 10 . 1 1 28 28 LEU HA H 28 4.325 4.325 4.620 -0.295 18321 12326 1 10 . 1 1 28 28 LEU C C 28 177.197 177.197 176.332 0.865 18321 12327 1 10 . 1 1 28 28 LEU CA C 28 55.143 55.143 53.569 1.573 18321 12328 1 10 . 1 1 28 28 LEU CB C 28 44.902 44.902 42.668 2.234 18321 12329 1 10 . 1 1 28 28 LEU H H 28 7.438 7.438 7.482 -0.044 18321 12330 1 10 . 1 1 29 29 GLN N N 29 121.312 121.312 121.290 0.022 18321 12331 1 10 . 1 1 29 29 GLN HA H 29 3.856 3.856 4.421 -0.565 18321 12332 1 10 . 1 1 29 29 GLN C C 29 178.048 178.048 176.891 1.157 18321 12333 1 10 . 1 1 29 29 GLN CA C 29 57.691 57.691 55.243 2.448 18321 12334 1 10 . 1 1 29 29 GLN CB C 29 27.293 27.293 26.696 0.597 18321 12335 1 10 . 1 1 29 29 GLN H H 29 8.250 8.250 7.860 0.390 18321 12336 1 10 . 1 1 30 30 GLY N N 30 116.768 116.768 114.702 2.066 18321 12337 1 10 . 1 1 30 30 GLY C C 30 174.914 174.914 174.320 0.594 18321 12338 1 10 . 1 1 30 30 GLY CA C 30 45.491 45.491 46.083 -0.592 18321 12339 1 10 . 1 1 30 30 GLY H H 30 9.135 9.135 8.993 0.142 18321 12340 1 10 . 1 1 31 31 GLN N N 31 117.979 117.979 120.392 -2.413 18321 12341 1 10 . 1 1 31 31 GLN HA H 31 4.329 4.329 3.702 0.627 18321 12342 1 10 . 1 1 31 31 GLN C C 31 177.174 177.174 176.469 0.705 18321 12343 1 10 . 1 1 31 31 GLN CA C 31 53.910 53.910 58.389 -4.479 18321 12344 1 10 . 1 1 31 31 GLN CB C 31 29.574 29.574 27.989 1.585 18321 12345 1 10 . 1 1 31 31 GLN H H 31 7.695 7.695 8.141 -0.446 18321 12346 1 10 . 1 1 32 32 ARG N N 32 123.918 123.918 118.991 4.927 18321 12347 1 10 . 1 1 32 32 ARG HA H 32 3.940 3.940 4.357 -0.417 18321 12348 1 10 . 1 1 32 32 ARG C C 32 175.810 175.810 175.829 -0.019 18321 12349 1 10 . 1 1 32 32 ARG CA C 32 56.770 56.770 55.720 1.050 18321 12350 1 10 . 1 1 32 32 ARG CB C 32 30.074 30.074 32.163 -2.089 18321 12351 1 10 . 1 1 32 32 ARG H H 32 8.955 8.955 8.049 0.906 18321 12352 1 10 . 1 1 33 33 HIS N N 33 122.248 122.248 115.196 7.052 18321 12353 1 10 . 1 1 33 33 HIS HA H 33 4.627 4.627 4.331 0.296 18321 12354 1 10 . 1 1 33 33 HIS C C 33 177.089 177.089 175.920 1.169 18321 12355 1 10 . 1 1 33 33 HIS CA C 33 55.858 55.858 56.611 -0.752 18321 12356 1 10 . 1 1 33 33 HIS CB C 33 28.648 28.648 29.110 -0.462 18321 12357 1 10 . 1 1 33 33 HIS H H 33 8.302 8.302 8.153 0.149 18321 12358 1 10 . 1 1 34 34 GLY N N 34 109.518 109.518 103.917 5.601 18321 12359 1 10 . 1 1 34 34 GLY C C 34 176.730 176.730 173.723 3.007 18321 12360 1 10 . 1 1 34 34 GLY CA C 34 45.967 45.967 45.660 0.307 18321 12361 1 10 . 1 1 34 34 GLY H H 34 9.496 9.496 8.761 0.735 18321 12362 1 10 . 1 1 35 35 MET N N 35 125.193 125.193 120.833 4.360 18321 12363 1 10 . 1 1 35 35 MET HA H 35 5.750 5.750 5.680 0.070 18321 12364 1 10 . 1 1 35 35 MET C C 35 174.388 174.388 175.154 -0.766 18321 12365 1 10 . 1 1 35 35 MET CA C 35 55.762 55.762 55.691 0.071 18321 12366 1 10 . 1 1 35 35 MET CB C 35 32.706 32.706 33.918 -1.212 18321 12367 1 10 . 1 1 35 35 MET H H 35 8.359 8.359 7.343 1.016 18321 12368 1 10 . 1 1 36 36 PHE N N 36 123.311 123.311 118.682 4.629 18321 12369 1 10 . 1 1 36 36 PHE HA H 36 5.985 5.985 5.941 0.044 18321 12370 1 10 . 1 1 36 36 PHE C C 36 172.140 172.140 173.000 -0.860 18321 12371 1 10 . 1 1 36 36 PHE CA C 36 55.755 55.755 55.112 0.643 18321 12372 1 10 . 1 1 36 36 PHE CB C 36 45.197 45.197 43.078 2.119 18321 12373 1 10 . 1 1 36 36 PHE H H 36 8.261 8.261 8.554 -0.293 18321 12374 1 10 . 1 1 37 37 LEU N N 37 114.652 114.652 115.349 -0.697 18321 12375 1 10 . 1 1 37 37 LEU HA H 37 4.489 4.489 5.046 -0.557 18321 12376 1 10 . 1 1 37 37 LEU C C 37 174.033 174.033 174.876 -0.843 18321 12377 1 10 . 1 1 37 37 LEU CA C 37 55.382 55.382 54.564 0.818 18321 12378 1 10 . 1 1 37 37 LEU CB C 37 44.791 44.791 45.667 -0.876 18321 12379 1 10 . 1 1 37 37 LEU H H 37 9.292 9.292 8.691 0.601 18321 12380 1 10 . 1 1 38 38 VAL N N 38 121.009 121.009 122.366 -1.357 18321 12381 1 10 . 1 1 38 38 VAL HA H 38 5.504 5.504 4.630 0.874 18321 12382 1 10 . 1 1 38 38 VAL C C 38 173.581 173.581 174.737 -1.156 18321 12383 1 10 . 1 1 38 38 VAL CA C 38 61.316 61.316 61.657 -0.341 18321 12384 1 10 . 1 1 38 38 VAL CB C 38 33.302 33.302 33.365 -0.063 18321 12385 1 10 . 1 1 38 38 VAL H H 38 8.991 8.991 8.492 0.499 18321 12386 1 10 . 1 1 39 39 ARG N N 39 124.863 124.863 127.439 -2.576 18321 12387 1 10 . 1 1 39 39 ARG HA H 39 5.444 5.444 4.383 1.061 18321 12388 1 10 . 1 1 39 39 ARG C C 39 175.772 175.772 174.367 1.405 18321 12389 1 10 . 1 1 39 39 ARG CA C 39 52.558 52.558 52.958 -0.400 18321 12390 1 10 . 1 1 39 39 ARG CB C 39 34.980 34.980 32.908 2.072 18321 12391 1 10 . 1 1 39 39 ARG H H 39 9.569 9.569 8.031 1.538 18321 12392 1 10 . 1 1 40 40 ASP N N 40 122.330 122.330 120.994 1.336 18321 12393 1 10 . 1 1 40 40 ASP HA H 40 4.785 4.785 5.003 -0.218 18321 12394 1 10 . 1 1 40 40 ASP C C 40 176.332 176.332 175.782 0.550 18321 12395 1 10 . 1 1 40 40 ASP CA C 40 55.334 55.334 56.210 -0.876 18321 12396 1 10 . 1 1 40 40 ASP CB C 40 40.650 40.650 41.053 -0.403 18321 12397 1 10 . 1 1 40 40 ASP H H 40 8.413 8.413 8.322 0.091 18321 12398 1 10 . 1 1 41 41 SER N N 41 114.363 114.363 118.087 -3.724 18321 12399 1 10 . 1 1 41 41 SER HA H 41 4.506 4.506 4.527 -0.021 18321 12400 1 10 . 1 1 41 41 SER CA C 41 57.525 57.525 57.676 -0.151 18321 12401 1 10 . 1 1 41 41 SER CB C 41 63.706 63.706 64.291 -0.585 18321 12402 1 10 . 1 1 41 41 SER H H 41 7.791 7.791 8.319 -0.528 18321 12403 1 10 . 1 1 42 42 SER N N 42 126.932 126.932 120.406 6.526 18321 12404 1 10 . 1 1 42 42 SER HA H 42 4.410 4.410 4.501 -0.091 18321 12405 1 10 . 1 1 42 42 SER CA C 42 60.362 60.362 60.333 0.029 18321 12406 1 10 . 1 1 42 42 SER CB C 42 63.707 63.707 63.499 0.208 18321 12407 1 10 . 1 1 42 42 SER H H 42 10.519 10.519 8.779 1.740 18321 12408 1 10 . 1 1 43 43 THR HA H 43 4.097 4.097 4.332 -0.235 18321 12409 1 10 . 1 1 43 43 THR CA C 43 64.722 64.722 63.129 1.593 18321 12410 1 10 . 1 1 43 43 THR CB C 43 69.439 69.439 69.683 -0.244 18321 12411 1 10 . 1 1 44 44 CYS HA H 44 5.100 5.100 4.996 0.104 18321 12412 1 10 . 1 1 44 44 CYS CA C 44 51.779 51.779 55.115 -3.336 18321 12413 1 10 . 1 1 44 44 CYS CB C 44 41.314 41.314 29.139 12.175 18321 12414 1 10 . 1 1 45 45 PRO HA H 45 4.278 4.278 4.604 -0.326 18321 12415 1 10 . 1 1 45 45 PRO C C 45 178.127 178.127 176.796 1.331 18321 12416 1 10 . 1 1 45 45 PRO CA C 45 64.151 64.151 63.746 0.405 18321 12417 1 10 . 1 1 45 45 PRO CB C 45 31.596 31.596 31.788 -0.192 18321 12418 1 10 . 1 1 46 46 GLY N N 46 114.947 114.947 106.238 8.709 18321 12419 1 10 . 1 1 46 46 GLY C C 46 174.701 174.701 173.628 1.073 18321 12420 1 10 . 1 1 46 46 GLY CA C 46 45.225 45.225 44.698 0.527 18321 12421 1 10 . 1 1 46 46 GLY H H 46 8.812 8.812 7.866 0.946 18321 12422 1 10 . 1 1 47 47 ASP N N 47 120.862 120.862 119.656 1.206 18321 12423 1 10 . 1 1 47 47 ASP HA H 47 5.235 5.235 4.957 0.278 18321 12424 1 10 . 1 1 47 47 ASP C C 47 176.480 176.480 174.406 2.074 18321 12425 1 10 . 1 1 47 47 ASP CA C 47 53.591 53.591 52.838 0.753 18321 12426 1 10 . 1 1 47 47 ASP CB C 47 41.707 41.707 44.118 -2.411 18321 12427 1 10 . 1 1 47 47 ASP H H 47 7.997 7.997 7.733 0.264 18321 12428 1 10 . 1 1 48 48 TYR N N 48 118.473 118.473 116.970 1.503 18321 12429 1 10 . 1 1 48 48 TYR HA H 48 5.431 5.431 5.443 -0.012 18321 12430 1 10 . 1 1 48 48 TYR C C 48 173.783 173.783 176.081 -2.298 18321 12431 1 10 . 1 1 48 48 TYR CA C 48 56.891 56.891 55.984 0.907 18321 12432 1 10 . 1 1 48 48 TYR CB C 48 43.274 43.274 42.517 0.757 18321 12433 1 10 . 1 1 48 48 TYR H H 48 8.892 8.892 9.299 -0.407 18321 12434 1 10 . 1 1 49 49 VAL N N 49 119.105 119.105 119.207 -0.102 18321 12435 1 10 . 1 1 49 49 VAL HA H 49 4.800 4.800 4.491 0.309 18321 12436 1 10 . 1 1 49 49 VAL C C 49 174.397 174.397 174.331 0.066 18321 12437 1 10 . 1 1 49 49 VAL CA C 49 61.439 61.439 62.377 -0.938 18321 12438 1 10 . 1 1 49 49 VAL CB C 49 35.388 35.388 33.780 1.608 18321 12439 1 10 . 1 1 49 49 VAL H H 49 9.661 9.661 8.733 0.928 18321 12440 1 10 . 1 1 50 50 LEU N N 50 129.599 129.599 130.168 -0.569 18321 12441 1 10 . 1 1 50 50 LEU HA H 50 5.033 5.033 5.173 -0.140 18321 12442 1 10 . 1 1 50 50 LEU C C 50 175.001 175.001 175.825 -0.824 18321 12443 1 10 . 1 1 50 50 LEU CA C 50 53.352 53.352 54.178 -0.826 18321 12444 1 10 . 1 1 50 50 LEU CB C 50 44.062 44.062 42.157 1.905 18321 12445 1 10 . 1 1 50 50 LEU H H 50 9.405 9.405 8.644 0.761 18321 12446 1 10 . 1 1 51 51 SER N N 51 126.895 126.895 124.264 2.631 18321 12447 1 10 . 1 1 51 51 SER HA H 51 5.731 5.731 5.269 0.462 18321 12448 1 10 . 1 1 51 51 SER C C 51 173.094 173.094 173.854 -0.760 18321 12449 1 10 . 1 1 51 51 SER CA C 51 58.834 58.834 57.591 1.243 18321 12450 1 10 . 1 1 51 51 SER CB C 51 64.977 64.977 64.103 0.874 18321 12451 1 10 . 1 1 51 51 SER H H 51 9.094 9.094 8.984 0.110 18321 12452 1 10 . 1 1 52 52 VAL N N 52 121.777 121.777 125.892 -4.115 18321 12453 1 10 . 1 1 52 52 VAL HA H 52 5.066 5.066 4.805 0.261 18321 12454 1 10 . 1 1 52 52 VAL C C 52 174.573 174.573 174.235 0.338 18321 12455 1 10 . 1 1 52 52 VAL CA C 52 59.535 59.535 60.697 -1.162 18321 12456 1 10 . 1 1 52 52 VAL CB C 52 36.834 36.834 35.735 1.099 18321 12457 1 10 . 1 1 52 52 VAL H H 52 8.816 8.816 8.940 -0.124 18321 12458 1 10 . 1 1 53 53 SER N N 53 120.489 120.489 120.844 -0.355 18321 12459 1 10 . 1 1 53 53 SER HA H 53 4.811 4.811 5.091 -0.280 18321 12460 1 10 . 1 1 53 53 SER C C 53 174.065 174.065 173.134 0.931 18321 12461 1 10 . 1 1 53 53 SER CA C 53 57.496 57.496 57.344 0.151 18321 12462 1 10 . 1 1 53 53 SER CB C 53 62.623 62.623 64.093 -1.470 18321 12463 1 10 . 1 1 53 53 SER H H 53 8.780 8.780 9.117 -0.337 18321 12464 1 10 . 1 1 54 54 GLU N N 54 132.020 132.020 126.689 5.331 18321 12465 1 10 . 1 1 54 54 GLU HA H 54 4.250 4.250 4.512 -0.262 18321 12466 1 10 . 1 1 54 54 GLU C C 54 175.387 175.387 175.701 -0.314 18321 12467 1 10 . 1 1 54 54 GLU CA C 54 56.999 56.999 56.005 0.994 18321 12468 1 10 . 1 1 54 54 GLU CB C 54 32.556 32.556 34.073 -1.517 18321 12469 1 10 . 1 1 54 54 GLU H H 54 8.472 8.472 8.478 -0.006 18321 12470 1 10 . 1 1 55 55 ASN N N 55 126.517 126.517 119.620 6.897 18321 12471 1 10 . 1 1 55 55 ASN HA H 55 4.220 4.220 4.267 -0.047 18321 12472 1 10 . 1 1 55 55 ASN C C 55 174.546 174.546 174.616 -0.070 18321 12473 1 10 . 1 1 55 55 ASN CA C 55 54.770 54.770 54.592 0.178 18321 12474 1 10 . 1 1 55 55 ASN CB C 55 37.314 37.314 37.734 -0.420 18321 12475 1 10 . 1 1 55 55 ASN H H 55 8.853 8.853 8.673 0.180 18321 12476 1 10 . 1 1 56 56 SER N N 56 112.009 112.009 107.489 4.520 18321 12477 1 10 . 1 1 56 56 SER HA H 56 4.334 4.334 4.044 0.290 18321 12478 1 10 . 1 1 56 56 SER C C 56 173.354 173.354 172.960 0.394 18321 12479 1 10 . 1 1 56 56 SER CA C 56 59.966 59.966 59.959 0.007 18321 12480 1 10 . 1 1 56 56 SER CB C 56 62.242 62.242 62.343 -0.101 18321 12481 1 10 . 1 1 56 56 SER H H 56 10.418 10.418 8.421 1.997 18321 12482 1 10 . 1 1 57 57 ARG N N 57 121.764 121.764 115.951 5.813 18321 12483 1 10 . 1 1 57 57 ARG HA H 57 5.167 5.167 4.679 0.488 18321 12484 1 10 . 1 1 57 57 ARG C C 57 174.983 174.983 174.343 0.640 18321 12485 1 10 . 1 1 57 57 ARG CA C 57 54.550 54.550 53.686 0.864 18321 12486 1 10 . 1 1 57 57 ARG CB C 57 31.886 31.886 33.281 -1.395 18321 12487 1 10 . 1 1 57 57 ARG H H 57 8.097 8.097 7.520 0.577 18321 12488 1 10 . 1 1 58 58 VAL N N 58 121.866 121.866 123.027 -1.161 18321 12489 1 10 . 1 1 58 58 VAL HA H 58 4.768 4.768 4.458 0.310 18321 12490 1 10 . 1 1 58 58 VAL C C 58 175.388 175.388 174.835 0.553 18321 12491 1 10 . 1 1 58 58 VAL CA C 58 61.818 61.818 61.298 0.520 18321 12492 1 10 . 1 1 58 58 VAL CB C 58 34.135 34.135 31.346 2.789 18321 12493 1 10 . 1 1 58 58 VAL H H 58 8.081 8.081 8.074 0.007 18321 12494 1 10 . 1 1 59 59 SER N N 59 124.445 124.445 121.568 2.877 18321 12495 1 10 . 1 1 59 59 SER HA H 59 4.462 4.462 4.148 0.314 18321 12496 1 10 . 1 1 59 59 SER C C 59 172.185 172.185 172.984 -0.799 18321 12497 1 10 . 1 1 59 59 SER CA C 59 56.629 56.629 57.811 -1.182 18321 12498 1 10 . 1 1 59 59 SER CB C 59 66.218 66.218 63.177 3.041 18321 12499 1 10 . 1 1 59 59 SER H H 59 9.082 9.082 8.338 0.744 18321 12500 1 10 . 1 1 60 60 HIS N N 60 121.224 121.224 127.450 -6.226 18321 12501 1 10 . 1 1 60 60 HIS HA H 60 4.885 4.885 4.538 0.347 18321 12502 1 10 . 1 1 60 60 HIS C C 60 174.674 174.674 174.557 0.117 18321 12503 1 10 . 1 1 60 60 HIS CA C 60 54.900 54.900 55.250 -0.350 18321 12504 1 10 . 1 1 60 60 HIS CB C 60 32.331 32.331 29.359 2.972 18321 12505 1 10 . 1 1 60 60 HIS H H 60 8.331 8.331 8.466 -0.135 18321 12506 1 10 . 1 1 61 61 TYR N N 61 124.780 124.780 125.965 -1.185 18321 12507 1 10 . 1 1 61 61 TYR HA H 61 4.655 4.655 4.776 -0.121 18321 12508 1 10 . 1 1 61 61 TYR CA C 61 57.409 57.409 56.801 0.608 18321 12509 1 10 . 1 1 61 61 TYR CB C 61 39.785 39.785 37.120 2.665 18321 12510 1 10 . 1 1 61 61 TYR H H 61 9.273 9.273 9.098 0.175 18321 12511 1 10 . 1 1 62 62 ILE HA H 62 4.298 4.298 4.232 0.066 18321 12512 1 10 . 1 1 62 62 ILE C C 62 174.817 174.817 175.307 -0.490 18321 12513 1 10 . 1 1 62 62 ILE CA C 62 61.908 61.908 62.169 -0.261 18321 12514 1 10 . 1 1 62 62 ILE CB C 62 38.321 38.321 38.499 -0.178 18321 12515 1 10 . 1 1 63 63 ILE N N 63 128.552 128.552 127.381 1.171 18321 12516 1 10 . 1 1 63 63 ILE HA H 63 4.788 4.788 4.649 0.139 18321 12517 1 10 . 1 1 63 63 ILE C C 63 175.982 175.982 174.990 0.992 18321 12518 1 10 . 1 1 63 63 ILE CA C 63 59.629 59.629 59.973 -0.344 18321 12519 1 10 . 1 1 63 63 ILE CB C 63 39.747 39.747 39.172 0.575 18321 12520 1 10 . 1 1 63 63 ILE H H 63 9.155 9.155 8.660 0.495 18321 12521 1 10 . 1 1 64 64 ASN N N 64 123.240 123.240 127.296 -4.056 18321 12522 1 10 . 1 1 64 64 ASN HA H 64 4.857 4.857 5.219 -0.362 18321 12523 1 10 . 1 1 64 64 ASN C C 64 175.324 175.324 174.147 1.177 18321 12524 1 10 . 1 1 64 64 ASN CA C 64 53.736 53.736 52.999 0.737 18321 12525 1 10 . 1 1 64 64 ASN CB C 64 41.531 41.531 40.286 1.244 18321 12526 1 10 . 1 1 64 64 ASN H H 64 9.379 9.379 9.003 0.376 18321 12527 1 10 . 1 1 65 65 SER N N 65 121.157 121.157 118.947 2.210 18321 12528 1 10 . 1 1 65 65 SER HA H 65 4.548 4.548 4.341 0.207 18321 12529 1 10 . 1 1 65 65 SER C C 65 174.328 174.328 174.380 -0.052 18321 12530 1 10 . 1 1 65 65 SER CA C 65 58.306 58.306 58.238 0.068 18321 12531 1 10 . 1 1 65 65 SER CB C 65 62.878 62.878 63.217 -0.339 18321 12532 1 10 . 1 1 65 65 SER H H 65 9.195 9.195 9.060 0.135 18321 12533 1 10 . 1 1 66 66 LEU N N 66 127.417 127.417 129.021 -1.604 18321 12534 1 10 . 1 1 66 66 LEU HA H 66 4.605 4.605 4.639 -0.034 18321 12535 1 10 . 1 1 66 66 LEU CA C 66 52.888 52.888 52.436 0.452 18321 12536 1 10 . 1 1 66 66 LEU CB C 66 41.799 41.799 41.517 0.282 18321 12537 1 10 . 1 1 66 66 LEU H H 66 8.143 8.143 8.598 -0.456 18321 12538 1 10 . 1 1 68 68 ASN HA H 68 4.386 4.386 4.674 -0.288 18321 12539 1 10 . 1 1 68 68 ASN C C 68 174.487 174.487 175.108 -0.621 18321 12540 1 10 . 1 1 68 68 ASN CA C 68 53.365 53.365 52.908 0.457 18321 12541 1 10 . 1 1 68 68 ASN CB C 68 36.778 36.778 37.754 -0.976 18321 12542 1 10 . 1 1 69 69 ARG N N 69 111.329 111.329 116.748 -5.419 18321 12543 1 10 . 1 1 69 69 ARG HA H 69 3.876 3.876 3.683 0.193 18321 12544 1 10 . 1 1 69 69 ARG CA C 69 57.393 57.393 57.273 0.121 18321 12545 1 10 . 1 1 69 69 ARG CB C 69 26.665 26.665 27.952 -1.287 18321 12546 1 10 . 1 1 69 69 ARG H H 69 8.191 8.191 8.017 0.174 18321 12547 1 10 . 1 1 70 70 ARG N N 70 116.120 116.120 114.276 1.844 18321 12548 1 10 . 1 1 70 70 ARG HA H 70 4.556 4.556 4.825 -0.269 18321 12549 1 10 . 1 1 70 70 ARG C C 70 174.882 174.882 173.754 1.128 18321 12550 1 10 . 1 1 70 70 ARG CA C 70 55.509 55.509 53.222 2.287 18321 12551 1 10 . 1 1 70 70 ARG CB C 70 31.771 31.771 32.955 -1.184 18321 12552 1 10 . 1 1 70 70 ARG H H 70 6.667 6.667 7.157 -0.490 18321 12553 1 10 . 1 1 71 71 PHE N N 71 116.313 116.313 118.608 -2.295 18321 12554 1 10 . 1 1 71 71 PHE HA H 71 5.540 5.540 5.465 0.075 18321 12555 1 10 . 1 1 71 71 PHE C C 71 174.391 174.391 175.460 -1.069 18321 12556 1 10 . 1 1 71 71 PHE CA C 71 57.528 57.528 56.592 0.936 18321 12557 1 10 . 1 1 71 71 PHE CB C 71 44.115 44.115 41.997 2.118 18321 12558 1 10 . 1 1 71 71 PHE H H 71 8.700 8.700 8.371 0.329 18321 12559 1 10 . 1 1 72 72 LYS N N 72 122.770 122.770 126.300 -3.530 18321 12560 1 10 . 1 1 72 72 LYS HA H 72 5.483 5.483 4.973 0.510 18321 12561 1 10 . 1 1 72 72 LYS C C 72 173.923 173.923 175.455 -1.532 18321 12562 1 10 . 1 1 72 72 LYS CA C 72 54.855 54.855 55.113 -0.258 18321 12563 1 10 . 1 1 72 72 LYS CB C 72 37.710 37.710 34.779 2.930 18321 12564 1 10 . 1 1 72 72 LYS H H 72 9.138 9.138 8.785 0.353 18321 12565 1 10 . 1 1 73 73 ILE N N 73 124.576 124.576 129.996 -5.420 18321 12566 1 10 . 1 1 73 73 ILE HA H 73 4.955 4.955 4.598 0.357 18321 12567 1 10 . 1 1 73 73 ILE C C 73 175.728 175.728 176.391 -0.663 18321 12568 1 10 . 1 1 73 73 ILE CA C 73 58.935 58.935 60.831 -1.896 18321 12569 1 10 . 1 1 73 73 ILE CB C 73 40.965 40.965 37.404 3.561 18321 12570 1 10 . 1 1 73 73 ILE H H 73 8.826 8.826 8.778 0.048 18321 12571 1 10 . 1 1 74 74 GLY N N 74 118.718 118.718 118.966 -0.248 18321 12572 1 10 . 1 1 74 74 GLY C C 74 174.436 174.436 174.104 0.332 18321 12573 1 10 . 1 1 74 74 GLY CA C 74 47.401 47.401 46.855 0.547 18321 12574 1 10 . 1 1 74 74 GLY H H 74 9.317 9.317 8.681 0.636 18321 12575 1 10 . 1 1 75 75 ASP N N 75 125.691 125.691 121.751 3.940 18321 12576 1 10 . 1 1 75 75 ASP HA H 75 4.713 4.713 4.816 -0.103 18321 12577 1 10 . 1 1 75 75 ASP C C 75 175.841 175.841 175.412 0.429 18321 12578 1 10 . 1 1 75 75 ASP CA C 75 53.815 53.815 54.422 -0.607 18321 12579 1 10 . 1 1 75 75 ASP CB C 75 41.288 41.288 43.006 -1.718 18321 12580 1 10 . 1 1 75 75 ASP H H 75 8.665 8.665 8.677 -0.012 18321 12581 1 10 . 1 1 76 76 GLN N N 76 120.368 120.368 120.308 0.060 18321 12582 1 10 . 1 1 76 76 GLN C C 76 173.630 173.630 174.511 -0.881 18321 12583 1 10 . 1 1 76 76 GLN CA C 76 54.254 54.254 55.639 -1.385 18321 12584 1 10 . 1 1 76 76 GLN CB C 76 31.248 31.248 29.485 1.763 18321 12585 1 10 . 1 1 76 76 GLN H H 76 8.289 8.289 7.949 0.340 18321 12586 1 10 . 1 1 77 77 GLU N N 77 120.435 120.435 122.183 -1.748 18321 12587 1 10 . 1 1 77 77 GLU C C 77 175.484 175.484 174.767 0.717 18321 12588 1 10 . 1 1 77 77 GLU CA C 77 54.203 54.203 55.134 -0.931 18321 12589 1 10 . 1 1 77 77 GLU CB C 77 33.141 33.141 30.723 2.418 18321 12590 1 10 . 1 1 77 77 GLU H H 77 7.732 7.732 8.251 -0.519 18321 12591 1 10 . 1 1 78 78 PHE N N 78 117.911 117.911 123.247 -5.336 18321 12592 1 10 . 1 1 78 78 PHE HA H 78 4.659 4.659 4.733 -0.074 18321 12593 1 10 . 1 1 78 78 PHE C C 78 175.673 175.673 175.671 0.002 18321 12594 1 10 . 1 1 78 78 PHE CA C 78 57.160 57.160 56.407 0.753 18321 12595 1 10 . 1 1 78 78 PHE CB C 78 45.405 45.405 41.996 3.409 18321 12596 1 10 . 1 1 78 78 PHE H H 78 9.235 9.235 8.445 0.790 18321 12597 1 10 . 1 1 79 79 ASP N N 79 119.296 119.296 117.826 1.470 18321 12598 1 10 . 1 1 79 79 ASP HA H 79 4.462 4.462 4.772 -0.310 18321 12599 1 10 . 1 1 79 79 ASP C C 79 174.482 174.482 175.548 -1.066 18321 12600 1 10 . 1 1 79 79 ASP CA C 79 56.629 56.629 55.303 1.325 18321 12601 1 10 . 1 1 79 79 ASP CB C 79 41.697 41.697 41.392 0.305 18321 12602 1 10 . 1 1 79 79 ASP H H 79 9.187 9.187 8.916 0.271 18321 12603 1 10 . 1 1 80 80 HIS N N 80 107.631 107.631 113.578 -5.947 18321 12604 1 10 . 1 1 80 80 HIS HA H 80 5.022 5.022 5.235 -0.213 18321 12605 1 10 . 1 1 80 80 HIS C C 80 174.626 174.626 175.374 -0.748 18321 12606 1 10 . 1 1 80 80 HIS CA C 80 54.223 54.223 54.609 -0.387 18321 12607 1 10 . 1 1 80 80 HIS CB C 80 32.205 32.205 31.745 0.460 18321 12608 1 10 . 1 1 80 80 HIS H H 80 7.200 7.200 7.150 0.050 18321 12609 1 10 . 1 1 81 81 LEU N N 81 120.710 120.710 121.459 -0.749 18321 12610 1 10 . 1 1 81 81 LEU HA H 81 3.804 3.804 4.167 -0.363 18321 12611 1 10 . 1 1 81 81 LEU CA C 81 58.709 58.709 59.230 -0.521 18321 12612 1 10 . 1 1 81 81 LEU CB C 81 39.646 39.646 40.306 -0.660 18321 12613 1 10 . 1 1 81 81 LEU H H 81 8.886 8.886 9.134 -0.248 18321 12614 1 10 . 1 1 82 82 PRO HA H 82 4.020 4.020 4.054 -0.034 18321 12615 1 10 . 1 1 82 82 PRO C C 82 175.619 175.619 177.225 -1.606 18321 12616 1 10 . 1 1 82 82 PRO CA C 82 67.025 67.025 64.823 2.202 18321 12617 1 10 . 1 1 82 82 PRO CB C 82 30.962 30.962 30.662 0.300 18321 12618 1 10 . 1 1 83 83 ALA N N 83 124.281 124.281 119.619 4.662 18321 12619 1 10 . 1 1 83 83 ALA HA H 83 4.019 4.019 4.342 -0.323 18321 12620 1 10 . 1 1 83 83 ALA C C 83 179.709 179.709 178.319 1.390 18321 12621 1 10 . 1 1 83 83 ALA CA C 83 54.985 54.985 53.507 1.478 18321 12622 1 10 . 1 1 83 83 ALA CB C 83 18.425 18.425 18.352 0.072 18321 12623 1 10 . 1 1 83 83 ALA H H 83 8.527 8.527 7.429 1.098 18321 12624 1 10 . 1 1 84 84 LEU N N 84 122.960 122.960 115.885 7.075 18321 12625 1 10 . 1 1 84 84 LEU HA H 84 1.917 1.917 2.700 -0.783 18321 12626 1 10 . 1 1 84 84 LEU C C 84 177.652 177.652 177.870 -0.218 18321 12627 1 10 . 1 1 84 84 LEU CA C 84 58.261 58.261 56.778 1.483 18321 12628 1 10 . 1 1 84 84 LEU CB C 84 42.544 42.544 41.023 1.521 18321 12629 1 10 . 1 1 84 84 LEU H H 84 6.982 6.982 7.060 -0.078 18321 12630 1 10 . 1 1 85 85 LEU N N 85 117.940 117.940 118.315 -0.375 18321 12631 1 10 . 1 1 85 85 LEU HA H 85 3.463 3.463 3.796 -0.333 18321 12632 1 10 . 1 1 85 85 LEU C C 85 178.809 178.809 178.009 0.800 18321 12633 1 10 . 1 1 85 85 LEU CA C 85 57.522 57.522 57.688 -0.166 18321 12634 1 10 . 1 1 85 85 LEU CB C 85 41.242 41.242 41.404 -0.162 18321 12635 1 10 . 1 1 85 85 LEU H H 85 7.773 7.773 7.365 0.408 18321 12636 1 10 . 1 1 86 86 GLU N N 86 115.762 115.762 116.609 -0.847 18321 12637 1 10 . 1 1 86 86 GLU HA H 86 3.540 3.540 4.004 -0.464 18321 12638 1 10 . 1 1 86 86 GLU C C 86 180.228 180.228 177.652 2.576 18321 12639 1 10 . 1 1 86 86 GLU CA C 86 58.943 58.943 58.198 0.745 18321 12640 1 10 . 1 1 86 86 GLU CB C 86 29.561 29.561 29.706 -0.145 18321 12641 1 10 . 1 1 86 86 GLU H H 86 8.300 8.300 7.719 0.581 18321 12642 1 10 . 1 1 87 87 PHE N N 87 121.135 121.135 120.229 0.906 18321 12643 1 10 . 1 1 87 87 PHE HA H 87 4.122 4.122 4.202 -0.080 18321 12644 1 10 . 1 1 87 87 PHE C C 87 179.497 179.497 176.382 3.115 18321 12645 1 10 . 1 1 87 87 PHE CA C 87 62.090 62.090 59.574 2.516 18321 12646 1 10 . 1 1 87 87 PHE CB C 87 40.103 40.103 39.828 0.276 18321 12647 1 10 . 1 1 87 87 PHE H H 87 7.717 7.717 7.078 0.639 18321 12648 1 10 . 1 1 88 88 TYR N N 88 116.579 116.579 116.836 -0.257 18321 12649 1 10 . 1 1 88 88 TYR HA H 88 4.933 4.933 4.256 0.677 18321 12650 1 10 . 1 1 88 88 TYR C C 88 174.799 174.799 176.725 -1.926 18321 12651 1 10 . 1 1 88 88 TYR CA C 88 61.333 61.333 57.863 3.470 18321 12652 1 10 . 1 1 88 88 TYR CB C 88 36.539 36.539 36.497 0.042 18321 12653 1 10 . 1 1 88 88 TYR H H 88 7.478 7.478 7.823 -0.345 18321 12654 1 10 . 1 1 89 89 LYS N N 89 117.737 117.737 120.330 -2.593 18321 12655 1 10 . 1 1 89 89 LYS HA H 89 4.466 4.466 3.968 0.498 18321 12656 1 10 . 1 1 89 89 LYS C C 89 178.417 178.417 177.365 1.052 18321 12657 1 10 . 1 1 89 89 LYS CA C 89 59.486 59.486 58.737 0.749 18321 12658 1 10 . 1 1 89 89 LYS CB C 89 34.523 34.523 31.576 2.947 18321 12659 1 10 . 1 1 89 89 LYS H H 89 7.505 7.505 7.350 0.155 18321 12660 1 10 . 1 1 90 90 ILE N N 90 110.972 110.972 112.026 -1.054 18321 12661 1 10 . 1 1 90 90 ILE HA H 90 4.181 4.181 4.120 0.061 18321 12662 1 10 . 1 1 90 90 ILE C C 90 174.571 174.571 175.396 -0.825 18321 12663 1 10 . 1 1 90 90 ILE CA C 90 60.516 60.516 62.000 -1.484 18321 12664 1 10 . 1 1 90 90 ILE CB C 90 39.979 39.979 38.757 1.222 18321 12665 1 10 . 1 1 90 90 ILE H H 90 6.710 6.710 6.995 -0.285 18321 12666 1 10 . 1 1 91 91 HIS N N 91 119.479 119.479 119.642 -0.163 18321 12667 1 10 . 1 1 91 91 HIS HA H 91 4.357 4.357 4.601 -0.244 18321 12668 1 10 . 1 1 91 91 HIS C C 91 172.751 172.751 174.074 -1.323 18321 12669 1 10 . 1 1 91 91 HIS CA C 91 55.066 55.066 54.482 0.584 18321 12670 1 10 . 1 1 91 91 HIS CB C 91 29.756 29.756 30.639 -0.883 18321 12671 1 10 . 1 1 91 91 HIS H H 91 7.460 7.460 7.113 0.347 18321 12672 1 10 . 1 1 92 92 TYR N N 92 117.642 117.642 126.173 -8.531 18321 12673 1 10 . 1 1 92 92 TYR HA H 92 4.131 4.131 4.525 -0.394 18321 12674 1 10 . 1 1 92 92 TYR C C 92 177.348 177.348 176.067 1.281 18321 12675 1 10 . 1 1 92 92 TYR CA C 92 58.627 58.627 58.274 0.353 18321 12676 1 10 . 1 1 92 92 TYR CB C 92 39.481 39.481 36.185 3.296 18321 12677 1 10 . 1 1 92 92 TYR H H 92 8.067 8.067 9.226 -1.159 18321 12678 1 10 . 1 1 93 93 LEU N N 93 123.560 123.560 123.681 -0.121 18321 12679 1 10 . 1 1 93 93 LEU HA H 93 4.104 4.104 3.728 0.376 18321 12680 1 10 . 1 1 93 93 LEU C C 93 175.610 175.610 178.201 -2.591 18321 12681 1 10 . 1 1 93 93 LEU CA C 93 56.381 56.381 57.984 -1.603 18321 12682 1 10 . 1 1 93 93 LEU CB C 93 38.896 38.896 41.795 -2.899 18321 12683 1 10 . 1 1 93 93 LEU H H 93 7.907 7.907 8.068 -0.161 18321 12684 1 10 . 1 1 94 94 ASP N N 94 118.194 118.194 113.719 4.475 18321 12685 1 10 . 1 1 94 94 ASP HA H 94 4.940 4.940 4.991 -0.051 18321 12686 1 10 . 1 1 94 94 ASP C C 94 176.123 176.123 177.005 -0.882 18321 12687 1 10 . 1 1 94 94 ASP CA C 94 56.235 56.235 55.614 0.621 18321 12688 1 10 . 1 1 94 94 ASP CB C 94 42.078 42.078 42.397 -0.319 18321 12689 1 10 . 1 1 94 94 ASP H H 94 8.640 8.640 7.724 0.916 18321 12690 1 10 . 1 1 95 95 THR N N 95 105.073 105.073 111.050 -5.977 18321 12691 1 10 . 1 1 95 95 THR HA H 95 4.318 4.318 4.354 -0.036 18321 12692 1 10 . 1 1 95 95 THR C C 95 174.685 174.685 173.493 1.192 18321 12693 1 10 . 1 1 95 95 THR CA C 95 60.756 60.756 62.992 -2.236 18321 12694 1 10 . 1 1 95 95 THR CB C 95 71.058 71.058 69.459 1.599 18321 12695 1 10 . 1 1 95 95 THR H H 95 8.576 8.576 8.144 0.432 18321 12696 1 10 . 1 1 96 96 THR N N 96 116.817 116.817 114.514 2.303 18321 12697 1 10 . 1 1 96 96 THR HA H 96 5.129 5.129 5.112 0.017 18321 12698 1 10 . 1 1 96 96 THR C C 96 172.464 172.464 173.324 -0.860 18321 12699 1 10 . 1 1 96 96 THR CA C 96 60.762 60.762 59.582 1.180 18321 12700 1 10 . 1 1 96 96 THR CB C 96 71.425 71.425 70.310 1.115 18321 12701 1 10 . 1 1 96 96 THR H H 96 8.205 8.205 7.700 0.505 18321 12702 1 10 . 1 1 97 97 THR N N 97 114.324 114.324 112.098 2.226 18321 12703 1 10 . 1 1 97 97 THR HA H 97 5.128 5.128 4.629 0.499 18321 12704 1 10 . 1 1 97 97 THR C C 97 175.480 175.480 174.570 0.910 18321 12705 1 10 . 1 1 97 97 THR CA C 97 60.233 60.233 59.281 0.952 18321 12706 1 10 . 1 1 97 97 THR CB C 97 70.415 70.415 70.954 -0.539 18321 12707 1 10 . 1 1 97 97 THR H H 97 7.128 7.128 8.063 -0.935 18321 12708 1 10 . 1 1 98 98 LEU N N 98 116.674 116.674 121.520 -4.846 18321 12709 1 10 . 1 1 98 98 LEU HA H 98 4.075 4.075 4.059 0.016 18321 12710 1 10 . 1 1 98 98 LEU C C 98 177.892 177.892 176.539 1.353 18321 12711 1 10 . 1 1 98 98 LEU CA C 98 59.597 59.597 55.524 4.073 18321 12712 1 10 . 1 1 98 98 LEU CB C 98 41.172 41.172 40.709 0.464 18321 12713 1 10 . 1 1 98 98 LEU H H 98 8.743 8.743 7.934 0.809 18321 12714 1 10 . 1 1 99 99 ILE N N 99 122.988 122.988 123.415 -0.427 18321 12715 1 10 . 1 1 99 99 ILE HA H 99 4.415 4.415 4.467 -0.052 18321 12716 1 10 . 1 1 99 99 ILE C C 99 175.055 175.055 175.898 -0.843 18321 12717 1 10 . 1 1 99 99 ILE CA C 99 62.183 62.183 61.398 0.785 18321 12718 1 10 . 1 1 99 99 ILE CB C 99 40.252 40.252 39.330 0.922 18321 12719 1 10 . 1 1 99 99 ILE H H 99 8.998 8.998 8.070 0.928 18321 12720 1 10 . 1 1 100 100 GLU N N 100 114.067 114.067 115.738 -1.671 18321 12721 1 10 . 1 1 100 100 GLU CA C 100 52.910 52.910 53.507 -0.597 18321 12722 1 10 . 1 1 100 100 GLU CB C 100 31.155 31.155 31.374 -0.219 18321 12723 1 10 . 1 1 100 100 GLU H H 100 7.332 7.332 8.344 -1.012 18321 12724 1 10 . 1 1 101 101 PRO HA H 101 4.952 4.952 4.373 0.579 18321 12725 1 10 . 1 1 101 101 PRO C C 101 175.976 175.976 175.740 0.236 18321 12726 1 10 . 1 1 101 101 PRO CA C 101 53.312 53.312 61.762 -8.450 18321 12727 1 10 . 1 1 101 101 PRO CB C 101 31.598 31.598 32.697 -1.099 18321 12728 1 10 . 1 1 102 102 ALA N N 102 125.968 125.968 122.313 3.655 18321 12729 1 10 . 1 1 102 102 ALA HA H 102 4.516 4.516 4.534 -0.018 18321 12730 1 10 . 1 1 102 102 ALA CA C 102 49.852 49.852 49.708 0.144 18321 12731 1 10 . 1 1 102 102 ALA CB C 102 17.766 17.766 18.619 -0.853 18321 12732 1 10 . 1 1 102 102 ALA H H 102 8.232 8.232 7.744 0.488 18321 12733 1 10 . 1 1 103 103 PRO HA H 103 4.283 4.283 4.477 -0.194 18321 12734 1 10 . 1 1 103 103 PRO CA C 103 62.435 62.435 62.831 -0.396 18321 12735 1 10 . 1 1 103 103 PRO CB C 103 32.145 32.145 32.539 -0.394 18321 12736 1 10 . 1 1 104 104 ARG HA H 104 4.004 4.004 4.561 -0.557 18321 12737 1 10 . 1 1 104 104 ARG CA C 104 56.660 56.660 55.337 1.323 18321 12738 1 10 . 1 1 106 106 PRO C C 106 174.587 174.587 175.592 -1.005 18321 12739 1 10 . 1 1 106 106 PRO CA C 106 57.867 57.867 62.782 -4.915 18321 12740 1 10 . 1 1 106 106 PRO CB C 106 31.942 31.942 32.782 -0.840 18321 12741 1 10 . 1 1 107 107 SER N N 107 121.280 121.280 116.508 4.772 18321 12742 1 10 . 1 1 107 107 SER CA C 107 61.772 61.772 58.424 3.348 18321 12743 1 10 . 1 1 107 107 SER CB C 107 63.234 63.234 63.033 0.201 18321 12744 1 10 . 1 1 107 107 SER H H 107 8.132 8.132 8.535 -0.403 18321 12745 1 10 . 1 1 109 109 PRO C C 109 177.129 177.129 176.215 0.914 18321 12746 1 10 . 1 1 109 109 PRO CA C 109 62.638 62.638 62.808 -0.170 18321 12747 1 10 . 1 1 109 109 PRO CB C 109 30.970 30.970 32.355 -1.385 18321 12748 1 10 . 1 1 110 110 MET N N 110 120.772 120.772 123.493 -2.721 18321 12749 1 10 . 1 1 110 110 MET C C 110 176.892 176.892 177.997 -1.105 18321 12750 1 10 . 1 1 110 110 MET CA C 110 55.310 55.310 54.869 0.441 18321 12751 1 10 . 1 1 110 110 MET CB C 110 32.202 32.202 35.376 -3.174 18321 12752 1 10 . 1 1 110 110 MET H H 110 8.430 8.430 8.520 -0.090 18321 12753 1 10 . 1 1 111 111 GLY N N 111 110.158 110.158 108.523 1.635 18321 12754 1 10 . 1 1 111 111 GLY C C 111 177.430 177.430 174.092 3.338 18321 12755 1 10 . 1 1 111 111 GLY CA C 111 44.951 44.951 45.320 -0.369 18321 12756 1 10 . 1 1 111 111 GLY H H 111 8.384 8.384 8.678 -0.294 18321 12757 1 10 . 1 1 112 112 SER N N 112 116.762 116.762 112.887 3.875 18321 12758 1 10 . 1 1 112 112 SER CA C 112 55.948 55.948 58.311 -2.363 18321 12759 1 10 . 1 1 112 112 SER CB C 112 62.745 62.745 63.558 -0.813 18321 12760 1 10 . 1 1 112 112 SER H H 112 8.161 8.161 7.797 0.364 18321 12761 1 10 . 1 1 113 113 VAL C C 113 176.083 176.083 176.600 -0.517 18321 12762 1 10 . 1 1 114 114 SER N N 114 119.151 119.151 123.411 -4.260 18321 12763 1 10 . 1 1 114 114 SER C C 114 173.638 173.638 173.801 -0.163 18321 12764 1 10 . 1 1 114 114 SER CA C 114 58.005 58.005 58.427 -0.422 18321 12765 1 10 . 1 1 114 114 SER CB C 114 63.169 63.169 62.167 1.002 18321 12766 1 10 . 1 1 114 114 SER H H 114 8.319 8.319 8.791 -0.472 18321 12767 1 10 . 1 1 115 115 ALA N N 115 126.914 126.914 122.952 3.962 18321 12768 1 10 . 1 1 115 115 ALA CA C 115 51.561 51.561 49.700 1.861 18321 12769 1 10 . 1 1 115 115 ALA CB C 115 17.714 17.714 20.338 -2.624 18321 12770 1 10 . 1 1 115 115 ALA H H 115 8.197 8.197 7.110 1.087 18321 12771 1 10 . 1 1 119 119 PRO C C 119 177.065 177.065 177.614 -0.549 18321 12772 1 10 . 1 1 120 120 THR N N 120 113.976 113.976 108.454 5.522 18321 12773 1 10 . 1 1 120 120 THR C C 120 174.461 174.461 173.030 1.431 18321 12774 1 10 . 1 1 120 120 THR CA C 120 61.215 61.215 63.268 -2.053 18321 12775 1 10 . 1 1 120 120 THR CB C 120 69.508 69.508 70.720 -1.212 18321 12776 1 10 . 1 1 120 120 THR H H 120 8.138 8.138 8.084 0.054 18321 12777 1 10 . 1 1 121 121 ALA N N 121 125.859 125.859 122.069 3.790 18321 12778 1 10 . 1 1 121 121 ALA CA C 121 52.281 52.281 51.636 0.644 18321 12779 1 10 . 1 1 121 121 ALA CB C 121 18.623 18.623 20.733 -2.110 18321 12780 1 10 . 1 1 121 121 ALA H H 121 8.272 8.272 7.805 0.467 18321 12781 1 10 . 1 1 122 122 GLU C C 122 176.316 176.316 177.179 -0.863 18321 12782 1 10 . 1 1 123 123 ASP N N 123 120.448 120.448 119.632 0.816 18321 12783 1 10 . 1 1 123 123 ASP C C 123 175.906 175.906 174.679 1.227 18321 12784 1 10 . 1 1 123 123 ASP CA C 123 54.167 54.167 56.535 -2.368 18321 12785 1 10 . 1 1 123 123 ASP CB C 123 40.695 40.695 40.505 0.190 18321 12786 1 10 . 1 1 123 123 ASP H H 123 8.181 8.181 8.799 -0.618 18321 12787 1 10 . 1 1 124 124 ASN N N 124 118.207 118.207 120.492 -2.285 18321 12788 1 10 . 1 1 124 124 ASN C C 124 174.851 174.851 174.213 0.638 18321 12789 1 10 . 1 1 124 124 ASN CA C 124 52.771 52.771 52.569 0.202 18321 12790 1 10 . 1 1 124 124 ASN CB C 124 38.304 38.304 40.377 -2.073 18321 12791 1 10 . 1 1 124 124 ASN H H 124 8.307 8.307 8.504 -0.197 18321 12792 1 10 . 1 1 125 125 LEU N N 125 121.311 121.311 123.236 -1.925 18321 12793 1 10 . 1 1 125 125 LEU C C 125 175.750 175.750 175.587 0.163 18321 12794 1 10 . 1 1 125 125 LEU CA C 125 54.428 54.428 55.413 -0.984 18321 12795 1 10 . 1 1 125 125 LEU CB C 125 41.350 41.350 41.219 0.131 18321 12796 1 10 . 1 1 125 125 LEU H H 125 7.747 7.747 8.395 -0.648 18321 12797 1 10 . 1 1 126 126 GLU N N 126 122.485 122.485 118.970 3.515 18321 12798 1 10 . 1 1 126 126 GLU C C 126 174.008 174.008 174.200 -0.192 18321 12799 1 10 . 1 1 126 126 GLU CA C 126 54.855 54.855 56.298 -1.443 18321 12800 1 10 . 1 1 126 126 GLU CB C 126 30.472 30.472 31.088 -0.616 18321 12801 1 10 . 1 1 126 126 GLU H H 126 8.453 8.453 7.903 0.550 18321 12802 1 10 . 1 1 127 127 TYR N N 127 122.713 122.713 119.676 3.037 18321 12803 1 10 . 1 1 127 127 TYR C C 127 176.859 176.859 174.812 2.047 18321 12804 1 10 . 1 1 127 127 TYR CA C 127 56.528 56.528 58.111 -1.583 18321 12805 1 10 . 1 1 127 127 TYR CB C 127 40.982 40.982 40.901 0.081 18321 12806 1 10 . 1 1 127 127 TYR H H 127 8.469 8.469 8.425 0.044 18321 12807 1 10 . 1 1 128 128 VAL N N 128 112.432 112.432 122.170 -9.738 18321 12808 1 10 . 1 1 128 128 VAL C C 128 173.150 173.150 174.511 -1.361 18321 12809 1 10 . 1 1 128 128 VAL CA C 128 57.940 57.940 60.525 -2.585 18321 12810 1 10 . 1 1 128 128 VAL CB C 128 34.935 34.935 37.045 -2.110 18321 12811 1 10 . 1 1 128 128 VAL H H 128 9.078 9.078 8.710 0.368 18321 12812 1 10 . 1 1 129 129 ARG N N 129 120.373 120.373 120.786 -0.413 18321 12813 1 10 . 1 1 129 129 ARG C C 129 176.539 176.539 175.347 1.192 18321 12814 1 10 . 1 1 129 129 ARG CA C 129 52.534 52.534 54.380 -1.846 18321 12815 1 10 . 1 1 129 129 ARG CB C 129 32.942 32.942 33.474 -0.532 18321 12816 1 10 . 1 1 129 129 ARG H H 129 9.010 9.010 9.492 -0.482 18321 12817 1 10 . 1 1 130 130 THR N N 130 116.637 116.637 114.642 1.995 18321 12818 1 10 . 1 1 130 130 THR CA C 130 60.618 60.618 61.533 -0.915 18321 12819 1 10 . 1 1 130 130 THR CB C 130 69.170 69.170 70.275 -1.105 18321 12820 1 10 . 1 1 130 130 THR H H 130 9.045 9.045 8.277 0.768 18321 12821 1 10 . 1 1 131 131 LEU N N 131 122.910 122.910 121.848 1.062 18321 12822 1 10 . 1 1 131 131 LEU C C 131 175.269 175.269 176.862 -1.593 18321 12823 1 10 . 1 1 131 131 LEU CA C 131 55.122 55.122 55.156 -0.034 18321 12824 1 10 . 1 1 131 131 LEU CB C 131 43.108 43.108 43.053 0.055 18321 12825 1 10 . 1 1 131 131 LEU H H 131 9.224 9.224 8.638 0.586 18321 12826 1 10 . 1 1 132 132 TYR N N 132 112.885 112.885 117.881 -4.996 18321 12827 1 10 . 1 1 132 132 TYR C C 132 173.818 173.818 175.467 -1.649 18321 12828 1 10 . 1 1 132 132 TYR CA C 132 54.230 54.230 58.948 -4.718 18321 12829 1 10 . 1 1 132 132 TYR CB C 132 42.672 42.672 40.109 2.563 18321 12830 1 10 . 1 1 132 132 TYR H H 132 7.284 7.284 7.589 -0.305 18321 12831 1 10 . 1 1 133 133 ASP N N 133 118.003 118.003 118.283 -0.280 18321 12832 1 10 . 1 1 133 133 ASP C C 133 175.779 175.779 174.274 1.505 18321 12833 1 10 . 1 1 133 133 ASP CA C 133 54.351 54.351 55.672 -1.321 18321 12834 1 10 . 1 1 133 133 ASP CB C 133 41.241 41.241 40.737 0.504 18321 12835 1 10 . 1 1 133 133 ASP H H 133 8.399 8.399 8.147 0.252 18321 12836 1 10 . 1 1 134 134 PHE N N 134 121.081 121.081 123.687 -2.606 18321 12837 1 10 . 1 1 134 134 PHE CA C 134 52.552 52.552 56.273 -3.720 18321 12838 1 10 . 1 1 134 134 PHE CB C 134 41.217 41.217 42.289 -1.072 18321 12839 1 10 . 1 1 134 134 PHE H H 134 8.797 8.797 8.492 0.305 18321 12840 1 10 . 1 1 136 136 GLY C C 136 171.616 171.616 175.004 -3.388 18321 12841 1 10 . 1 1 137 137 ASN N N 137 119.394 119.394 117.604 1.790 18321 12842 1 10 . 1 1 137 137 ASN C C 137 174.500 174.500 174.040 0.460 18321 12843 1 10 . 1 1 137 137 ASN CA C 137 44.670 44.670 54.722 -10.052 18321 12844 1 10 . 1 1 137 137 ASN H H 137 9.477 9.477 8.304 1.173 18321 12845 1 10 . 1 1 138 138 ASP N N 138 120.608 120.608 118.936 1.672 18321 12846 1 10 . 1 1 138 138 ASP C C 138 176.987 176.987 174.665 2.322 18321 12847 1 10 . 1 1 138 138 ASP CA C 138 52.992 52.992 53.291 -0.299 18321 12848 1 10 . 1 1 138 138 ASP H H 138 8.216 8.216 7.773 0.443 18321 12849 1 10 . 1 1 139 139 ALA N N 139 124.371 124.371 120.732 3.639 18321 12850 1 10 . 1 1 139 139 ALA C C 139 178.472 178.472 177.585 0.887 18321 12851 1 10 . 1 1 139 139 ALA CA C 139 54.513 54.513 53.387 1.126 18321 12852 1 10 . 1 1 139 139 ALA CB C 139 18.045 18.045 19.775 -1.730 18321 12853 1 10 . 1 1 139 139 ALA H H 139 8.565 8.565 8.512 0.053 18321 12854 1 10 . 1 1 140 140 GLU N N 140 115.022 115.022 115.597 -0.575 18321 12855 1 10 . 1 1 140 140 GLU C C 140 177.027 177.027 175.111 1.916 18321 12856 1 10 . 1 1 140 140 GLU CA C 140 56.181 56.181 56.292 -0.111 18321 12857 1 10 . 1 1 140 140 GLU CB C 140 28.619 28.619 30.391 -1.772 18321 12858 1 10 . 1 1 140 140 GLU H H 140 8.616 8.616 8.585 0.031 18321 12859 1 10 . 1 1 141 141 ASP N N 141 121.913 121.913 120.914 0.999 18321 12860 1 10 . 1 1 141 141 ASP C C 141 175.923 175.923 174.370 1.553 18321 12861 1 10 . 1 1 141 141 ASP CA C 141 54.736 54.736 53.617 1.119 18321 12862 1 10 . 1 1 141 141 ASP CB C 141 41.305 41.305 43.203 -1.898 18321 12863 1 10 . 1 1 141 141 ASP H H 141 7.636 7.636 7.878 -0.242 18321 12864 1 10 . 1 1 142 142 LEU N N 142 127.651 127.651 126.283 1.368 18321 12865 1 10 . 1 1 142 142 LEU CA C 142 50.955 50.955 52.381 -1.426 18321 12866 1 10 . 1 1 142 142 LEU CB C 142 42.343 42.343 43.658 -1.315 18321 12867 1 10 . 1 1 142 142 LEU H H 142 9.479 9.479 7.908 1.571 18321 12868 1 10 . 1 1 143 143 PRO C C 143 177.924 177.924 175.952 1.972 18321 12869 1 10 . 1 1 144 144 PHE N N 144 114.483 114.483 121.858 -7.375 18321 12870 1 10 . 1 1 144 144 PHE C C 144 175.055 175.055 174.271 0.784 18321 12871 1 10 . 1 1 144 144 PHE CA C 144 55.543 55.543 55.276 0.267 18321 12872 1 10 . 1 1 144 144 PHE CB C 144 40.581 40.581 41.153 -0.572 18321 12873 1 10 . 1 1 144 144 PHE H H 144 8.637 8.637 7.923 0.714 18321 12874 1 10 . 1 1 145 145 LYS N N 145 121.342 121.342 119.856 1.486 18321 12875 1 10 . 1 1 145 145 LYS C C 145 176.925 176.925 178.000 -1.075 18321 12876 1 10 . 1 1 145 145 LYS CA C 145 53.043 53.043 54.264 -1.221 18321 12877 1 10 . 1 1 145 145 LYS CB C 145 33.804 33.804 35.400 -1.596 18321 12878 1 10 . 1 1 145 145 LYS H H 145 9.418 9.418 8.969 0.449 18321 12879 1 10 . 1 1 146 146 LYS N N 146 123.378 123.378 119.227 4.151 18321 12880 1 10 . 1 1 146 146 LYS CA C 146 57.883 57.883 57.050 0.833 18321 12881 1 10 . 1 1 146 146 LYS CB C 146 32.008 32.008 32.273 -0.265 18321 12882 1 10 . 1 1 146 146 LYS H H 146 9.002 9.002 8.922 0.080 18321 12883 1 10 . 1 1 147 147 GLY C C 147 174.315 174.315 173.786 0.529 18321 12884 1 10 . 1 1 148 148 GLU N N 148 121.392 121.392 120.875 0.517 18321 12885 1 10 . 1 1 148 148 GLU C C 148 174.998 174.998 175.243 -0.245 18321 12886 1 10 . 1 1 148 148 GLU CA C 148 56.867 56.867 54.246 2.621 18321 12887 1 10 . 1 1 148 148 GLU CB C 148 31.649 31.649 31.532 0.117 18321 12888 1 10 . 1 1 148 148 GLU H H 148 7.937 7.937 7.902 0.035 18321 12889 1 10 . 1 1 149 149 ILE N N 149 120.124 120.124 121.832 -1.708 18321 12890 1 10 . 1 1 149 149 ILE C C 149 176.647 176.647 175.158 1.489 18321 12891 1 10 . 1 1 149 149 ILE CA C 149 58.621 58.621 59.577 -0.956 18321 12892 1 10 . 1 1 149 149 ILE CB C 149 36.952 36.952 37.681 -0.729 18321 12893 1 10 . 1 1 149 149 ILE H H 149 8.346 8.346 8.600 -0.254 18321 12894 1 10 . 1 1 150 150 LEU N N 150 126.950 126.950 124.657 2.293 18321 12895 1 10 . 1 1 150 150 LEU CA C 150 51.967 51.967 52.527 -0.560 18321 12896 1 10 . 1 1 150 150 LEU CB C 150 44.182 44.182 45.372 -1.190 18321 12897 1 10 . 1 1 150 150 LEU H H 150 8.988 8.988 9.089 -0.101 18321 12898 1 10 . 1 1 151 151 VAL C C 151 175.670 175.670 175.460 0.210 18321 12899 1 10 . 1 1 152 152 ILE N N 152 124.997 124.997 128.225 -3.228 18321 12900 1 10 . 1 1 152 152 ILE CA C 152 58.331 58.331 59.390 -1.059 18321 12901 1 10 . 1 1 152 152 ILE CB C 152 34.093 34.093 34.678 -0.585 18321 12902 1 10 . 1 1 152 152 ILE H H 152 8.673 8.673 8.943 -0.270 18321 12903 1 10 . 1 1 153 153 ILE N N 153 124.710 124.710 127.406 -2.696 18321 12904 1 10 . 1 1 153 153 ILE C C 153 176.264 176.264 175.372 0.892 18321 12905 1 10 . 1 1 154 154 GLU N N 154 117.398 117.398 116.857 0.541 18321 12906 1 10 . 1 1 154 154 GLU C C 154 173.959 173.959 174.497 -0.538 18321 12907 1 10 . 1 1 154 154 GLU CA C 154 55.289 55.289 55.149 0.140 18321 12908 1 10 . 1 1 154 154 GLU CB C 154 32.842 32.842 31.950 0.892 18321 12909 1 10 . 1 1 154 154 GLU H H 154 7.818 7.818 8.178 -0.360 18321 12910 1 10 . 1 1 155 155 LYS N N 155 121.130 121.130 124.250 -3.120 18321 12911 1 10 . 1 1 155 155 LYS CA C 155 53.022 53.022 52.877 0.145 18321 12912 1 10 . 1 1 155 155 LYS CB C 155 32.663 32.663 32.989 -0.326 18321 12913 1 10 . 1 1 155 155 LYS H H 155 8.654 8.654 9.044 -0.390 18321 12914 1 10 . 1 1 157 157 GLU C C 157 175.190 175.190 175.486 -0.296 18321 12915 1 10 . 1 1 157 157 GLU CA C 157 53.785 53.785 54.383 -0.598 18321 12916 1 10 . 1 1 157 157 GLU CB C 157 32.685 32.685 31.507 1.178 18321 12917 1 10 . 1 1 158 158 GLU N N 158 117.425 117.425 119.849 -2.424 18321 12918 1 10 . 1 1 158 158 GLU C C 158 178.600 178.600 177.992 0.608 18321 12919 1 10 . 1 1 158 158 GLU CA C 158 59.044 59.044 59.083 -0.039 18321 12920 1 10 . 1 1 158 158 GLU CB C 158 29.706 29.706 30.143 -0.437 18321 12921 1 10 . 1 1 158 158 GLU H H 158 8.678 8.678 8.657 0.021 18321 12922 1 10 . 1 1 159 159 GLN N N 159 110.925 110.925 117.687 -6.762 18321 12923 1 10 . 1 1 159 159 GLN C C 159 175.539 175.539 174.818 0.721 18321 12924 1 10 . 1 1 159 159 GLN CA C 159 54.942 54.942 57.765 -2.823 18321 12925 1 10 . 1 1 159 159 GLN CB C 159 28.572 28.572 29.071 -0.499 18321 12926 1 10 . 1 1 159 159 GLN H H 159 8.483 8.483 8.683 -0.200 18321 12927 1 10 . 1 1 160 160 TRP N N 160 120.171 120.171 118.274 1.897 18321 12928 1 10 . 1 1 160 160 TRP C C 160 173.444 173.444 175.069 -1.625 18321 12929 1 10 . 1 1 160 160 TRP CA C 160 56.175 56.175 55.574 0.601 18321 12930 1 10 . 1 1 160 160 TRP CB C 160 31.796 31.796 31.333 0.463 18321 12931 1 10 . 1 1 160 160 TRP H H 160 6.826 6.826 7.389 -0.563 18321 12932 1 10 . 1 1 161 161 TRP N N 161 120.687 120.687 122.700 -2.013 18321 12933 1 10 . 1 1 161 161 TRP C C 161 174.736 174.736 176.109 -1.373 18321 12934 1 10 . 1 1 161 161 TRP CA C 161 51.889 51.889 53.985 -2.096 18321 12935 1 10 . 1 1 161 161 TRP CB C 161 32.772 32.772 30.980 1.792 18321 12936 1 10 . 1 1 161 161 TRP H H 161 8.462 8.462 8.948 -0.486 18321 12937 1 10 . 1 1 162 162 SER N N 162 115.691 115.691 119.955 -4.264 18321 12938 1 10 . 1 1 162 162 SER C C 162 174.320 174.320 173.577 0.743 18321 12939 1 10 . 1 1 162 162 SER CA C 162 57.011 57.011 58.682 -1.671 18321 12940 1 10 . 1 1 162 162 SER CB C 162 63.948 63.948 62.948 1.000 18321 12941 1 10 . 1 1 162 162 SER H H 162 8.830 8.830 8.977 -0.147 18321 12942 1 10 . 1 1 163 163 ALA N N 163 130.630 130.630 128.618 2.012 18321 12943 1 10 . 1 1 163 163 ALA CA C 163 50.029 50.029 49.818 0.211 18321 12944 1 10 . 1 1 163 163 ALA CB C 163 25.500 25.500 22.436 3.064 18321 12945 1 10 . 1 1 163 163 ALA H H 163 9.585 9.585 8.902 0.683 18321 12946 1 10 . 1 1 164 164 ARG N N 164 117.526 117.526 118.988 -1.462 18321 12947 1 10 . 1 1 164 164 ARG C C 164 176.719 176.719 175.918 0.801 18321 12948 1 10 . 1 1 164 164 ARG CA C 164 52.975 52.975 53.978 -1.003 18321 12949 1 10 . 1 1 164 164 ARG CB C 164 34.260 34.260 31.945 2.314 18321 12950 1 10 . 1 1 164 164 ARG H H 164 9.097 9.097 8.502 0.595 18321 12951 1 10 . 1 1 165 165 ASN N N 165 123.935 123.935 121.439 2.496 18321 12952 1 10 . 1 1 165 165 ASN C C 165 178.484 178.484 176.800 1.684 18321 12953 1 10 . 1 1 165 165 ASN CA C 165 50.332 50.332 53.146 -2.814 18321 12954 1 10 . 1 1 165 165 ASN CB C 165 39.487 39.487 40.115 -0.628 18321 12955 1 10 . 1 1 165 165 ASN H H 165 8.756 8.756 8.554 0.202 18321 12956 1 10 . 1 1 166 166 LYS N N 166 118.464 118.464 124.379 -5.915 18321 12957 1 10 . 1 1 166 166 LYS C C 166 176.967 176.967 177.078 -0.111 18321 12958 1 10 . 1 1 166 166 LYS CA C 166 58.430 58.430 59.068 -0.638 18321 12959 1 10 . 1 1 166 166 LYS CB C 166 30.918 30.918 32.487 -1.569 18321 12960 1 10 . 1 1 166 166 LYS H H 166 8.915 8.915 8.357 0.558 18321 12961 1 10 . 1 1 167 167 ASP N N 167 118.138 118.138 116.322 1.816 18321 12962 1 10 . 1 1 167 167 ASP C C 167 176.464 176.464 176.057 0.407 18321 12963 1 10 . 1 1 167 167 ASP CA C 167 54.212 54.212 53.910 0.302 18321 12964 1 10 . 1 1 167 167 ASP CB C 167 41.178 41.178 41.524 -0.346 18321 12965 1 10 . 1 1 167 167 ASP H H 167 7.508 7.508 8.249 -0.741 18321 12966 1 10 . 1 1 168 168 GLY N N 168 107.901 107.901 108.306 -0.405 18321 12967 1 10 . 1 1 168 168 GLY C C 168 173.613 173.613 173.147 0.466 18321 12968 1 10 . 1 1 168 168 GLY CA C 168 44.783 44.783 44.709 0.074 18321 12969 1 10 . 1 1 168 168 GLY H H 168 8.173 8.173 7.853 0.320 18321 12970 1 10 . 1 1 169 169 ARG N N 169 124.324 124.324 118.318 6.006 18321 12971 1 10 . 1 1 169 169 ARG CA C 169 56.106 56.106 55.531 0.575 18321 12972 1 10 . 1 1 169 169 ARG CB C 169 29.648 29.648 32.149 -2.501 18321 12973 1 10 . 1 1 169 169 ARG H H 169 7.998 7.998 7.652 0.346 18321 12974 1 10 . 1 1 170 170 VAL C C 170 177.590 177.590 175.429 2.161 18321 12975 1 10 . 1 1 171 171 GLY N N 171 112.582 112.582 111.129 1.453 18321 12976 1 10 . 1 1 171 171 GLY C C 171 170.991 170.991 172.505 -1.514 18321 12977 1 10 . 1 1 171 171 GLY CA C 171 45.361 45.361 44.929 0.432 18321 12978 1 10 . 1 1 171 171 GLY H H 171 9.013 9.013 8.776 0.237 18321 12979 1 10 . 1 1 172 172 MET N N 172 117.368 117.368 120.729 -3.361 18321 12980 1 10 . 1 1 172 172 MET C C 172 177.921 177.921 176.757 1.164 18321 12981 1 10 . 1 1 172 172 MET CA C 172 53.536 53.536 57.206 -3.670 18321 12982 1 10 . 1 1 172 172 MET CB C 172 30.838 30.838 33.412 -2.574 18321 12983 1 10 . 1 1 172 172 MET H H 172 8.885 8.885 8.667 0.218 18321 12984 1 10 . 1 1 173 173 ILE N N 173 113.130 113.130 118.337 -5.207 18321 12985 1 10 . 1 1 173 173 ILE CA C 173 56.284 56.284 57.785 -1.502 18321 12986 1 10 . 1 1 173 173 ILE CB C 173 40.870 40.870 40.368 0.502 18321 12987 1 10 . 1 1 173 173 ILE H H 173 9.704 9.704 9.373 0.331 18321 12988 1 10 . 1 1 174 174 PRO C C 174 176.714 176.714 177.832 -1.118 18321 12989 1 10 . 1 1 174 174 PRO CA C 174 66.290 66.290 61.106 5.184 18321 12990 1 10 . 1 1 174 174 PRO CB C 174 28.993 28.993 30.910 -1.917 18321 12991 1 10 . 1 1 175 175 VAL N N 175 128.066 128.066 123.853 4.213 18321 12992 1 10 . 1 1 175 175 VAL CA C 175 59.356 59.356 67.750 -8.394 18321 12993 1 10 . 1 1 175 175 VAL H H 175 7.327 7.327 7.636 -0.309 18321 12994 1 10 . 1 1 176 176 PRO C C 176 176.351 176.351 176.958 -0.607 18321 12995 1 10 . 1 1 177 177 TYR N N 177 115.756 115.756 114.845 0.911 18321 12996 1 10 . 1 1 177 177 TYR C C 177 175.011 175.011 175.067 -0.056 18321 12997 1 10 . 1 1 177 177 TYR CA C 177 56.756 56.756 57.135 -0.379 18321 12998 1 10 . 1 1 177 177 TYR CB C 177 37.507 37.507 39.291 -1.784 18321 12999 1 10 . 1 1 177 177 TYR H H 177 7.784 7.784 7.592 0.192 18321 13000 1 10 . 1 1 178 178 VAL N N 178 111.428 111.428 113.429 -2.001 18321 13001 1 10 . 1 1 178 178 VAL C C 178 173.417 173.417 174.928 -1.511 18321 13002 1 10 . 1 1 178 178 VAL CA C 178 58.307 58.307 58.717 -0.410 18321 13003 1 10 . 1 1 178 178 VAL CB C 178 34.602 34.602 34.969 -0.367 18321 13004 1 10 . 1 1 178 178 VAL H H 178 7.801 7.801 7.645 0.156 18321 13005 1 10 . 1 1 179 179 GLU N N 179 118.581 118.581 120.721 -2.140 18321 13006 1 10 . 1 1 179 179 GLU C C 179 175.225 175.225 175.167 0.058 18321 13007 1 10 . 1 1 179 179 GLU CA C 179 53.114 53.114 53.852 -0.738 18321 13008 1 10 . 1 1 179 179 GLU CB C 179 32.712 32.712 34.217 -1.505 18321 13009 1 10 . 1 1 179 179 GLU H H 179 8.819 8.819 9.081 -0.262 18321 13010 1 10 . 1 1 180 180 LYS N N 180 124.167 124.167 120.969 3.198 18321 13011 1 10 . 1 1 180 180 LYS C C 180 176.303 176.303 176.575 -0.272 18321 13012 1 10 . 1 1 180 180 LYS CA C 180 57.318 57.318 55.368 1.950 18321 13013 1 10 . 1 1 180 180 LYS CB C 180 31.675 31.675 32.880 -1.206 18321 13014 1 10 . 1 1 180 180 LYS H H 180 8.775 8.775 8.612 0.163 18321 13015 1 10 . 1 1 181 181 LEU N N 181 125.157 125.157 124.865 0.292 18321 13016 1 10 . 1 1 181 181 LEU C C 181 176.462 176.462 176.794 -0.332 18321 13017 1 10 . 1 1 181 181 LEU CA C 181 54.470 54.470 57.152 -2.682 18321 13018 1 10 . 1 1 181 181 LEU CB C 181 41.625 41.625 42.599 -0.974 18321 13019 1 10 . 1 1 181 181 LEU H H 181 8.084 8.084 8.426 -0.342 18321 13020 1 10 . 1 1 182 182 VAL N N 182 123.167 123.167 115.176 7.991 18321 13021 1 10 . 1 1 182 182 VAL C C 182 175.983 175.983 174.833 1.150 18321 13022 1 10 . 1 1 182 182 VAL CA C 182 61.613 61.613 62.033 -0.420 18321 13023 1 10 . 1 1 182 182 VAL CB C 182 32.085 32.085 31.179 0.906 18321 13024 1 10 . 1 1 182 182 VAL H H 182 8.345 8.345 7.812 0.533 18321 13025 1 10 . 1 1 183 183 ARG N N 183 125.775 125.775 129.123 -3.348 18321 13026 1 10 . 1 1 183 183 ARG CA C 183 57.801 57.801 56.299 1.502 18321 13027 1 10 . 1 1 183 183 ARG CB C 183 30.091 30.091 32.239 -2.148 18321 13028 1 10 . 1 1 183 183 ARG H H 183 8.530 8.530 8.462 0.068 18321 13029 1 10 . 1 1 184 184 SER C C 184 173.239 173.239 173.390 -0.151 18321 13030 1 10 . 1 1 185 185 SER N N 185 116.511 116.511 117.533 -1.022 18321 13031 1 10 . 1 1 185 185 SER CA C 185 58.428 58.428 56.483 1.945 18321 13032 1 10 . 1 1 185 185 SER CB C 185 69.737 69.737 64.171 5.566 18321 13033 1 10 . 1 1 185 185 SER H H 185 7.944 7.944 7.600 0.344 18321 13034 1 10 . 1 1 190 190 HIS C C 190 176.953 176.953 174.180 2.773 18321 13035 1 10 . 1 1 190 190 HIS CA C 190 54.229 54.229 55.465 -1.236 18321 13036 1 10 . 1 1 190 190 HIS CB C 190 35.112 35.112 29.892 5.220 18321 13037 1 10 . 1 1 191 191 GLY N N 191 109.491 109.491 113.919 -4.428 18321 13038 1 10 . 1 1 191 191 GLY C C 191 172.295 172.295 173.892 -1.597 18321 13039 1 10 . 1 1 191 191 GLY CA C 191 45.227 45.227 45.357 -0.130 18321 13040 1 10 . 1 1 191 191 GLY H H 191 8.719 8.719 7.827 0.892 18321 13041 1 10 . 1 1 192 192 ASN N N 192 118.700 118.700 119.523 -0.823 18321 13042 1 10 . 1 1 192 192 ASN HA H 192 4.312 4.312 4.864 -0.551 18321 13043 1 10 . 1 1 192 192 ASN C C 192 176.369 176.369 174.225 2.144 18321 13044 1 10 . 1 1 192 192 ASN CA C 192 57.787 57.787 53.316 4.471 18321 13045 1 10 . 1 1 192 192 ASN H H 192 7.508 7.508 8.310 -0.802 18321 13046 1 10 . 1 1 193 193 ARG N N 193 120.743 120.743 125.236 -4.493 18321 13047 1 10 . 1 1 193 193 ARG H H 193 9.032 9.032 8.289 0.743 18321 13048 1 10 . 1 1 197 197 SER HA H 197 4.388 4.388 4.505 -0.117 18321 13049 1 10 . 1 1 197 197 SER C C 197 174.133 174.133 173.465 0.668 18321 13050 1 10 . 1 1 197 197 SER CA C 197 58.128 58.128 58.455 -0.327 18321 13051 1 10 . 1 1 197 197 SER CB C 197 62.966 62.966 61.740 1.226 18321 13052 1 10 . 1 1 198 198 TYR N N 198 121.435 121.435 120.793 0.642 18321 13053 1 10 . 1 1 198 198 TYR HA H 198 4.543 4.543 4.666 -0.123 18321 13054 1 10 . 1 1 198 198 TYR C C 198 176.230 176.230 175.720 0.510 18321 13055 1 10 . 1 1 198 198 TYR CA C 198 57.536 57.536 56.608 0.928 18321 13056 1 10 . 1 1 198 198 TYR CB C 198 38.279 38.279 39.308 -1.029 18321 13057 1 10 . 1 1 198 198 TYR H H 198 8.071 8.071 7.563 0.508 18321 13058 1 10 . 1 1 199 199 GLY N N 199 110.039 110.039 109.358 0.681 18321 13059 1 10 . 1 1 199 199 GLY C C 199 173.475 173.475 173.337 0.138 18321 13060 1 10 . 1 1 199 199 GLY CA C 199 44.805 44.805 45.028 -0.223 18321 13061 1 10 . 1 1 199 199 GLY H H 199 8.162 8.162 8.832 -0.670 18321 13062 1 10 . 1 1 200 200 ILE N N 200 121.530 121.530 117.670 3.860 18321 13063 1 10 . 1 1 200 200 ILE CA C 200 58.102 58.102 58.136 -0.035 18321 13064 1 10 . 1 1 200 200 ILE CB C 200 37.760 37.760 39.022 -1.262 18321 13065 1 10 . 1 1 200 200 ILE H H 200 7.851 7.851 7.722 0.129 18321 13066 1 10 . 1 1 201 201 PRO C C 201 176.485 176.485 176.320 0.165 18321 13067 1 10 . 1 1 201 201 PRO CA C 201 53.893 53.893 62.589 -8.696 18321 13068 1 10 . 1 1 201 201 PRO CB C 201 29.042 29.042 32.208 -3.166 18321 13069 1 10 . 1 1 202 202 GLU N N 202 122.468 122.468 124.800 -2.332 18321 13070 1 10 . 1 1 202 202 GLU CA C 202 62.490 62.490 53.289 9.201 18321 13071 1 10 . 1 1 202 202 GLU CB C 202 31.170 31.170 29.694 1.476 18321 13072 1 10 . 1 1 202 202 GLU H H 202 8.328 8.328 8.528 -0.200 18321 13073 1 10 . 1 1 203 203 PRO CA C 203 62.803 62.803 63.133 -0.330 18321 13074 1 10 . 1 1 203 203 PRO CB C 203 31.220 31.220 32.312 -1.091 18321 13075 1 10 . 1 1 204 204 ALA N N 204 123.251 123.251 126.684 -3.433 18321 13076 1 10 . 1 1 204 204 ALA HA H 204 4.180 4.180 4.176 0.004 18321 13077 1 10 . 1 1 204 204 ALA CA C 204 52.124 52.124 52.733 -0.609 18321 13078 1 10 . 1 1 204 204 ALA CB C 204 18.892 18.892 19.132 -0.240 18321 13079 1 10 . 1 1 204 204 ALA H H 204 8.308 8.308 8.558 -0.250 18321 13080 1 10 . 1 1 205 205 HIS N N 205 117.874 117.874 118.715 -0.841 18321 13081 1 10 . 1 1 205 205 HIS C C 205 173.282 173.282 173.810 -0.528 18321 13082 1 10 . 1 1 205 205 HIS H H 205 8.045 8.045 8.213 -0.168 18321 13083 1 10 . 1 1 206 206 ALA N N 206 125.519 125.519 127.435 -1.916 18321 13084 1 10 . 1 1 206 206 ALA HA H 206 4.204 4.204 4.539 -0.335 18321 13085 1 10 . 1 1 206 206 ALA CA C 206 40.196 40.196 52.009 -11.813 18321 13086 1 10 . 1 1 206 206 ALA CB C 206 19.407 19.407 19.932 -0.525 18321 13087 1 10 . 1 1 206 206 ALA H H 206 8.061 8.061 8.412 -0.351 18321 13088 1 10 . 1 1 207 207 TYR N N 207 120.381 120.381 117.028 3.353 18321 13089 1 10 . 1 1 207 207 TYR HA H 207 4.570 4.570 4.124 0.446 18321 13090 1 10 . 1 1 207 207 TYR CA C 207 52.572 52.572 57.627 -5.055 18321 13091 1 10 . 1 1 207 207 TYR CB C 207 41.333 41.333 37.639 3.694 18321 13092 1 10 . 1 1 207 207 TYR H H 207 8.199 8.199 8.393 -0.194 18321 13093 1 10 . 1 1 208 208 ALA HA H 208 4.281 4.281 4.432 -0.151 18321 13094 1 10 . 1 1 208 208 ALA C C 208 177.736 177.736 176.187 1.549 18321 13095 1 10 . 1 1 208 208 ALA CA C 208 52.084 52.084 52.785 -0.701 18321 13096 1 10 . 1 1 208 208 ALA CB C 208 18.999 18.999 19.800 -0.801 18321 13097 1 10 . 1 1 209 209 GLN N N 209 119.295 119.295 118.946 0.349 18321 13098 1 10 . 1 1 209 209 GLN CA C 209 61.474 61.474 53.996 7.478 18321 13099 1 10 . 1 1 209 209 GLN CB C 209 32.039 32.039 28.547 3.492 18321 13100 1 10 . 1 1 209 209 GLN H H 209 8.125 8.125 8.199 -0.074 18321 13101 1 10 . 1 1 210 210 PRO HA H 210 4.395 4.395 4.360 0.035 18321 13102 1 10 . 1 1 210 210 PRO CA C 210 62.584 62.584 63.077 -0.493 18321 13103 1 10 . 1 1 211 211 GLN HA H 211 4.377 4.377 4.129 0.248 18321 13104 1 10 . 1 1 211 211 GLN CA C 211 55.859 55.859 57.326 -1.467 18321 13105 1 10 . 1 1 211 211 GLN CB C 211 29.577 29.577 29.133 0.444 18321 13106 1 10 . 1 1 212 212 THR C C 212 176.551 176.551 174.928 1.623 18321 13107 1 10 . 1 1 212 212 THR CB C 212 69.890 69.890 69.100 0.790 18321 13108 1 10 . 1 1 213 213 THR N N 213 108.487 108.487 121.287 -12.800 18321 13109 1 10 . 1 1 213 213 THR CA C 213 61.236 61.236 62.896 -1.660 18321 13110 1 10 . 1 1 213 213 THR CB C 213 69.091 69.091 69.345 -0.254 18321 13111 1 10 . 1 1 213 213 THR H H 213 8.243 8.243 8.817 -0.574 18321 13112 1 10 . 1 1 214 214 THR N N 214 119.445 119.445 116.351 3.094 18321 13113 1 10 . 1 1 214 214 THR CA C 214 59.425 59.425 61.948 -2.523 18321 13114 1 10 . 1 1 214 214 THR CB C 214 69.251 69.251 69.109 0.142 18321 13115 1 10 . 1 1 214 214 THR H H 214 8.188 8.188 8.120 0.068 18321 13116 1 10 . 1 1 215 215 PRO HA H 215 4.361 4.361 4.461 -0.100 18321 13117 1 10 . 1 1 215 215 PRO C C 215 175.422 175.422 176.102 -0.680 18321 13118 1 10 . 1 1 215 215 PRO CA C 215 63.320 63.320 62.617 0.703 18321 13119 1 10 . 1 1 215 215 PRO CB C 215 31.918 31.918 32.200 -0.282 18321 13120 1 10 . 1 1 216 216 LEU N N 216 121.602 121.602 125.176 -3.574 18321 13121 1 10 . 1 1 216 216 LEU CA C 216 52.203 52.203 52.432 -0.229 18321 13122 1 10 . 1 1 216 216 LEU CB C 216 42.451 42.451 41.903 0.548 18321 13123 1 10 . 1 1 216 216 LEU H H 216 7.891 7.891 8.234 -0.343 18321 13124 1 10 . 1 1 217 217 PRO HA H 217 4.398 4.398 4.334 0.064 18321 13125 1 10 . 1 1 217 217 PRO C C 217 176.577 176.577 176.180 0.397 18321 13126 1 10 . 1 1 217 217 PRO CA C 217 62.984 62.984 63.893 -0.909 18321 13127 1 10 . 1 1 217 217 PRO CB C 217 32.056 32.056 32.220 -0.164 18321 13128 1 10 . 1 1 218 218 ALA N N 218 124.087 124.087 121.578 2.509 18321 13129 1 10 . 1 1 218 218 ALA HA H 218 4.309 4.309 4.452 -0.143 18321 13130 1 10 . 1 1 218 218 ALA C C 218 177.844 177.844 176.412 1.432 18321 13131 1 10 . 1 1 218 218 ALA CA C 218 52.379 52.379 51.951 0.428 18321 13132 1 10 . 1 1 218 218 ALA CB C 218 19.133 19.133 20.266 -1.133 18321 13133 1 10 . 1 1 218 218 ALA H H 218 8.261 8.261 7.553 0.708 18321 13134 1 10 . 1 1 219 219 VAL N N 219 118.942 118.942 123.517 -4.575 18321 13135 1 10 . 1 1 219 219 VAL HA H 219 4.142 4.142 4.093 0.049 18321 13136 1 10 . 1 1 219 219 VAL CA C 219 62.102 62.102 62.173 -0.071 18321 13137 1 10 . 1 1 219 219 VAL CB C 219 32.923 32.923 31.633 1.290 18321 13138 1 10 . 1 1 219 219 VAL H H 219 8.049 8.049 8.252 -0.203 18321 13139 1 10 . 1 1 220 220 SER N N 220 119.207 119.207 124.313 -5.106 18321 13140 1 10 . 1 1 220 220 SER HA H 220 4.436 4.436 4.583 -0.147 18321 13141 1 10 . 1 1 220 220 SER CA C 220 57.813 57.813 58.008 -0.195 18321 13142 1 10 . 1 1 220 220 SER CB C 220 63.375 63.375 64.196 -0.821 18321 13143 1 10 . 1 1 220 220 SER H H 220 8.275 8.275 8.408 -0.133 18321 13144 1 10 . 1 1 221 221 GLY N N 221 110.973 110.973 107.522 3.451 18321 13145 1 10 . 1 1 221 221 GLY C C 221 173.962 173.962 173.868 0.094 18321 13146 1 10 . 1 1 221 221 GLY CA C 221 45.286 45.286 44.407 0.879 18321 13147 1 10 . 1 1 221 221 GLY H H 221 8.374 8.374 8.315 0.059 18321 13148 1 10 . 1 1 222 222 SER N N 222 115.516 115.516 116.894 -1.378 18321 13149 1 10 . 1 1 222 222 SER HA H 222 4.763 4.763 4.535 0.228 18321 13150 1 10 . 1 1 222 222 SER CA C 222 56.407 56.407 56.599 -0.192 18321 13151 1 10 . 1 1 222 222 SER CB C 222 63.993 63.993 63.215 0.778 18321 13152 1 10 . 1 1 222 222 SER H H 222 8.155 8.155 8.220 -0.065 18321 13153 1 10 . 1 1 223 223 PRO HA H 223 4.417 4.417 4.358 0.059 18321 13154 1 10 . 1 1 223 223 PRO CA C 223 63.805 63.805 62.926 0.879 18321 13155 1 10 . 1 1 223 223 PRO CB C 223 32.090 32.090 32.220 -0.130 18321 13156 1 10 . 1 1 224 224 GLY N N 224 109.149 109.149 110.443 -1.294 18321 13157 1 10 . 1 1 224 224 GLY C C 224 173.813 173.813 173.796 0.017 18321 13158 1 10 . 1 1 224 224 GLY CA C 224 44.512 44.512 44.949 -0.437 18321 13159 1 10 . 1 1 224 224 GLY H H 224 8.376 8.376 8.449 -0.073 18321 13160 1 10 . 1 1 225 225 ALA N N 225 123.599 123.599 125.910 -2.311 18321 13161 1 10 . 1 1 225 225 ALA C C 225 177.341 177.341 178.128 -0.787 18321 13162 1 10 . 1 1 225 225 ALA CA C 225 51.878 51.878 52.149 -0.271 18321 13163 1 10 . 1 1 225 225 ALA CB C 225 19.169 19.169 19.296 -0.127 18321 13164 1 10 . 1 1 225 225 ALA H H 225 7.959 7.959 8.835 -0.876 18321 13165 1 10 . 1 1 226 226 ALA N N 226 123.218 123.218 124.057 -0.839 18321 13166 1 10 . 1 1 226 226 ALA HA H 226 4.350 4.350 4.601 -0.251 18321 13167 1 10 . 1 1 226 226 ALA C C 226 177.520 177.520 176.527 0.993 18321 13168 1 10 . 1 1 226 226 ALA CA C 226 52.535 52.535 51.409 1.126 18321 13169 1 10 . 1 1 226 226 ALA CB C 226 19.171 19.171 17.987 1.184 18321 13170 1 10 . 1 1 226 226 ALA H H 226 8.169 8.169 8.016 0.153 18321 13171 1 10 . 1 1 227 227 ILE N N 227 120.086 120.086 118.298 1.788 18321 13172 1 10 . 1 1 227 227 ILE HA H 227 4.201 4.201 4.526 -0.325 18321 13173 1 10 . 1 1 227 227 ILE C C 227 174.814 174.814 175.799 -0.985 18321 13174 1 10 . 1 1 227 227 ILE CA C 227 60.929 60.929 61.407 -0.478 18321 13175 1 10 . 1 1 227 227 ILE CB C 227 38.872 38.872 38.152 0.720 18321 13176 1 10 . 1 1 227 227 ILE H H 227 8.037 8.037 8.155 -0.118 18321 13177 1 10 . 1 1 228 228 THR N N 228 117.224 117.224 121.739 -4.515 18321 13178 1 10 . 1 1 228 228 THR HA H 228 4.203 4.203 4.571 -0.368 18321 13179 1 10 . 1 1 228 228 THR CA C 228 57.108 57.108 60.890 -3.782 18321 13180 1 10 . 1 1 228 228 THR CB C 228 69.945 69.945 69.514 0.430 18321 13181 1 10 . 1 1 228 228 THR H H 228 7.775 7.775 8.411 -0.636 18321 13182 1 10 . 1 1 229 229 PRO HA H 229 4.750 4.750 4.786 -0.036 18321 13183 1 10 . 1 1 229 229 PRO CA C 229 62.480 62.480 62.218 0.263 18321 13184 1 10 . 1 1 229 229 PRO CB C 229 33.995 33.995 32.731 1.264 18321 13185 1 10 . 1 1 230 230 LEU N N 230 123.629 123.629 121.182 2.447 18321 13186 1 10 . 1 1 230 230 LEU CA C 230 53.076 53.076 52.747 0.329 18321 13187 1 10 . 1 1 230 230 LEU CB C 230 40.608 40.608 40.648 -0.039 18321 13188 1 10 . 1 1 230 230 LEU H H 230 8.453 8.453 8.294 0.159 18321 13189 1 10 . 1 1 231 231 PRO HA H 231 4.412 4.412 4.592 -0.180 18321 13190 1 10 . 1 1 231 231 PRO C C 231 176.571 176.571 176.198 0.373 18321 13191 1 10 . 1 1 231 231 PRO CA C 231 63.225 63.225 62.043 1.182 18321 13192 1 10 . 1 1 231 231 PRO CB C 231 31.191 31.191 32.524 -1.333 18321 13193 1 10 . 1 1 232 232 SER N N 232 115.169 115.169 116.817 -1.648 18321 13194 1 10 . 1 1 232 232 SER HA H 232 4.450 4.450 4.479 -0.029 18321 13195 1 10 . 1 1 232 232 SER CA C 232 58.604 58.604 59.163 -0.559 18321 13196 1 10 . 1 1 232 232 SER CB C 232 63.962 63.962 62.974 0.988 18321 13197 1 10 . 1 1 232 232 SER H H 232 8.280 8.280 8.345 -0.065 18321 13198 1 10 . 1 1 233 233 THR N N 233 115.155 115.155 118.963 -3.808 18321 13199 1 10 . 1 1 233 233 THR HA H 233 4.351 4.351 4.107 0.244 18321 13200 1 10 . 1 1 233 233 THR C C 233 177.237 177.237 174.492 2.745 18321 13201 1 10 . 1 1 233 233 THR CA C 233 61.939 61.939 62.699 -0.760 18321 13202 1 10 . 1 1 233 233 THR CB C 233 68.986 68.986 69.302 -0.316 18321 13203 1 10 . 1 1 233 233 THR H H 233 8.096 8.096 8.497 -0.401 18321 13204 1 10 . 1 1 234 234 GLN N N 234 122.040 122.040 119.336 2.704 18321 13205 1 10 . 1 1 234 234 GLN HA H 234 4.681 4.681 4.079 0.602 18321 13206 1 10 . 1 1 234 234 GLN C C 234 176.177 176.177 175.209 0.968 18321 13207 1 10 . 1 1 234 234 GLN CA C 234 55.861 55.861 56.294 -0.433 18321 13208 1 10 . 1 1 234 234 GLN CB C 234 28.583 28.583 27.626 0.957 18321 13209 1 10 . 1 1 234 234 GLN H H 234 8.256 8.256 8.164 0.092 18321 13210 1 10 . 1 1 235 235 ASN N N 235 119.506 119.506 119.873 -0.367 18321 13211 1 10 . 1 1 235 235 ASN HA H 235 4.775 4.775 4.660 0.115 18321 13212 1 10 . 1 1 235 235 ASN C C 235 174.974 174.974 175.571 -0.597 18321 13213 1 10 . 1 1 235 235 ASN CA C 235 53.191 53.191 53.621 -0.430 18321 13214 1 10 . 1 1 235 235 ASN CB C 235 38.511 38.511 39.894 -1.383 18321 13215 1 10 . 1 1 235 235 ASN H H 235 8.346 8.346 8.525 -0.179 18321 13216 1 10 . 1 1 236 236 GLY N N 236 109.378 109.378 108.260 1.118 18321 13217 1 10 . 1 1 236 236 GLY CA C 236 44.023 44.023 44.737 -0.714 18321 13218 1 10 . 1 1 236 236 GLY H H 236 7.939 7.939 7.520 0.419 18321 13219 1 10 . 1 1 237 237 PRO HA H 237 4.336 4.336 4.516 -0.180 18321 13220 1 10 . 1 1 237 237 PRO C C 237 175.942 175.942 175.633 0.309 18321 13221 1 10 . 1 1 237 237 PRO CA C 237 62.797 62.797 62.520 0.277 18321 13222 1 10 . 1 1 237 237 PRO CB C 237 27.421 27.421 31.630 -4.209 18321 13223 1 10 . 1 1 238 238 VAL N N 238 120.535 120.535 125.220 -4.685 18321 13224 1 10 . 1 1 238 238 VAL HA H 238 4.195 4.195 4.285 -0.090 18321 13225 1 10 . 1 1 238 238 VAL C C 238 173.775 173.775 174.301 -0.526 18321 13226 1 10 . 1 1 238 238 VAL CA C 238 61.173 61.173 61.132 0.041 18321 13227 1 10 . 1 1 238 238 VAL CB C 238 38.328 38.328 35.274 3.054 18321 13228 1 10 . 1 1 238 238 VAL H H 238 7.986 7.986 8.625 -0.639 18321 13229 1 10 . 1 1 239 239 PHE N N 239 123.522 123.522 126.201 -2.679 18321 13230 1 10 . 1 1 239 239 PHE HA H 239 5.539 5.539 4.891 0.648 18321 13231 1 10 . 1 1 239 239 PHE C C 239 174.207 174.207 174.551 -0.344 18321 13232 1 10 . 1 1 239 239 PHE CA C 239 56.993 56.993 56.569 0.424 18321 13233 1 10 . 1 1 239 239 PHE CB C 239 41.743 41.743 40.032 1.712 18321 13234 1 10 . 1 1 239 239 PHE H H 239 8.927 8.927 8.794 0.133 18321 13235 1 10 . 1 1 240 240 ALA N N 240 120.871 120.871 127.296 -6.425 18321 13236 1 10 . 1 1 240 240 ALA HA H 240 5.352 5.352 5.351 0.001 18321 13237 1 10 . 1 1 240 240 ALA C C 240 174.639 174.639 175.865 -1.226 18321 13238 1 10 . 1 1 240 240 ALA CA C 240 49.736 49.736 50.223 -0.487 18321 13239 1 10 . 1 1 240 240 ALA CB C 240 23.480 23.480 21.920 1.560 18321 13240 1 10 . 1 1 240 240 ALA H H 240 9.398 9.398 9.048 0.350 18321 13241 1 10 . 1 1 241 241 LYS N N 241 121.227 121.227 126.566 -5.339 18321 13242 1 10 . 1 1 241 241 LYS HA H 241 5.373 5.373 5.275 0.098 18321 13243 1 10 . 1 1 241 241 LYS C C 241 176.772 176.772 176.146 0.626 18321 13244 1 10 . 1 1 241 241 LYS CA C 241 53.128 53.128 54.898 -1.770 18321 13245 1 10 . 1 1 241 241 LYS CB C 241 34.850 34.850 34.642 0.208 18321 13246 1 10 . 1 1 241 241 LYS H H 241 8.947 8.947 8.734 0.213 18321 13247 1 10 . 1 1 242 242 ALA N N 242 126.833 126.833 130.625 -3.792 18321 13248 1 10 . 1 1 242 242 ALA HA H 242 4.764 4.764 4.653 0.111 18321 13249 1 10 . 1 1 242 242 ALA C C 242 178.506 178.506 178.173 0.333 18321 13250 1 10 . 1 1 242 242 ALA CA C 242 52.788 52.788 52.096 0.692 18321 13251 1 10 . 1 1 242 242 ALA CB C 242 19.084 19.084 18.913 0.171 18321 13252 1 10 . 1 1 242 242 ALA H H 242 9.373 9.373 8.506 0.867 18321 13253 1 10 . 1 1 243 243 ILE N N 243 118.731 118.731 119.924 -1.193 18321 13254 1 10 . 1 1 243 243 ILE HA H 243 4.454 4.454 4.141 0.313 18321 13255 1 10 . 1 1 243 243 ILE C C 243 174.773 174.773 175.860 -1.087 18321 13256 1 10 . 1 1 243 243 ILE CA C 243 60.613 60.613 62.379 -1.766 18321 13257 1 10 . 1 1 243 243 ILE CB C 243 39.232 39.232 38.237 0.995 18321 13258 1 10 . 1 1 243 243 ILE H H 243 8.933 8.933 8.598 0.335 18321 13259 1 10 . 1 1 244 244 GLN N N 244 121.616 121.616 118.295 3.321 18321 13260 1 10 . 1 1 244 244 GLN HA H 244 4.283 4.283 4.642 -0.359 18321 13261 1 10 . 1 1 244 244 GLN C C 244 172.815 172.815 174.201 -1.386 18321 13262 1 10 . 1 1 244 244 GLN CA C 244 54.750 54.750 54.237 0.513 18321 13263 1 10 . 1 1 244 244 GLN CB C 244 31.469 31.469 31.546 -0.076 18321 13264 1 10 . 1 1 244 244 GLN H H 244 7.438 7.438 7.745 -0.307 18321 13265 1 10 . 1 1 245 245 LYS N N 245 124.215 124.215 118.975 5.240 18321 13266 1 10 . 1 1 245 245 LYS HA H 245 3.962 3.962 4.429 -0.467 18321 13267 1 10 . 1 1 245 245 LYS C C 245 175.679 175.679 176.021 -0.342 18321 13268 1 10 . 1 1 245 245 LYS CA C 245 56.413 56.413 56.041 0.372 18321 13269 1 10 . 1 1 245 245 LYS CB C 245 32.847 32.847 33.683 -0.836 18321 13270 1 10 . 1 1 245 245 LYS H H 245 8.318 8.318 8.598 -0.280 18321 13271 1 10 . 1 1 246 246 ARG N N 246 127.327 127.327 119.842 7.485 18321 13272 1 10 . 1 1 246 246 ARG HA H 246 4.221 4.221 4.635 -0.414 18321 13273 1 10 . 1 1 246 246 ARG CA C 246 56.279 56.279 56.602 -0.323 18321 13274 1 10 . 1 1 246 246 ARG CB C 246 32.987 32.987 33.196 -0.209 18321 13275 1 10 . 1 1 246 246 ARG H H 246 9.248 9.248 8.891 0.357 18321 13276 1 10 . 1 1 249 249 CYS HA H 249 4.260 4.260 4.404 -0.144 18321 13277 1 10 . 1 1 249 249 CYS CA C 249 55.886 55.886 56.583 -0.696 18321 13278 1 10 . 1 1 249 249 CYS CB C 249 34.146 34.146 29.331 4.815 18321 13279 1 10 . 1 1 250 250 ALA HA H 250 3.926 3.926 4.069 -0.143 18321 13280 1 10 . 1 1 250 250 ALA CA C 250 54.344 54.344 54.831 -0.487 18321 13281 1 10 . 1 1 250 250 ALA CB C 250 18.342 18.342 18.317 0.025 18321 13282 1 10 . 1 1 251 251 TYR N N 251 110.618 110.618 112.158 -1.540 18321 13283 1 10 . 1 1 251 251 TYR HA H 251 4.489 4.489 4.954 -0.465 18321 13284 1 10 . 1 1 251 251 TYR C C 251 175.286 175.286 174.926 0.360 18321 13285 1 10 . 1 1 251 251 TYR CA C 251 56.137 56.137 54.885 1.252 18321 13286 1 10 . 1 1 251 251 TYR CB C 251 37.203 37.203 37.962 -0.759 18321 13287 1 10 . 1 1 251 251 TYR H H 251 7.037 7.037 7.841 -0.804 18321 13288 1 10 . 1 1 252 252 ASP N N 252 121.835 121.835 122.980 -1.145 18321 13289 1 10 . 1 1 252 252 ASP HA H 252 4.763 4.763 4.657 0.106 18321 13290 1 10 . 1 1 252 252 ASP CA C 252 52.351 52.351 53.896 -1.545 18321 13291 1 10 . 1 1 252 252 ASP CB C 252 39.995 39.995 41.017 -1.022 18321 13292 1 10 . 1 1 252 252 ASP H H 252 7.339 7.339 7.363 -0.024 18321 13293 1 10 . 1 1 253 253 LYS N N 253 123.177 123.177 125.208 -2.031 18321 13294 1 10 . 1 1 253 253 LYS HA H 253 4.270 4.270 4.560 -0.290 18321 13295 1 10 . 1 1 253 253 LYS C C 253 177.724 177.724 177.479 0.245 18321 13296 1 10 . 1 1 253 253 LYS CA C 253 57.036 57.036 55.521 1.515 18321 13297 1 10 . 1 1 253 253 LYS H H 253 8.396 8.396 7.881 0.515 18321 13298 1 10 . 1 1 254 254 THR N N 254 108.317 108.317 113.728 -5.411 18321 13299 1 10 . 1 1 254 254 THR HA H 254 4.517 4.517 3.820 0.697 18321 13300 1 10 . 1 1 254 254 THR C C 254 174.012 174.012 173.505 0.507 18321 13301 1 10 . 1 1 254 254 THR CA C 254 61.036 61.036 63.157 -2.121 18321 13302 1 10 . 1 1 254 254 THR CB C 254 69.307 69.307 67.529 1.778 18321 13303 1 10 . 1 1 254 254 THR H H 254 8.217 8.217 8.947 -0.730 18321 13304 1 10 . 1 1 255 255 ALA N N 255 124.762 124.762 122.580 2.182 18321 13305 1 10 . 1 1 255 255 ALA HA H 255 4.524 4.524 4.732 -0.208 18321 13306 1 10 . 1 1 255 255 ALA C C 255 176.630 176.630 175.859 0.771 18321 13307 1 10 . 1 1 255 255 ALA CA C 255 51.352 51.352 51.036 0.316 18321 13308 1 10 . 1 1 255 255 ALA CB C 255 20.135 20.135 20.421 -0.286 18321 13309 1 10 . 1 1 255 255 ALA H H 255 7.096 7.096 7.606 -0.510 18321 13310 1 10 . 1 1 256 256 LEU N N 256 124.379 124.379 120.477 3.902 18321 13311 1 10 . 1 1 256 256 LEU HA H 256 4.328 4.328 4.638 -0.310 18321 13312 1 10 . 1 1 256 256 LEU C C 256 176.007 176.007 175.698 0.309 18321 13313 1 10 . 1 1 256 256 LEU CA C 256 53.502 53.502 53.468 0.034 18321 13314 1 10 . 1 1 256 256 LEU CB C 256 44.665 44.665 44.738 -0.073 18321 13315 1 10 . 1 1 256 256 LEU H H 256 8.889 8.889 7.788 1.101 18321 13316 1 10 . 1 1 257 257 ALA N N 257 129.619 129.619 127.318 2.301 18321 13317 1 10 . 1 1 257 257 ALA HA H 257 4.445 4.445 4.537 -0.092 18321 13318 1 10 . 1 1 257 257 ALA C C 257 176.813 176.813 176.404 0.409 18321 13319 1 10 . 1 1 257 257 ALA CA C 257 51.179 51.179 51.564 -0.385 18321 13320 1 10 . 1 1 257 257 ALA CB C 257 18.973 18.973 18.616 0.357 18321 13321 1 10 . 1 1 257 257 ALA H H 257 8.529 8.529 8.308 0.221 18321 13322 1 10 . 1 1 258 258 LEU N N 258 119.300 119.300 125.693 -6.393 18321 13323 1 10 . 1 1 258 258 LEU HA H 258 4.782 4.782 4.671 0.111 18321 13324 1 10 . 1 1 258 258 LEU CA C 258 53.259 53.259 54.093 -0.834 18321 13325 1 10 . 1 1 258 258 LEU CB C 258 45.972 45.972 44.974 0.998 18321 13326 1 10 . 1 1 258 258 LEU H H 258 8.505 8.505 8.933 -0.428 18321 13327 1 10 . 1 1 259 259 GLU N N 259 123.919 123.919 121.817 2.102 18321 13328 1 10 . 1 1 259 259 GLU HA H 259 4.516 4.516 4.637 -0.121 18321 13329 1 10 . 1 1 259 259 GLU C C 259 175.795 175.795 175.713 0.082 18321 13330 1 10 . 1 1 259 259 GLU CA C 259 52.896 52.896 53.991 -1.095 18321 13331 1 10 . 1 1 259 259 GLU H H 259 8.943 8.943 8.560 0.383 18321 13332 1 10 . 1 1 260 260 VAL N N 260 122.122 122.122 120.433 1.689 18321 13333 1 10 . 1 1 260 260 VAL HA H 260 2.923 2.923 3.890 -0.967 18321 13334 1 10 . 1 1 260 260 VAL C C 260 177.964 177.964 177.080 0.884 18321 13335 1 10 . 1 1 260 260 VAL CA C 260 65.417 65.417 63.925 1.492 18321 13336 1 10 . 1 1 260 260 VAL CB C 260 30.668 30.668 31.434 -0.766 18321 13337 1 10 . 1 1 260 260 VAL H H 260 8.956 8.956 8.486 0.470 18321 13338 1 10 . 1 1 261 261 GLY N N 261 116.009 116.009 116.291 -0.282 18321 13339 1 10 . 1 1 261 261 GLY C C 261 176.288 176.288 174.324 1.964 18321 13340 1 10 . 1 1 261 261 GLY CA C 261 44.210 44.210 44.858 -0.647 18321 13341 1 10 . 1 1 261 261 GLY H H 261 8.799 8.799 9.137 -0.338 18321 13342 1 10 . 1 1 262 262 ASP N N 262 121.945 121.945 121.466 0.479 18321 13343 1 10 . 1 1 262 262 ASP HA H 262 4.423 4.423 5.006 -0.583 18321 13344 1 10 . 1 1 262 262 ASP C C 262 175.381 175.381 175.138 0.243 18321 13345 1 10 . 1 1 262 262 ASP CA C 262 55.243 55.243 53.389 1.854 18321 13346 1 10 . 1 1 262 262 ASP CB C 262 41.819 41.819 42.919 -1.099 18321 13347 1 10 . 1 1 262 262 ASP H H 262 8.180 8.180 7.812 0.368 18321 13348 1 10 . 1 1 263 263 ILE N N 263 121.452 121.452 120.507 0.945 18321 13349 1 10 . 1 1 263 263 ILE HA H 263 4.707 4.707 4.656 0.051 18321 13350 1 10 . 1 1 263 263 ILE C C 263 174.996 174.996 175.946 -0.950 18321 13351 1 10 . 1 1 263 263 ILE CA C 263 59.289 59.289 59.176 0.113 18321 13352 1 10 . 1 1 263 263 ILE CB C 263 36.987 36.987 38.385 -1.398 18321 13353 1 10 . 1 1 263 263 ILE H H 263 8.460 8.460 8.326 0.134 18321 13354 1 10 . 1 1 264 264 VAL N N 264 128.756 128.756 128.998 -0.242 18321 13355 1 10 . 1 1 264 264 VAL HA H 264 4.309 4.309 4.075 0.234 18321 13356 1 10 . 1 1 264 264 VAL C C 264 175.486 175.486 175.001 0.485 18321 13357 1 10 . 1 1 264 264 VAL CA C 264 59.091 59.091 61.604 -2.513 18321 13358 1 10 . 1 1 264 264 VAL CB C 264 34.541 34.541 31.733 2.808 18321 13359 1 10 . 1 1 264 264 VAL H H 264 9.479 9.479 9.242 0.237 18321 13360 1 10 . 1 1 265 265 LYS N N 265 128.101 128.101 130.013 -1.912 18321 13361 1 10 . 1 1 265 265 LYS HA H 265 4.342 4.342 4.228 0.114 18321 13362 1 10 . 1 1 265 265 LYS C C 265 175.531 175.531 175.273 0.258 18321 13363 1 10 . 1 1 265 265 LYS CA C 265 55.620 55.620 55.460 0.160 18321 13364 1 10 . 1 1 265 265 LYS CB C 265 33.149 33.149 32.455 0.694 18321 13365 1 10 . 1 1 265 265 LYS H H 265 8.715 8.715 8.549 0.166 18321 13366 1 10 . 1 1 266 266 VAL N N 266 129.537 129.537 128.064 1.473 18321 13367 1 10 . 1 1 266 266 VAL HA H 266 4.333 4.333 4.349 -0.016 18321 13368 1 10 . 1 1 266 266 VAL C C 266 176.166 176.166 175.139 1.027 18321 13369 1 10 . 1 1 266 266 VAL CA C 266 63.339 63.339 61.278 2.062 18321 13370 1 10 . 1 1 266 266 VAL CB C 266 30.712 30.712 34.466 -3.754 18321 13371 1 10 . 1 1 266 266 VAL H H 266 9.073 9.073 8.627 0.446 18321 13372 1 10 . 1 1 267 267 THR N N 267 120.020 120.020 120.840 -0.820 18321 13373 1 10 . 1 1 267 267 THR HA H 267 4.189 4.189 4.435 -0.246 18321 13374 1 10 . 1 1 267 267 THR C C 267 176.054 176.054 173.928 2.126 18321 13375 1 10 . 1 1 267 267 THR CA C 267 62.204 62.204 63.449 -1.245 18321 13376 1 10 . 1 1 267 267 THR CB C 267 68.200 68.200 70.193 -1.993 18321 13377 1 10 . 1 1 267 267 THR H H 267 9.130 9.130 8.281 0.849 18321 13378 1 10 . 1 1 268 268 ARG N N 268 120.839 120.839 120.969 -0.130 18321 13379 1 10 . 1 1 268 268 ARG HA H 268 4.236 4.236 4.689 -0.453 18321 13380 1 10 . 1 1 268 268 ARG CA C 268 56.321 56.321 54.858 1.463 18321 13381 1 10 . 1 1 268 268 ARG CB C 268 33.049 33.049 32.541 0.508 18321 13382 1 10 . 1 1 268 268 ARG H H 268 7.631 7.631 7.433 0.198 18321 13383 1 10 . 1 1 269 269 MET N N 269 125.443 125.443 123.459 1.984 18321 13384 1 10 . 1 1 269 269 MET C C 269 174.392 174.392 174.898 -0.506 18321 13385 1 10 . 1 1 269 269 MET H H 269 8.532 8.532 8.430 0.102 18321 13386 1 10 . 1 1 270 270 ASN N N 270 119.125 119.125 123.804 -4.679 18321 13387 1 10 . 1 1 270 270 ASN HA H 270 4.546 4.546 4.828 -0.282 18321 13388 1 10 . 1 1 270 270 ASN C C 270 172.133 172.133 176.342 -4.209 18321 13389 1 10 . 1 1 270 270 ASN CA C 270 53.639 53.639 52.342 1.298 18321 13390 1 10 . 1 1 270 270 ASN CB C 270 39.845 39.845 38.968 0.877 18321 13391 1 10 . 1 1 270 270 ASN H H 270 6.631 6.631 8.806 -2.175 18321 13392 1 10 . 1 1 271 271 ILE N N 271 122.532 122.532 123.859 -1.327 18321 13393 1 10 . 1 1 271 271 ILE HA H 271 4.417 4.417 3.807 0.610 18321 13394 1 10 . 1 1 271 271 ILE CA C 271 63.348 63.348 62.757 0.591 18321 13395 1 10 . 1 1 271 271 ILE CB C 271 38.198 38.198 37.189 1.009 18321 13396 1 10 . 1 1 271 271 ILE H H 271 8.565 8.565 8.896 -0.331 18321 13397 1 10 . 1 1 272 272 ASN HA H 272 4.527 4.527 4.575 -0.048 18321 13398 1 10 . 1 1 272 272 ASN C C 272 176.259 176.259 176.115 0.144 18321 13399 1 10 . 1 1 272 272 ASN CA C 272 53.225 53.225 54.652 -1.427 18321 13400 1 10 . 1 1 272 272 ASN CB C 272 37.565 37.565 38.995 -1.430 18321 13401 1 10 . 1 1 273 273 GLY N N 273 107.043 107.043 105.942 1.101 18321 13402 1 10 . 1 1 273 273 GLY C C 273 173.216 173.216 172.424 0.792 18321 13403 1 10 . 1 1 273 273 GLY CA C 273 45.299 45.299 45.105 0.194 18321 13404 1 10 . 1 1 273 273 GLY H H 273 8.086 8.086 8.105 -0.019 18321 13405 1 10 . 1 1 274 274 GLN N N 274 120.624 120.624 121.730 -1.106 18321 13406 1 10 . 1 1 274 274 GLN HA H 274 4.551 4.551 4.342 0.209 18321 13407 1 10 . 1 1 274 274 GLN C C 274 175.039 175.039 175.644 -0.605 18321 13408 1 10 . 1 1 274 274 GLN CA C 274 54.556 54.556 54.599 -0.043 18321 13409 1 10 . 1 1 274 274 GLN CB C 274 33.698 33.698 28.218 5.481 18321 13410 1 10 . 1 1 274 274 GLN H H 274 8.045 8.045 8.003 0.042 18321 13411 1 10 . 1 1 275 275 TRP N N 275 125.596 125.596 125.386 0.210 18321 13412 1 10 . 1 1 275 275 TRP HA H 275 4.588 4.588 4.761 -0.173 18321 13413 1 10 . 1 1 275 275 TRP C C 275 172.832 172.832 175.764 -2.932 18321 13414 1 10 . 1 1 275 275 TRP CA C 275 55.296 55.296 54.041 1.255 18321 13415 1 10 . 1 1 275 275 TRP CB C 275 31.393 31.393 30.539 0.854 18321 13416 1 10 . 1 1 275 275 TRP H H 275 8.484 8.484 8.106 0.378 18321 13417 1 10 . 1 1 276 276 GLU N N 276 119.012 119.012 120.253 -1.241 18321 13418 1 10 . 1 1 276 276 GLU HA H 276 5.190 5.190 5.274 -0.084 18321 13419 1 10 . 1 1 276 276 GLU C C 276 176.553 176.553 176.470 0.083 18321 13420 1 10 . 1 1 276 276 GLU CA C 276 54.288 54.288 55.644 -1.356 18321 13421 1 10 . 1 1 276 276 GLU CB C 276 32.851 32.851 31.416 1.435 18321 13422 1 10 . 1 1 276 276 GLU H H 276 8.643 8.643 8.495 0.148 18321 13423 1 10 . 1 1 277 277 GLY N N 277 111.364 111.364 111.747 -0.383 18321 13424 1 10 . 1 1 277 277 GLY C C 277 170.707 170.707 172.465 -1.758 18321 13425 1 10 . 1 1 277 277 GLY CA C 277 46.723 46.723 43.730 2.993 18321 13426 1 10 . 1 1 277 277 GLY H H 277 9.072 9.072 8.860 0.212 18321 13427 1 10 . 1 1 278 278 GLU N N 278 117.733 117.733 124.183 -6.450 18321 13428 1 10 . 1 1 278 278 GLU HA H 278 5.748 5.748 4.894 0.854 18321 13429 1 10 . 1 1 278 278 GLU C C 278 176.051 176.051 175.205 0.846 18321 13430 1 10 . 1 1 278 278 GLU CA C 278 53.620 53.620 55.217 -1.597 18321 13431 1 10 . 1 1 278 278 GLU CB C 278 33.742 33.742 31.261 2.481 18321 13432 1 10 . 1 1 278 278 GLU H H 278 8.810 8.810 8.384 0.426 18321 13433 1 10 . 1 1 279 279 VAL N N 279 123.834 123.834 126.634 -2.800 18321 13434 1 10 . 1 1 279 279 VAL HA H 279 4.404 4.404 4.361 0.043 18321 13435 1 10 . 1 1 279 279 VAL C C 279 175.289 175.289 175.972 -0.683 18321 13436 1 10 . 1 1 279 279 VAL CA C 279 61.166 61.166 60.018 1.148 18321 13437 1 10 . 1 1 279 279 VAL CB C 279 34.123 34.123 32.762 1.361 18321 13438 1 10 . 1 1 279 279 VAL H H 279 8.887 8.887 8.887 0.000 18321 13439 1 10 . 1 1 280 280 ASN N N 280 126.025 126.025 126.695 -0.670 18321 13440 1 10 . 1 1 280 280 ASN HA H 280 4.435 4.435 4.421 0.014 18321 13441 1 10 . 1 1 280 280 ASN C C 280 175.205 175.205 175.238 -0.033 18321 13442 1 10 . 1 1 280 280 ASN CA C 280 45.615 45.615 53.597 -7.982 18321 13443 1 10 . 1 1 280 280 ASN CB C 280 37.386 37.386 38.059 -0.672 18321 13444 1 10 . 1 1 280 280 ASN H H 280 9.322 9.322 9.304 0.018 18321 13445 1 10 . 1 1 281 281 GLY N N 281 104.588 104.588 103.530 1.058 18321 13446 1 10 . 1 1 281 281 GLY C C 281 173.944 173.944 173.427 0.517 18321 13447 1 10 . 1 1 281 281 GLY CA C 281 45.224 45.224 44.914 0.310 18321 13448 1 10 . 1 1 281 281 GLY H H 281 8.768 8.768 8.307 0.461 18321 13449 1 10 . 1 1 282 282 ARG N N 282 122.567 122.567 121.563 1.004 18321 13450 1 10 . 1 1 282 282 ARG HA H 282 4.559 4.559 4.579 -0.020 18321 13451 1 10 . 1 1 282 282 ARG C C 282 174.350 174.350 174.173 0.177 18321 13452 1 10 . 1 1 282 282 ARG CA C 282 54.933 54.933 54.901 0.031 18321 13453 1 10 . 1 1 282 282 ARG CB C 282 31.765 31.765 32.560 -0.795 18321 13454 1 10 . 1 1 282 282 ARG H H 282 8.149 8.149 7.680 0.469 18321 13455 1 10 . 1 1 283 283 LYS N N 283 121.565 121.565 128.871 -7.306 18321 13456 1 10 . 1 1 283 283 LYS HA H 283 5.584 5.584 5.495 0.089 18321 13457 1 10 . 1 1 283 283 LYS CA C 283 54.143 54.143 55.223 -1.080 18321 13458 1 10 . 1 1 283 283 LYS CB C 283 36.040 36.040 34.447 1.593 18321 13459 1 10 . 1 1 283 283 LYS H H 283 8.424 8.424 8.676 -0.252 18321 13460 1 10 . 1 1 284 284 GLY C C 284 173.006 173.006 172.500 0.506 18321 13461 1 10 . 1 1 284 284 GLY CA C 284 45.886 45.886 44.716 1.170 18321 13462 1 10 . 1 1 285 285 LEU N N 285 119.673 119.673 121.580 -1.907 18321 13463 1 10 . 1 1 285 285 LEU HA H 285 5.718 5.718 5.617 0.101 18321 13464 1 10 . 1 1 285 285 LEU C C 285 178.657 178.657 176.367 2.290 18321 13465 1 10 . 1 1 285 285 LEU CA C 285 53.656 53.656 54.486 -0.831 18321 13466 1 10 . 1 1 285 285 LEU CB C 285 44.813 44.813 42.951 1.862 18321 13467 1 10 . 1 1 285 285 LEU H H 285 8.734 8.734 8.737 -0.003 18321 13468 1 10 . 1 1 286 286 PHE N N 286 118.785 118.785 120.684 -1.899 18321 13469 1 10 . 1 1 286 286 PHE HA H 286 4.521 4.521 5.049 -0.528 18321 13470 1 10 . 1 1 286 286 PHE CA C 286 57.592 57.592 54.515 3.077 18321 13471 1 10 . 1 1 286 286 PHE CB C 286 40.669 40.669 40.031 0.638 18321 13472 1 10 . 1 1 286 286 PHE H H 286 9.120 9.120 8.865 0.255 18321 13473 1 10 . 1 1 287 287 PRO HA H 287 4.385 4.385 4.339 0.046 18321 13474 1 10 . 1 1 287 287 PRO CA C 287 62.814 62.814 61.574 1.240 18321 13475 1 10 . 1 1 287 287 PRO CB C 287 32.133 32.133 31.942 0.192 18321 13476 1 10 . 1 1 288 288 PHE C C 288 174.837 174.837 176.544 -1.707 18321 13477 1 10 . 1 1 288 288 PHE CA C 288 59.020 59.020 59.452 -0.431 18321 13478 1 10 . 1 1 288 288 PHE CB C 288 34.987 34.987 37.044 -2.057 18321 13479 1 10 . 1 1 289 289 THR N N 289 107.865 107.865 110.972 -3.107 18321 13480 1 10 . 1 1 289 289 THR HA H 289 3.589 3.589 4.062 -0.473 18321 13481 1 10 . 1 1 289 289 THR C C 289 176.125 176.125 174.905 1.220 18321 13482 1 10 . 1 1 289 289 THR CA C 289 62.243 62.243 64.102 -1.859 18321 13483 1 10 . 1 1 289 289 THR CB C 289 69.365 69.365 67.844 1.521 18321 13484 1 10 . 1 1 289 289 THR H H 289 6.453 6.453 7.841 -1.388 18321 13485 1 10 . 1 1 290 290 HIS N N 290 119.462 119.462 118.943 0.519 18321 13486 1 10 . 1 1 290 290 HIS HA H 290 4.196 4.196 4.817 -0.621 18321 13487 1 10 . 1 1 290 290 HIS C C 290 175.165 175.165 173.623 1.542 18321 13488 1 10 . 1 1 290 290 HIS CA C 290 57.635 57.635 56.402 1.233 18321 13489 1 10 . 1 1 290 290 HIS CB C 290 29.840 29.840 32.010 -2.170 18321 13490 1 10 . 1 1 290 290 HIS H H 290 7.835 7.835 7.877 -0.042 18321 13491 1 10 . 1 1 291 291 VAL N N 291 110.050 110.050 112.863 -2.813 18321 13492 1 10 . 1 1 291 291 VAL HA H 291 5.445 5.445 5.193 0.252 18321 13493 1 10 . 1 1 291 291 VAL C C 291 173.386 173.386 174.787 -1.401 18321 13494 1 10 . 1 1 291 291 VAL CA C 291 57.794 57.794 58.668 -0.874 18321 13495 1 10 . 1 1 291 291 VAL CB C 291 35.784 35.784 35.145 0.639 18321 13496 1 10 . 1 1 291 291 VAL H H 291 7.562 7.562 7.374 0.188 18321 13497 1 10 . 1 1 292 292 LYS N N 292 119.445 119.445 120.940 -1.495 18321 13498 1 10 . 1 1 292 292 LYS HA H 292 4.857 4.857 4.742 0.115 18321 13499 1 10 . 1 1 292 292 LYS C C 292 176.512 176.512 175.581 0.931 18321 13500 1 10 . 1 1 292 292 LYS CA C 292 54.647 54.647 54.656 -0.008 18321 13501 1 10 . 1 1 292 292 LYS CB C 292 35.665 35.665 36.147 -0.482 18321 13502 1 10 . 1 1 292 292 LYS H H 292 8.753 8.753 8.546 0.207 18321 13503 1 10 . 1 1 293 293 ILE N N 293 128.707 128.707 125.043 3.664 18321 13504 1 10 . 1 1 293 293 ILE HA H 293 4.509 4.509 4.500 0.009 18321 13505 1 10 . 1 1 293 293 ILE C C 293 175.666 175.666 176.837 -1.171 18321 13506 1 10 . 1 1 293 293 ILE CA C 293 62.563 62.563 60.689 1.874 18321 13507 1 10 . 1 1 293 293 ILE CB C 293 38.076 38.076 36.822 1.254 18321 13508 1 10 . 1 1 293 293 ILE H H 293 9.107 9.107 8.777 0.330 18321 13509 1 10 . 1 1 294 294 PHE N N 294 126.638 126.638 124.202 2.436 18321 13510 1 10 . 1 1 294 294 PHE HA H 294 4.898 4.898 4.972 -0.074 18321 13511 1 10 . 1 1 294 294 PHE C C 294 175.838 175.838 173.899 1.939 18321 13512 1 10 . 1 1 294 294 PHE CA C 294 56.335 56.335 56.367 -0.032 18321 13513 1 10 . 1 1 294 294 PHE CB C 294 41.196 41.196 41.370 -0.173 18321 13514 1 10 . 1 1 294 294 PHE H H 294 8.716 8.716 8.072 0.644 18321 13515 1 10 . 1 1 295 295 ASP N N 295 122.961 122.961 121.261 1.700 18321 13516 1 10 . 1 1 295 295 ASP HA H 295 5.003 5.003 4.704 0.299 18321 13517 1 10 . 1 1 295 295 ASP CA C 295 50.602 50.602 55.576 -4.974 18321 13518 1 10 . 1 1 295 295 ASP CB C 295 40.754 40.754 40.352 0.403 18321 13519 1 10 . 1 1 295 295 ASP H H 295 8.418 8.418 9.129 -0.711 18321 13520 1 10 . 1 1 296 296 PRO HA H 296 4.524 4.524 4.687 -0.163 18321 13521 1 10 . 1 1 296 296 PRO C C 296 176.807 176.807 176.934 -0.127 18321 13522 1 10 . 1 1 296 296 PRO CA C 296 62.987 62.987 63.848 -0.861 18321 13523 1 10 . 1 1 296 296 PRO CB C 296 32.033 32.033 32.446 -0.412 18321 13524 1 10 . 1 1 297 297 GLN N N 297 120.729 120.729 116.656 4.073 18321 13525 1 10 . 1 1 297 297 GLN HA H 297 4.274 4.274 4.511 -0.237 18321 13526 1 10 . 1 1 297 297 GLN CA C 297 56.427 56.427 54.977 1.450 18321 13527 1 10 . 1 1 297 297 GLN CB C 297 28.819 28.819 31.351 -2.531 18321 13528 1 10 . 1 1 297 297 GLN H H 297 8.551 8.551 8.028 0.523 18321 13529 1 10 . 1 1 299 299 PRO C C 299 176.936 176.936 176.060 0.876 18321 13530 1 10 . 1 1 299 299 PRO CA C 299 63.406 63.406 63.124 0.282 18321 13531 1 10 . 1 1 299 299 PRO CB C 299 31.421 31.421 31.086 0.335 18321 13532 1 10 . 1 1 300 300 ASP N N 300 119.609 119.609 118.056 1.553 18321 13533 1 10 . 1 1 300 300 ASP C C 300 176.344 176.344 177.251 -0.907 18321 13534 1 10 . 1 1 300 300 ASP CA C 300 54.178 54.178 56.278 -2.100 18321 13535 1 10 . 1 1 300 300 ASP CB C 300 40.661 40.661 40.774 -0.113 18321 13536 1 10 . 1 1 300 300 ASP H H 300 8.239 8.239 8.183 0.056 18321 13537 1 10 . 1 1 301 301 GLU N N 301 120.462 120.462 120.035 0.427 18321 13538 1 10 . 1 1 301 301 GLU CA C 301 56.188 56.188 57.867 -1.679 18321 13539 1 10 . 1 1 301 301 GLU CB C 301 29.507 29.507 30.849 -1.343 18321 13540 1 10 . 1 1 301 301 GLU H H 301 8.084 8.084 7.907 0.177 18321 13541 1 11 . 1 1 2 2 SER HA H 2 4.521 4.521 4.714 -0.193 18321 13542 1 11 . 1 1 2 2 SER CA C 2 58.326 58.326 57.921 0.405 18321 13543 1 11 . 1 1 2 2 SER CB C 2 64.062 64.062 64.088 -0.026 18321 13544 1 11 . 1 1 3 3 SER HA H 3 4.465 4.465 4.091 0.374 18321 13545 1 11 . 1 1 3 3 SER C C 3 173.887 173.887 173.928 -0.041 18321 13546 1 11 . 1 1 3 3 SER CA C 3 58.374 58.374 59.994 -1.620 18321 13547 1 11 . 1 1 3 3 SER CB C 3 63.920 63.920 62.345 1.575 18321 13548 1 11 . 1 1 4 4 ALA N N 4 124.755 124.755 125.746 -0.991 18321 13549 1 11 . 1 1 4 4 ALA HA H 4 4.547 4.547 4.633 -0.086 18321 13550 1 11 . 1 1 4 4 ALA CA C 4 52.737 52.737 52.923 -0.186 18321 13551 1 11 . 1 1 4 4 ALA CB C 4 19.636 19.636 18.854 0.782 18321 13552 1 11 . 1 1 4 4 ALA H H 4 8.244 8.244 8.054 0.190 18321 13553 1 11 . 1 1 5 5 ARG N N 5 120.383 120.383 123.957 -3.574 18321 13554 1 11 . 1 1 5 5 ARG HA H 5 4.524 4.524 4.609 -0.085 18321 13555 1 11 . 1 1 5 5 ARG C C 5 175.611 175.611 176.305 -0.694 18321 13556 1 11 . 1 1 5 5 ARG CA C 5 56.082 56.082 55.388 0.695 18321 13557 1 11 . 1 1 5 5 ARG CB C 5 30.695 30.695 32.080 -1.385 18321 13558 1 11 . 1 1 5 5 ARG H H 5 8.727 8.727 8.426 0.301 18321 13559 1 11 . 1 1 6 6 PHE N N 6 115.159 115.159 119.152 -3.993 18321 13560 1 11 . 1 1 6 6 PHE HA H 6 4.786 4.786 4.808 -0.022 18321 13561 1 11 . 1 1 6 6 PHE C C 6 172.076 172.076 176.055 -3.979 18321 13562 1 11 . 1 1 6 6 PHE CA C 6 56.640 56.640 55.535 1.105 18321 13563 1 11 . 1 1 6 6 PHE CB C 6 40.378 40.378 39.622 0.756 18321 13564 1 11 . 1 1 6 6 PHE H H 6 7.536 7.536 7.764 -0.228 18321 13565 1 11 . 1 1 7 7 ASP N N 7 121.846 121.846 124.190 -2.344 18321 13566 1 11 . 1 1 7 7 ASP HA H 7 4.846 4.846 4.365 0.481 18321 13567 1 11 . 1 1 7 7 ASP CA C 7 52.327 52.327 56.540 -4.213 18321 13568 1 11 . 1 1 7 7 ASP CB C 7 41.298 41.298 40.952 0.346 18321 13569 1 11 . 1 1 7 7 ASP H H 7 9.062 9.062 8.913 0.149 18321 13570 1 11 . 1 1 8 8 SER HA H 8 3.950 3.950 4.369 -0.419 18321 13571 1 11 . 1 1 8 8 SER C C 8 174.705 174.705 173.414 1.291 18321 13572 1 11 . 1 1 8 8 SER CA C 8 61.937 61.937 58.834 3.103 18321 13573 1 11 . 1 1 8 8 SER CB C 8 62.260 62.260 62.545 -0.285 18321 13574 1 11 . 1 1 9 9 SER N N 9 114.373 114.373 113.727 0.646 18321 13575 1 11 . 1 1 9 9 SER HA H 9 4.529 4.529 4.643 -0.114 18321 13576 1 11 . 1 1 9 9 SER C C 9 175.089 175.089 173.042 2.047 18321 13577 1 11 . 1 1 9 9 SER CA C 9 59.851 59.851 58.791 1.060 18321 13578 1 11 . 1 1 9 9 SER CB C 9 64.246 64.246 64.267 -0.021 18321 13579 1 11 . 1 1 9 9 SER H H 9 8.722 8.722 8.331 0.391 18321 13580 1 11 . 1 1 10 10 ASP N N 10 121.818 121.818 123.631 -1.813 18321 13581 1 11 . 1 1 10 10 ASP HA H 10 4.730 4.730 4.573 0.157 18321 13582 1 11 . 1 1 10 10 ASP C C 10 174.455 174.455 177.240 -2.785 18321 13583 1 11 . 1 1 10 10 ASP CA C 10 52.432 52.432 54.661 -2.229 18321 13584 1 11 . 1 1 10 10 ASP CB C 10 39.607 39.607 41.100 -1.493 18321 13585 1 11 . 1 1 10 10 ASP H H 10 7.600 7.600 8.605 -1.005 18321 13586 1 11 . 1 1 11 11 ARG N N 11 125.238 125.238 125.771 -0.533 18321 13587 1 11 . 1 1 11 11 ARG HA H 11 1.936 1.936 2.944 -1.008 18321 13588 1 11 . 1 1 11 11 ARG C C 11 176.916 176.916 177.845 -0.929 18321 13589 1 11 . 1 1 11 11 ARG CA C 11 57.451 57.451 57.897 -0.446 18321 13590 1 11 . 1 1 11 11 ARG CB C 11 43.014 43.014 29.216 13.798 18321 13591 1 11 . 1 1 11 11 ARG H H 11 7.739 7.739 8.301 -0.562 18321 13592 1 11 . 1 1 12 12 SER N N 12 112.065 112.065 113.542 -1.477 18321 13593 1 11 . 1 1 12 12 SER HA H 12 4.695 4.695 4.235 0.460 18321 13594 1 11 . 1 1 12 12 SER C C 12 175.092 175.092 174.944 0.148 18321 13595 1 11 . 1 1 12 12 SER CA C 12 60.785 60.785 59.598 1.187 18321 13596 1 11 . 1 1 12 12 SER CB C 12 62.889 62.889 62.245 0.644 18321 13597 1 11 . 1 1 12 12 SER H H 12 7.888 7.888 7.738 0.150 18321 13598 1 11 . 1 1 13 13 ALA N N 13 122.249 122.249 123.015 -0.766 18321 13599 1 11 . 1 1 13 13 ALA HA H 13 4.216 4.216 4.425 -0.209 18321 13600 1 11 . 1 1 13 13 ALA C C 13 178.069 178.069 177.840 0.229 18321 13601 1 11 . 1 1 13 13 ALA CA C 13 53.562 53.562 53.917 -0.355 18321 13602 1 11 . 1 1 13 13 ALA CB C 13 19.339 19.339 19.837 -0.498 18321 13603 1 11 . 1 1 13 13 ALA H H 13 7.418 7.418 7.774 -0.356 18321 13604 1 11 . 1 1 14 14 TRP N N 14 107.433 107.433 111.902 -4.469 18321 13605 1 11 . 1 1 14 14 TRP HA H 14 4.785 4.785 4.814 -0.029 18321 13606 1 11 . 1 1 14 14 TRP C C 14 175.286 175.286 175.597 -0.311 18321 13607 1 11 . 1 1 14 14 TRP CA C 14 55.212 55.212 55.323 -0.111 18321 13608 1 11 . 1 1 14 14 TRP CB C 14 32.776 32.776 31.244 1.532 18321 13609 1 11 . 1 1 14 14 TRP H H 14 6.273 6.273 6.910 -0.637 18321 13610 1 11 . 1 1 15 15 TYR N N 15 122.315 122.315 124.538 -2.223 18321 13611 1 11 . 1 1 15 15 TYR HA H 15 5.436 5.436 4.992 0.444 18321 13612 1 11 . 1 1 15 15 TYR C C 15 175.325 175.325 175.162 0.163 18321 13613 1 11 . 1 1 15 15 TYR CA C 15 56.609 56.609 57.594 -0.985 18321 13614 1 11 . 1 1 15 15 TYR CB C 15 36.940 36.940 38.636 -1.696 18321 13615 1 11 . 1 1 15 15 TYR H H 15 8.221 8.221 7.788 0.433 18321 13616 1 11 . 1 1 16 16 MET N N 16 126.031 126.031 126.163 -0.132 18321 13617 1 11 . 1 1 16 16 MET HA H 16 4.462 4.462 4.381 0.081 18321 13618 1 11 . 1 1 16 16 MET CA C 16 53.046 53.046 53.397 -0.351 18321 13619 1 11 . 1 1 16 16 MET CB C 16 41.114 41.114 31.797 9.316 18321 13620 1 11 . 1 1 16 16 MET H H 16 8.989 8.989 8.770 0.219 18321 13621 1 11 . 1 1 17 17 GLY CA C 17 45.803 45.803 45.299 0.504 18321 13622 1 11 . 1 1 18 18 PRO HA H 18 4.675 4.675 4.827 -0.152 18321 13623 1 11 . 1 1 18 18 PRO C C 18 175.943 175.943 175.884 0.059 18321 13624 1 11 . 1 1 18 18 PRO CA C 18 63.647 63.647 63.623 0.024 18321 13625 1 11 . 1 1 18 18 PRO CB C 18 29.276 29.276 30.510 -1.234 18321 13626 1 11 . 1 1 19 19 VAL N N 19 126.159 126.159 120.765 5.394 18321 13627 1 11 . 1 1 19 19 VAL HA H 19 4.011 4.011 4.322 -0.311 18321 13628 1 11 . 1 1 19 19 VAL C C 19 175.812 175.812 174.734 1.078 18321 13629 1 11 . 1 1 19 19 VAL CA C 19 62.355 62.355 60.326 2.029 18321 13630 1 11 . 1 1 19 19 VAL CB C 19 33.468 33.468 35.612 -2.144 18321 13631 1 11 . 1 1 19 19 VAL H H 19 7.851 7.851 7.962 -0.111 18321 13632 1 11 . 1 1 20 20 SER N N 20 123.950 123.950 113.952 9.998 18321 13633 1 11 . 1 1 20 20 SER HA H 20 4.453 4.453 4.750 -0.297 18321 13634 1 11 . 1 1 20 20 SER CA C 20 57.631 57.631 57.417 0.214 18321 13635 1 11 . 1 1 20 20 SER CB C 20 65.951 65.951 65.192 0.759 18321 13636 1 11 . 1 1 20 20 SER H H 20 8.800 8.800 7.980 0.820 18321 13637 1 11 . 1 1 21 21 ARG N N 21 123.461 123.461 121.887 1.574 18321 13638 1 11 . 1 1 21 21 ARG HA H 21 3.489 3.489 4.106 -0.617 18321 13639 1 11 . 1 1 21 21 ARG C C 21 178.164 178.164 178.469 -0.305 18321 13640 1 11 . 1 1 21 21 ARG CA C 21 60.025 60.025 59.777 0.248 18321 13641 1 11 . 1 1 21 21 ARG CB C 21 30.334 30.334 30.085 0.249 18321 13642 1 11 . 1 1 21 21 ARG H H 21 9.307 9.307 8.907 0.400 18321 13643 1 11 . 1 1 22 22 GLN N N 22 116.591 116.591 118.447 -1.856 18321 13644 1 11 . 1 1 22 22 GLN HA H 22 4.008 4.008 4.070 -0.062 18321 13645 1 11 . 1 1 22 22 GLN CA C 22 59.095 59.095 59.463 -0.368 18321 13646 1 11 . 1 1 22 22 GLN CB C 22 29.249 29.249 28.450 0.799 18321 13647 1 11 . 1 1 22 22 GLN H H 22 8.394 8.394 8.621 -0.227 18321 13648 1 11 . 1 1 23 23 GLU N N 23 122.191 122.191 119.927 2.264 18321 13649 1 11 . 1 1 23 23 GLU HA H 23 4.037 4.037 3.986 0.051 18321 13650 1 11 . 1 1 23 23 GLU C C 23 178.986 178.986 178.961 0.025 18321 13651 1 11 . 1 1 23 23 GLU CA C 23 59.081 59.081 58.925 0.156 18321 13652 1 11 . 1 1 23 23 GLU CB C 23 31.896 31.896 29.488 2.408 18321 13653 1 11 . 1 1 23 23 GLU H H 23 8.106 8.106 7.657 0.449 18321 13654 1 11 . 1 1 24 24 ALA N N 24 121.964 121.964 121.245 0.719 18321 13655 1 11 . 1 1 24 24 ALA HA H 24 3.762 3.762 3.908 -0.146 18321 13656 1 11 . 1 1 24 24 ALA C C 24 178.653 178.653 179.224 -0.571 18321 13657 1 11 . 1 1 24 24 ALA CA C 24 55.480 55.480 55.366 0.114 18321 13658 1 11 . 1 1 24 24 ALA CB C 24 18.049 18.049 18.389 -0.340 18321 13659 1 11 . 1 1 24 24 ALA H H 24 8.732 8.732 8.304 0.428 18321 13660 1 11 . 1 1 25 25 GLN N N 25 116.229 116.229 118.355 -2.126 18321 13661 1 11 . 1 1 25 25 GLN HA H 25 3.950 3.950 4.023 -0.073 18321 13662 1 11 . 1 1 25 25 GLN C C 25 177.442 177.442 178.489 -1.047 18321 13663 1 11 . 1 1 25 25 GLN CA C 25 59.651 59.651 58.823 0.828 18321 13664 1 11 . 1 1 25 25 GLN CB C 25 29.308 29.308 28.655 0.653 18321 13665 1 11 . 1 1 25 25 GLN H H 25 8.391 8.391 7.766 0.625 18321 13666 1 11 . 1 1 26 26 THR N N 26 115.105 115.105 114.094 1.011 18321 13667 1 11 . 1 1 26 26 THR HA H 26 3.920 3.920 4.149 -0.229 18321 13668 1 11 . 1 1 26 26 THR C C 26 176.835 176.835 176.169 0.666 18321 13669 1 11 . 1 1 26 26 THR CA C 26 66.335 66.335 64.498 1.837 18321 13670 1 11 . 1 1 26 26 THR CB C 26 68.876 68.876 68.552 0.324 18321 13671 1 11 . 1 1 26 26 THR H H 26 8.223 8.223 7.748 0.475 18321 13672 1 11 . 1 1 27 27 ARG N N 27 119.096 119.096 117.771 1.325 18321 13673 1 11 . 1 1 27 27 ARG HA H 27 4.047 4.047 4.327 -0.280 18321 13674 1 11 . 1 1 27 27 ARG C C 27 177.245 177.245 176.843 0.402 18321 13675 1 11 . 1 1 27 27 ARG CA C 27 58.528 58.528 57.681 0.847 18321 13676 1 11 . 1 1 27 27 ARG CB C 27 30.184 30.184 30.925 -0.741 18321 13677 1 11 . 1 1 27 27 ARG H H 27 8.093 8.093 7.642 0.451 18321 13678 1 11 . 1 1 28 28 LEU N N 28 114.602 114.602 115.546 -0.944 18321 13679 1 11 . 1 1 28 28 LEU HA H 28 4.325 4.325 4.512 -0.187 18321 13680 1 11 . 1 1 28 28 LEU C C 28 177.197 177.197 176.182 1.015 18321 13681 1 11 . 1 1 28 28 LEU CA C 28 55.143 55.143 54.081 1.062 18321 13682 1 11 . 1 1 28 28 LEU CB C 28 44.902 44.902 43.445 1.457 18321 13683 1 11 . 1 1 28 28 LEU H H 28 7.438 7.438 7.827 -0.389 18321 13684 1 11 . 1 1 29 29 GLN N N 29 121.312 121.312 121.721 -0.409 18321 13685 1 11 . 1 1 29 29 GLN HA H 29 3.856 3.856 4.249 -0.393 18321 13686 1 11 . 1 1 29 29 GLN C C 29 178.048 178.048 176.752 1.296 18321 13687 1 11 . 1 1 29 29 GLN CA C 29 57.691 57.691 56.789 0.902 18321 13688 1 11 . 1 1 29 29 GLN CB C 29 27.293 27.293 27.453 -0.160 18321 13689 1 11 . 1 1 29 29 GLN H H 29 8.250 8.250 8.022 0.228 18321 13690 1 11 . 1 1 30 30 GLY N N 30 116.768 116.768 116.119 0.649 18321 13691 1 11 . 1 1 30 30 GLY C C 30 174.914 174.914 174.694 0.220 18321 13692 1 11 . 1 1 30 30 GLY CA C 30 45.491 45.491 45.276 0.215 18321 13693 1 11 . 1 1 30 30 GLY H H 30 9.135 9.135 8.281 0.854 18321 13694 1 11 . 1 1 31 31 GLN N N 31 117.979 117.979 119.982 -2.003 18321 13695 1 11 . 1 1 31 31 GLN HA H 31 4.329 4.329 4.458 -0.129 18321 13696 1 11 . 1 1 31 31 GLN C C 31 177.174 177.174 176.407 0.767 18321 13697 1 11 . 1 1 31 31 GLN CA C 31 53.910 53.910 54.942 -1.032 18321 13698 1 11 . 1 1 31 31 GLN CB C 31 29.574 29.574 29.515 0.059 18321 13699 1 11 . 1 1 31 31 GLN H H 31 7.695 7.695 7.475 0.220 18321 13700 1 11 . 1 1 32 32 ARG N N 32 123.918 123.918 118.740 5.178 18321 13701 1 11 . 1 1 32 32 ARG HA H 32 3.940 3.940 4.099 -0.159 18321 13702 1 11 . 1 1 32 32 ARG C C 32 175.810 175.810 176.528 -0.718 18321 13703 1 11 . 1 1 32 32 ARG CA C 32 56.770 56.770 56.546 0.224 18321 13704 1 11 . 1 1 32 32 ARG CB C 32 30.074 30.074 30.360 -0.286 18321 13705 1 11 . 1 1 32 32 ARG H H 32 8.955 8.955 8.359 0.596 18321 13706 1 11 . 1 1 33 33 HIS N N 33 122.248 122.248 123.989 -1.741 18321 13707 1 11 . 1 1 33 33 HIS HA H 33 4.627 4.627 4.680 -0.053 18321 13708 1 11 . 1 1 33 33 HIS C C 33 177.089 177.089 175.893 1.196 18321 13709 1 11 . 1 1 33 33 HIS CA C 33 55.858 55.858 56.664 -0.806 18321 13710 1 11 . 1 1 33 33 HIS CB C 33 28.648 28.648 29.511 -0.863 18321 13711 1 11 . 1 1 33 33 HIS H H 33 8.302 8.302 8.757 -0.455 18321 13712 1 11 . 1 1 34 34 GLY N N 34 109.518 109.518 113.469 -3.951 18321 13713 1 11 . 1 1 34 34 GLY C C 34 176.730 176.730 173.917 2.813 18321 13714 1 11 . 1 1 34 34 GLY CA C 34 45.967 45.967 44.834 1.133 18321 13715 1 11 . 1 1 34 34 GLY H H 34 9.496 9.496 9.237 0.259 18321 13716 1 11 . 1 1 35 35 MET N N 35 125.193 125.193 121.995 3.198 18321 13717 1 11 . 1 1 35 35 MET HA H 35 5.750 5.750 5.148 0.602 18321 13718 1 11 . 1 1 35 35 MET C C 35 174.388 174.388 175.106 -0.718 18321 13719 1 11 . 1 1 35 35 MET CA C 35 55.762 55.762 56.750 -0.988 18321 13720 1 11 . 1 1 35 35 MET CB C 35 32.706 32.706 34.209 -1.503 18321 13721 1 11 . 1 1 35 35 MET H H 35 8.359 8.359 7.525 0.834 18321 13722 1 11 . 1 1 36 36 PHE N N 36 123.311 123.311 114.494 8.817 18321 13723 1 11 . 1 1 36 36 PHE HA H 36 5.985 5.985 5.604 0.381 18321 13724 1 11 . 1 1 36 36 PHE C C 36 172.140 172.140 172.833 -0.693 18321 13725 1 11 . 1 1 36 36 PHE CA C 36 55.755 55.755 56.011 -0.256 18321 13726 1 11 . 1 1 36 36 PHE CB C 36 45.197 45.197 42.219 2.978 18321 13727 1 11 . 1 1 36 36 PHE H H 36 8.261 8.261 7.545 0.716 18321 13728 1 11 . 1 1 37 37 LEU N N 37 114.652 114.652 115.601 -0.949 18321 13729 1 11 . 1 1 37 37 LEU HA H 37 4.489 4.489 5.164 -0.675 18321 13730 1 11 . 1 1 37 37 LEU C C 37 174.033 174.033 174.663 -0.630 18321 13731 1 11 . 1 1 37 37 LEU CA C 37 55.382 55.382 54.774 0.608 18321 13732 1 11 . 1 1 37 37 LEU CB C 37 44.791 44.791 45.630 -0.839 18321 13733 1 11 . 1 1 37 37 LEU H H 37 9.292 9.292 9.264 0.028 18321 13734 1 11 . 1 1 38 38 VAL N N 38 121.009 121.009 122.498 -1.489 18321 13735 1 11 . 1 1 38 38 VAL HA H 38 5.504 5.504 5.028 0.476 18321 13736 1 11 . 1 1 38 38 VAL C C 38 173.581 173.581 175.395 -1.814 18321 13737 1 11 . 1 1 38 38 VAL CA C 38 61.316 61.316 61.713 -0.397 18321 13738 1 11 . 1 1 38 38 VAL CB C 38 33.302 33.302 33.502 -0.200 18321 13739 1 11 . 1 1 38 38 VAL H H 38 8.991 8.991 8.587 0.404 18321 13740 1 11 . 1 1 39 39 ARG N N 39 124.863 124.863 127.669 -2.806 18321 13741 1 11 . 1 1 39 39 ARG HA H 39 5.444 5.444 5.221 0.223 18321 13742 1 11 . 1 1 39 39 ARG C C 39 175.772 175.772 174.807 0.965 18321 13743 1 11 . 1 1 39 39 ARG CA C 39 52.558 52.558 53.598 -1.040 18321 13744 1 11 . 1 1 39 39 ARG CB C 39 34.980 34.980 33.337 1.643 18321 13745 1 11 . 1 1 39 39 ARG H H 39 9.569 9.569 8.610 0.959 18321 13746 1 11 . 1 1 40 40 ASP N N 40 122.330 122.330 119.659 2.671 18321 13747 1 11 . 1 1 40 40 ASP HA H 40 4.785 4.785 5.085 -0.300 18321 13748 1 11 . 1 1 40 40 ASP C C 40 176.332 176.332 176.289 0.043 18321 13749 1 11 . 1 1 40 40 ASP CA C 40 55.334 55.334 54.000 1.334 18321 13750 1 11 . 1 1 40 40 ASP CB C 40 40.650 40.650 41.755 -1.105 18321 13751 1 11 . 1 1 40 40 ASP H H 40 8.413 8.413 8.477 -0.064 18321 13752 1 11 . 1 1 41 41 SER N N 41 114.363 114.363 119.870 -5.507 18321 13753 1 11 . 1 1 41 41 SER HA H 41 4.506 4.506 4.529 -0.023 18321 13754 1 11 . 1 1 41 41 SER CA C 41 57.525 57.525 58.493 -0.968 18321 13755 1 11 . 1 1 41 41 SER CB C 41 63.706 63.706 63.188 0.518 18321 13756 1 11 . 1 1 41 41 SER H H 41 7.791 7.791 8.540 -0.749 18321 13757 1 11 . 1 1 42 42 SER N N 42 126.932 126.932 120.925 6.007 18321 13758 1 11 . 1 1 42 42 SER HA H 42 4.410 4.410 4.408 0.002 18321 13759 1 11 . 1 1 42 42 SER CA C 42 60.362 60.362 60.507 -0.145 18321 13760 1 11 . 1 1 42 42 SER CB C 42 63.707 63.707 63.174 0.533 18321 13761 1 11 . 1 1 42 42 SER H H 42 10.519 10.519 8.387 2.132 18321 13762 1 11 . 1 1 43 43 THR HA H 43 4.097 4.097 4.288 -0.191 18321 13763 1 11 . 1 1 43 43 THR CA C 43 64.722 64.722 63.218 1.504 18321 13764 1 11 . 1 1 43 43 THR CB C 43 69.439 69.439 69.306 0.133 18321 13765 1 11 . 1 1 44 44 CYS HA H 44 5.100 5.100 4.852 0.248 18321 13766 1 11 . 1 1 44 44 CYS CA C 44 51.779 51.779 56.282 -4.503 18321 13767 1 11 . 1 1 44 44 CYS CB C 44 41.314 41.314 28.185 13.129 18321 13768 1 11 . 1 1 45 45 PRO HA H 45 4.278 4.278 4.358 -0.080 18321 13769 1 11 . 1 1 45 45 PRO C C 45 178.127 178.127 177.564 0.563 18321 13770 1 11 . 1 1 45 45 PRO CA C 45 64.151 64.151 64.584 -0.433 18321 13771 1 11 . 1 1 45 45 PRO CB C 45 31.596 31.596 31.722 -0.126 18321 13772 1 11 . 1 1 46 46 GLY N N 46 114.947 114.947 113.333 1.614 18321 13773 1 11 . 1 1 46 46 GLY C C 46 174.701 174.701 173.908 0.793 18321 13774 1 11 . 1 1 46 46 GLY CA C 46 45.225 45.225 44.898 0.327 18321 13775 1 11 . 1 1 46 46 GLY H H 46 8.812 8.812 8.597 0.215 18321 13776 1 11 . 1 1 47 47 ASP N N 47 120.862 120.862 121.831 -0.969 18321 13777 1 11 . 1 1 47 47 ASP HA H 47 5.235 5.235 4.763 0.472 18321 13778 1 11 . 1 1 47 47 ASP C C 47 176.480 176.480 174.546 1.934 18321 13779 1 11 . 1 1 47 47 ASP CA C 47 53.591 53.591 54.129 -0.538 18321 13780 1 11 . 1 1 47 47 ASP CB C 47 41.707 41.707 43.004 -1.297 18321 13781 1 11 . 1 1 47 47 ASP H H 47 7.997 7.997 7.612 0.385 18321 13782 1 11 . 1 1 48 48 TYR N N 48 118.473 118.473 115.926 2.547 18321 13783 1 11 . 1 1 48 48 TYR HA H 48 5.431 5.431 5.272 0.159 18321 13784 1 11 . 1 1 48 48 TYR C C 48 173.783 173.783 175.458 -1.675 18321 13785 1 11 . 1 1 48 48 TYR CA C 48 56.891 56.891 56.415 0.476 18321 13786 1 11 . 1 1 48 48 TYR CB C 48 43.274 43.274 42.695 0.579 18321 13787 1 11 . 1 1 48 48 TYR H H 48 8.892 8.892 9.068 -0.176 18321 13788 1 11 . 1 1 49 49 VAL N N 49 119.105 119.105 119.584 -0.479 18321 13789 1 11 . 1 1 49 49 VAL HA H 49 4.800 4.800 4.564 0.236 18321 13790 1 11 . 1 1 49 49 VAL C C 49 174.397 174.397 174.602 -0.205 18321 13791 1 11 . 1 1 49 49 VAL CA C 49 61.439 61.439 62.012 -0.573 18321 13792 1 11 . 1 1 49 49 VAL CB C 49 35.388 35.388 34.217 1.171 18321 13793 1 11 . 1 1 49 49 VAL H H 49 9.661 9.661 8.664 0.997 18321 13794 1 11 . 1 1 50 50 LEU N N 50 129.599 129.599 131.446 -1.847 18321 13795 1 11 . 1 1 50 50 LEU HA H 50 5.033 5.033 5.025 0.008 18321 13796 1 11 . 1 1 50 50 LEU C C 50 175.001 175.001 175.331 -0.330 18321 13797 1 11 . 1 1 50 50 LEU CA C 50 53.352 53.352 53.660 -0.308 18321 13798 1 11 . 1 1 50 50 LEU CB C 50 44.062 44.062 42.326 1.736 18321 13799 1 11 . 1 1 50 50 LEU H H 50 9.405 9.405 9.238 0.167 18321 13800 1 11 . 1 1 51 51 SER N N 51 126.895 126.895 124.615 2.280 18321 13801 1 11 . 1 1 51 51 SER HA H 51 5.731 5.731 5.076 0.655 18321 13802 1 11 . 1 1 51 51 SER C C 51 173.094 173.094 173.601 -0.507 18321 13803 1 11 . 1 1 51 51 SER CA C 51 58.834 58.834 57.203 1.631 18321 13804 1 11 . 1 1 51 51 SER CB C 51 64.977 64.977 63.860 1.117 18321 13805 1 11 . 1 1 51 51 SER H H 51 9.094 9.094 9.217 -0.123 18321 13806 1 11 . 1 1 52 52 VAL N N 52 121.777 121.777 126.184 -4.407 18321 13807 1 11 . 1 1 52 52 VAL HA H 52 5.066 5.066 4.491 0.575 18321 13808 1 11 . 1 1 52 52 VAL C C 52 174.573 174.573 174.777 -0.204 18321 13809 1 11 . 1 1 52 52 VAL CA C 52 59.535 59.535 61.184 -1.649 18321 13810 1 11 . 1 1 52 52 VAL CB C 52 36.834 36.834 34.558 2.276 18321 13811 1 11 . 1 1 52 52 VAL H H 52 8.816 8.816 8.968 -0.152 18321 13812 1 11 . 1 1 53 53 SER N N 53 120.489 120.489 121.151 -0.662 18321 13813 1 11 . 1 1 53 53 SER HA H 53 4.811 4.811 4.622 0.189 18321 13814 1 11 . 1 1 53 53 SER C C 53 174.065 174.065 173.292 0.773 18321 13815 1 11 . 1 1 53 53 SER CA C 53 57.496 57.496 58.096 -0.600 18321 13816 1 11 . 1 1 53 53 SER CB C 53 62.623 62.623 63.055 -0.432 18321 13817 1 11 . 1 1 53 53 SER H H 53 8.780 8.780 9.047 -0.267 18321 13818 1 11 . 1 1 54 54 GLU N N 54 132.020 132.020 126.224 5.796 18321 13819 1 11 . 1 1 54 54 GLU HA H 54 4.250 4.250 4.380 -0.130 18321 13820 1 11 . 1 1 54 54 GLU C C 54 175.387 175.387 174.760 0.627 18321 13821 1 11 . 1 1 54 54 GLU CA C 54 56.999 56.999 54.370 2.629 18321 13822 1 11 . 1 1 54 54 GLU CB C 54 32.556 32.556 34.049 -1.493 18321 13823 1 11 . 1 1 54 54 GLU H H 54 8.472 8.472 7.585 0.887 18321 13824 1 11 . 1 1 55 55 ASN N N 55 126.517 126.517 118.736 7.781 18321 13825 1 11 . 1 1 55 55 ASN HA H 55 4.220 4.220 3.862 0.358 18321 13826 1 11 . 1 1 55 55 ASN C C 55 174.546 174.546 175.018 -0.472 18321 13827 1 11 . 1 1 55 55 ASN CA C 55 54.770 54.770 53.868 0.902 18321 13828 1 11 . 1 1 55 55 ASN CB C 55 37.314 37.314 36.355 0.959 18321 13829 1 11 . 1 1 55 55 ASN H H 55 8.853 8.853 8.305 0.548 18321 13830 1 11 . 1 1 56 56 SER N N 56 112.009 112.009 111.755 0.254 18321 13831 1 11 . 1 1 56 56 SER HA H 56 4.334 4.334 4.316 0.018 18321 13832 1 11 . 1 1 56 56 SER C C 56 173.354 173.354 173.808 -0.454 18321 13833 1 11 . 1 1 56 56 SER CA C 56 59.966 59.966 59.710 0.256 18321 13834 1 11 . 1 1 56 56 SER CB C 56 62.242 62.242 62.309 -0.067 18321 13835 1 11 . 1 1 56 56 SER H H 56 10.418 10.418 8.406 2.012 18321 13836 1 11 . 1 1 57 57 ARG N N 57 121.764 121.764 119.605 2.159 18321 13837 1 11 . 1 1 57 57 ARG HA H 57 5.167 5.167 4.399 0.768 18321 13838 1 11 . 1 1 57 57 ARG C C 57 174.983 174.983 174.087 0.896 18321 13839 1 11 . 1 1 57 57 ARG CA C 57 54.550 54.550 55.145 -0.595 18321 13840 1 11 . 1 1 57 57 ARG CB C 57 31.886 31.886 31.394 0.492 18321 13841 1 11 . 1 1 57 57 ARG H H 57 8.097 8.097 7.800 0.297 18321 13842 1 11 . 1 1 58 58 VAL N N 58 121.866 121.866 120.997 0.869 18321 13843 1 11 . 1 1 58 58 VAL HA H 58 4.768 4.768 4.424 0.344 18321 13844 1 11 . 1 1 58 58 VAL C C 58 175.388 175.388 176.348 -0.960 18321 13845 1 11 . 1 1 58 58 VAL CA C 58 61.818 61.818 62.314 -0.496 18321 13846 1 11 . 1 1 58 58 VAL CB C 58 34.135 34.135 30.952 3.183 18321 13847 1 11 . 1 1 58 58 VAL H H 58 8.081 8.081 7.812 0.269 18321 13848 1 11 . 1 1 59 59 SER N N 59 124.445 124.445 123.436 1.009 18321 13849 1 11 . 1 1 59 59 SER HA H 59 4.462 4.462 4.328 0.134 18321 13850 1 11 . 1 1 59 59 SER C C 59 172.185 172.185 173.592 -1.407 18321 13851 1 11 . 1 1 59 59 SER CA C 59 56.629 56.629 57.969 -1.341 18321 13852 1 11 . 1 1 59 59 SER CB C 59 66.218 66.218 63.640 2.578 18321 13853 1 11 . 1 1 59 59 SER H H 59 9.082 9.082 8.254 0.828 18321 13854 1 11 . 1 1 60 60 HIS N N 60 121.224 121.224 125.515 -4.291 18321 13855 1 11 . 1 1 60 60 HIS HA H 60 4.885 4.885 4.758 0.127 18321 13856 1 11 . 1 1 60 60 HIS C C 60 174.674 174.674 174.264 0.410 18321 13857 1 11 . 1 1 60 60 HIS CA C 60 54.900 54.900 55.552 -0.652 18321 13858 1 11 . 1 1 60 60 HIS CB C 60 32.331 32.331 29.769 2.562 18321 13859 1 11 . 1 1 60 60 HIS H H 60 8.331 8.331 8.608 -0.277 18321 13860 1 11 . 1 1 61 61 TYR N N 61 124.780 124.780 125.013 -0.233 18321 13861 1 11 . 1 1 61 61 TYR HA H 61 4.655 4.655 4.729 -0.074 18321 13862 1 11 . 1 1 61 61 TYR CA C 61 57.409 57.409 56.380 1.029 18321 13863 1 11 . 1 1 61 61 TYR CB C 61 39.785 39.785 38.760 1.025 18321 13864 1 11 . 1 1 61 61 TYR H H 61 9.273 9.273 9.273 -0.000 18321 13865 1 11 . 1 1 62 62 ILE HA H 62 4.298 4.298 4.310 -0.012 18321 13866 1 11 . 1 1 62 62 ILE C C 62 174.817 174.817 175.260 -0.443 18321 13867 1 11 . 1 1 62 62 ILE CA C 62 61.908 61.908 61.859 0.049 18321 13868 1 11 . 1 1 62 62 ILE CB C 62 38.321 38.321 39.134 -0.813 18321 13869 1 11 . 1 1 63 63 ILE N N 63 128.552 128.552 127.621 0.931 18321 13870 1 11 . 1 1 63 63 ILE HA H 63 4.788 4.788 4.734 0.054 18321 13871 1 11 . 1 1 63 63 ILE C C 63 175.982 175.982 174.897 1.085 18321 13872 1 11 . 1 1 63 63 ILE CA C 63 59.629 59.629 59.768 -0.139 18321 13873 1 11 . 1 1 63 63 ILE CB C 63 39.747 39.747 39.303 0.444 18321 13874 1 11 . 1 1 63 63 ILE H H 63 9.155 9.155 8.865 0.290 18321 13875 1 11 . 1 1 64 64 ASN N N 64 123.240 123.240 127.268 -4.028 18321 13876 1 11 . 1 1 64 64 ASN HA H 64 4.857 4.857 5.559 -0.702 18321 13877 1 11 . 1 1 64 64 ASN C C 64 175.324 175.324 174.785 0.539 18321 13878 1 11 . 1 1 64 64 ASN CA C 64 53.736 53.736 53.109 0.627 18321 13879 1 11 . 1 1 64 64 ASN CB C 64 41.531 41.531 40.450 1.081 18321 13880 1 11 . 1 1 64 64 ASN H H 64 9.379 9.379 8.833 0.546 18321 13881 1 11 . 1 1 65 65 SER N N 65 121.157 121.157 118.467 2.690 18321 13882 1 11 . 1 1 65 65 SER HA H 65 4.548 4.548 4.273 0.275 18321 13883 1 11 . 1 1 65 65 SER C C 65 174.328 174.328 174.359 -0.031 18321 13884 1 11 . 1 1 65 65 SER CA C 65 58.306 58.306 57.802 0.504 18321 13885 1 11 . 1 1 65 65 SER CB C 65 62.878 62.878 62.698 0.180 18321 13886 1 11 . 1 1 65 65 SER H H 65 9.195 9.195 8.545 0.650 18321 13887 1 11 . 1 1 66 66 LEU N N 66 127.417 127.417 128.235 -0.818 18321 13888 1 11 . 1 1 66 66 LEU HA H 66 4.605 4.605 4.537 0.068 18321 13889 1 11 . 1 1 66 66 LEU CA C 66 52.888 52.888 53.098 -0.210 18321 13890 1 11 . 1 1 66 66 LEU CB C 66 41.799 41.799 41.787 0.012 18321 13891 1 11 . 1 1 66 66 LEU H H 66 8.143 8.143 8.376 -0.233 18321 13892 1 11 . 1 1 68 68 ASN HA H 68 4.386 4.386 4.651 -0.265 18321 13893 1 11 . 1 1 68 68 ASN C C 68 174.487 174.487 174.879 -0.392 18321 13894 1 11 . 1 1 68 68 ASN CA C 68 53.365 53.365 52.825 0.540 18321 13895 1 11 . 1 1 68 68 ASN CB C 68 36.778 36.778 37.732 -0.954 18321 13896 1 11 . 1 1 69 69 ARG N N 69 111.329 111.329 115.308 -3.979 18321 13897 1 11 . 1 1 69 69 ARG HA H 69 3.876 3.876 3.780 0.096 18321 13898 1 11 . 1 1 69 69 ARG CA C 69 57.393 57.393 57.223 0.170 18321 13899 1 11 . 1 1 69 69 ARG CB C 69 26.665 26.665 28.095 -1.430 18321 13900 1 11 . 1 1 69 69 ARG H H 69 8.191 8.191 7.500 0.691 18321 13901 1 11 . 1 1 70 70 ARG N N 70 116.120 116.120 115.258 0.862 18321 13902 1 11 . 1 1 70 70 ARG HA H 70 4.556 4.556 4.689 -0.133 18321 13903 1 11 . 1 1 70 70 ARG C C 70 174.882 174.882 173.989 0.893 18321 13904 1 11 . 1 1 70 70 ARG CA C 70 55.509 55.509 53.979 1.530 18321 13905 1 11 . 1 1 70 70 ARG CB C 70 31.771 31.771 33.576 -1.805 18321 13906 1 11 . 1 1 70 70 ARG H H 70 6.667 6.667 7.290 -0.623 18321 13907 1 11 . 1 1 71 71 PHE N N 71 116.313 116.313 118.263 -1.950 18321 13908 1 11 . 1 1 71 71 PHE HA H 71 5.540 5.540 5.617 -0.077 18321 13909 1 11 . 1 1 71 71 PHE C C 71 174.391 174.391 175.188 -0.797 18321 13910 1 11 . 1 1 71 71 PHE CA C 71 57.528 57.528 56.636 0.892 18321 13911 1 11 . 1 1 71 71 PHE CB C 71 44.115 44.115 42.742 1.373 18321 13912 1 11 . 1 1 71 71 PHE H H 71 8.700 8.700 9.032 -0.332 18321 13913 1 11 . 1 1 72 72 LYS N N 72 122.770 122.770 126.030 -3.260 18321 13914 1 11 . 1 1 72 72 LYS HA H 72 5.483 5.483 4.792 0.691 18321 13915 1 11 . 1 1 72 72 LYS C C 72 173.923 173.923 175.951 -2.028 18321 13916 1 11 . 1 1 72 72 LYS CA C 72 54.855 54.855 55.524 -0.669 18321 13917 1 11 . 1 1 72 72 LYS CB C 72 37.710 37.710 33.438 4.272 18321 13918 1 11 . 1 1 72 72 LYS H H 72 9.138 9.138 8.758 0.380 18321 13919 1 11 . 1 1 73 73 ILE N N 73 124.576 124.576 127.837 -3.261 18321 13920 1 11 . 1 1 73 73 ILE HA H 73 4.955 4.955 4.694 0.261 18321 13921 1 11 . 1 1 73 73 ILE C C 73 175.728 175.728 176.391 -0.663 18321 13922 1 11 . 1 1 73 73 ILE CA C 73 58.935 58.935 60.448 -1.513 18321 13923 1 11 . 1 1 73 73 ILE CB C 73 40.965 40.965 38.331 2.635 18321 13924 1 11 . 1 1 73 73 ILE H H 73 8.826 8.826 8.557 0.269 18321 13925 1 11 . 1 1 74 74 GLY N N 74 118.718 118.718 119.723 -1.005 18321 13926 1 11 . 1 1 74 74 GLY C C 74 174.436 174.436 174.756 -0.320 18321 13927 1 11 . 1 1 74 74 GLY CA C 74 47.401 47.401 45.672 1.729 18321 13928 1 11 . 1 1 74 74 GLY H H 74 9.317 9.317 9.218 0.099 18321 13929 1 11 . 1 1 75 75 ASP N N 75 125.691 125.691 115.943 9.748 18321 13930 1 11 . 1 1 75 75 ASP HA H 75 4.713 4.713 4.196 0.517 18321 13931 1 11 . 1 1 75 75 ASP C C 75 175.841 175.841 175.174 0.667 18321 13932 1 11 . 1 1 75 75 ASP CA C 75 53.815 53.815 56.401 -2.586 18321 13933 1 11 . 1 1 75 75 ASP CB C 75 41.288 41.288 40.121 1.167 18321 13934 1 11 . 1 1 75 75 ASP H H 75 8.665 8.665 8.334 0.331 18321 13935 1 11 . 1 1 76 76 GLN N N 76 120.368 120.368 120.747 -0.379 18321 13936 1 11 . 1 1 76 76 GLN C C 76 173.630 173.630 174.851 -1.221 18321 13937 1 11 . 1 1 76 76 GLN CA C 76 54.254 54.254 55.703 -1.449 18321 13938 1 11 . 1 1 76 76 GLN CB C 76 31.248 31.248 28.293 2.955 18321 13939 1 11 . 1 1 76 76 GLN H H 76 8.289 8.289 7.455 0.834 18321 13940 1 11 . 1 1 77 77 GLU N N 77 120.435 120.435 123.064 -2.629 18321 13941 1 11 . 1 1 77 77 GLU C C 77 175.484 175.484 175.079 0.405 18321 13942 1 11 . 1 1 77 77 GLU CA C 77 54.203 54.203 54.224 -0.021 18321 13943 1 11 . 1 1 77 77 GLU CB C 77 33.141 33.141 31.185 1.956 18321 13944 1 11 . 1 1 77 77 GLU H H 77 7.732 7.732 8.009 -0.277 18321 13945 1 11 . 1 1 78 78 PHE N N 78 117.911 117.911 122.070 -4.159 18321 13946 1 11 . 1 1 78 78 PHE HA H 78 4.659 4.659 4.726 -0.067 18321 13947 1 11 . 1 1 78 78 PHE C C 78 175.673 175.673 176.140 -0.467 18321 13948 1 11 . 1 1 78 78 PHE CA C 78 57.160 57.160 56.164 0.996 18321 13949 1 11 . 1 1 78 78 PHE CB C 78 45.405 45.405 42.218 3.187 18321 13950 1 11 . 1 1 78 78 PHE H H 78 9.235 9.235 8.591 0.644 18321 13951 1 11 . 1 1 79 79 ASP N N 79 119.296 119.296 118.001 1.295 18321 13952 1 11 . 1 1 79 79 ASP HA H 79 4.462 4.462 4.373 0.089 18321 13953 1 11 . 1 1 79 79 ASP C C 79 174.482 174.482 175.415 -0.933 18321 13954 1 11 . 1 1 79 79 ASP CA C 79 56.629 56.629 55.909 0.720 18321 13955 1 11 . 1 1 79 79 ASP CB C 79 41.697 41.697 40.664 1.033 18321 13956 1 11 . 1 1 79 79 ASP H H 79 9.187 9.187 8.786 0.401 18321 13957 1 11 . 1 1 80 80 HIS N N 80 107.631 107.631 112.050 -4.419 18321 13958 1 11 . 1 1 80 80 HIS HA H 80 5.022 5.022 5.019 0.003 18321 13959 1 11 . 1 1 80 80 HIS C C 80 174.626 174.626 174.734 -0.108 18321 13960 1 11 . 1 1 80 80 HIS CA C 80 54.223 54.223 54.761 -0.538 18321 13961 1 11 . 1 1 80 80 HIS CB C 80 32.205 32.205 30.366 1.839 18321 13962 1 11 . 1 1 80 80 HIS H H 80 7.200 7.200 7.291 -0.091 18321 13963 1 11 . 1 1 81 81 LEU N N 81 120.710 120.710 121.694 -0.984 18321 13964 1 11 . 1 1 81 81 LEU HA H 81 3.804 3.804 4.081 -0.277 18321 13965 1 11 . 1 1 81 81 LEU CA C 81 58.709 58.709 59.974 -1.265 18321 13966 1 11 . 1 1 81 81 LEU CB C 81 39.646 39.646 39.861 -0.215 18321 13967 1 11 . 1 1 81 81 LEU H H 81 8.886 8.886 8.959 -0.073 18321 13968 1 11 . 1 1 82 82 PRO HA H 82 4.020 4.020 4.133 -0.113 18321 13969 1 11 . 1 1 82 82 PRO C C 82 175.619 175.619 176.713 -1.094 18321 13970 1 11 . 1 1 82 82 PRO CA C 82 67.025 67.025 64.299 2.726 18321 13971 1 11 . 1 1 82 82 PRO CB C 82 30.962 30.962 30.376 0.586 18321 13972 1 11 . 1 1 83 83 ALA N N 83 124.281 124.281 120.931 3.350 18321 13973 1 11 . 1 1 83 83 ALA HA H 83 4.019 4.019 4.298 -0.279 18321 13974 1 11 . 1 1 83 83 ALA C C 83 179.709 179.709 178.643 1.066 18321 13975 1 11 . 1 1 83 83 ALA CA C 83 54.985 54.985 54.077 0.909 18321 13976 1 11 . 1 1 83 83 ALA CB C 83 18.425 18.425 19.555 -1.130 18321 13977 1 11 . 1 1 83 83 ALA H H 83 8.527 8.527 7.858 0.669 18321 13978 1 11 . 1 1 84 84 LEU N N 84 122.960 122.960 117.566 5.394 18321 13979 1 11 . 1 1 84 84 LEU HA H 84 1.917 1.917 2.600 -0.683 18321 13980 1 11 . 1 1 84 84 LEU C C 84 177.652 177.652 178.074 -0.422 18321 13981 1 11 . 1 1 84 84 LEU CA C 84 58.261 58.261 57.200 1.062 18321 13982 1 11 . 1 1 84 84 LEU CB C 84 42.544 42.544 41.094 1.450 18321 13983 1 11 . 1 1 84 84 LEU H H 84 6.982 6.982 7.422 -0.440 18321 13984 1 11 . 1 1 85 85 LEU N N 85 117.940 117.940 118.724 -0.784 18321 13985 1 11 . 1 1 85 85 LEU HA H 85 3.463 3.463 3.888 -0.425 18321 13986 1 11 . 1 1 85 85 LEU C C 85 178.809 178.809 178.258 0.551 18321 13987 1 11 . 1 1 85 85 LEU CA C 85 57.522 57.522 57.167 0.355 18321 13988 1 11 . 1 1 85 85 LEU CB C 85 41.242 41.242 41.285 -0.043 18321 13989 1 11 . 1 1 85 85 LEU H H 85 7.773 7.773 7.215 0.558 18321 13990 1 11 . 1 1 86 86 GLU N N 86 115.762 115.762 117.424 -1.662 18321 13991 1 11 . 1 1 86 86 GLU HA H 86 3.540 3.540 4.078 -0.538 18321 13992 1 11 . 1 1 86 86 GLU C C 86 180.228 180.228 177.874 2.354 18321 13993 1 11 . 1 1 86 86 GLU CA C 86 58.943 58.943 58.132 0.811 18321 13994 1 11 . 1 1 86 86 GLU CB C 86 29.561 29.561 29.828 -0.268 18321 13995 1 11 . 1 1 86 86 GLU H H 86 8.300 8.300 7.963 0.337 18321 13996 1 11 . 1 1 87 87 PHE N N 87 121.135 121.135 119.077 2.058 18321 13997 1 11 . 1 1 87 87 PHE HA H 87 4.122 4.122 4.478 -0.356 18321 13998 1 11 . 1 1 87 87 PHE C C 87 179.497 179.497 176.370 3.127 18321 13999 1 11 . 1 1 87 87 PHE CA C 87 62.090 62.090 58.613 3.477 18321 14000 1 11 . 1 1 87 87 PHE CB C 87 40.103 40.103 39.663 0.439 18321 14001 1 11 . 1 1 87 87 PHE H H 87 7.717 7.717 7.388 0.329 18321 14002 1 11 . 1 1 88 88 TYR N N 88 116.579 116.579 119.807 -3.228 18321 14003 1 11 . 1 1 88 88 TYR HA H 88 4.933 4.933 4.289 0.644 18321 14004 1 11 . 1 1 88 88 TYR C C 88 174.799 174.799 176.742 -1.943 18321 14005 1 11 . 1 1 88 88 TYR CA C 88 61.333 61.333 58.542 2.791 18321 14006 1 11 . 1 1 88 88 TYR CB C 88 36.539 36.539 37.163 -0.625 18321 14007 1 11 . 1 1 88 88 TYR H H 88 7.478 7.478 7.794 -0.316 18321 14008 1 11 . 1 1 89 89 LYS N N 89 117.737 117.737 119.076 -1.339 18321 14009 1 11 . 1 1 89 89 LYS HA H 89 4.466 4.466 4.076 0.390 18321 14010 1 11 . 1 1 89 89 LYS C C 89 178.417 178.417 176.610 1.807 18321 14011 1 11 . 1 1 89 89 LYS CA C 89 59.486 59.486 58.750 0.736 18321 14012 1 11 . 1 1 89 89 LYS CB C 89 34.523 34.523 32.730 1.794 18321 14013 1 11 . 1 1 89 89 LYS H H 89 7.505 7.505 7.678 -0.173 18321 14014 1 11 . 1 1 90 90 ILE N N 90 110.972 110.972 111.781 -0.809 18321 14015 1 11 . 1 1 90 90 ILE HA H 90 4.181 4.181 4.141 0.040 18321 14016 1 11 . 1 1 90 90 ILE C C 90 174.571 174.571 176.007 -1.436 18321 14017 1 11 . 1 1 90 90 ILE CA C 90 60.516 60.516 61.342 -0.826 18321 14018 1 11 . 1 1 90 90 ILE CB C 90 39.979 39.979 37.628 2.351 18321 14019 1 11 . 1 1 90 90 ILE H H 90 6.710 6.710 7.231 -0.521 18321 14020 1 11 . 1 1 91 91 HIS N N 91 119.479 119.479 120.985 -1.506 18321 14021 1 11 . 1 1 91 91 HIS HA H 91 4.357 4.357 4.312 0.045 18321 14022 1 11 . 1 1 91 91 HIS C C 91 172.751 172.751 174.484 -1.733 18321 14023 1 11 . 1 1 91 91 HIS CA C 91 55.066 55.066 57.552 -2.486 18321 14024 1 11 . 1 1 91 91 HIS CB C 91 29.756 29.756 31.437 -1.681 18321 14025 1 11 . 1 1 91 91 HIS H H 91 7.460 7.460 7.379 0.081 18321 14026 1 11 . 1 1 92 92 TYR N N 92 117.642 117.642 115.339 2.303 18321 14027 1 11 . 1 1 92 92 TYR HA H 92 4.131 4.131 4.336 -0.205 18321 14028 1 11 . 1 1 92 92 TYR C C 92 177.348 177.348 175.425 1.923 18321 14029 1 11 . 1 1 92 92 TYR CA C 92 58.627 58.627 58.539 0.088 18321 14030 1 11 . 1 1 92 92 TYR CB C 92 39.481 39.481 36.126 3.355 18321 14031 1 11 . 1 1 92 92 TYR H H 92 8.067 8.067 7.350 0.717 18321 14032 1 11 . 1 1 93 93 LEU N N 93 123.560 123.560 122.487 1.073 18321 14033 1 11 . 1 1 93 93 LEU HA H 93 4.104 4.104 4.354 -0.250 18321 14034 1 11 . 1 1 93 93 LEU C C 93 175.610 175.610 178.227 -2.617 18321 14035 1 11 . 1 1 93 93 LEU CA C 93 56.381 56.381 57.394 -1.013 18321 14036 1 11 . 1 1 93 93 LEU CB C 93 38.896 38.896 42.472 -3.576 18321 14037 1 11 . 1 1 93 93 LEU H H 93 7.907 7.907 8.015 -0.108 18321 14038 1 11 . 1 1 94 94 ASP N N 94 118.194 118.194 117.241 0.953 18321 14039 1 11 . 1 1 94 94 ASP HA H 94 4.940 4.940 4.661 0.279 18321 14040 1 11 . 1 1 94 94 ASP C C 94 176.123 176.123 177.022 -0.899 18321 14041 1 11 . 1 1 94 94 ASP CA C 94 56.235 56.235 55.387 0.848 18321 14042 1 11 . 1 1 94 94 ASP CB C 94 42.078 42.078 41.603 0.474 18321 14043 1 11 . 1 1 94 94 ASP H H 94 8.640 8.640 8.133 0.507 18321 14044 1 11 . 1 1 95 95 THR N N 95 105.073 105.073 113.824 -8.751 18321 14045 1 11 . 1 1 95 95 THR HA H 95 4.318 4.318 4.462 -0.144 18321 14046 1 11 . 1 1 95 95 THR C C 95 174.685 174.685 174.555 0.130 18321 14047 1 11 . 1 1 95 95 THR CA C 95 60.756 60.756 63.068 -2.312 18321 14048 1 11 . 1 1 95 95 THR CB C 95 71.058 71.058 69.397 1.661 18321 14049 1 11 . 1 1 95 95 THR H H 95 8.576 8.576 8.323 0.253 18321 14050 1 11 . 1 1 96 96 THR N N 96 116.817 116.817 114.008 2.809 18321 14051 1 11 . 1 1 96 96 THR HA H 96 5.129 5.129 4.804 0.325 18321 14052 1 11 . 1 1 96 96 THR C C 96 172.464 172.464 172.490 -0.026 18321 14053 1 11 . 1 1 96 96 THR CA C 96 60.762 60.762 59.831 0.931 18321 14054 1 11 . 1 1 96 96 THR CB C 96 71.425 71.425 70.415 1.011 18321 14055 1 11 . 1 1 96 96 THR H H 96 8.205 8.205 7.589 0.616 18321 14056 1 11 . 1 1 97 97 THR N N 97 114.324 114.324 112.929 1.395 18321 14057 1 11 . 1 1 97 97 THR HA H 97 5.128 5.128 4.436 0.692 18321 14058 1 11 . 1 1 97 97 THR C C 97 175.480 175.480 174.135 1.345 18321 14059 1 11 . 1 1 97 97 THR CA C 97 60.233 60.233 59.600 0.633 18321 14060 1 11 . 1 1 97 97 THR CB C 97 70.415 70.415 70.802 -0.387 18321 14061 1 11 . 1 1 97 97 THR H H 97 7.128 7.128 8.088 -0.960 18321 14062 1 11 . 1 1 98 98 LEU N N 98 116.674 116.674 122.068 -5.394 18321 14063 1 11 . 1 1 98 98 LEU HA H 98 4.075 4.075 4.141 -0.066 18321 14064 1 11 . 1 1 98 98 LEU C C 98 177.892 177.892 176.775 1.117 18321 14065 1 11 . 1 1 98 98 LEU CA C 98 59.597 59.597 55.221 4.376 18321 14066 1 11 . 1 1 98 98 LEU CB C 98 41.172 41.172 40.883 0.289 18321 14067 1 11 . 1 1 98 98 LEU H H 98 8.743 8.743 8.003 0.740 18321 14068 1 11 . 1 1 99 99 ILE N N 99 122.988 122.988 123.785 -0.797 18321 14069 1 11 . 1 1 99 99 ILE HA H 99 4.415 4.415 4.324 0.091 18321 14070 1 11 . 1 1 99 99 ILE C C 99 175.055 175.055 175.727 -0.672 18321 14071 1 11 . 1 1 99 99 ILE CA C 99 62.183 62.183 61.597 0.586 18321 14072 1 11 . 1 1 99 99 ILE CB C 99 40.252 40.252 38.787 1.465 18321 14073 1 11 . 1 1 99 99 ILE H H 99 8.998 8.998 8.204 0.794 18321 14074 1 11 . 1 1 100 100 GLU N N 100 114.067 114.067 114.632 -0.565 18321 14075 1 11 . 1 1 100 100 GLU CA C 100 52.910 52.910 53.473 -0.563 18321 14076 1 11 . 1 1 100 100 GLU CB C 100 31.155 31.155 31.193 -0.038 18321 14077 1 11 . 1 1 100 100 GLU H H 100 7.332 7.332 7.716 -0.384 18321 14078 1 11 . 1 1 101 101 PRO HA H 101 4.952 4.952 3.413 1.539 18321 14079 1 11 . 1 1 101 101 PRO C C 101 175.976 175.976 175.831 0.145 18321 14080 1 11 . 1 1 101 101 PRO CA C 101 53.312 53.312 61.930 -8.618 18321 14081 1 11 . 1 1 101 101 PRO CB C 101 31.598 31.598 31.771 -0.173 18321 14082 1 11 . 1 1 102 102 ALA N N 102 125.968 125.968 120.872 5.096 18321 14083 1 11 . 1 1 102 102 ALA HA H 102 4.516 4.516 4.348 0.168 18321 14084 1 11 . 1 1 102 102 ALA CA C 102 49.852 49.852 50.093 -0.240 18321 14085 1 11 . 1 1 102 102 ALA CB C 102 17.766 17.766 17.819 -0.052 18321 14086 1 11 . 1 1 102 102 ALA H H 102 8.232 8.232 8.080 0.152 18321 14087 1 11 . 1 1 103 103 PRO HA H 103 4.283 4.283 4.331 -0.048 18321 14088 1 11 . 1 1 103 103 PRO CA C 103 62.435 62.435 63.105 -0.670 18321 14089 1 11 . 1 1 103 103 PRO CB C 103 32.145 32.145 30.058 2.087 18321 14090 1 11 . 1 1 104 104 ARG HA H 104 4.004 4.004 3.636 0.368 18321 14091 1 11 . 1 1 104 104 ARG CA C 104 56.660 56.660 58.504 -1.843 18321 14092 1 11 . 1 1 106 106 PRO C C 106 174.587 174.587 176.427 -1.840 18321 14093 1 11 . 1 1 106 106 PRO CA C 106 57.867 57.867 63.581 -5.714 18321 14094 1 11 . 1 1 106 106 PRO CB C 106 31.942 31.942 32.167 -0.225 18321 14095 1 11 . 1 1 107 107 SER N N 107 121.280 121.280 114.953 6.327 18321 14096 1 11 . 1 1 107 107 SER CA C 107 61.772 61.772 57.881 3.891 18321 14097 1 11 . 1 1 107 107 SER CB C 107 63.234 63.234 63.660 -0.426 18321 14098 1 11 . 1 1 107 107 SER H H 107 8.132 8.132 7.866 0.266 18321 14099 1 11 . 1 1 109 109 PRO C C 109 177.129 177.129 175.875 1.254 18321 14100 1 11 . 1 1 109 109 PRO CA C 109 62.638 62.638 63.316 -0.679 18321 14101 1 11 . 1 1 109 109 PRO CB C 109 30.970 30.970 30.985 -0.015 18321 14102 1 11 . 1 1 110 110 MET N N 110 120.772 120.772 123.920 -3.148 18321 14103 1 11 . 1 1 110 110 MET C C 110 176.892 176.892 177.797 -0.905 18321 14104 1 11 . 1 1 110 110 MET CA C 110 55.310 55.310 53.510 1.800 18321 14105 1 11 . 1 1 110 110 MET CB C 110 32.202 32.202 33.447 -1.246 18321 14106 1 11 . 1 1 110 110 MET H H 110 8.430 8.430 8.153 0.277 18321 14107 1 11 . 1 1 111 111 GLY N N 111 110.158 110.158 109.695 0.463 18321 14108 1 11 . 1 1 111 111 GLY C C 111 177.430 177.430 173.759 3.671 18321 14109 1 11 . 1 1 111 111 GLY CA C 111 44.951 44.951 45.071 -0.120 18321 14110 1 11 . 1 1 111 111 GLY H H 111 8.384 8.384 8.461 -0.077 18321 14111 1 11 . 1 1 112 112 SER N N 112 116.762 116.762 117.040 -0.278 18321 14112 1 11 . 1 1 112 112 SER CA C 112 55.948 55.948 57.920 -1.972 18321 14113 1 11 . 1 1 112 112 SER CB C 112 62.745 62.745 64.401 -1.657 18321 14114 1 11 . 1 1 112 112 SER H H 112 8.161 8.161 7.931 0.230 18321 14115 1 11 . 1 1 113 113 VAL C C 113 176.083 176.083 175.825 0.258 18321 14116 1 11 . 1 1 114 114 SER N N 114 119.151 119.151 116.920 2.231 18321 14117 1 11 . 1 1 114 114 SER C C 114 173.638 173.638 174.817 -1.179 18321 14118 1 11 . 1 1 114 114 SER CA C 114 58.005 58.005 59.013 -1.008 18321 14119 1 11 . 1 1 114 114 SER CB C 114 63.169 63.169 63.554 -0.385 18321 14120 1 11 . 1 1 114 114 SER H H 114 8.319 8.319 8.062 0.257 18321 14121 1 11 . 1 1 115 115 ALA N N 115 126.914 126.914 125.414 1.500 18321 14122 1 11 . 1 1 115 115 ALA CA C 115 51.561 51.561 49.337 2.224 18321 14123 1 11 . 1 1 115 115 ALA CB C 115 17.714 17.714 20.280 -2.566 18321 14124 1 11 . 1 1 115 115 ALA H H 115 8.197 8.197 7.383 0.814 18321 14125 1 11 . 1 1 119 119 PRO C C 119 177.065 177.065 176.240 0.825 18321 14126 1 11 . 1 1 120 120 THR N N 120 113.976 113.976 118.273 -4.297 18321 14127 1 11 . 1 1 120 120 THR C C 120 174.461 174.461 173.741 0.720 18321 14128 1 11 . 1 1 120 120 THR CA C 120 61.215 61.215 63.255 -2.040 18321 14129 1 11 . 1 1 120 120 THR CB C 120 69.508 69.508 68.871 0.637 18321 14130 1 11 . 1 1 120 120 THR H H 120 8.138 8.138 7.832 0.306 18321 14131 1 11 . 1 1 121 121 ALA N N 121 125.859 125.859 130.436 -4.577 18321 14132 1 11 . 1 1 121 121 ALA CA C 121 52.281 52.281 51.440 0.841 18321 14133 1 11 . 1 1 121 121 ALA CB C 121 18.623 18.623 18.968 -0.345 18321 14134 1 11 . 1 1 121 121 ALA H H 121 8.272 8.272 8.591 -0.319 18321 14135 1 11 . 1 1 122 122 GLU C C 122 176.316 176.316 175.448 0.868 18321 14136 1 11 . 1 1 123 123 ASP N N 123 120.448 120.448 122.377 -1.929 18321 14137 1 11 . 1 1 123 123 ASP C C 123 175.906 175.906 175.744 0.162 18321 14138 1 11 . 1 1 123 123 ASP CA C 123 54.167 54.167 53.231 0.936 18321 14139 1 11 . 1 1 123 123 ASP CB C 123 40.695 40.695 42.292 -1.597 18321 14140 1 11 . 1 1 123 123 ASP H H 123 8.181 8.181 8.417 -0.236 18321 14141 1 11 . 1 1 124 124 ASN N N 124 118.207 118.207 118.243 -0.036 18321 14142 1 11 . 1 1 124 124 ASN C C 124 174.851 174.851 174.470 0.381 18321 14143 1 11 . 1 1 124 124 ASN CA C 124 52.771 52.771 53.748 -0.977 18321 14144 1 11 . 1 1 124 124 ASN CB C 124 38.304 38.304 37.779 0.525 18321 14145 1 11 . 1 1 124 124 ASN H H 124 8.307 8.307 8.546 -0.239 18321 14146 1 11 . 1 1 125 125 LEU N N 125 121.311 121.311 121.261 0.050 18321 14147 1 11 . 1 1 125 125 LEU C C 125 175.750 175.750 175.914 -0.164 18321 14148 1 11 . 1 1 125 125 LEU CA C 125 54.428 54.428 55.686 -1.258 18321 14149 1 11 . 1 1 125 125 LEU CB C 125 41.350 41.350 39.820 1.530 18321 14150 1 11 . 1 1 125 125 LEU H H 125 7.747 7.747 8.566 -0.819 18321 14151 1 11 . 1 1 126 126 GLU N N 126 122.485 122.485 119.489 2.996 18321 14152 1 11 . 1 1 126 126 GLU C C 126 174.008 174.008 173.856 0.152 18321 14153 1 11 . 1 1 126 126 GLU CA C 126 54.855 54.855 56.663 -1.808 18321 14154 1 11 . 1 1 126 126 GLU CB C 126 30.472 30.472 31.197 -0.725 18321 14155 1 11 . 1 1 126 126 GLU H H 126 8.453 8.453 8.338 0.115 18321 14156 1 11 . 1 1 127 127 TYR N N 127 122.713 122.713 119.823 2.890 18321 14157 1 11 . 1 1 127 127 TYR C C 127 176.859 176.859 174.698 2.161 18321 14158 1 11 . 1 1 127 127 TYR CA C 127 56.528 56.528 57.475 -0.947 18321 14159 1 11 . 1 1 127 127 TYR CB C 127 40.982 40.982 39.772 1.210 18321 14160 1 11 . 1 1 127 127 TYR H H 127 8.469 8.469 8.022 0.447 18321 14161 1 11 . 1 1 128 128 VAL N N 128 112.432 112.432 125.282 -12.850 18321 14162 1 11 . 1 1 128 128 VAL C C 128 173.150 173.150 174.101 -0.951 18321 14163 1 11 . 1 1 128 128 VAL CA C 128 57.940 57.940 60.584 -2.644 18321 14164 1 11 . 1 1 128 128 VAL CB C 128 34.935 34.935 34.981 -0.046 18321 14165 1 11 . 1 1 128 128 VAL H H 128 9.078 9.078 9.124 -0.046 18321 14166 1 11 . 1 1 129 129 ARG N N 129 120.373 120.373 126.298 -5.925 18321 14167 1 11 . 1 1 129 129 ARG C C 129 176.539 176.539 175.959 0.580 18321 14168 1 11 . 1 1 129 129 ARG CA C 129 52.534 52.534 53.979 -1.445 18321 14169 1 11 . 1 1 129 129 ARG CB C 129 32.942 32.942 32.535 0.407 18321 14170 1 11 . 1 1 129 129 ARG H H 129 9.010 9.010 8.063 0.947 18321 14171 1 11 . 1 1 130 130 THR N N 130 116.637 116.637 115.442 1.195 18321 14172 1 11 . 1 1 130 130 THR CA C 130 60.618 60.618 61.074 -0.456 18321 14173 1 11 . 1 1 130 130 THR CB C 130 69.170 69.170 70.476 -1.306 18321 14174 1 11 . 1 1 130 130 THR H H 130 9.045 9.045 8.823 0.222 18321 14175 1 11 . 1 1 131 131 LEU N N 131 122.910 122.910 121.608 1.302 18321 14176 1 11 . 1 1 131 131 LEU C C 131 175.269 175.269 178.629 -3.360 18321 14177 1 11 . 1 1 131 131 LEU CA C 131 55.122 55.122 55.127 -0.005 18321 14178 1 11 . 1 1 131 131 LEU CB C 131 43.108 43.108 42.027 1.081 18321 14179 1 11 . 1 1 131 131 LEU H H 131 9.224 9.224 8.474 0.750 18321 14180 1 11 . 1 1 132 132 TYR N N 132 112.885 112.885 119.274 -6.389 18321 14181 1 11 . 1 1 132 132 TYR C C 132 173.818 173.818 175.700 -1.882 18321 14182 1 11 . 1 1 132 132 TYR CA C 132 54.230 54.230 59.815 -5.585 18321 14183 1 11 . 1 1 132 132 TYR CB C 132 42.672 42.672 40.154 2.518 18321 14184 1 11 . 1 1 132 132 TYR H H 132 7.284 7.284 7.774 -0.490 18321 14185 1 11 . 1 1 133 133 ASP N N 133 118.003 118.003 120.420 -2.417 18321 14186 1 11 . 1 1 133 133 ASP C C 133 175.779 175.779 174.572 1.207 18321 14187 1 11 . 1 1 133 133 ASP CA C 133 54.351 54.351 55.441 -1.090 18321 14188 1 11 . 1 1 133 133 ASP CB C 133 41.241 41.241 39.876 1.365 18321 14189 1 11 . 1 1 133 133 ASP H H 133 8.399 8.399 8.528 -0.129 18321 14190 1 11 . 1 1 134 134 PHE N N 134 121.081 121.081 123.864 -2.783 18321 14191 1 11 . 1 1 134 134 PHE CA C 134 52.552 52.552 54.842 -2.290 18321 14192 1 11 . 1 1 134 134 PHE CB C 134 41.217 41.217 41.144 0.073 18321 14193 1 11 . 1 1 134 134 PHE H H 134 8.797 8.797 6.949 1.848 18321 14194 1 11 . 1 1 136 136 GLY C C 136 171.616 171.616 174.833 -3.217 18321 14195 1 11 . 1 1 137 137 ASN N N 137 119.394 119.394 116.762 2.632 18321 14196 1 11 . 1 1 137 137 ASN C C 137 174.500 174.500 173.620 0.880 18321 14197 1 11 . 1 1 137 137 ASN CA C 137 44.670 44.670 54.487 -9.817 18321 14198 1 11 . 1 1 137 137 ASN H H 137 9.477 9.477 8.176 1.301 18321 14199 1 11 . 1 1 138 138 ASP N N 138 120.608 120.608 119.369 1.239 18321 14200 1 11 . 1 1 138 138 ASP C C 138 176.987 176.987 174.545 2.442 18321 14201 1 11 . 1 1 138 138 ASP CA C 138 52.992 52.992 53.000 -0.008 18321 14202 1 11 . 1 1 138 138 ASP H H 138 8.216 8.216 8.165 0.051 18321 14203 1 11 . 1 1 139 139 ALA N N 139 124.371 124.371 121.706 2.665 18321 14204 1 11 . 1 1 139 139 ALA C C 139 178.472 178.472 178.765 -0.293 18321 14205 1 11 . 1 1 139 139 ALA CA C 139 54.513 54.513 54.020 0.492 18321 14206 1 11 . 1 1 139 139 ALA CB C 139 18.045 18.045 19.468 -1.423 18321 14207 1 11 . 1 1 139 139 ALA H H 139 8.565 8.565 8.559 0.006 18321 14208 1 11 . 1 1 140 140 GLU N N 140 115.022 115.022 118.007 -2.985 18321 14209 1 11 . 1 1 140 140 GLU C C 140 177.027 177.027 175.781 1.246 18321 14210 1 11 . 1 1 140 140 GLU CA C 140 56.181 56.181 57.578 -1.397 18321 14211 1 11 . 1 1 140 140 GLU CB C 140 28.619 28.619 30.568 -1.949 18321 14212 1 11 . 1 1 140 140 GLU H H 140 8.616 8.616 8.488 0.128 18321 14213 1 11 . 1 1 141 141 ASP N N 141 121.913 121.913 119.720 2.193 18321 14214 1 11 . 1 1 141 141 ASP C C 141 175.923 175.923 174.557 1.366 18321 14215 1 11 . 1 1 141 141 ASP CA C 141 54.736 54.736 53.269 1.467 18321 14216 1 11 . 1 1 141 141 ASP CB C 141 41.305 41.305 43.362 -2.058 18321 14217 1 11 . 1 1 141 141 ASP H H 141 7.636 7.636 7.893 -0.257 18321 14218 1 11 . 1 1 142 142 LEU N N 142 127.651 127.651 126.567 1.084 18321 14219 1 11 . 1 1 142 142 LEU CA C 142 50.955 50.955 52.795 -1.840 18321 14220 1 11 . 1 1 142 142 LEU CB C 142 42.343 42.343 43.701 -1.358 18321 14221 1 11 . 1 1 142 142 LEU H H 142 9.479 9.479 8.002 1.477 18321 14222 1 11 . 1 1 143 143 PRO C C 143 177.924 177.924 175.571 2.353 18321 14223 1 11 . 1 1 144 144 PHE N N 144 114.483 114.483 120.382 -5.899 18321 14224 1 11 . 1 1 144 144 PHE C C 144 175.055 175.055 174.922 0.133 18321 14225 1 11 . 1 1 144 144 PHE CA C 144 55.543 55.543 54.631 0.912 18321 14226 1 11 . 1 1 144 144 PHE CB C 144 40.581 40.581 41.040 -0.459 18321 14227 1 11 . 1 1 144 144 PHE H H 144 8.637 8.637 7.206 1.431 18321 14228 1 11 . 1 1 145 145 LYS N N 145 121.342 121.342 119.869 1.473 18321 14229 1 11 . 1 1 145 145 LYS C C 145 176.925 176.925 177.889 -0.964 18321 14230 1 11 . 1 1 145 145 LYS CA C 145 53.043 53.043 54.593 -1.550 18321 14231 1 11 . 1 1 145 145 LYS CB C 145 33.804 33.804 34.326 -0.522 18321 14232 1 11 . 1 1 145 145 LYS H H 145 9.418 9.418 8.634 0.784 18321 14233 1 11 . 1 1 146 146 LYS N N 146 123.378 123.378 118.221 5.157 18321 14234 1 11 . 1 1 146 146 LYS CA C 146 57.883 57.883 58.429 -0.546 18321 14235 1 11 . 1 1 146 146 LYS CB C 146 32.008 32.008 32.893 -0.885 18321 14236 1 11 . 1 1 146 146 LYS H H 146 9.002 9.002 8.731 0.271 18321 14237 1 11 . 1 1 147 147 GLY C C 147 174.315 174.315 172.991 1.324 18321 14238 1 11 . 1 1 148 148 GLU N N 148 121.392 121.392 120.030 1.362 18321 14239 1 11 . 1 1 148 148 GLU C C 148 174.998 174.998 175.314 -0.316 18321 14240 1 11 . 1 1 148 148 GLU CA C 148 56.867 56.867 56.016 0.851 18321 14241 1 11 . 1 1 148 148 GLU CB C 148 31.649 31.649 31.056 0.593 18321 14242 1 11 . 1 1 148 148 GLU H H 148 7.937 7.937 7.488 0.449 18321 14243 1 11 . 1 1 149 149 ILE N N 149 120.124 120.124 122.700 -2.576 18321 14244 1 11 . 1 1 149 149 ILE C C 149 176.647 176.647 175.300 1.347 18321 14245 1 11 . 1 1 149 149 ILE CA C 149 58.621 58.621 60.919 -2.298 18321 14246 1 11 . 1 1 149 149 ILE CB C 149 36.952 36.952 38.472 -1.520 18321 14247 1 11 . 1 1 149 149 ILE H H 149 8.346 8.346 8.533 -0.187 18321 14248 1 11 . 1 1 150 150 LEU N N 150 126.950 126.950 124.776 2.174 18321 14249 1 11 . 1 1 150 150 LEU CA C 150 51.967 51.967 52.924 -0.957 18321 14250 1 11 . 1 1 150 150 LEU CB C 150 44.182 44.182 45.571 -1.389 18321 14251 1 11 . 1 1 150 150 LEU H H 150 8.988 8.988 9.168 -0.180 18321 14252 1 11 . 1 1 151 151 VAL C C 151 175.670 175.670 175.957 -0.287 18321 14253 1 11 . 1 1 152 152 ILE N N 152 124.997 124.997 129.209 -4.212 18321 14254 1 11 . 1 1 152 152 ILE CA C 152 58.331 58.331 60.188 -1.857 18321 14255 1 11 . 1 1 152 152 ILE CB C 152 34.093 34.093 34.593 -0.500 18321 14256 1 11 . 1 1 152 152 ILE H H 152 8.673 8.673 8.281 0.392 18321 14257 1 11 . 1 1 153 153 ILE N N 153 124.710 124.710 126.845 -2.135 18321 14258 1 11 . 1 1 153 153 ILE C C 153 176.264 176.264 174.977 1.287 18321 14259 1 11 . 1 1 154 154 GLU N N 154 117.398 117.398 115.998 1.400 18321 14260 1 11 . 1 1 154 154 GLU C C 154 173.959 173.959 174.308 -0.349 18321 14261 1 11 . 1 1 154 154 GLU CA C 154 55.289 55.289 54.779 0.511 18321 14262 1 11 . 1 1 154 154 GLU CB C 154 32.842 32.842 33.447 -0.605 18321 14263 1 11 . 1 1 154 154 GLU H H 154 7.818 7.818 8.430 -0.612 18321 14264 1 11 . 1 1 155 155 LYS N N 155 121.130 121.130 122.297 -1.167 18321 14265 1 11 . 1 1 155 155 LYS CA C 155 53.022 53.022 53.069 -0.048 18321 14266 1 11 . 1 1 155 155 LYS CB C 155 32.663 32.663 33.697 -1.034 18321 14267 1 11 . 1 1 155 155 LYS H H 155 8.654 8.654 9.132 -0.478 18321 14268 1 11 . 1 1 157 157 GLU C C 157 175.190 175.190 175.866 -0.676 18321 14269 1 11 . 1 1 157 157 GLU CA C 157 53.785 53.785 53.888 -0.103 18321 14270 1 11 . 1 1 157 157 GLU CB C 157 32.685 32.685 31.859 0.826 18321 14271 1 11 . 1 1 158 158 GLU N N 158 117.425 117.425 119.667 -2.242 18321 14272 1 11 . 1 1 158 158 GLU C C 158 178.600 178.600 176.999 1.601 18321 14273 1 11 . 1 1 158 158 GLU CA C 158 59.044 59.044 58.129 0.915 18321 14274 1 11 . 1 1 158 158 GLU CB C 158 29.706 29.706 30.017 -0.311 18321 14275 1 11 . 1 1 158 158 GLU H H 158 8.678 8.678 8.839 -0.161 18321 14276 1 11 . 1 1 159 159 GLN N N 159 110.925 110.925 115.185 -4.260 18321 14277 1 11 . 1 1 159 159 GLN C C 159 175.539 175.539 175.030 0.509 18321 14278 1 11 . 1 1 159 159 GLN CA C 159 54.942 54.942 56.125 -1.183 18321 14279 1 11 . 1 1 159 159 GLN CB C 159 28.572 28.572 29.701 -1.129 18321 14280 1 11 . 1 1 159 159 GLN H H 159 8.483 8.483 8.090 0.393 18321 14281 1 11 . 1 1 160 160 TRP N N 160 120.171 120.171 119.732 0.439 18321 14282 1 11 . 1 1 160 160 TRP C C 160 173.444 173.444 174.613 -1.169 18321 14283 1 11 . 1 1 160 160 TRP CA C 160 56.175 56.175 56.570 -0.395 18321 14284 1 11 . 1 1 160 160 TRP CB C 160 31.796 31.796 32.692 -0.896 18321 14285 1 11 . 1 1 160 160 TRP H H 160 6.826 6.826 7.792 -0.966 18321 14286 1 11 . 1 1 161 161 TRP N N 161 120.687 120.687 122.053 -1.366 18321 14287 1 11 . 1 1 161 161 TRP C C 161 174.736 174.736 175.737 -1.001 18321 14288 1 11 . 1 1 161 161 TRP CA C 161 51.889 51.889 54.499 -2.610 18321 14289 1 11 . 1 1 161 161 TRP CB C 161 32.772 32.772 32.084 0.688 18321 14290 1 11 . 1 1 161 161 TRP H H 161 8.462 8.462 9.550 -1.088 18321 14291 1 11 . 1 1 162 162 SER N N 162 115.691 115.691 119.748 -4.057 18321 14292 1 11 . 1 1 162 162 SER C C 162 174.320 174.320 173.390 0.930 18321 14293 1 11 . 1 1 162 162 SER CA C 162 57.011 57.011 58.200 -1.189 18321 14294 1 11 . 1 1 162 162 SER CB C 162 63.948 63.948 63.419 0.529 18321 14295 1 11 . 1 1 162 162 SER H H 162 8.830 8.830 9.217 -0.387 18321 14296 1 11 . 1 1 163 163 ALA N N 163 130.630 130.630 128.344 2.286 18321 14297 1 11 . 1 1 163 163 ALA CA C 163 50.029 50.029 49.973 0.056 18321 14298 1 11 . 1 1 163 163 ALA CB C 163 25.500 25.500 22.164 3.336 18321 14299 1 11 . 1 1 163 163 ALA H H 163 9.585 9.585 9.109 0.476 18321 14300 1 11 . 1 1 164 164 ARG N N 164 117.526 117.526 121.456 -3.930 18321 14301 1 11 . 1 1 164 164 ARG C C 164 176.719 176.719 176.631 0.088 18321 14302 1 11 . 1 1 164 164 ARG CA C 164 52.975 52.975 54.341 -1.366 18321 14303 1 11 . 1 1 164 164 ARG CB C 164 34.260 34.260 30.640 3.620 18321 14304 1 11 . 1 1 164 164 ARG H H 164 9.097 9.097 9.034 0.063 18321 14305 1 11 . 1 1 165 165 ASN N N 165 123.935 123.935 122.679 1.256 18321 14306 1 11 . 1 1 165 165 ASN C C 165 178.484 178.484 176.913 1.571 18321 14307 1 11 . 1 1 165 165 ASN CA C 165 50.332 50.332 54.529 -4.197 18321 14308 1 11 . 1 1 165 165 ASN CB C 165 39.487 39.487 39.647 -0.160 18321 14309 1 11 . 1 1 165 165 ASN H H 165 8.756 8.756 9.102 -0.346 18321 14310 1 11 . 1 1 166 166 LYS N N 166 118.464 118.464 120.630 -2.166 18321 14311 1 11 . 1 1 166 166 LYS C C 166 176.967 176.967 177.245 -0.278 18321 14312 1 11 . 1 1 166 166 LYS CA C 166 58.430 58.430 58.816 -0.386 18321 14313 1 11 . 1 1 166 166 LYS CB C 166 30.918 30.918 32.400 -1.482 18321 14314 1 11 . 1 1 166 166 LYS H H 166 8.915 8.915 9.462 -0.547 18321 14315 1 11 . 1 1 167 167 ASP N N 167 118.138 118.138 116.162 1.976 18321 14316 1 11 . 1 1 167 167 ASP C C 167 176.464 176.464 176.751 -0.287 18321 14317 1 11 . 1 1 167 167 ASP CA C 167 54.212 54.212 54.970 -0.758 18321 14318 1 11 . 1 1 167 167 ASP CB C 167 41.178 41.178 41.210 -0.032 18321 14319 1 11 . 1 1 167 167 ASP H H 167 7.508 7.508 8.284 -0.776 18321 14320 1 11 . 1 1 168 168 GLY N N 168 107.901 107.901 106.914 0.987 18321 14321 1 11 . 1 1 168 168 GLY C C 168 173.613 173.613 173.794 -0.181 18321 14322 1 11 . 1 1 168 168 GLY CA C 168 44.783 44.783 44.852 -0.069 18321 14323 1 11 . 1 1 168 168 GLY H H 168 8.173 8.173 7.907 0.266 18321 14324 1 11 . 1 1 169 169 ARG N N 169 124.324 124.324 121.329 2.995 18321 14325 1 11 . 1 1 169 169 ARG CA C 169 56.106 56.106 56.380 -0.274 18321 14326 1 11 . 1 1 169 169 ARG CB C 169 29.648 29.648 31.249 -1.601 18321 14327 1 11 . 1 1 169 169 ARG H H 169 7.998 7.998 8.061 -0.063 18321 14328 1 11 . 1 1 170 170 VAL C C 170 177.590 177.590 175.013 2.577 18321 14329 1 11 . 1 1 171 171 GLY N N 171 112.582 112.582 113.066 -0.484 18321 14330 1 11 . 1 1 171 171 GLY C C 171 170.991 170.991 172.419 -1.428 18321 14331 1 11 . 1 1 171 171 GLY CA C 171 45.361 45.361 44.451 0.910 18321 14332 1 11 . 1 1 171 171 GLY H H 171 9.013 9.013 8.595 0.418 18321 14333 1 11 . 1 1 172 172 MET N N 172 117.368 117.368 120.656 -3.288 18321 14334 1 11 . 1 1 172 172 MET C C 172 177.921 177.921 176.642 1.279 18321 14335 1 11 . 1 1 172 172 MET CA C 172 53.536 53.536 56.641 -3.105 18321 14336 1 11 . 1 1 172 172 MET CB C 172 30.838 30.838 33.991 -3.153 18321 14337 1 11 . 1 1 172 172 MET H H 172 8.885 8.885 8.370 0.515 18321 14338 1 11 . 1 1 173 173 ILE N N 173 113.130 113.130 117.825 -4.695 18321 14339 1 11 . 1 1 173 173 ILE CA C 173 56.284 56.284 57.936 -1.652 18321 14340 1 11 . 1 1 173 173 ILE CB C 173 40.870 40.870 40.645 0.225 18321 14341 1 11 . 1 1 173 173 ILE H H 173 9.704 9.704 9.485 0.219 18321 14342 1 11 . 1 1 174 174 PRO C C 174 176.714 176.714 177.621 -0.907 18321 14343 1 11 . 1 1 174 174 PRO CA C 174 66.290 66.290 61.301 4.989 18321 14344 1 11 . 1 1 174 174 PRO CB C 174 28.993 28.993 30.702 -1.709 18321 14345 1 11 . 1 1 175 175 VAL N N 175 128.066 128.066 123.641 4.425 18321 14346 1 11 . 1 1 175 175 VAL CA C 175 59.356 59.356 67.001 -7.645 18321 14347 1 11 . 1 1 175 175 VAL H H 175 7.327 7.327 8.172 -0.845 18321 14348 1 11 . 1 1 176 176 PRO C C 176 176.351 176.351 176.516 -0.165 18321 14349 1 11 . 1 1 177 177 TYR N N 177 115.756 115.756 116.568 -0.812 18321 14350 1 11 . 1 1 177 177 TYR C C 177 175.011 175.011 175.154 -0.143 18321 14351 1 11 . 1 1 177 177 TYR CA C 177 56.756 56.756 57.593 -0.837 18321 14352 1 11 . 1 1 177 177 TYR CB C 177 37.507 37.507 39.211 -1.704 18321 14353 1 11 . 1 1 177 177 TYR H H 177 7.784 7.784 7.433 0.351 18321 14354 1 11 . 1 1 178 178 VAL N N 178 111.428 111.428 114.932 -3.504 18321 14355 1 11 . 1 1 178 178 VAL C C 178 173.417 173.417 175.149 -1.732 18321 14356 1 11 . 1 1 178 178 VAL CA C 178 58.307 58.307 59.040 -0.733 18321 14357 1 11 . 1 1 178 178 VAL CB C 178 34.602 34.602 35.397 -0.795 18321 14358 1 11 . 1 1 178 178 VAL H H 178 7.801 7.801 7.519 0.282 18321 14359 1 11 . 1 1 179 179 GLU N N 179 118.581 118.581 118.656 -0.075 18321 14360 1 11 . 1 1 179 179 GLU C C 179 175.225 175.225 175.688 -0.463 18321 14361 1 11 . 1 1 179 179 GLU CA C 179 53.114 53.114 55.121 -2.007 18321 14362 1 11 . 1 1 179 179 GLU CB C 179 32.712 32.712 29.874 2.838 18321 14363 1 11 . 1 1 179 179 GLU H H 179 8.819 8.819 8.462 0.357 18321 14364 1 11 . 1 1 180 180 LYS N N 180 124.167 124.167 120.542 3.625 18321 14365 1 11 . 1 1 180 180 LYS C C 180 176.303 176.303 175.296 1.007 18321 14366 1 11 . 1 1 180 180 LYS CA C 180 57.318 57.318 56.012 1.306 18321 14367 1 11 . 1 1 180 180 LYS CB C 180 31.675 31.675 32.691 -1.016 18321 14368 1 11 . 1 1 180 180 LYS H H 180 8.775 8.775 7.953 0.822 18321 14369 1 11 . 1 1 181 181 LEU N N 181 125.157 125.157 123.913 1.244 18321 14370 1 11 . 1 1 181 181 LEU C C 181 176.462 176.462 178.448 -1.986 18321 14371 1 11 . 1 1 181 181 LEU CA C 181 54.470 54.470 57.229 -2.759 18321 14372 1 11 . 1 1 181 181 LEU CB C 181 41.625 41.625 42.787 -1.162 18321 14373 1 11 . 1 1 181 181 LEU H H 181 8.084 8.084 8.474 -0.390 18321 14374 1 11 . 1 1 182 182 VAL N N 182 123.167 123.167 119.269 3.898 18321 14375 1 11 . 1 1 182 182 VAL C C 182 175.983 175.983 174.365 1.618 18321 14376 1 11 . 1 1 182 182 VAL CA C 182 61.613 61.613 62.279 -0.666 18321 14377 1 11 . 1 1 182 182 VAL CB C 182 32.085 32.085 29.953 2.131 18321 14378 1 11 . 1 1 182 182 VAL H H 182 8.345 8.345 8.136 0.209 18321 14379 1 11 . 1 1 183 183 ARG N N 183 125.775 125.775 120.302 5.473 18321 14380 1 11 . 1 1 183 183 ARG CA C 183 57.801 57.801 55.472 2.329 18321 14381 1 11 . 1 1 183 183 ARG CB C 183 30.091 30.091 31.508 -1.417 18321 14382 1 11 . 1 1 183 183 ARG H H 183 8.530 8.530 8.175 0.355 18321 14383 1 11 . 1 1 184 184 SER C C 184 173.239 173.239 174.834 -1.595 18321 14384 1 11 . 1 1 185 185 SER N N 185 116.511 116.511 117.795 -1.284 18321 14385 1 11 . 1 1 185 185 SER CA C 185 58.428 58.428 62.135 -3.707 18321 14386 1 11 . 1 1 185 185 SER CB C 185 69.737 69.737 62.384 7.353 18321 14387 1 11 . 1 1 185 185 SER H H 185 7.944 7.944 8.745 -0.801 18321 14388 1 11 . 1 1 190 190 HIS C C 190 176.953 176.953 175.189 1.764 18321 14389 1 11 . 1 1 190 190 HIS CA C 190 54.229 54.229 56.694 -2.465 18321 14390 1 11 . 1 1 190 190 HIS CB C 190 35.112 35.112 28.448 6.664 18321 14391 1 11 . 1 1 191 191 GLY N N 191 109.491 109.491 114.337 -4.846 18321 14392 1 11 . 1 1 191 191 GLY C C 191 172.295 172.295 173.546 -1.251 18321 14393 1 11 . 1 1 191 191 GLY CA C 191 45.227 45.227 45.057 0.170 18321 14394 1 11 . 1 1 191 191 GLY H H 191 8.719 8.719 7.922 0.797 18321 14395 1 11 . 1 1 192 192 ASN N N 192 118.700 118.700 117.644 1.056 18321 14396 1 11 . 1 1 192 192 ASN HA H 192 4.312 4.312 4.602 -0.290 18321 14397 1 11 . 1 1 192 192 ASN C C 192 176.369 176.369 176.519 -0.150 18321 14398 1 11 . 1 1 192 192 ASN CA C 192 57.787 57.787 54.126 3.662 18321 14399 1 11 . 1 1 192 192 ASN H H 192 7.508 7.508 8.384 -0.876 18321 14400 1 11 . 1 1 193 193 ARG N N 193 120.743 120.743 118.788 1.955 18321 14401 1 11 . 1 1 193 193 ARG H H 193 9.032 9.032 8.403 0.629 18321 14402 1 11 . 1 1 197 197 SER HA H 197 4.388 4.388 3.976 0.412 18321 14403 1 11 . 1 1 197 197 SER C C 197 174.133 174.133 173.535 0.598 18321 14404 1 11 . 1 1 197 197 SER CA C 197 58.128 58.128 61.073 -2.945 18321 14405 1 11 . 1 1 197 197 SER CB C 197 62.966 62.966 62.551 0.415 18321 14406 1 11 . 1 1 198 198 TYR N N 198 121.435 121.435 123.655 -2.220 18321 14407 1 11 . 1 1 198 198 TYR HA H 198 4.543 4.543 4.500 0.043 18321 14408 1 11 . 1 1 198 198 TYR C C 198 176.230 176.230 177.261 -1.031 18321 14409 1 11 . 1 1 198 198 TYR CA C 198 57.536 57.536 58.958 -1.422 18321 14410 1 11 . 1 1 198 198 TYR CB C 198 38.279 38.279 39.165 -0.886 18321 14411 1 11 . 1 1 198 198 TYR H H 198 8.071 8.071 8.029 0.042 18321 14412 1 11 . 1 1 199 199 GLY N N 199 110.039 110.039 115.516 -5.477 18321 14413 1 11 . 1 1 199 199 GLY C C 199 173.475 173.475 173.711 -0.236 18321 14414 1 11 . 1 1 199 199 GLY CA C 199 44.805 44.805 45.897 -1.092 18321 14415 1 11 . 1 1 199 199 GLY H H 199 8.162 8.162 8.085 0.077 18321 14416 1 11 . 1 1 200 200 ILE N N 200 121.530 121.530 121.122 0.408 18321 14417 1 11 . 1 1 200 200 ILE CA C 200 58.102 58.102 58.256 -0.154 18321 14418 1 11 . 1 1 200 200 ILE CB C 200 37.760 37.760 40.149 -2.389 18321 14419 1 11 . 1 1 200 200 ILE H H 200 7.851 7.851 7.534 0.317 18321 14420 1 11 . 1 1 201 201 PRO C C 201 176.485 176.485 176.226 0.259 18321 14421 1 11 . 1 1 201 201 PRO CA C 201 53.893 53.893 63.800 -9.907 18321 14422 1 11 . 1 1 201 201 PRO CB C 201 29.042 29.042 31.933 -2.891 18321 14423 1 11 . 1 1 202 202 GLU N N 202 122.468 122.468 116.727 5.741 18321 14424 1 11 . 1 1 202 202 GLU CA C 202 62.490 62.490 55.703 6.787 18321 14425 1 11 . 1 1 202 202 GLU CB C 202 31.170 31.170 29.632 1.538 18321 14426 1 11 . 1 1 202 202 GLU H H 202 8.328 8.328 8.414 -0.086 18321 14427 1 11 . 1 1 203 203 PRO CA C 203 62.803 62.803 62.365 0.438 18321 14428 1 11 . 1 1 203 203 PRO CB C 203 31.220 31.220 32.183 -0.963 18321 14429 1 11 . 1 1 204 204 ALA N N 204 123.251 123.251 128.450 -5.199 18321 14430 1 11 . 1 1 204 204 ALA HA H 204 4.180 4.180 3.986 0.194 18321 14431 1 11 . 1 1 204 204 ALA CA C 204 52.124 52.124 53.807 -1.683 18321 14432 1 11 . 1 1 204 204 ALA CB C 204 18.892 18.892 18.657 0.235 18321 14433 1 11 . 1 1 204 204 ALA H H 204 8.308 8.308 8.745 -0.437 18321 14434 1 11 . 1 1 205 205 HIS N N 205 117.874 117.874 115.080 2.794 18321 14435 1 11 . 1 1 205 205 HIS C C 205 173.282 173.282 176.062 -2.780 18321 14436 1 11 . 1 1 205 205 HIS H H 205 8.045 8.045 8.510 -0.465 18321 14437 1 11 . 1 1 206 206 ALA N N 206 125.519 125.519 120.356 5.163 18321 14438 1 11 . 1 1 206 206 ALA HA H 206 4.204 4.204 4.429 -0.225 18321 14439 1 11 . 1 1 206 206 ALA CA C 206 40.196 40.196 52.637 -12.441 18321 14440 1 11 . 1 1 206 206 ALA CB C 206 19.407 19.407 19.288 0.118 18321 14441 1 11 . 1 1 206 206 ALA H H 206 8.061 8.061 8.082 -0.021 18321 14442 1 11 . 1 1 207 207 TYR N N 207 120.381 120.381 119.435 0.946 18321 14443 1 11 . 1 1 207 207 TYR HA H 207 4.570 4.570 4.503 0.067 18321 14444 1 11 . 1 1 207 207 TYR CA C 207 52.572 52.572 58.179 -5.607 18321 14445 1 11 . 1 1 207 207 TYR CB C 207 41.333 41.333 38.975 2.358 18321 14446 1 11 . 1 1 207 207 TYR H H 207 8.199 8.199 8.415 -0.216 18321 14447 1 11 . 1 1 208 208 ALA HA H 208 4.281 4.281 3.990 0.291 18321 14448 1 11 . 1 1 208 208 ALA C C 208 177.736 177.736 176.689 1.047 18321 14449 1 11 . 1 1 208 208 ALA CA C 208 52.084 52.084 53.166 -1.082 18321 14450 1 11 . 1 1 208 208 ALA CB C 208 18.999 18.999 18.226 0.773 18321 14451 1 11 . 1 1 209 209 GLN N N 209 119.295 119.295 116.696 2.599 18321 14452 1 11 . 1 1 209 209 GLN CA C 209 61.474 61.474 56.054 5.420 18321 14453 1 11 . 1 1 209 209 GLN CB C 209 32.039 32.039 28.950 3.090 18321 14454 1 11 . 1 1 209 209 GLN H H 209 8.125 8.125 8.532 -0.407 18321 14455 1 11 . 1 1 210 210 PRO HA H 210 4.395 4.395 4.460 -0.065 18321 14456 1 11 . 1 1 210 210 PRO CA C 210 62.584 62.584 63.550 -0.966 18321 14457 1 11 . 1 1 211 211 GLN HA H 211 4.377 4.377 4.384 -0.007 18321 14458 1 11 . 1 1 211 211 GLN CA C 211 55.859 55.859 55.801 0.058 18321 14459 1 11 . 1 1 211 211 GLN CB C 211 29.577 29.577 29.060 0.517 18321 14460 1 11 . 1 1 212 212 THR C C 212 176.551 176.551 174.916 1.635 18321 14461 1 11 . 1 1 212 212 THR CB C 212 69.890 69.890 69.152 0.738 18321 14462 1 11 . 1 1 213 213 THR N N 213 108.487 108.487 116.246 -7.759 18321 14463 1 11 . 1 1 213 213 THR CA C 213 61.236 61.236 62.263 -1.027 18321 14464 1 11 . 1 1 213 213 THR CB C 213 69.091 69.091 68.489 0.602 18321 14465 1 11 . 1 1 213 213 THR H H 213 8.243 8.243 7.742 0.501 18321 14466 1 11 . 1 1 214 214 THR N N 214 119.445 119.445 120.486 -1.041 18321 14467 1 11 . 1 1 214 214 THR CA C 214 59.425 59.425 59.156 0.269 18321 14468 1 11 . 1 1 214 214 THR CB C 214 69.251 69.251 70.009 -0.758 18321 14469 1 11 . 1 1 214 214 THR H H 214 8.188 8.188 8.182 0.006 18321 14470 1 11 . 1 1 215 215 PRO HA H 215 4.361 4.361 4.752 -0.391 18321 14471 1 11 . 1 1 215 215 PRO C C 215 175.422 175.422 175.321 0.101 18321 14472 1 11 . 1 1 215 215 PRO CA C 215 63.320 63.320 62.639 0.681 18321 14473 1 11 . 1 1 215 215 PRO CB C 215 31.918 31.918 32.515 -0.597 18321 14474 1 11 . 1 1 216 216 LEU N N 216 121.602 121.602 123.386 -1.784 18321 14475 1 11 . 1 1 216 216 LEU CA C 216 52.203 52.203 52.372 -0.169 18321 14476 1 11 . 1 1 216 216 LEU CB C 216 42.451 42.451 43.966 -1.515 18321 14477 1 11 . 1 1 216 216 LEU H H 216 7.891 7.891 8.073 -0.182 18321 14478 1 11 . 1 1 217 217 PRO HA H 217 4.398 4.398 4.900 -0.502 18321 14479 1 11 . 1 1 217 217 PRO C C 217 176.577 176.577 175.887 0.690 18321 14480 1 11 . 1 1 217 217 PRO CA C 217 62.984 62.984 62.916 0.068 18321 14481 1 11 . 1 1 217 217 PRO CB C 217 32.056 32.056 30.550 1.506 18321 14482 1 11 . 1 1 218 218 ALA N N 218 124.087 124.087 125.589 -1.502 18321 14483 1 11 . 1 1 218 218 ALA HA H 218 4.309 4.309 4.420 -0.111 18321 14484 1 11 . 1 1 218 218 ALA C C 218 177.844 177.844 178.065 -0.221 18321 14485 1 11 . 1 1 218 218 ALA CA C 218 52.379 52.379 52.889 -0.510 18321 14486 1 11 . 1 1 218 218 ALA CB C 218 19.133 19.133 19.961 -0.828 18321 14487 1 11 . 1 1 218 218 ALA H H 218 8.261 8.261 8.099 0.162 18321 14488 1 11 . 1 1 219 219 VAL N N 219 118.942 118.942 116.775 2.167 18321 14489 1 11 . 1 1 219 219 VAL HA H 219 4.142 4.142 4.269 -0.127 18321 14490 1 11 . 1 1 219 219 VAL CA C 219 62.102 62.102 63.216 -1.114 18321 14491 1 11 . 1 1 219 219 VAL CB C 219 32.923 32.923 32.289 0.634 18321 14492 1 11 . 1 1 219 219 VAL H H 219 8.049 8.049 7.968 0.081 18321 14493 1 11 . 1 1 220 220 SER N N 220 119.207 119.207 118.416 0.791 18321 14494 1 11 . 1 1 220 220 SER HA H 220 4.436 4.436 4.577 -0.141 18321 14495 1 11 . 1 1 220 220 SER CA C 220 57.813 57.813 58.144 -0.331 18321 14496 1 11 . 1 1 220 220 SER CB C 220 63.375 63.375 62.920 0.455 18321 14497 1 11 . 1 1 220 220 SER H H 220 8.275 8.275 7.795 0.480 18321 14498 1 11 . 1 1 221 221 GLY N N 221 110.973 110.973 112.747 -1.774 18321 14499 1 11 . 1 1 221 221 GLY C C 221 173.962 173.962 173.208 0.754 18321 14500 1 11 . 1 1 221 221 GLY CA C 221 45.286 45.286 45.399 -0.113 18321 14501 1 11 . 1 1 221 221 GLY H H 221 8.374 8.374 8.164 0.210 18321 14502 1 11 . 1 1 222 222 SER N N 222 115.516 115.516 117.738 -2.222 18321 14503 1 11 . 1 1 222 222 SER HA H 222 4.763 4.763 4.868 -0.105 18321 14504 1 11 . 1 1 222 222 SER CA C 222 56.407 56.407 55.392 1.015 18321 14505 1 11 . 1 1 222 222 SER CB C 222 63.993 63.993 64.151 -0.158 18321 14506 1 11 . 1 1 222 222 SER H H 222 8.155 8.155 8.323 -0.168 18321 14507 1 11 . 1 1 223 223 PRO HA H 223 4.417 4.417 4.557 -0.140 18321 14508 1 11 . 1 1 223 223 PRO CA C 223 63.805 63.805 63.084 0.722 18321 14509 1 11 . 1 1 223 223 PRO CB C 223 32.090 32.090 32.133 -0.043 18321 14510 1 11 . 1 1 224 224 GLY N N 224 109.149 109.149 111.518 -2.369 18321 14511 1 11 . 1 1 224 224 GLY C C 224 173.813 173.813 173.314 0.499 18321 14512 1 11 . 1 1 224 224 GLY CA C 224 44.512 44.512 45.399 -0.887 18321 14513 1 11 . 1 1 224 224 GLY H H 224 8.376 8.376 8.876 -0.500 18321 14514 1 11 . 1 1 225 225 ALA N N 225 123.599 123.599 120.027 3.572 18321 14515 1 11 . 1 1 225 225 ALA C C 225 177.341 177.341 175.718 1.623 18321 14516 1 11 . 1 1 225 225 ALA CA C 225 51.878 51.878 51.062 0.816 18321 14517 1 11 . 1 1 225 225 ALA CB C 225 19.169 19.169 21.279 -2.110 18321 14518 1 11 . 1 1 225 225 ALA H H 225 7.959 7.959 7.471 0.488 18321 14519 1 11 . 1 1 226 226 ALA N N 226 123.218 123.218 126.113 -2.895 18321 14520 1 11 . 1 1 226 226 ALA HA H 226 4.350 4.350 4.320 0.030 18321 14521 1 11 . 1 1 226 226 ALA C C 226 177.520 177.520 176.571 0.949 18321 14522 1 11 . 1 1 226 226 ALA CA C 226 52.535 52.535 52.267 0.268 18321 14523 1 11 . 1 1 226 226 ALA CB C 226 19.171 19.171 17.763 1.408 18321 14524 1 11 . 1 1 226 226 ALA H H 226 8.169 8.169 8.436 -0.267 18321 14525 1 11 . 1 1 227 227 ILE N N 227 120.086 120.086 123.936 -3.850 18321 14526 1 11 . 1 1 227 227 ILE HA H 227 4.201 4.201 4.310 -0.109 18321 14527 1 11 . 1 1 227 227 ILE C C 227 174.814 174.814 174.340 0.474 18321 14528 1 11 . 1 1 227 227 ILE CA C 227 60.929 60.929 61.453 -0.524 18321 14529 1 11 . 1 1 227 227 ILE CB C 227 38.872 38.872 41.130 -2.258 18321 14530 1 11 . 1 1 227 227 ILE H H 227 8.037 8.037 7.872 0.165 18321 14531 1 11 . 1 1 228 228 THR N N 228 117.224 117.224 120.233 -3.009 18321 14532 1 11 . 1 1 228 228 THR HA H 228 4.203 4.203 4.556 -0.353 18321 14533 1 11 . 1 1 228 228 THR CA C 228 57.108 57.108 62.084 -4.976 18321 14534 1 11 . 1 1 228 228 THR CB C 228 69.945 69.945 68.781 1.164 18321 14535 1 11 . 1 1 228 228 THR H H 228 7.775 7.775 7.947 -0.172 18321 14536 1 11 . 1 1 229 229 PRO HA H 229 4.750 4.750 4.501 0.249 18321 14537 1 11 . 1 1 229 229 PRO CA C 229 62.480 62.480 62.871 -0.391 18321 14538 1 11 . 1 1 229 229 PRO CB C 229 33.995 33.995 31.750 2.245 18321 14539 1 11 . 1 1 230 230 LEU N N 230 123.629 123.629 125.861 -2.232 18321 14540 1 11 . 1 1 230 230 LEU CA C 230 53.076 53.076 53.108 -0.032 18321 14541 1 11 . 1 1 230 230 LEU CB C 230 40.608 40.608 41.658 -1.050 18321 14542 1 11 . 1 1 230 230 LEU H H 230 8.453 8.453 8.243 0.210 18321 14543 1 11 . 1 1 231 231 PRO HA H 231 4.412 4.412 4.449 -0.037 18321 14544 1 11 . 1 1 231 231 PRO C C 231 176.571 176.571 176.724 -0.153 18321 14545 1 11 . 1 1 231 231 PRO CA C 231 63.225 63.225 62.962 0.263 18321 14546 1 11 . 1 1 231 231 PRO CB C 231 31.191 31.191 32.165 -0.974 18321 14547 1 11 . 1 1 232 232 SER N N 232 115.169 115.169 121.787 -6.618 18321 14548 1 11 . 1 1 232 232 SER HA H 232 4.450 4.450 4.487 -0.037 18321 14549 1 11 . 1 1 232 232 SER CA C 232 58.604 58.604 58.668 -0.064 18321 14550 1 11 . 1 1 232 232 SER CB C 232 63.962 63.962 62.496 1.466 18321 14551 1 11 . 1 1 232 232 SER H H 232 8.280 8.280 8.621 -0.341 18321 14552 1 11 . 1 1 233 233 THR N N 233 115.155 115.155 115.860 -0.705 18321 14553 1 11 . 1 1 233 233 THR HA H 233 4.351 4.351 4.141 0.210 18321 14554 1 11 . 1 1 233 233 THR C C 233 177.237 177.237 174.757 2.480 18321 14555 1 11 . 1 1 233 233 THR CA C 233 61.939 61.939 62.697 -0.758 18321 14556 1 11 . 1 1 233 233 THR CB C 233 68.986 68.986 69.370 -0.384 18321 14557 1 11 . 1 1 233 233 THR H H 233 8.096 8.096 8.243 -0.147 18321 14558 1 11 . 1 1 234 234 GLN N N 234 122.040 122.040 120.417 1.623 18321 14559 1 11 . 1 1 234 234 GLN HA H 234 4.681 4.681 3.994 0.687 18321 14560 1 11 . 1 1 234 234 GLN C C 234 176.177 176.177 174.243 1.934 18321 14561 1 11 . 1 1 234 234 GLN CA C 234 55.861 55.861 56.559 -0.698 18321 14562 1 11 . 1 1 234 234 GLN CB C 234 28.583 28.583 27.421 1.162 18321 14563 1 11 . 1 1 234 234 GLN H H 234 8.256 8.256 8.601 -0.345 18321 14564 1 11 . 1 1 235 235 ASN N N 235 119.506 119.506 119.698 -0.192 18321 14565 1 11 . 1 1 235 235 ASN HA H 235 4.775 4.775 4.716 0.059 18321 14566 1 11 . 1 1 235 235 ASN C C 235 174.974 174.974 174.089 0.885 18321 14567 1 11 . 1 1 235 235 ASN CA C 235 53.191 53.191 52.461 0.730 18321 14568 1 11 . 1 1 235 235 ASN CB C 235 38.511 38.511 39.396 -0.885 18321 14569 1 11 . 1 1 235 235 ASN H H 235 8.346 8.346 8.262 0.084 18321 14570 1 11 . 1 1 236 236 GLY N N 236 109.378 109.378 107.095 2.283 18321 14571 1 11 . 1 1 236 236 GLY CA C 236 44.023 44.023 44.443 -0.420 18321 14572 1 11 . 1 1 236 236 GLY H H 236 7.939 7.939 8.555 -0.616 18321 14573 1 11 . 1 1 237 237 PRO HA H 237 4.336 4.336 4.512 -0.176 18321 14574 1 11 . 1 1 237 237 PRO C C 237 175.942 175.942 176.471 -0.529 18321 14575 1 11 . 1 1 237 237 PRO CA C 237 62.797 62.797 61.936 0.861 18321 14576 1 11 . 1 1 237 237 PRO CB C 237 27.421 27.421 31.892 -4.471 18321 14577 1 11 . 1 1 238 238 VAL N N 238 120.535 120.535 122.935 -2.400 18321 14578 1 11 . 1 1 238 238 VAL HA H 238 4.195 4.195 3.856 0.339 18321 14579 1 11 . 1 1 238 238 VAL C C 238 173.775 173.775 175.075 -1.300 18321 14580 1 11 . 1 1 238 238 VAL CA C 238 61.173 61.173 62.952 -1.779 18321 14581 1 11 . 1 1 238 238 VAL CB C 238 38.328 38.328 31.910 6.418 18321 14582 1 11 . 1 1 238 238 VAL H H 238 7.986 7.986 7.559 0.427 18321 14583 1 11 . 1 1 239 239 PHE N N 239 123.522 123.522 125.128 -1.606 18321 14584 1 11 . 1 1 239 239 PHE HA H 239 5.539 5.539 5.145 0.394 18321 14585 1 11 . 1 1 239 239 PHE C C 239 174.207 174.207 174.704 -0.497 18321 14586 1 11 . 1 1 239 239 PHE CA C 239 56.993 56.993 56.555 0.438 18321 14587 1 11 . 1 1 239 239 PHE CB C 239 41.743 41.743 40.181 1.562 18321 14588 1 11 . 1 1 239 239 PHE H H 239 8.927 8.927 8.761 0.166 18321 14589 1 11 . 1 1 240 240 ALA N N 240 120.871 120.871 126.588 -5.717 18321 14590 1 11 . 1 1 240 240 ALA HA H 240 5.352 5.352 5.588 -0.236 18321 14591 1 11 . 1 1 240 240 ALA C C 240 174.639 174.639 175.878 -1.239 18321 14592 1 11 . 1 1 240 240 ALA CA C 240 49.736 49.736 50.257 -0.520 18321 14593 1 11 . 1 1 240 240 ALA CB C 240 23.480 23.480 22.476 1.004 18321 14594 1 11 . 1 1 240 240 ALA H H 240 9.398 9.398 9.104 0.294 18321 14595 1 11 . 1 1 241 241 LYS N N 241 121.227 121.227 124.708 -3.481 18321 14596 1 11 . 1 1 241 241 LYS HA H 241 5.373 5.373 5.036 0.337 18321 14597 1 11 . 1 1 241 241 LYS C C 241 176.772 176.772 176.222 0.550 18321 14598 1 11 . 1 1 241 241 LYS CA C 241 53.128 53.128 53.842 -0.714 18321 14599 1 11 . 1 1 241 241 LYS CB C 241 34.850 34.850 33.756 1.094 18321 14600 1 11 . 1 1 241 241 LYS H H 241 8.947 8.947 8.669 0.278 18321 14601 1 11 . 1 1 242 242 ALA N N 242 126.833 126.833 131.384 -4.551 18321 14602 1 11 . 1 1 242 242 ALA HA H 242 4.764 4.764 4.708 0.056 18321 14603 1 11 . 1 1 242 242 ALA C C 242 178.506 178.506 177.745 0.761 18321 14604 1 11 . 1 1 242 242 ALA CA C 242 52.788 52.788 51.716 1.072 18321 14605 1 11 . 1 1 242 242 ALA CB C 242 19.084 19.084 18.222 0.862 18321 14606 1 11 . 1 1 242 242 ALA H H 242 9.373 9.373 8.563 0.810 18321 14607 1 11 . 1 1 243 243 ILE N N 243 118.731 118.731 119.404 -0.673 18321 14608 1 11 . 1 1 243 243 ILE HA H 243 4.454 4.454 4.196 0.258 18321 14609 1 11 . 1 1 243 243 ILE C C 243 174.773 174.773 176.221 -1.448 18321 14610 1 11 . 1 1 243 243 ILE CA C 243 60.613 60.613 62.244 -1.631 18321 14611 1 11 . 1 1 243 243 ILE CB C 243 39.232 39.232 38.465 0.767 18321 14612 1 11 . 1 1 243 243 ILE H H 243 8.933 8.933 8.143 0.790 18321 14613 1 11 . 1 1 244 244 GLN N N 244 121.616 121.616 120.093 1.523 18321 14614 1 11 . 1 1 244 244 GLN HA H 244 4.283 4.283 4.481 -0.198 18321 14615 1 11 . 1 1 244 244 GLN C C 244 172.815 172.815 174.557 -1.742 18321 14616 1 11 . 1 1 244 244 GLN CA C 244 54.750 54.750 54.343 0.407 18321 14617 1 11 . 1 1 244 244 GLN CB C 244 31.469 31.469 31.860 -0.392 18321 14618 1 11 . 1 1 244 244 GLN H H 244 7.438 7.438 7.822 -0.384 18321 14619 1 11 . 1 1 245 245 LYS N N 245 124.215 124.215 123.233 0.982 18321 14620 1 11 . 1 1 245 245 LYS HA H 245 3.962 3.962 4.231 -0.269 18321 14621 1 11 . 1 1 245 245 LYS C C 245 175.679 175.679 176.329 -0.650 18321 14622 1 11 . 1 1 245 245 LYS CA C 245 56.413 56.413 56.964 -0.551 18321 14623 1 11 . 1 1 245 245 LYS CB C 245 32.847 32.847 33.281 -0.434 18321 14624 1 11 . 1 1 245 245 LYS H H 245 8.318 8.318 8.551 -0.233 18321 14625 1 11 . 1 1 246 246 ARG N N 246 127.327 127.327 122.063 5.264 18321 14626 1 11 . 1 1 246 246 ARG HA H 246 4.221 4.221 4.674 -0.453 18321 14627 1 11 . 1 1 246 246 ARG CA C 246 56.279 56.279 54.393 1.886 18321 14628 1 11 . 1 1 246 246 ARG CB C 246 32.987 32.987 33.214 -0.227 18321 14629 1 11 . 1 1 246 246 ARG H H 246 9.248 9.248 8.712 0.536 18321 14630 1 11 . 1 1 249 249 CYS HA H 249 4.260 4.260 4.181 0.079 18321 14631 1 11 . 1 1 249 249 CYS CA C 249 55.886 55.886 57.218 -1.332 18321 14632 1 11 . 1 1 249 249 CYS CB C 249 34.146 34.146 29.035 5.111 18321 14633 1 11 . 1 1 250 250 ALA HA H 250 3.926 3.926 4.104 -0.178 18321 14634 1 11 . 1 1 250 250 ALA CA C 250 54.344 54.344 54.058 0.286 18321 14635 1 11 . 1 1 250 250 ALA CB C 250 18.342 18.342 18.519 -0.177 18321 14636 1 11 . 1 1 251 251 TYR N N 251 110.618 110.618 110.786 -0.168 18321 14637 1 11 . 1 1 251 251 TYR HA H 251 4.489 4.489 4.800 -0.311 18321 14638 1 11 . 1 1 251 251 TYR C C 251 175.286 175.286 174.852 0.434 18321 14639 1 11 . 1 1 251 251 TYR CA C 251 56.137 56.137 54.491 1.646 18321 14640 1 11 . 1 1 251 251 TYR CB C 251 37.203 37.203 38.368 -1.165 18321 14641 1 11 . 1 1 251 251 TYR H H 251 7.037 7.037 6.947 0.090 18321 14642 1 11 . 1 1 252 252 ASP N N 252 121.835 121.835 123.674 -1.839 18321 14643 1 11 . 1 1 252 252 ASP HA H 252 4.763 4.763 4.943 -0.180 18321 14644 1 11 . 1 1 252 252 ASP CA C 252 52.351 52.351 54.646 -2.295 18321 14645 1 11 . 1 1 252 252 ASP CB C 252 39.995 39.995 40.914 -0.919 18321 14646 1 11 . 1 1 252 252 ASP H H 252 7.339 7.339 7.588 -0.249 18321 14647 1 11 . 1 1 253 253 LYS N N 253 123.177 123.177 124.132 -0.955 18321 14648 1 11 . 1 1 253 253 LYS HA H 253 4.270 4.270 4.309 -0.039 18321 14649 1 11 . 1 1 253 253 LYS C C 253 177.724 177.724 177.579 0.145 18321 14650 1 11 . 1 1 253 253 LYS CA C 253 57.036 57.036 58.456 -1.420 18321 14651 1 11 . 1 1 253 253 LYS H H 253 8.396 8.396 8.631 -0.235 18321 14652 1 11 . 1 1 254 254 THR N N 254 108.317 108.317 111.769 -3.452 18321 14653 1 11 . 1 1 254 254 THR HA H 254 4.517 4.517 4.485 0.032 18321 14654 1 11 . 1 1 254 254 THR C C 254 174.012 174.012 173.427 0.585 18321 14655 1 11 . 1 1 254 254 THR CA C 254 61.036 61.036 61.164 -0.128 18321 14656 1 11 . 1 1 254 254 THR CB C 254 69.307 69.307 68.255 1.052 18321 14657 1 11 . 1 1 254 254 THR H H 254 8.217 8.217 8.357 -0.140 18321 14658 1 11 . 1 1 255 255 ALA N N 255 124.762 124.762 124.597 0.165 18321 14659 1 11 . 1 1 255 255 ALA HA H 255 4.524 4.524 5.117 -0.593 18321 14660 1 11 . 1 1 255 255 ALA C C 255 176.630 176.630 175.892 0.738 18321 14661 1 11 . 1 1 255 255 ALA CA C 255 51.352 51.352 50.296 1.056 18321 14662 1 11 . 1 1 255 255 ALA CB C 255 20.135 20.135 19.977 0.158 18321 14663 1 11 . 1 1 255 255 ALA H H 255 7.096 7.096 7.652 -0.556 18321 14664 1 11 . 1 1 256 256 LEU N N 256 124.379 124.379 125.880 -1.501 18321 14665 1 11 . 1 1 256 256 LEU HA H 256 4.328 4.328 4.357 -0.029 18321 14666 1 11 . 1 1 256 256 LEU C C 256 176.007 176.007 175.254 0.753 18321 14667 1 11 . 1 1 256 256 LEU CA C 256 53.502 53.502 54.764 -1.262 18321 14668 1 11 . 1 1 256 256 LEU CB C 256 44.665 44.665 43.866 0.799 18321 14669 1 11 . 1 1 256 256 LEU H H 256 8.889 8.889 8.342 0.547 18321 14670 1 11 . 1 1 257 257 ALA N N 257 129.619 129.619 125.465 4.154 18321 14671 1 11 . 1 1 257 257 ALA HA H 257 4.445 4.445 4.425 0.020 18321 14672 1 11 . 1 1 257 257 ALA C C 257 176.813 176.813 176.065 0.748 18321 14673 1 11 . 1 1 257 257 ALA CA C 257 51.179 51.179 50.796 0.383 18321 14674 1 11 . 1 1 257 257 ALA CB C 257 18.973 18.973 20.169 -1.196 18321 14675 1 11 . 1 1 257 257 ALA H H 257 8.529 8.529 8.314 0.215 18321 14676 1 11 . 1 1 258 258 LEU N N 258 119.300 119.300 123.098 -3.798 18321 14677 1 11 . 1 1 258 258 LEU HA H 258 4.782 4.782 4.701 0.081 18321 14678 1 11 . 1 1 258 258 LEU CA C 258 53.259 53.259 53.965 -0.706 18321 14679 1 11 . 1 1 258 258 LEU CB C 258 45.972 45.972 46.111 -0.139 18321 14680 1 11 . 1 1 258 258 LEU H H 258 8.505 8.505 8.490 0.015 18321 14681 1 11 . 1 1 259 259 GLU N N 259 123.919 123.919 121.213 2.706 18321 14682 1 11 . 1 1 259 259 GLU HA H 259 4.516 4.516 4.559 -0.043 18321 14683 1 11 . 1 1 259 259 GLU C C 259 175.795 175.795 175.209 0.586 18321 14684 1 11 . 1 1 259 259 GLU CA C 259 52.896 52.896 54.333 -1.437 18321 14685 1 11 . 1 1 259 259 GLU H H 259 8.943 8.943 8.545 0.398 18321 14686 1 11 . 1 1 260 260 VAL N N 260 122.122 122.122 120.270 1.852 18321 14687 1 11 . 1 1 260 260 VAL HA H 260 2.923 2.923 3.995 -1.072 18321 14688 1 11 . 1 1 260 260 VAL C C 260 177.964 177.964 177.887 0.077 18321 14689 1 11 . 1 1 260 260 VAL CA C 260 65.417 65.417 63.442 1.975 18321 14690 1 11 . 1 1 260 260 VAL CB C 260 30.668 30.668 31.180 -0.512 18321 14691 1 11 . 1 1 260 260 VAL H H 260 8.956 8.956 8.417 0.539 18321 14692 1 11 . 1 1 261 261 GLY N N 261 116.009 116.009 117.874 -1.865 18321 14693 1 11 . 1 1 261 261 GLY C C 261 176.288 176.288 173.462 2.826 18321 14694 1 11 . 1 1 261 261 GLY CA C 261 44.210 44.210 44.991 -0.781 18321 14695 1 11 . 1 1 261 261 GLY H H 261 8.799 8.799 9.039 -0.240 18321 14696 1 11 . 1 1 262 262 ASP N N 262 121.945 121.945 119.006 2.939 18321 14697 1 11 . 1 1 262 262 ASP HA H 262 4.423 4.423 4.992 -0.569 18321 14698 1 11 . 1 1 262 262 ASP C C 262 175.381 175.381 174.942 0.439 18321 14699 1 11 . 1 1 262 262 ASP CA C 262 55.243 55.243 52.385 2.858 18321 14700 1 11 . 1 1 262 262 ASP CB C 262 41.819 41.819 43.913 -2.094 18321 14701 1 11 . 1 1 262 262 ASP H H 262 8.180 8.180 7.759 0.421 18321 14702 1 11 . 1 1 263 263 ILE N N 263 121.452 121.452 122.507 -1.055 18321 14703 1 11 . 1 1 263 263 ILE HA H 263 4.707 4.707 4.600 0.107 18321 14704 1 11 . 1 1 263 263 ILE C C 263 174.996 174.996 176.039 -1.043 18321 14705 1 11 . 1 1 263 263 ILE CA C 263 59.289 59.289 59.704 -0.415 18321 14706 1 11 . 1 1 263 263 ILE CB C 263 36.987 36.987 37.588 -0.601 18321 14707 1 11 . 1 1 263 263 ILE H H 263 8.460 8.460 8.527 -0.067 18321 14708 1 11 . 1 1 264 264 VAL N N 264 128.756 128.756 129.906 -1.150 18321 14709 1 11 . 1 1 264 264 VAL HA H 264 4.309 4.309 4.093 0.216 18321 14710 1 11 . 1 1 264 264 VAL C C 264 175.486 175.486 175.153 0.333 18321 14711 1 11 . 1 1 264 264 VAL CA C 264 59.091 59.091 61.841 -2.750 18321 14712 1 11 . 1 1 264 264 VAL CB C 264 34.541 34.541 31.279 3.262 18321 14713 1 11 . 1 1 264 264 VAL H H 264 9.479 9.479 9.336 0.143 18321 14714 1 11 . 1 1 265 265 LYS N N 265 128.101 128.101 128.671 -0.570 18321 14715 1 11 . 1 1 265 265 LYS HA H 265 4.342 4.342 4.568 -0.226 18321 14716 1 11 . 1 1 265 265 LYS C C 265 175.531 175.531 175.472 0.059 18321 14717 1 11 . 1 1 265 265 LYS CA C 265 55.620 55.620 55.085 0.535 18321 14718 1 11 . 1 1 265 265 LYS CB C 265 33.149 33.149 31.709 1.440 18321 14719 1 11 . 1 1 265 265 LYS H H 265 8.715 8.715 8.441 0.274 18321 14720 1 11 . 1 1 266 266 VAL N N 266 129.537 129.537 126.635 2.902 18321 14721 1 11 . 1 1 266 266 VAL HA H 266 4.333 4.333 4.454 -0.121 18321 14722 1 11 . 1 1 266 266 VAL C C 266 176.166 176.166 174.688 1.478 18321 14723 1 11 . 1 1 266 266 VAL CA C 266 63.339 63.339 60.668 2.671 18321 14724 1 11 . 1 1 266 266 VAL CB C 266 30.712 30.712 33.972 -3.260 18321 14725 1 11 . 1 1 266 266 VAL H H 266 9.073 9.073 8.122 0.951 18321 14726 1 11 . 1 1 267 267 THR N N 267 120.020 120.020 122.377 -2.357 18321 14727 1 11 . 1 1 267 267 THR HA H 267 4.189 4.189 4.411 -0.222 18321 14728 1 11 . 1 1 267 267 THR C C 267 176.054 176.054 175.061 0.993 18321 14729 1 11 . 1 1 267 267 THR CA C 267 62.204 62.204 63.103 -0.899 18321 14730 1 11 . 1 1 267 267 THR CB C 267 68.200 68.200 69.465 -1.265 18321 14731 1 11 . 1 1 267 267 THR H H 267 9.130 9.130 8.518 0.612 18321 14732 1 11 . 1 1 268 268 ARG N N 268 120.839 120.839 123.453 -2.614 18321 14733 1 11 . 1 1 268 268 ARG HA H 268 4.236 4.236 4.610 -0.374 18321 14734 1 11 . 1 1 268 268 ARG CA C 268 56.321 56.321 55.141 1.180 18321 14735 1 11 . 1 1 268 268 ARG CB C 268 33.049 33.049 32.148 0.901 18321 14736 1 11 . 1 1 268 268 ARG H H 268 7.631 7.631 7.984 -0.353 18321 14737 1 11 . 1 1 269 269 MET N N 269 125.443 125.443 125.803 -0.360 18321 14738 1 11 . 1 1 269 269 MET C C 269 174.392 174.392 174.199 0.193 18321 14739 1 11 . 1 1 269 269 MET H H 269 8.532 8.532 8.597 -0.065 18321 14740 1 11 . 1 1 270 270 ASN N N 270 119.125 119.125 125.175 -6.050 18321 14741 1 11 . 1 1 270 270 ASN HA H 270 4.546 4.546 5.020 -0.474 18321 14742 1 11 . 1 1 270 270 ASN C C 270 172.133 172.133 175.306 -3.173 18321 14743 1 11 . 1 1 270 270 ASN CA C 270 53.639 53.639 52.370 1.269 18321 14744 1 11 . 1 1 270 270 ASN CB C 270 39.845 39.845 40.045 -0.200 18321 14745 1 11 . 1 1 270 270 ASN H H 270 6.631 6.631 8.876 -2.245 18321 14746 1 11 . 1 1 271 271 ILE N N 271 122.532 122.532 115.414 7.118 18321 14747 1 11 . 1 1 271 271 ILE HA H 271 4.417 4.417 4.446 -0.029 18321 14748 1 11 . 1 1 271 271 ILE CA C 271 63.348 63.348 62.254 1.094 18321 14749 1 11 . 1 1 271 271 ILE CB C 271 38.198 38.198 37.643 0.555 18321 14750 1 11 . 1 1 271 271 ILE H H 271 8.565 8.565 8.345 0.220 18321 14751 1 11 . 1 1 272 272 ASN HA H 272 4.527 4.527 4.710 -0.183 18321 14752 1 11 . 1 1 272 272 ASN C C 272 176.259 176.259 176.541 -0.282 18321 14753 1 11 . 1 1 272 272 ASN CA C 272 53.225 53.225 53.542 -0.317 18321 14754 1 11 . 1 1 272 272 ASN CB C 272 37.565 37.565 38.314 -0.749 18321 14755 1 11 . 1 1 273 273 GLY N N 273 107.043 107.043 106.758 0.285 18321 14756 1 11 . 1 1 273 273 GLY C C 273 173.216 173.216 172.690 0.526 18321 14757 1 11 . 1 1 273 273 GLY CA C 273 45.299 45.299 44.839 0.460 18321 14758 1 11 . 1 1 273 273 GLY H H 273 8.086 8.086 8.235 -0.149 18321 14759 1 11 . 1 1 274 274 GLN N N 274 120.624 120.624 120.067 0.557 18321 14760 1 11 . 1 1 274 274 GLN HA H 274 4.551 4.551 4.621 -0.070 18321 14761 1 11 . 1 1 274 274 GLN C C 274 175.039 175.039 174.926 0.113 18321 14762 1 11 . 1 1 274 274 GLN CA C 274 54.556 54.556 54.486 0.070 18321 14763 1 11 . 1 1 274 274 GLN CB C 274 33.698 33.698 30.502 3.196 18321 14764 1 11 . 1 1 274 274 GLN H H 274 8.045 8.045 7.898 0.147 18321 14765 1 11 . 1 1 275 275 TRP N N 275 125.596 125.596 124.602 0.994 18321 14766 1 11 . 1 1 275 275 TRP HA H 275 4.588 4.588 4.656 -0.068 18321 14767 1 11 . 1 1 275 275 TRP C C 275 172.832 172.832 176.021 -3.189 18321 14768 1 11 . 1 1 275 275 TRP CA C 275 55.296 55.296 53.993 1.303 18321 14769 1 11 . 1 1 275 275 TRP CB C 275 31.393 31.393 30.445 0.948 18321 14770 1 11 . 1 1 275 275 TRP H H 275 8.484 8.484 7.595 0.889 18321 14771 1 11 . 1 1 276 276 GLU N N 276 119.012 119.012 120.336 -1.324 18321 14772 1 11 . 1 1 276 276 GLU HA H 276 5.190 5.190 5.211 -0.021 18321 14773 1 11 . 1 1 276 276 GLU C C 276 176.553 176.553 176.417 0.136 18321 14774 1 11 . 1 1 276 276 GLU CA C 276 54.288 54.288 55.819 -1.532 18321 14775 1 11 . 1 1 276 276 GLU CB C 276 32.851 32.851 31.276 1.575 18321 14776 1 11 . 1 1 276 276 GLU H H 276 8.643 8.643 9.033 -0.390 18321 14777 1 11 . 1 1 277 277 GLY N N 277 111.364 111.364 111.604 -0.240 18321 14778 1 11 . 1 1 277 277 GLY C C 277 170.707 170.707 172.128 -1.421 18321 14779 1 11 . 1 1 277 277 GLY CA C 277 46.723 46.723 43.976 2.747 18321 14780 1 11 . 1 1 277 277 GLY H H 277 9.072 9.072 8.649 0.423 18321 14781 1 11 . 1 1 278 278 GLU N N 278 117.733 117.733 122.266 -4.533 18321 14782 1 11 . 1 1 278 278 GLU HA H 278 5.748 5.748 4.800 0.948 18321 14783 1 11 . 1 1 278 278 GLU C C 278 176.051 176.051 175.147 0.904 18321 14784 1 11 . 1 1 278 278 GLU CA C 278 53.620 53.620 55.060 -1.440 18321 14785 1 11 . 1 1 278 278 GLU CB C 278 33.742 33.742 31.644 2.098 18321 14786 1 11 . 1 1 278 278 GLU H H 278 8.810 8.810 8.237 0.573 18321 14787 1 11 . 1 1 279 279 VAL N N 279 123.834 123.834 126.464 -2.630 18321 14788 1 11 . 1 1 279 279 VAL HA H 279 4.404 4.404 4.364 0.040 18321 14789 1 11 . 1 1 279 279 VAL C C 279 175.289 175.289 175.850 -0.561 18321 14790 1 11 . 1 1 279 279 VAL CA C 279 61.166 61.166 60.028 1.138 18321 14791 1 11 . 1 1 279 279 VAL CB C 279 34.123 34.123 34.262 -0.139 18321 14792 1 11 . 1 1 279 279 VAL H H 279 8.887 8.887 8.768 0.119 18321 14793 1 11 . 1 1 280 280 ASN N N 280 126.025 126.025 126.050 -0.025 18321 14794 1 11 . 1 1 280 280 ASN HA H 280 4.435 4.435 4.457 -0.022 18321 14795 1 11 . 1 1 280 280 ASN C C 280 175.205 175.205 175.486 -0.281 18321 14796 1 11 . 1 1 280 280 ASN CA C 280 45.615 45.615 53.892 -8.277 18321 14797 1 11 . 1 1 280 280 ASN CB C 280 37.386 37.386 38.019 -0.633 18321 14798 1 11 . 1 1 280 280 ASN H H 280 9.322 9.322 9.236 0.086 18321 14799 1 11 . 1 1 281 281 GLY N N 281 104.588 104.588 104.041 0.547 18321 14800 1 11 . 1 1 281 281 GLY C C 281 173.944 173.944 173.408 0.536 18321 14801 1 11 . 1 1 281 281 GLY CA C 281 45.224 45.224 45.012 0.212 18321 14802 1 11 . 1 1 281 281 GLY H H 281 8.768 8.768 8.330 0.438 18321 14803 1 11 . 1 1 282 282 ARG N N 282 122.567 122.567 121.591 0.976 18321 14804 1 11 . 1 1 282 282 ARG HA H 282 4.559 4.559 4.613 -0.054 18321 14805 1 11 . 1 1 282 282 ARG C C 282 174.350 174.350 174.451 -0.101 18321 14806 1 11 . 1 1 282 282 ARG CA C 282 54.933 54.933 54.614 0.319 18321 14807 1 11 . 1 1 282 282 ARG CB C 282 31.765 31.765 32.051 -0.286 18321 14808 1 11 . 1 1 282 282 ARG H H 282 8.149 8.149 7.842 0.307 18321 14809 1 11 . 1 1 283 283 LYS N N 283 121.565 121.565 126.887 -5.322 18321 14810 1 11 . 1 1 283 283 LYS HA H 283 5.584 5.584 5.684 -0.100 18321 14811 1 11 . 1 1 283 283 LYS CA C 283 54.143 54.143 54.821 -0.678 18321 14812 1 11 . 1 1 283 283 LYS CB C 283 36.040 36.040 34.506 1.534 18321 14813 1 11 . 1 1 283 283 LYS H H 283 8.424 8.424 8.571 -0.147 18321 14814 1 11 . 1 1 284 284 GLY C C 284 173.006 173.006 172.321 0.685 18321 14815 1 11 . 1 1 284 284 GLY CA C 284 45.886 45.886 45.438 0.448 18321 14816 1 11 . 1 1 285 285 LEU N N 285 119.673 119.673 121.383 -1.710 18321 14817 1 11 . 1 1 285 285 LEU HA H 285 5.718 5.718 5.422 0.296 18321 14818 1 11 . 1 1 285 285 LEU C C 285 178.657 178.657 176.696 1.961 18321 14819 1 11 . 1 1 285 285 LEU CA C 285 53.656 53.656 54.448 -0.792 18321 14820 1 11 . 1 1 285 285 LEU CB C 285 44.813 44.813 42.874 1.939 18321 14821 1 11 . 1 1 285 285 LEU H H 285 8.734 8.734 8.712 0.022 18321 14822 1 11 . 1 1 286 286 PHE N N 286 118.785 118.785 120.665 -1.880 18321 14823 1 11 . 1 1 286 286 PHE HA H 286 4.521 4.521 5.104 -0.583 18321 14824 1 11 . 1 1 286 286 PHE CA C 286 57.592 57.592 54.202 3.390 18321 14825 1 11 . 1 1 286 286 PHE CB C 286 40.669 40.669 39.807 0.862 18321 14826 1 11 . 1 1 286 286 PHE H H 286 9.120 9.120 8.735 0.385 18321 14827 1 11 . 1 1 287 287 PRO HA H 287 4.385 4.385 4.565 -0.180 18321 14828 1 11 . 1 1 287 287 PRO CA C 287 62.814 62.814 62.659 0.155 18321 14829 1 11 . 1 1 287 287 PRO CB C 287 32.133 32.133 31.438 0.695 18321 14830 1 11 . 1 1 288 288 PHE C C 288 174.837 174.837 176.576 -1.739 18321 14831 1 11 . 1 1 288 288 PHE CA C 288 59.020 59.020 59.646 -0.626 18321 14832 1 11 . 1 1 288 288 PHE CB C 288 34.987 34.987 37.323 -2.336 18321 14833 1 11 . 1 1 289 289 THR N N 289 107.865 107.865 113.935 -6.070 18321 14834 1 11 . 1 1 289 289 THR HA H 289 3.589 3.589 3.741 -0.152 18321 14835 1 11 . 1 1 289 289 THR C C 289 176.125 176.125 174.914 1.211 18321 14836 1 11 . 1 1 289 289 THR CA C 289 62.243 62.243 64.150 -1.907 18321 14837 1 11 . 1 1 289 289 THR CB C 289 69.365 69.365 67.886 1.479 18321 14838 1 11 . 1 1 289 289 THR H H 289 6.453 6.453 7.769 -1.316 18321 14839 1 11 . 1 1 290 290 HIS N N 290 119.462 119.462 117.636 1.826 18321 14840 1 11 . 1 1 290 290 HIS HA H 290 4.196 4.196 4.823 -0.627 18321 14841 1 11 . 1 1 290 290 HIS C C 290 175.165 175.165 173.881 1.284 18321 14842 1 11 . 1 1 290 290 HIS CA C 290 57.635 57.635 55.797 1.837 18321 14843 1 11 . 1 1 290 290 HIS CB C 290 29.840 29.840 31.640 -1.800 18321 14844 1 11 . 1 1 290 290 HIS H H 290 7.835 7.835 7.761 0.074 18321 14845 1 11 . 1 1 291 291 VAL N N 291 110.050 110.050 113.995 -3.945 18321 14846 1 11 . 1 1 291 291 VAL HA H 291 5.445 5.445 5.395 0.050 18321 14847 1 11 . 1 1 291 291 VAL C C 291 173.386 173.386 174.768 -1.382 18321 14848 1 11 . 1 1 291 291 VAL CA C 291 57.794 57.794 58.603 -0.809 18321 14849 1 11 . 1 1 291 291 VAL CB C 291 35.784 35.784 35.237 0.547 18321 14850 1 11 . 1 1 291 291 VAL H H 291 7.562 7.562 7.647 -0.085 18321 14851 1 11 . 1 1 292 292 LYS N N 292 119.445 119.445 121.439 -1.994 18321 14852 1 11 . 1 1 292 292 LYS HA H 292 4.857 4.857 4.782 0.075 18321 14853 1 11 . 1 1 292 292 LYS C C 292 176.512 176.512 175.621 0.891 18321 14854 1 11 . 1 1 292 292 LYS CA C 292 54.647 54.647 54.429 0.218 18321 14855 1 11 . 1 1 292 292 LYS CB C 292 35.665 35.665 36.033 -0.368 18321 14856 1 11 . 1 1 292 292 LYS H H 292 8.753 8.753 8.259 0.494 18321 14857 1 11 . 1 1 293 293 ILE N N 293 128.707 128.707 125.911 2.796 18321 14858 1 11 . 1 1 293 293 ILE HA H 293 4.509 4.509 4.486 0.023 18321 14859 1 11 . 1 1 293 293 ILE C C 293 175.666 175.666 176.672 -1.006 18321 14860 1 11 . 1 1 293 293 ILE CA C 293 62.563 62.563 60.936 1.627 18321 14861 1 11 . 1 1 293 293 ILE CB C 293 38.076 38.076 36.386 1.690 18321 14862 1 11 . 1 1 293 293 ILE H H 293 9.107 9.107 8.904 0.203 18321 14863 1 11 . 1 1 294 294 PHE N N 294 126.638 126.638 124.880 1.758 18321 14864 1 11 . 1 1 294 294 PHE HA H 294 4.898 4.898 4.977 -0.079 18321 14865 1 11 . 1 1 294 294 PHE C C 294 175.838 175.838 172.935 2.903 18321 14866 1 11 . 1 1 294 294 PHE CA C 294 56.335 56.335 55.962 0.374 18321 14867 1 11 . 1 1 294 294 PHE CB C 294 41.196 41.196 41.330 -0.134 18321 14868 1 11 . 1 1 294 294 PHE H H 294 8.716 8.716 8.345 0.371 18321 14869 1 11 . 1 1 295 295 ASP N N 295 122.961 122.961 120.607 2.354 18321 14870 1 11 . 1 1 295 295 ASP HA H 295 5.003 5.003 4.831 0.172 18321 14871 1 11 . 1 1 295 295 ASP CA C 295 50.602 50.602 50.263 0.340 18321 14872 1 11 . 1 1 295 295 ASP CB C 295 40.754 40.754 42.694 -1.940 18321 14873 1 11 . 1 1 295 295 ASP H H 295 8.418 8.418 8.672 -0.254 18321 14874 1 11 . 1 1 296 296 PRO HA H 296 4.524 4.524 4.583 -0.059 18321 14875 1 11 . 1 1 296 296 PRO C C 296 176.807 176.807 176.182 0.625 18321 14876 1 11 . 1 1 296 296 PRO CA C 296 62.987 62.987 63.275 -0.288 18321 14877 1 11 . 1 1 296 296 PRO CB C 296 32.033 32.033 31.702 0.331 18321 14878 1 11 . 1 1 297 297 GLN N N 297 120.729 120.729 120.790 -0.061 18321 14879 1 11 . 1 1 297 297 GLN HA H 297 4.274 4.274 4.135 0.139 18321 14880 1 11 . 1 1 297 297 GLN CA C 297 56.427 56.427 56.577 -0.150 18321 14881 1 11 . 1 1 297 297 GLN CB C 297 28.819 28.819 29.615 -0.796 18321 14882 1 11 . 1 1 297 297 GLN H H 297 8.551 8.551 8.065 0.486 18321 14883 1 11 . 1 1 299 299 PRO C C 299 176.936 176.936 176.347 0.589 18321 14884 1 11 . 1 1 299 299 PRO CA C 299 63.406 63.406 63.443 -0.037 18321 14885 1 11 . 1 1 299 299 PRO CB C 299 31.421 31.421 32.021 -0.600 18321 14886 1 11 . 1 1 300 300 ASP N N 300 119.609 119.609 121.460 -1.851 18321 14887 1 11 . 1 1 300 300 ASP C C 300 176.344 176.344 177.314 -0.970 18321 14888 1 11 . 1 1 300 300 ASP CA C 300 54.178 54.178 55.719 -1.541 18321 14889 1 11 . 1 1 300 300 ASP CB C 300 40.661 40.661 41.509 -0.848 18321 14890 1 11 . 1 1 300 300 ASP H H 300 8.239 8.239 8.214 0.025 18321 14891 1 11 . 1 1 301 301 GLU N N 301 120.462 120.462 115.382 5.080 18321 14892 1 11 . 1 1 301 301 GLU CA C 301 56.188 56.188 55.409 0.779 18321 14893 1 11 . 1 1 301 301 GLU CB C 301 29.507 29.507 29.870 -0.363 18321 14894 1 11 . 1 1 301 301 GLU H H 301 8.084 8.084 8.414 -0.330 18321 14895 1 12 . 1 1 2 2 SER HA H 2 4.521 4.521 4.787 -0.266 18321 14896 1 12 . 1 1 2 2 SER CA C 2 58.326 58.326 57.821 0.505 18321 14897 1 12 . 1 1 2 2 SER CB C 2 64.062 64.062 64.467 -0.405 18321 14898 1 12 . 1 1 3 3 SER HA H 3 4.465 4.465 4.212 0.253 18321 14899 1 12 . 1 1 3 3 SER C C 3 173.887 173.887 173.825 0.062 18321 14900 1 12 . 1 1 3 3 SER CA C 3 58.374 58.374 59.085 -0.711 18321 14901 1 12 . 1 1 3 3 SER CB C 3 63.920 63.920 62.782 1.138 18321 14902 1 12 . 1 1 4 4 ALA N N 4 124.755 124.755 123.029 1.726 18321 14903 1 12 . 1 1 4 4 ALA HA H 4 4.547 4.547 4.247 0.300 18321 14904 1 12 . 1 1 4 4 ALA CA C 4 52.737 52.737 52.937 -0.200 18321 14905 1 12 . 1 1 4 4 ALA CB C 4 19.636 19.636 18.646 0.990 18321 14906 1 12 . 1 1 4 4 ALA H H 4 8.244 8.244 8.313 -0.069 18321 14907 1 12 . 1 1 5 5 ARG N N 5 120.383 120.383 123.054 -2.671 18321 14908 1 12 . 1 1 5 5 ARG HA H 5 4.524 4.524 4.764 -0.240 18321 14909 1 12 . 1 1 5 5 ARG C C 5 175.611 175.611 174.853 0.758 18321 14910 1 12 . 1 1 5 5 ARG CA C 5 56.082 56.082 55.661 0.421 18321 14911 1 12 . 1 1 5 5 ARG CB C 5 30.695 30.695 29.889 0.806 18321 14912 1 12 . 1 1 5 5 ARG H H 5 8.727 8.727 8.293 0.434 18321 14913 1 12 . 1 1 6 6 PHE N N 6 115.159 115.159 120.182 -5.023 18321 14914 1 12 . 1 1 6 6 PHE HA H 6 4.786 4.786 4.843 -0.057 18321 14915 1 12 . 1 1 6 6 PHE C C 6 172.076 172.076 174.240 -2.164 18321 14916 1 12 . 1 1 6 6 PHE CA C 6 56.640 56.640 55.923 0.717 18321 14917 1 12 . 1 1 6 6 PHE CB C 6 40.378 40.378 40.457 -0.079 18321 14918 1 12 . 1 1 6 6 PHE H H 6 7.536 7.536 7.857 -0.321 18321 14919 1 12 . 1 1 7 7 ASP N N 7 121.846 121.846 121.202 0.644 18321 14920 1 12 . 1 1 7 7 ASP HA H 7 4.846 4.846 4.663 0.183 18321 14921 1 12 . 1 1 7 7 ASP CA C 7 52.327 52.327 54.478 -2.151 18321 14922 1 12 . 1 1 7 7 ASP CB C 7 41.298 41.298 41.038 0.261 18321 14923 1 12 . 1 1 7 7 ASP H H 7 9.062 9.062 8.855 0.207 18321 14924 1 12 . 1 1 8 8 SER HA H 8 3.950 3.950 4.065 -0.115 18321 14925 1 12 . 1 1 8 8 SER C C 8 174.705 174.705 174.273 0.432 18321 14926 1 12 . 1 1 8 8 SER CA C 8 61.937 61.937 60.223 1.714 18321 14927 1 12 . 1 1 8 8 SER CB C 8 62.260 62.260 62.888 -0.628 18321 14928 1 12 . 1 1 9 9 SER N N 9 114.373 114.373 115.073 -0.700 18321 14929 1 12 . 1 1 9 9 SER HA H 9 4.529 4.529 5.480 -0.951 18321 14930 1 12 . 1 1 9 9 SER C C 9 175.089 175.089 173.680 1.409 18321 14931 1 12 . 1 1 9 9 SER CA C 9 59.851 59.851 59.225 0.626 18321 14932 1 12 . 1 1 9 9 SER CB C 9 64.246 64.246 64.298 -0.052 18321 14933 1 12 . 1 1 9 9 SER H H 9 8.722 8.722 7.983 0.739 18321 14934 1 12 . 1 1 10 10 ASP N N 10 121.818 121.818 124.067 -2.249 18321 14935 1 12 . 1 1 10 10 ASP HA H 10 4.730 4.730 4.389 0.341 18321 14936 1 12 . 1 1 10 10 ASP C C 10 174.455 174.455 177.047 -2.592 18321 14937 1 12 . 1 1 10 10 ASP CA C 10 52.432 52.432 54.962 -2.530 18321 14938 1 12 . 1 1 10 10 ASP CB C 10 39.607 39.607 40.267 -0.660 18321 14939 1 12 . 1 1 10 10 ASP H H 10 7.600 7.600 8.545 -0.945 18321 14940 1 12 . 1 1 11 11 ARG N N 11 125.238 125.238 119.879 5.359 18321 14941 1 12 . 1 1 11 11 ARG HA H 11 1.936 1.936 3.142 -1.206 18321 14942 1 12 . 1 1 11 11 ARG C C 11 176.916 176.916 177.576 -0.660 18321 14943 1 12 . 1 1 11 11 ARG CA C 11 57.451 57.451 58.687 -1.236 18321 14944 1 12 . 1 1 11 11 ARG CB C 11 43.014 43.014 27.969 15.045 18321 14945 1 12 . 1 1 11 11 ARG H H 11 7.739 7.739 8.397 -0.658 18321 14946 1 12 . 1 1 12 12 SER N N 12 112.065 112.065 112.803 -0.738 18321 14947 1 12 . 1 1 12 12 SER HA H 12 4.695 4.695 4.176 0.519 18321 14948 1 12 . 1 1 12 12 SER C C 12 175.092 175.092 174.757 0.335 18321 14949 1 12 . 1 1 12 12 SER CA C 12 60.785 60.785 59.183 1.602 18321 14950 1 12 . 1 1 12 12 SER CB C 12 62.889 62.889 62.473 0.416 18321 14951 1 12 . 1 1 12 12 SER H H 12 7.888 7.888 8.479 -0.591 18321 14952 1 12 . 1 1 13 13 ALA N N 13 122.249 122.249 122.815 -0.566 18321 14953 1 12 . 1 1 13 13 ALA HA H 13 4.216 4.216 4.321 -0.105 18321 14954 1 12 . 1 1 13 13 ALA C C 13 178.069 178.069 177.777 0.292 18321 14955 1 12 . 1 1 13 13 ALA CA C 13 53.562 53.562 53.478 0.084 18321 14956 1 12 . 1 1 13 13 ALA CB C 13 19.339 19.339 19.674 -0.335 18321 14957 1 12 . 1 1 13 13 ALA H H 13 7.418 7.418 7.075 0.343 18321 14958 1 12 . 1 1 14 14 TRP N N 14 107.433 107.433 113.252 -5.819 18321 14959 1 12 . 1 1 14 14 TRP HA H 14 4.785 4.785 4.691 0.094 18321 14960 1 12 . 1 1 14 14 TRP C C 14 175.286 175.286 175.714 -0.428 18321 14961 1 12 . 1 1 14 14 TRP CA C 14 55.212 55.212 56.448 -1.236 18321 14962 1 12 . 1 1 14 14 TRP CB C 14 32.776 32.776 31.056 1.720 18321 14963 1 12 . 1 1 14 14 TRP H H 14 6.273 6.273 7.186 -0.913 18321 14964 1 12 . 1 1 15 15 TYR N N 15 122.315 122.315 125.237 -2.922 18321 14965 1 12 . 1 1 15 15 TYR HA H 15 5.436 5.436 4.524 0.912 18321 14966 1 12 . 1 1 15 15 TYR C C 15 175.325 175.325 174.865 0.460 18321 14967 1 12 . 1 1 15 15 TYR CA C 15 56.609 56.609 59.920 -3.311 18321 14968 1 12 . 1 1 15 15 TYR CB C 15 36.940 36.940 38.013 -1.073 18321 14969 1 12 . 1 1 15 15 TYR H H 15 8.221 8.221 7.549 0.672 18321 14970 1 12 . 1 1 16 16 MET N N 16 126.031 126.031 127.422 -1.391 18321 14971 1 12 . 1 1 16 16 MET HA H 16 4.462 4.462 4.409 0.053 18321 14972 1 12 . 1 1 16 16 MET CA C 16 53.046 53.046 52.690 0.357 18321 14973 1 12 . 1 1 16 16 MET CB C 16 41.114 41.114 33.614 7.500 18321 14974 1 12 . 1 1 16 16 MET H H 16 8.989 8.989 8.618 0.371 18321 14975 1 12 . 1 1 17 17 GLY CA C 17 45.803 45.803 45.642 0.161 18321 14976 1 12 . 1 1 18 18 PRO HA H 18 4.675 4.675 4.569 0.106 18321 14977 1 12 . 1 1 18 18 PRO C C 18 175.943 175.943 175.515 0.428 18321 14978 1 12 . 1 1 18 18 PRO CA C 18 63.647 63.647 63.306 0.341 18321 14979 1 12 . 1 1 18 18 PRO CB C 18 29.276 29.276 31.402 -2.126 18321 14980 1 12 . 1 1 19 19 VAL N N 19 126.159 126.159 123.818 2.341 18321 14981 1 12 . 1 1 19 19 VAL HA H 19 4.011 4.011 4.142 -0.131 18321 14982 1 12 . 1 1 19 19 VAL C C 19 175.812 175.812 175.344 0.468 18321 14983 1 12 . 1 1 19 19 VAL CA C 19 62.355 62.355 61.706 0.649 18321 14984 1 12 . 1 1 19 19 VAL CB C 19 33.468 33.468 33.706 -0.238 18321 14985 1 12 . 1 1 19 19 VAL H H 19 7.851 7.851 7.949 -0.098 18321 14986 1 12 . 1 1 20 20 SER N N 20 123.950 123.950 111.074 12.876 18321 14987 1 12 . 1 1 20 20 SER HA H 20 4.453 4.453 4.115 0.338 18321 14988 1 12 . 1 1 20 20 SER CA C 20 57.631 57.631 59.115 -1.484 18321 14989 1 12 . 1 1 20 20 SER CB C 20 65.951 65.951 63.156 2.795 18321 14990 1 12 . 1 1 20 20 SER H H 20 8.800 8.800 8.404 0.396 18321 14991 1 12 . 1 1 21 21 ARG N N 21 123.461 123.461 121.375 2.086 18321 14992 1 12 . 1 1 21 21 ARG HA H 21 3.489 3.489 4.002 -0.513 18321 14993 1 12 . 1 1 21 21 ARG C C 21 178.164 178.164 178.398 -0.234 18321 14994 1 12 . 1 1 21 21 ARG CA C 21 60.025 60.025 59.620 0.405 18321 14995 1 12 . 1 1 21 21 ARG CB C 21 30.334 30.334 29.990 0.344 18321 14996 1 12 . 1 1 21 21 ARG H H 21 9.307 9.307 8.728 0.579 18321 14997 1 12 . 1 1 22 22 GLN N N 22 116.591 116.591 119.993 -3.402 18321 14998 1 12 . 1 1 22 22 GLN HA H 22 4.008 4.008 4.058 -0.050 18321 14999 1 12 . 1 1 22 22 GLN CA C 22 59.095 59.095 59.399 -0.304 18321 15000 1 12 . 1 1 22 22 GLN CB C 22 29.249 29.249 28.043 1.206 18321 15001 1 12 . 1 1 22 22 GLN H H 22 8.394 8.394 8.517 -0.123 18321 15002 1 12 . 1 1 23 23 GLU N N 23 122.191 122.191 119.133 3.058 18321 15003 1 12 . 1 1 23 23 GLU HA H 23 4.037 4.037 4.047 -0.010 18321 15004 1 12 . 1 1 23 23 GLU C C 23 178.986 178.986 178.895 0.091 18321 15005 1 12 . 1 1 23 23 GLU CA C 23 59.081 59.081 58.927 0.154 18321 15006 1 12 . 1 1 23 23 GLU CB C 23 31.896 31.896 29.210 2.686 18321 15007 1 12 . 1 1 23 23 GLU H H 23 8.106 8.106 7.939 0.167 18321 15008 1 12 . 1 1 24 24 ALA N N 24 121.964 121.964 122.130 -0.166 18321 15009 1 12 . 1 1 24 24 ALA HA H 24 3.762 3.762 3.931 -0.169 18321 15010 1 12 . 1 1 24 24 ALA C C 24 178.653 178.653 179.955 -1.302 18321 15011 1 12 . 1 1 24 24 ALA CA C 24 55.480 55.480 55.368 0.112 18321 15012 1 12 . 1 1 24 24 ALA CB C 24 18.049 18.049 18.268 -0.220 18321 15013 1 12 . 1 1 24 24 ALA H H 24 8.732 8.732 8.013 0.719 18321 15014 1 12 . 1 1 25 25 GLN N N 25 116.229 116.229 116.739 -0.510 18321 15015 1 12 . 1 1 25 25 GLN HA H 25 3.950 3.950 4.144 -0.194 18321 15016 1 12 . 1 1 25 25 GLN C C 25 177.442 177.442 178.243 -0.801 18321 15017 1 12 . 1 1 25 25 GLN CA C 25 59.651 59.651 58.263 1.388 18321 15018 1 12 . 1 1 25 25 GLN CB C 25 29.308 29.308 28.604 0.704 18321 15019 1 12 . 1 1 25 25 GLN H H 25 8.391 8.391 8.223 0.168 18321 15020 1 12 . 1 1 26 26 THR N N 26 115.105 115.105 112.405 2.700 18321 15021 1 12 . 1 1 26 26 THR HA H 26 3.920 3.920 4.231 -0.311 18321 15022 1 12 . 1 1 26 26 THR C C 26 176.835 176.835 176.833 0.002 18321 15023 1 12 . 1 1 26 26 THR CA C 26 66.335 66.335 64.462 1.873 18321 15024 1 12 . 1 1 26 26 THR CB C 26 68.876 68.876 69.188 -0.312 18321 15025 1 12 . 1 1 26 26 THR H H 26 8.223 8.223 7.972 0.251 18321 15026 1 12 . 1 1 27 27 ARG N N 27 119.096 119.096 120.919 -1.823 18321 15027 1 12 . 1 1 27 27 ARG HA H 27 4.047 4.047 4.245 -0.198 18321 15028 1 12 . 1 1 27 27 ARG C C 27 177.245 177.245 176.857 0.388 18321 15029 1 12 . 1 1 27 27 ARG CA C 27 58.528 58.528 58.266 0.263 18321 15030 1 12 . 1 1 27 27 ARG CB C 27 30.184 30.184 30.845 -0.661 18321 15031 1 12 . 1 1 27 27 ARG H H 27 8.093 8.093 7.854 0.239 18321 15032 1 12 . 1 1 28 28 LEU N N 28 114.602 114.602 118.882 -4.280 18321 15033 1 12 . 1 1 28 28 LEU HA H 28 4.325 4.325 4.590 -0.265 18321 15034 1 12 . 1 1 28 28 LEU C C 28 177.197 177.197 176.415 0.782 18321 15035 1 12 . 1 1 28 28 LEU CA C 28 55.143 55.143 53.522 1.621 18321 15036 1 12 . 1 1 28 28 LEU CB C 28 44.902 44.902 41.938 2.964 18321 15037 1 12 . 1 1 28 28 LEU H H 28 7.438 7.438 7.541 -0.103 18321 15038 1 12 . 1 1 29 29 GLN N N 29 121.312 121.312 121.368 -0.056 18321 15039 1 12 . 1 1 29 29 GLN HA H 29 3.856 3.856 4.262 -0.406 18321 15040 1 12 . 1 1 29 29 GLN C C 29 178.048 178.048 176.758 1.290 18321 15041 1 12 . 1 1 29 29 GLN CA C 29 57.691 57.691 55.410 2.281 18321 15042 1 12 . 1 1 29 29 GLN CB C 29 27.293 27.293 26.561 0.732 18321 15043 1 12 . 1 1 29 29 GLN H H 29 8.250 8.250 7.822 0.428 18321 15044 1 12 . 1 1 30 30 GLY N N 30 116.768 116.768 110.637 6.131 18321 15045 1 12 . 1 1 30 30 GLY C C 30 174.914 174.914 174.755 0.159 18321 15046 1 12 . 1 1 30 30 GLY CA C 30 45.491 45.491 46.325 -0.834 18321 15047 1 12 . 1 1 30 30 GLY H H 30 9.135 9.135 9.038 0.097 18321 15048 1 12 . 1 1 31 31 GLN N N 31 117.979 117.979 119.957 -1.978 18321 15049 1 12 . 1 1 31 31 GLN HA H 31 4.329 4.329 4.000 0.329 18321 15050 1 12 . 1 1 31 31 GLN C C 31 177.174 177.174 175.422 1.752 18321 15051 1 12 . 1 1 31 31 GLN CA C 31 53.910 53.910 58.206 -4.296 18321 15052 1 12 . 1 1 31 31 GLN CB C 31 29.574 29.574 29.281 0.293 18321 15053 1 12 . 1 1 31 31 GLN H H 31 7.695 7.695 8.031 -0.336 18321 15054 1 12 . 1 1 32 32 ARG N N 32 123.918 123.918 118.167 5.751 18321 15055 1 12 . 1 1 32 32 ARG HA H 32 3.940 3.940 4.410 -0.470 18321 15056 1 12 . 1 1 32 32 ARG C C 32 175.810 175.810 175.788 0.022 18321 15057 1 12 . 1 1 32 32 ARG CA C 32 56.770 56.770 54.873 1.897 18321 15058 1 12 . 1 1 32 32 ARG CB C 32 30.074 30.074 31.727 -1.653 18321 15059 1 12 . 1 1 32 32 ARG H H 32 8.955 8.955 7.858 1.097 18321 15060 1 12 . 1 1 33 33 HIS N N 33 122.248 122.248 125.542 -3.294 18321 15061 1 12 . 1 1 33 33 HIS HA H 33 4.627 4.627 4.969 -0.342 18321 15062 1 12 . 1 1 33 33 HIS C C 33 177.089 177.089 175.692 1.397 18321 15063 1 12 . 1 1 33 33 HIS CA C 33 55.858 55.858 56.314 -0.456 18321 15064 1 12 . 1 1 33 33 HIS CB C 33 28.648 28.648 29.738 -1.090 18321 15065 1 12 . 1 1 33 33 HIS H H 33 8.302 8.302 8.199 0.103 18321 15066 1 12 . 1 1 34 34 GLY N N 34 109.518 109.518 112.081 -2.563 18321 15067 1 12 . 1 1 34 34 GLY C C 34 176.730 176.730 173.924 2.806 18321 15068 1 12 . 1 1 34 34 GLY CA C 34 45.967 45.967 44.993 0.974 18321 15069 1 12 . 1 1 34 34 GLY H H 34 9.496 9.496 9.167 0.329 18321 15070 1 12 . 1 1 35 35 MET N N 35 125.193 125.193 123.861 1.332 18321 15071 1 12 . 1 1 35 35 MET HA H 35 5.750 5.750 4.899 0.851 18321 15072 1 12 . 1 1 35 35 MET C C 35 174.388 174.388 175.154 -0.766 18321 15073 1 12 . 1 1 35 35 MET CA C 35 55.762 55.762 57.556 -1.794 18321 15074 1 12 . 1 1 35 35 MET CB C 35 32.706 32.706 33.221 -0.515 18321 15075 1 12 . 1 1 35 35 MET H H 35 8.359 8.359 7.448 0.911 18321 15076 1 12 . 1 1 36 36 PHE N N 36 123.311 123.311 119.138 4.173 18321 15077 1 12 . 1 1 36 36 PHE HA H 36 5.985 5.985 5.712 0.273 18321 15078 1 12 . 1 1 36 36 PHE C C 36 172.140 172.140 172.849 -0.709 18321 15079 1 12 . 1 1 36 36 PHE CA C 36 55.755 55.755 55.355 0.400 18321 15080 1 12 . 1 1 36 36 PHE CB C 36 45.197 45.197 42.681 2.516 18321 15081 1 12 . 1 1 36 36 PHE H H 36 8.261 8.261 7.967 0.294 18321 15082 1 12 . 1 1 37 37 LEU N N 37 114.652 114.652 116.430 -1.778 18321 15083 1 12 . 1 1 37 37 LEU HA H 37 4.489 4.489 4.947 -0.458 18321 15084 1 12 . 1 1 37 37 LEU C C 37 174.033 174.033 174.807 -0.774 18321 15085 1 12 . 1 1 37 37 LEU CA C 37 55.382 55.382 54.420 0.962 18321 15086 1 12 . 1 1 37 37 LEU CB C 37 44.791 44.791 45.907 -1.115 18321 15087 1 12 . 1 1 37 37 LEU H H 37 9.292 9.292 9.020 0.272 18321 15088 1 12 . 1 1 38 38 VAL N N 38 121.009 121.009 121.803 -0.794 18321 15089 1 12 . 1 1 38 38 VAL HA H 38 5.504 5.504 4.640 0.864 18321 15090 1 12 . 1 1 38 38 VAL C C 38 173.581 173.581 174.799 -1.218 18321 15091 1 12 . 1 1 38 38 VAL CA C 38 61.316 61.316 61.571 -0.255 18321 15092 1 12 . 1 1 38 38 VAL CB C 38 33.302 33.302 33.687 -0.385 18321 15093 1 12 . 1 1 38 38 VAL H H 38 8.991 8.991 8.378 0.613 18321 15094 1 12 . 1 1 39 39 ARG N N 39 124.863 124.863 127.334 -2.471 18321 15095 1 12 . 1 1 39 39 ARG HA H 39 5.444 5.444 4.461 0.983 18321 15096 1 12 . 1 1 39 39 ARG C C 39 175.772 175.772 174.396 1.376 18321 15097 1 12 . 1 1 39 39 ARG CA C 39 52.558 52.558 52.975 -0.417 18321 15098 1 12 . 1 1 39 39 ARG CB C 39 34.980 34.980 33.213 1.767 18321 15099 1 12 . 1 1 39 39 ARG H H 39 9.569 9.569 8.045 1.524 18321 15100 1 12 . 1 1 40 40 ASP N N 40 122.330 122.330 122.273 0.057 18321 15101 1 12 . 1 1 40 40 ASP HA H 40 4.785 4.785 4.942 -0.157 18321 15102 1 12 . 1 1 40 40 ASP C C 40 176.332 176.332 176.119 0.213 18321 15103 1 12 . 1 1 40 40 ASP CA C 40 55.334 55.334 56.421 -1.087 18321 15104 1 12 . 1 1 40 40 ASP CB C 40 40.650 40.650 40.521 0.129 18321 15105 1 12 . 1 1 40 40 ASP H H 40 8.413 8.413 8.084 0.329 18321 15106 1 12 . 1 1 41 41 SER N N 41 114.363 114.363 118.412 -4.049 18321 15107 1 12 . 1 1 41 41 SER HA H 41 4.506 4.506 4.436 0.070 18321 15108 1 12 . 1 1 41 41 SER CA C 41 57.525 57.525 58.098 -0.573 18321 15109 1 12 . 1 1 41 41 SER CB C 41 63.706 63.706 64.212 -0.506 18321 15110 1 12 . 1 1 41 41 SER H H 41 7.791 7.791 8.345 -0.554 18321 15111 1 12 . 1 1 42 42 SER N N 42 126.932 126.932 119.502 7.430 18321 15112 1 12 . 1 1 42 42 SER HA H 42 4.410 4.410 4.600 -0.190 18321 15113 1 12 . 1 1 42 42 SER CA C 42 60.362 60.362 59.772 0.590 18321 15114 1 12 . 1 1 42 42 SER CB C 42 63.707 63.707 63.366 0.341 18321 15115 1 12 . 1 1 42 42 SER H H 42 10.519 10.519 8.737 1.782 18321 15116 1 12 . 1 1 43 43 THR HA H 43 4.097 4.097 4.282 -0.185 18321 15117 1 12 . 1 1 43 43 THR CA C 43 64.722 64.722 62.863 1.859 18321 15118 1 12 . 1 1 43 43 THR CB C 43 69.439 69.439 69.719 -0.280 18321 15119 1 12 . 1 1 44 44 CYS HA H 44 5.100 5.100 4.905 0.195 18321 15120 1 12 . 1 1 44 44 CYS CA C 44 51.779 51.779 56.214 -4.434 18321 15121 1 12 . 1 1 44 44 CYS CB C 44 41.314 41.314 30.351 10.963 18321 15122 1 12 . 1 1 45 45 PRO HA H 45 4.278 4.278 4.446 -0.168 18321 15123 1 12 . 1 1 45 45 PRO C C 45 178.127 178.127 177.357 0.770 18321 15124 1 12 . 1 1 45 45 PRO CA C 45 64.151 64.151 64.741 -0.590 18321 15125 1 12 . 1 1 45 45 PRO CB C 45 31.596 31.596 31.982 -0.386 18321 15126 1 12 . 1 1 46 46 GLY N N 46 114.947 114.947 104.569 10.378 18321 15127 1 12 . 1 1 46 46 GLY C C 46 174.701 174.701 173.492 1.209 18321 15128 1 12 . 1 1 46 46 GLY CA C 46 45.225 45.225 44.716 0.509 18321 15129 1 12 . 1 1 46 46 GLY H H 46 8.812 8.812 8.316 0.496 18321 15130 1 12 . 1 1 47 47 ASP N N 47 120.862 120.862 119.707 1.155 18321 15131 1 12 . 1 1 47 47 ASP HA H 47 5.235 5.235 5.214 0.021 18321 15132 1 12 . 1 1 47 47 ASP C C 47 176.480 176.480 174.657 1.823 18321 15133 1 12 . 1 1 47 47 ASP CA C 47 53.591 53.591 53.544 0.047 18321 15134 1 12 . 1 1 47 47 ASP CB C 47 41.707 41.707 44.185 -2.478 18321 15135 1 12 . 1 1 47 47 ASP H H 47 7.997 7.997 7.459 0.538 18321 15136 1 12 . 1 1 48 48 TYR N N 48 118.473 118.473 117.641 0.832 18321 15137 1 12 . 1 1 48 48 TYR HA H 48 5.431 5.431 5.286 0.145 18321 15138 1 12 . 1 1 48 48 TYR C C 48 173.783 173.783 175.537 -1.754 18321 15139 1 12 . 1 1 48 48 TYR CA C 48 56.891 56.891 56.156 0.735 18321 15140 1 12 . 1 1 48 48 TYR CB C 48 43.274 43.274 42.666 0.607 18321 15141 1 12 . 1 1 48 48 TYR H H 48 8.892 8.892 9.209 -0.317 18321 15142 1 12 . 1 1 49 49 VAL N N 49 119.105 119.105 119.950 -0.845 18321 15143 1 12 . 1 1 49 49 VAL HA H 49 4.800 4.800 4.520 0.280 18321 15144 1 12 . 1 1 49 49 VAL C C 49 174.397 174.397 174.823 -0.426 18321 15145 1 12 . 1 1 49 49 VAL CA C 49 61.439 61.439 62.037 -0.598 18321 15146 1 12 . 1 1 49 49 VAL CB C 49 35.388 35.388 33.327 2.061 18321 15147 1 12 . 1 1 49 49 VAL H H 49 9.661 9.661 8.697 0.964 18321 15148 1 12 . 1 1 50 50 LEU N N 50 129.599 129.599 130.898 -1.299 18321 15149 1 12 . 1 1 50 50 LEU HA H 50 5.033 5.033 4.969 0.064 18321 15150 1 12 . 1 1 50 50 LEU C C 50 175.001 175.001 175.665 -0.664 18321 15151 1 12 . 1 1 50 50 LEU CA C 50 53.352 53.352 54.343 -0.991 18321 15152 1 12 . 1 1 50 50 LEU CB C 50 44.062 44.062 41.922 2.140 18321 15153 1 12 . 1 1 50 50 LEU H H 50 9.405 9.405 8.767 0.638 18321 15154 1 12 . 1 1 51 51 SER N N 51 126.895 126.895 124.310 2.585 18321 15155 1 12 . 1 1 51 51 SER HA H 51 5.731 5.731 5.046 0.685 18321 15156 1 12 . 1 1 51 51 SER C C 51 173.094 173.094 173.794 -0.700 18321 15157 1 12 . 1 1 51 51 SER CA C 51 58.834 58.834 57.473 1.361 18321 15158 1 12 . 1 1 51 51 SER CB C 51 64.977 64.977 63.789 1.188 18321 15159 1 12 . 1 1 51 51 SER H H 51 9.094 9.094 8.959 0.135 18321 15160 1 12 . 1 1 52 52 VAL N N 52 121.777 121.777 125.530 -3.753 18321 15161 1 12 . 1 1 52 52 VAL HA H 52 5.066 5.066 4.621 0.445 18321 15162 1 12 . 1 1 52 52 VAL C C 52 174.573 174.573 174.492 0.081 18321 15163 1 12 . 1 1 52 52 VAL CA C 52 59.535 59.535 60.592 -1.057 18321 15164 1 12 . 1 1 52 52 VAL CB C 52 36.834 36.834 35.735 1.099 18321 15165 1 12 . 1 1 52 52 VAL H H 52 8.816 8.816 8.620 0.196 18321 15166 1 12 . 1 1 53 53 SER N N 53 120.489 120.489 120.482 0.007 18321 15167 1 12 . 1 1 53 53 SER HA H 53 4.811 4.811 5.135 -0.324 18321 15168 1 12 . 1 1 53 53 SER C C 53 174.065 174.065 173.210 0.855 18321 15169 1 12 . 1 1 53 53 SER CA C 53 57.496 57.496 57.260 0.236 18321 15170 1 12 . 1 1 53 53 SER CB C 53 62.623 62.623 63.077 -0.454 18321 15171 1 12 . 1 1 53 53 SER H H 53 8.780 8.780 9.097 -0.317 18321 15172 1 12 . 1 1 54 54 GLU N N 54 132.020 132.020 126.822 5.198 18321 15173 1 12 . 1 1 54 54 GLU HA H 54 4.250 4.250 4.568 -0.318 18321 15174 1 12 . 1 1 54 54 GLU C C 54 175.387 175.387 175.577 -0.190 18321 15175 1 12 . 1 1 54 54 GLU CA C 54 56.999 56.999 54.619 2.380 18321 15176 1 12 . 1 1 54 54 GLU CB C 54 32.556 32.556 33.074 -0.518 18321 15177 1 12 . 1 1 54 54 GLU H H 54 8.472 8.472 8.274 0.198 18321 15178 1 12 . 1 1 55 55 ASN N N 55 126.517 126.517 119.741 6.776 18321 15179 1 12 . 1 1 55 55 ASN HA H 55 4.220 4.220 4.002 0.218 18321 15180 1 12 . 1 1 55 55 ASN C C 55 174.546 174.546 174.272 0.274 18321 15181 1 12 . 1 1 55 55 ASN CA C 55 54.770 54.770 56.060 -1.290 18321 15182 1 12 . 1 1 55 55 ASN CB C 55 37.314 37.314 37.907 -0.593 18321 15183 1 12 . 1 1 55 55 ASN H H 55 8.853 8.853 8.277 0.576 18321 15184 1 12 . 1 1 56 56 SER N N 56 112.009 112.009 109.303 2.706 18321 15185 1 12 . 1 1 56 56 SER HA H 56 4.334 4.334 4.666 -0.332 18321 15186 1 12 . 1 1 56 56 SER C C 56 173.354 173.354 173.460 -0.106 18321 15187 1 12 . 1 1 56 56 SER CA C 56 59.966 59.966 59.038 0.928 18321 15188 1 12 . 1 1 56 56 SER CB C 56 62.242 62.242 65.015 -2.773 18321 15189 1 12 . 1 1 56 56 SER H H 56 10.418 10.418 8.611 1.807 18321 15190 1 12 . 1 1 57 57 ARG N N 57 121.764 121.764 121.439 0.325 18321 15191 1 12 . 1 1 57 57 ARG HA H 57 5.167 5.167 4.777 0.390 18321 15192 1 12 . 1 1 57 57 ARG C C 57 174.983 174.983 173.980 1.003 18321 15193 1 12 . 1 1 57 57 ARG CA C 57 54.550 54.550 54.597 -0.047 18321 15194 1 12 . 1 1 57 57 ARG CB C 57 31.886 31.886 31.656 0.230 18321 15195 1 12 . 1 1 57 57 ARG H H 57 8.097 8.097 8.061 0.036 18321 15196 1 12 . 1 1 58 58 VAL N N 58 121.866 121.866 120.397 1.469 18321 15197 1 12 . 1 1 58 58 VAL HA H 58 4.768 4.768 4.967 -0.199 18321 15198 1 12 . 1 1 58 58 VAL C C 58 175.388 175.388 175.423 -0.035 18321 15199 1 12 . 1 1 58 58 VAL CA C 58 61.818 61.818 60.649 1.169 18321 15200 1 12 . 1 1 58 58 VAL CB C 58 34.135 34.135 32.426 1.709 18321 15201 1 12 . 1 1 58 58 VAL H H 58 8.081 8.081 8.295 -0.214 18321 15202 1 12 . 1 1 59 59 SER N N 59 124.445 124.445 123.621 0.824 18321 15203 1 12 . 1 1 59 59 SER HA H 59 4.462 4.462 4.267 0.195 18321 15204 1 12 . 1 1 59 59 SER C C 59 172.185 172.185 172.856 -0.671 18321 15205 1 12 . 1 1 59 59 SER CA C 59 56.629 56.629 57.833 -1.204 18321 15206 1 12 . 1 1 59 59 SER CB C 59 66.218 66.218 63.468 2.750 18321 15207 1 12 . 1 1 59 59 SER H H 59 9.082 9.082 8.335 0.747 18321 15208 1 12 . 1 1 60 60 HIS N N 60 121.224 121.224 126.455 -5.231 18321 15209 1 12 . 1 1 60 60 HIS HA H 60 4.885 4.885 4.629 0.256 18321 15210 1 12 . 1 1 60 60 HIS C C 60 174.674 174.674 174.353 0.321 18321 15211 1 12 . 1 1 60 60 HIS CA C 60 54.900 54.900 55.504 -0.604 18321 15212 1 12 . 1 1 60 60 HIS CB C 60 32.331 32.331 29.225 3.106 18321 15213 1 12 . 1 1 60 60 HIS H H 60 8.331 8.331 8.776 -0.445 18321 15214 1 12 . 1 1 61 61 TYR N N 61 124.780 124.780 125.772 -0.992 18321 15215 1 12 . 1 1 61 61 TYR HA H 61 4.655 4.655 4.737 -0.082 18321 15216 1 12 . 1 1 61 61 TYR CA C 61 57.409 57.409 56.995 0.414 18321 15217 1 12 . 1 1 61 61 TYR CB C 61 39.785 39.785 37.254 2.531 18321 15218 1 12 . 1 1 61 61 TYR H H 61 9.273 9.273 9.087 0.186 18321 15219 1 12 . 1 1 62 62 ILE HA H 62 4.298 4.298 4.412 -0.114 18321 15220 1 12 . 1 1 62 62 ILE C C 62 174.817 174.817 175.537 -0.720 18321 15221 1 12 . 1 1 62 62 ILE CA C 62 61.908 61.908 61.599 0.309 18321 15222 1 12 . 1 1 62 62 ILE CB C 62 38.321 38.321 38.906 -0.585 18321 15223 1 12 . 1 1 63 63 ILE N N 63 128.552 128.552 128.301 0.251 18321 15224 1 12 . 1 1 63 63 ILE HA H 63 4.788 4.788 4.639 0.149 18321 15225 1 12 . 1 1 63 63 ILE C C 63 175.982 175.982 174.790 1.192 18321 15226 1 12 . 1 1 63 63 ILE CA C 63 59.629 59.629 59.981 -0.352 18321 15227 1 12 . 1 1 63 63 ILE CB C 63 39.747 39.747 38.614 1.133 18321 15228 1 12 . 1 1 63 63 ILE H H 63 9.155 9.155 8.829 0.326 18321 15229 1 12 . 1 1 64 64 ASN N N 64 123.240 123.240 127.206 -3.966 18321 15230 1 12 . 1 1 64 64 ASN HA H 64 4.857 4.857 5.645 -0.788 18321 15231 1 12 . 1 1 64 64 ASN C C 64 175.324 175.324 174.806 0.518 18321 15232 1 12 . 1 1 64 64 ASN CA C 64 53.736 53.736 52.230 1.506 18321 15233 1 12 . 1 1 64 64 ASN CB C 64 41.531 41.531 41.272 0.259 18321 15234 1 12 . 1 1 64 64 ASN H H 64 9.379 9.379 8.894 0.485 18321 15235 1 12 . 1 1 65 65 SER N N 65 121.157 121.157 119.894 1.263 18321 15236 1 12 . 1 1 65 65 SER HA H 65 4.548 4.548 4.700 -0.152 18321 15237 1 12 . 1 1 65 65 SER C C 65 174.328 174.328 174.606 -0.278 18321 15238 1 12 . 1 1 65 65 SER CA C 65 58.306 58.306 58.527 -0.221 18321 15239 1 12 . 1 1 65 65 SER CB C 65 62.878 62.878 63.210 -0.332 18321 15240 1 12 . 1 1 65 65 SER H H 65 9.195 9.195 8.447 0.748 18321 15241 1 12 . 1 1 66 66 LEU N N 66 127.417 127.417 129.268 -1.851 18321 15242 1 12 . 1 1 66 66 LEU HA H 66 4.605 4.605 4.590 0.015 18321 15243 1 12 . 1 1 66 66 LEU CA C 66 52.888 52.888 52.913 -0.025 18321 15244 1 12 . 1 1 66 66 LEU CB C 66 41.799 41.799 41.513 0.286 18321 15245 1 12 . 1 1 66 66 LEU H H 66 8.143 8.143 8.701 -0.558 18321 15246 1 12 . 1 1 68 68 ASN HA H 68 4.386 4.386 4.628 -0.242 18321 15247 1 12 . 1 1 68 68 ASN C C 68 174.487 174.487 174.809 -0.322 18321 15248 1 12 . 1 1 68 68 ASN CA C 68 53.365 53.365 52.650 0.715 18321 15249 1 12 . 1 1 68 68 ASN CB C 68 36.778 36.778 37.403 -0.625 18321 15250 1 12 . 1 1 69 69 ARG N N 69 111.329 111.329 113.918 -2.589 18321 15251 1 12 . 1 1 69 69 ARG HA H 69 3.876 3.876 3.771 0.105 18321 15252 1 12 . 1 1 69 69 ARG CA C 69 57.393 57.393 57.287 0.106 18321 15253 1 12 . 1 1 69 69 ARG CB C 69 26.665 26.665 26.897 -0.232 18321 15254 1 12 . 1 1 69 69 ARG H H 69 8.191 8.191 8.191 -0.000 18321 15255 1 12 . 1 1 70 70 ARG N N 70 116.120 116.120 116.141 -0.021 18321 15256 1 12 . 1 1 70 70 ARG HA H 70 4.556 4.556 4.960 -0.404 18321 15257 1 12 . 1 1 70 70 ARG C C 70 174.882 174.882 174.548 0.334 18321 15258 1 12 . 1 1 70 70 ARG CA C 70 55.509 55.509 53.486 2.023 18321 15259 1 12 . 1 1 70 70 ARG CB C 70 31.771 31.771 33.715 -1.944 18321 15260 1 12 . 1 1 70 70 ARG H H 70 6.667 6.667 7.467 -0.800 18321 15261 1 12 . 1 1 71 71 PHE N N 71 116.313 116.313 118.627 -2.314 18321 15262 1 12 . 1 1 71 71 PHE HA H 71 5.540 5.540 5.336 0.204 18321 15263 1 12 . 1 1 71 71 PHE C C 71 174.391 174.391 175.184 -0.793 18321 15264 1 12 . 1 1 71 71 PHE CA C 71 57.528 57.528 56.536 0.992 18321 15265 1 12 . 1 1 71 71 PHE CB C 71 44.115 44.115 41.507 2.608 18321 15266 1 12 . 1 1 71 71 PHE H H 71 8.700 8.700 8.124 0.576 18321 15267 1 12 . 1 1 72 72 LYS N N 72 122.770 122.770 126.414 -3.644 18321 15268 1 12 . 1 1 72 72 LYS HA H 72 5.483 5.483 5.032 0.451 18321 15269 1 12 . 1 1 72 72 LYS C C 72 173.923 173.923 175.315 -1.392 18321 15270 1 12 . 1 1 72 72 LYS CA C 72 54.855 54.855 54.994 -0.139 18321 15271 1 12 . 1 1 72 72 LYS CB C 72 37.710 37.710 35.217 2.493 18321 15272 1 12 . 1 1 72 72 LYS H H 72 9.138 9.138 9.298 -0.160 18321 15273 1 12 . 1 1 73 73 ILE N N 73 124.576 124.576 129.396 -4.820 18321 15274 1 12 . 1 1 73 73 ILE HA H 73 4.955 4.955 4.830 0.125 18321 15275 1 12 . 1 1 73 73 ILE C C 73 175.728 175.728 176.201 -0.473 18321 15276 1 12 . 1 1 73 73 ILE CA C 73 58.935 58.935 60.207 -1.272 18321 15277 1 12 . 1 1 73 73 ILE CB C 73 40.965 40.965 39.156 1.809 18321 15278 1 12 . 1 1 73 73 ILE H H 73 8.826 8.826 8.687 0.139 18321 15279 1 12 . 1 1 74 74 GLY N N 74 118.718 118.718 119.281 -0.563 18321 15280 1 12 . 1 1 74 74 GLY C C 74 174.436 174.436 174.111 0.325 18321 15281 1 12 . 1 1 74 74 GLY CA C 74 47.401 47.401 45.950 1.451 18321 15282 1 12 . 1 1 74 74 GLY H H 74 9.317 9.317 9.326 -0.009 18321 15283 1 12 . 1 1 75 75 ASP N N 75 125.691 125.691 115.682 10.009 18321 15284 1 12 . 1 1 75 75 ASP HA H 75 4.713 4.713 4.294 0.419 18321 15285 1 12 . 1 1 75 75 ASP C C 75 175.841 175.841 175.505 0.336 18321 15286 1 12 . 1 1 75 75 ASP CA C 75 53.815 53.815 56.014 -2.199 18321 15287 1 12 . 1 1 75 75 ASP CB C 75 41.288 41.288 40.911 0.377 18321 15288 1 12 . 1 1 75 75 ASP H H 75 8.665 8.665 8.803 -0.138 18321 15289 1 12 . 1 1 76 76 GLN N N 76 120.368 120.368 120.803 -0.435 18321 15290 1 12 . 1 1 76 76 GLN C C 76 173.630 173.630 174.532 -0.902 18321 15291 1 12 . 1 1 76 76 GLN CA C 76 54.254 54.254 54.778 -0.523 18321 15292 1 12 . 1 1 76 76 GLN CB C 76 31.248 31.248 29.247 2.001 18321 15293 1 12 . 1 1 76 76 GLN H H 76 8.289 8.289 7.530 0.759 18321 15294 1 12 . 1 1 77 77 GLU N N 77 120.435 120.435 123.605 -3.170 18321 15295 1 12 . 1 1 77 77 GLU C C 77 175.484 175.484 175.201 0.283 18321 15296 1 12 . 1 1 77 77 GLU CA C 77 54.203 54.203 55.492 -1.290 18321 15297 1 12 . 1 1 77 77 GLU CB C 77 33.141 33.141 30.189 2.952 18321 15298 1 12 . 1 1 77 77 GLU H H 77 7.732 7.732 8.142 -0.410 18321 15299 1 12 . 1 1 78 78 PHE N N 78 117.911 117.911 124.324 -6.413 18321 15300 1 12 . 1 1 78 78 PHE HA H 78 4.659 4.659 4.672 -0.013 18321 15301 1 12 . 1 1 78 78 PHE C C 78 175.673 175.673 176.072 -0.399 18321 15302 1 12 . 1 1 78 78 PHE CA C 78 57.160 57.160 56.465 0.695 18321 15303 1 12 . 1 1 78 78 PHE CB C 78 45.405 45.405 41.535 3.869 18321 15304 1 12 . 1 1 78 78 PHE H H 78 9.235 9.235 8.086 1.149 18321 15305 1 12 . 1 1 79 79 ASP N N 79 119.296 119.296 119.259 0.037 18321 15306 1 12 . 1 1 79 79 ASP HA H 79 4.462 4.462 4.550 -0.088 18321 15307 1 12 . 1 1 79 79 ASP C C 79 174.482 174.482 175.625 -1.143 18321 15308 1 12 . 1 1 79 79 ASP CA C 79 56.629 56.629 57.414 -0.785 18321 15309 1 12 . 1 1 79 79 ASP CB C 79 41.697 41.697 41.108 0.590 18321 15310 1 12 . 1 1 79 79 ASP H H 79 9.187 9.187 8.633 0.553 18321 15311 1 12 . 1 1 80 80 HIS N N 80 107.631 107.631 111.925 -4.294 18321 15312 1 12 . 1 1 80 80 HIS HA H 80 5.022 5.022 5.188 -0.166 18321 15313 1 12 . 1 1 80 80 HIS C C 80 174.626 174.626 176.094 -1.468 18321 15314 1 12 . 1 1 80 80 HIS CA C 80 54.223 54.223 54.569 -0.346 18321 15315 1 12 . 1 1 80 80 HIS CB C 80 32.205 32.205 31.848 0.357 18321 15316 1 12 . 1 1 80 80 HIS H H 80 7.200 7.200 7.347 -0.147 18321 15317 1 12 . 1 1 81 81 LEU N N 81 120.710 120.710 121.444 -0.734 18321 15318 1 12 . 1 1 81 81 LEU HA H 81 3.804 3.804 4.234 -0.430 18321 15319 1 12 . 1 1 81 81 LEU CA C 81 58.709 58.709 59.609 -0.900 18321 15320 1 12 . 1 1 81 81 LEU CB C 81 39.646 39.646 40.214 -0.568 18321 15321 1 12 . 1 1 81 81 LEU H H 81 8.886 8.886 9.222 -0.336 18321 15322 1 12 . 1 1 82 82 PRO HA H 82 4.020 4.020 4.526 -0.506 18321 15323 1 12 . 1 1 82 82 PRO C C 82 175.619 175.619 177.589 -1.970 18321 15324 1 12 . 1 1 82 82 PRO CA C 82 67.025 67.025 65.061 1.964 18321 15325 1 12 . 1 1 82 82 PRO CB C 82 30.962 30.962 30.993 -0.031 18321 15326 1 12 . 1 1 83 83 ALA N N 83 124.281 124.281 120.014 4.267 18321 15327 1 12 . 1 1 83 83 ALA HA H 83 4.019 4.019 4.222 -0.203 18321 15328 1 12 . 1 1 83 83 ALA C C 83 179.709 179.709 178.241 1.468 18321 15329 1 12 . 1 1 83 83 ALA CA C 83 54.985 54.985 53.952 1.033 18321 15330 1 12 . 1 1 83 83 ALA CB C 83 18.425 18.425 18.558 -0.133 18321 15331 1 12 . 1 1 83 83 ALA H H 83 8.527 8.527 7.682 0.845 18321 15332 1 12 . 1 1 84 84 LEU N N 84 122.960 122.960 115.592 7.368 18321 15333 1 12 . 1 1 84 84 LEU HA H 84 1.917 1.917 3.250 -1.333 18321 15334 1 12 . 1 1 84 84 LEU C C 84 177.652 177.652 177.875 -0.223 18321 15335 1 12 . 1 1 84 84 LEU CA C 84 58.261 58.261 56.605 1.656 18321 15336 1 12 . 1 1 84 84 LEU CB C 84 42.544 42.544 41.385 1.159 18321 15337 1 12 . 1 1 84 84 LEU H H 84 6.982 6.982 7.243 -0.261 18321 15338 1 12 . 1 1 85 85 LEU N N 85 117.940 117.940 119.445 -1.505 18321 15339 1 12 . 1 1 85 85 LEU HA H 85 3.463 3.463 3.863 -0.400 18321 15340 1 12 . 1 1 85 85 LEU C C 85 178.809 178.809 178.777 0.032 18321 15341 1 12 . 1 1 85 85 LEU CA C 85 57.522 57.522 57.712 -0.190 18321 15342 1 12 . 1 1 85 85 LEU CB C 85 41.242 41.242 41.288 -0.046 18321 15343 1 12 . 1 1 85 85 LEU H H 85 7.773 7.773 7.678 0.095 18321 15344 1 12 . 1 1 86 86 GLU N N 86 115.762 115.762 118.602 -2.840 18321 15345 1 12 . 1 1 86 86 GLU HA H 86 3.540 3.540 3.964 -0.424 18321 15346 1 12 . 1 1 86 86 GLU C C 86 180.228 180.228 178.260 1.968 18321 15347 1 12 . 1 1 86 86 GLU CA C 86 58.943 58.943 58.422 0.521 18321 15348 1 12 . 1 1 86 86 GLU CB C 86 29.561 29.561 29.417 0.144 18321 15349 1 12 . 1 1 86 86 GLU H H 86 8.300 8.300 7.475 0.825 18321 15350 1 12 . 1 1 87 87 PHE N N 87 121.135 121.135 119.318 1.817 18321 15351 1 12 . 1 1 87 87 PHE HA H 87 4.122 4.122 4.266 -0.144 18321 15352 1 12 . 1 1 87 87 PHE C C 87 179.497 179.497 176.693 2.804 18321 15353 1 12 . 1 1 87 87 PHE CA C 87 62.090 62.090 60.053 2.037 18321 15354 1 12 . 1 1 87 87 PHE CB C 87 40.103 40.103 39.357 0.746 18321 15355 1 12 . 1 1 87 87 PHE H H 87 7.717 7.717 7.261 0.456 18321 15356 1 12 . 1 1 88 88 TYR N N 88 116.579 116.579 118.538 -1.959 18321 15357 1 12 . 1 1 88 88 TYR HA H 88 4.933 4.933 4.148 0.785 18321 15358 1 12 . 1 1 88 88 TYR C C 88 174.799 174.799 176.976 -2.177 18321 15359 1 12 . 1 1 88 88 TYR CA C 88 61.333 61.333 59.195 2.138 18321 15360 1 12 . 1 1 88 88 TYR CB C 88 36.539 36.539 36.893 -0.354 18321 15361 1 12 . 1 1 88 88 TYR H H 88 7.478 7.478 8.084 -0.606 18321 15362 1 12 . 1 1 89 89 LYS N N 89 117.737 117.737 120.662 -2.925 18321 15363 1 12 . 1 1 89 89 LYS HA H 89 4.466 4.466 3.917 0.549 18321 15364 1 12 . 1 1 89 89 LYS C C 89 178.417 178.417 177.511 0.906 18321 15365 1 12 . 1 1 89 89 LYS CA C 89 59.486 59.486 58.679 0.807 18321 15366 1 12 . 1 1 89 89 LYS CB C 89 34.523 34.523 31.903 2.620 18321 15367 1 12 . 1 1 89 89 LYS H H 89 7.505 7.505 7.407 0.098 18321 15368 1 12 . 1 1 90 90 ILE N N 90 110.972 110.972 112.436 -1.464 18321 15369 1 12 . 1 1 90 90 ILE HA H 90 4.181 4.181 3.939 0.242 18321 15370 1 12 . 1 1 90 90 ILE C C 90 174.571 174.571 176.623 -2.052 18321 15371 1 12 . 1 1 90 90 ILE CA C 90 60.516 60.516 62.833 -2.317 18321 15372 1 12 . 1 1 90 90 ILE CB C 90 39.979 39.979 38.009 1.970 18321 15373 1 12 . 1 1 90 90 ILE H H 90 6.710 6.710 7.319 -0.609 18321 15374 1 12 . 1 1 91 91 HIS N N 91 119.479 119.479 116.349 3.130 18321 15375 1 12 . 1 1 91 91 HIS HA H 91 4.357 4.357 4.424 -0.067 18321 15376 1 12 . 1 1 91 91 HIS C C 91 172.751 172.751 175.756 -3.005 18321 15377 1 12 . 1 1 91 91 HIS CA C 91 55.066 55.066 57.375 -2.309 18321 15378 1 12 . 1 1 91 91 HIS CB C 91 29.756 29.756 31.657 -1.901 18321 15379 1 12 . 1 1 91 91 HIS H H 91 7.460 7.460 7.316 0.144 18321 15380 1 12 . 1 1 92 92 TYR N N 92 117.642 117.642 112.547 5.095 18321 15381 1 12 . 1 1 92 92 TYR HA H 92 4.131 4.131 4.252 -0.121 18321 15382 1 12 . 1 1 92 92 TYR C C 92 177.348 177.348 176.928 0.420 18321 15383 1 12 . 1 1 92 92 TYR CA C 92 58.627 58.627 59.945 -1.318 18321 15384 1 12 . 1 1 92 92 TYR CB C 92 39.481 39.481 36.093 3.388 18321 15385 1 12 . 1 1 92 92 TYR H H 92 8.067 8.067 7.854 0.213 18321 15386 1 12 . 1 1 93 93 LEU N N 93 123.560 123.560 115.697 7.863 18321 15387 1 12 . 1 1 93 93 LEU HA H 93 4.104 4.104 3.833 0.271 18321 15388 1 12 . 1 1 93 93 LEU C C 93 175.610 175.610 176.657 -1.047 18321 15389 1 12 . 1 1 93 93 LEU CA C 93 56.381 56.381 57.169 -0.788 18321 15390 1 12 . 1 1 93 93 LEU CB C 93 38.896 38.896 40.348 -1.452 18321 15391 1 12 . 1 1 93 93 LEU H H 93 7.907 7.907 8.822 -0.915 18321 15392 1 12 . 1 1 94 94 ASP N N 94 118.194 118.194 111.818 6.376 18321 15393 1 12 . 1 1 94 94 ASP HA H 94 4.940 4.940 4.782 0.158 18321 15394 1 12 . 1 1 94 94 ASP C C 94 176.123 176.123 175.968 0.155 18321 15395 1 12 . 1 1 94 94 ASP CA C 94 56.235 56.235 55.217 1.018 18321 15396 1 12 . 1 1 94 94 ASP CB C 94 42.078 42.078 43.258 -1.180 18321 15397 1 12 . 1 1 94 94 ASP H H 94 8.640 8.640 8.434 0.206 18321 15398 1 12 . 1 1 95 95 THR N N 95 105.073 105.073 112.127 -7.054 18321 15399 1 12 . 1 1 95 95 THR HA H 95 4.318 4.318 4.389 -0.071 18321 15400 1 12 . 1 1 95 95 THR C C 95 174.685 174.685 173.737 0.948 18321 15401 1 12 . 1 1 95 95 THR CA C 95 60.756 60.756 63.417 -2.661 18321 15402 1 12 . 1 1 95 95 THR CB C 95 71.058 71.058 69.612 1.446 18321 15403 1 12 . 1 1 95 95 THR H H 95 8.576 8.576 7.688 0.888 18321 15404 1 12 . 1 1 96 96 THR N N 96 116.817 116.817 116.735 0.082 18321 15405 1 12 . 1 1 96 96 THR HA H 96 5.129 5.129 4.768 0.361 18321 15406 1 12 . 1 1 96 96 THR C C 96 172.464 172.464 173.969 -1.505 18321 15407 1 12 . 1 1 96 96 THR CA C 96 60.762 60.762 63.054 -2.292 18321 15408 1 12 . 1 1 96 96 THR CB C 96 71.425 71.425 69.995 1.430 18321 15409 1 12 . 1 1 96 96 THR H H 96 8.205 8.205 8.197 0.008 18321 15410 1 12 . 1 1 97 97 THR N N 97 114.324 114.324 112.872 1.452 18321 15411 1 12 . 1 1 97 97 THR HA H 97 5.128 5.128 3.754 1.374 18321 15412 1 12 . 1 1 97 97 THR C C 97 175.480 175.480 173.834 1.646 18321 15413 1 12 . 1 1 97 97 THR CA C 97 60.233 60.233 62.569 -2.336 18321 15414 1 12 . 1 1 97 97 THR CB C 97 70.415 70.415 68.543 1.872 18321 15415 1 12 . 1 1 97 97 THR H H 97 7.128 7.128 7.772 -0.644 18321 15416 1 12 . 1 1 98 98 LEU N N 98 116.674 116.674 121.894 -5.220 18321 15417 1 12 . 1 1 98 98 LEU HA H 98 4.075 4.075 4.008 0.067 18321 15418 1 12 . 1 1 98 98 LEU C C 98 177.892 177.892 176.775 1.117 18321 15419 1 12 . 1 1 98 98 LEU CA C 98 59.597 59.597 55.411 4.186 18321 15420 1 12 . 1 1 98 98 LEU CB C 98 41.172 41.172 41.023 0.149 18321 15421 1 12 . 1 1 98 98 LEU H H 98 8.743 8.743 8.477 0.266 18321 15422 1 12 . 1 1 99 99 ILE N N 99 122.988 122.988 122.821 0.167 18321 15423 1 12 . 1 1 99 99 ILE HA H 99 4.415 4.415 4.198 0.217 18321 15424 1 12 . 1 1 99 99 ILE C C 99 175.055 175.055 175.785 -0.730 18321 15425 1 12 . 1 1 99 99 ILE CA C 99 62.183 62.183 61.477 0.705 18321 15426 1 12 . 1 1 99 99 ILE CB C 99 40.252 40.252 38.812 1.440 18321 15427 1 12 . 1 1 99 99 ILE H H 99 8.998 8.998 8.301 0.697 18321 15428 1 12 . 1 1 100 100 GLU N N 100 114.067 114.067 116.897 -2.830 18321 15429 1 12 . 1 1 100 100 GLU CA C 100 52.910 52.910 52.886 0.024 18321 15430 1 12 . 1 1 100 100 GLU CB C 100 31.155 31.155 30.346 0.809 18321 15431 1 12 . 1 1 100 100 GLU H H 100 7.332 7.332 7.626 -0.294 18321 15432 1 12 . 1 1 101 101 PRO HA H 101 4.952 4.952 3.956 0.996 18321 15433 1 12 . 1 1 101 101 PRO C C 101 175.976 175.976 175.990 -0.014 18321 15434 1 12 . 1 1 101 101 PRO CA C 101 53.312 53.312 62.009 -8.697 18321 15435 1 12 . 1 1 101 101 PRO CB C 101 31.598 31.598 31.925 -0.327 18321 15436 1 12 . 1 1 102 102 ALA N N 102 125.968 125.968 125.282 0.686 18321 15437 1 12 . 1 1 102 102 ALA HA H 102 4.516 4.516 4.304 0.212 18321 15438 1 12 . 1 1 102 102 ALA CA C 102 49.852 49.852 50.341 -0.489 18321 15439 1 12 . 1 1 102 102 ALA CB C 102 17.766 17.766 18.219 -0.453 18321 15440 1 12 . 1 1 102 102 ALA H H 102 8.232 8.232 8.057 0.175 18321 15441 1 12 . 1 1 103 103 PRO HA H 103 4.283 4.283 4.327 -0.044 18321 15442 1 12 . 1 1 103 103 PRO CA C 103 62.435 62.435 63.112 -0.677 18321 15443 1 12 . 1 1 103 103 PRO CB C 103 32.145 32.145 32.067 0.078 18321 15444 1 12 . 1 1 104 104 ARG HA H 104 4.004 4.004 4.252 -0.248 18321 15445 1 12 . 1 1 104 104 ARG CA C 104 56.660 56.660 57.973 -1.313 18321 15446 1 12 . 1 1 106 106 PRO C C 106 174.587 174.587 175.806 -1.219 18321 15447 1 12 . 1 1 106 106 PRO CA C 106 57.867 57.867 63.830 -5.963 18321 15448 1 12 . 1 1 106 106 PRO CB C 106 31.942 31.942 31.625 0.317 18321 15449 1 12 . 1 1 107 107 SER N N 107 121.280 121.280 120.287 0.993 18321 15450 1 12 . 1 1 107 107 SER CA C 107 61.772 61.772 55.502 6.269 18321 15451 1 12 . 1 1 107 107 SER CB C 107 63.234 63.234 64.097 -0.863 18321 15452 1 12 . 1 1 107 107 SER H H 107 8.132 8.132 7.931 0.201 18321 15453 1 12 . 1 1 109 109 PRO C C 109 177.129 177.129 176.897 0.232 18321 15454 1 12 . 1 1 109 109 PRO CA C 109 62.638 62.638 63.272 -0.634 18321 15455 1 12 . 1 1 109 109 PRO CB C 109 30.970 30.970 30.982 -0.012 18321 15456 1 12 . 1 1 110 110 MET N N 110 120.772 120.772 122.114 -1.342 18321 15457 1 12 . 1 1 110 110 MET C C 110 176.892 176.892 176.392 0.500 18321 15458 1 12 . 1 1 110 110 MET CA C 110 55.310 55.310 56.203 -0.893 18321 15459 1 12 . 1 1 110 110 MET CB C 110 32.202 32.202 32.782 -0.580 18321 15460 1 12 . 1 1 110 110 MET H H 110 8.430 8.430 8.602 -0.172 18321 15461 1 12 . 1 1 111 111 GLY N N 111 110.158 110.158 108.076 2.082 18321 15462 1 12 . 1 1 111 111 GLY C C 111 177.430 177.430 172.722 4.708 18321 15463 1 12 . 1 1 111 111 GLY CA C 111 44.951 44.951 44.468 0.484 18321 15464 1 12 . 1 1 111 111 GLY H H 111 8.384 8.384 7.590 0.794 18321 15465 1 12 . 1 1 112 112 SER N N 112 116.762 116.762 115.702 1.060 18321 15466 1 12 . 1 1 112 112 SER CA C 112 55.948 55.948 57.499 -1.551 18321 15467 1 12 . 1 1 112 112 SER CB C 112 62.745 62.745 64.049 -1.304 18321 15468 1 12 . 1 1 112 112 SER H H 112 8.161 8.161 8.209 -0.048 18321 15469 1 12 . 1 1 113 113 VAL C C 113 176.083 176.083 176.071 0.012 18321 15470 1 12 . 1 1 114 114 SER N N 114 119.151 119.151 120.999 -1.848 18321 15471 1 12 . 1 1 114 114 SER C C 114 173.638 173.638 174.631 -0.993 18321 15472 1 12 . 1 1 114 114 SER CA C 114 58.005 58.005 58.483 -0.478 18321 15473 1 12 . 1 1 114 114 SER CB C 114 63.169 63.169 63.046 0.123 18321 15474 1 12 . 1 1 114 114 SER H H 114 8.319 8.319 8.569 -0.250 18321 15475 1 12 . 1 1 115 115 ALA N N 115 126.914 126.914 125.386 1.528 18321 15476 1 12 . 1 1 115 115 ALA CA C 115 51.561 51.561 50.505 1.056 18321 15477 1 12 . 1 1 115 115 ALA CB C 115 17.714 17.714 18.963 -1.249 18321 15478 1 12 . 1 1 115 115 ALA H H 115 8.197 8.197 7.698 0.499 18321 15479 1 12 . 1 1 119 119 PRO C C 119 177.065 177.065 176.394 0.671 18321 15480 1 12 . 1 1 120 120 THR N N 120 113.976 113.976 120.101 -6.125 18321 15481 1 12 . 1 1 120 120 THR C C 120 174.461 174.461 174.432 0.029 18321 15482 1 12 . 1 1 120 120 THR CA C 120 61.215 61.215 63.224 -2.009 18321 15483 1 12 . 1 1 120 120 THR CB C 120 69.508 69.508 69.332 0.176 18321 15484 1 12 . 1 1 120 120 THR H H 120 8.138 8.138 7.966 0.172 18321 15485 1 12 . 1 1 121 121 ALA N N 121 125.859 125.859 130.592 -4.733 18321 15486 1 12 . 1 1 121 121 ALA CA C 121 52.281 52.281 51.368 0.913 18321 15487 1 12 . 1 1 121 121 ALA CB C 121 18.623 18.623 18.757 -0.134 18321 15488 1 12 . 1 1 121 121 ALA H H 121 8.272 8.272 8.452 -0.180 18321 15489 1 12 . 1 1 122 122 GLU C C 122 176.316 176.316 175.576 0.740 18321 15490 1 12 . 1 1 123 123 ASP N N 123 120.448 120.448 122.429 -1.981 18321 15491 1 12 . 1 1 123 123 ASP C C 123 175.906 175.906 175.750 0.156 18321 15492 1 12 . 1 1 123 123 ASP CA C 123 54.167 54.167 53.440 0.727 18321 15493 1 12 . 1 1 123 123 ASP CB C 123 40.695 40.695 42.945 -2.250 18321 15494 1 12 . 1 1 123 123 ASP H H 123 8.181 8.181 8.529 -0.348 18321 15495 1 12 . 1 1 124 124 ASN N N 124 118.207 118.207 117.858 0.349 18321 15496 1 12 . 1 1 124 124 ASN C C 124 174.851 174.851 175.063 -0.212 18321 15497 1 12 . 1 1 124 124 ASN CA C 124 52.771 52.771 54.030 -1.259 18321 15498 1 12 . 1 1 124 124 ASN CB C 124 38.304 38.304 38.323 -0.019 18321 15499 1 12 . 1 1 124 124 ASN H H 124 8.307 8.307 8.721 -0.414 18321 15500 1 12 . 1 1 125 125 LEU N N 125 121.311 121.311 121.897 -0.586 18321 15501 1 12 . 1 1 125 125 LEU C C 125 175.750 175.750 176.204 -0.454 18321 15502 1 12 . 1 1 125 125 LEU CA C 125 54.428 54.428 55.485 -1.057 18321 15503 1 12 . 1 1 125 125 LEU CB C 125 41.350 41.350 40.675 0.675 18321 15504 1 12 . 1 1 125 125 LEU H H 125 7.747 7.747 8.506 -0.759 18321 15505 1 12 . 1 1 126 126 GLU N N 126 122.485 122.485 119.600 2.885 18321 15506 1 12 . 1 1 126 126 GLU C C 126 174.008 174.008 174.231 -0.223 18321 15507 1 12 . 1 1 126 126 GLU CA C 126 54.855 54.855 56.543 -1.688 18321 15508 1 12 . 1 1 126 126 GLU CB C 126 30.472 30.472 30.895 -0.423 18321 15509 1 12 . 1 1 126 126 GLU H H 126 8.453 8.453 8.108 0.345 18321 15510 1 12 . 1 1 127 127 TYR N N 127 122.713 122.713 119.524 3.189 18321 15511 1 12 . 1 1 127 127 TYR C C 127 176.859 176.859 175.528 1.331 18321 15512 1 12 . 1 1 127 127 TYR CA C 127 56.528 56.528 57.895 -1.367 18321 15513 1 12 . 1 1 127 127 TYR CB C 127 40.982 40.982 41.032 -0.050 18321 15514 1 12 . 1 1 127 127 TYR H H 127 8.469 8.469 8.382 0.087 18321 15515 1 12 . 1 1 128 128 VAL N N 128 112.432 112.432 121.566 -9.134 18321 15516 1 12 . 1 1 128 128 VAL C C 128 173.150 173.150 174.523 -1.373 18321 15517 1 12 . 1 1 128 128 VAL CA C 128 57.940 57.940 60.688 -2.748 18321 15518 1 12 . 1 1 128 128 VAL CB C 128 34.935 34.935 37.230 -2.295 18321 15519 1 12 . 1 1 128 128 VAL H H 128 9.078 9.078 9.108 -0.030 18321 15520 1 12 . 1 1 129 129 ARG N N 129 120.373 120.373 120.473 -0.100 18321 15521 1 12 . 1 1 129 129 ARG C C 129 176.539 176.539 175.275 1.264 18321 15522 1 12 . 1 1 129 129 ARG CA C 129 52.534 52.534 54.450 -1.916 18321 15523 1 12 . 1 1 129 129 ARG CB C 129 32.942 32.942 33.608 -0.666 18321 15524 1 12 . 1 1 129 129 ARG H H 129 9.010 9.010 9.472 -0.462 18321 15525 1 12 . 1 1 130 130 THR N N 130 116.637 116.637 114.352 2.285 18321 15526 1 12 . 1 1 130 130 THR CA C 130 60.618 60.618 61.566 -0.948 18321 15527 1 12 . 1 1 130 130 THR CB C 130 69.170 69.170 70.097 -0.927 18321 15528 1 12 . 1 1 130 130 THR H H 130 9.045 9.045 8.681 0.364 18321 15529 1 12 . 1 1 131 131 LEU N N 131 122.910 122.910 123.619 -0.709 18321 15530 1 12 . 1 1 131 131 LEU C C 131 175.269 175.269 177.972 -2.703 18321 15531 1 12 . 1 1 131 131 LEU CA C 131 55.122 55.122 55.801 -0.679 18321 15532 1 12 . 1 1 131 131 LEU CB C 131 43.108 43.108 42.791 0.317 18321 15533 1 12 . 1 1 131 131 LEU H H 131 9.224 9.224 8.915 0.309 18321 15534 1 12 . 1 1 132 132 TYR N N 132 112.885 112.885 118.331 -5.446 18321 15535 1 12 . 1 1 132 132 TYR C C 132 173.818 173.818 175.684 -1.866 18321 15536 1 12 . 1 1 132 132 TYR CA C 132 54.230 54.230 59.506 -5.276 18321 15537 1 12 . 1 1 132 132 TYR CB C 132 42.672 42.672 39.514 3.158 18321 15538 1 12 . 1 1 132 132 TYR H H 132 7.284 7.284 7.722 -0.438 18321 15539 1 12 . 1 1 133 133 ASP N N 133 118.003 118.003 119.785 -1.782 18321 15540 1 12 . 1 1 133 133 ASP C C 133 175.779 175.779 174.553 1.226 18321 15541 1 12 . 1 1 133 133 ASP CA C 133 54.351 54.351 55.679 -1.329 18321 15542 1 12 . 1 1 133 133 ASP CB C 133 41.241 41.241 40.213 1.028 18321 15543 1 12 . 1 1 133 133 ASP H H 133 8.399 8.399 8.366 0.033 18321 15544 1 12 . 1 1 134 134 PHE N N 134 121.081 121.081 124.414 -3.333 18321 15545 1 12 . 1 1 134 134 PHE CA C 134 52.552 52.552 55.332 -2.780 18321 15546 1 12 . 1 1 134 134 PHE CB C 134 41.217 41.217 42.492 -1.275 18321 15547 1 12 . 1 1 134 134 PHE H H 134 8.797 8.797 7.849 0.948 18321 15548 1 12 . 1 1 136 136 GLY C C 136 171.616 171.616 174.775 -3.159 18321 15549 1 12 . 1 1 137 137 ASN N N 137 119.394 119.394 117.166 2.228 18321 15550 1 12 . 1 1 137 137 ASN C C 137 174.500 174.500 173.419 1.081 18321 15551 1 12 . 1 1 137 137 ASN CA C 137 44.670 44.670 53.646 -8.976 18321 15552 1 12 . 1 1 137 137 ASN H H 137 9.477 9.477 8.239 1.238 18321 15553 1 12 . 1 1 138 138 ASP N N 138 120.608 120.608 120.324 0.284 18321 15554 1 12 . 1 1 138 138 ASP C C 138 176.987 176.987 174.663 2.324 18321 15555 1 12 . 1 1 138 138 ASP CA C 138 52.992 52.992 53.606 -0.614 18321 15556 1 12 . 1 1 138 138 ASP H H 138 8.216 8.216 7.986 0.230 18321 15557 1 12 . 1 1 139 139 ALA N N 139 124.371 124.371 120.213 4.158 18321 15558 1 12 . 1 1 139 139 ALA C C 139 178.472 178.472 178.003 0.469 18321 15559 1 12 . 1 1 139 139 ALA CA C 139 54.513 54.513 53.597 0.916 18321 15560 1 12 . 1 1 139 139 ALA CB C 139 18.045 18.045 19.633 -1.588 18321 15561 1 12 . 1 1 139 139 ALA H H 139 8.565 8.565 8.503 0.062 18321 15562 1 12 . 1 1 140 140 GLU N N 140 115.022 115.022 117.289 -2.267 18321 15563 1 12 . 1 1 140 140 GLU C C 140 177.027 177.027 174.908 2.119 18321 15564 1 12 . 1 1 140 140 GLU CA C 140 56.181 56.181 56.538 -0.357 18321 15565 1 12 . 1 1 140 140 GLU CB C 140 28.619 28.619 31.458 -2.839 18321 15566 1 12 . 1 1 140 140 GLU H H 140 8.616 8.616 8.666 -0.050 18321 15567 1 12 . 1 1 141 141 ASP N N 141 121.913 121.913 120.350 1.563 18321 15568 1 12 . 1 1 141 141 ASP C C 141 175.923 175.923 174.245 1.678 18321 15569 1 12 . 1 1 141 141 ASP CA C 141 54.736 54.736 52.945 1.791 18321 15570 1 12 . 1 1 141 141 ASP CB C 141 41.305 41.305 42.938 -1.633 18321 15571 1 12 . 1 1 141 141 ASP H H 141 7.636 7.636 7.830 -0.194 18321 15572 1 12 . 1 1 142 142 LEU N N 142 127.651 127.651 127.393 0.258 18321 15573 1 12 . 1 1 142 142 LEU CA C 142 50.955 50.955 51.911 -0.956 18321 15574 1 12 . 1 1 142 142 LEU CB C 142 42.343 42.343 43.651 -1.308 18321 15575 1 12 . 1 1 142 142 LEU H H 142 9.479 9.479 7.923 1.556 18321 15576 1 12 . 1 1 143 143 PRO C C 143 177.924 177.924 175.905 2.019 18321 15577 1 12 . 1 1 144 144 PHE N N 144 114.483 114.483 120.158 -5.675 18321 15578 1 12 . 1 1 144 144 PHE C C 144 175.055 175.055 174.112 0.943 18321 15579 1 12 . 1 1 144 144 PHE CA C 144 55.543 55.543 55.285 0.258 18321 15580 1 12 . 1 1 144 144 PHE CB C 144 40.581 40.581 40.743 -0.162 18321 15581 1 12 . 1 1 144 144 PHE H H 144 8.637 8.637 7.863 0.774 18321 15582 1 12 . 1 1 145 145 LYS N N 145 121.342 121.342 119.234 2.108 18321 15583 1 12 . 1 1 145 145 LYS C C 145 176.925 176.925 178.219 -1.294 18321 15584 1 12 . 1 1 145 145 LYS CA C 145 53.043 53.043 54.038 -0.995 18321 15585 1 12 . 1 1 145 145 LYS CB C 145 33.804 33.804 35.282 -1.478 18321 15586 1 12 . 1 1 145 145 LYS H H 145 9.418 9.418 8.798 0.620 18321 15587 1 12 . 1 1 146 146 LYS N N 146 123.378 123.378 119.612 3.766 18321 15588 1 12 . 1 1 146 146 LYS CA C 146 57.883 57.883 57.291 0.592 18321 15589 1 12 . 1 1 146 146 LYS CB C 146 32.008 32.008 32.466 -0.458 18321 15590 1 12 . 1 1 146 146 LYS H H 146 9.002 9.002 8.452 0.550 18321 15591 1 12 . 1 1 147 147 GLY C C 147 174.315 174.315 173.659 0.656 18321 15592 1 12 . 1 1 148 148 GLU N N 148 121.392 121.392 120.511 0.881 18321 15593 1 12 . 1 1 148 148 GLU C C 148 174.998 174.998 175.061 -0.063 18321 15594 1 12 . 1 1 148 148 GLU CA C 148 56.867 56.867 55.010 1.857 18321 15595 1 12 . 1 1 148 148 GLU CB C 148 31.649 31.649 32.373 -0.724 18321 15596 1 12 . 1 1 148 148 GLU H H 148 7.937 7.937 7.761 0.176 18321 15597 1 12 . 1 1 149 149 ILE N N 149 120.124 120.124 123.504 -3.380 18321 15598 1 12 . 1 1 149 149 ILE C C 149 176.647 176.647 175.614 1.033 18321 15599 1 12 . 1 1 149 149 ILE CA C 149 58.621 58.621 60.277 -1.656 18321 15600 1 12 . 1 1 149 149 ILE CB C 149 36.952 36.952 38.886 -1.933 18321 15601 1 12 . 1 1 149 149 ILE H H 149 8.346 8.346 8.611 -0.265 18321 15602 1 12 . 1 1 150 150 LEU N N 150 126.950 126.950 126.359 0.591 18321 15603 1 12 . 1 1 150 150 LEU CA C 150 51.967 51.967 52.594 -0.627 18321 15604 1 12 . 1 1 150 150 LEU CB C 150 44.182 44.182 45.512 -1.330 18321 15605 1 12 . 1 1 150 150 LEU H H 150 8.988 8.988 9.153 -0.165 18321 15606 1 12 . 1 1 151 151 VAL C C 151 175.670 175.670 175.646 0.024 18321 15607 1 12 . 1 1 152 152 ILE N N 152 124.997 124.997 128.028 -3.031 18321 15608 1 12 . 1 1 152 152 ILE CA C 152 58.331 58.331 59.446 -1.115 18321 15609 1 12 . 1 1 152 152 ILE CB C 152 34.093 34.093 34.846 -0.754 18321 15610 1 12 . 1 1 152 152 ILE H H 152 8.673 8.673 8.846 -0.173 18321 15611 1 12 . 1 1 153 153 ILE N N 153 124.710 124.710 126.974 -2.264 18321 15612 1 12 . 1 1 153 153 ILE C C 153 176.264 176.264 175.629 0.635 18321 15613 1 12 . 1 1 154 154 GLU N N 154 117.398 117.398 118.505 -1.107 18321 15614 1 12 . 1 1 154 154 GLU C C 154 173.959 173.959 174.702 -0.743 18321 15615 1 12 . 1 1 154 154 GLU CA C 154 55.289 55.289 55.108 0.181 18321 15616 1 12 . 1 1 154 154 GLU CB C 154 32.842 32.842 32.454 0.388 18321 15617 1 12 . 1 1 154 154 GLU H H 154 7.818 7.818 8.184 -0.366 18321 15618 1 12 . 1 1 155 155 LYS N N 155 121.130 121.130 124.990 -3.860 18321 15619 1 12 . 1 1 155 155 LYS CA C 155 53.022 53.022 52.437 0.585 18321 15620 1 12 . 1 1 155 155 LYS CB C 155 32.663 32.663 32.399 0.264 18321 15621 1 12 . 1 1 155 155 LYS H H 155 8.654 8.654 8.554 0.100 18321 15622 1 12 . 1 1 157 157 GLU C C 157 175.190 175.190 176.243 -1.053 18321 15623 1 12 . 1 1 157 157 GLU CA C 157 53.785 53.785 54.346 -0.562 18321 15624 1 12 . 1 1 157 157 GLU CB C 157 32.685 32.685 32.393 0.292 18321 15625 1 12 . 1 1 158 158 GLU N N 158 117.425 117.425 117.797 -0.372 18321 15626 1 12 . 1 1 158 158 GLU C C 158 178.600 178.600 176.999 1.601 18321 15627 1 12 . 1 1 158 158 GLU CA C 158 59.044 59.044 58.464 0.580 18321 15628 1 12 . 1 1 158 158 GLU CB C 158 29.706 29.706 30.025 -0.319 18321 15629 1 12 . 1 1 158 158 GLU H H 158 8.678 8.678 8.791 -0.113 18321 15630 1 12 . 1 1 159 159 GLN N N 159 110.925 110.925 118.707 -7.782 18321 15631 1 12 . 1 1 159 159 GLN C C 159 175.539 175.539 174.653 0.886 18321 15632 1 12 . 1 1 159 159 GLN CA C 159 54.942 54.942 57.107 -2.165 18321 15633 1 12 . 1 1 159 159 GLN CB C 159 28.572 28.572 29.638 -1.066 18321 15634 1 12 . 1 1 159 159 GLN H H 159 8.483 8.483 8.477 0.006 18321 15635 1 12 . 1 1 160 160 TRP N N 160 120.171 120.171 119.528 0.643 18321 15636 1 12 . 1 1 160 160 TRP C C 160 173.444 173.444 174.539 -1.095 18321 15637 1 12 . 1 1 160 160 TRP CA C 160 56.175 56.175 56.363 -0.188 18321 15638 1 12 . 1 1 160 160 TRP CB C 160 31.796 31.796 32.395 -0.599 18321 15639 1 12 . 1 1 160 160 TRP H H 160 6.826 6.826 7.774 -0.948 18321 15640 1 12 . 1 1 161 161 TRP N N 161 120.687 120.687 121.734 -1.047 18321 15641 1 12 . 1 1 161 161 TRP C C 161 174.736 174.736 175.644 -0.908 18321 15642 1 12 . 1 1 161 161 TRP CA C 161 51.889 51.889 54.397 -2.508 18321 15643 1 12 . 1 1 161 161 TRP CB C 161 32.772 32.772 32.113 0.659 18321 15644 1 12 . 1 1 161 161 TRP H H 161 8.462 8.462 9.302 -0.840 18321 15645 1 12 . 1 1 162 162 SER N N 162 115.691 115.691 120.117 -4.426 18321 15646 1 12 . 1 1 162 162 SER C C 162 174.320 174.320 173.573 0.747 18321 15647 1 12 . 1 1 162 162 SER CA C 162 57.011 57.011 58.863 -1.852 18321 15648 1 12 . 1 1 162 162 SER CB C 162 63.948 63.948 63.111 0.838 18321 15649 1 12 . 1 1 162 162 SER H H 162 8.830 8.830 8.841 -0.011 18321 15650 1 12 . 1 1 163 163 ALA N N 163 130.630 130.630 128.531 2.099 18321 15651 1 12 . 1 1 163 163 ALA CA C 163 50.029 50.029 49.730 0.299 18321 15652 1 12 . 1 1 163 163 ALA CB C 163 25.500 25.500 22.997 2.503 18321 15653 1 12 . 1 1 163 163 ALA H H 163 9.585 9.585 9.092 0.493 18321 15654 1 12 . 1 1 164 164 ARG N N 164 117.526 117.526 119.254 -1.728 18321 15655 1 12 . 1 1 164 164 ARG C C 164 176.719 176.719 176.449 0.270 18321 15656 1 12 . 1 1 164 164 ARG CA C 164 52.975 52.975 53.434 -0.459 18321 15657 1 12 . 1 1 164 164 ARG CB C 164 34.260 34.260 32.312 1.948 18321 15658 1 12 . 1 1 164 164 ARG H H 164 9.097 9.097 8.476 0.621 18321 15659 1 12 . 1 1 165 165 ASN N N 165 123.935 123.935 122.299 1.636 18321 15660 1 12 . 1 1 165 165 ASN C C 165 178.484 178.484 175.599 2.885 18321 15661 1 12 . 1 1 165 165 ASN CA C 165 50.332 50.332 52.429 -2.097 18321 15662 1 12 . 1 1 165 165 ASN CB C 165 39.487 39.487 39.667 -0.180 18321 15663 1 12 . 1 1 165 165 ASN H H 165 8.756 8.756 8.819 -0.063 18321 15664 1 12 . 1 1 166 166 LYS N N 166 118.464 118.464 118.072 0.392 18321 15665 1 12 . 1 1 166 166 LYS C C 166 176.967 176.967 177.450 -0.483 18321 15666 1 12 . 1 1 166 166 LYS CA C 166 58.430 58.430 57.783 0.647 18321 15667 1 12 . 1 1 166 166 LYS CB C 166 30.918 30.918 32.233 -1.315 18321 15668 1 12 . 1 1 166 166 LYS H H 166 8.915 8.915 8.281 0.634 18321 15669 1 12 . 1 1 167 167 ASP N N 167 118.138 118.138 116.200 1.938 18321 15670 1 12 . 1 1 167 167 ASP C C 167 176.464 176.464 177.139 -0.675 18321 15671 1 12 . 1 1 167 167 ASP CA C 167 54.212 54.212 54.921 -0.709 18321 15672 1 12 . 1 1 167 167 ASP CB C 167 41.178 41.178 41.770 -0.592 18321 15673 1 12 . 1 1 167 167 ASP H H 167 7.508 7.508 8.062 -0.554 18321 15674 1 12 . 1 1 168 168 GLY N N 168 107.901 107.901 106.548 1.353 18321 15675 1 12 . 1 1 168 168 GLY C C 168 173.613 173.613 173.569 0.044 18321 15676 1 12 . 1 1 168 168 GLY CA C 168 44.783 44.783 44.742 0.041 18321 15677 1 12 . 1 1 168 168 GLY H H 168 8.173 8.173 7.831 0.342 18321 15678 1 12 . 1 1 169 169 ARG N N 169 124.324 124.324 121.268 3.056 18321 15679 1 12 . 1 1 169 169 ARG CA C 169 56.106 56.106 55.238 0.868 18321 15680 1 12 . 1 1 169 169 ARG CB C 169 29.648 29.648 32.156 -2.508 18321 15681 1 12 . 1 1 169 169 ARG H H 169 7.998 7.998 8.828 -0.830 18321 15682 1 12 . 1 1 170 170 VAL C C 170 177.590 177.590 175.337 2.253 18321 15683 1 12 . 1 1 171 171 GLY N N 171 112.582 112.582 112.342 0.240 18321 15684 1 12 . 1 1 171 171 GLY C C 171 170.991 170.991 172.513 -1.522 18321 15685 1 12 . 1 1 171 171 GLY CA C 171 45.361 45.361 44.897 0.464 18321 15686 1 12 . 1 1 171 171 GLY H H 171 9.013 9.013 8.751 0.262 18321 15687 1 12 . 1 1 172 172 MET N N 172 117.368 117.368 120.895 -3.527 18321 15688 1 12 . 1 1 172 172 MET C C 172 177.921 177.921 176.285 1.636 18321 15689 1 12 . 1 1 172 172 MET CA C 172 53.536 53.536 54.743 -1.208 18321 15690 1 12 . 1 1 172 172 MET CB C 172 30.838 30.838 32.600 -1.762 18321 15691 1 12 . 1 1 172 172 MET H H 172 8.885 8.885 8.325 0.560 18321 15692 1 12 . 1 1 173 173 ILE N N 173 113.130 113.130 120.079 -6.949 18321 15693 1 12 . 1 1 173 173 ILE CA C 173 56.284 56.284 57.691 -1.407 18321 15694 1 12 . 1 1 173 173 ILE CB C 173 40.870 40.870 40.627 0.243 18321 15695 1 12 . 1 1 173 173 ILE H H 173 9.704 9.704 9.400 0.304 18321 15696 1 12 . 1 1 174 174 PRO C C 174 176.714 176.714 177.219 -0.505 18321 15697 1 12 . 1 1 174 174 PRO CA C 174 66.290 66.290 61.305 4.985 18321 15698 1 12 . 1 1 174 174 PRO CB C 174 28.993 28.993 30.504 -1.511 18321 15699 1 12 . 1 1 175 175 VAL N N 175 128.066 128.066 124.481 3.585 18321 15700 1 12 . 1 1 175 175 VAL CA C 175 59.356 59.356 66.452 -7.096 18321 15701 1 12 . 1 1 175 175 VAL H H 175 7.327 7.327 8.357 -1.030 18321 15702 1 12 . 1 1 176 176 PRO C C 176 176.351 176.351 176.953 -0.602 18321 15703 1 12 . 1 1 177 177 TYR N N 177 115.756 115.756 114.930 0.826 18321 15704 1 12 . 1 1 177 177 TYR C C 177 175.011 175.011 175.554 -0.543 18321 15705 1 12 . 1 1 177 177 TYR CA C 177 56.756 56.756 57.111 -0.355 18321 15706 1 12 . 1 1 177 177 TYR CB C 177 37.507 37.507 38.797 -1.290 18321 15707 1 12 . 1 1 177 177 TYR H H 177 7.784 7.784 7.577 0.207 18321 15708 1 12 . 1 1 178 178 VAL N N 178 111.428 111.428 114.100 -2.672 18321 15709 1 12 . 1 1 178 178 VAL C C 178 173.417 173.417 175.146 -1.729 18321 15710 1 12 . 1 1 178 178 VAL CA C 178 58.307 58.307 58.660 -0.353 18321 15711 1 12 . 1 1 178 178 VAL CB C 178 34.602 34.602 35.259 -0.657 18321 15712 1 12 . 1 1 178 178 VAL H H 178 7.801 7.801 7.416 0.385 18321 15713 1 12 . 1 1 179 179 GLU N N 179 118.581 118.581 117.740 0.841 18321 15714 1 12 . 1 1 179 179 GLU C C 179 175.225 175.225 174.875 0.350 18321 15715 1 12 . 1 1 179 179 GLU CA C 179 53.114 53.114 54.429 -1.315 18321 15716 1 12 . 1 1 179 179 GLU CB C 179 32.712 32.712 32.674 0.038 18321 15717 1 12 . 1 1 179 179 GLU H H 179 8.819 8.819 8.951 -0.132 18321 15718 1 12 . 1 1 180 180 LYS N N 180 124.167 124.167 120.158 4.009 18321 15719 1 12 . 1 1 180 180 LYS C C 180 176.303 176.303 176.298 0.005 18321 15720 1 12 . 1 1 180 180 LYS CA C 180 57.318 57.318 55.469 1.849 18321 15721 1 12 . 1 1 180 180 LYS CB C 180 31.675 31.675 33.219 -1.544 18321 15722 1 12 . 1 1 180 180 LYS H H 180 8.775 8.775 8.604 0.171 18321 15723 1 12 . 1 1 181 181 LEU N N 181 125.157 125.157 123.764 1.393 18321 15724 1 12 . 1 1 181 181 LEU C C 181 176.462 176.462 176.483 -0.021 18321 15725 1 12 . 1 1 181 181 LEU CA C 181 54.470 54.470 54.100 0.370 18321 15726 1 12 . 1 1 181 181 LEU CB C 181 41.625 41.625 43.524 -1.899 18321 15727 1 12 . 1 1 181 181 LEU H H 181 8.084 8.084 8.169 -0.085 18321 15728 1 12 . 1 1 182 182 VAL N N 182 123.167 123.167 117.974 5.193 18321 15729 1 12 . 1 1 182 182 VAL C C 182 175.983 175.983 175.258 0.725 18321 15730 1 12 . 1 1 182 182 VAL CA C 182 61.613 61.613 63.806 -2.193 18321 15731 1 12 . 1 1 182 182 VAL CB C 182 32.085 32.085 29.878 2.207 18321 15732 1 12 . 1 1 182 182 VAL H H 182 8.345 8.345 8.486 -0.141 18321 15733 1 12 . 1 1 183 183 ARG N N 183 125.775 125.775 119.643 6.132 18321 15734 1 12 . 1 1 183 183 ARG CA C 183 57.801 57.801 56.796 1.005 18321 15735 1 12 . 1 1 183 183 ARG CB C 183 30.091 30.091 30.060 0.031 18321 15736 1 12 . 1 1 183 183 ARG H H 183 8.530 8.530 8.254 0.276 18321 15737 1 12 . 1 1 184 184 SER C C 184 173.239 173.239 175.835 -2.596 18321 15738 1 12 . 1 1 185 185 SER N N 185 116.511 116.511 121.110 -4.599 18321 15739 1 12 . 1 1 185 185 SER CA C 185 58.428 58.428 61.849 -3.421 18321 15740 1 12 . 1 1 185 185 SER CB C 185 69.737 69.737 61.215 8.522 18321 15741 1 12 . 1 1 185 185 SER H H 185 7.944 7.944 8.371 -0.427 18321 15742 1 12 . 1 1 190 190 HIS C C 190 176.953 176.953 175.934 1.019 18321 15743 1 12 . 1 1 190 190 HIS CA C 190 54.229 54.229 55.449 -1.220 18321 15744 1 12 . 1 1 190 190 HIS CB C 190 35.112 35.112 30.676 4.436 18321 15745 1 12 . 1 1 191 191 GLY N N 191 109.491 109.491 109.902 -0.411 18321 15746 1 12 . 1 1 191 191 GLY C C 191 172.295 172.295 174.096 -1.801 18321 15747 1 12 . 1 1 191 191 GLY CA C 191 45.227 45.227 44.758 0.469 18321 15748 1 12 . 1 1 191 191 GLY H H 191 8.719 8.719 8.340 0.379 18321 15749 1 12 . 1 1 192 192 ASN N N 192 118.700 118.700 120.678 -1.978 18321 15750 1 12 . 1 1 192 192 ASN HA H 192 4.312 4.312 4.899 -0.587 18321 15751 1 12 . 1 1 192 192 ASN C C 192 176.369 176.369 175.196 1.173 18321 15752 1 12 . 1 1 192 192 ASN CA C 192 57.787 57.787 52.554 5.233 18321 15753 1 12 . 1 1 192 192 ASN H H 192 7.508 7.508 7.759 -0.251 18321 15754 1 12 . 1 1 193 193 ARG N N 193 120.743 120.743 120.592 0.151 18321 15755 1 12 . 1 1 193 193 ARG H H 193 9.032 9.032 8.302 0.730 18321 15756 1 12 . 1 1 197 197 SER HA H 197 4.388 4.388 4.415 -0.027 18321 15757 1 12 . 1 1 197 197 SER C C 197 174.133 174.133 173.413 0.720 18321 15758 1 12 . 1 1 197 197 SER CA C 197 58.128 58.128 57.735 0.393 18321 15759 1 12 . 1 1 197 197 SER CB C 197 62.966 62.966 64.634 -1.668 18321 15760 1 12 . 1 1 198 198 TYR N N 198 121.435 121.435 121.488 -0.053 18321 15761 1 12 . 1 1 198 198 TYR HA H 198 4.543 4.543 4.271 0.272 18321 15762 1 12 . 1 1 198 198 TYR C C 198 176.230 176.230 175.270 0.960 18321 15763 1 12 . 1 1 198 198 TYR CA C 198 57.536 57.536 58.385 -0.848 18321 15764 1 12 . 1 1 198 198 TYR CB C 198 38.279 38.279 37.695 0.584 18321 15765 1 12 . 1 1 198 198 TYR H H 198 8.071 8.071 8.316 -0.245 18321 15766 1 12 . 1 1 199 199 GLY N N 199 110.039 110.039 112.304 -2.265 18321 15767 1 12 . 1 1 199 199 GLY C C 199 173.475 173.475 173.371 0.104 18321 15768 1 12 . 1 1 199 199 GLY CA C 199 44.805 44.805 45.340 -0.535 18321 15769 1 12 . 1 1 199 199 GLY H H 199 8.162 8.162 8.459 -0.297 18321 15770 1 12 . 1 1 200 200 ILE N N 200 121.530 121.530 124.292 -2.762 18321 15771 1 12 . 1 1 200 200 ILE CA C 200 58.102 58.102 58.257 -0.155 18321 15772 1 12 . 1 1 200 200 ILE CB C 200 37.760 37.760 39.191 -1.431 18321 15773 1 12 . 1 1 200 200 ILE H H 200 7.851 7.851 8.043 -0.192 18321 15774 1 12 . 1 1 201 201 PRO C C 201 176.485 176.485 176.252 0.233 18321 15775 1 12 . 1 1 201 201 PRO CA C 201 53.893 53.893 63.367 -9.474 18321 15776 1 12 . 1 1 201 201 PRO CB C 201 29.042 29.042 32.030 -2.988 18321 15777 1 12 . 1 1 202 202 GLU N N 202 122.468 122.468 119.353 3.115 18321 15778 1 12 . 1 1 202 202 GLU CA C 202 62.490 62.490 56.077 6.413 18321 15779 1 12 . 1 1 202 202 GLU CB C 202 31.170 31.170 28.923 2.247 18321 15780 1 12 . 1 1 202 202 GLU H H 202 8.328 8.328 8.488 -0.160 18321 15781 1 12 . 1 1 203 203 PRO CA C 203 62.803 62.803 62.607 0.196 18321 15782 1 12 . 1 1 203 203 PRO CB C 203 31.220 31.220 32.367 -1.147 18321 15783 1 12 . 1 1 204 204 ALA N N 204 123.251 123.251 126.824 -3.573 18321 15784 1 12 . 1 1 204 204 ALA HA H 204 4.180 4.180 4.145 0.035 18321 15785 1 12 . 1 1 204 204 ALA CA C 204 52.124 52.124 52.565 -0.441 18321 15786 1 12 . 1 1 204 204 ALA CB C 204 18.892 18.892 19.414 -0.522 18321 15787 1 12 . 1 1 204 204 ALA H H 204 8.308 8.308 8.518 -0.210 18321 15788 1 12 . 1 1 205 205 HIS N N 205 117.874 117.874 118.826 -0.952 18321 15789 1 12 . 1 1 205 205 HIS C C 205 173.282 173.282 174.062 -0.780 18321 15790 1 12 . 1 1 205 205 HIS H H 205 8.045 8.045 8.118 -0.073 18321 15791 1 12 . 1 1 206 206 ALA N N 206 125.519 125.519 128.123 -2.604 18321 15792 1 12 . 1 1 206 206 ALA HA H 206 4.204 4.204 4.450 -0.246 18321 15793 1 12 . 1 1 206 206 ALA CA C 206 40.196 40.196 51.679 -11.483 18321 15794 1 12 . 1 1 206 206 ALA CB C 206 19.407 19.407 19.051 0.356 18321 15795 1 12 . 1 1 206 206 ALA H H 206 8.061 8.061 8.391 -0.330 18321 15796 1 12 . 1 1 207 207 TYR N N 207 120.381 120.381 125.735 -5.354 18321 15797 1 12 . 1 1 207 207 TYR HA H 207 4.570 4.570 4.624 -0.054 18321 15798 1 12 . 1 1 207 207 TYR CA C 207 52.572 52.572 57.815 -5.243 18321 15799 1 12 . 1 1 207 207 TYR CB C 207 41.333 41.333 39.376 1.957 18321 15800 1 12 . 1 1 207 207 TYR H H 207 8.199 8.199 8.646 -0.447 18321 15801 1 12 . 1 1 208 208 ALA HA H 208 4.281 4.281 4.586 -0.305 18321 15802 1 12 . 1 1 208 208 ALA C C 208 177.736 177.736 176.546 1.190 18321 15803 1 12 . 1 1 208 208 ALA CA C 208 52.084 52.084 51.480 0.604 18321 15804 1 12 . 1 1 208 208 ALA CB C 208 18.999 18.999 20.246 -1.247 18321 15805 1 12 . 1 1 209 209 GLN N N 209 119.295 119.295 121.266 -1.971 18321 15806 1 12 . 1 1 209 209 GLN CA C 209 61.474 61.474 53.696 7.778 18321 15807 1 12 . 1 1 209 209 GLN CB C 209 32.039 32.039 29.073 2.966 18321 15808 1 12 . 1 1 209 209 GLN H H 209 8.125 8.125 8.497 -0.372 18321 15809 1 12 . 1 1 210 210 PRO HA H 210 4.395 4.395 4.527 -0.132 18321 15810 1 12 . 1 1 210 210 PRO CA C 210 62.584 62.584 62.626 -0.042 18321 15811 1 12 . 1 1 211 211 GLN HA H 211 4.377 4.377 4.595 -0.218 18321 15812 1 12 . 1 1 211 211 GLN CA C 211 55.859 55.859 55.285 0.575 18321 15813 1 12 . 1 1 211 211 GLN CB C 211 29.577 29.577 30.619 -1.042 18321 15814 1 12 . 1 1 212 212 THR C C 212 176.551 176.551 174.081 2.470 18321 15815 1 12 . 1 1 212 212 THR CB C 212 69.890 69.890 68.981 0.909 18321 15816 1 12 . 1 1 213 213 THR N N 213 108.487 108.487 113.549 -5.062 18321 15817 1 12 . 1 1 213 213 THR CA C 213 61.236 61.236 62.084 -0.848 18321 15818 1 12 . 1 1 213 213 THR CB C 213 69.091 69.091 68.846 0.245 18321 15819 1 12 . 1 1 213 213 THR H H 213 8.243 8.243 7.481 0.762 18321 15820 1 12 . 1 1 214 214 THR N N 214 119.445 119.445 117.512 1.933 18321 15821 1 12 . 1 1 214 214 THR CA C 214 59.425 59.425 59.727 -0.302 18321 15822 1 12 . 1 1 214 214 THR CB C 214 69.251 69.251 69.347 -0.096 18321 15823 1 12 . 1 1 214 214 THR H H 214 8.188 8.188 8.327 -0.139 18321 15824 1 12 . 1 1 215 215 PRO HA H 215 4.361 4.361 4.560 -0.199 18321 15825 1 12 . 1 1 215 215 PRO C C 215 175.422 175.422 176.064 -0.642 18321 15826 1 12 . 1 1 215 215 PRO CA C 215 63.320 63.320 62.582 0.738 18321 15827 1 12 . 1 1 215 215 PRO CB C 215 31.918 31.918 32.256 -0.338 18321 15828 1 12 . 1 1 216 216 LEU N N 216 121.602 121.602 120.096 1.506 18321 15829 1 12 . 1 1 216 216 LEU CA C 216 52.203 52.203 54.795 -2.592 18321 15830 1 12 . 1 1 216 216 LEU CB C 216 42.451 42.451 40.752 1.699 18321 15831 1 12 . 1 1 216 216 LEU H H 216 7.891 7.891 8.360 -0.469 18321 15832 1 12 . 1 1 217 217 PRO HA H 217 4.398 4.398 4.432 -0.034 18321 15833 1 12 . 1 1 217 217 PRO C C 217 176.577 176.577 176.643 -0.066 18321 15834 1 12 . 1 1 217 217 PRO CA C 217 62.984 62.984 62.981 0.003 18321 15835 1 12 . 1 1 217 217 PRO CB C 217 32.056 32.056 31.924 0.132 18321 15836 1 12 . 1 1 218 218 ALA N N 218 124.087 124.087 121.936 2.151 18321 15837 1 12 . 1 1 218 218 ALA HA H 218 4.309 4.309 4.094 0.215 18321 15838 1 12 . 1 1 218 218 ALA C C 218 177.844 177.844 176.887 0.957 18321 15839 1 12 . 1 1 218 218 ALA CA C 218 52.379 52.379 52.122 0.257 18321 15840 1 12 . 1 1 218 218 ALA CB C 218 19.133 19.133 18.706 0.427 18321 15841 1 12 . 1 1 218 218 ALA H H 218 8.261 8.261 7.799 0.462 18321 15842 1 12 . 1 1 219 219 VAL N N 219 118.942 118.942 119.086 -0.144 18321 15843 1 12 . 1 1 219 219 VAL HA H 219 4.142 4.142 4.310 -0.168 18321 15844 1 12 . 1 1 219 219 VAL CA C 219 62.102 62.102 61.787 0.315 18321 15845 1 12 . 1 1 219 219 VAL CB C 219 32.923 32.923 32.716 0.207 18321 15846 1 12 . 1 1 219 219 VAL H H 219 8.049 8.049 8.027 0.022 18321 15847 1 12 . 1 1 220 220 SER N N 220 119.207 119.207 117.690 1.517 18321 15848 1 12 . 1 1 220 220 SER HA H 220 4.436 4.436 4.516 -0.080 18321 15849 1 12 . 1 1 220 220 SER CA C 220 57.813 57.813 59.310 -1.497 18321 15850 1 12 . 1 1 220 220 SER CB C 220 63.375 63.375 63.286 0.089 18321 15851 1 12 . 1 1 220 220 SER H H 220 8.275 8.275 8.682 -0.407 18321 15852 1 12 . 1 1 221 221 GLY N N 221 110.973 110.973 111.010 -0.037 18321 15853 1 12 . 1 1 221 221 GLY C C 221 173.962 173.962 173.572 0.390 18321 15854 1 12 . 1 1 221 221 GLY CA C 221 45.286 45.286 45.034 0.252 18321 15855 1 12 . 1 1 221 221 GLY H H 221 8.374 8.374 8.379 -0.005 18321 15856 1 12 . 1 1 222 222 SER N N 222 115.516 115.516 116.345 -0.829 18321 15857 1 12 . 1 1 222 222 SER HA H 222 4.763 4.763 4.772 -0.009 18321 15858 1 12 . 1 1 222 222 SER CA C 222 56.407 56.407 56.241 0.166 18321 15859 1 12 . 1 1 222 222 SER CB C 222 63.993 63.993 65.496 -1.503 18321 15860 1 12 . 1 1 222 222 SER H H 222 8.155 8.155 7.492 0.663 18321 15861 1 12 . 1 1 223 223 PRO HA H 223 4.417 4.417 4.494 -0.077 18321 15862 1 12 . 1 1 223 223 PRO CA C 223 63.805 63.805 63.099 0.706 18321 15863 1 12 . 1 1 223 223 PRO CB C 223 32.090 32.090 32.415 -0.325 18321 15864 1 12 . 1 1 224 224 GLY N N 224 109.149 109.149 108.727 0.422 18321 15865 1 12 . 1 1 224 224 GLY C C 224 173.813 173.813 173.380 0.433 18321 15866 1 12 . 1 1 224 224 GLY CA C 224 44.512 44.512 44.411 0.101 18321 15867 1 12 . 1 1 224 224 GLY H H 224 8.376 8.376 7.991 0.385 18321 15868 1 12 . 1 1 225 225 ALA N N 225 123.599 123.599 122.716 0.883 18321 15869 1 12 . 1 1 225 225 ALA C C 225 177.341 177.341 176.203 1.138 18321 15870 1 12 . 1 1 225 225 ALA CA C 225 51.878 51.878 52.362 -0.485 18321 15871 1 12 . 1 1 225 225 ALA CB C 225 19.169 19.169 19.158 0.011 18321 15872 1 12 . 1 1 225 225 ALA H H 225 7.959 7.959 8.400 -0.441 18321 15873 1 12 . 1 1 226 226 ALA N N 226 123.218 123.218 125.881 -2.663 18321 15874 1 12 . 1 1 226 226 ALA HA H 226 4.350 4.350 4.623 -0.273 18321 15875 1 12 . 1 1 226 226 ALA C C 226 177.520 177.520 175.669 1.851 18321 15876 1 12 . 1 1 226 226 ALA CA C 226 52.535 52.535 51.673 0.862 18321 15877 1 12 . 1 1 226 226 ALA CB C 226 19.171 19.171 20.180 -1.008 18321 15878 1 12 . 1 1 226 226 ALA H H 226 8.169 8.169 8.008 0.161 18321 15879 1 12 . 1 1 227 227 ILE N N 227 120.086 120.086 121.156 -1.070 18321 15880 1 12 . 1 1 227 227 ILE HA H 227 4.201 4.201 4.338 -0.137 18321 15881 1 12 . 1 1 227 227 ILE C C 227 174.814 174.814 175.405 -0.591 18321 15882 1 12 . 1 1 227 227 ILE CA C 227 60.929 60.929 60.915 0.014 18321 15883 1 12 . 1 1 227 227 ILE CB C 227 38.872 38.872 38.396 0.476 18321 15884 1 12 . 1 1 227 227 ILE H H 227 8.037 8.037 8.221 -0.184 18321 15885 1 12 . 1 1 228 228 THR N N 228 117.224 117.224 125.399 -8.175 18321 15886 1 12 . 1 1 228 228 THR HA H 228 4.203 4.203 4.448 -0.245 18321 15887 1 12 . 1 1 228 228 THR CA C 228 57.108 57.108 61.266 -4.158 18321 15888 1 12 . 1 1 228 228 THR CB C 228 69.945 69.945 68.553 1.392 18321 15889 1 12 . 1 1 228 228 THR H H 228 7.775 7.775 8.558 -0.783 18321 15890 1 12 . 1 1 229 229 PRO HA H 229 4.750 4.750 4.449 0.301 18321 15891 1 12 . 1 1 229 229 PRO CA C 229 62.480 62.480 62.675 -0.195 18321 15892 1 12 . 1 1 229 229 PRO CB C 229 33.995 33.995 32.302 1.693 18321 15893 1 12 . 1 1 230 230 LEU N N 230 123.629 123.629 124.677 -1.048 18321 15894 1 12 . 1 1 230 230 LEU CA C 230 53.076 53.076 53.053 0.023 18321 15895 1 12 . 1 1 230 230 LEU CB C 230 40.608 40.608 40.871 -0.263 18321 15896 1 12 . 1 1 230 230 LEU H H 230 8.453 8.453 8.195 0.258 18321 15897 1 12 . 1 1 231 231 PRO HA H 231 4.412 4.412 4.517 -0.105 18321 15898 1 12 . 1 1 231 231 PRO C C 231 176.571 176.571 175.966 0.605 18321 15899 1 12 . 1 1 231 231 PRO CA C 231 63.225 63.225 62.328 0.897 18321 15900 1 12 . 1 1 231 231 PRO CB C 231 31.191 31.191 30.311 0.881 18321 15901 1 12 . 1 1 232 232 SER N N 232 115.169 115.169 116.018 -0.849 18321 15902 1 12 . 1 1 232 232 SER HA H 232 4.450 4.450 4.194 0.256 18321 15903 1 12 . 1 1 232 232 SER CA C 232 58.604 58.604 59.456 -0.852 18321 15904 1 12 . 1 1 232 232 SER CB C 232 63.962 63.962 62.221 1.741 18321 15905 1 12 . 1 1 232 232 SER H H 232 8.280 8.280 8.369 -0.089 18321 15906 1 12 . 1 1 233 233 THR N N 233 115.155 115.155 115.595 -0.440 18321 15907 1 12 . 1 1 233 233 THR HA H 233 4.351 4.351 4.593 -0.242 18321 15908 1 12 . 1 1 233 233 THR C C 233 177.237 177.237 174.135 3.102 18321 15909 1 12 . 1 1 233 233 THR CA C 233 61.939 61.939 60.404 1.535 18321 15910 1 12 . 1 1 233 233 THR CB C 233 68.986 68.986 70.312 -1.326 18321 15911 1 12 . 1 1 233 233 THR H H 233 8.096 8.096 8.011 0.085 18321 15912 1 12 . 1 1 234 234 GLN N N 234 122.040 122.040 123.083 -1.043 18321 15913 1 12 . 1 1 234 234 GLN HA H 234 4.681 4.681 4.393 0.288 18321 15914 1 12 . 1 1 234 234 GLN C C 234 176.177 176.177 175.304 0.873 18321 15915 1 12 . 1 1 234 234 GLN CA C 234 55.861 55.861 55.790 0.071 18321 15916 1 12 . 1 1 234 234 GLN CB C 234 28.583 28.583 28.761 -0.178 18321 15917 1 12 . 1 1 234 234 GLN H H 234 8.256 8.256 8.649 -0.393 18321 15918 1 12 . 1 1 235 235 ASN N N 235 119.506 119.506 121.181 -1.675 18321 15919 1 12 . 1 1 235 235 ASN HA H 235 4.775 4.775 4.814 -0.039 18321 15920 1 12 . 1 1 235 235 ASN C C 235 174.974 174.974 175.496 -0.522 18321 15921 1 12 . 1 1 235 235 ASN CA C 235 53.191 53.191 53.366 -0.175 18321 15922 1 12 . 1 1 235 235 ASN CB C 235 38.511 38.511 39.710 -1.199 18321 15923 1 12 . 1 1 235 235 ASN H H 235 8.346 8.346 8.586 -0.240 18321 15924 1 12 . 1 1 236 236 GLY N N 236 109.378 109.378 111.183 -1.805 18321 15925 1 12 . 1 1 236 236 GLY CA C 236 44.023 44.023 44.058 -0.035 18321 15926 1 12 . 1 1 236 236 GLY H H 236 7.939 7.939 8.242 -0.303 18321 15927 1 12 . 1 1 237 237 PRO HA H 237 4.336 4.336 4.363 -0.027 18321 15928 1 12 . 1 1 237 237 PRO C C 237 175.942 175.942 175.641 0.301 18321 15929 1 12 . 1 1 237 237 PRO CA C 237 62.797 62.797 61.742 1.055 18321 15930 1 12 . 1 1 237 237 PRO CB C 237 27.421 27.421 32.423 -5.002 18321 15931 1 12 . 1 1 238 238 VAL N N 238 120.535 120.535 123.563 -3.028 18321 15932 1 12 . 1 1 238 238 VAL HA H 238 4.195 4.195 3.990 0.205 18321 15933 1 12 . 1 1 238 238 VAL C C 238 173.775 173.775 174.754 -0.979 18321 15934 1 12 . 1 1 238 238 VAL CA C 238 61.173 61.173 61.851 -0.678 18321 15935 1 12 . 1 1 238 238 VAL CB C 238 38.328 38.328 32.768 5.560 18321 15936 1 12 . 1 1 238 238 VAL H H 238 7.986 7.986 8.690 -0.704 18321 15937 1 12 . 1 1 239 239 PHE N N 239 123.522 123.522 127.516 -3.994 18321 15938 1 12 . 1 1 239 239 PHE HA H 239 5.539 5.539 4.795 0.744 18321 15939 1 12 . 1 1 239 239 PHE C C 239 174.207 174.207 174.503 -0.296 18321 15940 1 12 . 1 1 239 239 PHE CA C 239 56.993 56.993 56.749 0.244 18321 15941 1 12 . 1 1 239 239 PHE CB C 239 41.743 41.743 39.210 2.533 18321 15942 1 12 . 1 1 239 239 PHE H H 239 8.927 8.927 8.612 0.315 18321 15943 1 12 . 1 1 240 240 ALA N N 240 120.871 120.871 127.160 -6.289 18321 15944 1 12 . 1 1 240 240 ALA HA H 240 5.352 5.352 5.362 -0.010 18321 15945 1 12 . 1 1 240 240 ALA C C 240 174.639 174.639 175.891 -1.252 18321 15946 1 12 . 1 1 240 240 ALA CA C 240 49.736 49.736 50.111 -0.375 18321 15947 1 12 . 1 1 240 240 ALA CB C 240 23.480 23.480 21.984 1.496 18321 15948 1 12 . 1 1 240 240 ALA H H 240 9.398 9.398 8.657 0.741 18321 15949 1 12 . 1 1 241 241 LYS N N 241 121.227 121.227 126.019 -4.792 18321 15950 1 12 . 1 1 241 241 LYS HA H 241 5.373 5.373 5.303 0.070 18321 15951 1 12 . 1 1 241 241 LYS C C 241 176.772 176.772 176.069 0.703 18321 15952 1 12 . 1 1 241 241 LYS CA C 241 53.128 53.128 54.758 -1.630 18321 15953 1 12 . 1 1 241 241 LYS CB C 241 34.850 34.850 35.064 -0.214 18321 15954 1 12 . 1 1 241 241 LYS H H 241 8.947 8.947 8.497 0.450 18321 15955 1 12 . 1 1 242 242 ALA N N 242 126.833 126.833 130.314 -3.481 18321 15956 1 12 . 1 1 242 242 ALA HA H 242 4.764 4.764 4.701 0.063 18321 15957 1 12 . 1 1 242 242 ALA C C 242 178.506 178.506 177.846 0.660 18321 15958 1 12 . 1 1 242 242 ALA CA C 242 52.788 52.788 52.148 0.640 18321 15959 1 12 . 1 1 242 242 ALA CB C 242 19.084 19.084 19.077 0.007 18321 15960 1 12 . 1 1 242 242 ALA H H 242 9.373 9.373 8.745 0.628 18321 15961 1 12 . 1 1 243 243 ILE N N 243 118.731 118.731 119.502 -0.771 18321 15962 1 12 . 1 1 243 243 ILE HA H 243 4.454 4.454 4.373 0.081 18321 15963 1 12 . 1 1 243 243 ILE C C 243 174.773 174.773 176.158 -1.385 18321 15964 1 12 . 1 1 243 243 ILE CA C 243 60.613 60.613 62.124 -1.511 18321 15965 1 12 . 1 1 243 243 ILE CB C 243 39.232 39.232 39.112 0.120 18321 15966 1 12 . 1 1 243 243 ILE H H 243 8.933 8.933 8.669 0.264 18321 15967 1 12 . 1 1 244 244 GLN N N 244 121.616 121.616 120.161 1.455 18321 15968 1 12 . 1 1 244 244 GLN HA H 244 4.283 4.283 4.589 -0.306 18321 15969 1 12 . 1 1 244 244 GLN C C 244 172.815 172.815 174.472 -1.657 18321 15970 1 12 . 1 1 244 244 GLN CA C 244 54.750 54.750 54.377 0.373 18321 15971 1 12 . 1 1 244 244 GLN CB C 244 31.469 31.469 33.091 -1.622 18321 15972 1 12 . 1 1 244 244 GLN H H 244 7.438 7.438 7.979 -0.541 18321 15973 1 12 . 1 1 245 245 LYS N N 245 124.215 124.215 124.486 -0.271 18321 15974 1 12 . 1 1 245 245 LYS HA H 245 3.962 3.962 4.467 -0.505 18321 15975 1 12 . 1 1 245 245 LYS C C 245 175.679 175.679 176.952 -1.273 18321 15976 1 12 . 1 1 245 245 LYS CA C 245 56.413 56.413 57.585 -1.172 18321 15977 1 12 . 1 1 245 245 LYS CB C 245 32.847 32.847 33.085 -0.238 18321 15978 1 12 . 1 1 245 245 LYS H H 245 8.318 8.318 8.576 -0.258 18321 15979 1 12 . 1 1 246 246 ARG N N 246 127.327 127.327 123.303 4.024 18321 15980 1 12 . 1 1 246 246 ARG HA H 246 4.221 4.221 4.747 -0.526 18321 15981 1 12 . 1 1 246 246 ARG CA C 246 56.279 56.279 55.244 1.035 18321 15982 1 12 . 1 1 246 246 ARG CB C 246 32.987 32.987 31.627 1.360 18321 15983 1 12 . 1 1 246 246 ARG H H 246 9.248 9.248 8.656 0.592 18321 15984 1 12 . 1 1 249 249 CYS HA H 249 4.260 4.260 4.493 -0.233 18321 15985 1 12 . 1 1 249 249 CYS CA C 249 55.886 55.886 56.653 -0.767 18321 15986 1 12 . 1 1 249 249 CYS CB C 249 34.146 34.146 31.435 2.711 18321 15987 1 12 . 1 1 250 250 ALA HA H 250 3.926 3.926 3.896 0.030 18321 15988 1 12 . 1 1 250 250 ALA CA C 250 54.344 54.344 54.533 -0.189 18321 15989 1 12 . 1 1 250 250 ALA CB C 250 18.342 18.342 17.336 1.006 18321 15990 1 12 . 1 1 251 251 TYR N N 251 110.618 110.618 118.716 -8.098 18321 15991 1 12 . 1 1 251 251 TYR HA H 251 4.489 4.489 4.579 -0.090 18321 15992 1 12 . 1 1 251 251 TYR C C 251 175.286 175.286 176.383 -1.097 18321 15993 1 12 . 1 1 251 251 TYR CA C 251 56.137 56.137 57.803 -1.665 18321 15994 1 12 . 1 1 251 251 TYR CB C 251 37.203 37.203 38.999 -1.796 18321 15995 1 12 . 1 1 251 251 TYR H H 251 7.037 7.037 7.536 -0.499 18321 15996 1 12 . 1 1 252 252 ASP N N 252 121.835 121.835 117.605 4.230 18321 15997 1 12 . 1 1 252 252 ASP HA H 252 4.763 4.763 4.169 0.594 18321 15998 1 12 . 1 1 252 252 ASP CA C 252 52.351 52.351 55.487 -3.136 18321 15999 1 12 . 1 1 252 252 ASP CB C 252 39.995 39.995 39.499 0.495 18321 16000 1 12 . 1 1 252 252 ASP H H 252 7.339 7.339 7.628 -0.289 18321 16001 1 12 . 1 1 253 253 LYS N N 253 123.177 123.177 119.409 3.768 18321 16002 1 12 . 1 1 253 253 LYS HA H 253 4.270 4.270 4.523 -0.253 18321 16003 1 12 . 1 1 253 253 LYS C C 253 177.724 177.724 176.387 1.337 18321 16004 1 12 . 1 1 253 253 LYS CA C 253 57.036 57.036 55.553 1.483 18321 16005 1 12 . 1 1 253 253 LYS H H 253 8.396 8.396 8.305 0.091 18321 16006 1 12 . 1 1 254 254 THR N N 254 108.317 108.317 111.642 -3.325 18321 16007 1 12 . 1 1 254 254 THR HA H 254 4.517 4.517 4.018 0.499 18321 16008 1 12 . 1 1 254 254 THR C C 254 174.012 174.012 173.550 0.462 18321 16009 1 12 . 1 1 254 254 THR CA C 254 61.036 61.036 63.126 -2.090 18321 16010 1 12 . 1 1 254 254 THR CB C 254 69.307 69.307 68.461 0.846 18321 16011 1 12 . 1 1 254 254 THR H H 254 8.217 8.217 8.526 -0.309 18321 16012 1 12 . 1 1 255 255 ALA N N 255 124.762 124.762 123.437 1.325 18321 16013 1 12 . 1 1 255 255 ALA HA H 255 4.524 4.524 4.724 -0.200 18321 16014 1 12 . 1 1 255 255 ALA C C 255 176.630 176.630 176.709 -0.079 18321 16015 1 12 . 1 1 255 255 ALA CA C 255 51.352 51.352 50.643 0.709 18321 16016 1 12 . 1 1 255 255 ALA CB C 255 20.135 20.135 19.951 0.184 18321 16017 1 12 . 1 1 255 255 ALA H H 255 7.096 7.096 7.900 -0.804 18321 16018 1 12 . 1 1 256 256 LEU N N 256 124.379 124.379 124.679 -0.300 18321 16019 1 12 . 1 1 256 256 LEU HA H 256 4.328 4.328 4.425 -0.097 18321 16020 1 12 . 1 1 256 256 LEU C C 256 176.007 176.007 175.704 0.303 18321 16021 1 12 . 1 1 256 256 LEU CA C 256 53.502 53.502 54.160 -0.658 18321 16022 1 12 . 1 1 256 256 LEU CB C 256 44.665 44.665 43.805 0.860 18321 16023 1 12 . 1 1 256 256 LEU H H 256 8.889 8.889 8.468 0.421 18321 16024 1 12 . 1 1 257 257 ALA N N 257 129.619 129.619 129.548 0.071 18321 16025 1 12 . 1 1 257 257 ALA HA H 257 4.445 4.445 4.954 -0.509 18321 16026 1 12 . 1 1 257 257 ALA C C 257 176.813 176.813 176.856 -0.043 18321 16027 1 12 . 1 1 257 257 ALA CA C 257 51.179 51.179 51.158 0.021 18321 16028 1 12 . 1 1 257 257 ALA CB C 257 18.973 18.973 18.499 0.474 18321 16029 1 12 . 1 1 257 257 ALA H H 257 8.529 8.529 8.487 0.042 18321 16030 1 12 . 1 1 258 258 LEU N N 258 119.300 119.300 125.495 -6.195 18321 16031 1 12 . 1 1 258 258 LEU HA H 258 4.782 4.782 4.450 0.332 18321 16032 1 12 . 1 1 258 258 LEU CA C 258 53.259 53.259 54.166 -0.907 18321 16033 1 12 . 1 1 258 258 LEU CB C 258 45.972 45.972 43.532 2.440 18321 16034 1 12 . 1 1 258 258 LEU H H 258 8.505 8.505 8.568 -0.063 18321 16035 1 12 . 1 1 259 259 GLU N N 259 123.919 123.919 124.131 -0.212 18321 16036 1 12 . 1 1 259 259 GLU HA H 259 4.516 4.516 4.540 -0.024 18321 16037 1 12 . 1 1 259 259 GLU C C 259 175.795 175.795 175.408 0.387 18321 16038 1 12 . 1 1 259 259 GLU CA C 259 52.896 52.896 54.201 -1.305 18321 16039 1 12 . 1 1 259 259 GLU H H 259 8.943 8.943 8.697 0.246 18321 16040 1 12 . 1 1 260 260 VAL N N 260 122.122 122.122 123.562 -1.440 18321 16041 1 12 . 1 1 260 260 VAL HA H 260 2.923 2.923 4.008 -1.085 18321 16042 1 12 . 1 1 260 260 VAL C C 260 177.964 177.964 177.230 0.734 18321 16043 1 12 . 1 1 260 260 VAL CA C 260 65.417 65.417 64.362 1.055 18321 16044 1 12 . 1 1 260 260 VAL CB C 260 30.668 30.668 31.428 -0.760 18321 16045 1 12 . 1 1 260 260 VAL H H 260 8.956 8.956 8.655 0.301 18321 16046 1 12 . 1 1 261 261 GLY N N 261 116.009 116.009 115.931 0.078 18321 16047 1 12 . 1 1 261 261 GLY C C 261 176.288 176.288 174.042 2.246 18321 16048 1 12 . 1 1 261 261 GLY CA C 261 44.210 44.210 44.788 -0.578 18321 16049 1 12 . 1 1 261 261 GLY H H 261 8.799 8.799 9.292 -0.493 18321 16050 1 12 . 1 1 262 262 ASP N N 262 121.945 121.945 121.279 0.666 18321 16051 1 12 . 1 1 262 262 ASP HA H 262 4.423 4.423 4.970 -0.547 18321 16052 1 12 . 1 1 262 262 ASP C C 262 175.381 175.381 174.656 0.725 18321 16053 1 12 . 1 1 262 262 ASP CA C 262 55.243 55.243 53.592 1.651 18321 16054 1 12 . 1 1 262 262 ASP CB C 262 41.819 41.819 42.738 -0.919 18321 16055 1 12 . 1 1 262 262 ASP H H 262 8.180 8.180 7.849 0.331 18321 16056 1 12 . 1 1 263 263 ILE N N 263 121.452 121.452 120.839 0.613 18321 16057 1 12 . 1 1 263 263 ILE HA H 263 4.707 4.707 4.709 -0.002 18321 16058 1 12 . 1 1 263 263 ILE C C 263 174.996 174.996 176.116 -1.120 18321 16059 1 12 . 1 1 263 263 ILE CA C 263 59.289 59.289 59.226 0.063 18321 16060 1 12 . 1 1 263 263 ILE CB C 263 36.987 36.987 38.651 -1.664 18321 16061 1 12 . 1 1 263 263 ILE H H 263 8.460 8.460 8.528 -0.068 18321 16062 1 12 . 1 1 264 264 VAL N N 264 128.756 128.756 127.764 0.992 18321 16063 1 12 . 1 1 264 264 VAL HA H 264 4.309 4.309 4.172 0.137 18321 16064 1 12 . 1 1 264 264 VAL C C 264 175.486 175.486 174.986 0.500 18321 16065 1 12 . 1 1 264 264 VAL CA C 264 59.091 59.091 61.335 -2.244 18321 16066 1 12 . 1 1 264 264 VAL CB C 264 34.541 34.541 32.175 2.366 18321 16067 1 12 . 1 1 264 264 VAL H H 264 9.479 9.479 9.190 0.289 18321 16068 1 12 . 1 1 265 265 LYS N N 265 128.101 128.101 129.445 -1.344 18321 16069 1 12 . 1 1 265 265 LYS HA H 265 4.342 4.342 4.110 0.232 18321 16070 1 12 . 1 1 265 265 LYS C C 265 175.531 175.531 175.035 0.496 18321 16071 1 12 . 1 1 265 265 LYS CA C 265 55.620 55.620 56.295 -0.676 18321 16072 1 12 . 1 1 265 265 LYS CB C 265 33.149 33.149 31.565 1.584 18321 16073 1 12 . 1 1 265 265 LYS H H 265 8.715 8.715 8.662 0.053 18321 16074 1 12 . 1 1 266 266 VAL N N 266 129.537 129.537 126.640 2.897 18321 16075 1 12 . 1 1 266 266 VAL HA H 266 4.333 4.333 4.414 -0.081 18321 16076 1 12 . 1 1 266 266 VAL C C 266 176.166 176.166 175.148 1.018 18321 16077 1 12 . 1 1 266 266 VAL CA C 266 63.339 63.339 60.985 2.354 18321 16078 1 12 . 1 1 266 266 VAL CB C 266 30.712 30.712 33.967 -3.255 18321 16079 1 12 . 1 1 266 266 VAL H H 266 9.073 9.073 8.184 0.889 18321 16080 1 12 . 1 1 267 267 THR N N 267 120.020 120.020 122.416 -2.396 18321 16081 1 12 . 1 1 267 267 THR HA H 267 4.189 4.189 4.498 -0.309 18321 16082 1 12 . 1 1 267 267 THR C C 267 176.054 176.054 174.977 1.077 18321 16083 1 12 . 1 1 267 267 THR CA C 267 62.204 62.204 62.046 0.158 18321 16084 1 12 . 1 1 267 267 THR CB C 267 68.200 68.200 69.635 -1.435 18321 16085 1 12 . 1 1 267 267 THR H H 267 9.130 9.130 8.308 0.822 18321 16086 1 12 . 1 1 268 268 ARG N N 268 120.839 120.839 123.427 -2.588 18321 16087 1 12 . 1 1 268 268 ARG HA H 268 4.236 4.236 4.660 -0.424 18321 16088 1 12 . 1 1 268 268 ARG CA C 268 56.321 56.321 54.728 1.593 18321 16089 1 12 . 1 1 268 268 ARG CB C 268 33.049 33.049 30.808 2.241 18321 16090 1 12 . 1 1 268 268 ARG H H 268 7.631 7.631 7.537 0.094 18321 16091 1 12 . 1 1 269 269 MET N N 269 125.443 125.443 123.417 2.026 18321 16092 1 12 . 1 1 269 269 MET C C 269 174.392 174.392 175.590 -1.198 18321 16093 1 12 . 1 1 269 269 MET H H 269 8.532 8.532 8.629 -0.097 18321 16094 1 12 . 1 1 270 270 ASN N N 270 119.125 119.125 123.664 -4.539 18321 16095 1 12 . 1 1 270 270 ASN HA H 270 4.546 4.546 4.731 -0.185 18321 16096 1 12 . 1 1 270 270 ASN C C 270 172.133 172.133 176.433 -4.300 18321 16097 1 12 . 1 1 270 270 ASN CA C 270 53.639 53.639 54.404 -0.765 18321 16098 1 12 . 1 1 270 270 ASN CB C 270 39.845 39.845 38.757 1.088 18321 16099 1 12 . 1 1 270 270 ASN H H 270 6.631 6.631 9.346 -2.715 18321 16100 1 12 . 1 1 271 271 ILE N N 271 122.532 122.532 114.645 7.887 18321 16101 1 12 . 1 1 271 271 ILE HA H 271 4.417 4.417 3.797 0.620 18321 16102 1 12 . 1 1 271 271 ILE CA C 271 63.348 63.348 63.895 -0.547 18321 16103 1 12 . 1 1 271 271 ILE CB C 271 38.198 38.198 35.851 2.347 18321 16104 1 12 . 1 1 271 271 ILE H H 271 8.565 8.565 8.588 -0.023 18321 16105 1 12 . 1 1 272 272 ASN HA H 272 4.527 4.527 4.580 -0.053 18321 16106 1 12 . 1 1 272 272 ASN C C 272 176.259 176.259 176.554 -0.295 18321 16107 1 12 . 1 1 272 272 ASN CA C 272 53.225 53.225 55.549 -2.324 18321 16108 1 12 . 1 1 272 272 ASN CB C 272 37.565 37.565 38.902 -1.337 18321 16109 1 12 . 1 1 273 273 GLY N N 273 107.043 107.043 106.053 0.990 18321 16110 1 12 . 1 1 273 273 GLY C C 273 173.216 173.216 172.560 0.656 18321 16111 1 12 . 1 1 273 273 GLY CA C 273 45.299 45.299 44.926 0.373 18321 16112 1 12 . 1 1 273 273 GLY H H 273 8.086 8.086 8.199 -0.113 18321 16113 1 12 . 1 1 274 274 GLN N N 274 120.624 120.624 120.755 -0.131 18321 16114 1 12 . 1 1 274 274 GLN HA H 274 4.551 4.551 4.414 0.137 18321 16115 1 12 . 1 1 274 274 GLN C C 274 175.039 175.039 174.947 0.092 18321 16116 1 12 . 1 1 274 274 GLN CA C 274 54.556 54.556 54.471 0.085 18321 16117 1 12 . 1 1 274 274 GLN CB C 274 33.698 33.698 29.616 4.082 18321 16118 1 12 . 1 1 274 274 GLN H H 274 8.045 8.045 8.037 0.009 18321 16119 1 12 . 1 1 275 275 TRP N N 275 125.596 125.596 124.267 1.329 18321 16120 1 12 . 1 1 275 275 TRP HA H 275 4.588 4.588 4.811 -0.223 18321 16121 1 12 . 1 1 275 275 TRP C C 275 172.832 172.832 175.296 -2.464 18321 16122 1 12 . 1 1 275 275 TRP CA C 275 55.296 55.296 54.086 1.210 18321 16123 1 12 . 1 1 275 275 TRP CB C 275 31.393 31.393 31.885 -0.492 18321 16124 1 12 . 1 1 275 275 TRP H H 275 8.484 8.484 8.441 0.043 18321 16125 1 12 . 1 1 276 276 GLU N N 276 119.012 119.012 120.980 -1.968 18321 16126 1 12 . 1 1 276 276 GLU HA H 276 5.190 5.190 5.059 0.131 18321 16127 1 12 . 1 1 276 276 GLU C C 276 176.553 176.553 175.646 0.907 18321 16128 1 12 . 1 1 276 276 GLU CA C 276 54.288 54.288 55.075 -0.787 18321 16129 1 12 . 1 1 276 276 GLU CB C 276 32.851 32.851 31.310 1.541 18321 16130 1 12 . 1 1 276 276 GLU H H 276 8.643 8.643 9.052 -0.409 18321 16131 1 12 . 1 1 277 277 GLY N N 277 111.364 111.364 113.106 -1.742 18321 16132 1 12 . 1 1 277 277 GLY C C 277 170.707 170.707 172.862 -2.155 18321 16133 1 12 . 1 1 277 277 GLY CA C 277 46.723 46.723 43.899 2.824 18321 16134 1 12 . 1 1 277 277 GLY H H 277 9.072 9.072 8.387 0.685 18321 16135 1 12 . 1 1 278 278 GLU N N 278 117.733 117.733 123.559 -5.826 18321 16136 1 12 . 1 1 278 278 GLU HA H 278 5.748 5.748 4.966 0.782 18321 16137 1 12 . 1 1 278 278 GLU C C 278 176.051 176.051 175.404 0.647 18321 16138 1 12 . 1 1 278 278 GLU CA C 278 53.620 53.620 54.893 -1.273 18321 16139 1 12 . 1 1 278 278 GLU CB C 278 33.742 33.742 30.580 3.162 18321 16140 1 12 . 1 1 278 278 GLU H H 278 8.810 8.810 8.425 0.385 18321 16141 1 12 . 1 1 279 279 VAL N N 279 123.834 123.834 125.958 -2.124 18321 16142 1 12 . 1 1 279 279 VAL HA H 279 4.404 4.404 4.354 0.050 18321 16143 1 12 . 1 1 279 279 VAL C C 279 175.289 175.289 175.806 -0.517 18321 16144 1 12 . 1 1 279 279 VAL CA C 279 61.166 61.166 59.912 1.254 18321 16145 1 12 . 1 1 279 279 VAL CB C 279 34.123 34.123 32.788 1.335 18321 16146 1 12 . 1 1 279 279 VAL H H 279 8.887 8.887 8.849 0.038 18321 16147 1 12 . 1 1 280 280 ASN N N 280 126.025 126.025 127.140 -1.115 18321 16148 1 12 . 1 1 280 280 ASN HA H 280 4.435 4.435 4.431 0.004 18321 16149 1 12 . 1 1 280 280 ASN C C 280 175.205 175.205 175.491 -0.286 18321 16150 1 12 . 1 1 280 280 ASN CA C 280 45.615 45.615 54.202 -8.587 18321 16151 1 12 . 1 1 280 280 ASN CB C 280 37.386 37.386 37.612 -0.226 18321 16152 1 12 . 1 1 280 280 ASN H H 280 9.322 9.322 9.383 -0.061 18321 16153 1 12 . 1 1 281 281 GLY N N 281 104.588 104.588 103.673 0.915 18321 16154 1 12 . 1 1 281 281 GLY C C 281 173.944 173.944 173.394 0.550 18321 16155 1 12 . 1 1 281 281 GLY CA C 281 45.224 45.224 44.825 0.399 18321 16156 1 12 . 1 1 281 281 GLY H H 281 8.768 8.768 8.095 0.673 18321 16157 1 12 . 1 1 282 282 ARG N N 282 122.567 122.567 123.596 -1.029 18321 16158 1 12 . 1 1 282 282 ARG HA H 282 4.559 4.559 4.647 -0.088 18321 16159 1 12 . 1 1 282 282 ARG C C 282 174.350 174.350 174.436 -0.086 18321 16160 1 12 . 1 1 282 282 ARG CA C 282 54.933 54.933 54.849 0.084 18321 16161 1 12 . 1 1 282 282 ARG CB C 282 31.765 31.765 32.411 -0.646 18321 16162 1 12 . 1 1 282 282 ARG H H 282 8.149 8.149 7.917 0.232 18321 16163 1 12 . 1 1 283 283 LYS N N 283 121.565 121.565 125.581 -4.016 18321 16164 1 12 . 1 1 283 283 LYS HA H 283 5.584 5.584 5.454 0.130 18321 16165 1 12 . 1 1 283 283 LYS CA C 283 54.143 54.143 55.308 -1.165 18321 16166 1 12 . 1 1 283 283 LYS CB C 283 36.040 36.040 34.103 1.937 18321 16167 1 12 . 1 1 283 283 LYS H H 283 8.424 8.424 8.694 -0.270 18321 16168 1 12 . 1 1 284 284 GLY C C 284 173.006 173.006 172.223 0.783 18321 16169 1 12 . 1 1 284 284 GLY CA C 284 45.886 45.886 44.888 0.998 18321 16170 1 12 . 1 1 285 285 LEU N N 285 119.673 119.673 122.645 -2.972 18321 16171 1 12 . 1 1 285 285 LEU HA H 285 5.718 5.718 5.633 0.085 18321 16172 1 12 . 1 1 285 285 LEU C C 285 178.657 178.657 176.272 2.385 18321 16173 1 12 . 1 1 285 285 LEU CA C 285 53.656 53.656 54.105 -0.449 18321 16174 1 12 . 1 1 285 285 LEU CB C 285 44.813 44.813 42.498 2.315 18321 16175 1 12 . 1 1 285 285 LEU H H 285 8.734 8.734 8.321 0.413 18321 16176 1 12 . 1 1 286 286 PHE N N 286 118.785 118.785 121.702 -2.917 18321 16177 1 12 . 1 1 286 286 PHE HA H 286 4.521 4.521 5.061 -0.540 18321 16178 1 12 . 1 1 286 286 PHE CA C 286 57.592 57.592 53.775 3.817 18321 16179 1 12 . 1 1 286 286 PHE CB C 286 40.669 40.669 39.771 0.898 18321 16180 1 12 . 1 1 286 286 PHE H H 286 9.120 9.120 8.807 0.313 18321 16181 1 12 . 1 1 287 287 PRO HA H 287 4.385 4.385 4.603 -0.218 18321 16182 1 12 . 1 1 287 287 PRO CA C 287 62.814 62.814 62.050 0.764 18321 16183 1 12 . 1 1 287 287 PRO CB C 287 32.133 32.133 31.730 0.403 18321 16184 1 12 . 1 1 288 288 PHE C C 288 174.837 174.837 176.633 -1.796 18321 16185 1 12 . 1 1 288 288 PHE CA C 288 59.020 59.020 60.672 -1.652 18321 16186 1 12 . 1 1 288 288 PHE CB C 288 34.987 34.987 37.163 -2.176 18321 16187 1 12 . 1 1 289 289 THR N N 289 107.865 107.865 110.967 -3.102 18321 16188 1 12 . 1 1 289 289 THR HA H 289 3.589 3.589 3.922 -0.333 18321 16189 1 12 . 1 1 289 289 THR C C 289 176.125 176.125 174.881 1.244 18321 16190 1 12 . 1 1 289 289 THR CA C 289 62.243 62.243 63.837 -1.594 18321 16191 1 12 . 1 1 289 289 THR CB C 289 69.365 69.365 67.573 1.792 18321 16192 1 12 . 1 1 289 289 THR H H 289 6.453 6.453 7.527 -1.074 18321 16193 1 12 . 1 1 290 290 HIS N N 290 119.462 119.462 118.763 0.699 18321 16194 1 12 . 1 1 290 290 HIS HA H 290 4.196 4.196 4.780 -0.584 18321 16195 1 12 . 1 1 290 290 HIS C C 290 175.165 175.165 173.999 1.166 18321 16196 1 12 . 1 1 290 290 HIS CA C 290 57.635 57.635 57.290 0.345 18321 16197 1 12 . 1 1 290 290 HIS CB C 290 29.840 29.840 32.075 -2.235 18321 16198 1 12 . 1 1 290 290 HIS H H 290 7.835 7.835 7.995 -0.160 18321 16199 1 12 . 1 1 291 291 VAL N N 291 110.050 110.050 113.376 -3.326 18321 16200 1 12 . 1 1 291 291 VAL HA H 291 5.445 5.445 5.273 0.172 18321 16201 1 12 . 1 1 291 291 VAL C C 291 173.386 173.386 174.885 -1.499 18321 16202 1 12 . 1 1 291 291 VAL CA C 291 57.794 57.794 58.748 -0.954 18321 16203 1 12 . 1 1 291 291 VAL CB C 291 35.784 35.784 35.411 0.373 18321 16204 1 12 . 1 1 291 291 VAL H H 291 7.562 7.562 7.640 -0.078 18321 16205 1 12 . 1 1 292 292 LYS N N 292 119.445 119.445 118.609 0.836 18321 16206 1 12 . 1 1 292 292 LYS HA H 292 4.857 4.857 4.839 0.018 18321 16207 1 12 . 1 1 292 292 LYS C C 292 176.512 176.512 175.727 0.785 18321 16208 1 12 . 1 1 292 292 LYS CA C 292 54.647 54.647 54.689 -0.042 18321 16209 1 12 . 1 1 292 292 LYS CB C 292 35.665 35.665 35.291 0.374 18321 16210 1 12 . 1 1 292 292 LYS H H 292 8.753 8.753 8.475 0.278 18321 16211 1 12 . 1 1 293 293 ILE N N 293 128.707 128.707 124.415 4.292 18321 16212 1 12 . 1 1 293 293 ILE HA H 293 4.509 4.509 4.287 0.222 18321 16213 1 12 . 1 1 293 293 ILE C C 293 175.666 175.666 176.573 -0.907 18321 16214 1 12 . 1 1 293 293 ILE CA C 293 62.563 62.563 60.749 1.814 18321 16215 1 12 . 1 1 293 293 ILE CB C 293 38.076 38.076 36.902 1.174 18321 16216 1 12 . 1 1 293 293 ILE H H 293 9.107 9.107 8.888 0.219 18321 16217 1 12 . 1 1 294 294 PHE N N 294 126.638 126.638 124.952 1.686 18321 16218 1 12 . 1 1 294 294 PHE HA H 294 4.898 4.898 4.919 -0.021 18321 16219 1 12 . 1 1 294 294 PHE C C 294 175.838 175.838 173.118 2.720 18321 16220 1 12 . 1 1 294 294 PHE CA C 294 56.335 56.335 56.367 -0.032 18321 16221 1 12 . 1 1 294 294 PHE CB C 294 41.196 41.196 41.545 -0.349 18321 16222 1 12 . 1 1 294 294 PHE H H 294 8.716 8.716 8.020 0.696 18321 16223 1 12 . 1 1 295 295 ASP N N 295 122.961 122.961 121.765 1.196 18321 16224 1 12 . 1 1 295 295 ASP HA H 295 5.003 5.003 4.963 0.040 18321 16225 1 12 . 1 1 295 295 ASP CA C 295 50.602 50.602 50.652 -0.050 18321 16226 1 12 . 1 1 295 295 ASP CB C 295 40.754 40.754 42.473 -1.719 18321 16227 1 12 . 1 1 295 295 ASP H H 295 8.418 8.418 8.520 -0.102 18321 16228 1 12 . 1 1 296 296 PRO HA H 296 4.524 4.524 4.459 0.065 18321 16229 1 12 . 1 1 296 296 PRO C C 296 176.807 176.807 176.379 0.428 18321 16230 1 12 . 1 1 296 296 PRO CA C 296 62.987 62.987 64.093 -1.106 18321 16231 1 12 . 1 1 296 296 PRO CB C 296 32.033 32.033 32.200 -0.167 18321 16232 1 12 . 1 1 297 297 GLN N N 297 120.729 120.729 118.616 2.113 18321 16233 1 12 . 1 1 297 297 GLN HA H 297 4.274 4.274 4.525 -0.251 18321 16234 1 12 . 1 1 297 297 GLN CA C 297 56.427 56.427 54.184 2.243 18321 16235 1 12 . 1 1 297 297 GLN CB C 297 28.819 28.819 30.337 -1.518 18321 16236 1 12 . 1 1 297 297 GLN H H 297 8.551 8.551 8.110 0.441 18321 16237 1 12 . 1 1 299 299 PRO C C 299 176.936 176.936 176.397 0.539 18321 16238 1 12 . 1 1 299 299 PRO CA C 299 63.406 63.406 63.100 0.306 18321 16239 1 12 . 1 1 299 299 PRO CB C 299 31.421 31.421 32.194 -0.773 18321 16240 1 12 . 1 1 300 300 ASP N N 300 119.609 119.609 117.403 2.206 18321 16241 1 12 . 1 1 300 300 ASP C C 300 176.344 176.344 176.199 0.145 18321 16242 1 12 . 1 1 300 300 ASP CA C 300 54.178 54.178 55.119 -0.941 18321 16243 1 12 . 1 1 300 300 ASP CB C 300 40.661 40.661 40.930 -0.269 18321 16244 1 12 . 1 1 300 300 ASP H H 300 8.239 8.239 8.105 0.134 18321 16245 1 12 . 1 1 301 301 GLU N N 301 120.462 120.462 117.793 2.669 18321 16246 1 12 . 1 1 301 301 GLU CA C 301 56.188 56.188 56.676 -0.488 18321 16247 1 12 . 1 1 301 301 GLU CB C 301 29.507 29.507 30.287 -0.780 18321 16248 1 12 . 1 1 301 301 GLU H H 301 8.084 8.084 8.704 -0.620 18321 16249 1 13 . 1 1 2 2 SER HA H 2 4.521 4.521 4.803 -0.282 18321 16250 1 13 . 1 1 2 2 SER CA C 2 58.326 58.326 58.031 0.296 18321 16251 1 13 . 1 1 2 2 SER CB C 2 64.062 64.062 64.978 -0.916 18321 16252 1 13 . 1 1 3 3 SER HA H 3 4.465 4.465 4.177 0.288 18321 16253 1 13 . 1 1 3 3 SER C C 3 173.887 173.887 174.903 -1.016 18321 16254 1 13 . 1 1 3 3 SER CA C 3 58.374 58.374 59.663 -1.289 18321 16255 1 13 . 1 1 3 3 SER CB C 3 63.920 63.920 63.325 0.595 18321 16256 1 13 . 1 1 4 4 ALA N N 4 124.755 124.755 125.631 -0.876 18321 16257 1 13 . 1 1 4 4 ALA HA H 4 4.547 4.547 4.429 0.118 18321 16258 1 13 . 1 1 4 4 ALA CA C 4 52.737 52.737 52.505 0.232 18321 16259 1 13 . 1 1 4 4 ALA CB C 4 19.636 19.636 18.299 1.337 18321 16260 1 13 . 1 1 4 4 ALA H H 4 8.244 8.244 8.112 0.132 18321 16261 1 13 . 1 1 5 5 ARG N N 5 120.383 120.383 123.694 -3.311 18321 16262 1 13 . 1 1 5 5 ARG HA H 5 4.524 4.524 4.675 -0.151 18321 16263 1 13 . 1 1 5 5 ARG C C 5 175.611 175.611 174.498 1.113 18321 16264 1 13 . 1 1 5 5 ARG CA C 5 56.082 56.082 55.362 0.720 18321 16265 1 13 . 1 1 5 5 ARG CB C 5 30.695 30.695 31.139 -0.444 18321 16266 1 13 . 1 1 5 5 ARG H H 5 8.727 8.727 8.229 0.498 18321 16267 1 13 . 1 1 6 6 PHE N N 6 115.159 115.159 120.481 -5.322 18321 16268 1 13 . 1 1 6 6 PHE HA H 6 4.786 4.786 4.804 -0.018 18321 16269 1 13 . 1 1 6 6 PHE C C 6 172.076 172.076 173.810 -1.734 18321 16270 1 13 . 1 1 6 6 PHE CA C 6 56.640 56.640 55.545 1.095 18321 16271 1 13 . 1 1 6 6 PHE CB C 6 40.378 40.378 40.977 -0.599 18321 16272 1 13 . 1 1 6 6 PHE H H 6 7.536 7.536 7.687 -0.151 18321 16273 1 13 . 1 1 7 7 ASP N N 7 121.846 121.846 122.264 -0.418 18321 16274 1 13 . 1 1 7 7 ASP HA H 7 4.846 4.846 4.775 0.071 18321 16275 1 13 . 1 1 7 7 ASP CA C 7 52.327 52.327 53.706 -1.379 18321 16276 1 13 . 1 1 7 7 ASP CB C 7 41.298 41.298 41.928 -0.630 18321 16277 1 13 . 1 1 7 7 ASP H H 7 9.062 9.062 8.735 0.327 18321 16278 1 13 . 1 1 8 8 SER HA H 8 3.950 3.950 4.396 -0.446 18321 16279 1 13 . 1 1 8 8 SER C C 8 174.705 174.705 175.354 -0.649 18321 16280 1 13 . 1 1 8 8 SER CA C 8 61.937 61.937 60.276 1.661 18321 16281 1 13 . 1 1 8 8 SER CB C 8 62.260 62.260 63.318 -1.058 18321 16282 1 13 . 1 1 9 9 SER N N 9 114.373 114.373 114.843 -0.470 18321 16283 1 13 . 1 1 9 9 SER HA H 9 4.529 4.529 4.674 -0.145 18321 16284 1 13 . 1 1 9 9 SER C C 9 175.089 175.089 173.471 1.618 18321 16285 1 13 . 1 1 9 9 SER CA C 9 59.851 59.851 58.292 1.559 18321 16286 1 13 . 1 1 9 9 SER CB C 9 64.246 64.246 63.852 0.394 18321 16287 1 13 . 1 1 9 9 SER H H 9 8.722 8.722 9.029 -0.307 18321 16288 1 13 . 1 1 10 10 ASP N N 10 121.818 121.818 123.760 -1.942 18321 16289 1 13 . 1 1 10 10 ASP HA H 10 4.730 4.730 4.604 0.126 18321 16290 1 13 . 1 1 10 10 ASP C C 10 174.455 174.455 177.079 -2.624 18321 16291 1 13 . 1 1 10 10 ASP CA C 10 52.432 52.432 54.016 -1.584 18321 16292 1 13 . 1 1 10 10 ASP CB C 10 39.607 39.607 40.929 -1.322 18321 16293 1 13 . 1 1 10 10 ASP H H 10 7.600 7.600 7.897 -0.297 18321 16294 1 13 . 1 1 11 11 ARG N N 11 125.238 125.238 125.642 -0.404 18321 16295 1 13 . 1 1 11 11 ARG HA H 11 1.936 1.936 2.860 -0.924 18321 16296 1 13 . 1 1 11 11 ARG C C 11 176.916 176.916 177.614 -0.698 18321 16297 1 13 . 1 1 11 11 ARG CA C 11 57.451 57.451 57.644 -0.193 18321 16298 1 13 . 1 1 11 11 ARG CB C 11 43.014 43.014 29.120 13.894 18321 16299 1 13 . 1 1 11 11 ARG H H 11 7.739 7.739 8.030 -0.291 18321 16300 1 13 . 1 1 12 12 SER N N 12 112.065 112.065 111.842 0.223 18321 16301 1 13 . 1 1 12 12 SER HA H 12 4.695 4.695 4.160 0.535 18321 16302 1 13 . 1 1 12 12 SER C C 12 175.092 175.092 174.590 0.502 18321 16303 1 13 . 1 1 12 12 SER CA C 12 60.785 60.785 59.478 1.307 18321 16304 1 13 . 1 1 12 12 SER CB C 12 62.889 62.889 62.530 0.359 18321 16305 1 13 . 1 1 12 12 SER H H 12 7.888 7.888 8.142 -0.254 18321 16306 1 13 . 1 1 13 13 ALA N N 13 122.249 122.249 122.014 0.235 18321 16307 1 13 . 1 1 13 13 ALA HA H 13 4.216 4.216 4.471 -0.255 18321 16308 1 13 . 1 1 13 13 ALA C C 13 178.069 178.069 177.414 0.655 18321 16309 1 13 . 1 1 13 13 ALA CA C 13 53.562 53.562 53.526 0.036 18321 16310 1 13 . 1 1 13 13 ALA CB C 13 19.339 19.339 19.730 -0.391 18321 16311 1 13 . 1 1 13 13 ALA H H 13 7.418 7.418 7.686 -0.268 18321 16312 1 13 . 1 1 14 14 TRP N N 14 107.433 107.433 111.782 -4.349 18321 16313 1 13 . 1 1 14 14 TRP HA H 14 4.785 4.785 4.638 0.147 18321 16314 1 13 . 1 1 14 14 TRP C C 14 175.286 175.286 175.703 -0.417 18321 16315 1 13 . 1 1 14 14 TRP CA C 14 55.212 55.212 55.122 0.090 18321 16316 1 13 . 1 1 14 14 TRP CB C 14 32.776 32.776 30.905 1.871 18321 16317 1 13 . 1 1 14 14 TRP H H 14 6.273 6.273 6.723 -0.450 18321 16318 1 13 . 1 1 15 15 TYR N N 15 122.315 122.315 124.445 -2.130 18321 16319 1 13 . 1 1 15 15 TYR HA H 15 5.436 5.436 5.038 0.398 18321 16320 1 13 . 1 1 15 15 TYR C C 15 175.325 175.325 175.264 0.061 18321 16321 1 13 . 1 1 15 15 TYR CA C 15 56.609 56.609 57.831 -1.222 18321 16322 1 13 . 1 1 15 15 TYR CB C 15 36.940 36.940 38.941 -2.001 18321 16323 1 13 . 1 1 15 15 TYR H H 15 8.221 8.221 7.889 0.332 18321 16324 1 13 . 1 1 16 16 MET N N 16 126.031 126.031 126.331 -0.300 18321 16325 1 13 . 1 1 16 16 MET HA H 16 4.462 4.462 4.485 -0.023 18321 16326 1 13 . 1 1 16 16 MET CA C 16 53.046 53.046 53.333 -0.287 18321 16327 1 13 . 1 1 16 16 MET CB C 16 41.114 41.114 32.076 9.038 18321 16328 1 13 . 1 1 16 16 MET H H 16 8.989 8.989 8.885 0.104 18321 16329 1 13 . 1 1 17 17 GLY CA C 17 45.803 45.803 45.526 0.277 18321 16330 1 13 . 1 1 18 18 PRO HA H 18 4.675 4.675 4.443 0.232 18321 16331 1 13 . 1 1 18 18 PRO C C 18 175.943 175.943 175.484 0.459 18321 16332 1 13 . 1 1 18 18 PRO CA C 18 63.647 63.647 63.367 0.280 18321 16333 1 13 . 1 1 18 18 PRO CB C 18 29.276 29.276 30.439 -1.163 18321 16334 1 13 . 1 1 19 19 VAL N N 19 126.159 126.159 123.118 3.041 18321 16335 1 13 . 1 1 19 19 VAL HA H 19 4.011 4.011 4.316 -0.305 18321 16336 1 13 . 1 1 19 19 VAL C C 19 175.812 175.812 174.904 0.908 18321 16337 1 13 . 1 1 19 19 VAL CA C 19 62.355 62.355 60.434 1.921 18321 16338 1 13 . 1 1 19 19 VAL CB C 19 33.468 33.468 35.742 -2.274 18321 16339 1 13 . 1 1 19 19 VAL H H 19 7.851 7.851 7.937 -0.086 18321 16340 1 13 . 1 1 20 20 SER N N 20 123.950 123.950 117.715 6.235 18321 16341 1 13 . 1 1 20 20 SER HA H 20 4.453 4.453 4.956 -0.503 18321 16342 1 13 . 1 1 20 20 SER CA C 20 57.631 57.631 56.712 0.919 18321 16343 1 13 . 1 1 20 20 SER CB C 20 65.951 65.951 66.265 -0.314 18321 16344 1 13 . 1 1 20 20 SER H H 20 8.800 8.800 8.307 0.493 18321 16345 1 13 . 1 1 21 21 ARG N N 21 123.461 123.461 122.608 0.853 18321 16346 1 13 . 1 1 21 21 ARG HA H 21 3.489 3.489 4.018 -0.529 18321 16347 1 13 . 1 1 21 21 ARG C C 21 178.164 178.164 178.177 -0.013 18321 16348 1 13 . 1 1 21 21 ARG CA C 21 60.025 60.025 60.497 -0.472 18321 16349 1 13 . 1 1 21 21 ARG CB C 21 30.334 30.334 30.095 0.239 18321 16350 1 13 . 1 1 21 21 ARG H H 21 9.307 9.307 8.877 0.430 18321 16351 1 13 . 1 1 22 22 GLN N N 22 116.591 116.591 118.140 -1.549 18321 16352 1 13 . 1 1 22 22 GLN HA H 22 4.008 4.008 4.105 -0.097 18321 16353 1 13 . 1 1 22 22 GLN CA C 22 59.095 59.095 59.452 -0.356 18321 16354 1 13 . 1 1 22 22 GLN CB C 22 29.249 29.249 27.783 1.466 18321 16355 1 13 . 1 1 22 22 GLN H H 22 8.394 8.394 8.725 -0.331 18321 16356 1 13 . 1 1 23 23 GLU N N 23 122.191 122.191 119.678 2.513 18321 16357 1 13 . 1 1 23 23 GLU HA H 23 4.037 4.037 4.010 0.027 18321 16358 1 13 . 1 1 23 23 GLU C C 23 178.986 178.986 178.717 0.269 18321 16359 1 13 . 1 1 23 23 GLU CA C 23 59.081 59.081 58.959 0.122 18321 16360 1 13 . 1 1 23 23 GLU CB C 23 31.896 31.896 29.142 2.753 18321 16361 1 13 . 1 1 23 23 GLU H H 23 8.106 8.106 8.540 -0.434 18321 16362 1 13 . 1 1 24 24 ALA N N 24 121.964 121.964 121.627 0.337 18321 16363 1 13 . 1 1 24 24 ALA HA H 24 3.762 3.762 3.916 -0.154 18321 16364 1 13 . 1 1 24 24 ALA C C 24 178.653 178.653 179.244 -0.591 18321 16365 1 13 . 1 1 24 24 ALA CA C 24 55.480 55.480 55.373 0.107 18321 16366 1 13 . 1 1 24 24 ALA CB C 24 18.049 18.049 18.437 -0.388 18321 16367 1 13 . 1 1 24 24 ALA H H 24 8.732 8.732 8.375 0.357 18321 16368 1 13 . 1 1 25 25 GLN N N 25 116.229 116.229 117.358 -1.129 18321 16369 1 13 . 1 1 25 25 GLN HA H 25 3.950 3.950 4.067 -0.117 18321 16370 1 13 . 1 1 25 25 GLN C C 25 177.442 177.442 178.718 -1.276 18321 16371 1 13 . 1 1 25 25 GLN CA C 25 59.651 59.651 58.532 1.119 18321 16372 1 13 . 1 1 25 25 GLN CB C 25 29.308 29.308 28.709 0.599 18321 16373 1 13 . 1 1 25 25 GLN H H 25 8.391 8.391 7.925 0.466 18321 16374 1 13 . 1 1 26 26 THR N N 26 115.105 115.105 115.283 -0.178 18321 16375 1 13 . 1 1 26 26 THR HA H 26 3.920 3.920 4.187 -0.267 18321 16376 1 13 . 1 1 26 26 THR C C 26 176.835 176.835 176.904 -0.069 18321 16377 1 13 . 1 1 26 26 THR CA C 26 66.335 66.335 64.331 2.004 18321 16378 1 13 . 1 1 26 26 THR CB C 26 68.876 68.876 68.779 0.096 18321 16379 1 13 . 1 1 26 26 THR H H 26 8.223 8.223 7.837 0.386 18321 16380 1 13 . 1 1 27 27 ARG N N 27 119.096 119.096 119.196 -0.100 18321 16381 1 13 . 1 1 27 27 ARG HA H 27 4.047 4.047 4.305 -0.258 18321 16382 1 13 . 1 1 27 27 ARG C C 27 177.245 177.245 176.157 1.088 18321 16383 1 13 . 1 1 27 27 ARG CA C 27 58.528 58.528 57.746 0.782 18321 16384 1 13 . 1 1 27 27 ARG CB C 27 30.184 30.184 30.639 -0.455 18321 16385 1 13 . 1 1 27 27 ARG H H 27 8.093 8.093 7.645 0.448 18321 16386 1 13 . 1 1 28 28 LEU N N 28 114.602 114.602 116.308 -1.706 18321 16387 1 13 . 1 1 28 28 LEU HA H 28 4.325 4.325 4.567 -0.242 18321 16388 1 13 . 1 1 28 28 LEU C C 28 177.197 177.197 175.719 1.478 18321 16389 1 13 . 1 1 28 28 LEU CA C 28 55.143 55.143 53.615 1.528 18321 16390 1 13 . 1 1 28 28 LEU CB C 28 44.902 44.902 42.966 1.936 18321 16391 1 13 . 1 1 28 28 LEU H H 28 7.438 7.438 7.213 0.225 18321 16392 1 13 . 1 1 29 29 GLN N N 29 121.312 121.312 120.930 0.382 18321 16393 1 13 . 1 1 29 29 GLN HA H 29 3.856 3.856 4.218 -0.362 18321 16394 1 13 . 1 1 29 29 GLN C C 29 178.048 178.048 176.561 1.487 18321 16395 1 13 . 1 1 29 29 GLN CA C 29 57.691 57.691 55.780 1.911 18321 16396 1 13 . 1 1 29 29 GLN CB C 29 27.293 27.293 26.845 0.448 18321 16397 1 13 . 1 1 29 29 GLN H H 29 8.250 8.250 7.437 0.813 18321 16398 1 13 . 1 1 30 30 GLY N N 30 116.768 116.768 112.111 4.657 18321 16399 1 13 . 1 1 30 30 GLY C C 30 174.914 174.914 173.872 1.042 18321 16400 1 13 . 1 1 30 30 GLY CA C 30 45.491 45.491 46.130 -0.639 18321 16401 1 13 . 1 1 30 30 GLY H H 30 9.135 9.135 8.772 0.363 18321 16402 1 13 . 1 1 31 31 GLN N N 31 117.979 117.979 118.231 -0.252 18321 16403 1 13 . 1 1 31 31 GLN HA H 31 4.329 4.329 3.990 0.339 18321 16404 1 13 . 1 1 31 31 GLN C C 31 177.174 177.174 175.554 1.620 18321 16405 1 13 . 1 1 31 31 GLN CA C 31 53.910 53.910 58.473 -4.563 18321 16406 1 13 . 1 1 31 31 GLN CB C 31 29.574 29.574 29.490 0.084 18321 16407 1 13 . 1 1 31 31 GLN H H 31 7.695 7.695 8.165 -0.470 18321 16408 1 13 . 1 1 32 32 ARG N N 32 123.918 123.918 116.675 7.243 18321 16409 1 13 . 1 1 32 32 ARG HA H 32 3.940 3.940 4.869 -0.929 18321 16410 1 13 . 1 1 32 32 ARG C C 32 175.810 175.810 175.959 -0.149 18321 16411 1 13 . 1 1 32 32 ARG CA C 32 56.770 56.770 54.035 2.735 18321 16412 1 13 . 1 1 32 32 ARG CB C 32 30.074 30.074 32.390 -2.316 18321 16413 1 13 . 1 1 32 32 ARG H H 32 8.955 8.955 7.886 1.069 18321 16414 1 13 . 1 1 33 33 HIS N N 33 122.248 122.248 124.008 -1.760 18321 16415 1 13 . 1 1 33 33 HIS HA H 33 4.627 4.627 4.700 -0.073 18321 16416 1 13 . 1 1 33 33 HIS C C 33 177.089 177.089 176.501 0.588 18321 16417 1 13 . 1 1 33 33 HIS CA C 33 55.858 55.858 56.669 -0.811 18321 16418 1 13 . 1 1 33 33 HIS CB C 33 28.648 28.648 29.554 -0.906 18321 16419 1 13 . 1 1 33 33 HIS H H 33 8.302 8.302 8.537 -0.235 18321 16420 1 13 . 1 1 34 34 GLY N N 34 109.518 109.518 112.850 -3.332 18321 16421 1 13 . 1 1 34 34 GLY C C 34 176.730 176.730 173.676 3.054 18321 16422 1 13 . 1 1 34 34 GLY CA C 34 45.967 45.967 44.786 1.181 18321 16423 1 13 . 1 1 34 34 GLY H H 34 9.496 9.496 9.279 0.217 18321 16424 1 13 . 1 1 35 35 MET N N 35 125.193 125.193 123.550 1.643 18321 16425 1 13 . 1 1 35 35 MET HA H 35 5.750 5.750 5.728 0.022 18321 16426 1 13 . 1 1 35 35 MET C C 35 174.388 174.388 174.365 0.023 18321 16427 1 13 . 1 1 35 35 MET CA C 35 55.762 55.762 55.524 0.238 18321 16428 1 13 . 1 1 35 35 MET CB C 35 32.706 32.706 34.223 -1.517 18321 16429 1 13 . 1 1 35 35 MET H H 35 8.359 8.359 7.646 0.714 18321 16430 1 13 . 1 1 36 36 PHE N N 36 123.311 123.311 121.636 1.675 18321 16431 1 13 . 1 1 36 36 PHE HA H 36 5.985 5.985 5.621 0.364 18321 16432 1 13 . 1 1 36 36 PHE C C 36 172.140 172.140 172.775 -0.635 18321 16433 1 13 . 1 1 36 36 PHE CA C 36 55.755 55.755 54.826 0.929 18321 16434 1 13 . 1 1 36 36 PHE CB C 36 45.197 45.197 42.514 2.683 18321 16435 1 13 . 1 1 36 36 PHE H H 36 8.261 8.261 7.802 0.459 18321 16436 1 13 . 1 1 37 37 LEU N N 37 114.652 114.652 115.260 -0.608 18321 16437 1 13 . 1 1 37 37 LEU HA H 37 4.489 4.489 5.051 -0.562 18321 16438 1 13 . 1 1 37 37 LEU C C 37 174.033 174.033 174.775 -0.742 18321 16439 1 13 . 1 1 37 37 LEU CA C 37 55.382 55.382 54.830 0.553 18321 16440 1 13 . 1 1 37 37 LEU CB C 37 44.791 44.791 45.489 -0.698 18321 16441 1 13 . 1 1 37 37 LEU H H 37 9.292 9.292 9.123 0.169 18321 16442 1 13 . 1 1 38 38 VAL N N 38 121.009 121.009 121.932 -0.923 18321 16443 1 13 . 1 1 38 38 VAL HA H 38 5.504 5.504 4.745 0.759 18321 16444 1 13 . 1 1 38 38 VAL C C 38 173.581 173.581 175.271 -1.690 18321 16445 1 13 . 1 1 38 38 VAL CA C 38 61.316 61.316 61.799 -0.483 18321 16446 1 13 . 1 1 38 38 VAL CB C 38 33.302 33.302 33.063 0.239 18321 16447 1 13 . 1 1 38 38 VAL H H 38 8.991 8.991 8.537 0.454 18321 16448 1 13 . 1 1 39 39 ARG N N 39 124.863 124.863 126.671 -1.808 18321 16449 1 13 . 1 1 39 39 ARG HA H 39 5.444 5.444 5.077 0.367 18321 16450 1 13 . 1 1 39 39 ARG C C 39 175.772 175.772 174.692 1.080 18321 16451 1 13 . 1 1 39 39 ARG CA C 39 52.558 52.558 53.227 -0.669 18321 16452 1 13 . 1 1 39 39 ARG CB C 39 34.980 34.980 33.265 1.715 18321 16453 1 13 . 1 1 39 39 ARG H H 39 9.569 9.569 8.462 1.107 18321 16454 1 13 . 1 1 40 40 ASP N N 40 122.330 122.330 119.924 2.406 18321 16455 1 13 . 1 1 40 40 ASP HA H 40 4.785 4.785 5.064 -0.279 18321 16456 1 13 . 1 1 40 40 ASP C C 40 176.332 176.332 175.871 0.461 18321 16457 1 13 . 1 1 40 40 ASP CA C 40 55.334 55.334 54.773 0.562 18321 16458 1 13 . 1 1 40 40 ASP CB C 40 40.650 40.650 42.390 -1.740 18321 16459 1 13 . 1 1 40 40 ASP H H 40 8.413 8.413 8.627 -0.214 18321 16460 1 13 . 1 1 41 41 SER N N 41 114.363 114.363 120.515 -6.152 18321 16461 1 13 . 1 1 41 41 SER HA H 41 4.506 4.506 4.564 -0.058 18321 16462 1 13 . 1 1 41 41 SER CA C 41 57.525 57.525 58.279 -0.754 18321 16463 1 13 . 1 1 41 41 SER CB C 41 63.706 63.706 63.725 -0.019 18321 16464 1 13 . 1 1 41 41 SER H H 41 7.791 7.791 8.443 -0.652 18321 16465 1 13 . 1 1 42 42 SER N N 42 126.932 126.932 123.709 3.223 18321 16466 1 13 . 1 1 42 42 SER HA H 42 4.410 4.410 4.438 -0.028 18321 16467 1 13 . 1 1 42 42 SER CA C 42 60.362 60.362 59.901 0.461 18321 16468 1 13 . 1 1 42 42 SER CB C 42 63.707 63.707 63.059 0.648 18321 16469 1 13 . 1 1 42 42 SER H H 42 10.519 10.519 9.035 1.484 18321 16470 1 13 . 1 1 43 43 THR HA H 43 4.097 4.097 4.191 -0.094 18321 16471 1 13 . 1 1 43 43 THR CA C 43 64.722 64.722 64.129 0.593 18321 16472 1 13 . 1 1 43 43 THR CB C 43 69.439 69.439 69.594 -0.155 18321 16473 1 13 . 1 1 44 44 CYS HA H 44 5.100 5.100 4.966 0.134 18321 16474 1 13 . 1 1 44 44 CYS CA C 44 51.779 51.779 56.028 -4.249 18321 16475 1 13 . 1 1 44 44 CYS CB C 44 41.314 41.314 30.217 11.097 18321 16476 1 13 . 1 1 45 45 PRO HA H 45 4.278 4.278 4.426 -0.148 18321 16477 1 13 . 1 1 45 45 PRO C C 45 178.127 178.127 176.921 1.206 18321 16478 1 13 . 1 1 45 45 PRO CA C 45 64.151 64.151 64.558 -0.407 18321 16479 1 13 . 1 1 45 45 PRO CB C 45 31.596 31.596 31.218 0.379 18321 16480 1 13 . 1 1 46 46 GLY N N 46 114.947 114.947 113.447 1.500 18321 16481 1 13 . 1 1 46 46 GLY C C 46 174.701 174.701 173.957 0.744 18321 16482 1 13 . 1 1 46 46 GLY CA C 46 45.225 45.225 44.740 0.485 18321 16483 1 13 . 1 1 46 46 GLY H H 46 8.812 8.812 8.688 0.124 18321 16484 1 13 . 1 1 47 47 ASP N N 47 120.862 120.862 121.000 -0.138 18321 16485 1 13 . 1 1 47 47 ASP HA H 47 5.235 5.235 4.620 0.615 18321 16486 1 13 . 1 1 47 47 ASP C C 47 176.480 176.480 174.912 1.568 18321 16487 1 13 . 1 1 47 47 ASP CA C 47 53.591 53.591 54.436 -0.845 18321 16488 1 13 . 1 1 47 47 ASP CB C 47 41.707 41.707 42.184 -0.477 18321 16489 1 13 . 1 1 47 47 ASP H H 47 7.997 7.997 7.641 0.356 18321 16490 1 13 . 1 1 48 48 TYR N N 48 118.473 118.473 115.950 2.523 18321 16491 1 13 . 1 1 48 48 TYR HA H 48 5.431 5.431 5.242 0.189 18321 16492 1 13 . 1 1 48 48 TYR C C 48 173.783 173.783 175.674 -1.891 18321 16493 1 13 . 1 1 48 48 TYR CA C 48 56.891 56.891 56.577 0.314 18321 16494 1 13 . 1 1 48 48 TYR CB C 48 43.274 43.274 42.705 0.569 18321 16495 1 13 . 1 1 48 48 TYR H H 48 8.892 8.892 8.986 -0.094 18321 16496 1 13 . 1 1 49 49 VAL N N 49 119.105 119.105 119.497 -0.392 18321 16497 1 13 . 1 1 49 49 VAL HA H 49 4.800 4.800 4.536 0.264 18321 16498 1 13 . 1 1 49 49 VAL C C 49 174.397 174.397 174.628 -0.231 18321 16499 1 13 . 1 1 49 49 VAL CA C 49 61.439 61.439 62.150 -0.711 18321 16500 1 13 . 1 1 49 49 VAL CB C 49 35.388 35.388 34.157 1.230 18321 16501 1 13 . 1 1 49 49 VAL H H 49 9.661 9.661 8.730 0.931 18321 16502 1 13 . 1 1 50 50 LEU N N 50 129.599 129.599 131.367 -1.768 18321 16503 1 13 . 1 1 50 50 LEU HA H 50 5.033 5.033 5.060 -0.027 18321 16504 1 13 . 1 1 50 50 LEU C C 50 175.001 175.001 175.276 -0.275 18321 16505 1 13 . 1 1 50 50 LEU CA C 50 53.352 53.352 53.687 -0.335 18321 16506 1 13 . 1 1 50 50 LEU CB C 50 44.062 44.062 42.506 1.556 18321 16507 1 13 . 1 1 50 50 LEU H H 50 9.405 9.405 9.199 0.206 18321 16508 1 13 . 1 1 51 51 SER N N 51 126.895 126.895 124.187 2.708 18321 16509 1 13 . 1 1 51 51 SER HA H 51 5.731 5.731 5.044 0.687 18321 16510 1 13 . 1 1 51 51 SER C C 51 173.094 173.094 173.480 -0.386 18321 16511 1 13 . 1 1 51 51 SER CA C 51 58.834 58.834 57.183 1.651 18321 16512 1 13 . 1 1 51 51 SER CB C 51 64.977 64.977 64.106 0.871 18321 16513 1 13 . 1 1 51 51 SER H H 51 9.094 9.094 8.820 0.274 18321 16514 1 13 . 1 1 52 52 VAL N N 52 121.777 121.777 124.683 -2.906 18321 16515 1 13 . 1 1 52 52 VAL HA H 52 5.066 5.066 4.522 0.544 18321 16516 1 13 . 1 1 52 52 VAL C C 52 174.573 174.573 174.616 -0.043 18321 16517 1 13 . 1 1 52 52 VAL CA C 52 59.535 59.535 61.001 -1.466 18321 16518 1 13 . 1 1 52 52 VAL CB C 52 36.834 36.834 35.522 1.312 18321 16519 1 13 . 1 1 52 52 VAL H H 52 8.816 8.816 8.465 0.351 18321 16520 1 13 . 1 1 53 53 SER N N 53 120.489 120.489 120.685 -0.196 18321 16521 1 13 . 1 1 53 53 SER HA H 53 4.811 4.811 4.814 -0.003 18321 16522 1 13 . 1 1 53 53 SER C C 53 174.065 174.065 172.987 1.078 18321 16523 1 13 . 1 1 53 53 SER CA C 53 57.496 57.496 57.420 0.076 18321 16524 1 13 . 1 1 53 53 SER CB C 53 62.623 62.623 62.878 -0.255 18321 16525 1 13 . 1 1 53 53 SER H H 53 8.780 8.780 9.081 -0.301 18321 16526 1 13 . 1 1 54 54 GLU N N 54 132.020 132.020 126.465 5.555 18321 16527 1 13 . 1 1 54 54 GLU HA H 54 4.250 4.250 4.591 -0.341 18321 16528 1 13 . 1 1 54 54 GLU C C 54 175.387 175.387 175.091 0.296 18321 16529 1 13 . 1 1 54 54 GLU CA C 54 56.999 56.999 55.459 1.540 18321 16530 1 13 . 1 1 54 54 GLU CB C 54 32.556 32.556 33.305 -0.749 18321 16531 1 13 . 1 1 54 54 GLU H H 54 8.472 8.472 7.723 0.749 18321 16532 1 13 . 1 1 55 55 ASN N N 55 126.517 126.517 119.843 6.674 18321 16533 1 13 . 1 1 55 55 ASN HA H 55 4.220 4.220 3.867 0.353 18321 16534 1 13 . 1 1 55 55 ASN C C 55 174.546 174.546 175.136 -0.590 18321 16535 1 13 . 1 1 55 55 ASN CA C 55 54.770 54.770 53.604 1.166 18321 16536 1 13 . 1 1 55 55 ASN CB C 55 37.314 37.314 36.479 0.835 18321 16537 1 13 . 1 1 55 55 ASN H H 55 8.853 8.853 8.392 0.461 18321 16538 1 13 . 1 1 56 56 SER N N 56 112.009 112.009 108.627 3.382 18321 16539 1 13 . 1 1 56 56 SER HA H 56 4.334 4.334 4.157 0.177 18321 16540 1 13 . 1 1 56 56 SER C C 56 173.354 173.354 172.980 0.374 18321 16541 1 13 . 1 1 56 56 SER CA C 56 59.966 59.966 59.932 0.034 18321 16542 1 13 . 1 1 56 56 SER CB C 56 62.242 62.242 62.273 -0.031 18321 16543 1 13 . 1 1 56 56 SER H H 56 10.418 10.418 8.181 2.237 18321 16544 1 13 . 1 1 57 57 ARG N N 57 121.764 121.764 118.360 3.404 18321 16545 1 13 . 1 1 57 57 ARG HA H 57 5.167 5.167 4.440 0.727 18321 16546 1 13 . 1 1 57 57 ARG C C 57 174.983 174.983 173.733 1.250 18321 16547 1 13 . 1 1 57 57 ARG CA C 57 54.550 54.550 54.876 -0.326 18321 16548 1 13 . 1 1 57 57 ARG CB C 57 31.886 31.886 31.700 0.186 18321 16549 1 13 . 1 1 57 57 ARG H H 57 8.097 8.097 8.369 -0.272 18321 16550 1 13 . 1 1 58 58 VAL N N 58 121.866 121.866 122.826 -0.960 18321 16551 1 13 . 1 1 58 58 VAL HA H 58 4.768 4.768 4.620 0.148 18321 16552 1 13 . 1 1 58 58 VAL C C 58 175.388 175.388 175.990 -0.602 18321 16553 1 13 . 1 1 58 58 VAL CA C 58 61.818 61.818 62.699 -0.881 18321 16554 1 13 . 1 1 58 58 VAL CB C 58 34.135 34.135 31.003 3.132 18321 16555 1 13 . 1 1 58 58 VAL H H 58 8.081 8.081 8.050 0.031 18321 16556 1 13 . 1 1 59 59 SER N N 59 124.445 124.445 123.857 0.588 18321 16557 1 13 . 1 1 59 59 SER HA H 59 4.462 4.462 4.389 0.073 18321 16558 1 13 . 1 1 59 59 SER C C 59 172.185 172.185 173.324 -1.139 18321 16559 1 13 . 1 1 59 59 SER CA C 59 56.629 56.629 57.735 -1.106 18321 16560 1 13 . 1 1 59 59 SER CB C 59 66.218 66.218 63.739 2.479 18321 16561 1 13 . 1 1 59 59 SER H H 59 9.082 9.082 8.624 0.458 18321 16562 1 13 . 1 1 60 60 HIS N N 60 121.224 121.224 126.040 -4.816 18321 16563 1 13 . 1 1 60 60 HIS HA H 60 4.885 4.885 4.653 0.232 18321 16564 1 13 . 1 1 60 60 HIS C C 60 174.674 174.674 174.326 0.348 18321 16565 1 13 . 1 1 60 60 HIS CA C 60 54.900 54.900 55.675 -0.775 18321 16566 1 13 . 1 1 60 60 HIS CB C 60 32.331 32.331 29.219 3.112 18321 16567 1 13 . 1 1 60 60 HIS H H 60 8.331 8.331 8.700 -0.369 18321 16568 1 13 . 1 1 61 61 TYR N N 61 124.780 124.780 125.448 -0.668 18321 16569 1 13 . 1 1 61 61 TYR HA H 61 4.655 4.655 4.755 -0.100 18321 16570 1 13 . 1 1 61 61 TYR CA C 61 57.409 57.409 57.126 0.283 18321 16571 1 13 . 1 1 61 61 TYR CB C 61 39.785 39.785 37.847 1.938 18321 16572 1 13 . 1 1 61 61 TYR H H 61 9.273 9.273 9.086 0.187 18321 16573 1 13 . 1 1 62 62 ILE HA H 62 4.298 4.298 4.289 0.009 18321 16574 1 13 . 1 1 62 62 ILE C C 62 174.817 174.817 175.689 -0.872 18321 16575 1 13 . 1 1 62 62 ILE CA C 62 61.908 61.908 61.668 0.240 18321 16576 1 13 . 1 1 62 62 ILE CB C 62 38.321 38.321 38.854 -0.533 18321 16577 1 13 . 1 1 63 63 ILE N N 63 128.552 128.552 128.864 -0.312 18321 16578 1 13 . 1 1 63 63 ILE HA H 63 4.788 4.788 4.508 0.280 18321 16579 1 13 . 1 1 63 63 ILE C C 63 175.982 175.982 174.827 1.155 18321 16580 1 13 . 1 1 63 63 ILE CA C 63 59.629 59.629 60.182 -0.553 18321 16581 1 13 . 1 1 63 63 ILE CB C 63 39.747 39.747 39.107 0.640 18321 16582 1 13 . 1 1 63 63 ILE H H 63 9.155 9.155 8.542 0.613 18321 16583 1 13 . 1 1 64 64 ASN N N 64 123.240 123.240 127.311 -4.071 18321 16584 1 13 . 1 1 64 64 ASN HA H 64 4.857 4.857 5.399 -0.542 18321 16585 1 13 . 1 1 64 64 ASN C C 64 175.324 175.324 174.881 0.443 18321 16586 1 13 . 1 1 64 64 ASN CA C 64 53.736 53.736 52.794 0.942 18321 16587 1 13 . 1 1 64 64 ASN CB C 64 41.531 41.531 40.333 1.198 18321 16588 1 13 . 1 1 64 64 ASN H H 64 9.379 9.379 8.932 0.447 18321 16589 1 13 . 1 1 65 65 SER N N 65 121.157 121.157 118.528 2.629 18321 16590 1 13 . 1 1 65 65 SER HA H 65 4.548 4.548 4.726 -0.178 18321 16591 1 13 . 1 1 65 65 SER C C 65 174.328 174.328 174.553 -0.225 18321 16592 1 13 . 1 1 65 65 SER CA C 65 58.306 58.306 57.864 0.442 18321 16593 1 13 . 1 1 65 65 SER CB C 65 62.878 62.878 62.572 0.306 18321 16594 1 13 . 1 1 65 65 SER H H 65 9.195 9.195 9.180 0.015 18321 16595 1 13 . 1 1 66 66 LEU N N 66 127.417 127.417 128.849 -1.432 18321 16596 1 13 . 1 1 66 66 LEU HA H 66 4.605 4.605 4.612 -0.007 18321 16597 1 13 . 1 1 66 66 LEU CA C 66 52.888 52.888 52.997 -0.109 18321 16598 1 13 . 1 1 66 66 LEU CB C 66 41.799 41.799 41.894 -0.095 18321 16599 1 13 . 1 1 66 66 LEU H H 66 8.143 8.143 8.470 -0.327 18321 16600 1 13 . 1 1 68 68 ASN HA H 68 4.386 4.386 4.698 -0.312 18321 16601 1 13 . 1 1 68 68 ASN C C 68 174.487 174.487 174.832 -0.345 18321 16602 1 13 . 1 1 68 68 ASN CA C 68 53.365 53.365 52.784 0.581 18321 16603 1 13 . 1 1 68 68 ASN CB C 68 36.778 36.778 37.659 -0.881 18321 16604 1 13 . 1 1 69 69 ARG N N 69 111.329 111.329 116.325 -4.996 18321 16605 1 13 . 1 1 69 69 ARG HA H 69 3.876 3.876 3.845 0.031 18321 16606 1 13 . 1 1 69 69 ARG CA C 69 57.393 57.393 57.216 0.177 18321 16607 1 13 . 1 1 69 69 ARG CB C 69 26.665 26.665 28.255 -1.590 18321 16608 1 13 . 1 1 69 69 ARG H H 69 8.191 8.191 7.691 0.500 18321 16609 1 13 . 1 1 70 70 ARG N N 70 116.120 116.120 113.069 3.051 18321 16610 1 13 . 1 1 70 70 ARG HA H 70 4.556 4.556 5.033 -0.477 18321 16611 1 13 . 1 1 70 70 ARG C C 70 174.882 174.882 173.977 0.905 18321 16612 1 13 . 1 1 70 70 ARG CA C 70 55.509 55.509 53.655 1.854 18321 16613 1 13 . 1 1 70 70 ARG CB C 70 31.771 31.771 32.650 -0.879 18321 16614 1 13 . 1 1 70 70 ARG H H 70 6.667 6.667 7.317 -0.650 18321 16615 1 13 . 1 1 71 71 PHE N N 71 116.313 116.313 116.603 -0.290 18321 16616 1 13 . 1 1 71 71 PHE HA H 71 5.540 5.540 5.900 -0.360 18321 16617 1 13 . 1 1 71 71 PHE C C 71 174.391 174.391 175.379 -0.988 18321 16618 1 13 . 1 1 71 71 PHE CA C 71 57.528 57.528 55.471 2.057 18321 16619 1 13 . 1 1 71 71 PHE CB C 71 44.115 44.115 43.773 0.343 18321 16620 1 13 . 1 1 71 71 PHE H H 71 8.700 8.700 8.307 0.393 18321 16621 1 13 . 1 1 72 72 LYS N N 72 122.770 122.770 122.955 -0.185 18321 16622 1 13 . 1 1 72 72 LYS HA H 72 5.483 5.483 5.046 0.437 18321 16623 1 13 . 1 1 72 72 LYS C C 72 173.923 173.923 175.159 -1.236 18321 16624 1 13 . 1 1 72 72 LYS CA C 72 54.855 54.855 55.440 -0.585 18321 16625 1 13 . 1 1 72 72 LYS CB C 72 37.710 37.710 35.834 1.876 18321 16626 1 13 . 1 1 72 72 LYS H H 72 9.138 9.138 8.511 0.627 18321 16627 1 13 . 1 1 73 73 ILE N N 73 124.576 124.576 127.972 -3.396 18321 16628 1 13 . 1 1 73 73 ILE HA H 73 4.955 4.955 5.099 -0.144 18321 16629 1 13 . 1 1 73 73 ILE C C 73 175.728 175.728 176.663 -0.935 18321 16630 1 13 . 1 1 73 73 ILE CA C 73 58.935 58.935 60.105 -1.170 18321 16631 1 13 . 1 1 73 73 ILE CB C 73 40.965 40.965 38.915 2.050 18321 16632 1 13 . 1 1 73 73 ILE H H 73 8.826 8.826 8.842 -0.016 18321 16633 1 13 . 1 1 74 74 GLY N N 74 118.718 118.718 119.579 -0.861 18321 16634 1 13 . 1 1 74 74 GLY C C 74 174.436 174.436 173.847 0.589 18321 16635 1 13 . 1 1 74 74 GLY CA C 74 47.401 47.401 45.714 1.688 18321 16636 1 13 . 1 1 74 74 GLY H H 74 9.317 9.317 9.096 0.221 18321 16637 1 13 . 1 1 75 75 ASP N N 75 125.691 125.691 115.719 9.972 18321 16638 1 13 . 1 1 75 75 ASP HA H 75 4.713 4.713 4.215 0.498 18321 16639 1 13 . 1 1 75 75 ASP C C 75 175.841 175.841 174.715 1.126 18321 16640 1 13 . 1 1 75 75 ASP CA C 75 53.815 53.815 55.765 -1.950 18321 16641 1 13 . 1 1 75 75 ASP CB C 75 41.288 41.288 40.583 0.705 18321 16642 1 13 . 1 1 75 75 ASP H H 75 8.665 8.665 8.486 0.179 18321 16643 1 13 . 1 1 76 76 GLN N N 76 120.368 120.368 119.137 1.231 18321 16644 1 13 . 1 1 76 76 GLN C C 76 173.630 173.630 174.274 -0.644 18321 16645 1 13 . 1 1 76 76 GLN CA C 76 54.254 54.254 54.778 -0.524 18321 16646 1 13 . 1 1 76 76 GLN CB C 76 31.248 31.248 30.614 0.634 18321 16647 1 13 . 1 1 76 76 GLN H H 76 8.289 8.289 7.575 0.714 18321 16648 1 13 . 1 1 77 77 GLU N N 77 120.435 120.435 122.958 -2.523 18321 16649 1 13 . 1 1 77 77 GLU C C 77 175.484 175.484 174.863 0.621 18321 16650 1 13 . 1 1 77 77 GLU CA C 77 54.203 54.203 54.651 -0.448 18321 16651 1 13 . 1 1 77 77 GLU CB C 77 33.141 33.141 30.515 2.626 18321 16652 1 13 . 1 1 77 77 GLU H H 77 7.732 7.732 8.226 -0.494 18321 16653 1 13 . 1 1 78 78 PHE N N 78 117.911 117.911 122.791 -4.880 18321 16654 1 13 . 1 1 78 78 PHE HA H 78 4.659 4.659 4.719 -0.060 18321 16655 1 13 . 1 1 78 78 PHE C C 78 175.673 175.673 176.026 -0.353 18321 16656 1 13 . 1 1 78 78 PHE CA C 78 57.160 57.160 56.444 0.716 18321 16657 1 13 . 1 1 78 78 PHE CB C 78 45.405 45.405 42.011 3.394 18321 16658 1 13 . 1 1 78 78 PHE H H 78 9.235 9.235 8.471 0.764 18321 16659 1 13 . 1 1 79 79 ASP N N 79 119.296 119.296 119.367 -0.071 18321 16660 1 13 . 1 1 79 79 ASP HA H 79 4.462 4.462 4.412 0.050 18321 16661 1 13 . 1 1 79 79 ASP C C 79 174.482 174.482 176.196 -1.714 18321 16662 1 13 . 1 1 79 79 ASP CA C 79 56.629 56.629 57.351 -0.722 18321 16663 1 13 . 1 1 79 79 ASP CB C 79 41.697 41.697 41.003 0.694 18321 16664 1 13 . 1 1 79 79 ASP H H 79 9.187 9.187 8.597 0.590 18321 16665 1 13 . 1 1 80 80 HIS N N 80 107.631 107.631 112.691 -5.060 18321 16666 1 13 . 1 1 80 80 HIS HA H 80 5.022 5.022 5.196 -0.174 18321 16667 1 13 . 1 1 80 80 HIS C C 80 174.626 174.626 176.214 -1.588 18321 16668 1 13 . 1 1 80 80 HIS CA C 80 54.223 54.223 55.001 -0.778 18321 16669 1 13 . 1 1 80 80 HIS CB C 80 32.205 32.205 31.658 0.547 18321 16670 1 13 . 1 1 80 80 HIS H H 80 7.200 7.200 7.406 -0.206 18321 16671 1 13 . 1 1 81 81 LEU N N 81 120.710 120.710 121.649 -0.939 18321 16672 1 13 . 1 1 81 81 LEU HA H 81 3.804 3.804 4.153 -0.349 18321 16673 1 13 . 1 1 81 81 LEU CA C 81 58.709 58.709 60.088 -1.379 18321 16674 1 13 . 1 1 81 81 LEU CB C 81 39.646 39.646 39.951 -0.305 18321 16675 1 13 . 1 1 81 81 LEU H H 81 8.886 8.886 9.215 -0.329 18321 16676 1 13 . 1 1 82 82 PRO HA H 82 4.020 4.020 4.342 -0.322 18321 16677 1 13 . 1 1 82 82 PRO C C 82 175.619 175.619 176.688 -1.069 18321 16678 1 13 . 1 1 82 82 PRO CA C 82 67.025 67.025 64.659 2.366 18321 16679 1 13 . 1 1 82 82 PRO CB C 82 30.962 30.962 30.875 0.087 18321 16680 1 13 . 1 1 83 83 ALA N N 83 124.281 124.281 119.322 4.959 18321 16681 1 13 . 1 1 83 83 ALA HA H 83 4.019 4.019 4.352 -0.333 18321 16682 1 13 . 1 1 83 83 ALA C C 83 179.709 179.709 178.766 0.943 18321 16683 1 13 . 1 1 83 83 ALA CA C 83 54.985 54.985 53.821 1.164 18321 16684 1 13 . 1 1 83 83 ALA CB C 83 18.425 18.425 19.413 -0.988 18321 16685 1 13 . 1 1 83 83 ALA H H 83 8.527 8.527 7.824 0.703 18321 16686 1 13 . 1 1 84 84 LEU N N 84 122.960 122.960 117.981 4.979 18321 16687 1 13 . 1 1 84 84 LEU HA H 84 1.917 1.917 2.917 -1.000 18321 16688 1 13 . 1 1 84 84 LEU C C 84 177.652 177.652 178.139 -0.487 18321 16689 1 13 . 1 1 84 84 LEU CA C 84 58.261 58.261 57.039 1.222 18321 16690 1 13 . 1 1 84 84 LEU CB C 84 42.544 42.544 40.843 1.701 18321 16691 1 13 . 1 1 84 84 LEU H H 84 6.982 6.982 7.349 -0.367 18321 16692 1 13 . 1 1 85 85 LEU N N 85 117.940 117.940 119.319 -1.379 18321 16693 1 13 . 1 1 85 85 LEU HA H 85 3.463 3.463 3.806 -0.343 18321 16694 1 13 . 1 1 85 85 LEU C C 85 178.809 178.809 179.223 -0.414 18321 16695 1 13 . 1 1 85 85 LEU CA C 85 57.522 57.522 57.701 -0.179 18321 16696 1 13 . 1 1 85 85 LEU CB C 85 41.242 41.242 41.062 0.180 18321 16697 1 13 . 1 1 85 85 LEU H H 85 7.773 7.773 7.662 0.111 18321 16698 1 13 . 1 1 86 86 GLU N N 86 115.762 115.762 118.532 -2.770 18321 16699 1 13 . 1 1 86 86 GLU HA H 86 3.540 3.540 3.962 -0.422 18321 16700 1 13 . 1 1 86 86 GLU C C 86 180.228 180.228 178.767 1.461 18321 16701 1 13 . 1 1 86 86 GLU CA C 86 58.943 58.943 58.470 0.473 18321 16702 1 13 . 1 1 86 86 GLU CB C 86 29.561 29.561 29.176 0.385 18321 16703 1 13 . 1 1 86 86 GLU H H 86 8.300 8.300 7.674 0.626 18321 16704 1 13 . 1 1 87 87 PHE N N 87 121.135 121.135 121.508 -0.373 18321 16705 1 13 . 1 1 87 87 PHE HA H 87 4.122 4.122 4.120 0.002 18321 16706 1 13 . 1 1 87 87 PHE C C 87 179.497 179.497 177.362 2.135 18321 16707 1 13 . 1 1 87 87 PHE CA C 87 62.090 62.090 60.659 1.431 18321 16708 1 13 . 1 1 87 87 PHE CB C 87 40.103 40.103 38.996 1.107 18321 16709 1 13 . 1 1 87 87 PHE H H 87 7.717 7.717 7.491 0.226 18321 16710 1 13 . 1 1 88 88 TYR N N 88 116.579 116.579 116.395 0.184 18321 16711 1 13 . 1 1 88 88 TYR HA H 88 4.933 4.933 4.152 0.781 18321 16712 1 13 . 1 1 88 88 TYR C C 88 174.799 174.799 176.914 -2.115 18321 16713 1 13 . 1 1 88 88 TYR CA C 88 61.333 61.333 58.688 2.645 18321 16714 1 13 . 1 1 88 88 TYR CB C 88 36.539 36.539 36.935 -0.396 18321 16715 1 13 . 1 1 88 88 TYR H H 88 7.478 7.478 7.849 -0.371 18321 16716 1 13 . 1 1 89 89 LYS N N 89 117.737 117.737 118.535 -0.798 18321 16717 1 13 . 1 1 89 89 LYS HA H 89 4.466 4.466 4.082 0.384 18321 16718 1 13 . 1 1 89 89 LYS C C 89 178.417 178.417 176.525 1.892 18321 16719 1 13 . 1 1 89 89 LYS CA C 89 59.486 59.486 57.897 1.589 18321 16720 1 13 . 1 1 89 89 LYS CB C 89 34.523 34.523 32.738 1.785 18321 16721 1 13 . 1 1 89 89 LYS H H 89 7.505 7.505 7.429 0.076 18321 16722 1 13 . 1 1 90 90 ILE N N 90 110.972 110.972 111.266 -0.294 18321 16723 1 13 . 1 1 90 90 ILE HA H 90 4.181 4.181 4.191 -0.010 18321 16724 1 13 . 1 1 90 90 ILE C C 90 174.571 174.571 175.979 -1.408 18321 16725 1 13 . 1 1 90 90 ILE CA C 90 60.516 60.516 61.614 -1.098 18321 16726 1 13 . 1 1 90 90 ILE CB C 90 39.979 39.979 38.159 1.820 18321 16727 1 13 . 1 1 90 90 ILE H H 90 6.710 6.710 7.430 -0.720 18321 16728 1 13 . 1 1 91 91 HIS N N 91 119.479 119.479 120.600 -1.121 18321 16729 1 13 . 1 1 91 91 HIS HA H 91 4.357 4.357 4.287 0.070 18321 16730 1 13 . 1 1 91 91 HIS C C 91 172.751 172.751 174.836 -2.085 18321 16731 1 13 . 1 1 91 91 HIS CA C 91 55.066 55.066 56.554 -1.488 18321 16732 1 13 . 1 1 91 91 HIS CB C 91 29.756 29.756 31.048 -1.292 18321 16733 1 13 . 1 1 91 91 HIS H H 91 7.460 7.460 7.260 0.200 18321 16734 1 13 . 1 1 92 92 TYR N N 92 117.642 117.642 116.652 0.990 18321 16735 1 13 . 1 1 92 92 TYR HA H 92 4.131 4.131 4.263 -0.132 18321 16736 1 13 . 1 1 92 92 TYR C C 92 177.348 177.348 175.608 1.740 18321 16737 1 13 . 1 1 92 92 TYR CA C 92 58.627 58.627 58.477 0.150 18321 16738 1 13 . 1 1 92 92 TYR CB C 92 39.481 39.481 35.918 3.563 18321 16739 1 13 . 1 1 92 92 TYR H H 92 8.067 8.067 7.437 0.630 18321 16740 1 13 . 1 1 93 93 LEU N N 93 123.560 123.560 119.753 3.807 18321 16741 1 13 . 1 1 93 93 LEU HA H 93 4.104 4.104 3.667 0.437 18321 16742 1 13 . 1 1 93 93 LEU C C 93 175.610 175.610 177.614 -2.004 18321 16743 1 13 . 1 1 93 93 LEU CA C 93 56.381 56.381 57.304 -0.923 18321 16744 1 13 . 1 1 93 93 LEU CB C 93 38.896 38.896 41.885 -2.989 18321 16745 1 13 . 1 1 93 93 LEU H H 93 7.907 7.907 8.157 -0.250 18321 16746 1 13 . 1 1 94 94 ASP N N 94 118.194 118.194 115.769 2.425 18321 16747 1 13 . 1 1 94 94 ASP HA H 94 4.940 4.940 4.654 0.286 18321 16748 1 13 . 1 1 94 94 ASP C C 94 176.123 176.123 176.997 -0.874 18321 16749 1 13 . 1 1 94 94 ASP CA C 94 56.235 56.235 54.465 1.770 18321 16750 1 13 . 1 1 94 94 ASP CB C 94 42.078 42.078 40.839 1.239 18321 16751 1 13 . 1 1 94 94 ASP H H 94 8.640 8.640 7.519 1.121 18321 16752 1 13 . 1 1 95 95 THR N N 95 105.073 105.073 114.004 -8.931 18321 16753 1 13 . 1 1 95 95 THR HA H 95 4.318 4.318 4.464 -0.146 18321 16754 1 13 . 1 1 95 95 THR C C 95 174.685 174.685 174.116 0.569 18321 16755 1 13 . 1 1 95 95 THR CA C 95 60.756 60.756 62.141 -1.385 18321 16756 1 13 . 1 1 95 95 THR CB C 95 71.058 71.058 69.281 1.777 18321 16757 1 13 . 1 1 95 95 THR H H 95 8.576 8.576 8.184 0.392 18321 16758 1 13 . 1 1 96 96 THR N N 96 116.817 116.817 114.772 2.045 18321 16759 1 13 . 1 1 96 96 THR HA H 96 5.129 5.129 4.907 0.222 18321 16760 1 13 . 1 1 96 96 THR C C 96 172.464 172.464 172.608 -0.144 18321 16761 1 13 . 1 1 96 96 THR CA C 96 60.762 60.762 59.787 0.975 18321 16762 1 13 . 1 1 96 96 THR CB C 96 71.425 71.425 70.112 1.313 18321 16763 1 13 . 1 1 96 96 THR H H 96 8.205 8.205 7.683 0.522 18321 16764 1 13 . 1 1 97 97 THR N N 97 114.324 114.324 113.283 1.041 18321 16765 1 13 . 1 1 97 97 THR HA H 97 5.128 5.128 4.397 0.731 18321 16766 1 13 . 1 1 97 97 THR C C 97 175.480 175.480 174.187 1.293 18321 16767 1 13 . 1 1 97 97 THR CA C 97 60.233 60.233 59.702 0.531 18321 16768 1 13 . 1 1 97 97 THR CB C 97 70.415 70.415 70.427 -0.011 18321 16769 1 13 . 1 1 97 97 THR H H 97 7.128 7.128 8.064 -0.936 18321 16770 1 13 . 1 1 98 98 LEU N N 98 116.674 116.674 121.908 -5.234 18321 16771 1 13 . 1 1 98 98 LEU HA H 98 4.075 4.075 3.969 0.106 18321 16772 1 13 . 1 1 98 98 LEU C C 98 177.892 177.892 176.603 1.289 18321 16773 1 13 . 1 1 98 98 LEU CA C 98 59.597 59.597 55.397 4.200 18321 16774 1 13 . 1 1 98 98 LEU CB C 98 41.172 41.172 40.646 0.526 18321 16775 1 13 . 1 1 98 98 LEU H H 98 8.743 8.743 7.831 0.912 18321 16776 1 13 . 1 1 99 99 ILE N N 99 122.988 122.988 123.175 -0.187 18321 16777 1 13 . 1 1 99 99 ILE HA H 99 4.415 4.415 4.262 0.153 18321 16778 1 13 . 1 1 99 99 ILE C C 99 175.055 175.055 175.831 -0.776 18321 16779 1 13 . 1 1 99 99 ILE CA C 99 62.183 62.183 61.650 0.533 18321 16780 1 13 . 1 1 99 99 ILE CB C 99 40.252 40.252 39.094 1.158 18321 16781 1 13 . 1 1 99 99 ILE H H 99 8.998 8.998 8.159 0.840 18321 16782 1 13 . 1 1 100 100 GLU N N 100 114.067 114.067 114.765 -0.698 18321 16783 1 13 . 1 1 100 100 GLU CA C 100 52.910 52.910 53.516 -0.606 18321 16784 1 13 . 1 1 100 100 GLU CB C 100 31.155 31.155 30.999 0.156 18321 16785 1 13 . 1 1 100 100 GLU H H 100 7.332 7.332 7.703 -0.371 18321 16786 1 13 . 1 1 101 101 PRO HA H 101 4.952 4.952 3.869 1.083 18321 16787 1 13 . 1 1 101 101 PRO C C 101 175.976 175.976 175.817 0.159 18321 16788 1 13 . 1 1 101 101 PRO CA C 101 53.312 53.312 61.777 -8.465 18321 16789 1 13 . 1 1 101 101 PRO CB C 101 31.598 31.598 32.223 -0.625 18321 16790 1 13 . 1 1 102 102 ALA N N 102 125.968 125.968 122.083 3.885 18321 16791 1 13 . 1 1 102 102 ALA HA H 102 4.516 4.516 4.360 0.156 18321 16792 1 13 . 1 1 102 102 ALA CA C 102 49.852 49.852 49.453 0.399 18321 16793 1 13 . 1 1 102 102 ALA CB C 102 17.766 17.766 18.325 -0.559 18321 16794 1 13 . 1 1 102 102 ALA H H 102 8.232 8.232 8.010 0.222 18321 16795 1 13 . 1 1 103 103 PRO HA H 103 4.283 4.283 4.416 -0.133 18321 16796 1 13 . 1 1 103 103 PRO CA C 103 62.435 62.435 62.796 -0.361 18321 16797 1 13 . 1 1 103 103 PRO CB C 103 32.145 32.145 32.287 -0.142 18321 16798 1 13 . 1 1 104 104 ARG HA H 104 4.004 4.004 4.223 -0.219 18321 16799 1 13 . 1 1 104 104 ARG CA C 104 56.660 56.660 58.381 -1.721 18321 16800 1 13 . 1 1 106 106 PRO C C 106 174.587 174.587 175.972 -1.385 18321 16801 1 13 . 1 1 106 106 PRO CA C 106 57.867 57.867 63.150 -5.283 18321 16802 1 13 . 1 1 106 106 PRO CB C 106 31.942 31.942 30.815 1.127 18321 16803 1 13 . 1 1 107 107 SER N N 107 121.280 121.280 119.239 2.041 18321 16804 1 13 . 1 1 107 107 SER CA C 107 61.772 61.772 59.064 2.708 18321 16805 1 13 . 1 1 107 107 SER CB C 107 63.234 63.234 62.519 0.715 18321 16806 1 13 . 1 1 107 107 SER H H 107 8.132 8.132 8.011 0.121 18321 16807 1 13 . 1 1 109 109 PRO C C 109 177.129 177.129 176.529 0.600 18321 16808 1 13 . 1 1 109 109 PRO CA C 109 62.638 62.638 64.278 -1.640 18321 16809 1 13 . 1 1 109 109 PRO CB C 109 30.970 30.970 31.819 -0.849 18321 16810 1 13 . 1 1 110 110 MET N N 110 120.772 120.772 115.625 5.147 18321 16811 1 13 . 1 1 110 110 MET C C 110 176.892 176.892 174.731 2.161 18321 16812 1 13 . 1 1 110 110 MET CA C 110 55.310 55.310 54.831 0.479 18321 16813 1 13 . 1 1 110 110 MET CB C 110 32.202 32.202 35.111 -2.909 18321 16814 1 13 . 1 1 110 110 MET H H 110 8.430 8.430 7.341 1.089 18321 16815 1 13 . 1 1 111 111 GLY N N 111 110.158 110.158 108.448 1.710 18321 16816 1 13 . 1 1 111 111 GLY C C 111 177.430 177.430 174.509 2.921 18321 16817 1 13 . 1 1 111 111 GLY CA C 111 44.951 44.951 44.855 0.097 18321 16818 1 13 . 1 1 111 111 GLY H H 111 8.384 8.384 8.615 -0.231 18321 16819 1 13 . 1 1 112 112 SER N N 112 116.762 116.762 117.122 -0.360 18321 16820 1 13 . 1 1 112 112 SER CA C 112 55.948 55.948 57.645 -1.697 18321 16821 1 13 . 1 1 112 112 SER CB C 112 62.745 62.745 63.348 -0.603 18321 16822 1 13 . 1 1 112 112 SER H H 112 8.161 8.161 7.965 0.196 18321 16823 1 13 . 1 1 113 113 VAL C C 113 176.083 176.083 175.689 0.394 18321 16824 1 13 . 1 1 114 114 SER N N 114 119.151 119.151 124.225 -5.074 18321 16825 1 13 . 1 1 114 114 SER C C 114 173.638 173.638 173.719 -0.081 18321 16826 1 13 . 1 1 114 114 SER CA C 114 58.005 58.005 57.609 0.396 18321 16827 1 13 . 1 1 114 114 SER CB C 114 63.169 63.169 63.078 0.090 18321 16828 1 13 . 1 1 114 114 SER H H 114 8.319 8.319 8.505 -0.186 18321 16829 1 13 . 1 1 115 115 ALA N N 115 126.914 126.914 127.044 -0.130 18321 16830 1 13 . 1 1 115 115 ALA CA C 115 51.561 51.561 49.352 2.209 18321 16831 1 13 . 1 1 115 115 ALA CB C 115 17.714 17.714 19.177 -1.463 18321 16832 1 13 . 1 1 115 115 ALA H H 115 8.197 8.197 8.037 0.160 18321 16833 1 13 . 1 1 119 119 PRO C C 119 177.065 177.065 176.055 1.010 18321 16834 1 13 . 1 1 120 120 THR N N 120 113.976 113.976 117.803 -3.827 18321 16835 1 13 . 1 1 120 120 THR C C 120 174.461 174.461 173.320 1.141 18321 16836 1 13 . 1 1 120 120 THR CA C 120 61.215 61.215 62.319 -1.104 18321 16837 1 13 . 1 1 120 120 THR CB C 120 69.508 69.508 70.260 -0.752 18321 16838 1 13 . 1 1 120 120 THR H H 120 8.138 8.138 8.810 -0.672 18321 16839 1 13 . 1 1 121 121 ALA N N 121 125.859 125.859 127.527 -1.668 18321 16840 1 13 . 1 1 121 121 ALA CA C 121 52.281 52.281 50.480 1.801 18321 16841 1 13 . 1 1 121 121 ALA CB C 121 18.623 18.623 20.781 -2.158 18321 16842 1 13 . 1 1 121 121 ALA H H 121 8.272 8.272 8.149 0.123 18321 16843 1 13 . 1 1 122 122 GLU C C 122 176.316 176.316 175.634 0.682 18321 16844 1 13 . 1 1 123 123 ASP N N 123 120.448 120.448 118.520 1.928 18321 16845 1 13 . 1 1 123 123 ASP C C 123 175.906 175.906 175.142 0.764 18321 16846 1 13 . 1 1 123 123 ASP CA C 123 54.167 54.167 53.105 1.062 18321 16847 1 13 . 1 1 123 123 ASP CB C 123 40.695 40.695 41.807 -1.113 18321 16848 1 13 . 1 1 123 123 ASP H H 123 8.181 8.181 8.297 -0.116 18321 16849 1 13 . 1 1 124 124 ASN N N 124 118.207 118.207 117.223 0.984 18321 16850 1 13 . 1 1 124 124 ASN C C 124 174.851 174.851 174.037 0.814 18321 16851 1 13 . 1 1 124 124 ASN CA C 124 52.771 52.771 52.912 -0.141 18321 16852 1 13 . 1 1 124 124 ASN CB C 124 38.304 38.304 40.192 -1.888 18321 16853 1 13 . 1 1 124 124 ASN H H 124 8.307 8.307 8.414 -0.107 18321 16854 1 13 . 1 1 125 125 LEU N N 125 121.311 121.311 120.610 0.701 18321 16855 1 13 . 1 1 125 125 LEU C C 125 175.750 175.750 175.871 -0.121 18321 16856 1 13 . 1 1 125 125 LEU CA C 125 54.428 54.428 55.173 -0.745 18321 16857 1 13 . 1 1 125 125 LEU CB C 125 41.350 41.350 42.752 -1.402 18321 16858 1 13 . 1 1 125 125 LEU H H 125 7.747 7.747 8.118 -0.371 18321 16859 1 13 . 1 1 126 126 GLU N N 126 122.485 122.485 118.035 4.450 18321 16860 1 13 . 1 1 126 126 GLU C C 126 174.008 174.008 175.341 -1.333 18321 16861 1 13 . 1 1 126 126 GLU CA C 126 54.855 54.855 58.592 -3.737 18321 16862 1 13 . 1 1 126 126 GLU CB C 126 30.472 30.472 28.597 1.875 18321 16863 1 13 . 1 1 126 126 GLU H H 126 8.453 8.453 8.470 -0.017 18321 16864 1 13 . 1 1 127 127 TYR N N 127 122.713 122.713 120.170 2.543 18321 16865 1 13 . 1 1 127 127 TYR C C 127 176.859 176.859 175.238 1.621 18321 16866 1 13 . 1 1 127 127 TYR CA C 127 56.528 56.528 57.298 -0.770 18321 16867 1 13 . 1 1 127 127 TYR CB C 127 40.982 40.982 38.785 2.196 18321 16868 1 13 . 1 1 127 127 TYR H H 127 8.469 8.469 7.920 0.549 18321 16869 1 13 . 1 1 128 128 VAL N N 128 112.432 112.432 125.006 -12.574 18321 16870 1 13 . 1 1 128 128 VAL C C 128 173.150 173.150 174.310 -1.160 18321 16871 1 13 . 1 1 128 128 VAL CA C 128 57.940 57.940 60.573 -2.633 18321 16872 1 13 . 1 1 128 128 VAL CB C 128 34.935 34.935 35.133 -0.198 18321 16873 1 13 . 1 1 128 128 VAL H H 128 9.078 9.078 8.924 0.154 18321 16874 1 13 . 1 1 129 129 ARG N N 129 120.373 120.373 124.158 -3.785 18321 16875 1 13 . 1 1 129 129 ARG C C 129 176.539 176.539 175.213 1.326 18321 16876 1 13 . 1 1 129 129 ARG CA C 129 52.534 52.534 54.142 -1.608 18321 16877 1 13 . 1 1 129 129 ARG CB C 129 32.942 32.942 32.636 0.306 18321 16878 1 13 . 1 1 129 129 ARG H H 129 9.010 9.010 8.208 0.802 18321 16879 1 13 . 1 1 130 130 THR N N 130 116.637 116.637 111.716 4.921 18321 16880 1 13 . 1 1 130 130 THR CA C 130 60.618 60.618 60.773 -0.155 18321 16881 1 13 . 1 1 130 130 THR CB C 130 69.170 69.170 70.609 -1.439 18321 16882 1 13 . 1 1 130 130 THR H H 130 9.045 9.045 9.340 -0.295 18321 16883 1 13 . 1 1 131 131 LEU N N 131 122.910 122.910 122.689 0.221 18321 16884 1 13 . 1 1 131 131 LEU C C 131 175.269 175.269 176.680 -1.411 18321 16885 1 13 . 1 1 131 131 LEU CA C 131 55.122 55.122 55.416 -0.294 18321 16886 1 13 . 1 1 131 131 LEU CB C 131 43.108 43.108 42.413 0.695 18321 16887 1 13 . 1 1 131 131 LEU H H 131 9.224 9.224 8.546 0.678 18321 16888 1 13 . 1 1 132 132 TYR N N 132 112.885 112.885 119.823 -6.938 18321 16889 1 13 . 1 1 132 132 TYR C C 132 173.818 173.818 175.381 -1.563 18321 16890 1 13 . 1 1 132 132 TYR CA C 132 54.230 54.230 58.850 -4.620 18321 16891 1 13 . 1 1 132 132 TYR CB C 132 42.672 42.672 40.638 2.034 18321 16892 1 13 . 1 1 132 132 TYR H H 132 7.284 7.284 7.929 -0.645 18321 16893 1 13 . 1 1 133 133 ASP N N 133 118.003 118.003 120.029 -2.026 18321 16894 1 13 . 1 1 133 133 ASP C C 133 175.779 175.779 174.207 1.572 18321 16895 1 13 . 1 1 133 133 ASP CA C 133 54.351 54.351 55.356 -1.005 18321 16896 1 13 . 1 1 133 133 ASP CB C 133 41.241 41.241 40.158 1.083 18321 16897 1 13 . 1 1 133 133 ASP H H 133 8.399 8.399 8.524 -0.125 18321 16898 1 13 . 1 1 134 134 PHE N N 134 121.081 121.081 123.712 -2.631 18321 16899 1 13 . 1 1 134 134 PHE CA C 134 52.552 52.552 54.706 -2.154 18321 16900 1 13 . 1 1 134 134 PHE CB C 134 41.217 41.217 41.484 -0.267 18321 16901 1 13 . 1 1 134 134 PHE H H 134 8.797 8.797 6.646 2.151 18321 16902 1 13 . 1 1 136 136 GLY C C 136 171.616 171.616 174.788 -3.172 18321 16903 1 13 . 1 1 137 137 ASN N N 137 119.394 119.394 115.703 3.691 18321 16904 1 13 . 1 1 137 137 ASN C C 137 174.500 174.500 173.593 0.907 18321 16905 1 13 . 1 1 137 137 ASN CA C 137 44.670 44.670 54.276 -9.606 18321 16906 1 13 . 1 1 137 137 ASN H H 137 9.477 9.477 8.207 1.270 18321 16907 1 13 . 1 1 138 138 ASP N N 138 120.608 120.608 118.117 2.491 18321 16908 1 13 . 1 1 138 138 ASP C C 138 176.987 176.987 174.884 2.103 18321 16909 1 13 . 1 1 138 138 ASP CA C 138 52.992 52.992 52.804 0.188 18321 16910 1 13 . 1 1 138 138 ASP H H 138 8.216 8.216 8.387 -0.171 18321 16911 1 13 . 1 1 139 139 ALA N N 139 124.371 124.371 121.136 3.235 18321 16912 1 13 . 1 1 139 139 ALA C C 139 178.472 178.472 178.925 -0.453 18321 16913 1 13 . 1 1 139 139 ALA CA C 139 54.513 54.513 53.976 0.537 18321 16914 1 13 . 1 1 139 139 ALA CB C 139 18.045 18.045 19.570 -1.525 18321 16915 1 13 . 1 1 139 139 ALA H H 139 8.565 8.565 8.527 0.038 18321 16916 1 13 . 1 1 140 140 GLU N N 140 115.022 115.022 117.334 -2.312 18321 16917 1 13 . 1 1 140 140 GLU C C 140 177.027 177.027 175.032 1.995 18321 16918 1 13 . 1 1 140 140 GLU CA C 140 56.181 56.181 56.737 -0.556 18321 16919 1 13 . 1 1 140 140 GLU CB C 140 28.619 28.619 30.581 -1.962 18321 16920 1 13 . 1 1 140 140 GLU H H 140 8.616 8.616 8.425 0.191 18321 16921 1 13 . 1 1 141 141 ASP N N 141 121.913 121.913 119.295 2.618 18321 16922 1 13 . 1 1 141 141 ASP C C 141 175.923 175.923 174.708 1.215 18321 16923 1 13 . 1 1 141 141 ASP CA C 141 54.736 54.736 53.562 1.174 18321 16924 1 13 . 1 1 141 141 ASP CB C 141 41.305 41.305 42.910 -1.605 18321 16925 1 13 . 1 1 141 141 ASP H H 141 7.636 7.636 7.914 -0.278 18321 16926 1 13 . 1 1 142 142 LEU N N 142 127.651 127.651 126.657 0.994 18321 16927 1 13 . 1 1 142 142 LEU CA C 142 50.955 50.955 52.767 -1.812 18321 16928 1 13 . 1 1 142 142 LEU CB C 142 42.343 42.343 43.829 -1.486 18321 16929 1 13 . 1 1 142 142 LEU H H 142 9.479 9.479 8.315 1.164 18321 16930 1 13 . 1 1 143 143 PRO C C 143 177.924 177.924 175.653 2.271 18321 16931 1 13 . 1 1 144 144 PHE N N 144 114.483 114.483 120.195 -5.712 18321 16932 1 13 . 1 1 144 144 PHE C C 144 175.055 175.055 174.899 0.156 18321 16933 1 13 . 1 1 144 144 PHE CA C 144 55.543 55.543 55.195 0.348 18321 16934 1 13 . 1 1 144 144 PHE CB C 144 40.581 40.581 40.908 -0.327 18321 16935 1 13 . 1 1 144 144 PHE H H 144 8.637 8.637 7.351 1.286 18321 16936 1 13 . 1 1 145 145 LYS N N 145 121.342 121.342 119.606 1.736 18321 16937 1 13 . 1 1 145 145 LYS C C 145 176.925 176.925 176.967 -0.042 18321 16938 1 13 . 1 1 145 145 LYS CA C 145 53.043 53.043 54.165 -1.122 18321 16939 1 13 . 1 1 145 145 LYS CB C 145 33.804 33.804 35.462 -1.658 18321 16940 1 13 . 1 1 145 145 LYS H H 145 9.418 9.418 8.908 0.510 18321 16941 1 13 . 1 1 146 146 LYS N N 146 123.378 123.378 119.671 3.707 18321 16942 1 13 . 1 1 146 146 LYS CA C 146 57.883 57.883 55.725 2.158 18321 16943 1 13 . 1 1 146 146 LYS CB C 146 32.008 32.008 31.243 0.765 18321 16944 1 13 . 1 1 146 146 LYS H H 146 9.002 9.002 8.487 0.515 18321 16945 1 13 . 1 1 147 147 GLY C C 147 174.315 174.315 173.632 0.683 18321 16946 1 13 . 1 1 148 148 GLU N N 148 121.392 121.392 119.022 2.370 18321 16947 1 13 . 1 1 148 148 GLU C C 148 174.998 174.998 175.225 -0.227 18321 16948 1 13 . 1 1 148 148 GLU CA C 148 56.867 56.867 53.582 3.285 18321 16949 1 13 . 1 1 148 148 GLU CB C 148 31.649 31.649 30.512 1.137 18321 16950 1 13 . 1 1 148 148 GLU H H 148 7.937 7.937 7.860 0.077 18321 16951 1 13 . 1 1 149 149 ILE N N 149 120.124 120.124 119.906 0.218 18321 16952 1 13 . 1 1 149 149 ILE C C 149 176.647 176.647 174.733 1.914 18321 16953 1 13 . 1 1 149 149 ILE CA C 149 58.621 58.621 59.961 -1.340 18321 16954 1 13 . 1 1 149 149 ILE CB C 149 36.952 36.952 39.712 -2.760 18321 16955 1 13 . 1 1 149 149 ILE H H 149 8.346 8.346 8.366 -0.020 18321 16956 1 13 . 1 1 150 150 LEU N N 150 126.950 126.950 125.222 1.728 18321 16957 1 13 . 1 1 150 150 LEU CA C 150 51.967 51.967 52.715 -0.748 18321 16958 1 13 . 1 1 150 150 LEU CB C 150 44.182 44.182 45.701 -1.519 18321 16959 1 13 . 1 1 150 150 LEU H H 150 8.988 8.988 9.113 -0.125 18321 16960 1 13 . 1 1 151 151 VAL C C 151 175.670 175.670 175.915 -0.245 18321 16961 1 13 . 1 1 152 152 ILE N N 152 124.997 124.997 128.551 -3.554 18321 16962 1 13 . 1 1 152 152 ILE CA C 152 58.331 58.331 60.153 -1.822 18321 16963 1 13 . 1 1 152 152 ILE CB C 152 34.093 34.093 34.693 -0.600 18321 16964 1 13 . 1 1 152 152 ILE H H 152 8.673 8.673 8.834 -0.161 18321 16965 1 13 . 1 1 153 153 ILE N N 153 124.710 124.710 126.584 -1.874 18321 16966 1 13 . 1 1 153 153 ILE C C 153 176.264 176.264 175.056 1.208 18321 16967 1 13 . 1 1 154 154 GLU N N 154 117.398 117.398 118.935 -1.537 18321 16968 1 13 . 1 1 154 154 GLU C C 154 173.959 173.959 174.588 -0.629 18321 16969 1 13 . 1 1 154 154 GLU CA C 154 55.289 55.289 55.035 0.254 18321 16970 1 13 . 1 1 154 154 GLU CB C 154 32.842 32.842 32.797 0.045 18321 16971 1 13 . 1 1 154 154 GLU H H 154 7.818 7.818 8.188 -0.370 18321 16972 1 13 . 1 1 155 155 LYS N N 155 121.130 121.130 124.815 -3.685 18321 16973 1 13 . 1 1 155 155 LYS CA C 155 53.022 53.022 52.738 0.284 18321 16974 1 13 . 1 1 155 155 LYS CB C 155 32.663 32.663 33.128 -0.465 18321 16975 1 13 . 1 1 155 155 LYS H H 155 8.654 8.654 8.591 0.063 18321 16976 1 13 . 1 1 157 157 GLU C C 157 175.190 175.190 176.035 -0.845 18321 16977 1 13 . 1 1 157 157 GLU CA C 157 53.785 53.785 54.304 -0.519 18321 16978 1 13 . 1 1 157 157 GLU CB C 157 32.685 32.685 31.758 0.927 18321 16979 1 13 . 1 1 158 158 GLU N N 158 117.425 117.425 119.025 -1.600 18321 16980 1 13 . 1 1 158 158 GLU C C 158 178.600 178.600 176.764 1.836 18321 16981 1 13 . 1 1 158 158 GLU CA C 158 59.044 59.044 57.196 1.848 18321 16982 1 13 . 1 1 158 158 GLU CB C 158 29.706 29.706 30.341 -0.635 18321 16983 1 13 . 1 1 158 158 GLU H H 158 8.678 8.678 8.861 -0.183 18321 16984 1 13 . 1 1 159 159 GLN N N 159 110.925 110.925 116.876 -5.951 18321 16985 1 13 . 1 1 159 159 GLN C C 159 175.539 175.539 175.732 -0.193 18321 16986 1 13 . 1 1 159 159 GLN CA C 159 54.942 54.942 56.275 -1.333 18321 16987 1 13 . 1 1 159 159 GLN CB C 159 28.572 28.572 29.776 -1.204 18321 16988 1 13 . 1 1 159 159 GLN H H 159 8.483 8.483 8.236 0.247 18321 16989 1 13 . 1 1 160 160 TRP N N 160 120.171 120.171 119.434 0.737 18321 16990 1 13 . 1 1 160 160 TRP C C 160 173.444 173.444 174.814 -1.370 18321 16991 1 13 . 1 1 160 160 TRP CA C 160 56.175 56.175 56.494 -0.319 18321 16992 1 13 . 1 1 160 160 TRP CB C 160 31.796 31.796 32.766 -0.970 18321 16993 1 13 . 1 1 160 160 TRP H H 160 6.826 6.826 7.736 -0.910 18321 16994 1 13 . 1 1 161 161 TRP N N 161 120.687 120.687 121.133 -0.446 18321 16995 1 13 . 1 1 161 161 TRP C C 161 174.736 174.736 175.731 -0.995 18321 16996 1 13 . 1 1 161 161 TRP CA C 161 51.889 51.889 55.246 -3.357 18321 16997 1 13 . 1 1 161 161 TRP CB C 161 32.772 32.772 32.645 0.127 18321 16998 1 13 . 1 1 161 161 TRP H H 161 8.462 8.462 9.468 -1.006 18321 16999 1 13 . 1 1 162 162 SER N N 162 115.691 115.691 119.807 -4.116 18321 17000 1 13 . 1 1 162 162 SER C C 162 174.320 174.320 173.470 0.850 18321 17001 1 13 . 1 1 162 162 SER CA C 162 57.011 57.011 58.289 -1.278 18321 17002 1 13 . 1 1 162 162 SER CB C 162 63.948 63.948 63.213 0.735 18321 17003 1 13 . 1 1 162 162 SER H H 162 8.830 8.830 9.051 -0.221 18321 17004 1 13 . 1 1 163 163 ALA N N 163 130.630 130.630 128.209 2.421 18321 17005 1 13 . 1 1 163 163 ALA CA C 163 50.029 50.029 49.892 0.137 18321 17006 1 13 . 1 1 163 163 ALA CB C 163 25.500 25.500 22.321 3.179 18321 17007 1 13 . 1 1 163 163 ALA H H 163 9.585 9.585 9.035 0.550 18321 17008 1 13 . 1 1 164 164 ARG N N 164 117.526 117.526 120.350 -2.824 18321 17009 1 13 . 1 1 164 164 ARG C C 164 176.719 176.719 176.670 0.049 18321 17010 1 13 . 1 1 164 164 ARG CA C 164 52.975 52.975 54.367 -1.392 18321 17011 1 13 . 1 1 164 164 ARG CB C 164 34.260 34.260 30.726 3.534 18321 17012 1 13 . 1 1 164 164 ARG H H 164 9.097 9.097 8.823 0.274 18321 17013 1 13 . 1 1 165 165 ASN N N 165 123.935 123.935 123.489 0.446 18321 17014 1 13 . 1 1 165 165 ASN C C 165 178.484 178.484 177.109 1.375 18321 17015 1 13 . 1 1 165 165 ASN CA C 165 50.332 50.332 52.814 -2.482 18321 17016 1 13 . 1 1 165 165 ASN CB C 165 39.487 39.487 39.720 -0.233 18321 17017 1 13 . 1 1 165 165 ASN H H 165 8.756 8.756 8.834 -0.078 18321 17018 1 13 . 1 1 166 166 LYS N N 166 118.464 118.464 121.029 -2.565 18321 17019 1 13 . 1 1 166 166 LYS C C 166 176.967 176.967 176.720 0.247 18321 17020 1 13 . 1 1 166 166 LYS CA C 166 58.430 58.430 58.772 -0.342 18321 17021 1 13 . 1 1 166 166 LYS CB C 166 30.918 30.918 32.217 -1.299 18321 17022 1 13 . 1 1 166 166 LYS H H 166 8.915 8.915 8.778 0.137 18321 17023 1 13 . 1 1 167 167 ASP N N 167 118.138 118.138 116.537 1.601 18321 17024 1 13 . 1 1 167 167 ASP C C 167 176.464 176.464 176.801 -0.337 18321 17025 1 13 . 1 1 167 167 ASP CA C 167 54.212 54.212 54.984 -0.772 18321 17026 1 13 . 1 1 167 167 ASP CB C 167 41.178 41.178 40.742 0.436 18321 17027 1 13 . 1 1 167 167 ASP H H 167 7.508 7.508 8.015 -0.507 18321 17028 1 13 . 1 1 168 168 GLY N N 168 107.901 107.901 108.159 -0.258 18321 17029 1 13 . 1 1 168 168 GLY C C 168 173.613 173.613 173.201 0.412 18321 17030 1 13 . 1 1 168 168 GLY CA C 168 44.783 44.783 45.242 -0.459 18321 17031 1 13 . 1 1 168 168 GLY H H 168 8.173 8.173 8.216 -0.043 18321 17032 1 13 . 1 1 169 169 ARG N N 169 124.324 124.324 119.694 4.630 18321 17033 1 13 . 1 1 169 169 ARG CA C 169 56.106 56.106 54.653 1.453 18321 17034 1 13 . 1 1 169 169 ARG CB C 169 29.648 29.648 32.596 -2.948 18321 17035 1 13 . 1 1 169 169 ARG H H 169 7.998 7.998 7.823 0.175 18321 17036 1 13 . 1 1 170 170 VAL C C 170 177.590 177.590 174.556 3.034 18321 17037 1 13 . 1 1 171 171 GLY N N 171 112.582 112.582 113.391 -0.809 18321 17038 1 13 . 1 1 171 171 GLY C C 171 170.991 170.991 172.164 -1.173 18321 17039 1 13 . 1 1 171 171 GLY CA C 171 45.361 45.361 44.785 0.576 18321 17040 1 13 . 1 1 171 171 GLY H H 171 9.013 9.013 8.589 0.424 18321 17041 1 13 . 1 1 172 172 MET N N 172 117.368 117.368 119.886 -2.518 18321 17042 1 13 . 1 1 172 172 MET C C 172 177.921 177.921 176.660 1.261 18321 17043 1 13 . 1 1 172 172 MET CA C 172 53.536 53.536 54.551 -1.015 18321 17044 1 13 . 1 1 172 172 MET CB C 172 30.838 30.838 33.282 -2.444 18321 17045 1 13 . 1 1 172 172 MET H H 172 8.885 8.885 8.507 0.378 18321 17046 1 13 . 1 1 173 173 ILE N N 173 113.130 113.130 118.124 -4.994 18321 17047 1 13 . 1 1 173 173 ILE CA C 173 56.284 56.284 58.005 -1.721 18321 17048 1 13 . 1 1 173 173 ILE CB C 173 40.870 40.870 40.922 -0.052 18321 17049 1 13 . 1 1 173 173 ILE H H 173 9.704 9.704 9.397 0.307 18321 17050 1 13 . 1 1 174 174 PRO C C 174 176.714 176.714 177.711 -0.997 18321 17051 1 13 . 1 1 174 174 PRO CA C 174 66.290 66.290 61.537 4.753 18321 17052 1 13 . 1 1 174 174 PRO CB C 174 28.993 28.993 30.375 -1.382 18321 17053 1 13 . 1 1 175 175 VAL N N 175 128.066 128.066 124.564 3.502 18321 17054 1 13 . 1 1 175 175 VAL CA C 175 59.356 59.356 67.878 -8.522 18321 17055 1 13 . 1 1 175 175 VAL H H 175 7.327 7.327 8.318 -0.991 18321 17056 1 13 . 1 1 176 176 PRO C C 176 176.351 176.351 177.105 -0.754 18321 17057 1 13 . 1 1 177 177 TYR N N 177 115.756 115.756 115.677 0.079 18321 17058 1 13 . 1 1 177 177 TYR C C 177 175.011 175.011 175.644 -0.633 18321 17059 1 13 . 1 1 177 177 TYR CA C 177 56.756 56.756 56.962 -0.206 18321 17060 1 13 . 1 1 177 177 TYR CB C 177 37.507 37.507 38.445 -0.938 18321 17061 1 13 . 1 1 177 177 TYR H H 177 7.784 7.784 7.574 0.210 18321 17062 1 13 . 1 1 178 178 VAL N N 178 111.428 111.428 114.168 -2.740 18321 17063 1 13 . 1 1 178 178 VAL C C 178 173.417 173.417 175.733 -2.316 18321 17064 1 13 . 1 1 178 178 VAL CA C 178 58.307 58.307 59.575 -1.268 18321 17065 1 13 . 1 1 178 178 VAL CB C 178 34.602 34.602 33.873 0.729 18321 17066 1 13 . 1 1 178 178 VAL H H 178 7.801 7.801 7.469 0.332 18321 17067 1 13 . 1 1 179 179 GLU N N 179 118.581 118.581 120.221 -1.640 18321 17068 1 13 . 1 1 179 179 GLU C C 179 175.225 175.225 174.943 0.282 18321 17069 1 13 . 1 1 179 179 GLU CA C 179 53.114 53.114 55.910 -2.796 18321 17070 1 13 . 1 1 179 179 GLU CB C 179 32.712 32.712 30.705 2.007 18321 17071 1 13 . 1 1 179 179 GLU H H 179 8.819 8.819 8.376 0.443 18321 17072 1 13 . 1 1 180 180 LYS N N 180 124.167 124.167 121.443 2.724 18321 17073 1 13 . 1 1 180 180 LYS C C 180 176.303 176.303 177.409 -1.106 18321 17074 1 13 . 1 1 180 180 LYS CA C 180 57.318 57.318 57.038 0.280 18321 17075 1 13 . 1 1 180 180 LYS CB C 180 31.675 31.675 32.722 -1.047 18321 17076 1 13 . 1 1 180 180 LYS H H 180 8.775 8.775 7.985 0.790 18321 17077 1 13 . 1 1 181 181 LEU N N 181 125.157 125.157 126.352 -1.195 18321 17078 1 13 . 1 1 181 181 LEU C C 181 176.462 176.462 178.086 -1.624 18321 17079 1 13 . 1 1 181 181 LEU CA C 181 54.470 54.470 57.504 -3.034 18321 17080 1 13 . 1 1 181 181 LEU CB C 181 41.625 41.625 42.416 -0.791 18321 17081 1 13 . 1 1 181 181 LEU H H 181 8.084 8.084 8.607 -0.523 18321 17082 1 13 . 1 1 182 182 VAL N N 182 123.167 123.167 112.591 10.576 18321 17083 1 13 . 1 1 182 182 VAL C C 182 175.983 175.983 174.754 1.229 18321 17084 1 13 . 1 1 182 182 VAL CA C 182 61.613 61.613 62.257 -0.644 18321 17085 1 13 . 1 1 182 182 VAL CB C 182 32.085 32.085 29.903 2.182 18321 17086 1 13 . 1 1 182 182 VAL H H 182 8.345 8.345 8.232 0.113 18321 17087 1 13 . 1 1 183 183 ARG N N 183 125.775 125.775 121.593 4.182 18321 17088 1 13 . 1 1 183 183 ARG CA C 183 57.801 57.801 55.932 1.869 18321 17089 1 13 . 1 1 183 183 ARG CB C 183 30.091 30.091 31.698 -1.607 18321 17090 1 13 . 1 1 183 183 ARG H H 183 8.530 8.530 7.865 0.665 18321 17091 1 13 . 1 1 184 184 SER C C 184 173.239 173.239 172.740 0.499 18321 17092 1 13 . 1 1 185 185 SER N N 185 116.511 116.511 116.327 0.184 18321 17093 1 13 . 1 1 185 185 SER CA C 185 58.428 58.428 54.753 3.675 18321 17094 1 13 . 1 1 185 185 SER CB C 185 69.737 69.737 64.128 5.609 18321 17095 1 13 . 1 1 185 185 SER H H 185 7.944 7.944 8.315 -0.371 18321 17096 1 13 . 1 1 190 190 HIS C C 190 176.953 176.953 174.430 2.523 18321 17097 1 13 . 1 1 190 190 HIS CA C 190 54.229 54.229 56.229 -2.000 18321 17098 1 13 . 1 1 190 190 HIS CB C 190 35.112 35.112 30.162 4.950 18321 17099 1 13 . 1 1 191 191 GLY N N 191 109.491 109.491 112.120 -2.629 18321 17100 1 13 . 1 1 191 191 GLY C C 191 172.295 172.295 173.641 -1.346 18321 17101 1 13 . 1 1 191 191 GLY CA C 191 45.227 45.227 45.396 -0.169 18321 17102 1 13 . 1 1 191 191 GLY H H 191 8.719 8.719 8.074 0.645 18321 17103 1 13 . 1 1 192 192 ASN N N 192 118.700 118.700 119.435 -0.735 18321 17104 1 13 . 1 1 192 192 ASN HA H 192 4.312 4.312 4.719 -0.407 18321 17105 1 13 . 1 1 192 192 ASN C C 192 176.369 176.369 175.511 0.858 18321 17106 1 13 . 1 1 192 192 ASN CA C 192 57.787 57.787 52.875 4.912 18321 17107 1 13 . 1 1 192 192 ASN H H 192 7.508 7.508 8.349 -0.841 18321 17108 1 13 . 1 1 193 193 ARG N N 193 120.743 120.743 117.394 3.349 18321 17109 1 13 . 1 1 193 193 ARG H H 193 9.032 9.032 8.280 0.752 18321 17110 1 13 . 1 1 197 197 SER HA H 197 4.388 4.388 4.503 -0.115 18321 17111 1 13 . 1 1 197 197 SER C C 197 174.133 174.133 173.707 0.426 18321 17112 1 13 . 1 1 197 197 SER CA C 197 58.128 58.128 59.257 -1.129 18321 17113 1 13 . 1 1 197 197 SER CB C 197 62.966 62.966 62.402 0.564 18321 17114 1 13 . 1 1 198 198 TYR N N 198 121.435 121.435 125.410 -3.975 18321 17115 1 13 . 1 1 198 198 TYR HA H 198 4.543 4.543 4.555 -0.012 18321 17116 1 13 . 1 1 198 198 TYR C C 198 176.230 176.230 175.680 0.550 18321 17117 1 13 . 1 1 198 198 TYR CA C 198 57.536 57.536 57.816 -0.280 18321 17118 1 13 . 1 1 198 198 TYR CB C 198 38.279 38.279 39.722 -1.443 18321 17119 1 13 . 1 1 198 198 TYR H H 198 8.071 8.071 8.286 -0.215 18321 17120 1 13 . 1 1 199 199 GLY N N 199 110.039 110.039 108.504 1.535 18321 17121 1 13 . 1 1 199 199 GLY C C 199 173.475 173.475 173.458 0.017 18321 17122 1 13 . 1 1 199 199 GLY CA C 199 44.805 44.805 44.688 0.117 18321 17123 1 13 . 1 1 199 199 GLY H H 199 8.162 8.162 8.201 -0.039 18321 17124 1 13 . 1 1 200 200 ILE N N 200 121.530 121.530 121.220 0.310 18321 17125 1 13 . 1 1 200 200 ILE CA C 200 58.102 58.102 58.262 -0.160 18321 17126 1 13 . 1 1 200 200 ILE CB C 200 37.760 37.760 38.811 -1.051 18321 17127 1 13 . 1 1 200 200 ILE H H 200 7.851 7.851 8.308 -0.457 18321 17128 1 13 . 1 1 201 201 PRO C C 201 176.485 176.485 176.440 0.045 18321 17129 1 13 . 1 1 201 201 PRO CA C 201 53.893 53.893 63.390 -9.497 18321 17130 1 13 . 1 1 201 201 PRO CB C 201 29.042 29.042 32.302 -3.260 18321 17131 1 13 . 1 1 202 202 GLU N N 202 122.468 122.468 114.241 8.227 18321 17132 1 13 . 1 1 202 202 GLU CA C 202 62.490 62.490 55.880 6.610 18321 17133 1 13 . 1 1 202 202 GLU CB C 202 31.170 31.170 29.038 2.132 18321 17134 1 13 . 1 1 202 202 GLU H H 202 8.328 8.328 8.404 -0.076 18321 17135 1 13 . 1 1 203 203 PRO CA C 203 62.803 62.803 63.569 -0.766 18321 17136 1 13 . 1 1 203 203 PRO CB C 203 31.220 31.220 31.890 -0.670 18321 17137 1 13 . 1 1 204 204 ALA N N 204 123.251 123.251 126.178 -2.927 18321 17138 1 13 . 1 1 204 204 ALA HA H 204 4.180 4.180 4.071 0.109 18321 17139 1 13 . 1 1 204 204 ALA CA C 204 52.124 52.124 53.057 -0.933 18321 17140 1 13 . 1 1 204 204 ALA CB C 204 18.892 18.892 16.750 2.142 18321 17141 1 13 . 1 1 204 204 ALA H H 204 8.308 8.308 8.416 -0.108 18321 17142 1 13 . 1 1 205 205 HIS N N 205 117.874 117.874 116.798 1.076 18321 17143 1 13 . 1 1 205 205 HIS C C 205 173.282 173.282 174.392 -1.110 18321 17144 1 13 . 1 1 205 205 HIS H H 205 8.045 8.045 8.295 -0.250 18321 17145 1 13 . 1 1 206 206 ALA N N 206 125.519 125.519 122.142 3.377 18321 17146 1 13 . 1 1 206 206 ALA HA H 206 4.204 4.204 4.420 -0.216 18321 17147 1 13 . 1 1 206 206 ALA CA C 206 40.196 40.196 51.615 -11.419 18321 17148 1 13 . 1 1 206 206 ALA CB C 206 19.407 19.407 19.683 -0.276 18321 17149 1 13 . 1 1 206 206 ALA H H 206 8.061 8.061 7.870 0.191 18321 17150 1 13 . 1 1 207 207 TYR N N 207 120.381 120.381 121.691 -1.310 18321 17151 1 13 . 1 1 207 207 TYR HA H 207 4.570 4.570 4.498 0.072 18321 17152 1 13 . 1 1 207 207 TYR CA C 207 52.572 52.572 56.355 -3.783 18321 17153 1 13 . 1 1 207 207 TYR CB C 207 41.333 41.333 37.595 3.738 18321 17154 1 13 . 1 1 207 207 TYR H H 207 8.199 8.199 7.857 0.342 18321 17155 1 13 . 1 1 208 208 ALA HA H 208 4.281 4.281 4.117 0.164 18321 17156 1 13 . 1 1 208 208 ALA C C 208 177.736 177.736 176.597 1.139 18321 17157 1 13 . 1 1 208 208 ALA CA C 208 52.084 52.084 52.070 0.014 18321 17158 1 13 . 1 1 208 208 ALA CB C 208 18.999 18.999 18.598 0.401 18321 17159 1 13 . 1 1 209 209 GLN N N 209 119.295 119.295 122.990 -3.695 18321 17160 1 13 . 1 1 209 209 GLN CA C 209 61.474 61.474 53.649 7.825 18321 17161 1 13 . 1 1 209 209 GLN CB C 209 32.039 32.039 28.983 3.055 18321 17162 1 13 . 1 1 209 209 GLN H H 209 8.125 8.125 8.278 -0.153 18321 17163 1 13 . 1 1 210 210 PRO HA H 210 4.395 4.395 4.236 0.159 18321 17164 1 13 . 1 1 210 210 PRO CA C 210 62.584 62.584 63.828 -1.244 18321 17165 1 13 . 1 1 211 211 GLN HA H 211 4.377 4.377 4.093 0.284 18321 17166 1 13 . 1 1 211 211 GLN CA C 211 55.859 55.859 56.170 -0.311 18321 17167 1 13 . 1 1 211 211 GLN CB C 211 29.577 29.577 28.015 1.562 18321 17168 1 13 . 1 1 212 212 THR C C 212 176.551 176.551 174.603 1.948 18321 17169 1 13 . 1 1 212 212 THR CB C 212 69.890 69.890 68.496 1.394 18321 17170 1 13 . 1 1 213 213 THR N N 213 108.487 108.487 124.659 -16.172 18321 17171 1 13 . 1 1 213 213 THR CA C 213 61.236 61.236 61.746 -0.510 18321 17172 1 13 . 1 1 213 213 THR CB C 213 69.091 69.091 69.143 -0.052 18321 17173 1 13 . 1 1 213 213 THR H H 213 8.243 8.243 8.630 -0.387 18321 17174 1 13 . 1 1 214 214 THR N N 214 119.445 119.445 120.038 -0.593 18321 17175 1 13 . 1 1 214 214 THR CA C 214 59.425 59.425 63.816 -4.391 18321 17176 1 13 . 1 1 214 214 THR CB C 214 69.251 69.251 67.577 1.674 18321 17177 1 13 . 1 1 214 214 THR H H 214 8.188 8.188 8.594 -0.406 18321 17178 1 13 . 1 1 215 215 PRO HA H 215 4.361 4.361 4.475 -0.114 18321 17179 1 13 . 1 1 215 215 PRO C C 215 175.422 175.422 175.761 -0.339 18321 17180 1 13 . 1 1 215 215 PRO CA C 215 63.320 63.320 62.919 0.401 18321 17181 1 13 . 1 1 215 215 PRO CB C 215 31.918 31.918 31.234 0.684 18321 17182 1 13 . 1 1 216 216 LEU N N 216 121.602 121.602 126.761 -5.159 18321 17183 1 13 . 1 1 216 216 LEU CA C 216 52.203 52.203 52.190 0.013 18321 17184 1 13 . 1 1 216 216 LEU CB C 216 42.451 42.451 43.813 -1.362 18321 17185 1 13 . 1 1 216 216 LEU H H 216 7.891 7.891 7.981 -0.090 18321 17186 1 13 . 1 1 217 217 PRO HA H 217 4.398 4.398 4.683 -0.285 18321 17187 1 13 . 1 1 217 217 PRO C C 217 176.577 176.577 175.960 0.617 18321 17188 1 13 . 1 1 217 217 PRO CA C 217 62.984 62.984 62.727 0.257 18321 17189 1 13 . 1 1 217 217 PRO CB C 217 32.056 32.056 31.702 0.354 18321 17190 1 13 . 1 1 218 218 ALA N N 218 124.087 124.087 127.440 -3.353 18321 17191 1 13 . 1 1 218 218 ALA HA H 218 4.309 4.309 4.380 -0.071 18321 17192 1 13 . 1 1 218 218 ALA C C 218 177.844 177.844 177.241 0.603 18321 17193 1 13 . 1 1 218 218 ALA CA C 218 52.379 52.379 52.705 -0.326 18321 17194 1 13 . 1 1 218 218 ALA CB C 218 19.133 19.133 19.745 -0.612 18321 17195 1 13 . 1 1 218 218 ALA H H 218 8.261 8.261 8.626 -0.365 18321 17196 1 13 . 1 1 219 219 VAL N N 219 118.942 118.942 116.800 2.142 18321 17197 1 13 . 1 1 219 219 VAL HA H 219 4.142 4.142 4.244 -0.102 18321 17198 1 13 . 1 1 219 219 VAL CA C 219 62.102 62.102 61.734 0.368 18321 17199 1 13 . 1 1 219 219 VAL CB C 219 32.923 32.923 32.440 0.483 18321 17200 1 13 . 1 1 219 219 VAL H H 219 8.049 8.049 7.485 0.564 18321 17201 1 13 . 1 1 220 220 SER N N 220 119.207 119.207 122.692 -3.485 18321 17202 1 13 . 1 1 220 220 SER HA H 220 4.436 4.436 4.640 -0.204 18321 17203 1 13 . 1 1 220 220 SER CA C 220 57.813 57.813 58.239 -0.426 18321 17204 1 13 . 1 1 220 220 SER CB C 220 63.375 63.375 62.888 0.487 18321 17205 1 13 . 1 1 220 220 SER H H 220 8.275 8.275 8.760 -0.485 18321 17206 1 13 . 1 1 221 221 GLY N N 221 110.973 110.973 111.589 -0.616 18321 17207 1 13 . 1 1 221 221 GLY C C 221 173.962 173.962 173.494 0.468 18321 17208 1 13 . 1 1 221 221 GLY CA C 221 45.286 45.286 44.571 0.715 18321 17209 1 13 . 1 1 221 221 GLY H H 221 8.374 8.374 8.143 0.231 18321 17210 1 13 . 1 1 222 222 SER N N 222 115.516 115.516 113.626 1.890 18321 17211 1 13 . 1 1 222 222 SER HA H 222 4.763 4.763 4.512 0.251 18321 17212 1 13 . 1 1 222 222 SER CA C 222 56.407 56.407 58.653 -2.245 18321 17213 1 13 . 1 1 222 222 SER CB C 222 63.993 63.993 62.907 1.087 18321 17214 1 13 . 1 1 222 222 SER H H 222 8.155 8.155 8.289 -0.134 18321 17215 1 13 . 1 1 223 223 PRO HA H 223 4.417 4.417 4.368 0.049 18321 17216 1 13 . 1 1 223 223 PRO CA C 223 63.805 63.805 64.165 -0.360 18321 17217 1 13 . 1 1 223 223 PRO CB C 223 32.090 32.090 32.040 0.050 18321 17218 1 13 . 1 1 224 224 GLY N N 224 109.149 109.149 107.436 1.713 18321 17219 1 13 . 1 1 224 224 GLY C C 224 173.813 173.813 173.990 -0.177 18321 17220 1 13 . 1 1 224 224 GLY CA C 224 44.512 44.512 45.025 -0.513 18321 17221 1 13 . 1 1 224 224 GLY H H 224 8.376 8.376 8.273 0.103 18321 17222 1 13 . 1 1 225 225 ALA N N 225 123.599 123.599 126.020 -2.421 18321 17223 1 13 . 1 1 225 225 ALA C C 225 177.341 177.341 176.429 0.912 18321 17224 1 13 . 1 1 225 225 ALA CA C 225 51.878 51.878 51.519 0.359 18321 17225 1 13 . 1 1 225 225 ALA CB C 225 19.169 19.169 20.210 -1.041 18321 17226 1 13 . 1 1 225 225 ALA H H 225 7.959 7.959 7.935 0.024 18321 17227 1 13 . 1 1 226 226 ALA N N 226 123.218 123.218 124.515 -1.297 18321 17228 1 13 . 1 1 226 226 ALA HA H 226 4.350 4.350 4.689 -0.339 18321 17229 1 13 . 1 1 226 226 ALA C C 226 177.520 177.520 177.566 -0.046 18321 17230 1 13 . 1 1 226 226 ALA CA C 226 52.535 52.535 50.649 1.886 18321 17231 1 13 . 1 1 226 226 ALA CB C 226 19.171 19.171 20.166 -0.995 18321 17232 1 13 . 1 1 226 226 ALA H H 226 8.169 8.169 8.333 -0.164 18321 17233 1 13 . 1 1 227 227 ILE N N 227 120.086 120.086 118.488 1.598 18321 17234 1 13 . 1 1 227 227 ILE HA H 227 4.201 4.201 4.045 0.156 18321 17235 1 13 . 1 1 227 227 ILE C C 227 174.814 174.814 175.565 -0.751 18321 17236 1 13 . 1 1 227 227 ILE CA C 227 60.929 60.929 62.614 -1.685 18321 17237 1 13 . 1 1 227 227 ILE CB C 227 38.872 38.872 36.739 2.133 18321 17238 1 13 . 1 1 227 227 ILE H H 227 8.037 8.037 8.591 -0.554 18321 17239 1 13 . 1 1 228 228 THR N N 228 117.224 117.224 122.381 -5.157 18321 17240 1 13 . 1 1 228 228 THR HA H 228 4.203 4.203 4.515 -0.312 18321 17241 1 13 . 1 1 228 228 THR CA C 228 57.108 57.108 63.495 -6.387 18321 17242 1 13 . 1 1 228 228 THR CB C 228 69.945 69.945 67.205 2.740 18321 17243 1 13 . 1 1 228 228 THR H H 228 7.775 7.775 8.580 -0.805 18321 17244 1 13 . 1 1 229 229 PRO HA H 229 4.750 4.750 4.454 0.296 18321 17245 1 13 . 1 1 229 229 PRO CA C 229 62.480 62.480 63.439 -0.959 18321 17246 1 13 . 1 1 229 229 PRO CB C 229 33.995 33.995 30.987 3.008 18321 17247 1 13 . 1 1 230 230 LEU N N 230 123.629 123.629 126.033 -2.404 18321 17248 1 13 . 1 1 230 230 LEU CA C 230 53.076 53.076 52.753 0.323 18321 17249 1 13 . 1 1 230 230 LEU CB C 230 40.608 40.608 42.241 -1.633 18321 17250 1 13 . 1 1 230 230 LEU H H 230 8.453 8.453 7.753 0.700 18321 17251 1 13 . 1 1 231 231 PRO HA H 231 4.412 4.412 4.357 0.055 18321 17252 1 13 . 1 1 231 231 PRO C C 231 176.571 176.571 176.494 0.077 18321 17253 1 13 . 1 1 231 231 PRO CA C 231 63.225 63.225 64.623 -1.398 18321 17254 1 13 . 1 1 231 231 PRO CB C 231 31.191 31.191 32.136 -0.945 18321 17255 1 13 . 1 1 232 232 SER N N 232 115.169 115.169 112.986 2.183 18321 17256 1 13 . 1 1 232 232 SER HA H 232 4.450 4.450 4.665 -0.215 18321 17257 1 13 . 1 1 232 232 SER CA C 232 58.604 58.604 58.169 0.435 18321 17258 1 13 . 1 1 232 232 SER CB C 232 63.962 63.962 63.678 0.284 18321 17259 1 13 . 1 1 232 232 SER H H 232 8.280 8.280 8.143 0.137 18321 17260 1 13 . 1 1 233 233 THR N N 233 115.155 115.155 113.345 1.810 18321 17261 1 13 . 1 1 233 233 THR HA H 233 4.351 4.351 4.470 -0.119 18321 17262 1 13 . 1 1 233 233 THR C C 233 177.237 177.237 174.525 2.712 18321 17263 1 13 . 1 1 233 233 THR CA C 233 61.939 61.939 61.794 0.145 18321 17264 1 13 . 1 1 233 233 THR CB C 233 68.986 68.986 70.494 -1.508 18321 17265 1 13 . 1 1 233 233 THR H H 233 8.096 8.096 7.866 0.230 18321 17266 1 13 . 1 1 234 234 GLN N N 234 122.040 122.040 122.378 -0.338 18321 17267 1 13 . 1 1 234 234 GLN HA H 234 4.681 4.681 4.409 0.272 18321 17268 1 13 . 1 1 234 234 GLN C C 234 176.177 176.177 175.113 1.064 18321 17269 1 13 . 1 1 234 234 GLN CA C 234 55.861 55.861 55.688 0.173 18321 17270 1 13 . 1 1 234 234 GLN CB C 234 28.583 28.583 28.622 -0.039 18321 17271 1 13 . 1 1 234 234 GLN H H 234 8.256 8.256 8.662 -0.406 18321 17272 1 13 . 1 1 235 235 ASN N N 235 119.506 119.506 117.769 1.737 18321 17273 1 13 . 1 1 235 235 ASN HA H 235 4.775 4.775 4.941 -0.166 18321 17274 1 13 . 1 1 235 235 ASN C C 235 174.974 174.974 174.842 0.132 18321 17275 1 13 . 1 1 235 235 ASN CA C 235 53.191 53.191 51.986 1.204 18321 17276 1 13 . 1 1 235 235 ASN CB C 235 38.511 38.511 40.198 -1.687 18321 17277 1 13 . 1 1 235 235 ASN H H 235 8.346 8.346 7.844 0.502 18321 17278 1 13 . 1 1 236 236 GLY N N 236 109.378 109.378 105.139 4.239 18321 17279 1 13 . 1 1 236 236 GLY CA C 236 44.023 44.023 45.101 -1.078 18321 17280 1 13 . 1 1 236 236 GLY H H 236 7.939 7.939 8.066 -0.127 18321 17281 1 13 . 1 1 237 237 PRO HA H 237 4.336 4.336 4.370 -0.034 18321 17282 1 13 . 1 1 237 237 PRO C C 237 175.942 175.942 175.831 0.111 18321 17283 1 13 . 1 1 237 237 PRO CA C 237 62.797 62.797 62.596 0.201 18321 17284 1 13 . 1 1 237 237 PRO CB C 237 27.421 27.421 31.379 -3.958 18321 17285 1 13 . 1 1 238 238 VAL N N 238 120.535 120.535 123.591 -3.056 18321 17286 1 13 . 1 1 238 238 VAL HA H 238 4.195 4.195 3.811 0.384 18321 17287 1 13 . 1 1 238 238 VAL C C 238 173.775 173.775 174.791 -1.016 18321 17288 1 13 . 1 1 238 238 VAL CA C 238 61.173 61.173 62.236 -1.063 18321 17289 1 13 . 1 1 238 238 VAL CB C 238 38.328 38.328 32.105 6.223 18321 17290 1 13 . 1 1 238 238 VAL H H 238 7.986 7.986 7.839 0.147 18321 17291 1 13 . 1 1 239 239 PHE N N 239 123.522 123.522 124.849 -1.327 18321 17292 1 13 . 1 1 239 239 PHE HA H 239 5.539 5.539 5.447 0.092 18321 17293 1 13 . 1 1 239 239 PHE C C 239 174.207 174.207 174.868 -0.661 18321 17294 1 13 . 1 1 239 239 PHE CA C 239 56.993 56.993 56.190 0.803 18321 17295 1 13 . 1 1 239 239 PHE CB C 239 41.743 41.743 40.482 1.261 18321 17296 1 13 . 1 1 239 239 PHE H H 239 8.927 8.927 8.541 0.386 18321 17297 1 13 . 1 1 240 240 ALA N N 240 120.871 120.871 126.217 -5.346 18321 17298 1 13 . 1 1 240 240 ALA HA H 240 5.352 5.352 5.318 0.034 18321 17299 1 13 . 1 1 240 240 ALA C C 240 174.639 174.639 175.744 -1.105 18321 17300 1 13 . 1 1 240 240 ALA CA C 240 49.736 49.736 50.306 -0.570 18321 17301 1 13 . 1 1 240 240 ALA CB C 240 23.480 23.480 22.306 1.174 18321 17302 1 13 . 1 1 240 240 ALA H H 240 9.398 9.398 8.890 0.508 18321 17303 1 13 . 1 1 241 241 LYS N N 241 121.227 121.227 124.832 -3.605 18321 17304 1 13 . 1 1 241 241 LYS HA H 241 5.373 5.373 4.842 0.531 18321 17305 1 13 . 1 1 241 241 LYS C C 241 176.772 176.772 175.933 0.839 18321 17306 1 13 . 1 1 241 241 LYS CA C 241 53.128 53.128 54.756 -1.628 18321 17307 1 13 . 1 1 241 241 LYS CB C 241 34.850 34.850 33.655 1.195 18321 17308 1 13 . 1 1 241 241 LYS H H 241 8.947 8.947 8.733 0.214 18321 17309 1 13 . 1 1 242 242 ALA N N 242 126.833 126.833 130.761 -3.928 18321 17310 1 13 . 1 1 242 242 ALA HA H 242 4.764 4.764 4.632 0.132 18321 17311 1 13 . 1 1 242 242 ALA C C 242 178.506 178.506 177.789 0.717 18321 17312 1 13 . 1 1 242 242 ALA CA C 242 52.788 52.788 51.296 1.492 18321 17313 1 13 . 1 1 242 242 ALA CB C 242 19.084 19.084 18.554 0.530 18321 17314 1 13 . 1 1 242 242 ALA H H 242 9.373 9.373 8.933 0.440 18321 17315 1 13 . 1 1 243 243 ILE N N 243 118.731 118.731 118.153 0.578 18321 17316 1 13 . 1 1 243 243 ILE HA H 243 4.454 4.454 4.170 0.284 18321 17317 1 13 . 1 1 243 243 ILE C C 243 174.773 174.773 175.774 -1.001 18321 17318 1 13 . 1 1 243 243 ILE CA C 243 60.613 60.613 61.698 -1.085 18321 17319 1 13 . 1 1 243 243 ILE CB C 243 39.232 39.232 38.120 1.112 18321 17320 1 13 . 1 1 243 243 ILE H H 243 8.933 8.933 8.164 0.769 18321 17321 1 13 . 1 1 244 244 GLN N N 244 121.616 121.616 120.065 1.551 18321 17322 1 13 . 1 1 244 244 GLN HA H 244 4.283 4.283 4.559 -0.276 18321 17323 1 13 . 1 1 244 244 GLN C C 244 172.815 172.815 174.640 -1.825 18321 17324 1 13 . 1 1 244 244 GLN CA C 244 54.750 54.750 54.833 -0.083 18321 17325 1 13 . 1 1 244 244 GLN CB C 244 31.469 31.469 32.653 -1.184 18321 17326 1 13 . 1 1 244 244 GLN H H 244 7.438 7.438 7.421 0.017 18321 17327 1 13 . 1 1 245 245 LYS N N 245 124.215 124.215 121.725 2.490 18321 17328 1 13 . 1 1 245 245 LYS HA H 245 3.962 3.962 4.231 -0.269 18321 17329 1 13 . 1 1 245 245 LYS C C 245 175.679 175.679 176.006 -0.327 18321 17330 1 13 . 1 1 245 245 LYS CA C 245 56.413 56.413 56.353 0.060 18321 17331 1 13 . 1 1 245 245 LYS CB C 245 32.847 32.847 33.550 -0.703 18321 17332 1 13 . 1 1 245 245 LYS H H 245 8.318 8.318 8.599 -0.281 18321 17333 1 13 . 1 1 246 246 ARG N N 246 127.327 127.327 117.976 9.351 18321 17334 1 13 . 1 1 246 246 ARG HA H 246 4.221 4.221 4.607 -0.386 18321 17335 1 13 . 1 1 246 246 ARG CA C 246 56.279 56.279 56.167 0.112 18321 17336 1 13 . 1 1 246 246 ARG CB C 246 32.987 32.987 34.858 -1.871 18321 17337 1 13 . 1 1 246 246 ARG H H 246 9.248 9.248 8.695 0.553 18321 17338 1 13 . 1 1 249 249 CYS HA H 249 4.260 4.260 4.385 -0.125 18321 17339 1 13 . 1 1 249 249 CYS CA C 249 55.886 55.886 56.733 -0.847 18321 17340 1 13 . 1 1 249 249 CYS CB C 249 34.146 34.146 29.537 4.609 18321 17341 1 13 . 1 1 250 250 ALA HA H 250 3.926 3.926 4.124 -0.198 18321 17342 1 13 . 1 1 250 250 ALA CA C 250 54.344 54.344 54.308 0.036 18321 17343 1 13 . 1 1 250 250 ALA CB C 250 18.342 18.342 18.680 -0.338 18321 17344 1 13 . 1 1 251 251 TYR N N 251 110.618 110.618 111.381 -0.763 18321 17345 1 13 . 1 1 251 251 TYR HA H 251 4.489 4.489 4.784 -0.295 18321 17346 1 13 . 1 1 251 251 TYR C C 251 175.286 175.286 174.938 0.348 18321 17347 1 13 . 1 1 251 251 TYR CA C 251 56.137 56.137 55.407 0.730 18321 17348 1 13 . 1 1 251 251 TYR CB C 251 37.203 37.203 38.138 -0.935 18321 17349 1 13 . 1 1 251 251 TYR H H 251 7.037 7.037 7.038 -0.001 18321 17350 1 13 . 1 1 252 252 ASP N N 252 121.835 121.835 122.351 -0.516 18321 17351 1 13 . 1 1 252 252 ASP HA H 252 4.763 4.763 4.927 -0.164 18321 17352 1 13 . 1 1 252 252 ASP CA C 252 52.351 52.351 53.787 -1.436 18321 17353 1 13 . 1 1 252 252 ASP CB C 252 39.995 39.995 41.160 -1.165 18321 17354 1 13 . 1 1 252 252 ASP H H 252 7.339 7.339 7.635 -0.296 18321 17355 1 13 . 1 1 253 253 LYS N N 253 123.177 123.177 120.612 2.565 18321 17356 1 13 . 1 1 253 253 LYS HA H 253 4.270 4.270 4.253 0.017 18321 17357 1 13 . 1 1 253 253 LYS C C 253 177.724 177.724 177.740 -0.016 18321 17358 1 13 . 1 1 253 253 LYS CA C 253 57.036 57.036 58.000 -0.964 18321 17359 1 13 . 1 1 253 253 LYS H H 253 8.396 8.396 8.524 -0.128 18321 17360 1 13 . 1 1 254 254 THR N N 254 108.317 108.317 110.246 -1.929 18321 17361 1 13 . 1 1 254 254 THR HA H 254 4.517 4.517 4.380 0.137 18321 17362 1 13 . 1 1 254 254 THR C C 254 174.012 174.012 173.612 0.400 18321 17363 1 13 . 1 1 254 254 THR CA C 254 61.036 61.036 60.914 0.122 18321 17364 1 13 . 1 1 254 254 THR CB C 254 69.307 69.307 68.572 0.735 18321 17365 1 13 . 1 1 254 254 THR H H 254 8.217 8.217 8.278 -0.061 18321 17366 1 13 . 1 1 255 255 ALA N N 255 124.762 124.762 125.114 -0.352 18321 17367 1 13 . 1 1 255 255 ALA HA H 255 4.524 4.524 4.513 0.011 18321 17368 1 13 . 1 1 255 255 ALA C C 255 176.630 176.630 176.620 0.010 18321 17369 1 13 . 1 1 255 255 ALA CA C 255 51.352 51.352 51.021 0.331 18321 17370 1 13 . 1 1 255 255 ALA CB C 255 20.135 20.135 19.295 0.840 18321 17371 1 13 . 1 1 255 255 ALA H H 255 7.096 7.096 7.327 -0.231 18321 17372 1 13 . 1 1 256 256 LEU N N 256 124.379 124.379 125.892 -1.513 18321 17373 1 13 . 1 1 256 256 LEU HA H 256 4.328 4.328 4.320 0.008 18321 17374 1 13 . 1 1 256 256 LEU C C 256 176.007 176.007 175.446 0.561 18321 17375 1 13 . 1 1 256 256 LEU CA C 256 53.502 53.502 54.931 -1.429 18321 17376 1 13 . 1 1 256 256 LEU CB C 256 44.665 44.665 43.538 1.127 18321 17377 1 13 . 1 1 256 256 LEU H H 256 8.889 8.889 7.737 1.152 18321 17378 1 13 . 1 1 257 257 ALA N N 257 129.619 129.619 126.601 3.018 18321 17379 1 13 . 1 1 257 257 ALA HA H 257 4.445 4.445 4.784 -0.339 18321 17380 1 13 . 1 1 257 257 ALA C C 257 176.813 176.813 176.308 0.505 18321 17381 1 13 . 1 1 257 257 ALA CA C 257 51.179 51.179 50.978 0.201 18321 17382 1 13 . 1 1 257 257 ALA CB C 257 18.973 18.973 19.835 -0.863 18321 17383 1 13 . 1 1 257 257 ALA H H 257 8.529 8.529 8.329 0.200 18321 17384 1 13 . 1 1 258 258 LEU N N 258 119.300 119.300 123.129 -3.829 18321 17385 1 13 . 1 1 258 258 LEU HA H 258 4.782 4.782 4.613 0.169 18321 17386 1 13 . 1 1 258 258 LEU CA C 258 53.259 53.259 54.118 -0.859 18321 17387 1 13 . 1 1 258 258 LEU CB C 258 45.972 45.972 46.102 -0.130 18321 17388 1 13 . 1 1 258 258 LEU H H 258 8.505 8.505 8.542 -0.037 18321 17389 1 13 . 1 1 259 259 GLU N N 259 123.919 123.919 119.642 4.277 18321 17390 1 13 . 1 1 259 259 GLU HA H 259 4.516 4.516 4.621 -0.105 18321 17391 1 13 . 1 1 259 259 GLU C C 259 175.795 175.795 175.199 0.596 18321 17392 1 13 . 1 1 259 259 GLU CA C 259 52.896 52.896 53.802 -0.906 18321 17393 1 13 . 1 1 259 259 GLU H H 259 8.943 8.943 8.393 0.550 18321 17394 1 13 . 1 1 260 260 VAL N N 260 122.122 122.122 120.234 1.888 18321 17395 1 13 . 1 1 260 260 VAL HA H 260 2.923 2.923 4.332 -1.409 18321 17396 1 13 . 1 1 260 260 VAL C C 260 177.964 177.964 177.735 0.229 18321 17397 1 13 . 1 1 260 260 VAL CA C 260 65.417 65.417 63.699 1.718 18321 17398 1 13 . 1 1 260 260 VAL CB C 260 30.668 30.668 30.703 -0.035 18321 17399 1 13 . 1 1 260 260 VAL H H 260 8.956 8.956 8.416 0.540 18321 17400 1 13 . 1 1 261 261 GLY N N 261 116.009 116.009 117.247 -1.238 18321 17401 1 13 . 1 1 261 261 GLY C C 261 176.288 176.288 173.946 2.342 18321 17402 1 13 . 1 1 261 261 GLY CA C 261 44.210 44.210 44.636 -0.426 18321 17403 1 13 . 1 1 261 261 GLY H H 261 8.799 8.799 9.052 -0.253 18321 17404 1 13 . 1 1 262 262 ASP N N 262 121.945 121.945 121.632 0.313 18321 17405 1 13 . 1 1 262 262 ASP HA H 262 4.423 4.423 4.917 -0.494 18321 17406 1 13 . 1 1 262 262 ASP C C 262 175.381 175.381 174.993 0.388 18321 17407 1 13 . 1 1 262 262 ASP CA C 262 55.243 55.243 53.990 1.253 18321 17408 1 13 . 1 1 262 262 ASP CB C 262 41.819 41.819 42.270 -0.451 18321 17409 1 13 . 1 1 262 262 ASP H H 262 8.180 8.180 7.706 0.474 18321 17410 1 13 . 1 1 263 263 ILE N N 263 121.452 121.452 123.496 -2.044 18321 17411 1 13 . 1 1 263 263 ILE HA H 263 4.707 4.707 4.630 0.077 18321 17412 1 13 . 1 1 263 263 ILE C C 263 174.996 174.996 176.059 -1.063 18321 17413 1 13 . 1 1 263 263 ILE CA C 263 59.289 59.289 59.105 0.184 18321 17414 1 13 . 1 1 263 263 ILE CB C 263 36.987 36.987 37.496 -0.509 18321 17415 1 13 . 1 1 263 263 ILE H H 263 8.460 8.460 8.564 -0.104 18321 17416 1 13 . 1 1 264 264 VAL N N 264 128.756 128.756 129.606 -0.850 18321 17417 1 13 . 1 1 264 264 VAL HA H 264 4.309 4.309 4.042 0.267 18321 17418 1 13 . 1 1 264 264 VAL C C 264 175.486 175.486 175.082 0.404 18321 17419 1 13 . 1 1 264 264 VAL CA C 264 59.091 59.091 61.243 -2.152 18321 17420 1 13 . 1 1 264 264 VAL CB C 264 34.541 34.541 31.052 3.489 18321 17421 1 13 . 1 1 264 264 VAL H H 264 9.479 9.479 9.175 0.304 18321 17422 1 13 . 1 1 265 265 LYS N N 265 128.101 128.101 130.557 -2.456 18321 17423 1 13 . 1 1 265 265 LYS HA H 265 4.342 4.342 4.548 -0.206 18321 17424 1 13 . 1 1 265 265 LYS C C 265 175.531 175.531 175.494 0.037 18321 17425 1 13 . 1 1 265 265 LYS CA C 265 55.620 55.620 55.719 -0.099 18321 17426 1 13 . 1 1 265 265 LYS CB C 265 33.149 33.149 32.388 0.761 18321 17427 1 13 . 1 1 265 265 LYS H H 265 8.715 8.715 8.665 0.050 18321 17428 1 13 . 1 1 266 266 VAL N N 266 129.537 129.537 128.598 0.939 18321 17429 1 13 . 1 1 266 266 VAL HA H 266 4.333 4.333 4.663 -0.330 18321 17430 1 13 . 1 1 266 266 VAL C C 266 176.166 176.166 174.862 1.304 18321 17431 1 13 . 1 1 266 266 VAL CA C 266 63.339 63.339 60.989 2.350 18321 17432 1 13 . 1 1 266 266 VAL CB C 266 30.712 30.712 33.591 -2.879 18321 17433 1 13 . 1 1 266 266 VAL H H 266 9.073 9.073 8.731 0.342 18321 17434 1 13 . 1 1 267 267 THR N N 267 120.020 120.020 121.904 -1.884 18321 17435 1 13 . 1 1 267 267 THR HA H 267 4.189 4.189 4.403 -0.214 18321 17436 1 13 . 1 1 267 267 THR C C 267 176.054 176.054 175.180 0.874 18321 17437 1 13 . 1 1 267 267 THR CA C 267 62.204 62.204 62.800 -0.596 18321 17438 1 13 . 1 1 267 267 THR CB C 267 68.200 68.200 69.288 -1.088 18321 17439 1 13 . 1 1 267 267 THR H H 267 9.130 9.130 8.285 0.845 18321 17440 1 13 . 1 1 268 268 ARG N N 268 120.839 120.839 123.059 -2.220 18321 17441 1 13 . 1 1 268 268 ARG HA H 268 4.236 4.236 4.558 -0.322 18321 17442 1 13 . 1 1 268 268 ARG CA C 268 56.321 56.321 55.009 1.312 18321 17443 1 13 . 1 1 268 268 ARG CB C 268 33.049 33.049 32.240 0.809 18321 17444 1 13 . 1 1 268 268 ARG H H 268 7.631 7.631 7.461 0.170 18321 17445 1 13 . 1 1 269 269 MET N N 269 125.443 125.443 125.134 0.309 18321 17446 1 13 . 1 1 269 269 MET C C 269 174.392 174.392 174.379 0.013 18321 17447 1 13 . 1 1 269 269 MET H H 269 8.532 8.532 8.512 0.020 18321 17448 1 13 . 1 1 270 270 ASN N N 270 119.125 119.125 122.011 -2.886 18321 17449 1 13 . 1 1 270 270 ASN HA H 270 4.546 4.546 4.957 -0.411 18321 17450 1 13 . 1 1 270 270 ASN C C 270 172.133 172.133 176.569 -4.436 18321 17451 1 13 . 1 1 270 270 ASN CA C 270 53.639 53.639 52.609 1.030 18321 17452 1 13 . 1 1 270 270 ASN CB C 270 39.845 39.845 39.675 0.171 18321 17453 1 13 . 1 1 270 270 ASN H H 270 6.631 6.631 8.848 -2.217 18321 17454 1 13 . 1 1 271 271 ILE N N 271 122.532 122.532 119.194 3.338 18321 17455 1 13 . 1 1 271 271 ILE HA H 271 4.417 4.417 4.146 0.271 18321 17456 1 13 . 1 1 271 271 ILE CA C 271 63.348 63.348 62.736 0.612 18321 17457 1 13 . 1 1 271 271 ILE CB C 271 38.198 38.198 36.442 1.756 18321 17458 1 13 . 1 1 271 271 ILE H H 271 8.565 8.565 8.576 -0.011 18321 17459 1 13 . 1 1 272 272 ASN HA H 272 4.527 4.527 4.715 -0.188 18321 17460 1 13 . 1 1 272 272 ASN C C 272 176.259 176.259 176.428 -0.169 18321 17461 1 13 . 1 1 272 272 ASN CA C 272 53.225 53.225 53.430 -0.205 18321 17462 1 13 . 1 1 272 272 ASN CB C 272 37.565 37.565 39.631 -2.066 18321 17463 1 13 . 1 1 273 273 GLY N N 273 107.043 107.043 108.740 -1.697 18321 17464 1 13 . 1 1 273 273 GLY C C 273 173.216 173.216 172.474 0.742 18321 17465 1 13 . 1 1 273 273 GLY CA C 273 45.299 45.299 44.977 0.322 18321 17466 1 13 . 1 1 273 273 GLY H H 273 8.086 8.086 7.884 0.202 18321 17467 1 13 . 1 1 274 274 GLN N N 274 120.624 120.624 120.693 -0.069 18321 17468 1 13 . 1 1 274 274 GLN HA H 274 4.551 4.551 4.348 0.203 18321 17469 1 13 . 1 1 274 274 GLN C C 274 175.039 175.039 175.230 -0.191 18321 17470 1 13 . 1 1 274 274 GLN CA C 274 54.556 54.556 54.544 0.012 18321 17471 1 13 . 1 1 274 274 GLN CB C 274 33.698 33.698 29.227 4.471 18321 17472 1 13 . 1 1 274 274 GLN H H 274 8.045 8.045 8.078 -0.033 18321 17473 1 13 . 1 1 275 275 TRP N N 275 125.596 125.596 124.683 0.913 18321 17474 1 13 . 1 1 275 275 TRP HA H 275 4.588 4.588 4.660 -0.072 18321 17475 1 13 . 1 1 275 275 TRP C C 275 172.832 172.832 175.705 -2.873 18321 17476 1 13 . 1 1 275 275 TRP CA C 275 55.296 55.296 54.362 0.934 18321 17477 1 13 . 1 1 275 275 TRP CB C 275 31.393 31.393 30.276 1.117 18321 17478 1 13 . 1 1 275 275 TRP H H 275 8.484 8.484 8.107 0.377 18321 17479 1 13 . 1 1 276 276 GLU N N 276 119.012 119.012 120.809 -1.797 18321 17480 1 13 . 1 1 276 276 GLU HA H 276 5.190 5.190 5.005 0.185 18321 17481 1 13 . 1 1 276 276 GLU C C 276 176.553 176.553 176.362 0.191 18321 17482 1 13 . 1 1 276 276 GLU CA C 276 54.288 54.288 55.532 -1.244 18321 17483 1 13 . 1 1 276 276 GLU CB C 276 32.851 32.851 30.564 2.287 18321 17484 1 13 . 1 1 276 276 GLU H H 276 8.643 8.643 8.801 -0.158 18321 17485 1 13 . 1 1 277 277 GLY N N 277 111.364 111.364 112.827 -1.463 18321 17486 1 13 . 1 1 277 277 GLY C C 277 170.707 170.707 172.694 -1.987 18321 17487 1 13 . 1 1 277 277 GLY CA C 277 46.723 46.723 43.930 2.793 18321 17488 1 13 . 1 1 277 277 GLY H H 277 9.072 9.072 9.081 -0.009 18321 17489 1 13 . 1 1 278 278 GLU N N 278 117.733 117.733 122.228 -4.495 18321 17490 1 13 . 1 1 278 278 GLU HA H 278 5.748 5.748 4.853 0.895 18321 17491 1 13 . 1 1 278 278 GLU C C 278 176.051 176.051 175.060 0.991 18321 17492 1 13 . 1 1 278 278 GLU CA C 278 53.620 53.620 55.719 -2.099 18321 17493 1 13 . 1 1 278 278 GLU CB C 278 33.742 33.742 31.448 2.294 18321 17494 1 13 . 1 1 278 278 GLU H H 278 8.810 8.810 8.298 0.512 18321 17495 1 13 . 1 1 279 279 VAL N N 279 123.834 123.834 123.926 -0.092 18321 17496 1 13 . 1 1 279 279 VAL HA H 279 4.404 4.404 4.395 0.009 18321 17497 1 13 . 1 1 279 279 VAL C C 279 175.289 175.289 175.834 -0.545 18321 17498 1 13 . 1 1 279 279 VAL CA C 279 61.166 61.166 60.721 0.445 18321 17499 1 13 . 1 1 279 279 VAL CB C 279 34.123 34.123 35.132 -1.009 18321 17500 1 13 . 1 1 279 279 VAL H H 279 8.887 8.887 8.915 -0.028 18321 17501 1 13 . 1 1 280 280 ASN N N 280 126.025 126.025 126.176 -0.151 18321 17502 1 13 . 1 1 280 280 ASN HA H 280 4.435 4.435 4.430 0.005 18321 17503 1 13 . 1 1 280 280 ASN C C 280 175.205 175.205 175.655 -0.450 18321 17504 1 13 . 1 1 280 280 ASN CA C 280 45.615 45.615 53.777 -8.162 18321 17505 1 13 . 1 1 280 280 ASN CB C 280 37.386 37.386 37.449 -0.063 18321 17506 1 13 . 1 1 280 280 ASN H H 280 9.322 9.322 9.266 0.056 18321 17507 1 13 . 1 1 281 281 GLY N N 281 104.588 104.588 103.135 1.453 18321 17508 1 13 . 1 1 281 281 GLY C C 281 173.944 173.944 173.548 0.396 18321 17509 1 13 . 1 1 281 281 GLY CA C 281 45.224 45.224 44.975 0.249 18321 17510 1 13 . 1 1 281 281 GLY H H 281 8.768 8.768 8.296 0.472 18321 17511 1 13 . 1 1 282 282 ARG N N 282 122.567 122.567 122.690 -0.123 18321 17512 1 13 . 1 1 282 282 ARG HA H 282 4.559 4.559 4.689 -0.130 18321 17513 1 13 . 1 1 282 282 ARG C C 282 174.350 174.350 174.163 0.187 18321 17514 1 13 . 1 1 282 282 ARG CA C 282 54.933 54.933 54.469 0.464 18321 17515 1 13 . 1 1 282 282 ARG CB C 282 31.765 31.765 32.634 -0.869 18321 17516 1 13 . 1 1 282 282 ARG H H 282 8.149 8.149 7.955 0.194 18321 17517 1 13 . 1 1 283 283 LYS N N 283 121.565 121.565 125.787 -4.222 18321 17518 1 13 . 1 1 283 283 LYS HA H 283 5.584 5.584 5.614 -0.030 18321 17519 1 13 . 1 1 283 283 LYS CA C 283 54.143 54.143 54.671 -0.528 18321 17520 1 13 . 1 1 283 283 LYS CB C 283 36.040 36.040 34.964 1.076 18321 17521 1 13 . 1 1 283 283 LYS H H 283 8.424 8.424 8.558 -0.134 18321 17522 1 13 . 1 1 284 284 GLY C C 284 173.006 173.006 172.203 0.803 18321 17523 1 13 . 1 1 284 284 GLY CA C 284 45.886 45.886 45.396 0.490 18321 17524 1 13 . 1 1 285 285 LEU N N 285 119.673 119.673 121.211 -1.538 18321 17525 1 13 . 1 1 285 285 LEU HA H 285 5.718 5.718 5.683 0.035 18321 17526 1 13 . 1 1 285 285 LEU C C 285 178.657 178.657 176.489 2.168 18321 17527 1 13 . 1 1 285 285 LEU CA C 285 53.656 53.656 54.154 -0.498 18321 17528 1 13 . 1 1 285 285 LEU CB C 285 44.813 44.813 43.506 1.307 18321 17529 1 13 . 1 1 285 285 LEU H H 285 8.734 8.734 8.860 -0.126 18321 17530 1 13 . 1 1 286 286 PHE N N 286 118.785 118.785 120.025 -1.240 18321 17531 1 13 . 1 1 286 286 PHE HA H 286 4.521 4.521 5.263 -0.742 18321 17532 1 13 . 1 1 286 286 PHE CA C 286 57.592 57.592 54.634 2.958 18321 17533 1 13 . 1 1 286 286 PHE CB C 286 40.669 40.669 40.011 0.658 18321 17534 1 13 . 1 1 286 286 PHE H H 286 9.120 9.120 8.838 0.282 18321 17535 1 13 . 1 1 287 287 PRO HA H 287 4.385 4.385 4.580 -0.195 18321 17536 1 13 . 1 1 287 287 PRO CA C 287 62.814 62.814 61.935 0.879 18321 17537 1 13 . 1 1 287 287 PRO CB C 287 32.133 32.133 32.146 -0.013 18321 17538 1 13 . 1 1 288 288 PHE C C 288 174.837 174.837 176.291 -1.454 18321 17539 1 13 . 1 1 288 288 PHE CA C 288 59.020 59.020 59.510 -0.490 18321 17540 1 13 . 1 1 288 288 PHE CB C 288 34.987 34.987 37.633 -2.646 18321 17541 1 13 . 1 1 289 289 THR N N 289 107.865 107.865 116.904 -9.039 18321 17542 1 13 . 1 1 289 289 THR HA H 289 3.589 3.589 3.714 -0.125 18321 17543 1 13 . 1 1 289 289 THR C C 289 176.125 176.125 175.797 0.328 18321 17544 1 13 . 1 1 289 289 THR CA C 289 62.243 62.243 66.694 -4.451 18321 17545 1 13 . 1 1 289 289 THR CB C 289 69.365 69.365 68.109 1.256 18321 17546 1 13 . 1 1 289 289 THR H H 289 6.453 6.453 7.804 -1.351 18321 17547 1 13 . 1 1 290 290 HIS N N 290 119.462 119.462 114.762 4.700 18321 17548 1 13 . 1 1 290 290 HIS HA H 290 4.196 4.196 4.777 -0.581 18321 17549 1 13 . 1 1 290 290 HIS C C 290 175.165 175.165 173.592 1.573 18321 17550 1 13 . 1 1 290 290 HIS CA C 290 57.635 57.635 53.839 3.796 18321 17551 1 13 . 1 1 290 290 HIS CB C 290 29.840 29.840 30.061 -0.221 18321 17552 1 13 . 1 1 290 290 HIS H H 290 7.835 7.835 7.975 -0.140 18321 17553 1 13 . 1 1 291 291 VAL N N 291 110.050 110.050 113.220 -3.170 18321 17554 1 13 . 1 1 291 291 VAL HA H 291 5.445 5.445 5.327 0.118 18321 17555 1 13 . 1 1 291 291 VAL C C 291 173.386 173.386 174.760 -1.374 18321 17556 1 13 . 1 1 291 291 VAL CA C 291 57.794 57.794 59.194 -1.400 18321 17557 1 13 . 1 1 291 291 VAL CB C 291 35.784 35.784 35.555 0.229 18321 17558 1 13 . 1 1 291 291 VAL H H 291 7.562 7.562 7.138 0.424 18321 17559 1 13 . 1 1 292 292 LYS N N 292 119.445 119.445 122.132 -2.687 18321 17560 1 13 . 1 1 292 292 LYS HA H 292 4.857 4.857 4.916 -0.059 18321 17561 1 13 . 1 1 292 292 LYS C C 292 176.512 176.512 175.573 0.939 18321 17562 1 13 . 1 1 292 292 LYS CA C 292 54.647 54.647 53.724 0.923 18321 17563 1 13 . 1 1 292 292 LYS CB C 292 35.665 35.665 36.436 -0.771 18321 17564 1 13 . 1 1 292 292 LYS H H 292 8.753 8.753 8.148 0.605 18321 17565 1 13 . 1 1 293 293 ILE N N 293 128.707 128.707 123.936 4.771 18321 17566 1 13 . 1 1 293 293 ILE HA H 293 4.509 4.509 4.815 -0.306 18321 17567 1 13 . 1 1 293 293 ILE C C 293 175.666 175.666 176.775 -1.109 18321 17568 1 13 . 1 1 293 293 ILE CA C 293 62.563 62.563 62.217 0.346 18321 17569 1 13 . 1 1 293 293 ILE CB C 293 38.076 38.076 38.870 -0.794 18321 17570 1 13 . 1 1 293 293 ILE H H 293 9.107 9.107 8.809 0.298 18321 17571 1 13 . 1 1 294 294 PHE N N 294 126.638 126.638 125.245 1.393 18321 17572 1 13 . 1 1 294 294 PHE HA H 294 4.898 4.898 4.844 0.054 18321 17573 1 13 . 1 1 294 294 PHE C C 294 175.838 175.838 173.340 2.498 18321 17574 1 13 . 1 1 294 294 PHE CA C 294 56.335 56.335 56.119 0.216 18321 17575 1 13 . 1 1 294 294 PHE CB C 294 41.196 41.196 40.683 0.513 18321 17576 1 13 . 1 1 294 294 PHE H H 294 8.716 8.716 8.306 0.410 18321 17577 1 13 . 1 1 295 295 ASP N N 295 122.961 122.961 121.429 1.532 18321 17578 1 13 . 1 1 295 295 ASP HA H 295 5.003 5.003 4.859 0.144 18321 17579 1 13 . 1 1 295 295 ASP CA C 295 50.602 50.602 51.737 -1.135 18321 17580 1 13 . 1 1 295 295 ASP CB C 295 40.754 40.754 41.174 -0.420 18321 17581 1 13 . 1 1 295 295 ASP H H 295 8.418 8.418 8.480 -0.062 18321 17582 1 13 . 1 1 296 296 PRO HA H 296 4.524 4.524 4.200 0.324 18321 17583 1 13 . 1 1 296 296 PRO C C 296 176.807 176.807 176.834 -0.027 18321 17584 1 13 . 1 1 296 296 PRO CA C 296 62.987 62.987 64.061 -1.074 18321 17585 1 13 . 1 1 296 296 PRO CB C 296 32.033 32.033 31.933 0.100 18321 17586 1 13 . 1 1 297 297 GLN N N 297 120.729 120.729 118.527 2.202 18321 17587 1 13 . 1 1 297 297 GLN HA H 297 4.274 4.274 4.442 -0.168 18321 17588 1 13 . 1 1 297 297 GLN CA C 297 56.427 56.427 54.724 1.703 18321 17589 1 13 . 1 1 297 297 GLN CB C 297 28.819 28.819 27.230 1.589 18321 17590 1 13 . 1 1 297 297 GLN H H 297 8.551 8.551 8.068 0.483 18321 17591 1 13 . 1 1 299 299 PRO C C 299 176.936 176.936 177.975 -1.039 18321 17592 1 13 . 1 1 299 299 PRO CA C 299 63.406 63.406 65.335 -1.929 18321 17593 1 13 . 1 1 299 299 PRO CB C 299 31.421 31.421 31.902 -0.481 18321 17594 1 13 . 1 1 300 300 ASP N N 300 119.609 119.609 115.600 4.009 18321 17595 1 13 . 1 1 300 300 ASP C C 300 176.344 176.344 177.387 -1.043 18321 17596 1 13 . 1 1 300 300 ASP CA C 300 54.178 54.178 56.353 -2.175 18321 17597 1 13 . 1 1 300 300 ASP CB C 300 40.661 40.661 40.130 0.531 18321 17598 1 13 . 1 1 300 300 ASP H H 300 8.239 8.239 8.746 -0.507 18321 17599 1 13 . 1 1 301 301 GLU N N 301 120.462 120.462 118.092 2.370 18321 17600 1 13 . 1 1 301 301 GLU CA C 301 56.188 56.188 57.251 -1.063 18321 17601 1 13 . 1 1 301 301 GLU CB C 301 29.507 29.507 30.124 -0.617 18321 17602 1 13 . 1 1 301 301 GLU H H 301 8.084 8.084 7.721 0.363 18321 17603 1 14 . 1 1 2 2 SER HA H 2 4.521 4.521 4.701 -0.180 18321 17604 1 14 . 1 1 2 2 SER CA C 2 58.326 58.326 58.697 -0.371 18321 17605 1 14 . 1 1 2 2 SER CB C 2 64.062 64.062 64.132 -0.070 18321 17606 1 14 . 1 1 3 3 SER HA H 3 4.465 4.465 4.076 0.389 18321 17607 1 14 . 1 1 3 3 SER C C 3 173.887 173.887 174.040 -0.153 18321 17608 1 14 . 1 1 3 3 SER CA C 3 58.374 58.374 60.383 -2.009 18321 17609 1 14 . 1 1 3 3 SER CB C 3 63.920 63.920 62.260 1.660 18321 17610 1 14 . 1 1 4 4 ALA N N 4 124.755 124.755 126.538 -1.783 18321 17611 1 14 . 1 1 4 4 ALA HA H 4 4.547 4.547 4.758 -0.211 18321 17612 1 14 . 1 1 4 4 ALA CA C 4 52.737 52.737 51.943 0.794 18321 17613 1 14 . 1 1 4 4 ALA CB C 4 19.636 19.636 18.714 0.922 18321 17614 1 14 . 1 1 4 4 ALA H H 4 8.244 8.244 8.058 0.186 18321 17615 1 14 . 1 1 5 5 ARG N N 5 120.383 120.383 127.461 -7.078 18321 17616 1 14 . 1 1 5 5 ARG HA H 5 4.524 4.524 4.595 -0.071 18321 17617 1 14 . 1 1 5 5 ARG C C 5 175.611 175.611 174.577 1.034 18321 17618 1 14 . 1 1 5 5 ARG CA C 5 56.082 56.082 54.523 1.559 18321 17619 1 14 . 1 1 5 5 ARG CB C 5 30.695 30.695 29.664 1.031 18321 17620 1 14 . 1 1 5 5 ARG H H 5 8.727 8.727 8.118 0.609 18321 17621 1 14 . 1 1 6 6 PHE N N 6 115.159 115.159 122.456 -7.297 18321 17622 1 14 . 1 1 6 6 PHE HA H 6 4.786 4.786 4.844 -0.058 18321 17623 1 14 . 1 1 6 6 PHE C C 6 172.076 172.076 173.793 -1.717 18321 17624 1 14 . 1 1 6 6 PHE CA C 6 56.640 56.640 56.319 0.321 18321 17625 1 14 . 1 1 6 6 PHE CB C 6 40.378 40.378 40.683 -0.305 18321 17626 1 14 . 1 1 6 6 PHE H H 6 7.536 7.536 7.717 -0.181 18321 17627 1 14 . 1 1 7 7 ASP N N 7 121.846 121.846 123.409 -1.563 18321 17628 1 14 . 1 1 7 7 ASP HA H 7 4.846 4.846 4.362 0.484 18321 17629 1 14 . 1 1 7 7 ASP CA C 7 52.327 52.327 56.344 -4.017 18321 17630 1 14 . 1 1 7 7 ASP CB C 7 41.298 41.298 41.157 0.140 18321 17631 1 14 . 1 1 7 7 ASP H H 7 9.062 9.062 8.856 0.206 18321 17632 1 14 . 1 1 8 8 SER HA H 8 3.950 3.950 4.259 -0.309 18321 17633 1 14 . 1 1 8 8 SER C C 8 174.705 174.705 174.675 0.030 18321 17634 1 14 . 1 1 8 8 SER CA C 8 61.937 61.937 60.120 1.817 18321 17635 1 14 . 1 1 8 8 SER CB C 8 62.260 62.260 62.592 -0.332 18321 17636 1 14 . 1 1 9 9 SER N N 9 114.373 114.373 115.500 -1.127 18321 17637 1 14 . 1 1 9 9 SER HA H 9 4.529 4.529 4.852 -0.323 18321 17638 1 14 . 1 1 9 9 SER C C 9 175.089 175.089 174.210 0.879 18321 17639 1 14 . 1 1 9 9 SER CA C 9 59.851 59.851 59.508 0.343 18321 17640 1 14 . 1 1 9 9 SER CB C 9 64.246 64.246 64.204 0.042 18321 17641 1 14 . 1 1 9 9 SER H H 9 8.722 8.722 8.042 0.680 18321 17642 1 14 . 1 1 10 10 ASP N N 10 121.818 121.818 122.386 -0.568 18321 17643 1 14 . 1 1 10 10 ASP HA H 10 4.730 4.730 4.566 0.164 18321 17644 1 14 . 1 1 10 10 ASP C C 10 174.455 174.455 177.075 -2.620 18321 17645 1 14 . 1 1 10 10 ASP CA C 10 52.432 52.432 54.529 -2.097 18321 17646 1 14 . 1 1 10 10 ASP CB C 10 39.607 39.607 41.136 -1.529 18321 17647 1 14 . 1 1 10 10 ASP H H 10 7.600 7.600 8.505 -0.905 18321 17648 1 14 . 1 1 11 11 ARG N N 11 125.238 125.238 126.528 -1.290 18321 17649 1 14 . 1 1 11 11 ARG HA H 11 1.936 1.936 3.048 -1.112 18321 17650 1 14 . 1 1 11 11 ARG C C 11 176.916 176.916 176.768 0.148 18321 17651 1 14 . 1 1 11 11 ARG CA C 11 57.451 57.451 58.060 -0.609 18321 17652 1 14 . 1 1 11 11 ARG CB C 11 43.014 43.014 29.487 13.527 18321 17653 1 14 . 1 1 11 11 ARG H H 11 7.739 7.739 8.099 -0.360 18321 17654 1 14 . 1 1 12 12 SER N N 12 112.065 112.065 112.139 -0.074 18321 17655 1 14 . 1 1 12 12 SER HA H 12 4.695 4.695 4.181 0.514 18321 17656 1 14 . 1 1 12 12 SER C C 12 175.092 175.092 174.517 0.575 18321 17657 1 14 . 1 1 12 12 SER CA C 12 60.785 60.785 59.865 0.920 18321 17658 1 14 . 1 1 12 12 SER CB C 12 62.889 62.889 62.341 0.548 18321 17659 1 14 . 1 1 12 12 SER H H 12 7.888 7.888 8.302 -0.414 18321 17660 1 14 . 1 1 13 13 ALA N N 13 122.249 122.249 122.184 0.065 18321 17661 1 14 . 1 1 13 13 ALA HA H 13 4.216 4.216 4.294 -0.078 18321 17662 1 14 . 1 1 13 13 ALA C C 13 178.069 178.069 177.294 0.775 18321 17663 1 14 . 1 1 13 13 ALA CA C 13 53.562 53.562 53.600 -0.038 18321 17664 1 14 . 1 1 13 13 ALA CB C 13 19.339 19.339 20.010 -0.671 18321 17665 1 14 . 1 1 13 13 ALA H H 13 7.418 7.418 7.445 -0.027 18321 17666 1 14 . 1 1 14 14 TRP N N 14 107.433 107.433 111.867 -4.434 18321 17667 1 14 . 1 1 14 14 TRP HA H 14 4.785 4.785 4.627 0.158 18321 17668 1 14 . 1 1 14 14 TRP C C 14 175.286 175.286 175.804 -0.518 18321 17669 1 14 . 1 1 14 14 TRP CA C 14 55.212 55.212 55.172 0.040 18321 17670 1 14 . 1 1 14 14 TRP CB C 14 32.776 32.776 31.029 1.747 18321 17671 1 14 . 1 1 14 14 TRP H H 14 6.273 6.273 6.809 -0.536 18321 17672 1 14 . 1 1 15 15 TYR N N 15 122.315 122.315 124.707 -2.392 18321 17673 1 14 . 1 1 15 15 TYR HA H 15 5.436 5.436 4.707 0.729 18321 17674 1 14 . 1 1 15 15 TYR C C 15 175.325 175.325 174.698 0.627 18321 17675 1 14 . 1 1 15 15 TYR CA C 15 56.609 56.609 58.282 -1.673 18321 17676 1 14 . 1 1 15 15 TYR CB C 15 36.940 36.940 37.374 -0.434 18321 17677 1 14 . 1 1 15 15 TYR H H 15 8.221 8.221 7.558 0.663 18321 17678 1 14 . 1 1 16 16 MET N N 16 126.031 126.031 127.937 -1.906 18321 17679 1 14 . 1 1 16 16 MET HA H 16 4.462 4.462 4.348 0.114 18321 17680 1 14 . 1 1 16 16 MET CA C 16 53.046 53.046 52.940 0.106 18321 17681 1 14 . 1 1 16 16 MET CB C 16 41.114 41.114 33.447 7.667 18321 17682 1 14 . 1 1 16 16 MET H H 16 8.989 8.989 8.431 0.558 18321 17683 1 14 . 1 1 17 17 GLY CA C 17 45.803 45.803 45.441 0.362 18321 17684 1 14 . 1 1 18 18 PRO HA H 18 4.675 4.675 4.546 0.129 18321 17685 1 14 . 1 1 18 18 PRO C C 18 175.943 175.943 175.926 0.017 18321 17686 1 14 . 1 1 18 18 PRO CA C 18 63.647 63.647 63.281 0.366 18321 17687 1 14 . 1 1 18 18 PRO CB C 18 29.276 29.276 30.502 -1.226 18321 17688 1 14 . 1 1 19 19 VAL N N 19 126.159 126.159 122.127 4.032 18321 17689 1 14 . 1 1 19 19 VAL HA H 19 4.011 4.011 4.422 -0.411 18321 17690 1 14 . 1 1 19 19 VAL C C 19 175.812 175.812 174.751 1.061 18321 17691 1 14 . 1 1 19 19 VAL CA C 19 62.355 62.355 60.487 1.868 18321 17692 1 14 . 1 1 19 19 VAL CB C 19 33.468 33.468 35.618 -2.150 18321 17693 1 14 . 1 1 19 19 VAL H H 19 7.851 7.851 7.831 0.020 18321 17694 1 14 . 1 1 20 20 SER N N 20 123.950 123.950 114.308 9.642 18321 17695 1 14 . 1 1 20 20 SER HA H 20 4.453 4.453 4.886 -0.433 18321 17696 1 14 . 1 1 20 20 SER CA C 20 57.631 57.631 56.604 1.027 18321 17697 1 14 . 1 1 20 20 SER CB C 20 65.951 65.951 66.007 -0.056 18321 17698 1 14 . 1 1 20 20 SER H H 20 8.800 8.800 8.114 0.686 18321 17699 1 14 . 1 1 21 21 ARG N N 21 123.461 123.461 122.296 1.165 18321 17700 1 14 . 1 1 21 21 ARG HA H 21 3.489 3.489 4.078 -0.589 18321 17701 1 14 . 1 1 21 21 ARG C C 21 178.164 178.164 178.289 -0.125 18321 17702 1 14 . 1 1 21 21 ARG CA C 21 60.025 60.025 59.987 0.038 18321 17703 1 14 . 1 1 21 21 ARG CB C 21 30.334 30.334 30.174 0.160 18321 17704 1 14 . 1 1 21 21 ARG H H 21 9.307 9.307 8.910 0.397 18321 17705 1 14 . 1 1 22 22 GLN N N 22 116.591 116.591 117.953 -1.362 18321 17706 1 14 . 1 1 22 22 GLN HA H 22 4.008 4.008 4.038 -0.030 18321 17707 1 14 . 1 1 22 22 GLN CA C 22 59.095 59.095 58.636 0.459 18321 17708 1 14 . 1 1 22 22 GLN CB C 22 29.249 29.249 27.699 1.550 18321 17709 1 14 . 1 1 22 22 GLN H H 22 8.394 8.394 8.250 0.144 18321 17710 1 14 . 1 1 23 23 GLU N N 23 122.191 122.191 120.119 2.072 18321 17711 1 14 . 1 1 23 23 GLU HA H 23 4.037 4.037 4.007 0.030 18321 17712 1 14 . 1 1 23 23 GLU C C 23 178.986 178.986 178.669 0.317 18321 17713 1 14 . 1 1 23 23 GLU CA C 23 59.081 59.081 59.080 0.001 18321 17714 1 14 . 1 1 23 23 GLU CB C 23 31.896 31.896 29.206 2.690 18321 17715 1 14 . 1 1 23 23 GLU H H 23 8.106 8.106 7.777 0.329 18321 17716 1 14 . 1 1 24 24 ALA N N 24 121.964 121.964 121.345 0.619 18321 17717 1 14 . 1 1 24 24 ALA HA H 24 3.762 3.762 4.039 -0.277 18321 17718 1 14 . 1 1 24 24 ALA C C 24 178.653 178.653 179.851 -1.198 18321 17719 1 14 . 1 1 24 24 ALA CA C 24 55.480 55.480 55.218 0.262 18321 17720 1 14 . 1 1 24 24 ALA CB C 24 18.049 18.049 18.152 -0.103 18321 17721 1 14 . 1 1 24 24 ALA H H 24 8.732 8.732 8.144 0.588 18321 17722 1 14 . 1 1 25 25 GLN N N 25 116.229 116.229 116.859 -0.630 18321 17723 1 14 . 1 1 25 25 GLN HA H 25 3.950 3.950 4.092 -0.142 18321 17724 1 14 . 1 1 25 25 GLN C C 25 177.442 177.442 177.719 -0.277 18321 17725 1 14 . 1 1 25 25 GLN CA C 25 59.651 59.651 58.189 1.462 18321 17726 1 14 . 1 1 25 25 GLN CB C 25 29.308 29.308 28.583 0.725 18321 17727 1 14 . 1 1 25 25 GLN H H 25 8.391 8.391 7.742 0.649 18321 17728 1 14 . 1 1 26 26 THR N N 26 115.105 115.105 114.163 0.942 18321 17729 1 14 . 1 1 26 26 THR HA H 26 3.920 3.920 4.107 -0.187 18321 17730 1 14 . 1 1 26 26 THR C C 26 176.835 176.835 177.093 -0.258 18321 17731 1 14 . 1 1 26 26 THR CA C 26 66.335 66.335 66.131 0.204 18321 17732 1 14 . 1 1 26 26 THR CB C 26 68.876 68.876 68.739 0.137 18321 17733 1 14 . 1 1 26 26 THR H H 26 8.223 8.223 7.769 0.454 18321 17734 1 14 . 1 1 27 27 ARG N N 27 119.096 119.096 119.519 -0.423 18321 17735 1 14 . 1 1 27 27 ARG HA H 27 4.047 4.047 4.191 -0.144 18321 17736 1 14 . 1 1 27 27 ARG C C 27 177.245 177.245 177.425 -0.180 18321 17737 1 14 . 1 1 27 27 ARG CA C 27 58.528 58.528 57.627 0.901 18321 17738 1 14 . 1 1 27 27 ARG CB C 27 30.184 30.184 30.092 0.092 18321 17739 1 14 . 1 1 27 27 ARG H H 27 8.093 8.093 8.061 0.032 18321 17740 1 14 . 1 1 28 28 LEU N N 28 114.602 114.602 116.326 -1.724 18321 17741 1 14 . 1 1 28 28 LEU HA H 28 4.325 4.325 4.557 -0.232 18321 17742 1 14 . 1 1 28 28 LEU C C 28 177.197 177.197 175.938 1.259 18321 17743 1 14 . 1 1 28 28 LEU CA C 28 55.143 55.143 53.452 1.691 18321 17744 1 14 . 1 1 28 28 LEU CB C 28 44.902 44.902 42.736 2.166 18321 17745 1 14 . 1 1 28 28 LEU H H 28 7.438 7.438 7.414 0.024 18321 17746 1 14 . 1 1 29 29 GLN N N 29 121.312 121.312 121.164 0.148 18321 17747 1 14 . 1 1 29 29 GLN HA H 29 3.856 3.856 4.165 -0.309 18321 17748 1 14 . 1 1 29 29 GLN C C 29 178.048 178.048 176.979 1.069 18321 17749 1 14 . 1 1 29 29 GLN CA C 29 57.691 57.691 56.392 1.300 18321 17750 1 14 . 1 1 29 29 GLN CB C 29 27.293 27.293 27.049 0.244 18321 17751 1 14 . 1 1 29 29 GLN H H 29 8.250 8.250 7.495 0.755 18321 17752 1 14 . 1 1 30 30 GLY N N 30 116.768 116.768 113.833 2.935 18321 17753 1 14 . 1 1 30 30 GLY C C 30 174.914 174.914 174.359 0.555 18321 17754 1 14 . 1 1 30 30 GLY CA C 30 45.491 45.491 45.924 -0.433 18321 17755 1 14 . 1 1 30 30 GLY H H 30 9.135 9.135 9.006 0.129 18321 17756 1 14 . 1 1 31 31 GLN N N 31 117.979 117.979 120.886 -2.907 18321 17757 1 14 . 1 1 31 31 GLN HA H 31 4.329 4.329 3.712 0.617 18321 17758 1 14 . 1 1 31 31 GLN C C 31 177.174 177.174 176.718 0.456 18321 17759 1 14 . 1 1 31 31 GLN CA C 31 53.910 53.910 58.251 -4.341 18321 17760 1 14 . 1 1 31 31 GLN CB C 31 29.574 29.574 28.213 1.361 18321 17761 1 14 . 1 1 31 31 GLN H H 31 7.695 7.695 7.921 -0.226 18321 17762 1 14 . 1 1 32 32 ARG N N 32 123.918 123.918 116.626 7.292 18321 17763 1 14 . 1 1 32 32 ARG HA H 32 3.940 3.940 4.406 -0.466 18321 17764 1 14 . 1 1 32 32 ARG C C 32 175.810 175.810 175.709 0.101 18321 17765 1 14 . 1 1 32 32 ARG CA C 32 56.770 56.770 55.680 1.090 18321 17766 1 14 . 1 1 32 32 ARG CB C 32 30.074 30.074 31.658 -1.584 18321 17767 1 14 . 1 1 32 32 ARG H H 32 8.955 8.955 7.931 1.024 18321 17768 1 14 . 1 1 33 33 HIS N N 33 122.248 122.248 115.677 6.571 18321 17769 1 14 . 1 1 33 33 HIS HA H 33 4.627 4.627 4.260 0.367 18321 17770 1 14 . 1 1 33 33 HIS C C 33 177.089 177.089 176.314 0.775 18321 17771 1 14 . 1 1 33 33 HIS CA C 33 55.858 55.858 56.498 -0.639 18321 17772 1 14 . 1 1 33 33 HIS CB C 33 28.648 28.648 29.054 -0.406 18321 17773 1 14 . 1 1 33 33 HIS H H 33 8.302 8.302 8.213 0.089 18321 17774 1 14 . 1 1 34 34 GLY N N 34 109.518 109.518 104.206 5.312 18321 17775 1 14 . 1 1 34 34 GLY C C 34 176.730 176.730 173.334 3.396 18321 17776 1 14 . 1 1 34 34 GLY CA C 34 45.967 45.967 45.667 0.300 18321 17777 1 14 . 1 1 34 34 GLY H H 34 9.496 9.496 8.730 0.766 18321 17778 1 14 . 1 1 35 35 MET N N 35 125.193 125.193 119.648 5.545 18321 17779 1 14 . 1 1 35 35 MET HA H 35 5.750 5.750 5.963 -0.213 18321 17780 1 14 . 1 1 35 35 MET C C 35 174.388 174.388 174.944 -0.556 18321 17781 1 14 . 1 1 35 35 MET CA C 35 55.762 55.762 54.802 0.960 18321 17782 1 14 . 1 1 35 35 MET CB C 35 32.706 32.706 35.482 -2.776 18321 17783 1 14 . 1 1 35 35 MET H H 35 8.359 8.359 7.278 1.081 18321 17784 1 14 . 1 1 36 36 PHE N N 36 123.311 123.311 117.422 5.889 18321 17785 1 14 . 1 1 36 36 PHE HA H 36 5.985 5.985 5.763 0.222 18321 17786 1 14 . 1 1 36 36 PHE C C 36 172.140 172.140 172.717 -0.577 18321 17787 1 14 . 1 1 36 36 PHE CA C 36 55.755 55.755 55.526 0.229 18321 17788 1 14 . 1 1 36 36 PHE CB C 36 45.197 45.197 42.879 2.318 18321 17789 1 14 . 1 1 36 36 PHE H H 36 8.261 8.261 8.153 0.108 18321 17790 1 14 . 1 1 37 37 LEU N N 37 114.652 114.652 116.206 -1.554 18321 17791 1 14 . 1 1 37 37 LEU HA H 37 4.489 4.489 5.021 -0.532 18321 17792 1 14 . 1 1 37 37 LEU C C 37 174.033 174.033 174.924 -0.891 18321 17793 1 14 . 1 1 37 37 LEU CA C 37 55.382 55.382 54.583 0.799 18321 17794 1 14 . 1 1 37 37 LEU CB C 37 44.791 44.791 45.467 -0.676 18321 17795 1 14 . 1 1 37 37 LEU H H 37 9.292 9.292 9.133 0.159 18321 17796 1 14 . 1 1 38 38 VAL N N 38 121.009 121.009 122.643 -1.634 18321 17797 1 14 . 1 1 38 38 VAL HA H 38 5.504 5.504 4.646 0.858 18321 17798 1 14 . 1 1 38 38 VAL C C 38 173.581 173.581 175.460 -1.879 18321 17799 1 14 . 1 1 38 38 VAL CA C 38 61.316 61.316 62.147 -0.831 18321 17800 1 14 . 1 1 38 38 VAL CB C 38 33.302 33.302 32.459 0.843 18321 17801 1 14 . 1 1 38 38 VAL H H 38 8.991 8.991 8.494 0.497 18321 17802 1 14 . 1 1 39 39 ARG N N 39 124.863 124.863 127.727 -2.864 18321 17803 1 14 . 1 1 39 39 ARG HA H 39 5.444 5.444 5.014 0.430 18321 17804 1 14 . 1 1 39 39 ARG C C 39 175.772 175.772 175.173 0.599 18321 17805 1 14 . 1 1 39 39 ARG CA C 39 52.558 52.558 53.338 -0.780 18321 17806 1 14 . 1 1 39 39 ARG CB C 39 34.980 34.980 32.862 2.118 18321 17807 1 14 . 1 1 39 39 ARG H H 39 9.569 9.569 8.521 1.048 18321 17808 1 14 . 1 1 40 40 ASP N N 40 122.330 122.330 119.832 2.498 18321 17809 1 14 . 1 1 40 40 ASP HA H 40 4.785 4.785 4.712 0.073 18321 17810 1 14 . 1 1 40 40 ASP C C 40 176.332 176.332 176.601 -0.269 18321 17811 1 14 . 1 1 40 40 ASP CA C 40 55.334 55.334 55.808 -0.474 18321 17812 1 14 . 1 1 40 40 ASP CB C 40 40.650 40.650 42.462 -1.812 18321 17813 1 14 . 1 1 40 40 ASP H H 40 8.413 8.413 8.372 0.041 18321 17814 1 14 . 1 1 41 41 SER N N 41 114.363 114.363 121.593 -7.230 18321 17815 1 14 . 1 1 41 41 SER HA H 41 4.506 4.506 4.165 0.341 18321 17816 1 14 . 1 1 41 41 SER CA C 41 57.525 57.525 61.279 -3.754 18321 17817 1 14 . 1 1 41 41 SER CB C 41 63.706 63.706 63.764 -0.058 18321 17818 1 14 . 1 1 41 41 SER H H 41 7.791 7.791 8.573 -0.782 18321 17819 1 14 . 1 1 42 42 SER N N 42 126.932 126.932 110.054 16.878 18321 17820 1 14 . 1 1 42 42 SER HA H 42 4.410 4.410 4.265 0.145 18321 17821 1 14 . 1 1 42 42 SER CA C 42 60.362 60.362 60.285 0.077 18321 17822 1 14 . 1 1 42 42 SER CB C 42 63.707 63.707 62.208 1.499 18321 17823 1 14 . 1 1 42 42 SER H H 42 10.519 10.519 8.372 2.147 18321 17824 1 14 . 1 1 43 43 THR HA H 43 4.097 4.097 4.440 -0.343 18321 17825 1 14 . 1 1 43 43 THR CA C 43 64.722 64.722 62.660 2.062 18321 17826 1 14 . 1 1 43 43 THR CB C 43 69.439 69.439 70.987 -1.548 18321 17827 1 14 . 1 1 44 44 CYS HA H 44 5.100 5.100 4.965 0.135 18321 17828 1 14 . 1 1 44 44 CYS CA C 44 51.779 51.779 55.990 -4.211 18321 17829 1 14 . 1 1 44 44 CYS CB C 44 41.314 41.314 30.178 11.136 18321 17830 1 14 . 1 1 45 45 PRO HA H 45 4.278 4.278 4.394 -0.116 18321 17831 1 14 . 1 1 45 45 PRO C C 45 178.127 178.127 177.107 1.020 18321 17832 1 14 . 1 1 45 45 PRO CA C 45 64.151 64.151 64.511 -0.360 18321 17833 1 14 . 1 1 45 45 PRO CB C 45 31.596 31.596 31.549 0.048 18321 17834 1 14 . 1 1 46 46 GLY N N 46 114.947 114.947 113.463 1.484 18321 17835 1 14 . 1 1 46 46 GLY C C 46 174.701 174.701 173.967 0.734 18321 17836 1 14 . 1 1 46 46 GLY CA C 46 45.225 45.225 44.809 0.416 18321 17837 1 14 . 1 1 46 46 GLY H H 46 8.812 8.812 8.756 0.056 18321 17838 1 14 . 1 1 47 47 ASP N N 47 120.862 120.862 121.957 -1.095 18321 17839 1 14 . 1 1 47 47 ASP HA H 47 5.235 5.235 4.613 0.622 18321 17840 1 14 . 1 1 47 47 ASP C C 47 176.480 176.480 174.893 1.587 18321 17841 1 14 . 1 1 47 47 ASP CA C 47 53.591 53.591 54.920 -1.329 18321 17842 1 14 . 1 1 47 47 ASP CB C 47 41.707 41.707 42.028 -0.321 18321 17843 1 14 . 1 1 47 47 ASP H H 47 7.997 7.997 7.551 0.446 18321 17844 1 14 . 1 1 48 48 TYR N N 48 118.473 118.473 115.715 2.758 18321 17845 1 14 . 1 1 48 48 TYR HA H 48 5.431 5.431 5.328 0.103 18321 17846 1 14 . 1 1 48 48 TYR C C 48 173.783 173.783 175.630 -1.847 18321 17847 1 14 . 1 1 48 48 TYR CA C 48 56.891 56.891 56.820 0.071 18321 17848 1 14 . 1 1 48 48 TYR CB C 48 43.274 43.274 42.853 0.421 18321 17849 1 14 . 1 1 48 48 TYR H H 48 8.892 8.892 9.124 -0.232 18321 17850 1 14 . 1 1 49 49 VAL N N 49 119.105 119.105 119.321 -0.216 18321 17851 1 14 . 1 1 49 49 VAL HA H 49 4.800 4.800 4.564 0.236 18321 17852 1 14 . 1 1 49 49 VAL C C 49 174.397 174.397 174.603 -0.206 18321 17853 1 14 . 1 1 49 49 VAL CA C 49 61.439 61.439 62.352 -0.914 18321 17854 1 14 . 1 1 49 49 VAL CB C 49 35.388 35.388 35.139 0.249 18321 17855 1 14 . 1 1 49 49 VAL H H 49 9.661 9.661 8.673 0.988 18321 17856 1 14 . 1 1 50 50 LEU N N 50 129.599 129.599 130.993 -1.394 18321 17857 1 14 . 1 1 50 50 LEU HA H 50 5.033 5.033 5.276 -0.243 18321 17858 1 14 . 1 1 50 50 LEU C C 50 175.001 175.001 175.396 -0.395 18321 17859 1 14 . 1 1 50 50 LEU CA C 50 53.352 53.352 53.708 -0.356 18321 17860 1 14 . 1 1 50 50 LEU CB C 50 44.062 44.062 42.925 1.137 18321 17861 1 14 . 1 1 50 50 LEU H H 50 9.405 9.405 9.300 0.105 18321 17862 1 14 . 1 1 51 51 SER N N 51 126.895 126.895 123.961 2.934 18321 17863 1 14 . 1 1 51 51 SER HA H 51 5.731 5.731 5.165 0.566 18321 17864 1 14 . 1 1 51 51 SER C C 51 173.094 173.094 173.547 -0.453 18321 17865 1 14 . 1 1 51 51 SER CA C 51 58.834 58.834 56.989 1.845 18321 17866 1 14 . 1 1 51 51 SER CB C 51 64.977 64.977 64.120 0.857 18321 17867 1 14 . 1 1 51 51 SER H H 51 9.094 9.094 8.914 0.180 18321 17868 1 14 . 1 1 52 52 VAL N N 52 121.777 121.777 124.643 -2.866 18321 17869 1 14 . 1 1 52 52 VAL HA H 52 5.066 5.066 4.648 0.418 18321 17870 1 14 . 1 1 52 52 VAL C C 52 174.573 174.573 174.557 0.016 18321 17871 1 14 . 1 1 52 52 VAL CA C 52 59.535 59.535 60.903 -1.368 18321 17872 1 14 . 1 1 52 52 VAL CB C 52 36.834 36.834 35.803 1.031 18321 17873 1 14 . 1 1 52 52 VAL H H 52 8.816 8.816 8.426 0.390 18321 17874 1 14 . 1 1 53 53 SER N N 53 120.489 120.489 122.334 -1.845 18321 17875 1 14 . 1 1 53 53 SER HA H 53 4.811 4.811 4.680 0.131 18321 17876 1 14 . 1 1 53 53 SER C C 53 174.065 174.065 172.531 1.534 18321 17877 1 14 . 1 1 53 53 SER CA C 53 57.496 57.496 57.624 -0.128 18321 17878 1 14 . 1 1 53 53 SER CB C 53 62.623 62.623 63.480 -0.857 18321 17879 1 14 . 1 1 53 53 SER H H 53 8.780 8.780 9.136 -0.356 18321 17880 1 14 . 1 1 54 54 GLU N N 54 132.020 132.020 127.848 4.172 18321 17881 1 14 . 1 1 54 54 GLU HA H 54 4.250 4.250 4.376 -0.126 18321 17882 1 14 . 1 1 54 54 GLU C C 54 175.387 175.387 175.108 0.279 18321 17883 1 14 . 1 1 54 54 GLU CA C 54 56.999 56.999 55.841 1.158 18321 17884 1 14 . 1 1 54 54 GLU CB C 54 32.556 32.556 32.863 -0.307 18321 17885 1 14 . 1 1 54 54 GLU H H 54 8.472 8.472 7.737 0.735 18321 17886 1 14 . 1 1 55 55 ASN N N 55 126.517 126.517 120.198 6.319 18321 17887 1 14 . 1 1 55 55 ASN HA H 55 4.220 4.220 4.121 0.099 18321 17888 1 14 . 1 1 55 55 ASN C C 55 174.546 174.546 175.344 -0.798 18321 17889 1 14 . 1 1 55 55 ASN CA C 55 54.770 54.770 54.162 0.608 18321 17890 1 14 . 1 1 55 55 ASN CB C 55 37.314 37.314 37.497 -0.183 18321 17891 1 14 . 1 1 55 55 ASN H H 55 8.853 8.853 8.532 0.321 18321 17892 1 14 . 1 1 56 56 SER N N 56 112.009 112.009 111.283 0.726 18321 17893 1 14 . 1 1 56 56 SER HA H 56 4.334 4.334 4.223 0.111 18321 17894 1 14 . 1 1 56 56 SER C C 56 173.354 173.354 172.529 0.825 18321 17895 1 14 . 1 1 56 56 SER CA C 56 59.966 59.966 59.371 0.595 18321 17896 1 14 . 1 1 56 56 SER CB C 56 62.242 62.242 62.928 -0.686 18321 17897 1 14 . 1 1 56 56 SER H H 56 10.418 10.418 7.945 2.473 18321 17898 1 14 . 1 1 57 57 ARG N N 57 121.764 121.764 117.112 4.652 18321 17899 1 14 . 1 1 57 57 ARG HA H 57 5.167 5.167 4.433 0.734 18321 17900 1 14 . 1 1 57 57 ARG C C 57 174.983 174.983 174.491 0.492 18321 17901 1 14 . 1 1 57 57 ARG CA C 57 54.550 54.550 55.240 -0.690 18321 17902 1 14 . 1 1 57 57 ARG CB C 57 31.886 31.886 30.851 1.035 18321 17903 1 14 . 1 1 57 57 ARG H H 57 8.097 8.097 7.415 0.682 18321 17904 1 14 . 1 1 58 58 VAL N N 58 121.866 121.866 122.830 -0.964 18321 17905 1 14 . 1 1 58 58 VAL HA H 58 4.768 4.768 4.372 0.396 18321 17906 1 14 . 1 1 58 58 VAL C C 58 175.388 175.388 175.750 -0.362 18321 17907 1 14 . 1 1 58 58 VAL CA C 58 61.818 61.818 62.452 -0.634 18321 17908 1 14 . 1 1 58 58 VAL CB C 58 34.135 34.135 31.183 2.952 18321 17909 1 14 . 1 1 58 58 VAL H H 58 8.081 8.081 8.059 0.022 18321 17910 1 14 . 1 1 59 59 SER N N 59 124.445 124.445 122.529 1.916 18321 17911 1 14 . 1 1 59 59 SER HA H 59 4.462 4.462 4.322 0.140 18321 17912 1 14 . 1 1 59 59 SER C C 59 172.185 172.185 173.275 -1.090 18321 17913 1 14 . 1 1 59 59 SER CA C 59 56.629 56.629 58.325 -1.696 18321 17914 1 14 . 1 1 59 59 SER CB C 59 66.218 66.218 63.446 2.772 18321 17915 1 14 . 1 1 59 59 SER H H 59 9.082 9.082 7.987 1.095 18321 17916 1 14 . 1 1 60 60 HIS N N 60 121.224 121.224 126.011 -4.787 18321 17917 1 14 . 1 1 60 60 HIS HA H 60 4.885 4.885 4.634 0.251 18321 17918 1 14 . 1 1 60 60 HIS C C 60 174.674 174.674 174.414 0.260 18321 17919 1 14 . 1 1 60 60 HIS CA C 60 54.900 54.900 55.404 -0.503 18321 17920 1 14 . 1 1 60 60 HIS CB C 60 32.331 32.331 29.259 3.072 18321 17921 1 14 . 1 1 60 60 HIS H H 60 8.331 8.331 8.771 -0.440 18321 17922 1 14 . 1 1 61 61 TYR N N 61 124.780 124.780 125.542 -0.762 18321 17923 1 14 . 1 1 61 61 TYR HA H 61 4.655 4.655 4.769 -0.114 18321 17924 1 14 . 1 1 61 61 TYR CA C 61 57.409 57.409 57.109 0.300 18321 17925 1 14 . 1 1 61 61 TYR CB C 61 39.785 39.785 37.756 2.029 18321 17926 1 14 . 1 1 61 61 TYR H H 61 9.273 9.273 9.214 0.059 18321 17927 1 14 . 1 1 62 62 ILE HA H 62 4.298 4.298 4.205 0.093 18321 17928 1 14 . 1 1 62 62 ILE C C 62 174.817 174.817 175.504 -0.687 18321 17929 1 14 . 1 1 62 62 ILE CA C 62 61.908 61.908 61.963 -0.055 18321 17930 1 14 . 1 1 62 62 ILE CB C 62 38.321 38.321 38.629 -0.308 18321 17931 1 14 . 1 1 63 63 ILE N N 63 128.552 128.552 128.886 -0.334 18321 17932 1 14 . 1 1 63 63 ILE HA H 63 4.788 4.788 4.882 -0.094 18321 17933 1 14 . 1 1 63 63 ILE C C 63 175.982 175.982 175.044 0.938 18321 17934 1 14 . 1 1 63 63 ILE CA C 63 59.629 59.629 59.963 -0.334 18321 17935 1 14 . 1 1 63 63 ILE CB C 63 39.747 39.747 38.964 0.783 18321 17936 1 14 . 1 1 63 63 ILE H H 63 9.155 9.155 8.831 0.324 18321 17937 1 14 . 1 1 64 64 ASN N N 64 123.240 123.240 126.930 -3.690 18321 17938 1 14 . 1 1 64 64 ASN HA H 64 4.857 4.857 5.197 -0.340 18321 17939 1 14 . 1 1 64 64 ASN C C 64 175.324 175.324 174.665 0.659 18321 17940 1 14 . 1 1 64 64 ASN CA C 64 53.736 53.736 53.636 0.100 18321 17941 1 14 . 1 1 64 64 ASN CB C 64 41.531 41.531 40.288 1.243 18321 17942 1 14 . 1 1 64 64 ASN H H 64 9.379 9.379 9.076 0.303 18321 17943 1 14 . 1 1 65 65 SER N N 65 121.157 121.157 117.134 4.023 18321 17944 1 14 . 1 1 65 65 SER HA H 65 4.548 4.548 4.311 0.237 18321 17945 1 14 . 1 1 65 65 SER C C 65 174.328 174.328 174.413 -0.085 18321 17946 1 14 . 1 1 65 65 SER CA C 65 58.306 58.306 58.199 0.107 18321 17947 1 14 . 1 1 65 65 SER CB C 65 62.878 62.878 63.383 -0.505 18321 17948 1 14 . 1 1 65 65 SER H H 65 9.195 9.195 8.858 0.337 18321 17949 1 14 . 1 1 66 66 LEU N N 66 127.417 127.417 129.626 -2.209 18321 17950 1 14 . 1 1 66 66 LEU HA H 66 4.605 4.605 4.573 0.032 18321 17951 1 14 . 1 1 66 66 LEU CA C 66 52.888 52.888 52.704 0.184 18321 17952 1 14 . 1 1 66 66 LEU CB C 66 41.799 41.799 41.742 0.057 18321 17953 1 14 . 1 1 66 66 LEU H H 66 8.143 8.143 8.564 -0.421 18321 17954 1 14 . 1 1 68 68 ASN HA H 68 4.386 4.386 4.554 -0.168 18321 17955 1 14 . 1 1 68 68 ASN C C 68 174.487 174.487 175.275 -0.788 18321 17956 1 14 . 1 1 68 68 ASN CA C 68 53.365 53.365 53.145 0.220 18321 17957 1 14 . 1 1 68 68 ASN CB C 68 36.778 36.778 37.322 -0.544 18321 17958 1 14 . 1 1 69 69 ARG N N 69 111.329 111.329 113.817 -2.488 18321 17959 1 14 . 1 1 69 69 ARG HA H 69 3.876 3.876 3.820 0.056 18321 17960 1 14 . 1 1 69 69 ARG CA C 69 57.393 57.393 57.171 0.222 18321 17961 1 14 . 1 1 69 69 ARG CB C 69 26.665 26.665 27.353 -0.688 18321 17962 1 14 . 1 1 69 69 ARG H H 69 8.191 8.191 7.846 0.345 18321 17963 1 14 . 1 1 70 70 ARG N N 70 116.120 116.120 115.004 1.116 18321 17964 1 14 . 1 1 70 70 ARG HA H 70 4.556 4.556 4.965 -0.409 18321 17965 1 14 . 1 1 70 70 ARG C C 70 174.882 174.882 174.396 0.486 18321 17966 1 14 . 1 1 70 70 ARG CA C 70 55.509 55.509 53.721 1.788 18321 17967 1 14 . 1 1 70 70 ARG CB C 70 31.771 31.771 33.122 -1.351 18321 17968 1 14 . 1 1 70 70 ARG H H 70 6.667 6.667 7.196 -0.529 18321 17969 1 14 . 1 1 71 71 PHE N N 71 116.313 116.313 117.386 -1.073 18321 17970 1 14 . 1 1 71 71 PHE HA H 71 5.540 5.540 5.605 -0.065 18321 17971 1 14 . 1 1 71 71 PHE C C 71 174.391 174.391 174.916 -0.525 18321 17972 1 14 . 1 1 71 71 PHE CA C 71 57.528 57.528 56.806 0.722 18321 17973 1 14 . 1 1 71 71 PHE CB C 71 44.115 44.115 43.074 1.041 18321 17974 1 14 . 1 1 71 71 PHE H H 71 8.700 8.700 8.414 0.286 18321 17975 1 14 . 1 1 72 72 LYS N N 72 122.770 122.770 125.107 -2.337 18321 17976 1 14 . 1 1 72 72 LYS HA H 72 5.483 5.483 5.004 0.479 18321 17977 1 14 . 1 1 72 72 LYS C C 72 173.923 173.923 174.591 -0.668 18321 17978 1 14 . 1 1 72 72 LYS CA C 72 54.855 54.855 55.239 -0.384 18321 17979 1 14 . 1 1 72 72 LYS CB C 72 37.710 37.710 36.272 1.438 18321 17980 1 14 . 1 1 72 72 LYS H H 72 9.138 9.138 8.576 0.562 18321 17981 1 14 . 1 1 73 73 ILE N N 73 124.576 124.576 129.315 -4.739 18321 17982 1 14 . 1 1 73 73 ILE HA H 73 4.955 4.955 5.348 -0.393 18321 17983 1 14 . 1 1 73 73 ILE C C 73 175.728 175.728 175.985 -0.257 18321 17984 1 14 . 1 1 73 73 ILE CA C 73 58.935 58.935 59.732 -0.797 18321 17985 1 14 . 1 1 73 73 ILE CB C 73 40.965 40.965 39.606 1.359 18321 17986 1 14 . 1 1 73 73 ILE H H 73 8.826 8.826 8.851 -0.025 18321 17987 1 14 . 1 1 74 74 GLY N N 74 118.718 118.718 119.249 -0.531 18321 17988 1 14 . 1 1 74 74 GLY C C 74 174.436 174.436 173.923 0.513 18321 17989 1 14 . 1 1 74 74 GLY CA C 74 47.401 47.401 47.066 0.335 18321 17990 1 14 . 1 1 74 74 GLY H H 74 9.317 9.317 9.116 0.201 18321 17991 1 14 . 1 1 75 75 ASP N N 75 125.691 125.691 125.078 0.613 18321 17992 1 14 . 1 1 75 75 ASP HA H 75 4.713 4.713 4.778 -0.065 18321 17993 1 14 . 1 1 75 75 ASP C C 75 175.841 175.841 175.567 0.274 18321 17994 1 14 . 1 1 75 75 ASP CA C 75 53.815 53.815 54.080 -0.265 18321 17995 1 14 . 1 1 75 75 ASP CB C 75 41.288 41.288 42.454 -1.166 18321 17996 1 14 . 1 1 75 75 ASP H H 75 8.665 8.665 8.270 0.395 18321 17997 1 14 . 1 1 76 76 GLN N N 76 120.368 120.368 120.707 -0.339 18321 17998 1 14 . 1 1 76 76 GLN C C 76 173.630 173.630 174.341 -0.711 18321 17999 1 14 . 1 1 76 76 GLN CA C 76 54.254 54.254 54.690 -0.436 18321 18000 1 14 . 1 1 76 76 GLN CB C 76 31.248 31.248 30.674 0.574 18321 18001 1 14 . 1 1 76 76 GLN H H 76 8.289 8.289 7.870 0.419 18321 18002 1 14 . 1 1 77 77 GLU N N 77 120.435 120.435 122.685 -2.250 18321 18003 1 14 . 1 1 77 77 GLU C C 77 175.484 175.484 175.194 0.290 18321 18004 1 14 . 1 1 77 77 GLU CA C 77 54.203 54.203 55.359 -1.156 18321 18005 1 14 . 1 1 77 77 GLU CB C 77 33.141 33.141 30.179 2.962 18321 18006 1 14 . 1 1 77 77 GLU H H 77 7.732 7.732 8.327 -0.595 18321 18007 1 14 . 1 1 78 78 PHE N N 78 117.911 117.911 122.245 -4.334 18321 18008 1 14 . 1 1 78 78 PHE HA H 78 4.659 4.659 4.678 -0.019 18321 18009 1 14 . 1 1 78 78 PHE C C 78 175.673 175.673 176.656 -0.983 18321 18010 1 14 . 1 1 78 78 PHE CA C 78 57.160 57.160 56.822 0.338 18321 18011 1 14 . 1 1 78 78 PHE CB C 78 45.405 45.405 41.364 4.041 18321 18012 1 14 . 1 1 78 78 PHE H H 78 9.235 9.235 8.170 1.065 18321 18013 1 14 . 1 1 79 79 ASP N N 79 119.296 119.296 118.906 0.390 18321 18014 1 14 . 1 1 79 79 ASP HA H 79 4.462 4.462 4.539 -0.077 18321 18015 1 14 . 1 1 79 79 ASP C C 79 174.482 174.482 174.991 -0.509 18321 18016 1 14 . 1 1 79 79 ASP CA C 79 56.629 56.629 56.623 0.006 18321 18017 1 14 . 1 1 79 79 ASP CB C 79 41.697 41.697 41.402 0.295 18321 18018 1 14 . 1 1 79 79 ASP H H 79 9.187 9.187 8.833 0.354 18321 18019 1 14 . 1 1 80 80 HIS N N 80 107.631 107.631 108.955 -1.324 18321 18020 1 14 . 1 1 80 80 HIS HA H 80 5.022 5.022 5.119 -0.097 18321 18021 1 14 . 1 1 80 80 HIS C C 80 174.626 174.626 174.576 0.050 18321 18022 1 14 . 1 1 80 80 HIS CA C 80 54.223 54.223 54.988 -0.765 18321 18023 1 14 . 1 1 80 80 HIS CB C 80 32.205 32.205 31.197 1.008 18321 18024 1 14 . 1 1 80 80 HIS H H 80 7.200 7.200 7.131 0.069 18321 18025 1 14 . 1 1 81 81 LEU N N 81 120.710 120.710 120.787 -0.077 18321 18026 1 14 . 1 1 81 81 LEU HA H 81 3.804 3.804 4.111 -0.307 18321 18027 1 14 . 1 1 81 81 LEU CA C 81 58.709 58.709 59.308 -0.599 18321 18028 1 14 . 1 1 81 81 LEU CB C 81 39.646 39.646 40.175 -0.529 18321 18029 1 14 . 1 1 81 81 LEU H H 81 8.886 8.886 9.129 -0.243 18321 18030 1 14 . 1 1 82 82 PRO HA H 82 4.020 4.020 4.287 -0.267 18321 18031 1 14 . 1 1 82 82 PRO C C 82 175.619 175.619 177.247 -1.628 18321 18032 1 14 . 1 1 82 82 PRO CA C 82 67.025 67.025 64.626 2.399 18321 18033 1 14 . 1 1 82 82 PRO CB C 82 30.962 30.962 30.679 0.283 18321 18034 1 14 . 1 1 83 83 ALA N N 83 124.281 124.281 121.043 3.238 18321 18035 1 14 . 1 1 83 83 ALA HA H 83 4.019 4.019 4.156 -0.137 18321 18036 1 14 . 1 1 83 83 ALA C C 83 179.709 179.709 178.740 0.969 18321 18037 1 14 . 1 1 83 83 ALA CA C 83 54.985 54.985 54.348 0.637 18321 18038 1 14 . 1 1 83 83 ALA CB C 83 18.425 18.425 18.420 0.005 18321 18039 1 14 . 1 1 83 83 ALA H H 83 8.527 8.527 7.651 0.876 18321 18040 1 14 . 1 1 84 84 LEU N N 84 122.960 122.960 117.468 5.492 18321 18041 1 14 . 1 1 84 84 LEU HA H 84 1.917 1.917 3.103 -1.186 18321 18042 1 14 . 1 1 84 84 LEU C C 84 177.652 177.652 178.149 -0.497 18321 18043 1 14 . 1 1 84 84 LEU CA C 84 58.261 58.261 57.154 1.107 18321 18044 1 14 . 1 1 84 84 LEU CB C 84 42.544 42.544 40.867 1.677 18321 18045 1 14 . 1 1 84 84 LEU H H 84 6.982 6.982 7.356 -0.374 18321 18046 1 14 . 1 1 85 85 LEU N N 85 117.940 117.940 118.717 -0.777 18321 18047 1 14 . 1 1 85 85 LEU HA H 85 3.463 3.463 3.819 -0.356 18321 18048 1 14 . 1 1 85 85 LEU C C 85 178.809 178.809 178.280 0.529 18321 18049 1 14 . 1 1 85 85 LEU CA C 85 57.522 57.522 57.316 0.206 18321 18050 1 14 . 1 1 85 85 LEU CB C 85 41.242 41.242 41.218 0.024 18321 18051 1 14 . 1 1 85 85 LEU H H 85 7.773 7.773 7.404 0.369 18321 18052 1 14 . 1 1 86 86 GLU N N 86 115.762 115.762 117.652 -1.890 18321 18053 1 14 . 1 1 86 86 GLU HA H 86 3.540 3.540 3.968 -0.428 18321 18054 1 14 . 1 1 86 86 GLU C C 86 180.228 180.228 178.792 1.436 18321 18055 1 14 . 1 1 86 86 GLU CA C 86 58.943 58.943 58.283 0.660 18321 18056 1 14 . 1 1 86 86 GLU CB C 86 29.561 29.561 29.368 0.193 18321 18057 1 14 . 1 1 86 86 GLU H H 86 8.300 8.300 7.651 0.649 18321 18058 1 14 . 1 1 87 87 PHE N N 87 121.135 121.135 122.044 -0.909 18321 18059 1 14 . 1 1 87 87 PHE HA H 87 4.122 4.122 4.081 0.041 18321 18060 1 14 . 1 1 87 87 PHE C C 87 179.497 179.497 177.221 2.276 18321 18061 1 14 . 1 1 87 87 PHE CA C 87 62.090 62.090 60.678 1.413 18321 18062 1 14 . 1 1 87 87 PHE CB C 87 40.103 40.103 38.994 1.109 18321 18063 1 14 . 1 1 87 87 PHE H H 87 7.717 7.717 7.475 0.242 18321 18064 1 14 . 1 1 88 88 TYR N N 88 116.579 116.579 116.199 0.380 18321 18065 1 14 . 1 1 88 88 TYR HA H 88 4.933 4.933 4.208 0.725 18321 18066 1 14 . 1 1 88 88 TYR C C 88 174.799 174.799 177.026 -2.227 18321 18067 1 14 . 1 1 88 88 TYR CA C 88 61.333 61.333 58.513 2.820 18321 18068 1 14 . 1 1 88 88 TYR CB C 88 36.539 36.539 36.889 -0.350 18321 18069 1 14 . 1 1 88 88 TYR H H 88 7.478 7.478 7.853 -0.375 18321 18070 1 14 . 1 1 89 89 LYS N N 89 117.737 117.737 118.414 -0.677 18321 18071 1 14 . 1 1 89 89 LYS HA H 89 4.466 4.466 4.014 0.452 18321 18072 1 14 . 1 1 89 89 LYS C C 89 178.417 178.417 177.188 1.229 18321 18073 1 14 . 1 1 89 89 LYS CA C 89 59.486 59.486 58.827 0.659 18321 18074 1 14 . 1 1 89 89 LYS CB C 89 34.523 34.523 32.789 1.734 18321 18075 1 14 . 1 1 89 89 LYS H H 89 7.505 7.505 7.455 0.050 18321 18076 1 14 . 1 1 90 90 ILE N N 90 110.972 110.972 110.813 0.159 18321 18077 1 14 . 1 1 90 90 ILE HA H 90 4.181 4.181 4.085 0.096 18321 18078 1 14 . 1 1 90 90 ILE C C 90 174.571 174.571 175.719 -1.148 18321 18079 1 14 . 1 1 90 90 ILE CA C 90 60.516 60.516 60.509 0.007 18321 18080 1 14 . 1 1 90 90 ILE CB C 90 39.979 39.979 38.018 1.961 18321 18081 1 14 . 1 1 90 90 ILE H H 90 6.710 6.710 7.178 -0.468 18321 18082 1 14 . 1 1 91 91 HIS N N 91 119.479 119.479 118.784 0.695 18321 18083 1 14 . 1 1 91 91 HIS HA H 91 4.357 4.357 4.352 0.005 18321 18084 1 14 . 1 1 91 91 HIS C C 91 172.751 172.751 175.485 -2.734 18321 18085 1 14 . 1 1 91 91 HIS CA C 91 55.066 55.066 56.664 -1.598 18321 18086 1 14 . 1 1 91 91 HIS CB C 91 29.756 29.756 31.227 -1.472 18321 18087 1 14 . 1 1 91 91 HIS H H 91 7.460 7.460 7.228 0.232 18321 18088 1 14 . 1 1 92 92 TYR N N 92 117.642 117.642 115.224 2.418 18321 18089 1 14 . 1 1 92 92 TYR HA H 92 4.131 4.131 4.335 -0.204 18321 18090 1 14 . 1 1 92 92 TYR C C 92 177.348 177.348 175.231 2.117 18321 18091 1 14 . 1 1 92 92 TYR CA C 92 58.627 58.627 57.925 0.702 18321 18092 1 14 . 1 1 92 92 TYR CB C 92 39.481 39.481 35.615 3.866 18321 18093 1 14 . 1 1 92 92 TYR H H 92 8.067 8.067 7.312 0.755 18321 18094 1 14 . 1 1 93 93 LEU N N 93 123.560 123.560 118.414 5.146 18321 18095 1 14 . 1 1 93 93 LEU HA H 93 4.104 4.104 4.095 0.009 18321 18096 1 14 . 1 1 93 93 LEU C C 93 175.610 175.610 177.610 -2.000 18321 18097 1 14 . 1 1 93 93 LEU CA C 93 56.381 56.381 56.755 -0.374 18321 18098 1 14 . 1 1 93 93 LEU CB C 93 38.896 38.896 41.837 -2.942 18321 18099 1 14 . 1 1 93 93 LEU H H 93 7.907 7.907 8.544 -0.637 18321 18100 1 14 . 1 1 94 94 ASP N N 94 118.194 118.194 110.521 7.673 18321 18101 1 14 . 1 1 94 94 ASP HA H 94 4.940 4.940 4.603 0.337 18321 18102 1 14 . 1 1 94 94 ASP C C 94 176.123 176.123 175.977 0.146 18321 18103 1 14 . 1 1 94 94 ASP CA C 94 56.235 56.235 54.289 1.946 18321 18104 1 14 . 1 1 94 94 ASP CB C 94 42.078 42.078 41.436 0.642 18321 18105 1 14 . 1 1 94 94 ASP H H 94 8.640 8.640 8.124 0.516 18321 18106 1 14 . 1 1 95 95 THR N N 95 105.073 105.073 110.076 -5.003 18321 18107 1 14 . 1 1 95 95 THR HA H 95 4.318 4.318 4.490 -0.172 18321 18108 1 14 . 1 1 95 95 THR C C 95 174.685 174.685 173.269 1.416 18321 18109 1 14 . 1 1 95 95 THR CA C 95 60.756 60.756 63.302 -2.546 18321 18110 1 14 . 1 1 95 95 THR CB C 95 71.058 71.058 69.527 1.531 18321 18111 1 14 . 1 1 95 95 THR H H 95 8.576 8.576 7.710 0.866 18321 18112 1 14 . 1 1 96 96 THR N N 96 116.817 116.817 117.125 -0.308 18321 18113 1 14 . 1 1 96 96 THR HA H 96 5.129 5.129 4.923 0.206 18321 18114 1 14 . 1 1 96 96 THR C C 96 172.464 172.464 173.708 -1.244 18321 18115 1 14 . 1 1 96 96 THR CA C 96 60.762 60.762 62.889 -2.127 18321 18116 1 14 . 1 1 96 96 THR CB C 96 71.425 71.425 70.444 0.981 18321 18117 1 14 . 1 1 96 96 THR H H 96 8.205 8.205 9.232 -1.027 18321 18118 1 14 . 1 1 97 97 THR N N 97 114.324 114.324 112.774 1.550 18321 18119 1 14 . 1 1 97 97 THR HA H 97 5.128 5.128 3.791 1.337 18321 18120 1 14 . 1 1 97 97 THR C C 97 175.480 175.480 173.353 2.127 18321 18121 1 14 . 1 1 97 97 THR CA C 97 60.233 60.233 63.127 -2.893 18321 18122 1 14 . 1 1 97 97 THR CB C 97 70.415 70.415 67.632 2.783 18321 18123 1 14 . 1 1 97 97 THR H H 97 7.128 7.128 7.924 -0.796 18321 18124 1 14 . 1 1 98 98 LEU N N 98 116.674 116.674 122.647 -5.973 18321 18125 1 14 . 1 1 98 98 LEU HA H 98 4.075 4.075 4.211 -0.136 18321 18126 1 14 . 1 1 98 98 LEU C C 98 177.892 177.892 176.939 0.953 18321 18127 1 14 . 1 1 98 98 LEU CA C 98 59.597 59.597 54.443 5.154 18321 18128 1 14 . 1 1 98 98 LEU CB C 98 41.172 41.172 40.237 0.935 18321 18129 1 14 . 1 1 98 98 LEU H H 98 8.743 8.743 8.124 0.619 18321 18130 1 14 . 1 1 99 99 ILE N N 99 122.988 122.988 123.225 -0.237 18321 18131 1 14 . 1 1 99 99 ILE HA H 99 4.415 4.415 4.091 0.324 18321 18132 1 14 . 1 1 99 99 ILE C C 99 175.055 175.055 176.087 -1.032 18321 18133 1 14 . 1 1 99 99 ILE CA C 99 62.183 62.183 62.435 -0.252 18321 18134 1 14 . 1 1 99 99 ILE CB C 99 40.252 40.252 38.400 1.853 18321 18135 1 14 . 1 1 99 99 ILE H H 99 8.998 8.998 8.041 0.957 18321 18136 1 14 . 1 1 100 100 GLU N N 100 114.067 114.067 113.666 0.401 18321 18137 1 14 . 1 1 100 100 GLU CA C 100 52.910 52.910 53.517 -0.607 18321 18138 1 14 . 1 1 100 100 GLU CB C 100 31.155 31.155 31.233 -0.078 18321 18139 1 14 . 1 1 100 100 GLU H H 100 7.332 7.332 8.441 -1.109 18321 18140 1 14 . 1 1 101 101 PRO HA H 101 4.952 4.952 3.828 1.124 18321 18141 1 14 . 1 1 101 101 PRO C C 101 175.976 175.976 176.037 -0.061 18321 18142 1 14 . 1 1 101 101 PRO CA C 101 53.312 53.312 61.696 -8.384 18321 18143 1 14 . 1 1 101 101 PRO CB C 101 31.598 31.598 32.138 -0.540 18321 18144 1 14 . 1 1 102 102 ALA N N 102 125.968 125.968 124.634 1.334 18321 18145 1 14 . 1 1 102 102 ALA HA H 102 4.516 4.516 4.395 0.121 18321 18146 1 14 . 1 1 102 102 ALA CA C 102 49.852 49.852 50.208 -0.356 18321 18147 1 14 . 1 1 102 102 ALA CB C 102 17.766 17.766 18.154 -0.388 18321 18148 1 14 . 1 1 102 102 ALA H H 102 8.232 8.232 8.306 -0.074 18321 18149 1 14 . 1 1 103 103 PRO HA H 103 4.283 4.283 4.355 -0.072 18321 18150 1 14 . 1 1 103 103 PRO CA C 103 62.435 62.435 63.115 -0.680 18321 18151 1 14 . 1 1 103 103 PRO CB C 103 32.145 32.145 32.052 0.093 18321 18152 1 14 . 1 1 104 104 ARG HA H 104 4.004 4.004 4.288 -0.284 18321 18153 1 14 . 1 1 104 104 ARG CA C 104 56.660 56.660 56.415 0.245 18321 18154 1 14 . 1 1 106 106 PRO C C 106 174.587 174.587 175.504 -0.917 18321 18155 1 14 . 1 1 106 106 PRO CA C 106 57.867 57.867 62.739 -4.872 18321 18156 1 14 . 1 1 106 106 PRO CB C 106 31.942 31.942 32.291 -0.349 18321 18157 1 14 . 1 1 107 107 SER N N 107 121.280 121.280 118.769 2.511 18321 18158 1 14 . 1 1 107 107 SER CA C 107 61.772 61.772 55.845 5.927 18321 18159 1 14 . 1 1 107 107 SER CB C 107 63.234 63.234 63.173 0.061 18321 18160 1 14 . 1 1 107 107 SER H H 107 8.132 8.132 8.299 -0.167 18321 18161 1 14 . 1 1 109 109 PRO C C 109 177.129 177.129 176.316 0.813 18321 18162 1 14 . 1 1 109 109 PRO CA C 109 62.638 62.638 62.959 -0.321 18321 18163 1 14 . 1 1 109 109 PRO CB C 109 30.970 30.970 32.608 -1.638 18321 18164 1 14 . 1 1 110 110 MET N N 110 120.772 120.772 118.297 2.475 18321 18165 1 14 . 1 1 110 110 MET C C 110 176.892 176.892 174.763 2.129 18321 18166 1 14 . 1 1 110 110 MET CA C 110 55.310 55.310 56.118 -0.808 18321 18167 1 14 . 1 1 110 110 MET CB C 110 32.202 32.202 31.676 0.526 18321 18168 1 14 . 1 1 110 110 MET H H 110 8.430 8.430 7.843 0.587 18321 18169 1 14 . 1 1 111 111 GLY N N 111 110.158 110.158 112.209 -2.051 18321 18170 1 14 . 1 1 111 111 GLY C C 111 177.430 177.430 172.485 4.945 18321 18171 1 14 . 1 1 111 111 GLY CA C 111 44.951 44.951 45.324 -0.373 18321 18172 1 14 . 1 1 111 111 GLY H H 111 8.384 8.384 7.852 0.532 18321 18173 1 14 . 1 1 112 112 SER N N 112 116.762 116.762 117.534 -0.772 18321 18174 1 14 . 1 1 112 112 SER CA C 112 55.948 55.948 57.417 -1.469 18321 18175 1 14 . 1 1 112 112 SER CB C 112 62.745 62.745 63.677 -0.932 18321 18176 1 14 . 1 1 112 112 SER H H 112 8.161 8.161 8.329 -0.168 18321 18177 1 14 . 1 1 113 113 VAL C C 113 176.083 176.083 176.150 -0.067 18321 18178 1 14 . 1 1 114 114 SER N N 114 119.151 119.151 112.723 6.428 18321 18179 1 14 . 1 1 114 114 SER C C 114 173.638 173.638 172.287 1.351 18321 18180 1 14 . 1 1 114 114 SER CA C 114 58.005 58.005 57.514 0.491 18321 18181 1 14 . 1 1 114 114 SER CB C 114 63.169 63.169 64.770 -1.601 18321 18182 1 14 . 1 1 114 114 SER H H 114 8.319 8.319 7.697 0.622 18321 18183 1 14 . 1 1 115 115 ALA N N 115 126.914 126.914 125.644 1.270 18321 18184 1 14 . 1 1 115 115 ALA CA C 115 51.561 51.561 50.728 0.833 18321 18185 1 14 . 1 1 115 115 ALA CB C 115 17.714 17.714 19.475 -1.761 18321 18186 1 14 . 1 1 115 115 ALA H H 115 8.197 8.197 8.339 -0.142 18321 18187 1 14 . 1 1 119 119 PRO C C 119 177.065 177.065 176.259 0.806 18321 18188 1 14 . 1 1 120 120 THR N N 120 113.976 113.976 109.459 4.517 18321 18189 1 14 . 1 1 120 120 THR C C 120 174.461 174.461 173.577 0.884 18321 18190 1 14 . 1 1 120 120 THR CA C 120 61.215 61.215 62.068 -0.853 18321 18191 1 14 . 1 1 120 120 THR CB C 120 69.508 69.508 69.904 -0.396 18321 18192 1 14 . 1 1 120 120 THR H H 120 8.138 8.138 7.762 0.376 18321 18193 1 14 . 1 1 121 121 ALA N N 121 125.859 125.859 128.291 -2.432 18321 18194 1 14 . 1 1 121 121 ALA CA C 121 52.281 52.281 51.388 0.893 18321 18195 1 14 . 1 1 121 121 ALA CB C 121 18.623 18.623 19.906 -1.283 18321 18196 1 14 . 1 1 121 121 ALA H H 121 8.272 8.272 8.765 -0.493 18321 18197 1 14 . 1 1 122 122 GLU C C 122 176.316 176.316 175.219 1.097 18321 18198 1 14 . 1 1 123 123 ASP N N 123 120.448 120.448 119.173 1.275 18321 18199 1 14 . 1 1 123 123 ASP C C 123 175.906 175.906 174.929 0.977 18321 18200 1 14 . 1 1 123 123 ASP CA C 123 54.167 54.167 55.591 -1.424 18321 18201 1 14 . 1 1 123 123 ASP CB C 123 40.695 40.695 41.347 -0.652 18321 18202 1 14 . 1 1 123 123 ASP H H 123 8.181 8.181 8.553 -0.372 18321 18203 1 14 . 1 1 124 124 ASN N N 124 118.207 118.207 119.151 -0.944 18321 18204 1 14 . 1 1 124 124 ASN C C 124 174.851 174.851 174.435 0.416 18321 18205 1 14 . 1 1 124 124 ASN CA C 124 52.771 52.771 52.819 -0.048 18321 18206 1 14 . 1 1 124 124 ASN CB C 124 38.304 38.304 39.679 -1.375 18321 18207 1 14 . 1 1 124 124 ASN H H 124 8.307 8.307 8.440 -0.133 18321 18208 1 14 . 1 1 125 125 LEU N N 125 121.311 121.311 120.269 1.042 18321 18209 1 14 . 1 1 125 125 LEU C C 125 175.750 175.750 175.559 0.191 18321 18210 1 14 . 1 1 125 125 LEU CA C 125 54.428 54.428 55.707 -1.279 18321 18211 1 14 . 1 1 125 125 LEU CB C 125 41.350 41.350 41.132 0.218 18321 18212 1 14 . 1 1 125 125 LEU H H 125 7.747 7.747 8.633 -0.886 18321 18213 1 14 . 1 1 126 126 GLU N N 126 122.485 122.485 118.174 4.311 18321 18214 1 14 . 1 1 126 126 GLU C C 126 174.008 174.008 174.308 -0.300 18321 18215 1 14 . 1 1 126 126 GLU CA C 126 54.855 54.855 56.621 -1.766 18321 18216 1 14 . 1 1 126 126 GLU CB C 126 30.472 30.472 30.681 -0.209 18321 18217 1 14 . 1 1 126 126 GLU H H 126 8.453 8.453 8.147 0.306 18321 18218 1 14 . 1 1 127 127 TYR N N 127 122.713 122.713 120.775 1.938 18321 18219 1 14 . 1 1 127 127 TYR C C 127 176.859 176.859 175.306 1.553 18321 18220 1 14 . 1 1 127 127 TYR CA C 127 56.528 56.528 57.781 -1.253 18321 18221 1 14 . 1 1 127 127 TYR CB C 127 40.982 40.982 38.321 2.661 18321 18222 1 14 . 1 1 127 127 TYR H H 127 8.469 8.469 8.230 0.239 18321 18223 1 14 . 1 1 128 128 VAL N N 128 112.432 112.432 124.375 -11.943 18321 18224 1 14 . 1 1 128 128 VAL C C 128 173.150 173.150 174.610 -1.460 18321 18225 1 14 . 1 1 128 128 VAL CA C 128 57.940 57.940 61.213 -3.273 18321 18226 1 14 . 1 1 128 128 VAL CB C 128 34.935 34.935 34.367 0.568 18321 18227 1 14 . 1 1 128 128 VAL H H 128 9.078 9.078 9.112 -0.034 18321 18228 1 14 . 1 1 129 129 ARG N N 129 120.373 120.373 126.817 -6.444 18321 18229 1 14 . 1 1 129 129 ARG C C 129 176.539 176.539 175.656 0.883 18321 18230 1 14 . 1 1 129 129 ARG CA C 129 52.534 52.534 53.881 -1.347 18321 18231 1 14 . 1 1 129 129 ARG CB C 129 32.942 32.942 32.776 0.166 18321 18232 1 14 . 1 1 129 129 ARG H H 129 9.010 9.010 8.136 0.874 18321 18233 1 14 . 1 1 130 130 THR N N 130 116.637 116.637 113.838 2.799 18321 18234 1 14 . 1 1 130 130 THR CA C 130 60.618 60.618 60.860 -0.242 18321 18235 1 14 . 1 1 130 130 THR CB C 130 69.170 69.170 70.376 -1.206 18321 18236 1 14 . 1 1 130 130 THR H H 130 9.045 9.045 8.578 0.467 18321 18237 1 14 . 1 1 131 131 LEU N N 131 122.910 122.910 124.854 -1.944 18321 18238 1 14 . 1 1 131 131 LEU C C 131 175.269 175.269 176.902 -1.633 18321 18239 1 14 . 1 1 131 131 LEU CA C 131 55.122 55.122 56.107 -0.985 18321 18240 1 14 . 1 1 131 131 LEU CB C 131 43.108 43.108 42.347 0.761 18321 18241 1 14 . 1 1 131 131 LEU H H 131 9.224 9.224 8.183 1.041 18321 18242 1 14 . 1 1 132 132 TYR N N 132 112.885 112.885 118.159 -5.274 18321 18243 1 14 . 1 1 132 132 TYR C C 132 173.818 173.818 175.662 -1.844 18321 18244 1 14 . 1 1 132 132 TYR CA C 132 54.230 54.230 59.432 -5.202 18321 18245 1 14 . 1 1 132 132 TYR CB C 132 42.672 42.672 39.819 2.853 18321 18246 1 14 . 1 1 132 132 TYR H H 132 7.284 7.284 7.616 -0.332 18321 18247 1 14 . 1 1 133 133 ASP N N 133 118.003 118.003 119.116 -1.113 18321 18248 1 14 . 1 1 133 133 ASP C C 133 175.779 175.779 174.608 1.171 18321 18249 1 14 . 1 1 133 133 ASP CA C 133 54.351 54.351 55.348 -0.997 18321 18250 1 14 . 1 1 133 133 ASP CB C 133 41.241 41.241 40.114 1.127 18321 18251 1 14 . 1 1 133 133 ASP H H 133 8.399 8.399 8.323 0.076 18321 18252 1 14 . 1 1 134 134 PHE N N 134 121.081 121.081 124.278 -3.197 18321 18253 1 14 . 1 1 134 134 PHE CA C 134 52.552 52.552 54.814 -2.262 18321 18254 1 14 . 1 1 134 134 PHE CB C 134 41.217 41.217 41.652 -0.435 18321 18255 1 14 . 1 1 134 134 PHE H H 134 8.797 8.797 7.253 1.544 18321 18256 1 14 . 1 1 136 136 GLY C C 136 171.616 171.616 175.025 -3.409 18321 18257 1 14 . 1 1 137 137 ASN N N 137 119.394 119.394 115.814 3.580 18321 18258 1 14 . 1 1 137 137 ASN C C 137 174.500 174.500 173.589 0.911 18321 18259 1 14 . 1 1 137 137 ASN CA C 137 44.670 44.670 54.214 -9.544 18321 18260 1 14 . 1 1 137 137 ASN H H 137 9.477 9.477 8.326 1.151 18321 18261 1 14 . 1 1 138 138 ASP N N 138 120.608 120.608 118.849 1.759 18321 18262 1 14 . 1 1 138 138 ASP C C 138 176.987 176.987 174.539 2.448 18321 18263 1 14 . 1 1 138 138 ASP CA C 138 52.992 52.992 53.285 -0.293 18321 18264 1 14 . 1 1 138 138 ASP H H 138 8.216 8.216 8.031 0.185 18321 18265 1 14 . 1 1 139 139 ALA N N 139 124.371 124.371 121.423 2.948 18321 18266 1 14 . 1 1 139 139 ALA C C 139 178.472 178.472 179.193 -0.721 18321 18267 1 14 . 1 1 139 139 ALA CA C 139 54.513 54.513 54.077 0.436 18321 18268 1 14 . 1 1 139 139 ALA CB C 139 18.045 18.045 19.414 -1.369 18321 18269 1 14 . 1 1 139 139 ALA H H 139 8.565 8.565 8.525 0.040 18321 18270 1 14 . 1 1 140 140 GLU N N 140 115.022 115.022 118.093 -3.071 18321 18271 1 14 . 1 1 140 140 GLU C C 140 177.027 177.027 175.774 1.253 18321 18272 1 14 . 1 1 140 140 GLU CA C 140 56.181 56.181 58.239 -2.058 18321 18273 1 14 . 1 1 140 140 GLU CB C 140 28.619 28.619 30.275 -1.656 18321 18274 1 14 . 1 1 140 140 GLU H H 140 8.616 8.616 8.449 0.167 18321 18275 1 14 . 1 1 141 141 ASP N N 141 121.913 121.913 119.472 2.441 18321 18276 1 14 . 1 1 141 141 ASP C C 141 175.923 175.923 175.129 0.794 18321 18277 1 14 . 1 1 141 141 ASP CA C 141 54.736 54.736 53.117 1.619 18321 18278 1 14 . 1 1 141 141 ASP CB C 141 41.305 41.305 42.883 -1.578 18321 18279 1 14 . 1 1 141 141 ASP H H 141 7.636 7.636 7.864 -0.228 18321 18280 1 14 . 1 1 142 142 LEU N N 142 127.651 127.651 126.844 0.807 18321 18281 1 14 . 1 1 142 142 LEU CA C 142 50.955 50.955 53.182 -2.227 18321 18282 1 14 . 1 1 142 142 LEU CB C 142 42.343 42.343 43.605 -1.262 18321 18283 1 14 . 1 1 142 142 LEU H H 142 9.479 9.479 8.053 1.426 18321 18284 1 14 . 1 1 143 143 PRO C C 143 177.924 177.924 175.718 2.206 18321 18285 1 14 . 1 1 144 144 PHE N N 144 114.483 114.483 120.545 -6.062 18321 18286 1 14 . 1 1 144 144 PHE C C 144 175.055 175.055 174.910 0.145 18321 18287 1 14 . 1 1 144 144 PHE CA C 144 55.543 55.543 54.586 0.957 18321 18288 1 14 . 1 1 144 144 PHE CB C 144 40.581 40.581 40.931 -0.350 18321 18289 1 14 . 1 1 144 144 PHE H H 144 8.637 8.637 7.347 1.290 18321 18290 1 14 . 1 1 145 145 LYS N N 145 121.342 121.342 120.091 1.251 18321 18291 1 14 . 1 1 145 145 LYS C C 145 176.925 176.925 177.944 -1.019 18321 18292 1 14 . 1 1 145 145 LYS CA C 145 53.043 53.043 54.433 -1.390 18321 18293 1 14 . 1 1 145 145 LYS CB C 145 33.804 33.804 34.925 -1.121 18321 18294 1 14 . 1 1 145 145 LYS H H 145 9.418 9.418 8.660 0.758 18321 18295 1 14 . 1 1 146 146 LYS N N 146 123.378 123.378 120.195 3.183 18321 18296 1 14 . 1 1 146 146 LYS CA C 146 57.883 57.883 56.564 1.319 18321 18297 1 14 . 1 1 146 146 LYS CB C 146 32.008 32.008 30.807 1.201 18321 18298 1 14 . 1 1 146 146 LYS H H 146 9.002 9.002 8.679 0.323 18321 18299 1 14 . 1 1 147 147 GLY C C 147 174.315 174.315 172.890 1.425 18321 18300 1 14 . 1 1 148 148 GLU N N 148 121.392 121.392 119.670 1.722 18321 18301 1 14 . 1 1 148 148 GLU C C 148 174.998 174.998 175.070 -0.072 18321 18302 1 14 . 1 1 148 148 GLU CA C 148 56.867 56.867 54.466 2.401 18321 18303 1 14 . 1 1 148 148 GLU CB C 148 31.649 31.649 32.444 -0.794 18321 18304 1 14 . 1 1 148 148 GLU H H 148 7.937 7.937 7.761 0.176 18321 18305 1 14 . 1 1 149 149 ILE N N 149 120.124 120.124 122.229 -2.105 18321 18306 1 14 . 1 1 149 149 ILE C C 149 176.647 176.647 174.953 1.694 18321 18307 1 14 . 1 1 149 149 ILE CA C 149 58.621 58.621 60.741 -2.120 18321 18308 1 14 . 1 1 149 149 ILE CB C 149 36.952 36.952 38.465 -1.512 18321 18309 1 14 . 1 1 149 149 ILE H H 149 8.346 8.346 8.598 -0.252 18321 18310 1 14 . 1 1 150 150 LEU N N 150 126.950 126.950 125.071 1.879 18321 18311 1 14 . 1 1 150 150 LEU CA C 150 51.967 51.967 52.823 -0.856 18321 18312 1 14 . 1 1 150 150 LEU CB C 150 44.182 44.182 45.698 -1.516 18321 18313 1 14 . 1 1 150 150 LEU H H 150 8.988 8.988 9.080 -0.092 18321 18314 1 14 . 1 1 151 151 VAL C C 151 175.670 175.670 176.192 -0.522 18321 18315 1 14 . 1 1 152 152 ILE N N 152 124.997 124.997 128.709 -3.712 18321 18316 1 14 . 1 1 152 152 ILE CA C 152 58.331 58.331 59.994 -1.663 18321 18317 1 14 . 1 1 152 152 ILE CB C 152 34.093 34.093 34.786 -0.693 18321 18318 1 14 . 1 1 152 152 ILE H H 152 8.673 8.673 8.607 0.066 18321 18319 1 14 . 1 1 153 153 ILE N N 153 124.710 124.710 126.936 -2.226 18321 18320 1 14 . 1 1 153 153 ILE C C 153 176.264 176.264 175.140 1.124 18321 18321 1 14 . 1 1 154 154 GLU N N 154 117.398 117.398 117.684 -0.286 18321 18322 1 14 . 1 1 154 154 GLU C C 154 173.959 173.959 174.467 -0.508 18321 18323 1 14 . 1 1 154 154 GLU CA C 154 55.289 55.289 54.808 0.481 18321 18324 1 14 . 1 1 154 154 GLU CB C 154 32.842 32.842 32.747 0.095 18321 18325 1 14 . 1 1 154 154 GLU H H 154 7.818 7.818 8.220 -0.402 18321 18326 1 14 . 1 1 155 155 LYS N N 155 121.130 121.130 123.911 -2.781 18321 18327 1 14 . 1 1 155 155 LYS CA C 155 53.022 53.022 53.160 -0.138 18321 18328 1 14 . 1 1 155 155 LYS CB C 155 32.663 32.663 32.692 -0.029 18321 18329 1 14 . 1 1 155 155 LYS H H 155 8.654 8.654 8.682 -0.028 18321 18330 1 14 . 1 1 157 157 GLU C C 157 175.190 175.190 176.089 -0.899 18321 18331 1 14 . 1 1 157 157 GLU CA C 157 53.785 53.785 54.317 -0.532 18321 18332 1 14 . 1 1 157 157 GLU CB C 157 32.685 32.685 32.018 0.667 18321 18333 1 14 . 1 1 158 158 GLU N N 158 117.425 117.425 118.540 -1.115 18321 18334 1 14 . 1 1 158 158 GLU C C 158 178.600 178.600 177.099 1.501 18321 18335 1 14 . 1 1 158 158 GLU CA C 158 59.044 59.044 58.114 0.930 18321 18336 1 14 . 1 1 158 158 GLU CB C 158 29.706 29.706 29.997 -0.291 18321 18337 1 14 . 1 1 158 158 GLU H H 158 8.678 8.678 8.676 0.002 18321 18338 1 14 . 1 1 159 159 GLN N N 159 110.925 110.925 118.116 -7.191 18321 18339 1 14 . 1 1 159 159 GLN C C 159 175.539 175.539 174.016 1.523 18321 18340 1 14 . 1 1 159 159 GLN CA C 159 54.942 54.942 56.222 -1.280 18321 18341 1 14 . 1 1 159 159 GLN CB C 159 28.572 28.572 29.618 -1.046 18321 18342 1 14 . 1 1 159 159 GLN H H 159 8.483 8.483 8.263 0.220 18321 18343 1 14 . 1 1 160 160 TRP N N 160 120.171 120.171 118.954 1.217 18321 18344 1 14 . 1 1 160 160 TRP C C 160 173.444 173.444 174.926 -1.482 18321 18345 1 14 . 1 1 160 160 TRP CA C 160 56.175 56.175 55.636 0.539 18321 18346 1 14 . 1 1 160 160 TRP CB C 160 31.796 31.796 31.973 -0.177 18321 18347 1 14 . 1 1 160 160 TRP H H 160 6.826 6.826 7.381 -0.555 18321 18348 1 14 . 1 1 161 161 TRP N N 161 120.687 120.687 122.721 -2.034 18321 18349 1 14 . 1 1 161 161 TRP C C 161 174.736 174.736 176.074 -1.338 18321 18350 1 14 . 1 1 161 161 TRP CA C 161 51.889 51.889 54.341 -2.452 18321 18351 1 14 . 1 1 161 161 TRP CB C 161 32.772 32.772 31.626 1.146 18321 18352 1 14 . 1 1 161 161 TRP H H 161 8.462 8.462 9.469 -1.007 18321 18353 1 14 . 1 1 162 162 SER N N 162 115.691 115.691 120.449 -4.758 18321 18354 1 14 . 1 1 162 162 SER C C 162 174.320 174.320 173.379 0.941 18321 18355 1 14 . 1 1 162 162 SER CA C 162 57.011 57.011 58.392 -1.381 18321 18356 1 14 . 1 1 162 162 SER CB C 162 63.948 63.948 62.929 1.018 18321 18357 1 14 . 1 1 162 162 SER H H 162 8.830 8.830 9.206 -0.376 18321 18358 1 14 . 1 1 163 163 ALA N N 163 130.630 130.630 128.136 2.494 18321 18359 1 14 . 1 1 163 163 ALA CA C 163 50.029 50.029 49.986 0.043 18321 18360 1 14 . 1 1 163 163 ALA CB C 163 25.500 25.500 22.150 3.350 18321 18361 1 14 . 1 1 163 163 ALA H H 163 9.585 9.585 9.138 0.447 18321 18362 1 14 . 1 1 164 164 ARG N N 164 117.526 117.526 121.391 -3.865 18321 18363 1 14 . 1 1 164 164 ARG C C 164 176.719 176.719 176.717 0.002 18321 18364 1 14 . 1 1 164 164 ARG CA C 164 52.975 52.975 54.292 -1.317 18321 18365 1 14 . 1 1 164 164 ARG CB C 164 34.260 34.260 30.542 3.718 18321 18366 1 14 . 1 1 164 164 ARG H H 164 9.097 9.097 9.082 0.015 18321 18367 1 14 . 1 1 165 165 ASN N N 165 123.935 123.935 123.056 0.879 18321 18368 1 14 . 1 1 165 165 ASN C C 165 178.484 178.484 176.957 1.527 18321 18369 1 14 . 1 1 165 165 ASN CA C 165 50.332 50.332 54.320 -3.988 18321 18370 1 14 . 1 1 165 165 ASN CB C 165 39.487 39.487 39.512 -0.025 18321 18371 1 14 . 1 1 165 165 ASN H H 165 8.756 8.756 9.032 -0.276 18321 18372 1 14 . 1 1 166 166 LYS N N 166 118.464 118.464 121.338 -2.874 18321 18373 1 14 . 1 1 166 166 LYS C C 166 176.967 176.967 177.394 -0.427 18321 18374 1 14 . 1 1 166 166 LYS CA C 166 58.430 58.430 58.509 -0.079 18321 18375 1 14 . 1 1 166 166 LYS CB C 166 30.918 30.918 32.335 -1.417 18321 18376 1 14 . 1 1 166 166 LYS H H 166 8.915 8.915 9.370 -0.455 18321 18377 1 14 . 1 1 167 167 ASP N N 167 118.138 118.138 115.797 2.341 18321 18378 1 14 . 1 1 167 167 ASP C C 167 176.464 176.464 176.777 -0.313 18321 18379 1 14 . 1 1 167 167 ASP CA C 167 54.212 54.212 55.327 -1.115 18321 18380 1 14 . 1 1 167 167 ASP CB C 167 41.178 41.178 41.112 0.066 18321 18381 1 14 . 1 1 167 167 ASP H H 167 7.508 7.508 8.485 -0.977 18321 18382 1 14 . 1 1 168 168 GLY N N 168 107.901 107.901 107.311 0.590 18321 18383 1 14 . 1 1 168 168 GLY C C 168 173.613 173.613 173.216 0.397 18321 18384 1 14 . 1 1 168 168 GLY CA C 168 44.783 44.783 45.037 -0.254 18321 18385 1 14 . 1 1 168 168 GLY H H 168 8.173 8.173 8.081 0.092 18321 18386 1 14 . 1 1 169 169 ARG N N 169 124.324 124.324 119.952 4.372 18321 18387 1 14 . 1 1 169 169 ARG CA C 169 56.106 56.106 54.687 1.419 18321 18388 1 14 . 1 1 169 169 ARG CB C 169 29.648 29.648 31.961 -2.313 18321 18389 1 14 . 1 1 169 169 ARG H H 169 7.998 7.998 8.219 -0.221 18321 18390 1 14 . 1 1 170 170 VAL C C 170 177.590 177.590 175.109 2.481 18321 18391 1 14 . 1 1 171 171 GLY N N 171 112.582 112.582 114.328 -1.746 18321 18392 1 14 . 1 1 171 171 GLY C C 171 170.991 170.991 172.467 -1.476 18321 18393 1 14 . 1 1 171 171 GLY CA C 171 45.361 45.361 44.593 0.768 18321 18394 1 14 . 1 1 171 171 GLY H H 171 9.013 9.013 8.653 0.360 18321 18395 1 14 . 1 1 172 172 MET N N 172 117.368 117.368 121.196 -3.828 18321 18396 1 14 . 1 1 172 172 MET C C 172 177.921 177.921 176.287 1.634 18321 18397 1 14 . 1 1 172 172 MET CA C 172 53.536 53.536 56.788 -3.252 18321 18398 1 14 . 1 1 172 172 MET CB C 172 30.838 30.838 33.860 -3.022 18321 18399 1 14 . 1 1 172 172 MET H H 172 8.885 8.885 7.864 1.021 18321 18400 1 14 . 1 1 173 173 ILE N N 173 113.130 113.130 116.693 -3.563 18321 18401 1 14 . 1 1 173 173 ILE CA C 173 56.284 56.284 57.879 -1.595 18321 18402 1 14 . 1 1 173 173 ILE CB C 173 40.870 40.870 40.496 0.374 18321 18403 1 14 . 1 1 173 173 ILE H H 173 9.704 9.704 9.313 0.391 18321 18404 1 14 . 1 1 174 174 PRO C C 174 176.714 176.714 177.603 -0.889 18321 18405 1 14 . 1 1 174 174 PRO CA C 174 66.290 66.290 61.547 4.743 18321 18406 1 14 . 1 1 174 174 PRO CB C 174 28.993 28.993 30.568 -1.575 18321 18407 1 14 . 1 1 175 175 VAL N N 175 128.066 128.066 124.769 3.297 18321 18408 1 14 . 1 1 175 175 VAL CA C 175 59.356 59.356 67.053 -7.697 18321 18409 1 14 . 1 1 175 175 VAL H H 175 7.327 7.327 8.098 -0.771 18321 18410 1 14 . 1 1 176 176 PRO C C 176 176.351 176.351 176.768 -0.417 18321 18411 1 14 . 1 1 177 177 TYR N N 177 115.756 115.756 116.195 -0.439 18321 18412 1 14 . 1 1 177 177 TYR C C 177 175.011 175.011 175.585 -0.574 18321 18413 1 14 . 1 1 177 177 TYR CA C 177 56.756 56.756 57.580 -0.823 18321 18414 1 14 . 1 1 177 177 TYR CB C 177 37.507 37.507 38.868 -1.361 18321 18415 1 14 . 1 1 177 177 TYR H H 177 7.784 7.784 7.532 0.252 18321 18416 1 14 . 1 1 178 178 VAL N N 178 111.428 111.428 114.067 -2.639 18321 18417 1 14 . 1 1 178 178 VAL C C 178 173.417 173.417 175.931 -2.514 18321 18418 1 14 . 1 1 178 178 VAL CA C 178 58.307 58.307 59.284 -0.977 18321 18419 1 14 . 1 1 178 178 VAL CB C 178 34.602 34.602 34.205 0.397 18321 18420 1 14 . 1 1 178 178 VAL H H 178 7.801 7.801 7.559 0.242 18321 18421 1 14 . 1 1 179 179 GLU N N 179 118.581 118.581 119.714 -1.133 18321 18422 1 14 . 1 1 179 179 GLU C C 179 175.225 175.225 175.483 -0.258 18321 18423 1 14 . 1 1 179 179 GLU CA C 179 53.114 53.114 55.086 -1.972 18321 18424 1 14 . 1 1 179 179 GLU CB C 179 32.712 32.712 29.928 2.784 18321 18425 1 14 . 1 1 179 179 GLU H H 179 8.819 8.819 8.491 0.328 18321 18426 1 14 . 1 1 180 180 LYS N N 180 124.167 124.167 120.558 3.609 18321 18427 1 14 . 1 1 180 180 LYS C C 180 176.303 176.303 176.592 -0.289 18321 18428 1 14 . 1 1 180 180 LYS CA C 180 57.318 57.318 56.113 1.205 18321 18429 1 14 . 1 1 180 180 LYS CB C 180 31.675 31.675 33.269 -1.594 18321 18430 1 14 . 1 1 180 180 LYS H H 180 8.775 8.775 7.760 1.015 18321 18431 1 14 . 1 1 181 181 LEU N N 181 125.157 125.157 123.137 2.020 18321 18432 1 14 . 1 1 181 181 LEU C C 181 176.462 176.462 176.083 0.379 18321 18433 1 14 . 1 1 181 181 LEU CA C 181 54.470 54.470 53.656 0.814 18321 18434 1 14 . 1 1 181 181 LEU CB C 181 41.625 41.625 43.340 -1.716 18321 18435 1 14 . 1 1 181 181 LEU H H 181 8.084 8.084 8.441 -0.357 18321 18436 1 14 . 1 1 182 182 VAL N N 182 123.167 123.167 126.713 -3.546 18321 18437 1 14 . 1 1 182 182 VAL C C 182 175.983 175.983 173.500 2.483 18321 18438 1 14 . 1 1 182 182 VAL CA C 182 61.613 61.613 64.021 -2.408 18321 18439 1 14 . 1 1 182 182 VAL CB C 182 32.085 32.085 31.842 0.243 18321 18440 1 14 . 1 1 182 182 VAL H H 182 8.345 8.345 8.671 -0.326 18321 18441 1 14 . 1 1 183 183 ARG N N 183 125.775 125.775 126.846 -1.071 18321 18442 1 14 . 1 1 183 183 ARG CA C 183 57.801 57.801 56.029 1.772 18321 18443 1 14 . 1 1 183 183 ARG CB C 183 30.091 30.091 31.328 -1.237 18321 18444 1 14 . 1 1 183 183 ARG H H 183 8.530 8.530 8.227 0.303 18321 18445 1 14 . 1 1 184 184 SER C C 184 173.239 173.239 173.935 -0.696 18321 18446 1 14 . 1 1 185 185 SER N N 185 116.511 116.511 112.627 3.884 18321 18447 1 14 . 1 1 185 185 SER CA C 185 58.428 58.428 56.374 2.054 18321 18448 1 14 . 1 1 185 185 SER CB C 185 69.737 69.737 63.603 6.134 18321 18449 1 14 . 1 1 185 185 SER H H 185 7.944 7.944 7.083 0.861 18321 18450 1 14 . 1 1 190 190 HIS C C 190 176.953 176.953 172.830 4.123 18321 18451 1 14 . 1 1 190 190 HIS CA C 190 54.229 54.229 55.818 -1.589 18321 18452 1 14 . 1 1 190 190 HIS CB C 190 35.112 35.112 30.266 4.846 18321 18453 1 14 . 1 1 191 191 GLY N N 191 109.491 109.491 107.396 2.095 18321 18454 1 14 . 1 1 191 191 GLY C C 191 172.295 172.295 172.226 0.069 18321 18455 1 14 . 1 1 191 191 GLY CA C 191 45.227 45.227 44.945 0.282 18321 18456 1 14 . 1 1 191 191 GLY H H 191 8.719 8.719 8.325 0.394 18321 18457 1 14 . 1 1 192 192 ASN N N 192 118.700 118.700 118.404 0.296 18321 18458 1 14 . 1 1 192 192 ASN HA H 192 4.312 4.312 5.359 -1.047 18321 18459 1 14 . 1 1 192 192 ASN C C 192 176.369 176.369 175.124 1.245 18321 18460 1 14 . 1 1 192 192 ASN CA C 192 57.787 57.787 53.666 4.121 18321 18461 1 14 . 1 1 192 192 ASN H H 192 7.508 7.508 8.598 -1.090 18321 18462 1 14 . 1 1 193 193 ARG N N 193 120.743 120.743 119.484 1.259 18321 18463 1 14 . 1 1 193 193 ARG H H 193 9.032 9.032 8.040 0.992 18321 18464 1 14 . 1 1 197 197 SER HA H 197 4.388 4.388 4.334 0.054 18321 18465 1 14 . 1 1 197 197 SER C C 197 174.133 174.133 175.113 -0.980 18321 18466 1 14 . 1 1 197 197 SER CA C 197 58.128 58.128 60.119 -1.991 18321 18467 1 14 . 1 1 197 197 SER CB C 197 62.966 62.966 62.851 0.115 18321 18468 1 14 . 1 1 198 198 TYR N N 198 121.435 121.435 119.474 1.961 18321 18469 1 14 . 1 1 198 198 TYR HA H 198 4.543 4.543 4.553 -0.010 18321 18470 1 14 . 1 1 198 198 TYR C C 198 176.230 176.230 176.165 0.065 18321 18471 1 14 . 1 1 198 198 TYR CA C 198 57.536 57.536 58.107 -0.571 18321 18472 1 14 . 1 1 198 198 TYR CB C 198 38.279 38.279 38.520 -0.241 18321 18473 1 14 . 1 1 198 198 TYR H H 198 8.071 8.071 7.927 0.144 18321 18474 1 14 . 1 1 199 199 GLY N N 199 110.039 110.039 109.494 0.545 18321 18475 1 14 . 1 1 199 199 GLY C C 199 173.475 173.475 173.227 0.248 18321 18476 1 14 . 1 1 199 199 GLY CA C 199 44.805 44.805 45.422 -0.618 18321 18477 1 14 . 1 1 199 199 GLY H H 199 8.162 8.162 7.878 0.284 18321 18478 1 14 . 1 1 200 200 ILE N N 200 121.530 121.530 122.168 -0.638 18321 18479 1 14 . 1 1 200 200 ILE CA C 200 58.102 58.102 57.914 0.188 18321 18480 1 14 . 1 1 200 200 ILE CB C 200 37.760 37.760 38.779 -1.018 18321 18481 1 14 . 1 1 200 200 ILE H H 200 7.851 7.851 8.484 -0.633 18321 18482 1 14 . 1 1 201 201 PRO C C 201 176.485 176.485 176.236 0.249 18321 18483 1 14 . 1 1 201 201 PRO CA C 201 53.893 53.893 64.234 -10.341 18321 18484 1 14 . 1 1 201 201 PRO CB C 201 29.042 29.042 32.226 -3.184 18321 18485 1 14 . 1 1 202 202 GLU N N 202 122.468 122.468 117.384 5.084 18321 18486 1 14 . 1 1 202 202 GLU CA C 202 62.490 62.490 53.573 8.917 18321 18487 1 14 . 1 1 202 202 GLU CB C 202 31.170 31.170 31.262 -0.092 18321 18488 1 14 . 1 1 202 202 GLU H H 202 8.328 8.328 7.910 0.418 18321 18489 1 14 . 1 1 203 203 PRO CA C 203 62.803 62.803 63.676 -0.873 18321 18490 1 14 . 1 1 203 203 PRO CB C 203 31.220 31.220 32.240 -1.020 18321 18491 1 14 . 1 1 204 204 ALA N N 204 123.251 123.251 121.009 2.242 18321 18492 1 14 . 1 1 204 204 ALA HA H 204 4.180 4.180 4.522 -0.342 18321 18493 1 14 . 1 1 204 204 ALA CA C 204 52.124 52.124 51.856 0.268 18321 18494 1 14 . 1 1 204 204 ALA CB C 204 18.892 18.892 20.285 -1.393 18321 18495 1 14 . 1 1 204 204 ALA H H 204 8.308 8.308 7.549 0.759 18321 18496 1 14 . 1 1 205 205 HIS N N 205 117.874 117.874 124.022 -6.148 18321 18497 1 14 . 1 1 205 205 HIS C C 205 173.282 173.282 176.126 -2.844 18321 18498 1 14 . 1 1 205 205 HIS H H 205 8.045 8.045 8.802 -0.757 18321 18499 1 14 . 1 1 206 206 ALA N N 206 125.519 125.519 131.319 -5.800 18321 18500 1 14 . 1 1 206 206 ALA HA H 206 4.204 4.204 3.858 0.346 18321 18501 1 14 . 1 1 206 206 ALA CA C 206 40.196 40.196 53.701 -13.505 18321 18502 1 14 . 1 1 206 206 ALA CB C 206 19.407 19.407 17.393 2.014 18321 18503 1 14 . 1 1 206 206 ALA H H 206 8.061 8.061 8.860 -0.799 18321 18504 1 14 . 1 1 207 207 TYR N N 207 120.381 120.381 122.154 -1.773 18321 18505 1 14 . 1 1 207 207 TYR HA H 207 4.570 4.570 4.374 0.196 18321 18506 1 14 . 1 1 207 207 TYR CA C 207 52.572 52.572 58.203 -5.631 18321 18507 1 14 . 1 1 207 207 TYR CB C 207 41.333 41.333 38.404 2.929 18321 18508 1 14 . 1 1 207 207 TYR H H 207 8.199 8.199 8.183 0.016 18321 18509 1 14 . 1 1 208 208 ALA HA H 208 4.281 4.281 4.262 0.019 18321 18510 1 14 . 1 1 208 208 ALA C C 208 177.736 177.736 176.318 1.418 18321 18511 1 14 . 1 1 208 208 ALA CA C 208 52.084 52.084 52.275 -0.191 18321 18512 1 14 . 1 1 208 208 ALA CB C 208 18.999 18.999 20.216 -1.217 18321 18513 1 14 . 1 1 209 209 GLN N N 209 119.295 119.295 119.353 -0.058 18321 18514 1 14 . 1 1 209 209 GLN CA C 209 61.474 61.474 53.309 8.165 18321 18515 1 14 . 1 1 209 209 GLN CB C 209 32.039 32.039 30.883 1.156 18321 18516 1 14 . 1 1 209 209 GLN H H 209 8.125 8.125 7.928 0.197 18321 18517 1 14 . 1 1 210 210 PRO HA H 210 4.395 4.395 4.571 -0.176 18321 18518 1 14 . 1 1 210 210 PRO CA C 210 62.584 62.584 62.430 0.154 18321 18519 1 14 . 1 1 211 211 GLN HA H 211 4.377 4.377 4.506 -0.129 18321 18520 1 14 . 1 1 211 211 GLN CA C 211 55.859 55.859 55.559 0.300 18321 18521 1 14 . 1 1 211 211 GLN CB C 211 29.577 29.577 27.907 1.670 18321 18522 1 14 . 1 1 212 212 THR C C 212 176.551 176.551 174.190 2.361 18321 18523 1 14 . 1 1 212 212 THR CB C 212 69.890 69.890 68.665 1.225 18321 18524 1 14 . 1 1 213 213 THR N N 213 108.487 108.487 119.322 -10.835 18321 18525 1 14 . 1 1 213 213 THR CA C 213 61.236 61.236 63.123 -1.887 18321 18526 1 14 . 1 1 213 213 THR CB C 213 69.091 69.091 69.832 -0.741 18321 18527 1 14 . 1 1 213 213 THR H H 213 8.243 8.243 8.154 0.089 18321 18528 1 14 . 1 1 214 214 THR N N 214 119.445 119.445 113.955 5.490 18321 18529 1 14 . 1 1 214 214 THR CA C 214 59.425 59.425 62.649 -3.224 18321 18530 1 14 . 1 1 214 214 THR CB C 214 69.251 69.251 67.507 1.744 18321 18531 1 14 . 1 1 214 214 THR H H 214 8.188 8.188 8.248 -0.060 18321 18532 1 14 . 1 1 215 215 PRO HA H 215 4.361 4.361 4.385 -0.024 18321 18533 1 14 . 1 1 215 215 PRO C C 215 175.422 175.422 176.130 -0.708 18321 18534 1 14 . 1 1 215 215 PRO CA C 215 63.320 63.320 63.885 -0.565 18321 18535 1 14 . 1 1 215 215 PRO CB C 215 31.918 31.918 31.558 0.360 18321 18536 1 14 . 1 1 216 216 LEU N N 216 121.602 121.602 115.864 5.738 18321 18537 1 14 . 1 1 216 216 LEU CA C 216 52.203 52.203 51.155 1.048 18321 18538 1 14 . 1 1 216 216 LEU CB C 216 42.451 42.451 42.136 0.315 18321 18539 1 14 . 1 1 216 216 LEU H H 216 7.891 7.891 7.458 0.433 18321 18540 1 14 . 1 1 217 217 PRO HA H 217 4.398 4.398 4.604 -0.206 18321 18541 1 14 . 1 1 217 217 PRO C C 217 176.577 176.577 176.657 -0.080 18321 18542 1 14 . 1 1 217 217 PRO CA C 217 62.984 62.984 62.562 0.422 18321 18543 1 14 . 1 1 217 217 PRO CB C 217 32.056 32.056 32.306 -0.250 18321 18544 1 14 . 1 1 218 218 ALA N N 218 124.087 124.087 128.801 -4.714 18321 18545 1 14 . 1 1 218 218 ALA HA H 218 4.309 4.309 4.219 0.090 18321 18546 1 14 . 1 1 218 218 ALA C C 218 177.844 177.844 177.303 0.541 18321 18547 1 14 . 1 1 218 218 ALA CA C 218 52.379 52.379 53.069 -0.690 18321 18548 1 14 . 1 1 218 218 ALA CB C 218 19.133 19.133 19.199 -0.066 18321 18549 1 14 . 1 1 218 218 ALA H H 218 8.261 8.261 8.612 -0.351 18321 18550 1 14 . 1 1 219 219 VAL N N 219 118.942 118.942 118.664 0.278 18321 18551 1 14 . 1 1 219 219 VAL HA H 219 4.142 4.142 3.785 0.357 18321 18552 1 14 . 1 1 219 219 VAL CA C 219 62.102 62.102 61.873 0.229 18321 18553 1 14 . 1 1 219 219 VAL CB C 219 32.923 32.923 31.061 1.861 18321 18554 1 14 . 1 1 219 219 VAL H H 219 8.049 8.049 7.952 0.097 18321 18555 1 14 . 1 1 220 220 SER N N 220 119.207 119.207 119.683 -0.476 18321 18556 1 14 . 1 1 220 220 SER HA H 220 4.436 4.436 4.643 -0.207 18321 18557 1 14 . 1 1 220 220 SER CA C 220 57.813 57.813 58.503 -0.690 18321 18558 1 14 . 1 1 220 220 SER CB C 220 63.375 63.375 63.295 0.080 18321 18559 1 14 . 1 1 220 220 SER H H 220 8.275 8.275 8.311 -0.036 18321 18560 1 14 . 1 1 221 221 GLY N N 221 110.973 110.973 112.808 -1.835 18321 18561 1 14 . 1 1 221 221 GLY C C 221 173.962 173.962 174.248 -0.286 18321 18562 1 14 . 1 1 221 221 GLY CA C 221 45.286 45.286 45.459 -0.173 18321 18563 1 14 . 1 1 221 221 GLY H H 221 8.374 8.374 8.812 -0.438 18321 18564 1 14 . 1 1 222 222 SER N N 222 115.516 115.516 118.286 -2.770 18321 18565 1 14 . 1 1 222 222 SER HA H 222 4.763 4.763 4.815 -0.052 18321 18566 1 14 . 1 1 222 222 SER CA C 222 56.407 56.407 56.812 -0.405 18321 18567 1 14 . 1 1 222 222 SER CB C 222 63.993 63.993 63.776 0.217 18321 18568 1 14 . 1 1 222 222 SER H H 222 8.155 8.155 8.027 0.128 18321 18569 1 14 . 1 1 223 223 PRO HA H 223 4.417 4.417 4.513 -0.096 18321 18570 1 14 . 1 1 223 223 PRO CA C 223 63.805 63.805 62.650 1.155 18321 18571 1 14 . 1 1 223 223 PRO CB C 223 32.090 32.090 32.327 -0.237 18321 18572 1 14 . 1 1 224 224 GLY N N 224 109.149 109.149 112.382 -3.233 18321 18573 1 14 . 1 1 224 224 GLY C C 224 173.813 173.813 173.396 0.417 18321 18574 1 14 . 1 1 224 224 GLY CA C 224 44.512 44.512 45.014 -0.502 18321 18575 1 14 . 1 1 224 224 GLY H H 224 8.376 8.376 8.753 -0.377 18321 18576 1 14 . 1 1 225 225 ALA N N 225 123.599 123.599 123.172 0.427 18321 18577 1 14 . 1 1 225 225 ALA C C 225 177.341 177.341 175.803 1.538 18321 18578 1 14 . 1 1 225 225 ALA CA C 225 51.878 51.878 51.887 -0.009 18321 18579 1 14 . 1 1 225 225 ALA CB C 225 19.169 19.169 20.678 -1.509 18321 18580 1 14 . 1 1 225 225 ALA H H 225 7.959 7.959 7.608 0.351 18321 18581 1 14 . 1 1 226 226 ALA N N 226 123.218 123.218 123.039 0.179 18321 18582 1 14 . 1 1 226 226 ALA HA H 226 4.350 4.350 4.563 -0.213 18321 18583 1 14 . 1 1 226 226 ALA C C 226 177.520 177.520 177.630 -0.110 18321 18584 1 14 . 1 1 226 226 ALA CA C 226 52.535 52.535 51.606 0.929 18321 18585 1 14 . 1 1 226 226 ALA CB C 226 19.171 19.171 18.570 0.601 18321 18586 1 14 . 1 1 226 226 ALA H H 226 8.169 8.169 8.307 -0.138 18321 18587 1 14 . 1 1 227 227 ILE N N 227 120.086 120.086 122.843 -2.757 18321 18588 1 14 . 1 1 227 227 ILE HA H 227 4.201 4.201 4.106 0.095 18321 18589 1 14 . 1 1 227 227 ILE C C 227 174.814 174.814 175.134 -0.320 18321 18590 1 14 . 1 1 227 227 ILE CA C 227 60.929 60.929 61.189 -0.260 18321 18591 1 14 . 1 1 227 227 ILE CB C 227 38.872 38.872 38.330 0.543 18321 18592 1 14 . 1 1 227 227 ILE H H 227 8.037 8.037 8.592 -0.555 18321 18593 1 14 . 1 1 228 228 THR N N 228 117.224 117.224 112.675 4.549 18321 18594 1 14 . 1 1 228 228 THR HA H 228 4.203 4.203 4.200 0.003 18321 18595 1 14 . 1 1 228 228 THR CA C 228 57.108 57.108 62.357 -5.249 18321 18596 1 14 . 1 1 228 228 THR CB C 228 69.945 69.945 68.273 1.671 18321 18597 1 14 . 1 1 228 228 THR H H 228 7.775 7.775 7.792 -0.017 18321 18598 1 14 . 1 1 229 229 PRO HA H 229 4.750 4.750 4.463 0.287 18321 18599 1 14 . 1 1 229 229 PRO CA C 229 62.480 62.480 64.094 -1.615 18321 18600 1 14 . 1 1 229 229 PRO CB C 229 33.995 33.995 32.422 1.573 18321 18601 1 14 . 1 1 230 230 LEU N N 230 123.629 123.629 116.821 6.808 18321 18602 1 14 . 1 1 230 230 LEU CA C 230 53.076 53.076 51.233 1.843 18321 18603 1 14 . 1 1 230 230 LEU CB C 230 40.608 40.608 42.079 -1.471 18321 18604 1 14 . 1 1 230 230 LEU H H 230 8.453 8.453 7.748 0.705 18321 18605 1 14 . 1 1 231 231 PRO HA H 231 4.412 4.412 4.308 0.104 18321 18606 1 14 . 1 1 231 231 PRO C C 231 176.571 176.571 176.980 -0.409 18321 18607 1 14 . 1 1 231 231 PRO CA C 231 63.225 63.225 64.766 -1.541 18321 18608 1 14 . 1 1 231 231 PRO CB C 231 31.191 31.191 32.311 -1.120 18321 18609 1 14 . 1 1 232 232 SER N N 232 115.169 115.169 113.519 1.650 18321 18610 1 14 . 1 1 232 232 SER HA H 232 4.450 4.450 4.597 -0.147 18321 18611 1 14 . 1 1 232 232 SER CA C 232 58.604 58.604 58.248 0.356 18321 18612 1 14 . 1 1 232 232 SER CB C 232 63.962 63.962 62.387 1.575 18321 18613 1 14 . 1 1 232 232 SER H H 232 8.280 8.280 7.969 0.311 18321 18614 1 14 . 1 1 233 233 THR N N 233 115.155 115.155 116.682 -1.527 18321 18615 1 14 . 1 1 233 233 THR HA H 233 4.351 4.351 4.525 -0.174 18321 18616 1 14 . 1 1 233 233 THR C C 233 177.237 177.237 175.761 1.476 18321 18617 1 14 . 1 1 233 233 THR CA C 233 61.939 61.939 61.951 -0.012 18321 18618 1 14 . 1 1 233 233 THR CB C 233 68.986 68.986 69.890 -0.904 18321 18619 1 14 . 1 1 233 233 THR H H 233 8.096 8.096 8.297 -0.201 18321 18620 1 14 . 1 1 234 234 GLN N N 234 122.040 122.040 119.770 2.270 18321 18621 1 14 . 1 1 234 234 GLN HA H 234 4.681 4.681 3.718 0.963 18321 18622 1 14 . 1 1 234 234 GLN C C 234 176.177 176.177 176.356 -0.179 18321 18623 1 14 . 1 1 234 234 GLN CA C 234 55.861 55.861 58.689 -2.828 18321 18624 1 14 . 1 1 234 234 GLN CB C 234 28.583 28.583 27.535 1.048 18321 18625 1 14 . 1 1 234 234 GLN H H 234 8.256 8.256 8.699 -0.443 18321 18626 1 14 . 1 1 235 235 ASN N N 235 119.506 119.506 116.233 3.273 18321 18627 1 14 . 1 1 235 235 ASN HA H 235 4.775 4.775 4.365 0.410 18321 18628 1 14 . 1 1 235 235 ASN C C 235 174.974 174.974 175.122 -0.148 18321 18629 1 14 . 1 1 235 235 ASN CA C 235 53.191 53.191 54.838 -1.647 18321 18630 1 14 . 1 1 235 235 ASN CB C 235 38.511 38.511 38.051 0.460 18321 18631 1 14 . 1 1 235 235 ASN H H 235 8.346 8.346 8.722 -0.376 18321 18632 1 14 . 1 1 236 236 GLY N N 236 109.378 109.378 107.194 2.184 18321 18633 1 14 . 1 1 236 236 GLY CA C 236 44.023 44.023 44.481 -0.458 18321 18634 1 14 . 1 1 236 236 GLY H H 236 7.939 7.939 8.110 -0.171 18321 18635 1 14 . 1 1 237 237 PRO HA H 237 4.336 4.336 4.829 -0.493 18321 18636 1 14 . 1 1 237 237 PRO C C 237 175.942 175.942 175.669 0.273 18321 18637 1 14 . 1 1 237 237 PRO CA C 237 62.797 62.797 61.752 1.045 18321 18638 1 14 . 1 1 237 237 PRO CB C 237 27.421 27.421 31.943 -4.522 18321 18639 1 14 . 1 1 238 238 VAL N N 238 120.535 120.535 124.049 -3.514 18321 18640 1 14 . 1 1 238 238 VAL HA H 238 4.195 4.195 4.208 -0.013 18321 18641 1 14 . 1 1 238 238 VAL C C 238 173.775 173.775 174.816 -1.041 18321 18642 1 14 . 1 1 238 238 VAL CA C 238 61.173 61.173 61.724 -0.551 18321 18643 1 14 . 1 1 238 238 VAL CB C 238 38.328 38.328 33.027 5.301 18321 18644 1 14 . 1 1 238 238 VAL H H 238 7.986 7.986 7.957 0.029 18321 18645 1 14 . 1 1 239 239 PHE N N 239 123.522 123.522 125.990 -2.468 18321 18646 1 14 . 1 1 239 239 PHE HA H 239 5.539 5.539 5.466 0.073 18321 18647 1 14 . 1 1 239 239 PHE C C 239 174.207 174.207 174.820 -0.613 18321 18648 1 14 . 1 1 239 239 PHE CA C 239 56.993 56.993 56.342 0.652 18321 18649 1 14 . 1 1 239 239 PHE CB C 239 41.743 41.743 40.955 0.788 18321 18650 1 14 . 1 1 239 239 PHE H H 239 8.927 8.927 8.215 0.712 18321 18651 1 14 . 1 1 240 240 ALA N N 240 120.871 120.871 126.019 -5.148 18321 18652 1 14 . 1 1 240 240 ALA HA H 240 5.352 5.352 5.321 0.031 18321 18653 1 14 . 1 1 240 240 ALA C C 240 174.639 174.639 175.660 -1.021 18321 18654 1 14 . 1 1 240 240 ALA CA C 240 49.736 49.736 50.265 -0.529 18321 18655 1 14 . 1 1 240 240 ALA CB C 240 23.480 23.480 22.789 0.691 18321 18656 1 14 . 1 1 240 240 ALA H H 240 9.398 9.398 9.101 0.297 18321 18657 1 14 . 1 1 241 241 LYS N N 241 121.227 121.227 121.891 -0.664 18321 18658 1 14 . 1 1 241 241 LYS HA H 241 5.373 5.373 4.981 0.392 18321 18659 1 14 . 1 1 241 241 LYS C C 241 176.772 176.772 175.868 0.904 18321 18660 1 14 . 1 1 241 241 LYS CA C 241 53.128 53.128 53.903 -0.775 18321 18661 1 14 . 1 1 241 241 LYS CB C 241 34.850 34.850 34.220 0.630 18321 18662 1 14 . 1 1 241 241 LYS H H 241 8.947 8.947 8.853 0.094 18321 18663 1 14 . 1 1 242 242 ALA N N 242 126.833 126.833 130.958 -4.125 18321 18664 1 14 . 1 1 242 242 ALA HA H 242 4.764 4.764 4.561 0.203 18321 18665 1 14 . 1 1 242 242 ALA C C 242 178.506 178.506 177.403 1.103 18321 18666 1 14 . 1 1 242 242 ALA CA C 242 52.788 52.788 51.786 1.002 18321 18667 1 14 . 1 1 242 242 ALA CB C 242 19.084 19.084 18.645 0.439 18321 18668 1 14 . 1 1 242 242 ALA H H 242 9.373 9.373 8.547 0.826 18321 18669 1 14 . 1 1 243 243 ILE N N 243 118.731 118.731 118.199 0.532 18321 18670 1 14 . 1 1 243 243 ILE HA H 243 4.454 4.454 4.257 0.197 18321 18671 1 14 . 1 1 243 243 ILE C C 243 174.773 174.773 175.791 -1.018 18321 18672 1 14 . 1 1 243 243 ILE CA C 243 60.613 60.613 61.336 -0.723 18321 18673 1 14 . 1 1 243 243 ILE CB C 243 39.232 39.232 38.254 0.978 18321 18674 1 14 . 1 1 243 243 ILE H H 243 8.933 8.933 7.960 0.973 18321 18675 1 14 . 1 1 244 244 GLN N N 244 121.616 121.616 120.062 1.554 18321 18676 1 14 . 1 1 244 244 GLN HA H 244 4.283 4.283 4.439 -0.156 18321 18677 1 14 . 1 1 244 244 GLN C C 244 172.815 172.815 174.403 -1.588 18321 18678 1 14 . 1 1 244 244 GLN CA C 244 54.750 54.750 54.568 0.182 18321 18679 1 14 . 1 1 244 244 GLN CB C 244 31.469 31.469 32.262 -0.793 18321 18680 1 14 . 1 1 244 244 GLN H H 244 7.438 7.438 7.433 0.005 18321 18681 1 14 . 1 1 245 245 LYS N N 245 124.215 124.215 125.374 -1.159 18321 18682 1 14 . 1 1 245 245 LYS HA H 245 3.962 3.962 4.255 -0.293 18321 18683 1 14 . 1 1 245 245 LYS C C 245 175.679 175.679 176.381 -0.702 18321 18684 1 14 . 1 1 245 245 LYS CA C 245 56.413 56.413 57.139 -0.726 18321 18685 1 14 . 1 1 245 245 LYS CB C 245 32.847 32.847 32.953 -0.106 18321 18686 1 14 . 1 1 245 245 LYS H H 245 8.318 8.318 8.487 -0.169 18321 18687 1 14 . 1 1 246 246 ARG N N 246 127.327 127.327 128.770 -1.443 18321 18688 1 14 . 1 1 246 246 ARG HA H 246 4.221 4.221 4.649 -0.428 18321 18689 1 14 . 1 1 246 246 ARG CA C 246 56.279 56.279 54.519 1.760 18321 18690 1 14 . 1 1 246 246 ARG CB C 246 32.987 32.987 31.374 1.613 18321 18691 1 14 . 1 1 246 246 ARG H H 246 9.248 9.248 8.939 0.309 18321 18692 1 14 . 1 1 249 249 CYS HA H 249 4.260 4.260 4.180 0.080 18321 18693 1 14 . 1 1 249 249 CYS CA C 249 55.886 55.886 57.698 -1.812 18321 18694 1 14 . 1 1 249 249 CYS CB C 249 34.146 34.146 29.059 5.087 18321 18695 1 14 . 1 1 250 250 ALA HA H 250 3.926 3.926 4.007 -0.081 18321 18696 1 14 . 1 1 250 250 ALA CA C 250 54.344 54.344 54.281 0.063 18321 18697 1 14 . 1 1 250 250 ALA CB C 250 18.342 18.342 18.622 -0.280 18321 18698 1 14 . 1 1 251 251 TYR N N 251 110.618 110.618 112.036 -1.418 18321 18699 1 14 . 1 1 251 251 TYR HA H 251 4.489 4.489 4.678 -0.189 18321 18700 1 14 . 1 1 251 251 TYR C C 251 175.286 175.286 175.007 0.279 18321 18701 1 14 . 1 1 251 251 TYR CA C 251 56.137 56.137 55.202 0.936 18321 18702 1 14 . 1 1 251 251 TYR CB C 251 37.203 37.203 37.968 -0.765 18321 18703 1 14 . 1 1 251 251 TYR H H 251 7.037 7.037 7.040 -0.003 18321 18704 1 14 . 1 1 252 252 ASP N N 252 121.835 121.835 121.916 -0.081 18321 18705 1 14 . 1 1 252 252 ASP HA H 252 4.763 4.763 4.861 -0.098 18321 18706 1 14 . 1 1 252 252 ASP CA C 252 52.351 52.351 53.675 -1.324 18321 18707 1 14 . 1 1 252 252 ASP CB C 252 39.995 39.995 42.663 -2.668 18321 18708 1 14 . 1 1 252 252 ASP H H 252 7.339 7.339 7.688 -0.349 18321 18709 1 14 . 1 1 253 253 LYS N N 253 123.177 123.177 119.386 3.791 18321 18710 1 14 . 1 1 253 253 LYS HA H 253 4.270 4.270 4.456 -0.186 18321 18711 1 14 . 1 1 253 253 LYS C C 253 177.724 177.724 177.126 0.598 18321 18712 1 14 . 1 1 253 253 LYS CA C 253 57.036 57.036 56.828 0.208 18321 18713 1 14 . 1 1 253 253 LYS H H 253 8.396 8.396 8.573 -0.177 18321 18714 1 14 . 1 1 254 254 THR N N 254 108.317 108.317 116.958 -8.641 18321 18715 1 14 . 1 1 254 254 THR HA H 254 4.517 4.517 4.349 0.168 18321 18716 1 14 . 1 1 254 254 THR C C 254 174.012 174.012 174.099 -0.087 18321 18717 1 14 . 1 1 254 254 THR CA C 254 61.036 61.036 62.247 -1.211 18321 18718 1 14 . 1 1 254 254 THR CB C 254 69.307 69.307 68.549 0.758 18321 18719 1 14 . 1 1 254 254 THR H H 254 8.217 8.217 8.206 0.011 18321 18720 1 14 . 1 1 255 255 ALA N N 255 124.762 124.762 125.272 -0.510 18321 18721 1 14 . 1 1 255 255 ALA HA H 255 4.524 4.524 4.888 -0.364 18321 18722 1 14 . 1 1 255 255 ALA C C 255 176.630 176.630 176.892 -0.262 18321 18723 1 14 . 1 1 255 255 ALA CA C 255 51.352 51.352 51.941 -0.588 18321 18724 1 14 . 1 1 255 255 ALA CB C 255 20.135 20.135 19.159 0.977 18321 18725 1 14 . 1 1 255 255 ALA H H 255 7.096 7.096 7.706 -0.610 18321 18726 1 14 . 1 1 256 256 LEU N N 256 124.379 124.379 125.263 -0.884 18321 18727 1 14 . 1 1 256 256 LEU HA H 256 4.328 4.328 4.390 -0.062 18321 18728 1 14 . 1 1 256 256 LEU C C 256 176.007 176.007 175.986 0.021 18321 18729 1 14 . 1 1 256 256 LEU CA C 256 53.502 53.502 54.418 -0.916 18321 18730 1 14 . 1 1 256 256 LEU CB C 256 44.665 44.665 43.890 0.775 18321 18731 1 14 . 1 1 256 256 LEU H H 256 8.889 8.889 8.242 0.647 18321 18732 1 14 . 1 1 257 257 ALA N N 257 129.619 129.619 126.690 2.929 18321 18733 1 14 . 1 1 257 257 ALA HA H 257 4.445 4.445 5.015 -0.570 18321 18734 1 14 . 1 1 257 257 ALA C C 257 176.813 176.813 176.640 0.173 18321 18735 1 14 . 1 1 257 257 ALA CA C 257 51.179 51.179 51.177 0.002 18321 18736 1 14 . 1 1 257 257 ALA CB C 257 18.973 18.973 19.308 -0.335 18321 18737 1 14 . 1 1 257 257 ALA H H 257 8.529 8.529 8.119 0.410 18321 18738 1 14 . 1 1 258 258 LEU N N 258 119.300 119.300 125.434 -6.134 18321 18739 1 14 . 1 1 258 258 LEU HA H 258 4.782 4.782 4.641 0.141 18321 18740 1 14 . 1 1 258 258 LEU CA C 258 53.259 53.259 53.833 -0.574 18321 18741 1 14 . 1 1 258 258 LEU CB C 258 45.972 45.972 45.821 0.151 18321 18742 1 14 . 1 1 258 258 LEU H H 258 8.505 8.505 8.824 -0.319 18321 18743 1 14 . 1 1 259 259 GLU N N 259 123.919 123.919 122.722 1.197 18321 18744 1 14 . 1 1 259 259 GLU HA H 259 4.516 4.516 4.530 -0.014 18321 18745 1 14 . 1 1 259 259 GLU C C 259 175.795 175.795 175.680 0.115 18321 18746 1 14 . 1 1 259 259 GLU CA C 259 52.896 52.896 54.171 -1.275 18321 18747 1 14 . 1 1 259 259 GLU H H 259 8.943 8.943 8.593 0.350 18321 18748 1 14 . 1 1 260 260 VAL N N 260 122.122 122.122 120.596 1.526 18321 18749 1 14 . 1 1 260 260 VAL HA H 260 2.923 2.923 4.136 -1.213 18321 18750 1 14 . 1 1 260 260 VAL C C 260 177.964 177.964 177.459 0.505 18321 18751 1 14 . 1 1 260 260 VAL CA C 260 65.417 65.417 63.595 1.822 18321 18752 1 14 . 1 1 260 260 VAL CB C 260 30.668 30.668 30.878 -0.210 18321 18753 1 14 . 1 1 260 260 VAL H H 260 8.956 8.956 8.443 0.513 18321 18754 1 14 . 1 1 261 261 GLY N N 261 116.009 116.009 116.921 -0.912 18321 18755 1 14 . 1 1 261 261 GLY C C 261 176.288 176.288 173.695 2.593 18321 18756 1 14 . 1 1 261 261 GLY CA C 261 44.210 44.210 44.606 -0.396 18321 18757 1 14 . 1 1 261 261 GLY H H 261 8.799 8.799 9.064 -0.265 18321 18758 1 14 . 1 1 262 262 ASP N N 262 121.945 121.945 121.003 0.942 18321 18759 1 14 . 1 1 262 262 ASP HA H 262 4.423 4.423 4.978 -0.555 18321 18760 1 14 . 1 1 262 262 ASP C C 262 175.381 175.381 175.158 0.223 18321 18761 1 14 . 1 1 262 262 ASP CA C 262 55.243 55.243 52.542 2.701 18321 18762 1 14 . 1 1 262 262 ASP CB C 262 41.819 41.819 42.694 -0.875 18321 18763 1 14 . 1 1 262 262 ASP H H 262 8.180 8.180 7.952 0.228 18321 18764 1 14 . 1 1 263 263 ILE N N 263 121.452 121.452 123.503 -2.051 18321 18765 1 14 . 1 1 263 263 ILE HA H 263 4.707 4.707 4.696 0.011 18321 18766 1 14 . 1 1 263 263 ILE C C 263 174.996 174.996 176.167 -1.171 18321 18767 1 14 . 1 1 263 263 ILE CA C 263 59.289 59.289 59.276 0.013 18321 18768 1 14 . 1 1 263 263 ILE CB C 263 36.987 36.987 37.847 -0.860 18321 18769 1 14 . 1 1 263 263 ILE H H 263 8.460 8.460 8.535 -0.075 18321 18770 1 14 . 1 1 264 264 VAL N N 264 128.756 128.756 129.854 -1.098 18321 18771 1 14 . 1 1 264 264 VAL HA H 264 4.309 4.309 4.048 0.261 18321 18772 1 14 . 1 1 264 264 VAL C C 264 175.486 175.486 174.489 0.997 18321 18773 1 14 . 1 1 264 264 VAL CA C 264 59.091 59.091 61.408 -2.317 18321 18774 1 14 . 1 1 264 264 VAL CB C 264 34.541 34.541 31.767 2.774 18321 18775 1 14 . 1 1 264 264 VAL H H 264 9.479 9.479 9.185 0.294 18321 18776 1 14 . 1 1 265 265 LYS N N 265 128.101 128.101 130.030 -1.929 18321 18777 1 14 . 1 1 265 265 LYS HA H 265 4.342 4.342 3.934 0.408 18321 18778 1 14 . 1 1 265 265 LYS C C 265 175.531 175.531 175.023 0.508 18321 18779 1 14 . 1 1 265 265 LYS CA C 265 55.620 55.620 55.320 0.300 18321 18780 1 14 . 1 1 265 265 LYS CB C 265 33.149 33.149 32.317 0.832 18321 18781 1 14 . 1 1 265 265 LYS H H 265 8.715 8.715 8.572 0.143 18321 18782 1 14 . 1 1 266 266 VAL N N 266 129.537 129.537 128.217 1.320 18321 18783 1 14 . 1 1 266 266 VAL HA H 266 4.333 4.333 4.368 -0.035 18321 18784 1 14 . 1 1 266 266 VAL C C 266 176.166 176.166 174.723 1.443 18321 18785 1 14 . 1 1 266 266 VAL CA C 266 63.339 63.339 61.146 2.193 18321 18786 1 14 . 1 1 266 266 VAL CB C 266 30.712 30.712 34.182 -3.470 18321 18787 1 14 . 1 1 266 266 VAL H H 266 9.073 9.073 8.312 0.761 18321 18788 1 14 . 1 1 267 267 THR N N 267 120.020 120.020 123.179 -3.159 18321 18789 1 14 . 1 1 267 267 THR HA H 267 4.189 4.189 4.452 -0.263 18321 18790 1 14 . 1 1 267 267 THR C C 267 176.054 176.054 175.269 0.785 18321 18791 1 14 . 1 1 267 267 THR CA C 267 62.204 62.204 62.876 -0.672 18321 18792 1 14 . 1 1 267 267 THR CB C 267 68.200 68.200 69.596 -1.396 18321 18793 1 14 . 1 1 267 267 THR H H 267 9.130 9.130 8.240 0.890 18321 18794 1 14 . 1 1 268 268 ARG N N 268 120.839 120.839 122.001 -1.162 18321 18795 1 14 . 1 1 268 268 ARG HA H 268 4.236 4.236 4.628 -0.392 18321 18796 1 14 . 1 1 268 268 ARG CA C 268 56.321 56.321 54.979 1.342 18321 18797 1 14 . 1 1 268 268 ARG CB C 268 33.049 33.049 32.473 0.576 18321 18798 1 14 . 1 1 268 268 ARG H H 268 7.631 7.631 7.417 0.214 18321 18799 1 14 . 1 1 269 269 MET N N 269 125.443 125.443 123.053 2.390 18321 18800 1 14 . 1 1 269 269 MET C C 269 174.392 174.392 174.969 -0.577 18321 18801 1 14 . 1 1 269 269 MET H H 269 8.532 8.532 8.526 0.006 18321 18802 1 14 . 1 1 270 270 ASN N N 270 119.125 119.125 123.929 -4.804 18321 18803 1 14 . 1 1 270 270 ASN HA H 270 4.546 4.546 4.910 -0.364 18321 18804 1 14 . 1 1 270 270 ASN C C 270 172.133 172.133 175.950 -3.817 18321 18805 1 14 . 1 1 270 270 ASN CA C 270 53.639 53.639 52.359 1.280 18321 18806 1 14 . 1 1 270 270 ASN CB C 270 39.845 39.845 39.856 -0.011 18321 18807 1 14 . 1 1 270 270 ASN H H 270 6.631 6.631 9.002 -2.371 18321 18808 1 14 . 1 1 271 271 ILE N N 271 122.532 122.532 118.928 3.604 18321 18809 1 14 . 1 1 271 271 ILE HA H 271 4.417 4.417 4.135 0.282 18321 18810 1 14 . 1 1 271 271 ILE CA C 271 63.348 63.348 62.075 1.273 18321 18811 1 14 . 1 1 271 271 ILE CB C 271 38.198 38.198 37.349 0.849 18321 18812 1 14 . 1 1 271 271 ILE H H 271 8.565 8.565 8.637 -0.072 18321 18813 1 14 . 1 1 272 272 ASN HA H 272 4.527 4.527 4.648 -0.121 18321 18814 1 14 . 1 1 272 272 ASN C C 272 176.259 176.259 176.034 0.225 18321 18815 1 14 . 1 1 272 272 ASN CA C 272 53.225 53.225 53.413 -0.188 18321 18816 1 14 . 1 1 272 272 ASN CB C 272 37.565 37.565 38.564 -0.999 18321 18817 1 14 . 1 1 273 273 GLY N N 273 107.043 107.043 108.402 -1.359 18321 18818 1 14 . 1 1 273 273 GLY C C 273 173.216 173.216 173.352 -0.136 18321 18819 1 14 . 1 1 273 273 GLY CA C 273 45.299 45.299 45.139 0.160 18321 18820 1 14 . 1 1 273 273 GLY H H 273 8.086 8.086 7.869 0.217 18321 18821 1 14 . 1 1 274 274 GLN N N 274 120.624 120.624 121.792 -1.168 18321 18822 1 14 . 1 1 274 274 GLN HA H 274 4.551 4.551 4.433 0.118 18321 18823 1 14 . 1 1 274 274 GLN C C 274 175.039 175.039 175.571 -0.532 18321 18824 1 14 . 1 1 274 274 GLN CA C 274 54.556 54.556 55.392 -0.836 18321 18825 1 14 . 1 1 274 274 GLN CB C 274 33.698 33.698 28.988 4.710 18321 18826 1 14 . 1 1 274 274 GLN H H 274 8.045 8.045 7.981 0.064 18321 18827 1 14 . 1 1 275 275 TRP N N 275 125.596 125.596 125.764 -0.168 18321 18828 1 14 . 1 1 275 275 TRP HA H 275 4.588 4.588 4.619 -0.031 18321 18829 1 14 . 1 1 275 275 TRP C C 275 172.832 172.832 176.043 -3.211 18321 18830 1 14 . 1 1 275 275 TRP CA C 275 55.296 55.296 54.157 1.139 18321 18831 1 14 . 1 1 275 275 TRP CB C 275 31.393 31.393 30.280 1.113 18321 18832 1 14 . 1 1 275 275 TRP H H 275 8.484 8.484 7.742 0.742 18321 18833 1 14 . 1 1 276 276 GLU N N 276 119.012 119.012 120.513 -1.501 18321 18834 1 14 . 1 1 276 276 GLU HA H 276 5.190 5.190 4.908 0.282 18321 18835 1 14 . 1 1 276 276 GLU C C 276 176.553 176.553 176.501 0.052 18321 18836 1 14 . 1 1 276 276 GLU CA C 276 54.288 54.288 56.134 -1.846 18321 18837 1 14 . 1 1 276 276 GLU CB C 276 32.851 32.851 30.247 2.604 18321 18838 1 14 . 1 1 276 276 GLU H H 276 8.643 8.643 8.518 0.125 18321 18839 1 14 . 1 1 277 277 GLY N N 277 111.364 111.364 111.831 -0.467 18321 18840 1 14 . 1 1 277 277 GLY C C 277 170.707 170.707 172.261 -1.554 18321 18841 1 14 . 1 1 277 277 GLY CA C 277 46.723 46.723 43.858 2.865 18321 18842 1 14 . 1 1 277 277 GLY H H 277 9.072 9.072 9.135 -0.063 18321 18843 1 14 . 1 1 278 278 GLU N N 278 117.733 117.733 124.352 -6.619 18321 18844 1 14 . 1 1 278 278 GLU HA H 278 5.748 5.748 5.219 0.529 18321 18845 1 14 . 1 1 278 278 GLU C C 278 176.051 176.051 174.992 1.059 18321 18846 1 14 . 1 1 278 278 GLU CA C 278 53.620 53.620 54.997 -1.377 18321 18847 1 14 . 1 1 278 278 GLU CB C 278 33.742 33.742 31.745 1.996 18321 18848 1 14 . 1 1 278 278 GLU H H 278 8.810 8.810 8.371 0.439 18321 18849 1 14 . 1 1 279 279 VAL N N 279 123.834 123.834 125.696 -1.862 18321 18850 1 14 . 1 1 279 279 VAL HA H 279 4.404 4.404 4.431 -0.027 18321 18851 1 14 . 1 1 279 279 VAL C C 279 175.289 175.289 175.689 -0.400 18321 18852 1 14 . 1 1 279 279 VAL CA C 279 61.166 61.166 60.157 1.009 18321 18853 1 14 . 1 1 279 279 VAL CB C 279 34.123 34.123 35.343 -1.220 18321 18854 1 14 . 1 1 279 279 VAL H H 279 8.887 8.887 9.050 -0.163 18321 18855 1 14 . 1 1 280 280 ASN N N 280 126.025 126.025 123.783 2.242 18321 18856 1 14 . 1 1 280 280 ASN HA H 280 4.435 4.435 4.442 -0.007 18321 18857 1 14 . 1 1 280 280 ASN C C 280 175.205 175.205 175.449 -0.244 18321 18858 1 14 . 1 1 280 280 ASN CA C 280 45.615 45.615 54.224 -8.608 18321 18859 1 14 . 1 1 280 280 ASN CB C 280 37.386 37.386 38.097 -0.711 18321 18860 1 14 . 1 1 280 280 ASN H H 280 9.322 9.322 9.195 0.127 18321 18861 1 14 . 1 1 281 281 GLY N N 281 104.588 104.588 103.771 0.817 18321 18862 1 14 . 1 1 281 281 GLY C C 281 173.944 173.944 173.473 0.471 18321 18863 1 14 . 1 1 281 281 GLY CA C 281 45.224 45.224 44.954 0.270 18321 18864 1 14 . 1 1 281 281 GLY H H 281 8.768 8.768 8.335 0.433 18321 18865 1 14 . 1 1 282 282 ARG N N 282 122.567 122.567 122.112 0.455 18321 18866 1 14 . 1 1 282 282 ARG HA H 282 4.559 4.559 4.548 0.011 18321 18867 1 14 . 1 1 282 282 ARG C C 282 174.350 174.350 174.405 -0.055 18321 18868 1 14 . 1 1 282 282 ARG CA C 282 54.933 54.933 55.101 -0.168 18321 18869 1 14 . 1 1 282 282 ARG CB C 282 31.765 31.765 32.345 -0.580 18321 18870 1 14 . 1 1 282 282 ARG H H 282 8.149 8.149 7.814 0.335 18321 18871 1 14 . 1 1 283 283 LYS N N 283 121.565 121.565 128.665 -7.100 18321 18872 1 14 . 1 1 283 283 LYS HA H 283 5.584 5.584 5.400 0.184 18321 18873 1 14 . 1 1 283 283 LYS CA C 283 54.143 54.143 55.350 -1.207 18321 18874 1 14 . 1 1 283 283 LYS CB C 283 36.040 36.040 33.949 2.091 18321 18875 1 14 . 1 1 283 283 LYS H H 283 8.424 8.424 8.648 -0.224 18321 18876 1 14 . 1 1 284 284 GLY C C 284 173.006 173.006 172.275 0.731 18321 18877 1 14 . 1 1 284 284 GLY CA C 284 45.886 45.886 44.307 1.579 18321 18878 1 14 . 1 1 285 285 LEU N N 285 119.673 119.673 120.660 -0.987 18321 18879 1 14 . 1 1 285 285 LEU HA H 285 5.718 5.718 5.706 0.012 18321 18880 1 14 . 1 1 285 285 LEU C C 285 178.657 178.657 176.336 2.321 18321 18881 1 14 . 1 1 285 285 LEU CA C 285 53.656 53.656 53.729 -0.073 18321 18882 1 14 . 1 1 285 285 LEU CB C 285 44.813 44.813 44.086 0.727 18321 18883 1 14 . 1 1 285 285 LEU H H 285 8.734 8.734 8.668 0.066 18321 18884 1 14 . 1 1 286 286 PHE N N 286 118.785 118.785 118.684 0.101 18321 18885 1 14 . 1 1 286 286 PHE HA H 286 4.521 4.521 5.097 -0.576 18321 18886 1 14 . 1 1 286 286 PHE CA C 286 57.592 57.592 54.738 2.854 18321 18887 1 14 . 1 1 286 286 PHE CB C 286 40.669 40.669 39.823 0.846 18321 18888 1 14 . 1 1 286 286 PHE H H 286 9.120 9.120 8.377 0.743 18321 18889 1 14 . 1 1 287 287 PRO HA H 287 4.385 4.385 4.432 -0.047 18321 18890 1 14 . 1 1 287 287 PRO CA C 287 62.814 62.814 62.266 0.548 18321 18891 1 14 . 1 1 287 287 PRO CB C 287 32.133 32.133 31.357 0.776 18321 18892 1 14 . 1 1 288 288 PHE C C 288 174.837 174.837 176.408 -1.571 18321 18893 1 14 . 1 1 288 288 PHE CA C 288 59.020 59.020 60.334 -1.315 18321 18894 1 14 . 1 1 288 288 PHE CB C 288 34.987 34.987 36.673 -1.687 18321 18895 1 14 . 1 1 289 289 THR N N 289 107.865 107.865 109.984 -2.119 18321 18896 1 14 . 1 1 289 289 THR HA H 289 3.589 3.589 3.703 -0.114 18321 18897 1 14 . 1 1 289 289 THR C C 289 176.125 176.125 174.866 1.259 18321 18898 1 14 . 1 1 289 289 THR CA C 289 62.243 62.243 63.986 -1.743 18321 18899 1 14 . 1 1 289 289 THR CB C 289 69.365 69.365 67.554 1.811 18321 18900 1 14 . 1 1 289 289 THR H H 289 6.453 6.453 7.454 -1.001 18321 18901 1 14 . 1 1 290 290 HIS N N 290 119.462 119.462 117.820 1.642 18321 18902 1 14 . 1 1 290 290 HIS HA H 290 4.196 4.196 4.776 -0.580 18321 18903 1 14 . 1 1 290 290 HIS C C 290 175.165 175.165 174.220 0.945 18321 18904 1 14 . 1 1 290 290 HIS CA C 290 57.635 57.635 57.085 0.550 18321 18905 1 14 . 1 1 290 290 HIS CB C 290 29.840 29.840 31.298 -1.458 18321 18906 1 14 . 1 1 290 290 HIS H H 290 7.835 7.835 7.875 -0.040 18321 18907 1 14 . 1 1 291 291 VAL N N 291 110.050 110.050 113.430 -3.380 18321 18908 1 14 . 1 1 291 291 VAL HA H 291 5.445 5.445 5.134 0.311 18321 18909 1 14 . 1 1 291 291 VAL C C 291 173.386 173.386 174.888 -1.502 18321 18910 1 14 . 1 1 291 291 VAL CA C 291 57.794 57.794 58.878 -1.084 18321 18911 1 14 . 1 1 291 291 VAL CB C 291 35.784 35.784 35.009 0.775 18321 18912 1 14 . 1 1 291 291 VAL H H 291 7.562 7.562 7.554 0.008 18321 18913 1 14 . 1 1 292 292 LYS N N 292 119.445 119.445 120.650 -1.205 18321 18914 1 14 . 1 1 292 292 LYS HA H 292 4.857 4.857 4.784 0.073 18321 18915 1 14 . 1 1 292 292 LYS C C 292 176.512 176.512 175.640 0.872 18321 18916 1 14 . 1 1 292 292 LYS CA C 292 54.647 54.647 54.653 -0.006 18321 18917 1 14 . 1 1 292 292 LYS CB C 292 35.665 35.665 36.669 -1.004 18321 18918 1 14 . 1 1 292 292 LYS H H 292 8.753 8.753 8.392 0.361 18321 18919 1 14 . 1 1 293 293 ILE N N 293 128.707 128.707 124.284 4.423 18321 18920 1 14 . 1 1 293 293 ILE HA H 293 4.509 4.509 4.297 0.212 18321 18921 1 14 . 1 1 293 293 ILE C C 293 175.666 175.666 176.890 -1.224 18321 18922 1 14 . 1 1 293 293 ILE CA C 293 62.563 62.563 61.607 0.956 18321 18923 1 14 . 1 1 293 293 ILE CB C 293 38.076 38.076 36.765 1.311 18321 18924 1 14 . 1 1 293 293 ILE H H 293 9.107 9.107 9.000 0.107 18321 18925 1 14 . 1 1 294 294 PHE N N 294 126.638 126.638 124.449 2.189 18321 18926 1 14 . 1 1 294 294 PHE HA H 294 4.898 4.898 4.825 0.073 18321 18927 1 14 . 1 1 294 294 PHE C C 294 175.838 175.838 175.604 0.234 18321 18928 1 14 . 1 1 294 294 PHE CA C 294 56.335 56.335 57.159 -0.824 18321 18929 1 14 . 1 1 294 294 PHE CB C 294 41.196 41.196 40.913 0.283 18321 18930 1 14 . 1 1 294 294 PHE H H 294 8.716 8.716 8.579 0.137 18321 18931 1 14 . 1 1 295 295 ASP N N 295 122.961 122.961 121.779 1.182 18321 18932 1 14 . 1 1 295 295 ASP HA H 295 5.003 5.003 4.111 0.892 18321 18933 1 14 . 1 1 295 295 ASP CA C 295 50.602 50.602 54.416 -3.814 18321 18934 1 14 . 1 1 295 295 ASP CB C 295 40.754 40.754 40.576 0.178 18321 18935 1 14 . 1 1 295 295 ASP H H 295 8.418 8.418 7.276 1.142 18321 18936 1 14 . 1 1 296 296 PRO HA H 296 4.524 4.524 4.395 0.129 18321 18937 1 14 . 1 1 296 296 PRO C C 296 176.807 176.807 176.833 -0.026 18321 18938 1 14 . 1 1 296 296 PRO CA C 296 62.987 62.987 62.981 0.006 18321 18939 1 14 . 1 1 296 296 PRO CB C 296 32.033 32.033 30.445 1.588 18321 18940 1 14 . 1 1 297 297 GLN N N 297 120.729 120.729 116.147 4.582 18321 18941 1 14 . 1 1 297 297 GLN HA H 297 4.274 4.274 3.866 0.408 18321 18942 1 14 . 1 1 297 297 GLN CA C 297 56.427 56.427 58.069 -1.642 18321 18943 1 14 . 1 1 297 297 GLN CB C 297 28.819 28.819 27.653 1.166 18321 18944 1 14 . 1 1 297 297 GLN H H 297 8.551 8.551 8.471 0.080 18321 18945 1 14 . 1 1 299 299 PRO C C 299 176.936 176.936 177.785 -0.849 18321 18946 1 14 . 1 1 299 299 PRO CA C 299 63.406 63.406 65.076 -1.670 18321 18947 1 14 . 1 1 299 299 PRO CB C 299 31.421 31.421 31.655 -0.234 18321 18948 1 14 . 1 1 300 300 ASP N N 300 119.609 119.609 118.113 1.496 18321 18949 1 14 . 1 1 300 300 ASP C C 300 176.344 176.344 177.530 -1.186 18321 18950 1 14 . 1 1 300 300 ASP CA C 300 54.178 54.178 56.868 -2.690 18321 18951 1 14 . 1 1 300 300 ASP CB C 300 40.661 40.661 40.418 0.243 18321 18952 1 14 . 1 1 300 300 ASP H H 300 8.239 8.239 8.502 -0.263 18321 18953 1 14 . 1 1 301 301 GLU N N 301 120.462 120.462 118.421 2.041 18321 18954 1 14 . 1 1 301 301 GLU CA C 301 56.188 56.188 57.099 -0.911 18321 18955 1 14 . 1 1 301 301 GLU CB C 301 29.507 29.507 29.738 -0.230 18321 18956 1 14 . 1 1 301 301 GLU H H 301 8.084 8.084 7.929 0.155 18321 18957 1 15 . 1 1 2 2 SER HA H 2 4.521 4.521 4.746 -0.225 18321 18958 1 15 . 1 1 2 2 SER CA C 2 58.326 58.326 57.978 0.348 18321 18959 1 15 . 1 1 2 2 SER CB C 2 64.062 64.062 63.181 0.881 18321 18960 1 15 . 1 1 3 3 SER HA H 3 4.465 4.465 4.255 0.210 18321 18961 1 15 . 1 1 3 3 SER C C 3 173.887 173.887 174.538 -0.651 18321 18962 1 15 . 1 1 3 3 SER CA C 3 58.374 58.374 60.004 -1.629 18321 18963 1 15 . 1 1 3 3 SER CB C 3 63.920 63.920 63.470 0.450 18321 18964 1 15 . 1 1 4 4 ALA N N 4 124.755 124.755 125.188 -0.433 18321 18965 1 15 . 1 1 4 4 ALA HA H 4 4.547 4.547 4.628 -0.081 18321 18966 1 15 . 1 1 4 4 ALA CA C 4 52.737 52.737 51.975 0.762 18321 18967 1 15 . 1 1 4 4 ALA CB C 4 19.636 19.636 18.410 1.226 18321 18968 1 15 . 1 1 4 4 ALA H H 4 8.244 8.244 8.042 0.202 18321 18969 1 15 . 1 1 5 5 ARG N N 5 120.383 120.383 125.159 -4.776 18321 18970 1 15 . 1 1 5 5 ARG HA H 5 4.524 4.524 4.805 -0.281 18321 18971 1 15 . 1 1 5 5 ARG C C 5 175.611 175.611 174.722 0.889 18321 18972 1 15 . 1 1 5 5 ARG CA C 5 56.082 56.082 55.267 0.815 18321 18973 1 15 . 1 1 5 5 ARG CB C 5 30.695 30.695 30.078 0.617 18321 18974 1 15 . 1 1 5 5 ARG H H 5 8.727 8.727 8.103 0.624 18321 18975 1 15 . 1 1 6 6 PHE N N 6 115.159 115.159 120.353 -5.194 18321 18976 1 15 . 1 1 6 6 PHE HA H 6 4.786 4.786 4.924 -0.138 18321 18977 1 15 . 1 1 6 6 PHE C C 6 172.076 172.076 174.754 -2.678 18321 18978 1 15 . 1 1 6 6 PHE CA C 6 56.640 56.640 56.220 0.420 18321 18979 1 15 . 1 1 6 6 PHE CB C 6 40.378 40.378 40.089 0.289 18321 18980 1 15 . 1 1 6 6 PHE H H 6 7.536 7.536 7.721 -0.185 18321 18981 1 15 . 1 1 7 7 ASP N N 7 121.846 121.846 122.268 -0.422 18321 18982 1 15 . 1 1 7 7 ASP HA H 7 4.846 4.846 4.504 0.342 18321 18983 1 15 . 1 1 7 7 ASP CA C 7 52.327 52.327 56.093 -3.766 18321 18984 1 15 . 1 1 7 7 ASP CB C 7 41.298 41.298 41.219 0.079 18321 18985 1 15 . 1 1 7 7 ASP H H 7 9.062 9.062 9.093 -0.031 18321 18986 1 15 . 1 1 8 8 SER HA H 8 3.950 3.950 4.318 -0.368 18321 18987 1 15 . 1 1 8 8 SER C C 8 174.705 174.705 175.181 -0.476 18321 18988 1 15 . 1 1 8 8 SER CA C 8 61.937 61.937 60.312 1.625 18321 18989 1 15 . 1 1 8 8 SER CB C 8 62.260 62.260 62.444 -0.184 18321 18990 1 15 . 1 1 9 9 SER N N 9 114.373 114.373 115.590 -1.217 18321 18991 1 15 . 1 1 9 9 SER HA H 9 4.529 4.529 4.792 -0.263 18321 18992 1 15 . 1 1 9 9 SER C C 9 175.089 175.089 174.054 1.035 18321 18993 1 15 . 1 1 9 9 SER CA C 9 59.851 59.851 60.641 -0.790 18321 18994 1 15 . 1 1 9 9 SER CB C 9 64.246 64.246 63.989 0.257 18321 18995 1 15 . 1 1 9 9 SER H H 9 8.722 8.722 8.357 0.365 18321 18996 1 15 . 1 1 10 10 ASP N N 10 121.818 121.818 122.616 -0.798 18321 18997 1 15 . 1 1 10 10 ASP HA H 10 4.730 4.730 4.552 0.178 18321 18998 1 15 . 1 1 10 10 ASP C C 10 174.455 174.455 177.039 -2.584 18321 18999 1 15 . 1 1 10 10 ASP CA C 10 52.432 52.432 54.787 -2.355 18321 19000 1 15 . 1 1 10 10 ASP CB C 10 39.607 39.607 41.199 -1.592 18321 19001 1 15 . 1 1 10 10 ASP H H 10 7.600 7.600 8.468 -0.868 18321 19002 1 15 . 1 1 11 11 ARG N N 11 125.238 125.238 126.078 -0.840 18321 19003 1 15 . 1 1 11 11 ARG HA H 11 1.936 1.936 3.000 -1.064 18321 19004 1 15 . 1 1 11 11 ARG C C 11 176.916 176.916 177.480 -0.564 18321 19005 1 15 . 1 1 11 11 ARG CA C 11 57.451 57.451 57.754 -0.303 18321 19006 1 15 . 1 1 11 11 ARG CB C 11 43.014 43.014 29.344 13.670 18321 19007 1 15 . 1 1 11 11 ARG H H 11 7.739 7.739 8.267 -0.528 18321 19008 1 15 . 1 1 12 12 SER N N 12 112.065 112.065 113.173 -1.108 18321 19009 1 15 . 1 1 12 12 SER HA H 12 4.695 4.695 4.214 0.481 18321 19010 1 15 . 1 1 12 12 SER C C 12 175.092 175.092 174.217 0.875 18321 19011 1 15 . 1 1 12 12 SER CA C 12 60.785 60.785 60.414 0.371 18321 19012 1 15 . 1 1 12 12 SER CB C 12 62.889 62.889 62.785 0.104 18321 19013 1 15 . 1 1 12 12 SER H H 12 7.888 7.888 7.865 0.023 18321 19014 1 15 . 1 1 13 13 ALA N N 13 122.249 122.249 122.761 -0.512 18321 19015 1 15 . 1 1 13 13 ALA HA H 13 4.216 4.216 4.237 -0.021 18321 19016 1 15 . 1 1 13 13 ALA C C 13 178.069 178.069 177.260 0.809 18321 19017 1 15 . 1 1 13 13 ALA CA C 13 53.562 53.562 53.906 -0.344 18321 19018 1 15 . 1 1 13 13 ALA CB C 13 19.339 19.339 19.586 -0.247 18321 19019 1 15 . 1 1 13 13 ALA H H 13 7.418 7.418 7.522 -0.104 18321 19020 1 15 . 1 1 14 14 TRP N N 14 107.433 107.433 111.780 -4.347 18321 19021 1 15 . 1 1 14 14 TRP HA H 14 4.785 4.785 4.652 0.133 18321 19022 1 15 . 1 1 14 14 TRP C C 14 175.286 175.286 175.685 -0.399 18321 19023 1 15 . 1 1 14 14 TRP CA C 14 55.212 55.212 55.319 -0.106 18321 19024 1 15 . 1 1 14 14 TRP CB C 14 32.776 32.776 30.645 2.131 18321 19025 1 15 . 1 1 14 14 TRP H H 14 6.273 6.273 6.773 -0.500 18321 19026 1 15 . 1 1 15 15 TYR N N 15 122.315 122.315 124.664 -2.349 18321 19027 1 15 . 1 1 15 15 TYR HA H 15 5.436 5.436 4.694 0.742 18321 19028 1 15 . 1 1 15 15 TYR C C 15 175.325 175.325 174.746 0.579 18321 19029 1 15 . 1 1 15 15 TYR CA C 15 56.609 56.609 58.385 -1.776 18321 19030 1 15 . 1 1 15 15 TYR CB C 15 36.940 36.940 37.280 -0.340 18321 19031 1 15 . 1 1 15 15 TYR H H 15 8.221 8.221 7.829 0.392 18321 19032 1 15 . 1 1 16 16 MET N N 16 126.031 126.031 127.259 -1.228 18321 19033 1 15 . 1 1 16 16 MET HA H 16 4.462 4.462 4.248 0.214 18321 19034 1 15 . 1 1 16 16 MET CA C 16 53.046 53.046 53.087 -0.041 18321 19035 1 15 . 1 1 16 16 MET CB C 16 41.114 41.114 33.388 7.726 18321 19036 1 15 . 1 1 16 16 MET H H 16 8.989 8.989 8.582 0.407 18321 19037 1 15 . 1 1 17 17 GLY CA C 17 45.803 45.803 45.369 0.434 18321 19038 1 15 . 1 1 18 18 PRO HA H 18 4.675 4.675 4.403 0.272 18321 19039 1 15 . 1 1 18 18 PRO C C 18 175.943 175.943 175.525 0.418 18321 19040 1 15 . 1 1 18 18 PRO CA C 18 63.647 63.647 63.419 0.228 18321 19041 1 15 . 1 1 18 18 PRO CB C 18 29.276 29.276 30.150 -0.874 18321 19042 1 15 . 1 1 19 19 VAL N N 19 126.159 126.159 121.985 4.174 18321 19043 1 15 . 1 1 19 19 VAL HA H 19 4.011 4.011 4.390 -0.379 18321 19044 1 15 . 1 1 19 19 VAL C C 19 175.812 175.812 174.938 0.874 18321 19045 1 15 . 1 1 19 19 VAL CA C 19 62.355 62.355 60.240 2.115 18321 19046 1 15 . 1 1 19 19 VAL CB C 19 33.468 33.468 35.736 -2.268 18321 19047 1 15 . 1 1 19 19 VAL H H 19 7.851 7.851 7.894 -0.043 18321 19048 1 15 . 1 1 20 20 SER N N 20 123.950 123.950 114.299 9.651 18321 19049 1 15 . 1 1 20 20 SER HA H 20 4.453 4.453 4.674 -0.221 18321 19050 1 15 . 1 1 20 20 SER CA C 20 57.631 57.631 56.668 0.963 18321 19051 1 15 . 1 1 20 20 SER CB C 20 65.951 65.951 64.334 1.617 18321 19052 1 15 . 1 1 20 20 SER H H 20 8.800 8.800 8.100 0.700 18321 19053 1 15 . 1 1 21 21 ARG N N 21 123.461 123.461 122.910 0.551 18321 19054 1 15 . 1 1 21 21 ARG HA H 21 3.489 3.489 3.973 -0.484 18321 19055 1 15 . 1 1 21 21 ARG C C 21 178.164 178.164 178.014 0.150 18321 19056 1 15 . 1 1 21 21 ARG CA C 21 60.025 60.025 58.940 1.085 18321 19057 1 15 . 1 1 21 21 ARG CB C 21 30.334 30.334 29.880 0.454 18321 19058 1 15 . 1 1 21 21 ARG H H 21 9.307 9.307 8.955 0.352 18321 19059 1 15 . 1 1 22 22 GLN N N 22 116.591 116.591 118.175 -1.584 18321 19060 1 15 . 1 1 22 22 GLN HA H 22 4.008 4.008 4.023 -0.015 18321 19061 1 15 . 1 1 22 22 GLN CA C 22 59.095 59.095 59.322 -0.227 18321 19062 1 15 . 1 1 22 22 GLN CB C 22 29.249 29.249 28.036 1.213 18321 19063 1 15 . 1 1 22 22 GLN H H 22 8.394 8.394 8.091 0.303 18321 19064 1 15 . 1 1 23 23 GLU N N 23 122.191 122.191 118.951 3.240 18321 19065 1 15 . 1 1 23 23 GLU HA H 23 4.037 4.037 4.039 -0.002 18321 19066 1 15 . 1 1 23 23 GLU C C 23 178.986 178.986 178.657 0.329 18321 19067 1 15 . 1 1 23 23 GLU CA C 23 59.081 59.081 59.013 0.068 18321 19068 1 15 . 1 1 23 23 GLU CB C 23 31.896 31.896 29.144 2.752 18321 19069 1 15 . 1 1 23 23 GLU H H 23 8.106 8.106 8.493 -0.387 18321 19070 1 15 . 1 1 24 24 ALA N N 24 121.964 121.964 121.537 0.427 18321 19071 1 15 . 1 1 24 24 ALA HA H 24 3.762 3.762 3.908 -0.146 18321 19072 1 15 . 1 1 24 24 ALA C C 24 178.653 178.653 179.779 -1.126 18321 19073 1 15 . 1 1 24 24 ALA CA C 24 55.480 55.480 55.190 0.290 18321 19074 1 15 . 1 1 24 24 ALA CB C 24 18.049 18.049 18.390 -0.341 18321 19075 1 15 . 1 1 24 24 ALA H H 24 8.732 8.732 8.266 0.466 18321 19076 1 15 . 1 1 25 25 GLN N N 25 116.229 116.229 116.795 -0.566 18321 19077 1 15 . 1 1 25 25 GLN HA H 25 3.950 3.950 4.047 -0.097 18321 19078 1 15 . 1 1 25 25 GLN C C 25 177.442 177.442 178.387 -0.945 18321 19079 1 15 . 1 1 25 25 GLN CA C 25 59.651 59.651 58.578 1.073 18321 19080 1 15 . 1 1 25 25 GLN CB C 25 29.308 29.308 28.250 1.058 18321 19081 1 15 . 1 1 25 25 GLN H H 25 8.391 8.391 7.783 0.608 18321 19082 1 15 . 1 1 26 26 THR N N 26 115.105 115.105 112.448 2.657 18321 19083 1 15 . 1 1 26 26 THR HA H 26 3.920 3.920 4.200 -0.280 18321 19084 1 15 . 1 1 26 26 THR C C 26 176.835 176.835 176.182 0.653 18321 19085 1 15 . 1 1 26 26 THR CA C 26 66.335 66.335 64.024 2.311 18321 19086 1 15 . 1 1 26 26 THR CB C 26 68.876 68.876 68.302 0.574 18321 19087 1 15 . 1 1 26 26 THR H H 26 8.223 8.223 7.588 0.635 18321 19088 1 15 . 1 1 27 27 ARG N N 27 119.096 119.096 117.362 1.734 18321 19089 1 15 . 1 1 27 27 ARG HA H 27 4.047 4.047 4.460 -0.413 18321 19090 1 15 . 1 1 27 27 ARG C C 27 177.245 177.245 176.557 0.688 18321 19091 1 15 . 1 1 27 27 ARG CA C 27 58.528 58.528 57.115 1.413 18321 19092 1 15 . 1 1 27 27 ARG CB C 27 30.184 30.184 31.343 -1.159 18321 19093 1 15 . 1 1 27 27 ARG H H 27 8.093 8.093 7.547 0.546 18321 19094 1 15 . 1 1 28 28 LEU N N 28 114.602 114.602 115.940 -1.338 18321 19095 1 15 . 1 1 28 28 LEU HA H 28 4.325 4.325 4.538 -0.213 18321 19096 1 15 . 1 1 28 28 LEU C C 28 177.197 177.197 175.985 1.212 18321 19097 1 15 . 1 1 28 28 LEU CA C 28 55.143 55.143 54.476 0.667 18321 19098 1 15 . 1 1 28 28 LEU CB C 28 44.902 44.902 43.974 0.928 18321 19099 1 15 . 1 1 28 28 LEU H H 28 7.438 7.438 7.601 -0.163 18321 19100 1 15 . 1 1 29 29 GLN N N 29 121.312 121.312 120.926 0.386 18321 19101 1 15 . 1 1 29 29 GLN HA H 29 3.856 3.856 4.167 -0.311 18321 19102 1 15 . 1 1 29 29 GLN C C 29 178.048 178.048 176.762 1.286 18321 19103 1 15 . 1 1 29 29 GLN CA C 29 57.691 57.691 56.722 0.969 18321 19104 1 15 . 1 1 29 29 GLN CB C 29 27.293 27.293 28.503 -1.210 18321 19105 1 15 . 1 1 29 29 GLN H H 29 8.250 8.250 8.369 -0.119 18321 19106 1 15 . 1 1 30 30 GLY N N 30 116.768 116.768 115.535 1.233 18321 19107 1 15 . 1 1 30 30 GLY C C 30 174.914 174.914 174.010 0.904 18321 19108 1 15 . 1 1 30 30 GLY CA C 30 45.491 45.491 45.414 0.077 18321 19109 1 15 . 1 1 30 30 GLY H H 30 9.135 9.135 8.504 0.631 18321 19110 1 15 . 1 1 31 31 GLN N N 31 117.979 117.979 118.814 -0.835 18321 19111 1 15 . 1 1 31 31 GLN HA H 31 4.329 4.329 4.526 -0.197 18321 19112 1 15 . 1 1 31 31 GLN C C 31 177.174 177.174 176.308 0.866 18321 19113 1 15 . 1 1 31 31 GLN CA C 31 53.910 53.910 54.490 -0.580 18321 19114 1 15 . 1 1 31 31 GLN CB C 31 29.574 29.574 30.121 -0.547 18321 19115 1 15 . 1 1 31 31 GLN H H 31 7.695 7.695 7.573 0.122 18321 19116 1 15 . 1 1 32 32 ARG N N 32 123.918 123.918 118.980 4.938 18321 19117 1 15 . 1 1 32 32 ARG HA H 32 3.940 3.940 4.098 -0.158 18321 19118 1 15 . 1 1 32 32 ARG C C 32 175.810 175.810 176.026 -0.216 18321 19119 1 15 . 1 1 32 32 ARG CA C 32 56.770 56.770 56.671 0.099 18321 19120 1 15 . 1 1 32 32 ARG CB C 32 30.074 30.074 30.896 -0.822 18321 19121 1 15 . 1 1 32 32 ARG H H 32 8.955 8.955 8.528 0.427 18321 19122 1 15 . 1 1 33 33 HIS N N 33 122.248 122.248 120.438 1.810 18321 19123 1 15 . 1 1 33 33 HIS HA H 33 4.627 4.627 5.060 -0.433 18321 19124 1 15 . 1 1 33 33 HIS C C 33 177.089 177.089 175.941 1.148 18321 19125 1 15 . 1 1 33 33 HIS CA C 33 55.858 55.858 55.437 0.422 18321 19126 1 15 . 1 1 33 33 HIS CB C 33 28.648 28.648 30.054 -1.406 18321 19127 1 15 . 1 1 33 33 HIS H H 33 8.302 8.302 8.477 -0.175 18321 19128 1 15 . 1 1 34 34 GLY N N 34 109.518 109.518 113.852 -4.334 18321 19129 1 15 . 1 1 34 34 GLY C C 34 176.730 176.730 173.540 3.190 18321 19130 1 15 . 1 1 34 34 GLY CA C 34 45.967 45.967 44.920 1.047 18321 19131 1 15 . 1 1 34 34 GLY H H 34 9.496 9.496 9.142 0.354 18321 19132 1 15 . 1 1 35 35 MET N N 35 125.193 125.193 122.139 3.054 18321 19133 1 15 . 1 1 35 35 MET HA H 35 5.750 5.750 5.680 0.070 18321 19134 1 15 . 1 1 35 35 MET C C 35 174.388 174.388 174.920 -0.532 18321 19135 1 15 . 1 1 35 35 MET CA C 35 55.762 55.762 55.926 -0.164 18321 19136 1 15 . 1 1 35 35 MET CB C 35 32.706 32.706 34.528 -1.822 18321 19137 1 15 . 1 1 35 35 MET H H 35 8.359 8.359 7.350 1.009 18321 19138 1 15 . 1 1 36 36 PHE N N 36 123.311 123.311 117.338 5.973 18321 19139 1 15 . 1 1 36 36 PHE HA H 36 5.985 5.985 5.825 0.160 18321 19140 1 15 . 1 1 36 36 PHE C C 36 172.140 172.140 172.969 -0.829 18321 19141 1 15 . 1 1 36 36 PHE CA C 36 55.755 55.755 55.428 0.327 18321 19142 1 15 . 1 1 36 36 PHE CB C 36 45.197 45.197 42.780 2.417 18321 19143 1 15 . 1 1 36 36 PHE H H 36 8.261 8.261 7.701 0.560 18321 19144 1 15 . 1 1 37 37 LEU N N 37 114.652 114.652 116.859 -2.207 18321 19145 1 15 . 1 1 37 37 LEU HA H 37 4.489 4.489 5.194 -0.705 18321 19146 1 15 . 1 1 37 37 LEU C C 37 174.033 174.033 174.993 -0.960 18321 19147 1 15 . 1 1 37 37 LEU CA C 37 55.382 55.382 54.451 0.931 18321 19148 1 15 . 1 1 37 37 LEU CB C 37 44.791 44.791 45.693 -0.902 18321 19149 1 15 . 1 1 37 37 LEU H H 37 9.292 9.292 9.227 0.065 18321 19150 1 15 . 1 1 38 38 VAL N N 38 121.009 121.009 122.692 -1.683 18321 19151 1 15 . 1 1 38 38 VAL HA H 38 5.504 5.504 4.852 0.652 18321 19152 1 15 . 1 1 38 38 VAL C C 38 173.581 173.581 175.346 -1.765 18321 19153 1 15 . 1 1 38 38 VAL CA C 38 61.316 61.316 61.680 -0.364 18321 19154 1 15 . 1 1 38 38 VAL CB C 38 33.302 33.302 33.173 0.129 18321 19155 1 15 . 1 1 38 38 VAL H H 38 8.991 8.991 8.596 0.395 18321 19156 1 15 . 1 1 39 39 ARG N N 39 124.863 124.863 127.059 -2.196 18321 19157 1 15 . 1 1 39 39 ARG HA H 39 5.444 5.444 4.886 0.558 18321 19158 1 15 . 1 1 39 39 ARG C C 39 175.772 175.772 175.144 0.628 18321 19159 1 15 . 1 1 39 39 ARG CA C 39 52.558 52.558 53.361 -0.803 18321 19160 1 15 . 1 1 39 39 ARG CB C 39 34.980 34.980 32.923 2.057 18321 19161 1 15 . 1 1 39 39 ARG H H 39 9.569 9.569 8.547 1.022 18321 19162 1 15 . 1 1 40 40 ASP N N 40 122.330 122.330 121.994 0.336 18321 19163 1 15 . 1 1 40 40 ASP HA H 40 4.785 4.785 5.039 -0.254 18321 19164 1 15 . 1 1 40 40 ASP C C 40 176.332 176.332 175.846 0.486 18321 19165 1 15 . 1 1 40 40 ASP CA C 40 55.334 55.334 55.420 -0.086 18321 19166 1 15 . 1 1 40 40 ASP CB C 40 40.650 40.650 41.200 -0.550 18321 19167 1 15 . 1 1 40 40 ASP H H 40 8.413 8.413 8.306 0.107 18321 19168 1 15 . 1 1 41 41 SER N N 41 114.363 114.363 118.274 -3.911 18321 19169 1 15 . 1 1 41 41 SER HA H 41 4.506 4.506 4.609 -0.103 18321 19170 1 15 . 1 1 41 41 SER CA C 41 57.525 57.525 57.584 -0.059 18321 19171 1 15 . 1 1 41 41 SER CB C 41 63.706 63.706 64.404 -0.699 18321 19172 1 15 . 1 1 41 41 SER H H 41 7.791 7.791 8.382 -0.591 18321 19173 1 15 . 1 1 42 42 SER N N 42 126.932 126.932 121.763 5.169 18321 19174 1 15 . 1 1 42 42 SER HA H 42 4.410 4.410 4.601 -0.191 18321 19175 1 15 . 1 1 42 42 SER CA C 42 60.362 60.362 59.809 0.553 18321 19176 1 15 . 1 1 42 42 SER CB C 42 63.707 63.707 63.082 0.625 18321 19177 1 15 . 1 1 42 42 SER H H 42 10.519 10.519 8.798 1.721 18321 19178 1 15 . 1 1 43 43 THR HA H 43 4.097 4.097 4.199 -0.102 18321 19179 1 15 . 1 1 43 43 THR CA C 43 64.722 64.722 64.733 -0.010 18321 19180 1 15 . 1 1 43 43 THR CB C 43 69.439 69.439 69.562 -0.123 18321 19181 1 15 . 1 1 44 44 CYS HA H 44 5.100 5.100 4.833 0.267 18321 19182 1 15 . 1 1 44 44 CYS CA C 44 51.779 51.779 55.463 -3.684 18321 19183 1 15 . 1 1 44 44 CYS CB C 44 41.314 41.314 31.251 10.063 18321 19184 1 15 . 1 1 45 45 PRO HA H 45 4.278 4.278 4.369 -0.091 18321 19185 1 15 . 1 1 45 45 PRO C C 45 178.127 178.127 176.292 1.835 18321 19186 1 15 . 1 1 45 45 PRO CA C 45 64.151 64.151 64.072 0.079 18321 19187 1 15 . 1 1 45 45 PRO CB C 45 31.596 31.596 29.851 1.745 18321 19188 1 15 . 1 1 46 46 GLY N N 46 114.947 114.947 110.991 3.956 18321 19189 1 15 . 1 1 46 46 GLY C C 46 174.701 174.701 173.299 1.402 18321 19190 1 15 . 1 1 46 46 GLY CA C 46 45.225 45.225 45.250 -0.025 18321 19191 1 15 . 1 1 46 46 GLY H H 46 8.812 8.812 8.431 0.381 18321 19192 1 15 . 1 1 47 47 ASP N N 47 120.862 120.862 122.251 -1.389 18321 19193 1 15 . 1 1 47 47 ASP HA H 47 5.235 5.235 4.735 0.500 18321 19194 1 15 . 1 1 47 47 ASP C C 47 176.480 176.480 175.051 1.429 18321 19195 1 15 . 1 1 47 47 ASP CA C 47 53.591 53.591 54.549 -0.958 18321 19196 1 15 . 1 1 47 47 ASP CB C 47 41.707 41.707 41.748 -0.041 18321 19197 1 15 . 1 1 47 47 ASP H H 47 7.997 7.997 7.578 0.419 18321 19198 1 15 . 1 1 48 48 TYR N N 48 118.473 118.473 117.475 0.998 18321 19199 1 15 . 1 1 48 48 TYR HA H 48 5.431 5.431 5.476 -0.045 18321 19200 1 15 . 1 1 48 48 TYR C C 48 173.783 173.783 175.602 -1.819 18321 19201 1 15 . 1 1 48 48 TYR CA C 48 56.891 56.891 56.242 0.648 18321 19202 1 15 . 1 1 48 48 TYR CB C 48 43.274 43.274 42.764 0.510 18321 19203 1 15 . 1 1 48 48 TYR H H 48 8.892 8.892 9.209 -0.317 18321 19204 1 15 . 1 1 49 49 VAL N N 49 119.105 119.105 118.649 0.456 18321 19205 1 15 . 1 1 49 49 VAL HA H 49 4.800 4.800 4.571 0.229 18321 19206 1 15 . 1 1 49 49 VAL C C 49 174.397 174.397 174.749 -0.352 18321 19207 1 15 . 1 1 49 49 VAL CA C 49 61.439 61.439 62.370 -0.931 18321 19208 1 15 . 1 1 49 49 VAL CB C 49 35.388 35.388 34.710 0.678 18321 19209 1 15 . 1 1 49 49 VAL H H 49 9.661 9.661 8.627 1.034 18321 19210 1 15 . 1 1 50 50 LEU N N 50 129.599 129.599 131.104 -1.505 18321 19211 1 15 . 1 1 50 50 LEU HA H 50 5.033 5.033 5.230 -0.197 18321 19212 1 15 . 1 1 50 50 LEU C C 50 175.001 175.001 175.466 -0.465 18321 19213 1 15 . 1 1 50 50 LEU CA C 50 53.352 53.352 53.736 -0.384 18321 19214 1 15 . 1 1 50 50 LEU CB C 50 44.062 44.062 42.503 1.559 18321 19215 1 15 . 1 1 50 50 LEU H H 50 9.405 9.405 9.328 0.077 18321 19216 1 15 . 1 1 51 51 SER N N 51 126.895 126.895 124.429 2.466 18321 19217 1 15 . 1 1 51 51 SER HA H 51 5.731 5.731 5.019 0.712 18321 19218 1 15 . 1 1 51 51 SER C C 51 173.094 173.094 173.604 -0.510 18321 19219 1 15 . 1 1 51 51 SER CA C 51 58.834 58.834 57.633 1.201 18321 19220 1 15 . 1 1 51 51 SER CB C 51 64.977 64.977 63.841 1.136 18321 19221 1 15 . 1 1 51 51 SER H H 51 9.094 9.094 9.355 -0.261 18321 19222 1 15 . 1 1 52 52 VAL N N 52 121.777 121.777 126.068 -4.291 18321 19223 1 15 . 1 1 52 52 VAL HA H 52 5.066 5.066 4.648 0.418 18321 19224 1 15 . 1 1 52 52 VAL C C 52 174.573 174.573 174.285 0.288 18321 19225 1 15 . 1 1 52 52 VAL CA C 52 59.535 59.535 60.638 -1.103 18321 19226 1 15 . 1 1 52 52 VAL CB C 52 36.834 36.834 35.298 1.536 18321 19227 1 15 . 1 1 52 52 VAL H H 52 8.816 8.816 8.926 -0.110 18321 19228 1 15 . 1 1 53 53 SER N N 53 120.489 120.489 121.717 -1.228 18321 19229 1 15 . 1 1 53 53 SER HA H 53 4.811 4.811 4.574 0.237 18321 19230 1 15 . 1 1 53 53 SER C C 53 174.065 174.065 172.834 1.231 18321 19231 1 15 . 1 1 53 53 SER CA C 53 57.496 57.496 57.868 -0.372 18321 19232 1 15 . 1 1 53 53 SER CB C 53 62.623 62.623 63.164 -0.541 18321 19233 1 15 . 1 1 53 53 SER H H 53 8.780 8.780 9.086 -0.306 18321 19234 1 15 . 1 1 54 54 GLU N N 54 132.020 132.020 128.077 3.943 18321 19235 1 15 . 1 1 54 54 GLU HA H 54 4.250 4.250 4.279 -0.029 18321 19236 1 15 . 1 1 54 54 GLU C C 54 175.387 175.387 174.676 0.711 18321 19237 1 15 . 1 1 54 54 GLU CA C 54 56.999 56.999 55.716 1.283 18321 19238 1 15 . 1 1 54 54 GLU CB C 54 32.556 32.556 33.634 -1.078 18321 19239 1 15 . 1 1 54 54 GLU H H 54 8.472 8.472 7.757 0.715 18321 19240 1 15 . 1 1 55 55 ASN N N 55 126.517 126.517 119.071 7.446 18321 19241 1 15 . 1 1 55 55 ASN HA H 55 4.220 4.220 3.982 0.238 18321 19242 1 15 . 1 1 55 55 ASN C C 55 174.546 174.546 174.784 -0.238 18321 19243 1 15 . 1 1 55 55 ASN CA C 55 54.770 54.770 53.863 0.907 18321 19244 1 15 . 1 1 55 55 ASN CB C 55 37.314 37.314 37.364 -0.050 18321 19245 1 15 . 1 1 55 55 ASN H H 55 8.853 8.853 7.210 1.643 18321 19246 1 15 . 1 1 56 56 SER N N 56 112.009 112.009 110.327 1.682 18321 19247 1 15 . 1 1 56 56 SER HA H 56 4.334 4.334 3.985 0.349 18321 19248 1 15 . 1 1 56 56 SER C C 56 173.354 173.354 172.406 0.948 18321 19249 1 15 . 1 1 56 56 SER CA C 56 59.966 59.966 59.682 0.284 18321 19250 1 15 . 1 1 56 56 SER CB C 56 62.242 62.242 62.712 -0.470 18321 19251 1 15 . 1 1 56 56 SER H H 56 10.418 10.418 8.032 2.386 18321 19252 1 15 . 1 1 57 57 ARG N N 57 121.764 121.764 116.341 5.423 18321 19253 1 15 . 1 1 57 57 ARG HA H 57 5.167 5.167 4.385 0.782 18321 19254 1 15 . 1 1 57 57 ARG C C 57 174.983 174.983 174.242 0.741 18321 19255 1 15 . 1 1 57 57 ARG CA C 57 54.550 54.550 55.611 -1.061 18321 19256 1 15 . 1 1 57 57 ARG CB C 57 31.886 31.886 30.555 1.331 18321 19257 1 15 . 1 1 57 57 ARG H H 57 8.097 8.097 7.457 0.640 18321 19258 1 15 . 1 1 58 58 VAL N N 58 121.866 121.866 123.887 -2.021 18321 19259 1 15 . 1 1 58 58 VAL HA H 58 4.768 4.768 4.190 0.578 18321 19260 1 15 . 1 1 58 58 VAL C C 58 175.388 175.388 175.663 -0.275 18321 19261 1 15 . 1 1 58 58 VAL CA C 58 61.818 61.818 62.489 -0.671 18321 19262 1 15 . 1 1 58 58 VAL CB C 58 34.135 34.135 31.647 2.488 18321 19263 1 15 . 1 1 58 58 VAL H H 58 8.081 8.081 8.211 -0.130 18321 19264 1 15 . 1 1 59 59 SER N N 59 124.445 124.445 124.369 0.076 18321 19265 1 15 . 1 1 59 59 SER HA H 59 4.462 4.462 4.185 0.277 18321 19266 1 15 . 1 1 59 59 SER C C 59 172.185 172.185 173.189 -1.004 18321 19267 1 15 . 1 1 59 59 SER CA C 59 56.629 56.629 58.309 -1.680 18321 19268 1 15 . 1 1 59 59 SER CB C 59 66.218 66.218 63.317 2.901 18321 19269 1 15 . 1 1 59 59 SER H H 59 9.082 9.082 8.375 0.707 18321 19270 1 15 . 1 1 60 60 HIS N N 60 121.224 121.224 125.625 -4.401 18321 19271 1 15 . 1 1 60 60 HIS HA H 60 4.885 4.885 4.715 0.170 18321 19272 1 15 . 1 1 60 60 HIS C C 60 174.674 174.674 174.374 0.300 18321 19273 1 15 . 1 1 60 60 HIS CA C 60 54.900 54.900 55.492 -0.592 18321 19274 1 15 . 1 1 60 60 HIS CB C 60 32.331 32.331 30.003 2.328 18321 19275 1 15 . 1 1 60 60 HIS H H 60 8.331 8.331 8.608 -0.277 18321 19276 1 15 . 1 1 61 61 TYR N N 61 124.780 124.780 125.536 -0.756 18321 19277 1 15 . 1 1 61 61 TYR HA H 61 4.655 4.655 4.724 -0.069 18321 19278 1 15 . 1 1 61 61 TYR CA C 61 57.409 57.409 56.819 0.590 18321 19279 1 15 . 1 1 61 61 TYR CB C 61 39.785 39.785 38.411 1.374 18321 19280 1 15 . 1 1 61 61 TYR H H 61 9.273 9.273 9.250 0.023 18321 19281 1 15 . 1 1 62 62 ILE HA H 62 4.298 4.298 4.191 0.107 18321 19282 1 15 . 1 1 62 62 ILE C C 62 174.817 174.817 175.547 -0.730 18321 19283 1 15 . 1 1 62 62 ILE CA C 62 61.908 61.908 60.221 1.687 18321 19284 1 15 . 1 1 62 62 ILE CB C 62 38.321 38.321 37.906 0.415 18321 19285 1 15 . 1 1 63 63 ILE N N 63 128.552 128.552 128.967 -0.415 18321 19286 1 15 . 1 1 63 63 ILE HA H 63 4.788 4.788 4.833 -0.045 18321 19287 1 15 . 1 1 63 63 ILE C C 63 175.982 175.982 174.876 1.106 18321 19288 1 15 . 1 1 63 63 ILE CA C 63 59.629 59.629 60.108 -0.479 18321 19289 1 15 . 1 1 63 63 ILE CB C 63 39.747 39.747 39.625 0.122 18321 19290 1 15 . 1 1 63 63 ILE H H 63 9.155 9.155 9.016 0.139 18321 19291 1 15 . 1 1 64 64 ASN N N 64 123.240 123.240 126.975 -3.735 18321 19292 1 15 . 1 1 64 64 ASN HA H 64 4.857 4.857 5.254 -0.397 18321 19293 1 15 . 1 1 64 64 ASN C C 64 175.324 175.324 174.003 1.321 18321 19294 1 15 . 1 1 64 64 ASN CA C 64 53.736 53.736 53.269 0.467 18321 19295 1 15 . 1 1 64 64 ASN CB C 64 41.531 41.531 40.110 1.421 18321 19296 1 15 . 1 1 64 64 ASN H H 64 9.379 9.379 8.873 0.506 18321 19297 1 15 . 1 1 65 65 SER N N 65 121.157 121.157 117.879 3.278 18321 19298 1 15 . 1 1 65 65 SER HA H 65 4.548 4.548 4.625 -0.077 18321 19299 1 15 . 1 1 65 65 SER C C 65 174.328 174.328 174.517 -0.189 18321 19300 1 15 . 1 1 65 65 SER CA C 65 58.306 58.306 58.503 -0.197 18321 19301 1 15 . 1 1 65 65 SER CB C 65 62.878 62.878 63.232 -0.354 18321 19302 1 15 . 1 1 65 65 SER H H 65 9.195 9.195 9.203 -0.008 18321 19303 1 15 . 1 1 66 66 LEU N N 66 127.417 127.417 129.476 -2.059 18321 19304 1 15 . 1 1 66 66 LEU HA H 66 4.605 4.605 4.507 0.098 18321 19305 1 15 . 1 1 66 66 LEU CA C 66 52.888 52.888 52.880 0.008 18321 19306 1 15 . 1 1 66 66 LEU CB C 66 41.799 41.799 41.597 0.202 18321 19307 1 15 . 1 1 66 66 LEU H H 66 8.143 8.143 8.524 -0.381 18321 19308 1 15 . 1 1 68 68 ASN HA H 68 4.386 4.386 4.645 -0.259 18321 19309 1 15 . 1 1 68 68 ASN C C 68 174.487 174.487 175.036 -0.549 18321 19310 1 15 . 1 1 68 68 ASN CA C 68 53.365 53.365 53.191 0.174 18321 19311 1 15 . 1 1 68 68 ASN CB C 68 36.778 36.778 37.546 -0.768 18321 19312 1 15 . 1 1 69 69 ARG N N 69 111.329 111.329 113.873 -2.544 18321 19313 1 15 . 1 1 69 69 ARG HA H 69 3.876 3.876 3.774 0.102 18321 19314 1 15 . 1 1 69 69 ARG CA C 69 57.393 57.393 57.343 0.050 18321 19315 1 15 . 1 1 69 69 ARG CB C 69 26.665 26.665 26.847 -0.182 18321 19316 1 15 . 1 1 69 69 ARG H H 69 8.191 8.191 8.042 0.149 18321 19317 1 15 . 1 1 70 70 ARG N N 70 116.120 116.120 115.273 0.847 18321 19318 1 15 . 1 1 70 70 ARG HA H 70 4.556 4.556 4.744 -0.188 18321 19319 1 15 . 1 1 70 70 ARG C C 70 174.882 174.882 174.209 0.673 18321 19320 1 15 . 1 1 70 70 ARG CA C 70 55.509 55.509 53.879 1.630 18321 19321 1 15 . 1 1 70 70 ARG CB C 70 31.771 31.771 33.500 -1.729 18321 19322 1 15 . 1 1 70 70 ARG H H 70 6.667 6.667 7.161 -0.494 18321 19323 1 15 . 1 1 71 71 PHE N N 71 116.313 116.313 116.153 0.160 18321 19324 1 15 . 1 1 71 71 PHE HA H 71 5.540 5.540 5.699 -0.159 18321 19325 1 15 . 1 1 71 71 PHE C C 71 174.391 174.391 174.727 -0.336 18321 19326 1 15 . 1 1 71 71 PHE CA C 71 57.528 57.528 56.350 1.178 18321 19327 1 15 . 1 1 71 71 PHE CB C 71 44.115 44.115 43.522 0.593 18321 19328 1 15 . 1 1 71 71 PHE H H 71 8.700 8.700 8.215 0.485 18321 19329 1 15 . 1 1 72 72 LYS N N 72 122.770 122.770 123.998 -1.228 18321 19330 1 15 . 1 1 72 72 LYS HA H 72 5.483 5.483 5.002 0.481 18321 19331 1 15 . 1 1 72 72 LYS C C 72 173.923 173.923 174.906 -0.983 18321 19332 1 15 . 1 1 72 72 LYS CA C 72 54.855 54.855 55.208 -0.353 18321 19333 1 15 . 1 1 72 72 LYS CB C 72 37.710 37.710 36.047 1.663 18321 19334 1 15 . 1 1 72 72 LYS H H 72 9.138 9.138 8.542 0.596 18321 19335 1 15 . 1 1 73 73 ILE N N 73 124.576 124.576 129.452 -4.876 18321 19336 1 15 . 1 1 73 73 ILE HA H 73 4.955 4.955 5.351 -0.396 18321 19337 1 15 . 1 1 73 73 ILE C C 73 175.728 175.728 175.899 -0.171 18321 19338 1 15 . 1 1 73 73 ILE CA C 73 58.935 58.935 59.513 -0.578 18321 19339 1 15 . 1 1 73 73 ILE CB C 73 40.965 40.965 39.086 1.879 18321 19340 1 15 . 1 1 73 73 ILE H H 73 8.826 8.826 9.058 -0.232 18321 19341 1 15 . 1 1 74 74 GLY N N 74 118.718 118.718 119.062 -0.344 18321 19342 1 15 . 1 1 74 74 GLY C C 74 174.436 174.436 174.825 -0.389 18321 19343 1 15 . 1 1 74 74 GLY CA C 74 47.401 47.401 45.699 1.702 18321 19344 1 15 . 1 1 74 74 GLY H H 74 9.317 9.317 8.745 0.572 18321 19345 1 15 . 1 1 75 75 ASP N N 75 125.691 125.691 117.843 7.848 18321 19346 1 15 . 1 1 75 75 ASP HA H 75 4.713 4.713 4.180 0.533 18321 19347 1 15 . 1 1 75 75 ASP C C 75 175.841 175.841 175.562 0.279 18321 19348 1 15 . 1 1 75 75 ASP CA C 75 53.815 53.815 56.646 -2.831 18321 19349 1 15 . 1 1 75 75 ASP CB C 75 41.288 41.288 39.952 1.336 18321 19350 1 15 . 1 1 75 75 ASP H H 75 8.665 8.665 8.880 -0.215 18321 19351 1 15 . 1 1 76 76 GLN N N 76 120.368 120.368 120.893 -0.525 18321 19352 1 15 . 1 1 76 76 GLN C C 76 173.630 173.630 174.955 -1.325 18321 19353 1 15 . 1 1 76 76 GLN CA C 76 54.254 54.254 56.169 -1.915 18321 19354 1 15 . 1 1 76 76 GLN CB C 76 31.248 31.248 29.365 1.883 18321 19355 1 15 . 1 1 76 76 GLN H H 76 8.289 8.289 7.897 0.392 18321 19356 1 15 . 1 1 77 77 GLU N N 77 120.435 120.435 121.551 -1.116 18321 19357 1 15 . 1 1 77 77 GLU C C 77 175.484 175.484 175.611 -0.127 18321 19358 1 15 . 1 1 77 77 GLU CA C 77 54.203 54.203 55.568 -1.365 18321 19359 1 15 . 1 1 77 77 GLU CB C 77 33.141 33.141 32.074 1.067 18321 19360 1 15 . 1 1 77 77 GLU H H 77 7.732 7.732 8.235 -0.503 18321 19361 1 15 . 1 1 78 78 PHE N N 78 117.911 117.911 121.005 -3.094 18321 19362 1 15 . 1 1 78 78 PHE HA H 78 4.659 4.659 4.739 -0.080 18321 19363 1 15 . 1 1 78 78 PHE C C 78 175.673 175.673 175.227 0.446 18321 19364 1 15 . 1 1 78 78 PHE CA C 78 57.160 57.160 57.070 0.090 18321 19365 1 15 . 1 1 78 78 PHE CB C 78 45.405 45.405 41.172 4.233 18321 19366 1 15 . 1 1 78 78 PHE H H 78 9.235 9.235 8.625 0.610 18321 19367 1 15 . 1 1 79 79 ASP N N 79 119.296 119.296 119.396 -0.100 18321 19368 1 15 . 1 1 79 79 ASP HA H 79 4.462 4.462 4.603 -0.141 18321 19369 1 15 . 1 1 79 79 ASP C C 79 174.482 174.482 176.248 -1.766 18321 19370 1 15 . 1 1 79 79 ASP CA C 79 56.629 56.629 57.176 -0.547 18321 19371 1 15 . 1 1 79 79 ASP CB C 79 41.697 41.697 41.134 0.563 18321 19372 1 15 . 1 1 79 79 ASP H H 79 9.187 9.187 8.785 0.402 18321 19373 1 15 . 1 1 80 80 HIS N N 80 107.631 107.631 112.034 -4.403 18321 19374 1 15 . 1 1 80 80 HIS HA H 80 5.022 5.022 5.202 -0.180 18321 19375 1 15 . 1 1 80 80 HIS C C 80 174.626 174.626 175.458 -0.832 18321 19376 1 15 . 1 1 80 80 HIS CA C 80 54.223 54.223 54.920 -0.697 18321 19377 1 15 . 1 1 80 80 HIS CB C 80 32.205 32.205 31.549 0.656 18321 19378 1 15 . 1 1 80 80 HIS H H 80 7.200 7.200 7.344 -0.144 18321 19379 1 15 . 1 1 81 81 LEU N N 81 120.710 120.710 121.077 -0.367 18321 19380 1 15 . 1 1 81 81 LEU HA H 81 3.804 3.804 4.096 -0.292 18321 19381 1 15 . 1 1 81 81 LEU CA C 81 58.709 58.709 59.474 -0.764 18321 19382 1 15 . 1 1 81 81 LEU CB C 81 39.646 39.646 40.229 -0.583 18321 19383 1 15 . 1 1 81 81 LEU H H 81 8.886 8.886 9.175 -0.289 18321 19384 1 15 . 1 1 82 82 PRO HA H 82 4.020 4.020 4.313 -0.293 18321 19385 1 15 . 1 1 82 82 PRO C C 82 175.619 175.619 176.889 -1.270 18321 19386 1 15 . 1 1 82 82 PRO CA C 82 67.025 67.025 64.774 2.251 18321 19387 1 15 . 1 1 82 82 PRO CB C 82 30.962 30.962 30.846 0.116 18321 19388 1 15 . 1 1 83 83 ALA N N 83 124.281 124.281 120.079 4.202 18321 19389 1 15 . 1 1 83 83 ALA HA H 83 4.019 4.019 4.013 0.006 18321 19390 1 15 . 1 1 83 83 ALA C C 83 179.709 179.709 178.622 1.087 18321 19391 1 15 . 1 1 83 83 ALA CA C 83 54.985 54.985 54.271 0.714 18321 19392 1 15 . 1 1 83 83 ALA CB C 83 18.425 18.425 18.657 -0.233 18321 19393 1 15 . 1 1 83 83 ALA H H 83 8.527 8.527 7.494 1.033 18321 19394 1 15 . 1 1 84 84 LEU N N 84 122.960 122.960 117.269 5.691 18321 19395 1 15 . 1 1 84 84 LEU HA H 84 1.917 1.917 3.104 -1.187 18321 19396 1 15 . 1 1 84 84 LEU C C 84 177.652 177.652 178.257 -0.605 18321 19397 1 15 . 1 1 84 84 LEU CA C 84 58.261 58.261 57.330 0.931 18321 19398 1 15 . 1 1 84 84 LEU CB C 84 42.544 42.544 41.101 1.443 18321 19399 1 15 . 1 1 84 84 LEU H H 84 6.982 6.982 7.246 -0.264 18321 19400 1 15 . 1 1 85 85 LEU N N 85 117.940 117.940 118.555 -0.615 18321 19401 1 15 . 1 1 85 85 LEU HA H 85 3.463 3.463 3.818 -0.355 18321 19402 1 15 . 1 1 85 85 LEU C C 85 178.809 178.809 178.262 0.547 18321 19403 1 15 . 1 1 85 85 LEU CA C 85 57.522 57.522 57.211 0.311 18321 19404 1 15 . 1 1 85 85 LEU CB C 85 41.242 41.242 41.213 0.029 18321 19405 1 15 . 1 1 85 85 LEU H H 85 7.773 7.773 7.530 0.243 18321 19406 1 15 . 1 1 86 86 GLU N N 86 115.762 115.762 117.637 -1.875 18321 19407 1 15 . 1 1 86 86 GLU HA H 86 3.540 3.540 3.996 -0.456 18321 19408 1 15 . 1 1 86 86 GLU C C 86 180.228 180.228 178.312 1.916 18321 19409 1 15 . 1 1 86 86 GLU CA C 86 58.943 58.943 58.336 0.607 18321 19410 1 15 . 1 1 86 86 GLU CB C 86 29.561 29.561 29.510 0.051 18321 19411 1 15 . 1 1 86 86 GLU H H 86 8.300 8.300 7.554 0.746 18321 19412 1 15 . 1 1 87 87 PHE N N 87 121.135 121.135 120.488 0.647 18321 19413 1 15 . 1 1 87 87 PHE HA H 87 4.122 4.122 4.182 -0.060 18321 19414 1 15 . 1 1 87 87 PHE C C 87 179.497 179.497 176.906 2.591 18321 19415 1 15 . 1 1 87 87 PHE CA C 87 62.090 62.090 60.238 1.852 18321 19416 1 15 . 1 1 87 87 PHE CB C 87 40.103 40.103 39.401 0.702 18321 19417 1 15 . 1 1 87 87 PHE H H 87 7.717 7.717 7.429 0.288 18321 19418 1 15 . 1 1 88 88 TYR N N 88 116.579 116.579 117.710 -1.131 18321 19419 1 15 . 1 1 88 88 TYR HA H 88 4.933 4.933 4.141 0.792 18321 19420 1 15 . 1 1 88 88 TYR C C 88 174.799 174.799 177.124 -2.325 18321 19421 1 15 . 1 1 88 88 TYR CA C 88 61.333 61.333 58.937 2.396 18321 19422 1 15 . 1 1 88 88 TYR CB C 88 36.539 36.539 36.835 -0.296 18321 19423 1 15 . 1 1 88 88 TYR H H 88 7.478 7.478 8.007 -0.529 18321 19424 1 15 . 1 1 89 89 LYS N N 89 117.737 117.737 119.005 -1.268 18321 19425 1 15 . 1 1 89 89 LYS HA H 89 4.466 4.466 3.985 0.481 18321 19426 1 15 . 1 1 89 89 LYS C C 89 178.417 178.417 176.954 1.463 18321 19427 1 15 . 1 1 89 89 LYS CA C 89 59.486 59.486 58.822 0.664 18321 19428 1 15 . 1 1 89 89 LYS CB C 89 34.523 34.523 32.661 1.862 18321 19429 1 15 . 1 1 89 89 LYS H H 89 7.505 7.505 7.429 0.076 18321 19430 1 15 . 1 1 90 90 ILE N N 90 110.972 110.972 110.497 0.475 18321 19431 1 15 . 1 1 90 90 ILE HA H 90 4.181 4.181 4.265 -0.084 18321 19432 1 15 . 1 1 90 90 ILE C C 90 174.571 174.571 175.100 -0.529 18321 19433 1 15 . 1 1 90 90 ILE CA C 90 60.516 60.516 60.041 0.475 18321 19434 1 15 . 1 1 90 90 ILE CB C 90 39.979 39.979 37.441 2.538 18321 19435 1 15 . 1 1 90 90 ILE H H 90 6.710 6.710 7.327 -0.617 18321 19436 1 15 . 1 1 91 91 HIS N N 91 119.479 119.479 120.277 -0.798 18321 19437 1 15 . 1 1 91 91 HIS HA H 91 4.357 4.357 4.482 -0.125 18321 19438 1 15 . 1 1 91 91 HIS C C 91 172.751 172.751 174.438 -1.687 18321 19439 1 15 . 1 1 91 91 HIS CA C 91 55.066 55.066 55.498 -0.432 18321 19440 1 15 . 1 1 91 91 HIS CB C 91 29.756 29.756 32.837 -3.080 18321 19441 1 15 . 1 1 91 91 HIS H H 91 7.460 7.460 7.049 0.411 18321 19442 1 15 . 1 1 92 92 TYR N N 92 117.642 117.642 115.158 2.484 18321 19443 1 15 . 1 1 92 92 TYR HA H 92 4.131 4.131 4.393 -0.262 18321 19444 1 15 . 1 1 92 92 TYR C C 92 177.348 177.348 176.673 0.675 18321 19445 1 15 . 1 1 92 92 TYR CA C 92 58.627 58.627 58.289 0.338 18321 19446 1 15 . 1 1 92 92 TYR CB C 92 39.481 39.481 35.698 3.783 18321 19447 1 15 . 1 1 92 92 TYR H H 92 8.067 8.067 7.444 0.623 18321 19448 1 15 . 1 1 93 93 LEU N N 93 123.560 123.560 121.406 2.154 18321 19449 1 15 . 1 1 93 93 LEU HA H 93 4.104 4.104 4.333 -0.229 18321 19450 1 15 . 1 1 93 93 LEU C C 93 175.610 175.610 177.188 -1.578 18321 19451 1 15 . 1 1 93 93 LEU CA C 93 56.381 56.381 56.830 -0.449 18321 19452 1 15 . 1 1 93 93 LEU CB C 93 38.896 38.896 42.284 -3.388 18321 19453 1 15 . 1 1 93 93 LEU H H 93 7.907 7.907 8.127 -0.220 18321 19454 1 15 . 1 1 94 94 ASP N N 94 118.194 118.194 115.011 3.183 18321 19455 1 15 . 1 1 94 94 ASP HA H 94 4.940 4.940 4.839 0.101 18321 19456 1 15 . 1 1 94 94 ASP C C 94 176.123 176.123 175.702 0.421 18321 19457 1 15 . 1 1 94 94 ASP CA C 94 56.235 56.235 53.866 2.369 18321 19458 1 15 . 1 1 94 94 ASP CB C 94 42.078 42.078 40.106 1.972 18321 19459 1 15 . 1 1 94 94 ASP H H 94 8.640 8.640 8.067 0.573 18321 19460 1 15 . 1 1 95 95 THR N N 95 105.073 105.073 114.182 -9.109 18321 19461 1 15 . 1 1 95 95 THR HA H 95 4.318 4.318 3.838 0.480 18321 19462 1 15 . 1 1 95 95 THR C C 95 174.685 174.685 173.417 1.268 18321 19463 1 15 . 1 1 95 95 THR CA C 95 60.756 60.756 64.806 -4.050 18321 19464 1 15 . 1 1 95 95 THR CB C 95 71.058 71.058 68.606 2.451 18321 19465 1 15 . 1 1 95 95 THR H H 95 8.576 8.576 8.576 -0.000 18321 19466 1 15 . 1 1 96 96 THR N N 96 116.817 116.817 116.593 0.224 18321 19467 1 15 . 1 1 96 96 THR HA H 96 5.129 5.129 4.881 0.248 18321 19468 1 15 . 1 1 96 96 THR C C 96 172.464 172.464 173.147 -0.683 18321 19469 1 15 . 1 1 96 96 THR CA C 96 60.762 60.762 61.483 -0.721 18321 19470 1 15 . 1 1 96 96 THR CB C 96 71.425 71.425 71.989 -0.564 18321 19471 1 15 . 1 1 96 96 THR H H 96 8.205 8.205 7.902 0.303 18321 19472 1 15 . 1 1 97 97 THR N N 97 114.324 114.324 115.181 -0.857 18321 19473 1 15 . 1 1 97 97 THR HA H 97 5.128 5.128 4.430 0.698 18321 19474 1 15 . 1 1 97 97 THR C C 97 175.480 175.480 174.775 0.705 18321 19475 1 15 . 1 1 97 97 THR CA C 97 60.233 60.233 60.052 0.181 18321 19476 1 15 . 1 1 97 97 THR CB C 97 70.415 70.415 69.898 0.517 18321 19477 1 15 . 1 1 97 97 THR H H 97 7.128 7.128 8.383 -1.255 18321 19478 1 15 . 1 1 98 98 LEU N N 98 116.674 116.674 122.396 -5.722 18321 19479 1 15 . 1 1 98 98 LEU HA H 98 4.075 4.075 3.990 0.085 18321 19480 1 15 . 1 1 98 98 LEU C C 98 177.892 177.892 176.603 1.289 18321 19481 1 15 . 1 1 98 98 LEU CA C 98 59.597 59.597 55.494 4.103 18321 19482 1 15 . 1 1 98 98 LEU CB C 98 41.172 41.172 40.385 0.787 18321 19483 1 15 . 1 1 98 98 LEU H H 98 8.743 8.743 7.851 0.892 18321 19484 1 15 . 1 1 99 99 ILE N N 99 122.988 122.988 122.837 0.151 18321 19485 1 15 . 1 1 99 99 ILE HA H 99 4.415 4.415 4.195 0.220 18321 19486 1 15 . 1 1 99 99 ILE C C 99 175.055 175.055 175.976 -0.921 18321 19487 1 15 . 1 1 99 99 ILE CA C 99 62.183 62.183 61.723 0.460 18321 19488 1 15 . 1 1 99 99 ILE CB C 99 40.252 40.252 38.858 1.393 18321 19489 1 15 . 1 1 99 99 ILE H H 99 8.998 8.998 8.119 0.879 18321 19490 1 15 . 1 1 100 100 GLU N N 100 114.067 114.067 117.036 -2.969 18321 19491 1 15 . 1 1 100 100 GLU CA C 100 52.910 52.910 53.348 -0.438 18321 19492 1 15 . 1 1 100 100 GLU CB C 100 31.155 31.155 32.620 -1.465 18321 19493 1 15 . 1 1 100 100 GLU H H 100 7.332 7.332 7.857 -0.525 18321 19494 1 15 . 1 1 101 101 PRO HA H 101 4.952 4.952 3.548 1.404 18321 19495 1 15 . 1 1 101 101 PRO C C 101 175.976 175.976 175.497 0.479 18321 19496 1 15 . 1 1 101 101 PRO CA C 101 53.312 53.312 62.238 -8.926 18321 19497 1 15 . 1 1 101 101 PRO CB C 101 31.598 31.598 31.846 -0.248 18321 19498 1 15 . 1 1 102 102 ALA N N 102 125.968 125.968 122.964 3.004 18321 19499 1 15 . 1 1 102 102 ALA HA H 102 4.516 4.516 4.323 0.193 18321 19500 1 15 . 1 1 102 102 ALA CA C 102 49.852 49.852 50.234 -0.382 18321 19501 1 15 . 1 1 102 102 ALA CB C 102 17.766 17.766 18.380 -0.614 18321 19502 1 15 . 1 1 102 102 ALA H H 102 8.232 8.232 8.101 0.131 18321 19503 1 15 . 1 1 103 103 PRO HA H 103 4.283 4.283 4.286 -0.003 18321 19504 1 15 . 1 1 103 103 PRO CA C 103 62.435 62.435 63.226 -0.791 18321 19505 1 15 . 1 1 103 103 PRO CB C 103 32.145 32.145 31.762 0.383 18321 19506 1 15 . 1 1 104 104 ARG HA H 104 4.004 4.004 3.859 0.145 18321 19507 1 15 . 1 1 104 104 ARG CA C 104 56.660 56.660 58.462 -1.802 18321 19508 1 15 . 1 1 106 106 PRO C C 106 174.587 174.587 176.104 -1.517 18321 19509 1 15 . 1 1 106 106 PRO CA C 106 57.867 57.867 63.094 -5.227 18321 19510 1 15 . 1 1 106 106 PRO CB C 106 31.942 31.942 30.093 1.849 18321 19511 1 15 . 1 1 107 107 SER N N 107 121.280 121.280 116.725 4.555 18321 19512 1 15 . 1 1 107 107 SER CA C 107 61.772 61.772 59.287 2.485 18321 19513 1 15 . 1 1 107 107 SER CB C 107 63.234 63.234 62.894 0.340 18321 19514 1 15 . 1 1 107 107 SER H H 107 8.132 8.132 8.306 -0.174 18321 19515 1 15 . 1 1 109 109 PRO C C 109 177.129 177.129 176.860 0.269 18321 19516 1 15 . 1 1 109 109 PRO CA C 109 62.638 62.638 63.008 -0.370 18321 19517 1 15 . 1 1 109 109 PRO CB C 109 30.970 30.970 32.347 -1.377 18321 19518 1 15 . 1 1 110 110 MET N N 110 120.772 120.772 121.450 -0.678 18321 19519 1 15 . 1 1 110 110 MET C C 110 176.892 176.892 176.920 -0.028 18321 19520 1 15 . 1 1 110 110 MET CA C 110 55.310 55.310 55.732 -0.422 18321 19521 1 15 . 1 1 110 110 MET CB C 110 32.202 32.202 33.038 -0.835 18321 19522 1 15 . 1 1 110 110 MET H H 110 8.430 8.430 8.532 -0.102 18321 19523 1 15 . 1 1 111 111 GLY N N 111 110.158 110.158 106.585 3.573 18321 19524 1 15 . 1 1 111 111 GLY C C 111 177.430 177.430 173.979 3.451 18321 19525 1 15 . 1 1 111 111 GLY CA C 111 44.951 44.951 44.586 0.366 18321 19526 1 15 . 1 1 111 111 GLY H H 111 8.384 8.384 7.997 0.387 18321 19527 1 15 . 1 1 112 112 SER N N 112 116.762 116.762 113.971 2.791 18321 19528 1 15 . 1 1 112 112 SER CA C 112 55.948 55.948 59.253 -3.305 18321 19529 1 15 . 1 1 112 112 SER CB C 112 62.745 62.745 62.726 0.019 18321 19530 1 15 . 1 1 112 112 SER H H 112 8.161 8.161 8.403 -0.242 18321 19531 1 15 . 1 1 113 113 VAL C C 113 176.083 176.083 176.616 -0.533 18321 19532 1 15 . 1 1 114 114 SER N N 114 119.151 119.151 116.131 3.020 18321 19533 1 15 . 1 1 114 114 SER C C 114 173.638 173.638 173.043 0.595 18321 19534 1 15 . 1 1 114 114 SER CA C 114 58.005 58.005 59.546 -1.541 18321 19535 1 15 . 1 1 114 114 SER CB C 114 63.169 63.169 62.435 0.734 18321 19536 1 15 . 1 1 114 114 SER H H 114 8.319 8.319 8.396 -0.077 18321 19537 1 15 . 1 1 115 115 ALA N N 115 126.914 126.914 123.034 3.880 18321 19538 1 15 . 1 1 115 115 ALA CA C 115 51.561 51.561 50.634 0.927 18321 19539 1 15 . 1 1 115 115 ALA CB C 115 17.714 17.714 20.367 -2.653 18321 19540 1 15 . 1 1 115 115 ALA H H 115 8.197 8.197 7.978 0.219 18321 19541 1 15 . 1 1 119 119 PRO C C 119 177.065 177.065 177.297 -0.232 18321 19542 1 15 . 1 1 120 120 THR N N 120 113.976 113.976 116.415 -2.439 18321 19543 1 15 . 1 1 120 120 THR C C 120 174.461 174.461 173.809 0.652 18321 19544 1 15 . 1 1 120 120 THR CA C 120 61.215 61.215 62.092 -0.877 18321 19545 1 15 . 1 1 120 120 THR CB C 120 69.508 69.508 68.902 0.606 18321 19546 1 15 . 1 1 120 120 THR H H 120 8.138 8.138 7.944 0.194 18321 19547 1 15 . 1 1 121 121 ALA N N 121 125.859 125.859 129.719 -3.860 18321 19548 1 15 . 1 1 121 121 ALA CA C 121 52.281 52.281 51.684 0.597 18321 19549 1 15 . 1 1 121 121 ALA CB C 121 18.623 18.623 19.413 -0.790 18321 19550 1 15 . 1 1 121 121 ALA H H 121 8.272 8.272 8.595 -0.323 18321 19551 1 15 . 1 1 122 122 GLU C C 122 176.316 176.316 175.637 0.679 18321 19552 1 15 . 1 1 123 123 ASP N N 123 120.448 120.448 120.717 -0.269 18321 19553 1 15 . 1 1 123 123 ASP C C 123 175.906 175.906 175.134 0.772 18321 19554 1 15 . 1 1 123 123 ASP CA C 123 54.167 54.167 53.507 0.660 18321 19555 1 15 . 1 1 123 123 ASP CB C 123 40.695 40.695 40.614 0.081 18321 19556 1 15 . 1 1 123 123 ASP H H 123 8.181 8.181 8.367 -0.186 18321 19557 1 15 . 1 1 124 124 ASN N N 124 118.207 118.207 119.144 -0.937 18321 19558 1 15 . 1 1 124 124 ASN C C 124 174.851 174.851 174.797 0.054 18321 19559 1 15 . 1 1 124 124 ASN CA C 124 52.771 52.771 53.779 -1.008 18321 19560 1 15 . 1 1 124 124 ASN CB C 124 38.304 38.304 39.337 -1.033 18321 19561 1 15 . 1 1 124 124 ASN H H 124 8.307 8.307 7.797 0.510 18321 19562 1 15 . 1 1 125 125 LEU N N 125 121.311 121.311 121.045 0.266 18321 19563 1 15 . 1 1 125 125 LEU C C 125 175.750 175.750 175.663 0.087 18321 19564 1 15 . 1 1 125 125 LEU CA C 125 54.428 54.428 55.397 -0.968 18321 19565 1 15 . 1 1 125 125 LEU CB C 125 41.350 41.350 40.516 0.834 18321 19566 1 15 . 1 1 125 125 LEU H H 125 7.747 7.747 8.426 -0.679 18321 19567 1 15 . 1 1 126 126 GLU N N 126 122.485 122.485 120.275 2.210 18321 19568 1 15 . 1 1 126 126 GLU C C 126 174.008 174.008 174.131 -0.123 18321 19569 1 15 . 1 1 126 126 GLU CA C 126 54.855 54.855 56.155 -1.300 18321 19570 1 15 . 1 1 126 126 GLU CB C 126 30.472 30.472 30.679 -0.207 18321 19571 1 15 . 1 1 126 126 GLU H H 126 8.453 8.453 7.907 0.546 18321 19572 1 15 . 1 1 127 127 TYR N N 127 122.713 122.713 120.891 1.822 18321 19573 1 15 . 1 1 127 127 TYR C C 127 176.859 176.859 174.437 2.422 18321 19574 1 15 . 1 1 127 127 TYR CA C 127 56.528 56.528 57.151 -0.623 18321 19575 1 15 . 1 1 127 127 TYR CB C 127 40.982 40.982 39.645 1.337 18321 19576 1 15 . 1 1 127 127 TYR H H 127 8.469 8.469 8.258 0.211 18321 19577 1 15 . 1 1 128 128 VAL N N 128 112.432 112.432 125.087 -12.655 18321 19578 1 15 . 1 1 128 128 VAL C C 128 173.150 173.150 174.341 -1.191 18321 19579 1 15 . 1 1 128 128 VAL CA C 128 57.940 57.940 60.583 -2.643 18321 19580 1 15 . 1 1 128 128 VAL CB C 128 34.935 34.935 34.251 0.684 18321 19581 1 15 . 1 1 128 128 VAL H H 128 9.078 9.078 9.116 -0.038 18321 19582 1 15 . 1 1 129 129 ARG N N 129 120.373 120.373 126.158 -5.785 18321 19583 1 15 . 1 1 129 129 ARG C C 129 176.539 176.539 175.677 0.862 18321 19584 1 15 . 1 1 129 129 ARG CA C 129 52.534 52.534 53.912 -1.378 18321 19585 1 15 . 1 1 129 129 ARG CB C 129 32.942 32.942 33.062 -0.120 18321 19586 1 15 . 1 1 129 129 ARG H H 129 9.010 9.010 8.114 0.896 18321 19587 1 15 . 1 1 130 130 THR N N 130 116.637 116.637 113.529 3.108 18321 19588 1 15 . 1 1 130 130 THR CA C 130 60.618 60.618 61.048 -0.430 18321 19589 1 15 . 1 1 130 130 THR CB C 130 69.170 69.170 70.398 -1.228 18321 19590 1 15 . 1 1 130 130 THR H H 130 9.045 9.045 8.458 0.587 18321 19591 1 15 . 1 1 131 131 LEU N N 131 122.910 122.910 124.176 -1.266 18321 19592 1 15 . 1 1 131 131 LEU C C 131 175.269 175.269 176.829 -1.560 18321 19593 1 15 . 1 1 131 131 LEU CA C 131 55.122 55.122 55.361 -0.239 18321 19594 1 15 . 1 1 131 131 LEU CB C 131 43.108 43.108 42.698 0.410 18321 19595 1 15 . 1 1 131 131 LEU H H 131 9.224 9.224 8.243 0.981 18321 19596 1 15 . 1 1 132 132 TYR N N 132 112.885 112.885 118.459 -5.574 18321 19597 1 15 . 1 1 132 132 TYR C C 132 173.818 173.818 175.775 -1.957 18321 19598 1 15 . 1 1 132 132 TYR CA C 132 54.230 54.230 59.892 -5.662 18321 19599 1 15 . 1 1 132 132 TYR CB C 132 42.672 42.672 40.139 2.533 18321 19600 1 15 . 1 1 132 132 TYR H H 132 7.284 7.284 7.571 -0.287 18321 19601 1 15 . 1 1 133 133 ASP N N 133 118.003 118.003 118.350 -0.347 18321 19602 1 15 . 1 1 133 133 ASP C C 133 175.779 175.779 174.459 1.320 18321 19603 1 15 . 1 1 133 133 ASP CA C 133 54.351 54.351 55.559 -1.208 18321 19604 1 15 . 1 1 133 133 ASP CB C 133 41.241 41.241 40.640 0.601 18321 19605 1 15 . 1 1 133 133 ASP H H 133 8.399 8.399 8.329 0.070 18321 19606 1 15 . 1 1 134 134 PHE N N 134 121.081 121.081 124.168 -3.087 18321 19607 1 15 . 1 1 134 134 PHE CA C 134 52.552 52.552 55.781 -3.229 18321 19608 1 15 . 1 1 134 134 PHE CB C 134 41.217 41.217 42.321 -1.104 18321 19609 1 15 . 1 1 134 134 PHE H H 134 8.797 8.797 8.120 0.677 18321 19610 1 15 . 1 1 136 136 GLY C C 136 171.616 171.616 174.277 -2.661 18321 19611 1 15 . 1 1 137 137 ASN N N 137 119.394 119.394 117.255 2.139 18321 19612 1 15 . 1 1 137 137 ASN C C 137 174.500 174.500 173.872 0.628 18321 19613 1 15 . 1 1 137 137 ASN CA C 137 44.670 44.670 54.228 -9.558 18321 19614 1 15 . 1 1 137 137 ASN H H 137 9.477 9.477 8.163 1.314 18321 19615 1 15 . 1 1 138 138 ASP N N 138 120.608 120.608 118.545 2.063 18321 19616 1 15 . 1 1 138 138 ASP C C 138 176.987 176.987 174.443 2.544 18321 19617 1 15 . 1 1 138 138 ASP CA C 138 52.992 52.992 52.681 0.311 18321 19618 1 15 . 1 1 138 138 ASP H H 138 8.216 8.216 7.700 0.516 18321 19619 1 15 . 1 1 139 139 ALA N N 139 124.371 124.371 120.832 3.539 18321 19620 1 15 . 1 1 139 139 ALA C C 139 178.472 178.472 176.948 1.524 18321 19621 1 15 . 1 1 139 139 ALA CA C 139 54.513 54.513 52.420 2.093 18321 19622 1 15 . 1 1 139 139 ALA CB C 139 18.045 18.045 20.073 -2.028 18321 19623 1 15 . 1 1 139 139 ALA H H 139 8.565 8.565 8.480 0.085 18321 19624 1 15 . 1 1 140 140 GLU N N 140 115.022 115.022 119.090 -4.068 18321 19625 1 15 . 1 1 140 140 GLU C C 140 177.027 177.027 175.167 1.860 18321 19626 1 15 . 1 1 140 140 GLU CA C 140 56.181 56.181 57.103 -0.923 18321 19627 1 15 . 1 1 140 140 GLU CB C 140 28.619 28.619 31.353 -2.734 18321 19628 1 15 . 1 1 140 140 GLU H H 140 8.616 8.616 8.126 0.490 18321 19629 1 15 . 1 1 141 141 ASP N N 141 121.913 121.913 119.584 2.329 18321 19630 1 15 . 1 1 141 141 ASP C C 141 175.923 175.923 174.910 1.013 18321 19631 1 15 . 1 1 141 141 ASP CA C 141 54.736 54.736 54.282 0.454 18321 19632 1 15 . 1 1 141 141 ASP CB C 141 41.305 41.305 41.849 -0.544 18321 19633 1 15 . 1 1 141 141 ASP H H 141 7.636 7.636 8.256 -0.620 18321 19634 1 15 . 1 1 142 142 LEU N N 142 127.651 127.651 124.563 3.088 18321 19635 1 15 . 1 1 142 142 LEU CA C 142 50.955 50.955 52.112 -1.157 18321 19636 1 15 . 1 1 142 142 LEU CB C 142 42.343 42.343 44.178 -1.835 18321 19637 1 15 . 1 1 142 142 LEU H H 142 9.479 9.479 8.438 1.041 18321 19638 1 15 . 1 1 143 143 PRO C C 143 177.924 177.924 175.699 2.225 18321 19639 1 15 . 1 1 144 144 PHE N N 144 114.483 114.483 120.544 -6.061 18321 19640 1 15 . 1 1 144 144 PHE C C 144 175.055 175.055 174.746 0.309 18321 19641 1 15 . 1 1 144 144 PHE CA C 144 55.543 55.543 54.890 0.653 18321 19642 1 15 . 1 1 144 144 PHE CB C 144 40.581 40.581 40.863 -0.282 18321 19643 1 15 . 1 1 144 144 PHE H H 144 8.637 8.637 7.481 1.156 18321 19644 1 15 . 1 1 145 145 LYS N N 145 121.342 121.342 119.761 1.581 18321 19645 1 15 . 1 1 145 145 LYS C C 145 176.925 176.925 178.245 -1.320 18321 19646 1 15 . 1 1 145 145 LYS CA C 145 53.043 53.043 54.279 -1.236 18321 19647 1 15 . 1 1 145 145 LYS CB C 145 33.804 33.804 35.135 -1.331 18321 19648 1 15 . 1 1 145 145 LYS H H 145 9.418 9.418 8.690 0.728 18321 19649 1 15 . 1 1 146 146 LYS N N 146 123.378 123.378 119.623 3.755 18321 19650 1 15 . 1 1 146 146 LYS CA C 146 57.883 57.883 57.076 0.807 18321 19651 1 15 . 1 1 146 146 LYS CB C 146 32.008 32.008 32.303 -0.295 18321 19652 1 15 . 1 1 146 146 LYS H H 146 9.002 9.002 8.830 0.172 18321 19653 1 15 . 1 1 147 147 GLY C C 147 174.315 174.315 173.255 1.060 18321 19654 1 15 . 1 1 148 148 GLU N N 148 121.392 121.392 120.436 0.956 18321 19655 1 15 . 1 1 148 148 GLU C C 148 174.998 174.998 175.206 -0.208 18321 19656 1 15 . 1 1 148 148 GLU CA C 148 56.867 56.867 54.695 2.172 18321 19657 1 15 . 1 1 148 148 GLU CB C 148 31.649 31.649 32.121 -0.472 18321 19658 1 15 . 1 1 148 148 GLU H H 148 7.937 7.937 7.697 0.240 18321 19659 1 15 . 1 1 149 149 ILE N N 149 120.124 120.124 122.742 -2.618 18321 19660 1 15 . 1 1 149 149 ILE C C 149 176.647 176.647 174.997 1.650 18321 19661 1 15 . 1 1 149 149 ILE CA C 149 58.621 58.621 60.145 -1.524 18321 19662 1 15 . 1 1 149 149 ILE CB C 149 36.952 36.952 37.642 -0.690 18321 19663 1 15 . 1 1 149 149 ILE H H 149 8.346 8.346 8.686 -0.340 18321 19664 1 15 . 1 1 150 150 LEU N N 150 126.950 126.950 125.698 1.252 18321 19665 1 15 . 1 1 150 150 LEU CA C 150 51.967 51.967 52.879 -0.912 18321 19666 1 15 . 1 1 150 150 LEU CB C 150 44.182 44.182 45.483 -1.301 18321 19667 1 15 . 1 1 150 150 LEU H H 150 8.988 8.988 9.076 -0.088 18321 19668 1 15 . 1 1 151 151 VAL C C 151 175.670 175.670 175.697 -0.027 18321 19669 1 15 . 1 1 152 152 ILE N N 152 124.997 124.997 128.609 -3.612 18321 19670 1 15 . 1 1 152 152 ILE CA C 152 58.331 58.331 60.100 -1.769 18321 19671 1 15 . 1 1 152 152 ILE CB C 152 34.093 34.093 34.987 -0.894 18321 19672 1 15 . 1 1 152 152 ILE H H 152 8.673 8.673 8.280 0.393 18321 19673 1 15 . 1 1 153 153 ILE N N 153 124.710 124.710 127.309 -2.599 18321 19674 1 15 . 1 1 153 153 ILE C C 153 176.264 176.264 175.482 0.782 18321 19675 1 15 . 1 1 154 154 GLU N N 154 117.398 117.398 117.970 -0.572 18321 19676 1 15 . 1 1 154 154 GLU C C 154 173.959 173.959 174.044 -0.085 18321 19677 1 15 . 1 1 154 154 GLU CA C 154 55.289 55.289 54.788 0.501 18321 19678 1 15 . 1 1 154 154 GLU CB C 154 32.842 32.842 33.249 -0.407 18321 19679 1 15 . 1 1 154 154 GLU H H 154 7.818 7.818 8.522 -0.704 18321 19680 1 15 . 1 1 155 155 LYS N N 155 121.130 121.130 123.977 -2.847 18321 19681 1 15 . 1 1 155 155 LYS CA C 155 53.022 53.022 52.691 0.331 18321 19682 1 15 . 1 1 155 155 LYS CB C 155 32.663 32.663 33.480 -0.817 18321 19683 1 15 . 1 1 155 155 LYS H H 155 8.654 8.654 9.339 -0.685 18321 19684 1 15 . 1 1 157 157 GLU C C 157 175.190 175.190 175.793 -0.603 18321 19685 1 15 . 1 1 157 157 GLU CA C 157 53.785 53.785 54.687 -0.902 18321 19686 1 15 . 1 1 157 157 GLU CB C 157 32.685 32.685 32.840 -0.155 18321 19687 1 15 . 1 1 158 158 GLU N N 158 117.425 117.425 116.994 0.431 18321 19688 1 15 . 1 1 158 158 GLU C C 158 178.600 178.600 176.325 2.275 18321 19689 1 15 . 1 1 158 158 GLU CA C 158 59.044 59.044 57.419 1.625 18321 19690 1 15 . 1 1 158 158 GLU CB C 158 29.706 29.706 30.086 -0.380 18321 19691 1 15 . 1 1 158 158 GLU H H 158 8.678 8.678 8.829 -0.151 18321 19692 1 15 . 1 1 159 159 GLN N N 159 110.925 110.925 117.829 -6.904 18321 19693 1 15 . 1 1 159 159 GLN C C 159 175.539 175.539 175.235 0.304 18321 19694 1 15 . 1 1 159 159 GLN CA C 159 54.942 54.942 56.713 -1.771 18321 19695 1 15 . 1 1 159 159 GLN CB C 159 28.572 28.572 30.038 -1.466 18321 19696 1 15 . 1 1 159 159 GLN H H 159 8.483 8.483 8.298 0.185 18321 19697 1 15 . 1 1 160 160 TRP N N 160 120.171 120.171 119.302 0.869 18321 19698 1 15 . 1 1 160 160 TRP C C 160 173.444 173.444 174.600 -1.156 18321 19699 1 15 . 1 1 160 160 TRP CA C 160 56.175 56.175 56.483 -0.308 18321 19700 1 15 . 1 1 160 160 TRP CB C 160 31.796 31.796 32.696 -0.899 18321 19701 1 15 . 1 1 160 160 TRP H H 160 6.826 6.826 7.789 -0.963 18321 19702 1 15 . 1 1 161 161 TRP N N 161 120.687 120.687 120.693 -0.006 18321 19703 1 15 . 1 1 161 161 TRP C C 161 174.736 174.736 175.794 -1.058 18321 19704 1 15 . 1 1 161 161 TRP CA C 161 51.889 51.889 55.063 -3.174 18321 19705 1 15 . 1 1 161 161 TRP CB C 161 32.772 32.772 32.150 0.622 18321 19706 1 15 . 1 1 161 161 TRP H H 161 8.462 8.462 9.485 -1.023 18321 19707 1 15 . 1 1 162 162 SER N N 162 115.691 115.691 119.849 -4.158 18321 19708 1 15 . 1 1 162 162 SER C C 162 174.320 174.320 173.322 0.998 18321 19709 1 15 . 1 1 162 162 SER CA C 162 57.011 57.011 58.346 -1.335 18321 19710 1 15 . 1 1 162 162 SER CB C 162 63.948 63.948 63.075 0.873 18321 19711 1 15 . 1 1 162 162 SER H H 162 8.830 8.830 9.162 -0.332 18321 19712 1 15 . 1 1 163 163 ALA N N 163 130.630 130.630 128.187 2.443 18321 19713 1 15 . 1 1 163 163 ALA CA C 163 50.029 50.029 50.023 0.006 18321 19714 1 15 . 1 1 163 163 ALA CB C 163 25.500 25.500 22.184 3.316 18321 19715 1 15 . 1 1 163 163 ALA H H 163 9.585 9.585 9.211 0.374 18321 19716 1 15 . 1 1 164 164 ARG N N 164 117.526 117.526 120.791 -3.265 18321 19717 1 15 . 1 1 164 164 ARG C C 164 176.719 176.719 176.673 0.046 18321 19718 1 15 . 1 1 164 164 ARG CA C 164 52.975 52.975 54.297 -1.322 18321 19719 1 15 . 1 1 164 164 ARG CB C 164 34.260 34.260 30.710 3.550 18321 19720 1 15 . 1 1 164 164 ARG H H 164 9.097 9.097 9.081 0.016 18321 19721 1 15 . 1 1 165 165 ASN N N 165 123.935 123.935 122.854 1.081 18321 19722 1 15 . 1 1 165 165 ASN C C 165 178.484 178.484 176.299 2.185 18321 19723 1 15 . 1 1 165 165 ASN CA C 165 50.332 50.332 54.297 -3.965 18321 19724 1 15 . 1 1 165 165 ASN CB C 165 39.487 39.487 39.560 -0.073 18321 19725 1 15 . 1 1 165 165 ASN H H 165 8.756 8.756 8.847 -0.091 18321 19726 1 15 . 1 1 166 166 LYS N N 166 118.464 118.464 119.242 -0.778 18321 19727 1 15 . 1 1 166 166 LYS C C 166 176.967 176.967 177.792 -0.825 18321 19728 1 15 . 1 1 166 166 LYS CA C 166 58.430 58.430 58.583 -0.153 18321 19729 1 15 . 1 1 166 166 LYS CB C 166 30.918 30.918 32.263 -1.345 18321 19730 1 15 . 1 1 166 166 LYS H H 166 8.915 8.915 9.168 -0.253 18321 19731 1 15 . 1 1 167 167 ASP N N 167 118.138 118.138 116.859 1.279 18321 19732 1 15 . 1 1 167 167 ASP C C 167 176.464 176.464 177.212 -0.748 18321 19733 1 15 . 1 1 167 167 ASP CA C 167 54.212 54.212 55.573 -1.361 18321 19734 1 15 . 1 1 167 167 ASP CB C 167 41.178 41.178 41.215 -0.037 18321 19735 1 15 . 1 1 167 167 ASP H H 167 7.508 7.508 8.337 -0.829 18321 19736 1 15 . 1 1 168 168 GLY N N 168 107.901 107.901 106.448 1.453 18321 19737 1 15 . 1 1 168 168 GLY C C 168 173.613 173.613 173.348 0.265 18321 19738 1 15 . 1 1 168 168 GLY CA C 168 44.783 44.783 44.894 -0.111 18321 19739 1 15 . 1 1 168 168 GLY H H 168 8.173 8.173 8.061 0.112 18321 19740 1 15 . 1 1 169 169 ARG N N 169 124.324 124.324 120.449 3.875 18321 19741 1 15 . 1 1 169 169 ARG CA C 169 56.106 56.106 55.921 0.185 18321 19742 1 15 . 1 1 169 169 ARG CB C 169 29.648 29.648 31.287 -1.639 18321 19743 1 15 . 1 1 169 169 ARG H H 169 7.998 7.998 7.934 0.064 18321 19744 1 15 . 1 1 170 170 VAL C C 170 177.590 177.590 175.171 2.419 18321 19745 1 15 . 1 1 171 171 GLY N N 171 112.582 112.582 113.714 -1.132 18321 19746 1 15 . 1 1 171 171 GLY C C 171 170.991 170.991 172.785 -1.794 18321 19747 1 15 . 1 1 171 171 GLY CA C 171 45.361 45.361 44.852 0.509 18321 19748 1 15 . 1 1 171 171 GLY H H 171 9.013 9.013 8.769 0.244 18321 19749 1 15 . 1 1 172 172 MET N N 172 117.368 117.368 121.785 -4.417 18321 19750 1 15 . 1 1 172 172 MET C C 172 177.921 177.921 176.362 1.559 18321 19751 1 15 . 1 1 172 172 MET CA C 172 53.536 53.536 54.752 -1.216 18321 19752 1 15 . 1 1 172 172 MET CB C 172 30.838 30.838 33.131 -2.293 18321 19753 1 15 . 1 1 172 172 MET H H 172 8.885 8.885 9.226 -0.341 18321 19754 1 15 . 1 1 173 173 ILE N N 173 113.130 113.130 118.326 -5.196 18321 19755 1 15 . 1 1 173 173 ILE CA C 173 56.284 56.284 58.031 -1.747 18321 19756 1 15 . 1 1 173 173 ILE CB C 173 40.870 40.870 40.960 -0.090 18321 19757 1 15 . 1 1 173 173 ILE H H 173 9.704 9.704 9.369 0.335 18321 19758 1 15 . 1 1 174 174 PRO C C 174 176.714 176.714 177.602 -0.888 18321 19759 1 15 . 1 1 174 174 PRO CA C 174 66.290 66.290 61.166 5.123 18321 19760 1 15 . 1 1 174 174 PRO CB C 174 28.993 28.993 30.539 -1.546 18321 19761 1 15 . 1 1 175 175 VAL N N 175 128.066 128.066 124.107 3.959 18321 19762 1 15 . 1 1 175 175 VAL CA C 175 59.356 59.356 67.319 -7.963 18321 19763 1 15 . 1 1 175 175 VAL H H 175 7.327 7.327 8.099 -0.772 18321 19764 1 15 . 1 1 176 176 PRO C C 176 176.351 176.351 177.098 -0.747 18321 19765 1 15 . 1 1 177 177 TYR N N 177 115.756 115.756 116.009 -0.253 18321 19766 1 15 . 1 1 177 177 TYR C C 177 175.011 175.011 175.651 -0.640 18321 19767 1 15 . 1 1 177 177 TYR CA C 177 56.756 56.756 57.684 -0.928 18321 19768 1 15 . 1 1 177 177 TYR CB C 177 37.507 37.507 38.757 -1.250 18321 19769 1 15 . 1 1 177 177 TYR H H 177 7.784 7.784 7.563 0.221 18321 19770 1 15 . 1 1 178 178 VAL N N 178 111.428 111.428 114.010 -2.582 18321 19771 1 15 . 1 1 178 178 VAL C C 178 173.417 173.417 175.829 -2.412 18321 19772 1 15 . 1 1 178 178 VAL CA C 178 58.307 58.307 59.578 -1.271 18321 19773 1 15 . 1 1 178 178 VAL CB C 178 34.602 34.602 33.963 0.639 18321 19774 1 15 . 1 1 178 178 VAL H H 178 7.801 7.801 7.426 0.375 18321 19775 1 15 . 1 1 179 179 GLU N N 179 118.581 118.581 120.242 -1.661 18321 19776 1 15 . 1 1 179 179 GLU C C 179 175.225 175.225 174.860 0.365 18321 19777 1 15 . 1 1 179 179 GLU CA C 179 53.114 53.114 56.217 -3.103 18321 19778 1 15 . 1 1 179 179 GLU CB C 179 32.712 32.712 30.379 2.333 18321 19779 1 15 . 1 1 179 179 GLU H H 179 8.819 8.819 8.460 0.359 18321 19780 1 15 . 1 1 180 180 LYS N N 180 124.167 124.167 119.700 4.467 18321 19781 1 15 . 1 1 180 180 LYS C C 180 176.303 176.303 176.583 -0.280 18321 19782 1 15 . 1 1 180 180 LYS CA C 180 57.318 57.318 55.836 1.482 18321 19783 1 15 . 1 1 180 180 LYS CB C 180 31.675 31.675 32.166 -0.491 18321 19784 1 15 . 1 1 180 180 LYS H H 180 8.775 8.775 7.813 0.962 18321 19785 1 15 . 1 1 181 181 LEU N N 181 125.157 125.157 124.078 1.079 18321 19786 1 15 . 1 1 181 181 LEU C C 181 176.462 176.462 177.933 -1.471 18321 19787 1 15 . 1 1 181 181 LEU CA C 181 54.470 54.470 56.925 -2.455 18321 19788 1 15 . 1 1 181 181 LEU CB C 181 41.625 41.625 42.464 -0.839 18321 19789 1 15 . 1 1 181 181 LEU H H 181 8.084 8.084 8.747 -0.663 18321 19790 1 15 . 1 1 182 182 VAL N N 182 123.167 123.167 115.293 7.874 18321 19791 1 15 . 1 1 182 182 VAL C C 182 175.983 175.983 176.007 -0.024 18321 19792 1 15 . 1 1 182 182 VAL CA C 182 61.613 61.613 62.825 -1.212 18321 19793 1 15 . 1 1 182 182 VAL CB C 182 32.085 32.085 31.326 0.759 18321 19794 1 15 . 1 1 182 182 VAL H H 182 8.345 8.345 8.068 0.277 18321 19795 1 15 . 1 1 183 183 ARG N N 183 125.775 125.775 122.149 3.626 18321 19796 1 15 . 1 1 183 183 ARG CA C 183 57.801 57.801 56.314 1.487 18321 19797 1 15 . 1 1 183 183 ARG CB C 183 30.091 30.091 29.792 0.299 18321 19798 1 15 . 1 1 183 183 ARG H H 183 8.530 8.530 8.074 0.456 18321 19799 1 15 . 1 1 184 184 SER C C 184 173.239 173.239 174.214 -0.975 18321 19800 1 15 . 1 1 185 185 SER N N 185 116.511 116.511 116.882 -0.371 18321 19801 1 15 . 1 1 185 185 SER CA C 185 58.428 58.428 55.252 3.176 18321 19802 1 15 . 1 1 185 185 SER CB C 185 69.737 69.737 64.259 5.478 18321 19803 1 15 . 1 1 185 185 SER H H 185 7.944 7.944 8.487 -0.543 18321 19804 1 15 . 1 1 190 190 HIS C C 190 176.953 176.953 176.554 0.399 18321 19805 1 15 . 1 1 190 190 HIS CA C 190 54.229 54.229 56.977 -2.748 18321 19806 1 15 . 1 1 190 190 HIS CB C 190 35.112 35.112 29.926 5.186 18321 19807 1 15 . 1 1 191 191 GLY N N 191 109.491 109.491 115.264 -5.773 18321 19808 1 15 . 1 1 191 191 GLY C C 191 172.295 172.295 173.774 -1.479 18321 19809 1 15 . 1 1 191 191 GLY CA C 191 45.227 45.227 44.644 0.583 18321 19810 1 15 . 1 1 191 191 GLY H H 191 8.719 8.719 8.470 0.249 18321 19811 1 15 . 1 1 192 192 ASN N N 192 118.700 118.700 124.626 -5.926 18321 19812 1 15 . 1 1 192 192 ASN HA H 192 4.312 4.312 4.598 -0.286 18321 19813 1 15 . 1 1 192 192 ASN C C 192 176.369 176.369 174.518 1.851 18321 19814 1 15 . 1 1 192 192 ASN CA C 192 57.787 57.787 53.375 4.412 18321 19815 1 15 . 1 1 192 192 ASN H H 192 7.508 7.508 8.489 -0.981 18321 19816 1 15 . 1 1 193 193 ARG N N 193 120.743 120.743 124.676 -3.933 18321 19817 1 15 . 1 1 193 193 ARG H H 193 9.032 9.032 8.166 0.866 18321 19818 1 15 . 1 1 197 197 SER HA H 197 4.388 4.388 4.464 -0.076 18321 19819 1 15 . 1 1 197 197 SER C C 197 174.133 174.133 173.891 0.242 18321 19820 1 15 . 1 1 197 197 SER CA C 197 58.128 58.128 58.728 -0.600 18321 19821 1 15 . 1 1 197 197 SER CB C 197 62.966 62.966 63.497 -0.531 18321 19822 1 15 . 1 1 198 198 TYR N N 198 121.435 121.435 122.045 -0.610 18321 19823 1 15 . 1 1 198 198 TYR HA H 198 4.543 4.543 4.697 -0.154 18321 19824 1 15 . 1 1 198 198 TYR C C 198 176.230 176.230 174.885 1.345 18321 19825 1 15 . 1 1 198 198 TYR CA C 198 57.536 57.536 57.444 0.092 18321 19826 1 15 . 1 1 198 198 TYR CB C 198 38.279 38.279 39.072 -0.793 18321 19827 1 15 . 1 1 198 198 TYR H H 198 8.071 8.071 7.621 0.450 18321 19828 1 15 . 1 1 199 199 GLY N N 199 110.039 110.039 114.712 -4.673 18321 19829 1 15 . 1 1 199 199 GLY C C 199 173.475 173.475 172.087 1.388 18321 19830 1 15 . 1 1 199 199 GLY CA C 199 44.805 44.805 43.951 0.854 18321 19831 1 15 . 1 1 199 199 GLY H H 199 8.162 8.162 8.160 0.002 18321 19832 1 15 . 1 1 200 200 ILE N N 200 121.530 121.530 117.244 4.286 18321 19833 1 15 . 1 1 200 200 ILE CA C 200 58.102 58.102 57.589 0.513 18321 19834 1 15 . 1 1 200 200 ILE CB C 200 37.760 37.760 38.798 -1.038 18321 19835 1 15 . 1 1 200 200 ILE H H 200 7.851 7.851 8.040 -0.189 18321 19836 1 15 . 1 1 201 201 PRO C C 201 176.485 176.485 175.739 0.746 18321 19837 1 15 . 1 1 201 201 PRO CA C 201 53.893 53.893 62.756 -8.863 18321 19838 1 15 . 1 1 201 201 PRO CB C 201 29.042 29.042 30.934 -1.892 18321 19839 1 15 . 1 1 202 202 GLU N N 202 122.468 122.468 120.389 2.079 18321 19840 1 15 . 1 1 202 202 GLU CA C 202 62.490 62.490 56.425 6.065 18321 19841 1 15 . 1 1 202 202 GLU CB C 202 31.170 31.170 28.789 2.381 18321 19842 1 15 . 1 1 202 202 GLU H H 202 8.328 8.328 8.076 0.252 18321 19843 1 15 . 1 1 203 203 PRO CA C 203 62.803 62.803 62.848 -0.045 18321 19844 1 15 . 1 1 203 203 PRO CB C 203 31.220 31.220 32.390 -1.170 18321 19845 1 15 . 1 1 204 204 ALA N N 204 123.251 123.251 123.113 0.138 18321 19846 1 15 . 1 1 204 204 ALA HA H 204 4.180 4.180 4.424 -0.244 18321 19847 1 15 . 1 1 204 204 ALA CA C 204 52.124 52.124 51.424 0.700 18321 19848 1 15 . 1 1 204 204 ALA CB C 204 18.892 18.892 19.820 -0.928 18321 19849 1 15 . 1 1 204 204 ALA H H 204 8.308 8.308 8.057 0.251 18321 19850 1 15 . 1 1 205 205 HIS N N 205 117.874 117.874 120.940 -3.066 18321 19851 1 15 . 1 1 205 205 HIS C C 205 173.282 173.282 174.904 -1.622 18321 19852 1 15 . 1 1 205 205 HIS H H 205 8.045 8.045 8.906 -0.861 18321 19853 1 15 . 1 1 206 206 ALA N N 206 125.519 125.519 121.907 3.612 18321 19854 1 15 . 1 1 206 206 ALA HA H 206 4.204 4.204 4.295 -0.091 18321 19855 1 15 . 1 1 206 206 ALA CA C 206 40.196 40.196 51.358 -11.162 18321 19856 1 15 . 1 1 206 206 ALA CB C 206 19.407 19.407 20.272 -0.865 18321 19857 1 15 . 1 1 206 206 ALA H H 206 8.061 8.061 7.857 0.204 18321 19858 1 15 . 1 1 207 207 TYR N N 207 120.381 120.381 120.936 -0.555 18321 19859 1 15 . 1 1 207 207 TYR HA H 207 4.570 4.570 4.413 0.157 18321 19860 1 15 . 1 1 207 207 TYR CA C 207 52.572 52.572 57.868 -5.296 18321 19861 1 15 . 1 1 207 207 TYR CB C 207 41.333 41.333 37.443 3.890 18321 19862 1 15 . 1 1 207 207 TYR H H 207 8.199 8.199 8.514 -0.315 18321 19863 1 15 . 1 1 208 208 ALA HA H 208 4.281 4.281 4.088 0.193 18321 19864 1 15 . 1 1 208 208 ALA C C 208 177.736 177.736 175.914 1.822 18321 19865 1 15 . 1 1 208 208 ALA CA C 208 52.084 52.084 52.217 -0.133 18321 19866 1 15 . 1 1 208 208 ALA CB C 208 18.999 18.999 18.384 0.615 18321 19867 1 15 . 1 1 209 209 GLN N N 209 119.295 119.295 120.326 -1.031 18321 19868 1 15 . 1 1 209 209 GLN CA C 209 61.474 61.474 53.590 7.884 18321 19869 1 15 . 1 1 209 209 GLN CB C 209 32.039 32.039 29.129 2.910 18321 19870 1 15 . 1 1 209 209 GLN H H 209 8.125 8.125 8.245 -0.120 18321 19871 1 15 . 1 1 210 210 PRO HA H 210 4.395 4.395 4.487 -0.092 18321 19872 1 15 . 1 1 210 210 PRO CA C 210 62.584 62.584 63.002 -0.417 18321 19873 1 15 . 1 1 211 211 GLN HA H 211 4.377 4.377 4.296 0.081 18321 19874 1 15 . 1 1 211 211 GLN CA C 211 55.859 55.859 55.899 -0.040 18321 19875 1 15 . 1 1 211 211 GLN CB C 211 29.577 29.577 29.259 0.317 18321 19876 1 15 . 1 1 212 212 THR C C 212 176.551 176.551 173.685 2.866 18321 19877 1 15 . 1 1 212 212 THR CB C 212 69.890 69.890 67.680 2.210 18321 19878 1 15 . 1 1 213 213 THR N N 213 108.487 108.487 115.934 -7.447 18321 19879 1 15 . 1 1 213 213 THR CA C 213 61.236 61.236 62.764 -1.528 18321 19880 1 15 . 1 1 213 213 THR CB C 213 69.091 69.091 68.913 0.178 18321 19881 1 15 . 1 1 213 213 THR H H 213 8.243 8.243 8.211 0.032 18321 19882 1 15 . 1 1 214 214 THR N N 214 119.445 119.445 118.943 0.502 18321 19883 1 15 . 1 1 214 214 THR CA C 214 59.425 59.425 62.616 -3.191 18321 19884 1 15 . 1 1 214 214 THR CB C 214 69.251 69.251 68.374 0.877 18321 19885 1 15 . 1 1 214 214 THR H H 214 8.188 8.188 8.695 -0.507 18321 19886 1 15 . 1 1 215 215 PRO HA H 215 4.361 4.361 4.723 -0.362 18321 19887 1 15 . 1 1 215 215 PRO C C 215 175.422 175.422 175.753 -0.331 18321 19888 1 15 . 1 1 215 215 PRO CA C 215 63.320 63.320 62.701 0.619 18321 19889 1 15 . 1 1 215 215 PRO CB C 215 31.918 31.918 32.291 -0.373 18321 19890 1 15 . 1 1 216 216 LEU N N 216 121.602 121.602 121.096 0.506 18321 19891 1 15 . 1 1 216 216 LEU CA C 216 52.203 52.203 53.287 -1.084 18321 19892 1 15 . 1 1 216 216 LEU CB C 216 42.451 42.451 42.239 0.212 18321 19893 1 15 . 1 1 216 216 LEU H H 216 7.891 7.891 8.204 -0.313 18321 19894 1 15 . 1 1 217 217 PRO HA H 217 4.398 4.398 4.395 0.003 18321 19895 1 15 . 1 1 217 217 PRO C C 217 176.577 176.577 175.932 0.645 18321 19896 1 15 . 1 1 217 217 PRO CA C 217 62.984 62.984 63.651 -0.667 18321 19897 1 15 . 1 1 217 217 PRO CB C 217 32.056 32.056 32.092 -0.036 18321 19898 1 15 . 1 1 218 218 ALA N N 218 124.087 124.087 120.186 3.901 18321 19899 1 15 . 1 1 218 218 ALA HA H 218 4.309 4.309 4.472 -0.163 18321 19900 1 15 . 1 1 218 218 ALA C C 218 177.844 177.844 175.902 1.942 18321 19901 1 15 . 1 1 218 218 ALA CA C 218 52.379 52.379 51.218 1.161 18321 19902 1 15 . 1 1 218 218 ALA CB C 218 19.133 19.133 20.818 -1.685 18321 19903 1 15 . 1 1 218 218 ALA H H 218 8.261 8.261 7.589 0.672 18321 19904 1 15 . 1 1 219 219 VAL N N 219 118.942 118.942 121.174 -2.232 18321 19905 1 15 . 1 1 219 219 VAL HA H 219 4.142 4.142 4.101 0.041 18321 19906 1 15 . 1 1 219 219 VAL CA C 219 62.102 62.102 62.395 -0.292 18321 19907 1 15 . 1 1 219 219 VAL CB C 219 32.923 32.923 31.555 1.368 18321 19908 1 15 . 1 1 219 219 VAL H H 219 8.049 8.049 8.858 -0.809 18321 19909 1 15 . 1 1 220 220 SER N N 220 119.207 119.207 122.230 -3.023 18321 19910 1 15 . 1 1 220 220 SER HA H 220 4.436 4.436 4.105 0.331 18321 19911 1 15 . 1 1 220 220 SER CA C 220 57.813 57.813 58.986 -1.173 18321 19912 1 15 . 1 1 220 220 SER CB C 220 63.375 63.375 62.244 1.131 18321 19913 1 15 . 1 1 220 220 SER H H 220 8.275 8.275 9.111 -0.836 18321 19914 1 15 . 1 1 221 221 GLY N N 221 110.973 110.973 105.651 5.322 18321 19915 1 15 . 1 1 221 221 GLY C C 221 173.962 173.962 174.345 -0.383 18321 19916 1 15 . 1 1 221 221 GLY CA C 221 45.286 45.286 45.581 -0.295 18321 19917 1 15 . 1 1 221 221 GLY H H 221 8.374 8.374 8.365 0.009 18321 19918 1 15 . 1 1 222 222 SER N N 222 115.516 115.516 116.423 -0.907 18321 19919 1 15 . 1 1 222 222 SER HA H 222 4.763 4.763 4.967 -0.204 18321 19920 1 15 . 1 1 222 222 SER CA C 222 56.407 56.407 55.747 0.660 18321 19921 1 15 . 1 1 222 222 SER CB C 222 63.993 63.993 64.513 -0.520 18321 19922 1 15 . 1 1 222 222 SER H H 222 8.155 8.155 7.768 0.387 18321 19923 1 15 . 1 1 223 223 PRO HA H 223 4.417 4.417 4.413 0.004 18321 19924 1 15 . 1 1 223 223 PRO CA C 223 63.805 63.805 63.315 0.490 18321 19925 1 15 . 1 1 223 223 PRO CB C 223 32.090 32.090 32.215 -0.125 18321 19926 1 15 . 1 1 224 224 GLY N N 224 109.149 109.149 106.748 2.401 18321 19927 1 15 . 1 1 224 224 GLY C C 224 173.813 173.813 173.413 0.400 18321 19928 1 15 . 1 1 224 224 GLY CA C 224 44.512 44.512 44.697 -0.185 18321 19929 1 15 . 1 1 224 224 GLY H H 224 8.376 8.376 8.253 0.123 18321 19930 1 15 . 1 1 225 225 ALA N N 225 123.599 123.599 126.801 -3.202 18321 19931 1 15 . 1 1 225 225 ALA C C 225 177.341 177.341 177.323 0.018 18321 19932 1 15 . 1 1 225 225 ALA CA C 225 51.878 51.878 51.172 0.705 18321 19933 1 15 . 1 1 225 225 ALA CB C 225 19.169 19.169 17.718 1.451 18321 19934 1 15 . 1 1 225 225 ALA H H 225 7.959 7.959 8.265 -0.306 18321 19935 1 15 . 1 1 226 226 ALA N N 226 123.218 123.218 126.582 -3.364 18321 19936 1 15 . 1 1 226 226 ALA HA H 226 4.350 4.350 4.087 0.263 18321 19937 1 15 . 1 1 226 226 ALA C C 226 177.520 177.520 176.028 1.492 18321 19938 1 15 . 1 1 226 226 ALA CA C 226 52.535 52.535 52.354 0.181 18321 19939 1 15 . 1 1 226 226 ALA CB C 226 19.171 19.171 18.425 0.746 18321 19940 1 15 . 1 1 226 226 ALA H H 226 8.169 8.169 8.096 0.073 18321 19941 1 15 . 1 1 227 227 ILE N N 227 120.086 120.086 116.915 3.171 18321 19942 1 15 . 1 1 227 227 ILE HA H 227 4.201 4.201 4.255 -0.054 18321 19943 1 15 . 1 1 227 227 ILE C C 227 174.814 174.814 176.487 -1.673 18321 19944 1 15 . 1 1 227 227 ILE CA C 227 60.929 60.929 62.044 -1.115 18321 19945 1 15 . 1 1 227 227 ILE CB C 227 38.872 38.872 37.467 1.405 18321 19946 1 15 . 1 1 227 227 ILE H H 227 8.037 8.037 8.217 -0.180 18321 19947 1 15 . 1 1 228 228 THR N N 228 117.224 117.224 113.942 3.282 18321 19948 1 15 . 1 1 228 228 THR HA H 228 4.203 4.203 4.786 -0.583 18321 19949 1 15 . 1 1 228 228 THR CA C 228 57.108 57.108 59.779 -2.671 18321 19950 1 15 . 1 1 228 228 THR CB C 228 69.945 69.945 70.571 -0.626 18321 19951 1 15 . 1 1 228 228 THR H H 228 7.775 7.775 7.903 -0.128 18321 19952 1 15 . 1 1 229 229 PRO HA H 229 4.750 4.750 4.633 0.117 18321 19953 1 15 . 1 1 229 229 PRO CA C 229 62.480 62.480 62.505 -0.025 18321 19954 1 15 . 1 1 229 229 PRO CB C 229 33.995 33.995 32.293 1.702 18321 19955 1 15 . 1 1 230 230 LEU N N 230 123.629 123.629 122.053 1.576 18321 19956 1 15 . 1 1 230 230 LEU CA C 230 53.076 53.076 52.313 0.763 18321 19957 1 15 . 1 1 230 230 LEU CB C 230 40.608 40.608 40.744 -0.136 18321 19958 1 15 . 1 1 230 230 LEU H H 230 8.453 8.453 8.310 0.143 18321 19959 1 15 . 1 1 231 231 PRO HA H 231 4.412 4.412 4.619 -0.207 18321 19960 1 15 . 1 1 231 231 PRO C C 231 176.571 176.571 177.183 -0.612 18321 19961 1 15 . 1 1 231 231 PRO CA C 231 63.225 63.225 62.162 1.063 18321 19962 1 15 . 1 1 231 231 PRO CB C 231 31.191 31.191 32.447 -1.256 18321 19963 1 15 . 1 1 232 232 SER N N 232 115.169 115.169 116.967 -1.798 18321 19964 1 15 . 1 1 232 232 SER HA H 232 4.450 4.450 4.641 -0.191 18321 19965 1 15 . 1 1 232 232 SER CA C 232 58.604 58.604 58.041 0.563 18321 19966 1 15 . 1 1 232 232 SER CB C 232 63.962 63.962 62.164 1.798 18321 19967 1 15 . 1 1 232 232 SER H H 232 8.280 8.280 8.621 -0.341 18321 19968 1 15 . 1 1 233 233 THR N N 233 115.155 115.155 117.365 -2.210 18321 19969 1 15 . 1 1 233 233 THR HA H 233 4.351 4.351 4.267 0.084 18321 19970 1 15 . 1 1 233 233 THR C C 233 177.237 177.237 174.201 3.036 18321 19971 1 15 . 1 1 233 233 THR CA C 233 61.939 61.939 61.290 0.649 18321 19972 1 15 . 1 1 233 233 THR CB C 233 68.986 68.986 68.448 0.538 18321 19973 1 15 . 1 1 233 233 THR H H 233 8.096 8.096 7.951 0.145 18321 19974 1 15 . 1 1 234 234 GLN N N 234 122.040 122.040 124.312 -2.272 18321 19975 1 15 . 1 1 234 234 GLN HA H 234 4.681 4.681 4.373 0.308 18321 19976 1 15 . 1 1 234 234 GLN C C 234 176.177 176.177 175.094 1.083 18321 19977 1 15 . 1 1 234 234 GLN CA C 234 55.861 55.861 55.352 0.509 18321 19978 1 15 . 1 1 234 234 GLN CB C 234 28.583 28.583 27.741 0.842 18321 19979 1 15 . 1 1 234 234 GLN H H 234 8.256 8.256 8.093 0.163 18321 19980 1 15 . 1 1 235 235 ASN N N 235 119.506 119.506 121.870 -2.364 18321 19981 1 15 . 1 1 235 235 ASN HA H 235 4.775 4.775 4.848 -0.073 18321 19982 1 15 . 1 1 235 235 ASN C C 235 174.974 174.974 175.728 -0.754 18321 19983 1 15 . 1 1 235 235 ASN CA C 235 53.191 53.191 53.096 0.095 18321 19984 1 15 . 1 1 235 235 ASN CB C 235 38.511 38.511 40.503 -1.992 18321 19985 1 15 . 1 1 235 235 ASN H H 235 8.346 8.346 8.599 -0.253 18321 19986 1 15 . 1 1 236 236 GLY N N 236 109.378 109.378 109.872 -0.494 18321 19987 1 15 . 1 1 236 236 GLY CA C 236 44.023 44.023 44.641 -0.618 18321 19988 1 15 . 1 1 236 236 GLY H H 236 7.939 7.939 8.327 -0.388 18321 19989 1 15 . 1 1 237 237 PRO HA H 237 4.336 4.336 4.434 -0.098 18321 19990 1 15 . 1 1 237 237 PRO C C 237 175.942 175.942 175.723 0.219 18321 19991 1 15 . 1 1 237 237 PRO CA C 237 62.797 62.797 62.617 0.180 18321 19992 1 15 . 1 1 237 237 PRO CB C 237 27.421 27.421 31.595 -4.174 18321 19993 1 15 . 1 1 238 238 VAL N N 238 120.535 120.535 124.317 -3.782 18321 19994 1 15 . 1 1 238 238 VAL HA H 238 4.195 4.195 3.972 0.223 18321 19995 1 15 . 1 1 238 238 VAL C C 238 173.775 173.775 174.974 -1.199 18321 19996 1 15 . 1 1 238 238 VAL CA C 238 61.173 61.173 61.601 -0.428 18321 19997 1 15 . 1 1 238 238 VAL CB C 238 38.328 38.328 32.191 6.137 18321 19998 1 15 . 1 1 238 238 VAL H H 238 7.986 7.986 8.657 -0.671 18321 19999 1 15 . 1 1 239 239 PHE N N 239 123.522 123.522 125.522 -2.000 18321 20000 1 15 . 1 1 239 239 PHE HA H 239 5.539 5.539 5.591 -0.052 18321 20001 1 15 . 1 1 239 239 PHE C C 239 174.207 174.207 175.130 -0.923 18321 20002 1 15 . 1 1 239 239 PHE CA C 239 56.993 56.993 56.171 0.822 18321 20003 1 15 . 1 1 239 239 PHE CB C 239 41.743 41.743 40.693 1.050 18321 20004 1 15 . 1 1 239 239 PHE H H 239 8.927 8.927 8.579 0.348 18321 20005 1 15 . 1 1 240 240 ALA N N 240 120.871 120.871 126.315 -5.444 18321 20006 1 15 . 1 1 240 240 ALA HA H 240 5.352 5.352 5.292 0.060 18321 20007 1 15 . 1 1 240 240 ALA C C 240 174.639 174.639 175.703 -1.064 18321 20008 1 15 . 1 1 240 240 ALA CA C 240 49.736 49.736 50.334 -0.598 18321 20009 1 15 . 1 1 240 240 ALA CB C 240 23.480 23.480 22.409 1.071 18321 20010 1 15 . 1 1 240 240 ALA H H 240 9.398 9.398 9.124 0.274 18321 20011 1 15 . 1 1 241 241 LYS N N 241 121.227 121.227 124.454 -3.227 18321 20012 1 15 . 1 1 241 241 LYS HA H 241 5.373 5.373 5.011 0.362 18321 20013 1 15 . 1 1 241 241 LYS C C 241 176.772 176.772 175.887 0.885 18321 20014 1 15 . 1 1 241 241 LYS CA C 241 53.128 53.128 54.831 -1.703 18321 20015 1 15 . 1 1 241 241 LYS CB C 241 34.850 34.850 34.361 0.489 18321 20016 1 15 . 1 1 241 241 LYS H H 241 8.947 8.947 8.653 0.294 18321 20017 1 15 . 1 1 242 242 ALA N N 242 126.833 126.833 130.813 -3.980 18321 20018 1 15 . 1 1 242 242 ALA HA H 242 4.764 4.764 4.579 0.185 18321 20019 1 15 . 1 1 242 242 ALA C C 242 178.506 178.506 177.949 0.557 18321 20020 1 15 . 1 1 242 242 ALA CA C 242 52.788 52.788 51.696 1.092 18321 20021 1 15 . 1 1 242 242 ALA CB C 242 19.084 19.084 18.554 0.530 18321 20022 1 15 . 1 1 242 242 ALA H H 242 9.373 9.373 8.394 0.979 18321 20023 1 15 . 1 1 243 243 ILE N N 243 118.731 118.731 119.649 -0.918 18321 20024 1 15 . 1 1 243 243 ILE HA H 243 4.454 4.454 4.054 0.400 18321 20025 1 15 . 1 1 243 243 ILE C C 243 174.773 174.773 176.305 -1.532 18321 20026 1 15 . 1 1 243 243 ILE CA C 243 60.613 60.613 62.749 -2.136 18321 20027 1 15 . 1 1 243 243 ILE CB C 243 39.232 39.232 38.507 0.725 18321 20028 1 15 . 1 1 243 243 ILE H H 243 8.933 8.933 8.147 0.786 18321 20029 1 15 . 1 1 244 244 GLN N N 244 121.616 121.616 119.255 2.361 18321 20030 1 15 . 1 1 244 244 GLN HA H 244 4.283 4.283 4.556 -0.273 18321 20031 1 15 . 1 1 244 244 GLN C C 244 172.815 172.815 174.376 -1.561 18321 20032 1 15 . 1 1 244 244 GLN CA C 244 54.750 54.750 54.328 0.422 18321 20033 1 15 . 1 1 244 244 GLN CB C 244 31.469 31.469 32.680 -1.211 18321 20034 1 15 . 1 1 244 244 GLN H H 244 7.438 7.438 7.651 -0.213 18321 20035 1 15 . 1 1 245 245 LYS N N 245 124.215 124.215 120.725 3.490 18321 20036 1 15 . 1 1 245 245 LYS HA H 245 3.962 3.962 4.316 -0.354 18321 20037 1 15 . 1 1 245 245 LYS C C 245 175.679 175.679 175.526 0.153 18321 20038 1 15 . 1 1 245 245 LYS CA C 245 56.413 56.413 56.511 -0.098 18321 20039 1 15 . 1 1 245 245 LYS CB C 245 32.847 32.847 33.321 -0.474 18321 20040 1 15 . 1 1 245 245 LYS H H 245 8.318 8.318 8.561 -0.243 18321 20041 1 15 . 1 1 246 246 ARG N N 246 127.327 127.327 120.149 7.178 18321 20042 1 15 . 1 1 246 246 ARG HA H 246 4.221 4.221 4.594 -0.373 18321 20043 1 15 . 1 1 246 246 ARG CA C 246 56.279 56.279 55.480 0.799 18321 20044 1 15 . 1 1 246 246 ARG CB C 246 32.987 32.987 32.069 0.918 18321 20045 1 15 . 1 1 246 246 ARG H H 246 9.248 9.248 8.391 0.857 18321 20046 1 15 . 1 1 249 249 CYS HA H 249 4.260 4.260 4.153 0.107 18321 20047 1 15 . 1 1 249 249 CYS CA C 249 55.886 55.886 57.517 -1.631 18321 20048 1 15 . 1 1 249 249 CYS CB C 249 34.146 34.146 29.186 4.960 18321 20049 1 15 . 1 1 250 250 ALA HA H 250 3.926 3.926 4.065 -0.139 18321 20050 1 15 . 1 1 250 250 ALA CA C 250 54.344 54.344 54.647 -0.303 18321 20051 1 15 . 1 1 250 250 ALA CB C 250 18.342 18.342 18.687 -0.345 18321 20052 1 15 . 1 1 251 251 TYR N N 251 110.618 110.618 111.562 -0.944 18321 20053 1 15 . 1 1 251 251 TYR HA H 251 4.489 4.489 4.801 -0.312 18321 20054 1 15 . 1 1 251 251 TYR C C 251 175.286 175.286 175.230 0.056 18321 20055 1 15 . 1 1 251 251 TYR CA C 251 56.137 56.137 55.417 0.720 18321 20056 1 15 . 1 1 251 251 TYR CB C 251 37.203 37.203 38.111 -0.908 18321 20057 1 15 . 1 1 251 251 TYR H H 251 7.037 7.037 7.102 -0.065 18321 20058 1 15 . 1 1 252 252 ASP N N 252 121.835 121.835 121.559 0.276 18321 20059 1 15 . 1 1 252 252 ASP HA H 252 4.763 4.763 4.947 -0.184 18321 20060 1 15 . 1 1 252 252 ASP CA C 252 52.351 52.351 53.724 -1.373 18321 20061 1 15 . 1 1 252 252 ASP CB C 252 39.995 39.995 40.894 -0.899 18321 20062 1 15 . 1 1 252 252 ASP H H 252 7.339 7.339 7.643 -0.304 18321 20063 1 15 . 1 1 253 253 LYS N N 253 123.177 123.177 119.686 3.491 18321 20064 1 15 . 1 1 253 253 LYS HA H 253 4.270 4.270 4.146 0.124 18321 20065 1 15 . 1 1 253 253 LYS C C 253 177.724 177.724 177.553 0.171 18321 20066 1 15 . 1 1 253 253 LYS CA C 253 57.036 57.036 58.776 -1.740 18321 20067 1 15 . 1 1 253 253 LYS H H 253 8.396 8.396 8.335 0.061 18321 20068 1 15 . 1 1 254 254 THR N N 254 108.317 108.317 108.483 -0.166 18321 20069 1 15 . 1 1 254 254 THR HA H 254 4.517 4.517 4.301 0.216 18321 20070 1 15 . 1 1 254 254 THR C C 254 174.012 174.012 174.041 -0.029 18321 20071 1 15 . 1 1 254 254 THR CA C 254 61.036 61.036 61.392 -0.356 18321 20072 1 15 . 1 1 254 254 THR CB C 254 69.307 69.307 68.435 0.872 18321 20073 1 15 . 1 1 254 254 THR H H 254 8.217 8.217 8.114 0.103 18321 20074 1 15 . 1 1 255 255 ALA N N 255 124.762 124.762 124.596 0.166 18321 20075 1 15 . 1 1 255 255 ALA HA H 255 4.524 4.524 5.053 -0.529 18321 20076 1 15 . 1 1 255 255 ALA C C 255 176.630 176.630 176.467 0.163 18321 20077 1 15 . 1 1 255 255 ALA CA C 255 51.352 51.352 50.977 0.375 18321 20078 1 15 . 1 1 255 255 ALA CB C 255 20.135 20.135 20.082 0.053 18321 20079 1 15 . 1 1 255 255 ALA H H 255 7.096 7.096 7.354 -0.258 18321 20080 1 15 . 1 1 256 256 LEU N N 256 124.379 124.379 124.188 0.191 18321 20081 1 15 . 1 1 256 256 LEU HA H 256 4.328 4.328 4.429 -0.101 18321 20082 1 15 . 1 1 256 256 LEU C C 256 176.007 176.007 176.112 -0.105 18321 20083 1 15 . 1 1 256 256 LEU CA C 256 53.502 53.502 54.381 -0.879 18321 20084 1 15 . 1 1 256 256 LEU CB C 256 44.665 44.665 43.935 0.730 18321 20085 1 15 . 1 1 256 256 LEU H H 256 8.889 8.889 8.103 0.786 18321 20086 1 15 . 1 1 257 257 ALA N N 257 129.619 129.619 127.634 1.985 18321 20087 1 15 . 1 1 257 257 ALA HA H 257 4.445 4.445 5.030 -0.585 18321 20088 1 15 . 1 1 257 257 ALA C C 257 176.813 176.813 176.660 0.153 18321 20089 1 15 . 1 1 257 257 ALA CA C 257 51.179 51.179 51.226 -0.047 18321 20090 1 15 . 1 1 257 257 ALA CB C 257 18.973 18.973 18.949 0.024 18321 20091 1 15 . 1 1 257 257 ALA H H 257 8.529 8.529 8.208 0.321 18321 20092 1 15 . 1 1 258 258 LEU N N 258 119.300 119.300 125.272 -5.972 18321 20093 1 15 . 1 1 258 258 LEU HA H 258 4.782 4.782 4.646 0.136 18321 20094 1 15 . 1 1 258 258 LEU CA C 258 53.259 53.259 54.011 -0.752 18321 20095 1 15 . 1 1 258 258 LEU CB C 258 45.972 45.972 44.819 1.153 18321 20096 1 15 . 1 1 258 258 LEU H H 258 8.505 8.505 8.839 -0.334 18321 20097 1 15 . 1 1 259 259 GLU N N 259 123.919 123.919 121.428 2.491 18321 20098 1 15 . 1 1 259 259 GLU HA H 259 4.516 4.516 4.515 0.001 18321 20099 1 15 . 1 1 259 259 GLU C C 259 175.795 175.795 175.572 0.223 18321 20100 1 15 . 1 1 259 259 GLU CA C 259 52.896 52.896 54.211 -1.315 18321 20101 1 15 . 1 1 259 259 GLU H H 259 8.943 8.943 8.553 0.390 18321 20102 1 15 . 1 1 260 260 VAL N N 260 122.122 122.122 120.322 1.800 18321 20103 1 15 . 1 1 260 260 VAL HA H 260 2.923 2.923 4.026 -1.103 18321 20104 1 15 . 1 1 260 260 VAL C C 260 177.964 177.964 177.622 0.342 18321 20105 1 15 . 1 1 260 260 VAL CA C 260 65.417 65.417 63.785 1.632 18321 20106 1 15 . 1 1 260 260 VAL CB C 260 30.668 30.668 31.312 -0.644 18321 20107 1 15 . 1 1 260 260 VAL H H 260 8.956 8.956 8.403 0.553 18321 20108 1 15 . 1 1 261 261 GLY N N 261 116.009 116.009 116.244 -0.235 18321 20109 1 15 . 1 1 261 261 GLY C C 261 176.288 176.288 173.682 2.606 18321 20110 1 15 . 1 1 261 261 GLY CA C 261 44.210 44.210 44.815 -0.605 18321 20111 1 15 . 1 1 261 261 GLY H H 261 8.799 8.799 8.907 -0.108 18321 20112 1 15 . 1 1 262 262 ASP N N 262 121.945 121.945 120.195 1.750 18321 20113 1 15 . 1 1 262 262 ASP HA H 262 4.423 4.423 4.973 -0.550 18321 20114 1 15 . 1 1 262 262 ASP C C 262 175.381 175.381 174.449 0.932 18321 20115 1 15 . 1 1 262 262 ASP CA C 262 55.243 55.243 52.505 2.738 18321 20116 1 15 . 1 1 262 262 ASP CB C 262 41.819 41.819 43.187 -1.368 18321 20117 1 15 . 1 1 262 262 ASP H H 262 8.180 8.180 7.751 0.429 18321 20118 1 15 . 1 1 263 263 ILE N N 263 121.452 121.452 121.492 -0.040 18321 20119 1 15 . 1 1 263 263 ILE HA H 263 4.707 4.707 4.747 -0.040 18321 20120 1 15 . 1 1 263 263 ILE C C 263 174.996 174.996 175.811 -0.815 18321 20121 1 15 . 1 1 263 263 ILE CA C 263 59.289 59.289 59.399 -0.110 18321 20122 1 15 . 1 1 263 263 ILE CB C 263 36.987 36.987 38.304 -1.317 18321 20123 1 15 . 1 1 263 263 ILE H H 263 8.460 8.460 8.572 -0.112 18321 20124 1 15 . 1 1 264 264 VAL N N 264 128.756 128.756 129.269 -0.513 18321 20125 1 15 . 1 1 264 264 VAL HA H 264 4.309 4.309 4.098 0.211 18321 20126 1 15 . 1 1 264 264 VAL C C 264 175.486 175.486 174.892 0.594 18321 20127 1 15 . 1 1 264 264 VAL CA C 264 59.091 59.091 61.925 -2.834 18321 20128 1 15 . 1 1 264 264 VAL CB C 264 34.541 34.541 32.070 2.471 18321 20129 1 15 . 1 1 264 264 VAL H H 264 9.479 9.479 9.342 0.137 18321 20130 1 15 . 1 1 265 265 LYS N N 265 128.101 128.101 130.508 -2.407 18321 20131 1 15 . 1 1 265 265 LYS HA H 265 4.342 4.342 4.382 -0.040 18321 20132 1 15 . 1 1 265 265 LYS C C 265 175.531 175.531 174.979 0.552 18321 20133 1 15 . 1 1 265 265 LYS CA C 265 55.620 55.620 55.580 0.040 18321 20134 1 15 . 1 1 265 265 LYS CB C 265 33.149 33.149 32.467 0.682 18321 20135 1 15 . 1 1 265 265 LYS H H 265 8.715 8.715 8.731 -0.016 18321 20136 1 15 . 1 1 266 266 VAL N N 266 129.537 129.537 128.219 1.318 18321 20137 1 15 . 1 1 266 266 VAL HA H 266 4.333 4.333 4.419 -0.086 18321 20138 1 15 . 1 1 266 266 VAL C C 266 176.166 176.166 174.914 1.252 18321 20139 1 15 . 1 1 266 266 VAL CA C 266 63.339 63.339 60.743 2.596 18321 20140 1 15 . 1 1 266 266 VAL CB C 266 30.712 30.712 34.706 -3.994 18321 20141 1 15 . 1 1 266 266 VAL H H 266 9.073 9.073 8.867 0.206 18321 20142 1 15 . 1 1 267 267 THR N N 267 120.020 120.020 123.966 -3.946 18321 20143 1 15 . 1 1 267 267 THR HA H 267 4.189 4.189 4.360 -0.171 18321 20144 1 15 . 1 1 267 267 THR C C 267 176.054 176.054 175.108 0.946 18321 20145 1 15 . 1 1 267 267 THR CA C 267 62.204 62.204 63.301 -1.097 18321 20146 1 15 . 1 1 267 267 THR CB C 267 68.200 68.200 69.283 -1.083 18321 20147 1 15 . 1 1 267 267 THR H H 267 9.130 9.130 8.335 0.795 18321 20148 1 15 . 1 1 268 268 ARG N N 268 120.839 120.839 123.001 -2.162 18321 20149 1 15 . 1 1 268 268 ARG HA H 268 4.236 4.236 4.657 -0.421 18321 20150 1 15 . 1 1 268 268 ARG CA C 268 56.321 56.321 54.228 2.093 18321 20151 1 15 . 1 1 268 268 ARG CB C 268 33.049 33.049 30.426 2.623 18321 20152 1 15 . 1 1 268 268 ARG H H 268 7.631 7.631 7.563 0.068 18321 20153 1 15 . 1 1 269 269 MET N N 269 125.443 125.443 123.476 1.967 18321 20154 1 15 . 1 1 269 269 MET C C 269 174.392 174.392 175.261 -0.869 18321 20155 1 15 . 1 1 269 269 MET H H 269 8.532 8.532 8.482 0.050 18321 20156 1 15 . 1 1 270 270 ASN N N 270 119.125 119.125 122.880 -3.755 18321 20157 1 15 . 1 1 270 270 ASN HA H 270 4.546 4.546 5.048 -0.502 18321 20158 1 15 . 1 1 270 270 ASN C C 270 172.133 172.133 175.129 -2.996 18321 20159 1 15 . 1 1 270 270 ASN CA C 270 53.639 53.639 52.114 1.525 18321 20160 1 15 . 1 1 270 270 ASN CB C 270 39.845 39.845 40.328 -0.483 18321 20161 1 15 . 1 1 270 270 ASN H H 270 6.631 6.631 8.480 -1.849 18321 20162 1 15 . 1 1 271 271 ILE N N 271 122.532 122.532 112.450 10.082 18321 20163 1 15 . 1 1 271 271 ILE HA H 271 4.417 4.417 4.487 -0.070 18321 20164 1 15 . 1 1 271 271 ILE CA C 271 63.348 63.348 61.577 1.771 18321 20165 1 15 . 1 1 271 271 ILE CB C 271 38.198 38.198 37.817 0.381 18321 20166 1 15 . 1 1 271 271 ILE H H 271 8.565 8.565 8.263 0.302 18321 20167 1 15 . 1 1 272 272 ASN HA H 272 4.527 4.527 4.699 -0.172 18321 20168 1 15 . 1 1 272 272 ASN C C 272 176.259 176.259 176.428 -0.169 18321 20169 1 15 . 1 1 272 272 ASN CA C 272 53.225 53.225 54.316 -1.091 18321 20170 1 15 . 1 1 272 272 ASN CB C 272 37.565 37.565 39.690 -2.125 18321 20171 1 15 . 1 1 273 273 GLY N N 273 107.043 107.043 106.826 0.217 18321 20172 1 15 . 1 1 273 273 GLY C C 273 173.216 173.216 172.833 0.383 18321 20173 1 15 . 1 1 273 273 GLY CA C 273 45.299 45.299 44.931 0.368 18321 20174 1 15 . 1 1 273 273 GLY H H 273 8.086 8.086 8.037 0.049 18321 20175 1 15 . 1 1 274 274 GLN N N 274 120.624 120.624 121.611 -0.987 18321 20176 1 15 . 1 1 274 274 GLN HA H 274 4.551 4.551 4.593 -0.042 18321 20177 1 15 . 1 1 274 274 GLN C C 274 175.039 175.039 175.543 -0.504 18321 20178 1 15 . 1 1 274 274 GLN CA C 274 54.556 54.556 55.064 -0.508 18321 20179 1 15 . 1 1 274 274 GLN CB C 274 33.698 33.698 29.063 4.635 18321 20180 1 15 . 1 1 274 274 GLN H H 274 8.045 8.045 7.954 0.091 18321 20181 1 15 . 1 1 275 275 TRP N N 275 125.596 125.596 124.520 1.076 18321 20182 1 15 . 1 1 275 275 TRP HA H 275 4.588 4.588 4.551 0.037 18321 20183 1 15 . 1 1 275 275 TRP C C 275 172.832 172.832 176.174 -3.342 18321 20184 1 15 . 1 1 275 275 TRP CA C 275 55.296 55.296 54.340 0.956 18321 20185 1 15 . 1 1 275 275 TRP CB C 275 31.393 31.393 30.014 1.379 18321 20186 1 15 . 1 1 275 275 TRP H H 275 8.484 8.484 7.671 0.813 18321 20187 1 15 . 1 1 276 276 GLU N N 276 119.012 119.012 121.608 -2.596 18321 20188 1 15 . 1 1 276 276 GLU HA H 276 5.190 5.190 4.774 0.416 18321 20189 1 15 . 1 1 276 276 GLU C C 276 176.553 176.553 175.987 0.566 18321 20190 1 15 . 1 1 276 276 GLU CA C 276 54.288 54.288 55.647 -1.359 18321 20191 1 15 . 1 1 276 276 GLU CB C 276 32.851 32.851 30.198 2.653 18321 20192 1 15 . 1 1 276 276 GLU H H 276 8.643 8.643 8.391 0.252 18321 20193 1 15 . 1 1 277 277 GLY N N 277 111.364 111.364 113.705 -2.341 18321 20194 1 15 . 1 1 277 277 GLY C C 277 170.707 170.707 172.760 -2.053 18321 20195 1 15 . 1 1 277 277 GLY CA C 277 46.723 46.723 44.084 2.639 18321 20196 1 15 . 1 1 277 277 GLY H H 277 9.072 9.072 8.909 0.163 18321 20197 1 15 . 1 1 278 278 GLU N N 278 117.733 117.733 125.196 -7.463 18321 20198 1 15 . 1 1 278 278 GLU HA H 278 5.748 5.748 4.940 0.808 18321 20199 1 15 . 1 1 278 278 GLU C C 278 176.051 176.051 175.173 0.878 18321 20200 1 15 . 1 1 278 278 GLU CA C 278 53.620 53.620 55.232 -1.612 18321 20201 1 15 . 1 1 278 278 GLU CB C 278 33.742 33.742 30.122 3.620 18321 20202 1 15 . 1 1 278 278 GLU H H 278 8.810 8.810 8.196 0.614 18321 20203 1 15 . 1 1 279 279 VAL N N 279 123.834 123.834 124.421 -0.587 18321 20204 1 15 . 1 1 279 279 VAL HA H 279 4.404 4.404 4.212 0.192 18321 20205 1 15 . 1 1 279 279 VAL C C 279 175.289 175.289 176.554 -1.265 18321 20206 1 15 . 1 1 279 279 VAL CA C 279 61.166 61.166 62.687 -1.521 18321 20207 1 15 . 1 1 279 279 VAL CB C 279 34.123 34.123 33.352 0.771 18321 20208 1 15 . 1 1 279 279 VAL H H 279 8.887 8.887 8.155 0.732 18321 20209 1 15 . 1 1 280 280 ASN N N 280 126.025 126.025 119.957 6.068 18321 20210 1 15 . 1 1 280 280 ASN HA H 280 4.435 4.435 4.933 -0.498 18321 20211 1 15 . 1 1 280 280 ASN C C 280 175.205 175.205 176.085 -0.880 18321 20212 1 15 . 1 1 280 280 ASN CA C 280 45.615 45.615 52.411 -6.796 18321 20213 1 15 . 1 1 280 280 ASN CB C 280 37.386 37.386 37.003 0.383 18321 20214 1 15 . 1 1 280 280 ASN H H 280 9.322 9.322 8.520 0.802 18321 20215 1 15 . 1 1 281 281 GLY N N 281 104.588 104.588 108.052 -3.464 18321 20216 1 15 . 1 1 281 281 GLY C C 281 173.944 173.944 173.566 0.378 18321 20217 1 15 . 1 1 281 281 GLY CA C 281 45.224 45.224 45.592 -0.368 18321 20218 1 15 . 1 1 281 281 GLY H H 281 8.768 8.768 8.005 0.763 18321 20219 1 15 . 1 1 282 282 ARG N N 282 122.567 122.567 119.146 3.421 18321 20220 1 15 . 1 1 282 282 ARG HA H 282 4.559 4.559 4.496 0.063 18321 20221 1 15 . 1 1 282 282 ARG C C 282 174.350 174.350 173.910 0.440 18321 20222 1 15 . 1 1 282 282 ARG CA C 282 54.933 54.933 55.349 -0.416 18321 20223 1 15 . 1 1 282 282 ARG CB C 282 31.765 31.765 32.632 -0.867 18321 20224 1 15 . 1 1 282 282 ARG H H 282 8.149 8.149 7.904 0.245 18321 20225 1 15 . 1 1 283 283 LYS N N 283 121.565 121.565 127.151 -5.586 18321 20226 1 15 . 1 1 283 283 LYS HA H 283 5.584 5.584 5.526 0.058 18321 20227 1 15 . 1 1 283 283 LYS CA C 283 54.143 54.143 55.008 -0.865 18321 20228 1 15 . 1 1 283 283 LYS CB C 283 36.040 36.040 34.526 1.514 18321 20229 1 15 . 1 1 283 283 LYS H H 283 8.424 8.424 8.425 -0.001 18321 20230 1 15 . 1 1 284 284 GLY C C 284 173.006 173.006 172.403 0.603 18321 20231 1 15 . 1 1 284 284 GLY CA C 284 45.886 45.886 44.859 1.027 18321 20232 1 15 . 1 1 285 285 LEU N N 285 119.673 119.673 121.192 -1.519 18321 20233 1 15 . 1 1 285 285 LEU HA H 285 5.718 5.718 5.621 0.097 18321 20234 1 15 . 1 1 285 285 LEU C C 285 178.657 178.657 176.426 2.231 18321 20235 1 15 . 1 1 285 285 LEU CA C 285 53.656 53.656 54.034 -0.378 18321 20236 1 15 . 1 1 285 285 LEU CB C 285 44.813 44.813 43.587 1.226 18321 20237 1 15 . 1 1 285 285 LEU H H 285 8.734 8.734 8.703 0.031 18321 20238 1 15 . 1 1 286 286 PHE N N 286 118.785 118.785 119.031 -0.246 18321 20239 1 15 . 1 1 286 286 PHE HA H 286 4.521 4.521 5.079 -0.558 18321 20240 1 15 . 1 1 286 286 PHE CA C 286 57.592 57.592 54.392 3.200 18321 20241 1 15 . 1 1 286 286 PHE CB C 286 40.669 40.669 40.269 0.400 18321 20242 1 15 . 1 1 286 286 PHE H H 286 9.120 9.120 8.350 0.770 18321 20243 1 15 . 1 1 287 287 PRO HA H 287 4.385 4.385 4.621 -0.236 18321 20244 1 15 . 1 1 287 287 PRO CA C 287 62.814 62.814 62.299 0.515 18321 20245 1 15 . 1 1 287 287 PRO CB C 287 32.133 32.133 31.691 0.442 18321 20246 1 15 . 1 1 288 288 PHE C C 288 174.837 174.837 174.954 -0.117 18321 20247 1 15 . 1 1 288 288 PHE CA C 288 59.020 59.020 59.202 -0.182 18321 20248 1 15 . 1 1 288 288 PHE CB C 288 34.987 34.987 37.538 -2.551 18321 20249 1 15 . 1 1 289 289 THR N N 289 107.865 107.865 111.529 -3.664 18321 20250 1 15 . 1 1 289 289 THR HA H 289 3.589 3.589 3.934 -0.345 18321 20251 1 15 . 1 1 289 289 THR C C 289 176.125 176.125 174.747 1.378 18321 20252 1 15 . 1 1 289 289 THR CA C 289 62.243 62.243 63.741 -1.498 18321 20253 1 15 . 1 1 289 289 THR CB C 289 69.365 69.365 68.162 1.203 18321 20254 1 15 . 1 1 289 289 THR H H 289 6.453 6.453 7.502 -1.049 18321 20255 1 15 . 1 1 290 290 HIS N N 290 119.462 119.462 117.703 1.759 18321 20256 1 15 . 1 1 290 290 HIS HA H 290 4.196 4.196 4.678 -0.482 18321 20257 1 15 . 1 1 290 290 HIS C C 290 175.165 175.165 173.395 1.770 18321 20258 1 15 . 1 1 290 290 HIS CA C 290 57.635 57.635 56.352 1.283 18321 20259 1 15 . 1 1 290 290 HIS CB C 290 29.840 29.840 31.964 -2.124 18321 20260 1 15 . 1 1 290 290 HIS H H 290 7.835 7.835 7.955 -0.120 18321 20261 1 15 . 1 1 291 291 VAL N N 291 110.050 110.050 112.384 -2.334 18321 20262 1 15 . 1 1 291 291 VAL HA H 291 5.445 5.445 5.166 0.279 18321 20263 1 15 . 1 1 291 291 VAL C C 291 173.386 173.386 174.753 -1.367 18321 20264 1 15 . 1 1 291 291 VAL CA C 291 57.794 57.794 58.861 -1.067 18321 20265 1 15 . 1 1 291 291 VAL CB C 291 35.784 35.784 35.337 0.446 18321 20266 1 15 . 1 1 291 291 VAL H H 291 7.562 7.562 7.171 0.391 18321 20267 1 15 . 1 1 292 292 LYS N N 292 119.445 119.445 121.402 -1.957 18321 20268 1 15 . 1 1 292 292 LYS HA H 292 4.857 4.857 4.807 0.050 18321 20269 1 15 . 1 1 292 292 LYS C C 292 176.512 176.512 175.664 0.848 18321 20270 1 15 . 1 1 292 292 LYS CA C 292 54.647 54.647 54.612 0.035 18321 20271 1 15 . 1 1 292 292 LYS CB C 292 35.665 35.665 36.554 -0.889 18321 20272 1 15 . 1 1 292 292 LYS H H 292 8.753 8.753 8.506 0.247 18321 20273 1 15 . 1 1 293 293 ILE N N 293 128.707 128.707 124.111 4.596 18321 20274 1 15 . 1 1 293 293 ILE HA H 293 4.509 4.509 4.317 0.192 18321 20275 1 15 . 1 1 293 293 ILE C C 293 175.666 175.666 176.929 -1.263 18321 20276 1 15 . 1 1 293 293 ILE CA C 293 62.563 62.563 61.393 1.170 18321 20277 1 15 . 1 1 293 293 ILE CB C 293 38.076 38.076 36.517 1.558 18321 20278 1 15 . 1 1 293 293 ILE H H 293 9.107 9.107 8.876 0.231 18321 20279 1 15 . 1 1 294 294 PHE N N 294 126.638 126.638 127.206 -0.568 18321 20280 1 15 . 1 1 294 294 PHE HA H 294 4.898 4.898 4.986 -0.088 18321 20281 1 15 . 1 1 294 294 PHE C C 294 175.838 175.838 173.753 2.085 18321 20282 1 15 . 1 1 294 294 PHE CA C 294 56.335 56.335 55.814 0.521 18321 20283 1 15 . 1 1 294 294 PHE CB C 294 41.196 41.196 40.942 0.254 18321 20284 1 15 . 1 1 294 294 PHE H H 294 8.716 8.716 8.367 0.349 18321 20285 1 15 . 1 1 295 295 ASP N N 295 122.961 122.961 119.074 3.887 18321 20286 1 15 . 1 1 295 295 ASP HA H 295 5.003 5.003 4.721 0.282 18321 20287 1 15 . 1 1 295 295 ASP CA C 295 50.602 50.602 51.294 -0.692 18321 20288 1 15 . 1 1 295 295 ASP CB C 295 40.754 40.754 40.749 0.005 18321 20289 1 15 . 1 1 295 295 ASP H H 295 8.418 8.418 8.448 -0.030 18321 20290 1 15 . 1 1 296 296 PRO HA H 296 4.524 4.524 4.345 0.179 18321 20291 1 15 . 1 1 296 296 PRO C C 296 176.807 176.807 176.789 0.018 18321 20292 1 15 . 1 1 296 296 PRO CA C 296 62.987 62.987 64.562 -1.575 18321 20293 1 15 . 1 1 296 296 PRO CB C 296 32.033 32.033 32.065 -0.032 18321 20294 1 15 . 1 1 297 297 GLN N N 297 120.729 120.729 115.229 5.500 18321 20295 1 15 . 1 1 297 297 GLN HA H 297 4.274 4.274 4.268 0.006 18321 20296 1 15 . 1 1 297 297 GLN CA C 297 56.427 56.427 55.590 0.837 18321 20297 1 15 . 1 1 297 297 GLN CB C 297 28.819 28.819 28.596 0.223 18321 20298 1 15 . 1 1 297 297 GLN H H 297 8.551 8.551 8.358 0.193 18321 20299 1 15 . 1 1 299 299 PRO C C 299 176.936 176.936 176.131 0.805 18321 20300 1 15 . 1 1 299 299 PRO CA C 299 63.406 63.406 63.398 0.008 18321 20301 1 15 . 1 1 299 299 PRO CB C 299 31.421 31.421 32.012 -0.591 18321 20302 1 15 . 1 1 300 300 ASP N N 300 119.609 119.609 118.759 0.850 18321 20303 1 15 . 1 1 300 300 ASP C C 300 176.344 176.344 177.050 -0.706 18321 20304 1 15 . 1 1 300 300 ASP CA C 300 54.178 54.178 55.270 -1.092 18321 20305 1 15 . 1 1 300 300 ASP CB C 300 40.661 40.661 40.973 -0.312 18321 20306 1 15 . 1 1 300 300 ASP H H 300 8.239 8.239 7.936 0.303 18321 20307 1 15 . 1 1 301 301 GLU N N 301 120.462 120.462 116.925 3.537 18321 20308 1 15 . 1 1 301 301 GLU CA C 301 56.188 56.188 58.368 -2.180 18321 20309 1 15 . 1 1 301 301 GLU CB C 301 29.507 29.507 28.500 1.007 18321 20310 1 15 . 1 1 301 301 GLU H H 301 8.084 8.084 8.973 -0.889 18321 20311 1 16 . 1 1 2 2 SER HA H 2 4.521 4.521 4.541 -0.020 18321 20312 1 16 . 1 1 2 2 SER CA C 2 58.326 58.326 58.871 -0.545 18321 20313 1 16 . 1 1 2 2 SER CB C 2 64.062 64.062 63.928 0.134 18321 20314 1 16 . 1 1 3 3 SER HA H 3 4.465 4.465 4.078 0.387 18321 20315 1 16 . 1 1 3 3 SER C C 3 173.887 173.887 173.631 0.256 18321 20316 1 16 . 1 1 3 3 SER CA C 3 58.374 58.374 60.213 -1.839 18321 20317 1 16 . 1 1 3 3 SER CB C 3 63.920 63.920 62.382 1.538 18321 20318 1 16 . 1 1 4 4 ALA N N 4 124.755 124.755 126.293 -1.538 18321 20319 1 16 . 1 1 4 4 ALA HA H 4 4.547 4.547 4.495 0.052 18321 20320 1 16 . 1 1 4 4 ALA CA C 4 52.737 52.737 52.747 -0.010 18321 20321 1 16 . 1 1 4 4 ALA CB C 4 19.636 19.636 19.058 0.578 18321 20322 1 16 . 1 1 4 4 ALA H H 4 8.244 8.244 8.007 0.237 18321 20323 1 16 . 1 1 5 5 ARG N N 5 120.383 120.383 127.396 -7.013 18321 20324 1 16 . 1 1 5 5 ARG HA H 5 4.524 4.524 4.756 -0.232 18321 20325 1 16 . 1 1 5 5 ARG C C 5 175.611 175.611 174.481 1.130 18321 20326 1 16 . 1 1 5 5 ARG CA C 5 56.082 56.082 55.216 0.866 18321 20327 1 16 . 1 1 5 5 ARG CB C 5 30.695 30.695 31.265 -0.570 18321 20328 1 16 . 1 1 5 5 ARG H H 5 8.727 8.727 8.854 -0.127 18321 20329 1 16 . 1 1 6 6 PHE N N 6 115.159 115.159 119.528 -4.369 18321 20330 1 16 . 1 1 6 6 PHE HA H 6 4.786 4.786 4.759 0.027 18321 20331 1 16 . 1 1 6 6 PHE C C 6 172.076 172.076 173.710 -1.634 18321 20332 1 16 . 1 1 6 6 PHE CA C 6 56.640 56.640 56.551 0.089 18321 20333 1 16 . 1 1 6 6 PHE CB C 6 40.378 40.378 40.564 -0.186 18321 20334 1 16 . 1 1 6 6 PHE H H 6 7.536 7.536 7.922 -0.386 18321 20335 1 16 . 1 1 7 7 ASP N N 7 121.846 121.846 122.671 -0.825 18321 20336 1 16 . 1 1 7 7 ASP HA H 7 4.846 4.846 4.682 0.164 18321 20337 1 16 . 1 1 7 7 ASP CA C 7 52.327 52.327 54.576 -2.249 18321 20338 1 16 . 1 1 7 7 ASP CB C 7 41.298 41.298 41.065 0.233 18321 20339 1 16 . 1 1 7 7 ASP H H 7 9.062 9.062 8.730 0.332 18321 20340 1 16 . 1 1 8 8 SER HA H 8 3.950 3.950 4.482 -0.532 18321 20341 1 16 . 1 1 8 8 SER C C 8 174.705 174.705 173.717 0.988 18321 20342 1 16 . 1 1 8 8 SER CA C 8 61.937 61.937 59.020 2.917 18321 20343 1 16 . 1 1 8 8 SER CB C 8 62.260 62.260 61.949 0.311 18321 20344 1 16 . 1 1 9 9 SER N N 9 114.373 114.373 114.867 -0.494 18321 20345 1 16 . 1 1 9 9 SER HA H 9 4.529 4.529 4.815 -0.286 18321 20346 1 16 . 1 1 9 9 SER C C 9 175.089 175.089 172.911 2.178 18321 20347 1 16 . 1 1 9 9 SER CA C 9 59.851 59.851 59.337 0.514 18321 20348 1 16 . 1 1 9 9 SER CB C 9 64.246 64.246 65.640 -1.394 18321 20349 1 16 . 1 1 9 9 SER H H 9 8.722 8.722 8.672 0.050 18321 20350 1 16 . 1 1 10 10 ASP N N 10 121.818 121.818 123.085 -1.267 18321 20351 1 16 . 1 1 10 10 ASP HA H 10 4.730 4.730 4.576 0.154 18321 20352 1 16 . 1 1 10 10 ASP C C 10 174.455 174.455 177.326 -2.871 18321 20353 1 16 . 1 1 10 10 ASP CA C 10 52.432 52.432 54.218 -1.786 18321 20354 1 16 . 1 1 10 10 ASP CB C 10 39.607 39.607 41.560 -1.953 18321 20355 1 16 . 1 1 10 10 ASP H H 10 7.600 7.600 7.854 -0.254 18321 20356 1 16 . 1 1 11 11 ARG N N 11 125.238 125.238 126.110 -0.872 18321 20357 1 16 . 1 1 11 11 ARG HA H 11 1.936 1.936 2.921 -0.985 18321 20358 1 16 . 1 1 11 11 ARG C C 11 176.916 176.916 177.382 -0.466 18321 20359 1 16 . 1 1 11 11 ARG CA C 11 57.451 57.451 58.071 -0.620 18321 20360 1 16 . 1 1 11 11 ARG CB C 11 43.014 43.014 29.375 13.639 18321 20361 1 16 . 1 1 11 11 ARG H H 11 7.739 7.739 8.276 -0.537 18321 20362 1 16 . 1 1 12 12 SER N N 12 112.065 112.065 112.481 -0.416 18321 20363 1 16 . 1 1 12 12 SER HA H 12 4.695 4.695 4.176 0.519 18321 20364 1 16 . 1 1 12 12 SER C C 12 175.092 175.092 174.040 1.052 18321 20365 1 16 . 1 1 12 12 SER CA C 12 60.785 60.785 60.027 0.758 18321 20366 1 16 . 1 1 12 12 SER CB C 12 62.889 62.889 62.804 0.085 18321 20367 1 16 . 1 1 12 12 SER H H 12 7.888 7.888 8.020 -0.132 18321 20368 1 16 . 1 1 13 13 ALA N N 13 122.249 122.249 122.587 -0.338 18321 20369 1 16 . 1 1 13 13 ALA HA H 13 4.216 4.216 4.333 -0.117 18321 20370 1 16 . 1 1 13 13 ALA C C 13 178.069 178.069 177.342 0.727 18321 20371 1 16 . 1 1 13 13 ALA CA C 13 53.562 53.562 53.782 -0.220 18321 20372 1 16 . 1 1 13 13 ALA CB C 13 19.339 19.339 19.774 -0.435 18321 20373 1 16 . 1 1 13 13 ALA H H 13 7.418 7.418 7.577 -0.159 18321 20374 1 16 . 1 1 14 14 TRP N N 14 107.433 107.433 111.730 -4.297 18321 20375 1 16 . 1 1 14 14 TRP HA H 14 4.785 4.785 4.642 0.143 18321 20376 1 16 . 1 1 14 14 TRP C C 14 175.286 175.286 175.732 -0.446 18321 20377 1 16 . 1 1 14 14 TRP CA C 14 55.212 55.212 54.988 0.224 18321 20378 1 16 . 1 1 14 14 TRP CB C 14 32.776 32.776 31.081 1.695 18321 20379 1 16 . 1 1 14 14 TRP H H 14 6.273 6.273 6.788 -0.515 18321 20380 1 16 . 1 1 15 15 TYR N N 15 122.315 122.315 124.384 -2.069 18321 20381 1 16 . 1 1 15 15 TYR HA H 15 5.436 5.436 5.103 0.333 18321 20382 1 16 . 1 1 15 15 TYR C C 15 175.325 175.325 175.218 0.107 18321 20383 1 16 . 1 1 15 15 TYR CA C 15 56.609 56.609 57.713 -1.104 18321 20384 1 16 . 1 1 15 15 TYR CB C 15 36.940 36.940 38.975 -2.035 18321 20385 1 16 . 1 1 15 15 TYR H H 15 8.221 8.221 7.843 0.378 18321 20386 1 16 . 1 1 16 16 MET N N 16 126.031 126.031 125.925 0.106 18321 20387 1 16 . 1 1 16 16 MET HA H 16 4.462 4.462 4.410 0.052 18321 20388 1 16 . 1 1 16 16 MET CA C 16 53.046 53.046 53.244 -0.198 18321 20389 1 16 . 1 1 16 16 MET CB C 16 41.114 41.114 31.870 9.243 18321 20390 1 16 . 1 1 16 16 MET H H 16 8.989 8.989 8.771 0.218 18321 20391 1 16 . 1 1 17 17 GLY CA C 17 45.803 45.803 45.452 0.351 18321 20392 1 16 . 1 1 18 18 PRO HA H 18 4.675 4.675 4.415 0.260 18321 20393 1 16 . 1 1 18 18 PRO C C 18 175.943 175.943 175.421 0.522 18321 20394 1 16 . 1 1 18 18 PRO CA C 18 63.647 63.647 63.552 0.095 18321 20395 1 16 . 1 1 18 18 PRO CB C 18 29.276 29.276 30.111 -0.835 18321 20396 1 16 . 1 1 19 19 VAL N N 19 126.159 126.159 122.105 4.054 18321 20397 1 16 . 1 1 19 19 VAL HA H 19 4.011 4.011 4.482 -0.471 18321 20398 1 16 . 1 1 19 19 VAL C C 19 175.812 175.812 174.824 0.988 18321 20399 1 16 . 1 1 19 19 VAL CA C 19 62.355 62.355 60.186 2.169 18321 20400 1 16 . 1 1 19 19 VAL CB C 19 33.468 33.468 35.969 -2.501 18321 20401 1 16 . 1 1 19 19 VAL H H 19 7.851 7.851 7.785 0.066 18321 20402 1 16 . 1 1 20 20 SER N N 20 123.950 123.950 118.546 5.404 18321 20403 1 16 . 1 1 20 20 SER HA H 20 4.453 4.453 4.977 -0.524 18321 20404 1 16 . 1 1 20 20 SER CA C 20 57.631 57.631 56.657 0.974 18321 20405 1 16 . 1 1 20 20 SER CB C 20 65.951 65.951 66.129 -0.178 18321 20406 1 16 . 1 1 20 20 SER H H 20 8.800 8.800 8.099 0.701 18321 20407 1 16 . 1 1 21 21 ARG N N 21 123.461 123.461 121.650 1.811 18321 20408 1 16 . 1 1 21 21 ARG HA H 21 3.489 3.489 4.019 -0.530 18321 20409 1 16 . 1 1 21 21 ARG C C 21 178.164 178.164 178.858 -0.694 18321 20410 1 16 . 1 1 21 21 ARG CA C 21 60.025 60.025 59.969 0.056 18321 20411 1 16 . 1 1 21 21 ARG CB C 21 30.334 30.334 29.271 1.063 18321 20412 1 16 . 1 1 21 21 ARG H H 21 9.307 9.307 8.900 0.407 18321 20413 1 16 . 1 1 22 22 GLN N N 22 116.591 116.591 116.761 -0.170 18321 20414 1 16 . 1 1 22 22 GLN HA H 22 4.008 4.008 4.162 -0.154 18321 20415 1 16 . 1 1 22 22 GLN CA C 22 59.095 59.095 58.618 0.477 18321 20416 1 16 . 1 1 22 22 GLN CB C 22 29.249 29.249 28.083 1.166 18321 20417 1 16 . 1 1 22 22 GLN H H 22 8.394 8.394 8.753 -0.359 18321 20418 1 16 . 1 1 23 23 GLU N N 23 122.191 122.191 121.068 1.123 18321 20419 1 16 . 1 1 23 23 GLU HA H 23 4.037 4.037 4.042 -0.005 18321 20420 1 16 . 1 1 23 23 GLU C C 23 178.986 178.986 178.825 0.161 18321 20421 1 16 . 1 1 23 23 GLU CA C 23 59.081 59.081 58.812 0.269 18321 20422 1 16 . 1 1 23 23 GLU CB C 23 31.896 31.896 29.578 2.318 18321 20423 1 16 . 1 1 23 23 GLU H H 23 8.106 8.106 7.585 0.521 18321 20424 1 16 . 1 1 24 24 ALA N N 24 121.964 121.964 121.385 0.579 18321 20425 1 16 . 1 1 24 24 ALA HA H 24 3.762 3.762 3.980 -0.218 18321 20426 1 16 . 1 1 24 24 ALA C C 24 178.653 178.653 179.755 -1.102 18321 20427 1 16 . 1 1 24 24 ALA CA C 24 55.480 55.480 54.940 0.540 18321 20428 1 16 . 1 1 24 24 ALA CB C 24 18.049 18.049 18.286 -0.237 18321 20429 1 16 . 1 1 24 24 ALA H H 24 8.732 8.732 8.234 0.498 18321 20430 1 16 . 1 1 25 25 GLN N N 25 116.229 116.229 118.962 -2.733 18321 20431 1 16 . 1 1 25 25 GLN HA H 25 3.950 3.950 3.984 -0.034 18321 20432 1 16 . 1 1 25 25 GLN C C 25 177.442 177.442 178.054 -0.612 18321 20433 1 16 . 1 1 25 25 GLN CA C 25 59.651 59.651 58.932 0.719 18321 20434 1 16 . 1 1 25 25 GLN CB C 25 29.308 29.308 28.349 0.959 18321 20435 1 16 . 1 1 25 25 GLN H H 25 8.391 8.391 8.248 0.143 18321 20436 1 16 . 1 1 26 26 THR N N 26 115.105 115.105 113.498 1.607 18321 20437 1 16 . 1 1 26 26 THR HA H 26 3.920 3.920 4.142 -0.222 18321 20438 1 16 . 1 1 26 26 THR C C 26 176.835 176.835 176.056 0.779 18321 20439 1 16 . 1 1 26 26 THR CA C 26 66.335 66.335 63.433 2.902 18321 20440 1 16 . 1 1 26 26 THR CB C 26 68.876 68.876 68.140 0.736 18321 20441 1 16 . 1 1 26 26 THR H H 26 8.223 8.223 7.568 0.655 18321 20442 1 16 . 1 1 27 27 ARG N N 27 119.096 119.096 118.932 0.164 18321 20443 1 16 . 1 1 27 27 ARG HA H 27 4.047 4.047 4.221 -0.174 18321 20444 1 16 . 1 1 27 27 ARG C C 27 177.245 177.245 177.049 0.196 18321 20445 1 16 . 1 1 27 27 ARG CA C 27 58.528 58.528 57.041 1.487 18321 20446 1 16 . 1 1 27 27 ARG CB C 27 30.184 30.184 30.214 -0.030 18321 20447 1 16 . 1 1 27 27 ARG H H 27 8.093 8.093 7.661 0.432 18321 20448 1 16 . 1 1 28 28 LEU N N 28 114.602 114.602 116.261 -1.659 18321 20449 1 16 . 1 1 28 28 LEU HA H 28 4.325 4.325 4.513 -0.188 18321 20450 1 16 . 1 1 28 28 LEU C C 28 177.197 177.197 175.779 1.418 18321 20451 1 16 . 1 1 28 28 LEU CA C 28 55.143 55.143 54.471 0.672 18321 20452 1 16 . 1 1 28 28 LEU CB C 28 44.902 44.902 43.181 1.721 18321 20453 1 16 . 1 1 28 28 LEU H H 28 7.438 7.438 7.795 -0.357 18321 20454 1 16 . 1 1 29 29 GLN N N 29 121.312 121.312 121.311 0.001 18321 20455 1 16 . 1 1 29 29 GLN HA H 29 3.856 3.856 4.167 -0.311 18321 20456 1 16 . 1 1 29 29 GLN C C 29 178.048 178.048 176.904 1.144 18321 20457 1 16 . 1 1 29 29 GLN CA C 29 57.691 57.691 56.309 1.382 18321 20458 1 16 . 1 1 29 29 GLN CB C 29 27.293 27.293 28.059 -0.766 18321 20459 1 16 . 1 1 29 29 GLN H H 29 8.250 8.250 8.240 0.010 18321 20460 1 16 . 1 1 30 30 GLY N N 30 116.768 116.768 116.180 0.588 18321 20461 1 16 . 1 1 30 30 GLY C C 30 174.914 174.914 174.634 0.280 18321 20462 1 16 . 1 1 30 30 GLY CA C 30 45.491 45.491 46.072 -0.581 18321 20463 1 16 . 1 1 30 30 GLY H H 30 9.135 9.135 8.749 0.386 18321 20464 1 16 . 1 1 31 31 GLN N N 31 117.979 117.979 120.007 -2.028 18321 20465 1 16 . 1 1 31 31 GLN HA H 31 4.329 4.329 4.173 0.156 18321 20466 1 16 . 1 1 31 31 GLN C C 31 177.174 177.174 176.503 0.671 18321 20467 1 16 . 1 1 31 31 GLN CA C 31 53.910 53.910 58.042 -4.132 18321 20468 1 16 . 1 1 31 31 GLN CB C 31 29.574 29.574 29.403 0.171 18321 20469 1 16 . 1 1 31 31 GLN H H 31 7.695 7.695 7.722 -0.027 18321 20470 1 16 . 1 1 32 32 ARG N N 32 123.918 123.918 113.369 10.549 18321 20471 1 16 . 1 1 32 32 ARG HA H 32 3.940 3.940 4.270 -0.330 18321 20472 1 16 . 1 1 32 32 ARG C C 32 175.810 175.810 175.371 0.439 18321 20473 1 16 . 1 1 32 32 ARG CA C 32 56.770 56.770 55.396 1.374 18321 20474 1 16 . 1 1 32 32 ARG CB C 32 30.074 30.074 32.739 -2.665 18321 20475 1 16 . 1 1 32 32 ARG H H 32 8.955 8.955 8.024 0.931 18321 20476 1 16 . 1 1 33 33 HIS N N 33 122.248 122.248 116.885 5.363 18321 20477 1 16 . 1 1 33 33 HIS HA H 33 4.627 4.627 4.128 0.499 18321 20478 1 16 . 1 1 33 33 HIS C C 33 177.089 177.089 176.237 0.852 18321 20479 1 16 . 1 1 33 33 HIS CA C 33 55.858 55.858 56.408 -0.550 18321 20480 1 16 . 1 1 33 33 HIS CB C 33 28.648 28.648 29.099 -0.451 18321 20481 1 16 . 1 1 33 33 HIS H H 33 8.302 8.302 7.815 0.487 18321 20482 1 16 . 1 1 34 34 GLY N N 34 109.518 109.518 104.360 5.158 18321 20483 1 16 . 1 1 34 34 GLY C C 34 176.730 176.730 173.947 2.783 18321 20484 1 16 . 1 1 34 34 GLY CA C 34 45.967 45.967 45.691 0.276 18321 20485 1 16 . 1 1 34 34 GLY H H 34 9.496 9.496 8.791 0.705 18321 20486 1 16 . 1 1 35 35 MET N N 35 125.193 125.193 121.577 3.616 18321 20487 1 16 . 1 1 35 35 MET HA H 35 5.750 5.750 5.768 -0.018 18321 20488 1 16 . 1 1 35 35 MET C C 35 174.388 174.388 175.390 -1.002 18321 20489 1 16 . 1 1 35 35 MET CA C 35 55.762 55.762 55.678 0.084 18321 20490 1 16 . 1 1 35 35 MET CB C 35 32.706 32.706 34.196 -1.490 18321 20491 1 16 . 1 1 35 35 MET H H 35 8.359 8.359 7.470 0.889 18321 20492 1 16 . 1 1 36 36 PHE N N 36 123.311 123.311 116.834 6.477 18321 20493 1 16 . 1 1 36 36 PHE HA H 36 5.985 5.985 5.773 0.212 18321 20494 1 16 . 1 1 36 36 PHE C C 36 172.140 172.140 172.992 -0.852 18321 20495 1 16 . 1 1 36 36 PHE CA C 36 55.755 55.755 55.218 0.537 18321 20496 1 16 . 1 1 36 36 PHE CB C 36 45.197 45.197 42.810 2.387 18321 20497 1 16 . 1 1 36 36 PHE H H 36 8.261 8.261 7.991 0.270 18321 20498 1 16 . 1 1 37 37 LEU N N 37 114.652 114.652 116.498 -1.846 18321 20499 1 16 . 1 1 37 37 LEU HA H 37 4.489 4.489 5.101 -0.612 18321 20500 1 16 . 1 1 37 37 LEU C C 37 174.033 174.033 174.822 -0.789 18321 20501 1 16 . 1 1 37 37 LEU CA C 37 55.382 55.382 54.496 0.886 18321 20502 1 16 . 1 1 37 37 LEU CB C 37 44.791 44.791 45.479 -0.688 18321 20503 1 16 . 1 1 37 37 LEU H H 37 9.292 9.292 9.227 0.065 18321 20504 1 16 . 1 1 38 38 VAL N N 38 121.009 121.009 123.367 -2.358 18321 20505 1 16 . 1 1 38 38 VAL HA H 38 5.504 5.504 4.932 0.572 18321 20506 1 16 . 1 1 38 38 VAL C C 38 173.581 173.581 175.354 -1.773 18321 20507 1 16 . 1 1 38 38 VAL CA C 38 61.316 61.316 61.848 -0.532 18321 20508 1 16 . 1 1 38 38 VAL CB C 38 33.302 33.302 33.651 -0.349 18321 20509 1 16 . 1 1 38 38 VAL H H 38 8.991 8.991 8.572 0.419 18321 20510 1 16 . 1 1 39 39 ARG N N 39 124.863 124.863 126.760 -1.897 18321 20511 1 16 . 1 1 39 39 ARG HA H 39 5.444 5.444 5.032 0.412 18321 20512 1 16 . 1 1 39 39 ARG C C 39 175.772 175.772 174.809 0.963 18321 20513 1 16 . 1 1 39 39 ARG CA C 39 52.558 52.558 53.286 -0.729 18321 20514 1 16 . 1 1 39 39 ARG CB C 39 34.980 34.980 33.315 1.665 18321 20515 1 16 . 1 1 39 39 ARG H H 39 9.569 9.569 8.379 1.190 18321 20516 1 16 . 1 1 40 40 ASP N N 40 122.330 122.330 120.365 1.965 18321 20517 1 16 . 1 1 40 40 ASP HA H 40 4.785 4.785 4.918 -0.133 18321 20518 1 16 . 1 1 40 40 ASP C C 40 176.332 176.332 176.019 0.313 18321 20519 1 16 . 1 1 40 40 ASP CA C 40 55.334 55.334 55.531 -0.197 18321 20520 1 16 . 1 1 40 40 ASP CB C 40 40.650 40.650 41.955 -1.304 18321 20521 1 16 . 1 1 40 40 ASP H H 40 8.413 8.413 8.521 -0.108 18321 20522 1 16 . 1 1 41 41 SER N N 41 114.363 114.363 119.233 -4.870 18321 20523 1 16 . 1 1 41 41 SER HA H 41 4.506 4.506 4.455 0.051 18321 20524 1 16 . 1 1 41 41 SER CA C 41 57.525 57.525 57.771 -0.246 18321 20525 1 16 . 1 1 41 41 SER CB C 41 63.706 63.706 63.858 -0.152 18321 20526 1 16 . 1 1 41 41 SER H H 41 7.791 7.791 8.175 -0.384 18321 20527 1 16 . 1 1 42 42 SER N N 42 126.932 126.932 118.539 8.393 18321 20528 1 16 . 1 1 42 42 SER HA H 42 4.410 4.410 4.774 -0.364 18321 20529 1 16 . 1 1 42 42 SER CA C 42 60.362 60.362 58.771 1.591 18321 20530 1 16 . 1 1 42 42 SER CB C 42 63.707 63.707 63.673 0.034 18321 20531 1 16 . 1 1 42 42 SER H H 42 10.519 10.519 8.662 1.857 18321 20532 1 16 . 1 1 43 43 THR HA H 43 4.097 4.097 4.418 -0.321 18321 20533 1 16 . 1 1 43 43 THR CA C 43 64.722 64.722 62.943 1.779 18321 20534 1 16 . 1 1 43 43 THR CB C 43 69.439 69.439 69.725 -0.286 18321 20535 1 16 . 1 1 44 44 CYS HA H 44 5.100 5.100 4.802 0.298 18321 20536 1 16 . 1 1 44 44 CYS CA C 44 51.779 51.779 54.888 -3.109 18321 20537 1 16 . 1 1 44 44 CYS CB C 44 41.314 41.314 28.339 12.975 18321 20538 1 16 . 1 1 45 45 PRO HA H 45 4.278 4.278 4.212 0.066 18321 20539 1 16 . 1 1 45 45 PRO C C 45 178.127 178.127 177.588 0.539 18321 20540 1 16 . 1 1 45 45 PRO CA C 45 64.151 64.151 64.183 -0.032 18321 20541 1 16 . 1 1 45 45 PRO CB C 45 31.596 31.596 31.090 0.506 18321 20542 1 16 . 1 1 46 46 GLY N N 46 114.947 114.947 113.830 1.117 18321 20543 1 16 . 1 1 46 46 GLY C C 46 174.701 174.701 173.702 0.999 18321 20544 1 16 . 1 1 46 46 GLY CA C 46 45.225 45.225 44.807 0.418 18321 20545 1 16 . 1 1 46 46 GLY H H 46 8.812 8.812 8.792 0.020 18321 20546 1 16 . 1 1 47 47 ASP N N 47 120.862 120.862 121.952 -1.090 18321 20547 1 16 . 1 1 47 47 ASP HA H 47 5.235 5.235 4.935 0.300 18321 20548 1 16 . 1 1 47 47 ASP C C 47 176.480 176.480 175.148 1.332 18321 20549 1 16 . 1 1 47 47 ASP CA C 47 53.591 53.591 53.672 -0.082 18321 20550 1 16 . 1 1 47 47 ASP CB C 47 41.707 41.707 42.263 -0.556 18321 20551 1 16 . 1 1 47 47 ASP H H 47 7.997 7.997 7.638 0.359 18321 20552 1 16 . 1 1 48 48 TYR N N 48 118.473 118.473 116.152 2.321 18321 20553 1 16 . 1 1 48 48 TYR HA H 48 5.431 5.431 5.312 0.119 18321 20554 1 16 . 1 1 48 48 TYR C C 48 173.783 173.783 175.637 -1.854 18321 20555 1 16 . 1 1 48 48 TYR CA C 48 56.891 56.891 56.496 0.395 18321 20556 1 16 . 1 1 48 48 TYR CB C 48 43.274 43.274 43.309 -0.035 18321 20557 1 16 . 1 1 48 48 TYR H H 48 8.892 8.892 9.149 -0.257 18321 20558 1 16 . 1 1 49 49 VAL N N 49 119.105 119.105 119.113 -0.008 18321 20559 1 16 . 1 1 49 49 VAL HA H 49 4.800 4.800 4.557 0.243 18321 20560 1 16 . 1 1 49 49 VAL C C 49 174.397 174.397 174.583 -0.186 18321 20561 1 16 . 1 1 49 49 VAL CA C 49 61.439 61.439 61.928 -0.489 18321 20562 1 16 . 1 1 49 49 VAL CB C 49 35.388 35.388 34.675 0.713 18321 20563 1 16 . 1 1 49 49 VAL H H 49 9.661 9.661 8.566 1.095 18321 20564 1 16 . 1 1 50 50 LEU N N 50 129.599 129.599 131.217 -1.618 18321 20565 1 16 . 1 1 50 50 LEU HA H 50 5.033 5.033 5.158 -0.125 18321 20566 1 16 . 1 1 50 50 LEU C C 50 175.001 175.001 175.246 -0.245 18321 20567 1 16 . 1 1 50 50 LEU CA C 50 53.352 53.352 53.781 -0.428 18321 20568 1 16 . 1 1 50 50 LEU CB C 50 44.062 44.062 42.554 1.508 18321 20569 1 16 . 1 1 50 50 LEU H H 50 9.405 9.405 9.309 0.096 18321 20570 1 16 . 1 1 51 51 SER N N 51 126.895 126.895 124.235 2.660 18321 20571 1 16 . 1 1 51 51 SER HA H 51 5.731 5.731 5.014 0.717 18321 20572 1 16 . 1 1 51 51 SER C C 51 173.094 173.094 173.547 -0.453 18321 20573 1 16 . 1 1 51 51 SER CA C 51 58.834 58.834 57.683 1.151 18321 20574 1 16 . 1 1 51 51 SER CB C 51 64.977 64.977 64.121 0.856 18321 20575 1 16 . 1 1 51 51 SER H H 51 9.094 9.094 9.398 -0.304 18321 20576 1 16 . 1 1 52 52 VAL N N 52 121.777 121.777 125.450 -3.673 18321 20577 1 16 . 1 1 52 52 VAL HA H 52 5.066 5.066 4.602 0.464 18321 20578 1 16 . 1 1 52 52 VAL C C 52 174.573 174.573 174.849 -0.276 18321 20579 1 16 . 1 1 52 52 VAL CA C 52 59.535 59.535 60.715 -1.180 18321 20580 1 16 . 1 1 52 52 VAL CB C 52 36.834 36.834 35.606 1.228 18321 20581 1 16 . 1 1 52 52 VAL H H 52 8.816 8.816 8.835 -0.019 18321 20582 1 16 . 1 1 53 53 SER N N 53 120.489 120.489 121.647 -1.158 18321 20583 1 16 . 1 1 53 53 SER HA H 53 4.811 4.811 5.202 -0.391 18321 20584 1 16 . 1 1 53 53 SER C C 53 174.065 174.065 173.265 0.800 18321 20585 1 16 . 1 1 53 53 SER CA C 53 57.496 57.496 57.668 -0.172 18321 20586 1 16 . 1 1 53 53 SER CB C 53 62.623 62.623 63.708 -1.085 18321 20587 1 16 . 1 1 53 53 SER H H 53 8.780 8.780 9.062 -0.282 18321 20588 1 16 . 1 1 54 54 GLU N N 54 132.020 132.020 126.800 5.220 18321 20589 1 16 . 1 1 54 54 GLU HA H 54 4.250 4.250 3.960 0.290 18321 20590 1 16 . 1 1 54 54 GLU C C 54 175.387 175.387 174.578 0.809 18321 20591 1 16 . 1 1 54 54 GLU CA C 54 56.999 56.999 55.870 1.129 18321 20592 1 16 . 1 1 54 54 GLU CB C 54 32.556 32.556 32.088 0.468 18321 20593 1 16 . 1 1 54 54 GLU H H 54 8.472 8.472 7.958 0.514 18321 20594 1 16 . 1 1 55 55 ASN N N 55 126.517 126.517 120.063 6.454 18321 20595 1 16 . 1 1 55 55 ASN HA H 55 4.220 4.220 4.322 -0.102 18321 20596 1 16 . 1 1 55 55 ASN C C 55 174.546 174.546 174.546 0.000 18321 20597 1 16 . 1 1 55 55 ASN CA C 55 54.770 54.770 54.453 0.317 18321 20598 1 16 . 1 1 55 55 ASN CB C 55 37.314 37.314 37.713 -0.399 18321 20599 1 16 . 1 1 55 55 ASN H H 55 8.853 8.853 8.865 -0.012 18321 20600 1 16 . 1 1 56 56 SER N N 56 112.009 112.009 107.113 4.896 18321 20601 1 16 . 1 1 56 56 SER HA H 56 4.334 4.334 4.418 -0.084 18321 20602 1 16 . 1 1 56 56 SER C C 56 173.354 173.354 174.503 -1.149 18321 20603 1 16 . 1 1 56 56 SER CA C 56 59.966 59.966 61.909 -1.943 18321 20604 1 16 . 1 1 56 56 SER CB C 56 62.242 62.242 62.500 -0.258 18321 20605 1 16 . 1 1 56 56 SER H H 56 10.418 10.418 8.394 2.024 18321 20606 1 16 . 1 1 57 57 ARG N N 57 121.764 121.764 116.853 4.911 18321 20607 1 16 . 1 1 57 57 ARG HA H 57 5.167 5.167 4.660 0.507 18321 20608 1 16 . 1 1 57 57 ARG C C 57 174.983 174.983 174.790 0.193 18321 20609 1 16 . 1 1 57 57 ARG CA C 57 54.550 54.550 56.814 -2.264 18321 20610 1 16 . 1 1 57 57 ARG CB C 57 31.886 31.886 32.021 -0.135 18321 20611 1 16 . 1 1 57 57 ARG H H 57 8.097 8.097 7.790 0.307 18321 20612 1 16 . 1 1 58 58 VAL N N 58 121.866 121.866 118.872 2.994 18321 20613 1 16 . 1 1 58 58 VAL HA H 58 4.768 4.768 5.020 -0.252 18321 20614 1 16 . 1 1 58 58 VAL C C 58 175.388 175.388 174.143 1.245 18321 20615 1 16 . 1 1 58 58 VAL CA C 58 61.818 61.818 60.498 1.319 18321 20616 1 16 . 1 1 58 58 VAL CB C 58 34.135 34.135 35.095 -0.960 18321 20617 1 16 . 1 1 58 58 VAL H H 58 8.081 8.081 7.624 0.457 18321 20618 1 16 . 1 1 59 59 SER N N 59 124.445 124.445 121.538 2.907 18321 20619 1 16 . 1 1 59 59 SER HA H 59 4.462 4.462 4.556 -0.094 18321 20620 1 16 . 1 1 59 59 SER C C 59 172.185 172.185 173.209 -1.024 18321 20621 1 16 . 1 1 59 59 SER CA C 59 56.629 56.629 56.628 0.001 18321 20622 1 16 . 1 1 59 59 SER CB C 59 66.218 66.218 63.657 2.561 18321 20623 1 16 . 1 1 59 59 SER H H 59 9.082 9.082 8.794 0.288 18321 20624 1 16 . 1 1 60 60 HIS N N 60 121.224 121.224 126.000 -4.776 18321 20625 1 16 . 1 1 60 60 HIS HA H 60 4.885 4.885 4.722 0.163 18321 20626 1 16 . 1 1 60 60 HIS C C 60 174.674 174.674 174.280 0.394 18321 20627 1 16 . 1 1 60 60 HIS CA C 60 54.900 54.900 55.587 -0.686 18321 20628 1 16 . 1 1 60 60 HIS CB C 60 32.331 32.331 30.262 2.069 18321 20629 1 16 . 1 1 60 60 HIS H H 60 8.331 8.331 8.567 -0.236 18321 20630 1 16 . 1 1 61 61 TYR N N 61 124.780 124.780 124.431 0.349 18321 20631 1 16 . 1 1 61 61 TYR HA H 61 4.655 4.655 4.764 -0.109 18321 20632 1 16 . 1 1 61 61 TYR CA C 61 57.409 57.409 56.251 1.158 18321 20633 1 16 . 1 1 61 61 TYR CB C 61 39.785 39.785 39.443 0.342 18321 20634 1 16 . 1 1 61 61 TYR H H 61 9.273 9.273 9.338 -0.065 18321 20635 1 16 . 1 1 62 62 ILE HA H 62 4.298 4.298 4.303 -0.005 18321 20636 1 16 . 1 1 62 62 ILE C C 62 174.817 174.817 175.193 -0.376 18321 20637 1 16 . 1 1 62 62 ILE CA C 62 61.908 61.908 61.776 0.132 18321 20638 1 16 . 1 1 62 62 ILE CB C 62 38.321 38.321 39.081 -0.760 18321 20639 1 16 . 1 1 63 63 ILE N N 63 128.552 128.552 127.784 0.768 18321 20640 1 16 . 1 1 63 63 ILE HA H 63 4.788 4.788 4.847 -0.059 18321 20641 1 16 . 1 1 63 63 ILE C C 63 175.982 175.982 175.001 0.981 18321 20642 1 16 . 1 1 63 63 ILE CA C 63 59.629 59.629 59.788 -0.158 18321 20643 1 16 . 1 1 63 63 ILE CB C 63 39.747 39.747 38.918 0.829 18321 20644 1 16 . 1 1 63 63 ILE H H 63 9.155 9.155 8.859 0.296 18321 20645 1 16 . 1 1 64 64 ASN N N 64 123.240 123.240 126.957 -3.717 18321 20646 1 16 . 1 1 64 64 ASN HA H 64 4.857 4.857 5.236 -0.379 18321 20647 1 16 . 1 1 64 64 ASN C C 64 175.324 175.324 174.118 1.206 18321 20648 1 16 . 1 1 64 64 ASN CA C 64 53.736 53.736 53.511 0.225 18321 20649 1 16 . 1 1 64 64 ASN CB C 64 41.531 41.531 40.061 1.470 18321 20650 1 16 . 1 1 64 64 ASN H H 64 9.379 9.379 9.098 0.281 18321 20651 1 16 . 1 1 65 65 SER N N 65 121.157 121.157 117.464 3.693 18321 20652 1 16 . 1 1 65 65 SER HA H 65 4.548 4.548 4.666 -0.118 18321 20653 1 16 . 1 1 65 65 SER C C 65 174.328 174.328 174.722 -0.394 18321 20654 1 16 . 1 1 65 65 SER CA C 65 58.306 58.306 58.437 -0.131 18321 20655 1 16 . 1 1 65 65 SER CB C 65 62.878 62.878 63.444 -0.566 18321 20656 1 16 . 1 1 65 65 SER H H 65 9.195 9.195 9.274 -0.079 18321 20657 1 16 . 1 1 66 66 LEU N N 66 127.417 127.417 129.629 -2.212 18321 20658 1 16 . 1 1 66 66 LEU HA H 66 4.605 4.605 4.639 -0.034 18321 20659 1 16 . 1 1 66 66 LEU CA C 66 52.888 52.888 52.558 0.330 18321 20660 1 16 . 1 1 66 66 LEU CB C 66 41.799 41.799 41.842 -0.043 18321 20661 1 16 . 1 1 66 66 LEU H H 66 8.143 8.143 8.625 -0.482 18321 20662 1 16 . 1 1 68 68 ASN HA H 68 4.386 4.386 4.636 -0.250 18321 20663 1 16 . 1 1 68 68 ASN C C 68 174.487 174.487 174.903 -0.416 18321 20664 1 16 . 1 1 68 68 ASN CA C 68 53.365 53.365 52.935 0.430 18321 20665 1 16 . 1 1 68 68 ASN CB C 68 36.778 36.778 38.428 -1.650 18321 20666 1 16 . 1 1 69 69 ARG N N 69 111.329 111.329 114.463 -3.134 18321 20667 1 16 . 1 1 69 69 ARG HA H 69 3.876 3.876 3.759 0.117 18321 20668 1 16 . 1 1 69 69 ARG CA C 69 57.393 57.393 57.259 0.134 18321 20669 1 16 . 1 1 69 69 ARG CB C 69 26.665 26.665 27.041 -0.376 18321 20670 1 16 . 1 1 69 69 ARG H H 69 8.191 8.191 7.945 0.246 18321 20671 1 16 . 1 1 70 70 ARG N N 70 116.120 116.120 116.441 -0.321 18321 20672 1 16 . 1 1 70 70 ARG HA H 70 4.556 4.556 4.637 -0.081 18321 20673 1 16 . 1 1 70 70 ARG C C 70 174.882 174.882 174.322 0.560 18321 20674 1 16 . 1 1 70 70 ARG CA C 70 55.509 55.509 53.679 1.830 18321 20675 1 16 . 1 1 70 70 ARG CB C 70 31.771 31.771 33.547 -1.776 18321 20676 1 16 . 1 1 70 70 ARG H H 70 6.667 6.667 7.231 -0.564 18321 20677 1 16 . 1 1 71 71 PHE N N 71 116.313 116.313 116.836 -0.523 18321 20678 1 16 . 1 1 71 71 PHE HA H 71 5.540 5.540 5.734 -0.194 18321 20679 1 16 . 1 1 71 71 PHE C C 71 174.391 174.391 174.723 -0.332 18321 20680 1 16 . 1 1 71 71 PHE CA C 71 57.528 57.528 56.244 1.284 18321 20681 1 16 . 1 1 71 71 PHE CB C 71 44.115 44.115 43.664 0.451 18321 20682 1 16 . 1 1 71 71 PHE H H 71 8.700 8.700 8.269 0.431 18321 20683 1 16 . 1 1 72 72 LYS N N 72 122.770 122.770 121.979 0.791 18321 20684 1 16 . 1 1 72 72 LYS HA H 72 5.483 5.483 5.117 0.366 18321 20685 1 16 . 1 1 72 72 LYS C C 72 173.923 173.923 175.403 -1.480 18321 20686 1 16 . 1 1 72 72 LYS CA C 72 54.855 54.855 55.114 -0.259 18321 20687 1 16 . 1 1 72 72 LYS CB C 72 37.710 37.710 35.329 2.381 18321 20688 1 16 . 1 1 72 72 LYS H H 72 9.138 9.138 8.898 0.240 18321 20689 1 16 . 1 1 73 73 ILE N N 73 124.576 124.576 127.773 -3.197 18321 20690 1 16 . 1 1 73 73 ILE HA H 73 4.955 4.955 4.946 0.009 18321 20691 1 16 . 1 1 73 73 ILE C C 73 175.728 175.728 176.281 -0.553 18321 20692 1 16 . 1 1 73 73 ILE CA C 73 58.935 58.935 59.963 -1.028 18321 20693 1 16 . 1 1 73 73 ILE CB C 73 40.965 40.965 38.639 2.326 18321 20694 1 16 . 1 1 73 73 ILE H H 73 8.826 8.826 8.551 0.275 18321 20695 1 16 . 1 1 74 74 GLY N N 74 118.718 118.718 118.677 0.041 18321 20696 1 16 . 1 1 74 74 GLY C C 74 174.436 174.436 174.824 -0.388 18321 20697 1 16 . 1 1 74 74 GLY CA C 74 47.401 47.401 45.623 1.778 18321 20698 1 16 . 1 1 74 74 GLY H H 74 9.317 9.317 9.126 0.191 18321 20699 1 16 . 1 1 75 75 ASP N N 75 125.691 125.691 120.604 5.087 18321 20700 1 16 . 1 1 75 75 ASP HA H 75 4.713 4.713 4.145 0.568 18321 20701 1 16 . 1 1 75 75 ASP C C 75 175.841 175.841 175.829 0.012 18321 20702 1 16 . 1 1 75 75 ASP CA C 75 53.815 53.815 56.953 -3.138 18321 20703 1 16 . 1 1 75 75 ASP CB C 75 41.288 41.288 40.125 1.163 18321 20704 1 16 . 1 1 75 75 ASP H H 75 8.665 8.665 8.909 -0.244 18321 20705 1 16 . 1 1 76 76 GLN N N 76 120.368 120.368 120.756 -0.388 18321 20706 1 16 . 1 1 76 76 GLN C C 76 173.630 173.630 175.097 -1.467 18321 20707 1 16 . 1 1 76 76 GLN CA C 76 54.254 54.254 56.251 -1.997 18321 20708 1 16 . 1 1 76 76 GLN CB C 76 31.248 31.248 29.489 1.758 18321 20709 1 16 . 1 1 76 76 GLN H H 76 8.289 8.289 7.887 0.402 18321 20710 1 16 . 1 1 77 77 GLU N N 77 120.435 120.435 120.654 -0.219 18321 20711 1 16 . 1 1 77 77 GLU C C 77 175.484 175.484 175.722 -0.238 18321 20712 1 16 . 1 1 77 77 GLU CA C 77 54.203 54.203 55.976 -1.773 18321 20713 1 16 . 1 1 77 77 GLU CB C 77 33.141 33.141 30.567 2.574 18321 20714 1 16 . 1 1 77 77 GLU H H 77 7.732 7.732 8.282 -0.550 18321 20715 1 16 . 1 1 78 78 PHE N N 78 117.911 117.911 122.271 -4.360 18321 20716 1 16 . 1 1 78 78 PHE HA H 78 4.659 4.659 4.714 -0.055 18321 20717 1 16 . 1 1 78 78 PHE C C 78 175.673 175.673 175.196 0.477 18321 20718 1 16 . 1 1 78 78 PHE CA C 78 57.160 57.160 57.226 -0.066 18321 20719 1 16 . 1 1 78 78 PHE CB C 78 45.405 45.405 41.553 3.852 18321 20720 1 16 . 1 1 78 78 PHE H H 78 9.235 9.235 8.258 0.977 18321 20721 1 16 . 1 1 79 79 ASP N N 79 119.296 119.296 119.088 0.208 18321 20722 1 16 . 1 1 79 79 ASP HA H 79 4.462 4.462 4.479 -0.017 18321 20723 1 16 . 1 1 79 79 ASP C C 79 174.482 174.482 175.433 -0.951 18321 20724 1 16 . 1 1 79 79 ASP CA C 79 56.629 56.629 57.192 -0.563 18321 20725 1 16 . 1 1 79 79 ASP CB C 79 41.697 41.697 41.291 0.406 18321 20726 1 16 . 1 1 79 79 ASP H H 79 9.187 9.187 8.705 0.482 18321 20727 1 16 . 1 1 80 80 HIS N N 80 107.631 107.631 111.582 -3.951 18321 20728 1 16 . 1 1 80 80 HIS HA H 80 5.022 5.022 5.080 -0.058 18321 20729 1 16 . 1 1 80 80 HIS C C 80 174.626 174.626 175.401 -0.775 18321 20730 1 16 . 1 1 80 80 HIS CA C 80 54.223 54.223 55.216 -0.993 18321 20731 1 16 . 1 1 80 80 HIS CB C 80 32.205 32.205 30.892 1.313 18321 20732 1 16 . 1 1 80 80 HIS H H 80 7.200 7.200 7.568 -0.368 18321 20733 1 16 . 1 1 81 81 LEU N N 81 120.710 120.710 120.962 -0.252 18321 20734 1 16 . 1 1 81 81 LEU HA H 81 3.804 3.804 4.088 -0.284 18321 20735 1 16 . 1 1 81 81 LEU CA C 81 58.709 58.709 60.228 -1.519 18321 20736 1 16 . 1 1 81 81 LEU CB C 81 39.646 39.646 39.965 -0.319 18321 20737 1 16 . 1 1 81 81 LEU H H 81 8.886 8.886 9.006 -0.120 18321 20738 1 16 . 1 1 82 82 PRO HA H 82 4.020 4.020 4.217 -0.197 18321 20739 1 16 . 1 1 82 82 PRO C C 82 175.619 175.619 176.423 -0.804 18321 20740 1 16 . 1 1 82 82 PRO CA C 82 67.025 67.025 64.466 2.559 18321 20741 1 16 . 1 1 82 82 PRO CB C 82 30.962 30.962 30.925 0.037 18321 20742 1 16 . 1 1 83 83 ALA N N 83 124.281 124.281 118.919 5.362 18321 20743 1 16 . 1 1 83 83 ALA HA H 83 4.019 4.019 4.302 -0.283 18321 20744 1 16 . 1 1 83 83 ALA C C 83 179.709 179.709 178.312 1.397 18321 20745 1 16 . 1 1 83 83 ALA CA C 83 54.985 54.985 53.356 1.629 18321 20746 1 16 . 1 1 83 83 ALA CB C 83 18.425 18.425 19.937 -1.512 18321 20747 1 16 . 1 1 83 83 ALA H H 83 8.527 8.527 7.681 0.846 18321 20748 1 16 . 1 1 84 84 LEU N N 84 122.960 122.960 117.654 5.306 18321 20749 1 16 . 1 1 84 84 LEU HA H 84 1.917 1.917 3.054 -1.137 18321 20750 1 16 . 1 1 84 84 LEU C C 84 177.652 177.652 178.297 -0.645 18321 20751 1 16 . 1 1 84 84 LEU CA C 84 58.261 58.261 57.095 1.166 18321 20752 1 16 . 1 1 84 84 LEU CB C 84 42.544 42.544 41.058 1.486 18321 20753 1 16 . 1 1 84 84 LEU H H 84 6.982 6.982 7.547 -0.565 18321 20754 1 16 . 1 1 85 85 LEU N N 85 117.940 117.940 118.550 -0.610 18321 20755 1 16 . 1 1 85 85 LEU HA H 85 3.463 3.463 3.800 -0.337 18321 20756 1 16 . 1 1 85 85 LEU C C 85 178.809 178.809 178.542 0.267 18321 20757 1 16 . 1 1 85 85 LEU CA C 85 57.522 57.522 57.237 0.285 18321 20758 1 16 . 1 1 85 85 LEU CB C 85 41.242 41.242 41.215 0.027 18321 20759 1 16 . 1 1 85 85 LEU H H 85 7.773 7.773 7.416 0.357 18321 20760 1 16 . 1 1 86 86 GLU N N 86 115.762 115.762 117.269 -1.507 18321 20761 1 16 . 1 1 86 86 GLU HA H 86 3.540 3.540 4.024 -0.484 18321 20762 1 16 . 1 1 86 86 GLU C C 86 180.228 180.228 177.794 2.434 18321 20763 1 16 . 1 1 86 86 GLU CA C 86 58.943 58.943 57.792 1.151 18321 20764 1 16 . 1 1 86 86 GLU CB C 86 29.561 29.561 29.413 0.148 18321 20765 1 16 . 1 1 86 86 GLU H H 86 8.300 8.300 7.470 0.830 18321 20766 1 16 . 1 1 87 87 PHE N N 87 121.135 121.135 119.560 1.575 18321 20767 1 16 . 1 1 87 87 PHE HA H 87 4.122 4.122 4.334 -0.212 18321 20768 1 16 . 1 1 87 87 PHE C C 87 179.497 179.497 176.350 3.147 18321 20769 1 16 . 1 1 87 87 PHE CA C 87 62.090 62.090 59.521 2.569 18321 20770 1 16 . 1 1 87 87 PHE CB C 87 40.103 40.103 39.871 0.232 18321 20771 1 16 . 1 1 87 87 PHE H H 87 7.717 7.717 7.299 0.418 18321 20772 1 16 . 1 1 88 88 TYR N N 88 116.579 116.579 117.615 -1.036 18321 20773 1 16 . 1 1 88 88 TYR HA H 88 4.933 4.933 4.395 0.538 18321 20774 1 16 . 1 1 88 88 TYR C C 88 174.799 174.799 176.107 -1.308 18321 20775 1 16 . 1 1 88 88 TYR CA C 88 61.333 61.333 57.399 3.934 18321 20776 1 16 . 1 1 88 88 TYR CB C 88 36.539 36.539 37.221 -0.681 18321 20777 1 16 . 1 1 88 88 TYR H H 88 7.478 7.478 7.267 0.211 18321 20778 1 16 . 1 1 89 89 LYS N N 89 117.737 117.737 119.520 -1.783 18321 20779 1 16 . 1 1 89 89 LYS HA H 89 4.466 4.466 4.111 0.355 18321 20780 1 16 . 1 1 89 89 LYS C C 89 178.417 178.417 176.623 1.794 18321 20781 1 16 . 1 1 89 89 LYS CA C 89 59.486 59.486 57.897 1.589 18321 20782 1 16 . 1 1 89 89 LYS CB C 89 34.523 34.523 32.334 2.189 18321 20783 1 16 . 1 1 89 89 LYS H H 89 7.505 7.505 7.508 -0.003 18321 20784 1 16 . 1 1 90 90 ILE N N 90 110.972 110.972 110.909 0.063 18321 20785 1 16 . 1 1 90 90 ILE HA H 90 4.181 4.181 4.205 -0.024 18321 20786 1 16 . 1 1 90 90 ILE C C 90 174.571 174.571 176.012 -1.441 18321 20787 1 16 . 1 1 90 90 ILE CA C 90 60.516 60.516 61.343 -0.827 18321 20788 1 16 . 1 1 90 90 ILE CB C 90 39.979 39.979 38.524 1.455 18321 20789 1 16 . 1 1 90 90 ILE H H 90 6.710 6.710 7.045 -0.335 18321 20790 1 16 . 1 1 91 91 HIS N N 91 119.479 119.479 120.640 -1.161 18321 20791 1 16 . 1 1 91 91 HIS HA H 91 4.357 4.357 4.264 0.093 18321 20792 1 16 . 1 1 91 91 HIS C C 91 172.751 172.751 175.096 -2.345 18321 20793 1 16 . 1 1 91 91 HIS CA C 91 55.066 55.066 57.609 -2.543 18321 20794 1 16 . 1 1 91 91 HIS CB C 91 29.756 29.756 30.922 -1.166 18321 20795 1 16 . 1 1 91 91 HIS H H 91 7.460 7.460 7.496 -0.036 18321 20796 1 16 . 1 1 92 92 TYR N N 92 117.642 117.642 116.060 1.582 18321 20797 1 16 . 1 1 92 92 TYR HA H 92 4.131 4.131 4.255 -0.124 18321 20798 1 16 . 1 1 92 92 TYR C C 92 177.348 177.348 175.967 1.381 18321 20799 1 16 . 1 1 92 92 TYR CA C 92 58.627 58.627 58.341 0.286 18321 20800 1 16 . 1 1 92 92 TYR CB C 92 39.481 39.481 35.574 3.907 18321 20801 1 16 . 1 1 92 92 TYR H H 92 8.067 8.067 7.514 0.553 18321 20802 1 16 . 1 1 93 93 LEU N N 93 123.560 123.560 121.177 2.383 18321 20803 1 16 . 1 1 93 93 LEU HA H 93 4.104 4.104 4.024 0.080 18321 20804 1 16 . 1 1 93 93 LEU C C 93 175.610 175.610 178.190 -2.580 18321 20805 1 16 . 1 1 93 93 LEU CA C 93 56.381 56.381 57.542 -1.161 18321 20806 1 16 . 1 1 93 93 LEU CB C 93 38.896 38.896 42.124 -3.228 18321 20807 1 16 . 1 1 93 93 LEU H H 93 7.907 7.907 7.921 -0.014 18321 20808 1 16 . 1 1 94 94 ASP N N 94 118.194 118.194 116.519 1.675 18321 20809 1 16 . 1 1 94 94 ASP HA H 94 4.940 4.940 4.748 0.192 18321 20810 1 16 . 1 1 94 94 ASP C C 94 176.123 176.123 175.917 0.206 18321 20811 1 16 . 1 1 94 94 ASP CA C 94 56.235 56.235 53.096 3.139 18321 20812 1 16 . 1 1 94 94 ASP CB C 94 42.078 42.078 39.987 2.091 18321 20813 1 16 . 1 1 94 94 ASP H H 94 8.640 8.640 8.134 0.506 18321 20814 1 16 . 1 1 95 95 THR N N 95 105.073 105.073 116.233 -11.160 18321 20815 1 16 . 1 1 95 95 THR HA H 95 4.318 4.318 4.035 0.283 18321 20816 1 16 . 1 1 95 95 THR C C 95 174.685 174.685 173.241 1.444 18321 20817 1 16 . 1 1 95 95 THR CA C 95 60.756 60.756 64.072 -3.316 18321 20818 1 16 . 1 1 95 95 THR CB C 95 71.058 71.058 68.636 2.422 18321 20819 1 16 . 1 1 95 95 THR H H 95 8.576 8.576 8.327 0.249 18321 20820 1 16 . 1 1 96 96 THR N N 96 116.817 116.817 111.182 5.635 18321 20821 1 16 . 1 1 96 96 THR HA H 96 5.129 5.129 4.740 0.389 18321 20822 1 16 . 1 1 96 96 THR C C 96 172.464 172.464 172.561 -0.097 18321 20823 1 16 . 1 1 96 96 THR CA C 96 60.762 60.762 60.227 0.535 18321 20824 1 16 . 1 1 96 96 THR CB C 96 71.425 71.425 70.681 0.744 18321 20825 1 16 . 1 1 96 96 THR H H 96 8.205 8.205 7.592 0.613 18321 20826 1 16 . 1 1 97 97 THR N N 97 114.324 114.324 113.918 0.406 18321 20827 1 16 . 1 1 97 97 THR HA H 97 5.128 5.128 4.565 0.563 18321 20828 1 16 . 1 1 97 97 THR C C 97 175.480 175.480 174.657 0.823 18321 20829 1 16 . 1 1 97 97 THR CA C 97 60.233 60.233 60.058 0.175 18321 20830 1 16 . 1 1 97 97 THR CB C 97 70.415 70.415 70.290 0.125 18321 20831 1 16 . 1 1 97 97 THR H H 97 7.128 7.128 8.159 -1.031 18321 20832 1 16 . 1 1 98 98 LEU N N 98 116.674 116.674 122.220 -5.546 18321 20833 1 16 . 1 1 98 98 LEU HA H 98 4.075 4.075 4.053 0.022 18321 20834 1 16 . 1 1 98 98 LEU C C 98 177.892 177.892 176.631 1.261 18321 20835 1 16 . 1 1 98 98 LEU CA C 98 59.597 59.597 54.967 4.630 18321 20836 1 16 . 1 1 98 98 LEU CB C 98 41.172 41.172 40.332 0.840 18321 20837 1 16 . 1 1 98 98 LEU H H 98 8.743 8.743 7.798 0.945 18321 20838 1 16 . 1 1 99 99 ILE N N 99 122.988 122.988 122.529 0.459 18321 20839 1 16 . 1 1 99 99 ILE HA H 99 4.415 4.415 4.032 0.383 18321 20840 1 16 . 1 1 99 99 ILE C C 99 175.055 175.055 175.942 -0.887 18321 20841 1 16 . 1 1 99 99 ILE CA C 99 62.183 62.183 62.151 0.032 18321 20842 1 16 . 1 1 99 99 ILE CB C 99 40.252 40.252 38.564 1.688 18321 20843 1 16 . 1 1 99 99 ILE H H 99 8.998 8.998 8.251 0.747 18321 20844 1 16 . 1 1 100 100 GLU N N 100 114.067 114.067 113.950 0.117 18321 20845 1 16 . 1 1 100 100 GLU CA C 100 52.910 52.910 53.625 -0.715 18321 20846 1 16 . 1 1 100 100 GLU CB C 100 31.155 31.155 30.979 0.176 18321 20847 1 16 . 1 1 100 100 GLU H H 100 7.332 7.332 8.044 -0.712 18321 20848 1 16 . 1 1 101 101 PRO HA H 101 4.952 4.952 3.618 1.334 18321 20849 1 16 . 1 1 101 101 PRO C C 101 175.976 175.976 176.183 -0.207 18321 20850 1 16 . 1 1 101 101 PRO CA C 101 53.312 53.312 61.792 -8.480 18321 20851 1 16 . 1 1 101 101 PRO CB C 101 31.598 31.598 31.965 -0.367 18321 20852 1 16 . 1 1 102 102 ALA N N 102 125.968 125.968 126.521 -0.553 18321 20853 1 16 . 1 1 102 102 ALA HA H 102 4.516 4.516 4.291 0.225 18321 20854 1 16 . 1 1 102 102 ALA CA C 102 49.852 49.852 50.347 -0.495 18321 20855 1 16 . 1 1 102 102 ALA CB C 102 17.766 17.766 18.336 -0.570 18321 20856 1 16 . 1 1 102 102 ALA H H 102 8.232 8.232 8.115 0.117 18321 20857 1 16 . 1 1 103 103 PRO HA H 103 4.283 4.283 4.423 -0.140 18321 20858 1 16 . 1 1 103 103 PRO CA C 103 62.435 62.435 63.317 -0.882 18321 20859 1 16 . 1 1 103 103 PRO CB C 103 32.145 32.145 32.273 -0.128 18321 20860 1 16 . 1 1 104 104 ARG HA H 104 4.004 4.004 4.355 -0.351 18321 20861 1 16 . 1 1 104 104 ARG CA C 104 56.660 56.660 57.454 -0.794 18321 20862 1 16 . 1 1 106 106 PRO C C 106 174.587 174.587 175.766 -1.179 18321 20863 1 16 . 1 1 106 106 PRO CA C 106 57.867 57.867 62.640 -4.773 18321 20864 1 16 . 1 1 106 106 PRO CB C 106 31.942 31.942 31.314 0.628 18321 20865 1 16 . 1 1 107 107 SER N N 107 121.280 121.280 120.915 0.365 18321 20866 1 16 . 1 1 107 107 SER CA C 107 61.772 61.772 57.892 3.881 18321 20867 1 16 . 1 1 107 107 SER CB C 107 63.234 63.234 62.869 0.365 18321 20868 1 16 . 1 1 107 107 SER H H 107 8.132 8.132 7.563 0.569 18321 20869 1 16 . 1 1 109 109 PRO C C 109 177.129 177.129 176.594 0.535 18321 20870 1 16 . 1 1 109 109 PRO CA C 109 62.638 62.638 62.878 -0.240 18321 20871 1 16 . 1 1 109 109 PRO CB C 109 30.970 30.970 31.896 -0.926 18321 20872 1 16 . 1 1 110 110 MET N N 110 120.772 120.772 114.642 6.130 18321 20873 1 16 . 1 1 110 110 MET C C 110 176.892 176.892 176.337 0.555 18321 20874 1 16 . 1 1 110 110 MET CA C 110 55.310 55.310 58.432 -3.122 18321 20875 1 16 . 1 1 110 110 MET CB C 110 32.202 32.202 31.083 1.119 18321 20876 1 16 . 1 1 110 110 MET H H 110 8.430 8.430 8.019 0.411 18321 20877 1 16 . 1 1 111 111 GLY N N 111 110.158 110.158 103.323 6.835 18321 20878 1 16 . 1 1 111 111 GLY C C 111 177.430 177.430 173.928 3.502 18321 20879 1 16 . 1 1 111 111 GLY CA C 111 44.951 44.951 45.464 -0.513 18321 20880 1 16 . 1 1 111 111 GLY H H 111 8.384 8.384 8.457 -0.073 18321 20881 1 16 . 1 1 112 112 SER N N 112 116.762 116.762 114.584 2.178 18321 20882 1 16 . 1 1 112 112 SER CA C 112 55.948 55.948 58.911 -2.963 18321 20883 1 16 . 1 1 112 112 SER CB C 112 62.745 62.745 65.175 -2.430 18321 20884 1 16 . 1 1 112 112 SER H H 112 8.161 8.161 7.827 0.334 18321 20885 1 16 . 1 1 113 113 VAL C C 113 176.083 176.083 174.362 1.721 18321 20886 1 16 . 1 1 114 114 SER N N 114 119.151 119.151 118.098 1.053 18321 20887 1 16 . 1 1 114 114 SER C C 114 173.638 173.638 173.719 -0.081 18321 20888 1 16 . 1 1 114 114 SER CA C 114 58.005 58.005 58.209 -0.204 18321 20889 1 16 . 1 1 114 114 SER CB C 114 63.169 63.169 62.110 1.059 18321 20890 1 16 . 1 1 114 114 SER H H 114 8.319 8.319 8.357 -0.038 18321 20891 1 16 . 1 1 115 115 ALA N N 115 126.914 126.914 129.202 -2.288 18321 20892 1 16 . 1 1 115 115 ALA CA C 115 51.561 51.561 49.282 2.279 18321 20893 1 16 . 1 1 115 115 ALA CB C 115 17.714 17.714 18.989 -1.275 18321 20894 1 16 . 1 1 115 115 ALA H H 115 8.197 8.197 7.778 0.419 18321 20895 1 16 . 1 1 119 119 PRO C C 119 177.065 177.065 176.164 0.901 18321 20896 1 16 . 1 1 120 120 THR N N 120 113.976 113.976 114.474 -0.498 18321 20897 1 16 . 1 1 120 120 THR C C 120 174.461 174.461 175.172 -0.711 18321 20898 1 16 . 1 1 120 120 THR CA C 120 61.215 61.215 62.256 -1.041 18321 20899 1 16 . 1 1 120 120 THR CB C 120 69.508 69.508 68.287 1.220 18321 20900 1 16 . 1 1 120 120 THR H H 120 8.138 8.138 9.151 -1.013 18321 20901 1 16 . 1 1 121 121 ALA N N 121 125.859 125.859 123.369 2.490 18321 20902 1 16 . 1 1 121 121 ALA CA C 121 52.281 52.281 53.858 -1.577 18321 20903 1 16 . 1 1 121 121 ALA CB C 121 18.623 18.623 17.349 1.274 18321 20904 1 16 . 1 1 121 121 ALA H H 121 8.272 8.272 8.497 -0.225 18321 20905 1 16 . 1 1 122 122 GLU C C 122 176.316 176.316 175.199 1.117 18321 20906 1 16 . 1 1 123 123 ASP N N 123 120.448 120.448 123.403 -2.955 18321 20907 1 16 . 1 1 123 123 ASP C C 123 175.906 175.906 176.011 -0.105 18321 20908 1 16 . 1 1 123 123 ASP CA C 123 54.167 54.167 54.136 0.031 18321 20909 1 16 . 1 1 123 123 ASP CB C 123 40.695 40.695 41.660 -0.965 18321 20910 1 16 . 1 1 123 123 ASP H H 123 8.181 8.181 8.387 -0.206 18321 20911 1 16 . 1 1 124 124 ASN N N 124 118.207 118.207 118.488 -0.281 18321 20912 1 16 . 1 1 124 124 ASN C C 124 174.851 174.851 172.907 1.944 18321 20913 1 16 . 1 1 124 124 ASN CA C 124 52.771 52.771 53.383 -0.612 18321 20914 1 16 . 1 1 124 124 ASN CB C 124 38.304 38.304 39.456 -1.152 18321 20915 1 16 . 1 1 124 124 ASN H H 124 8.307 8.307 8.005 0.302 18321 20916 1 16 . 1 1 125 125 LEU N N 125 121.311 121.311 121.629 -0.318 18321 20917 1 16 . 1 1 125 125 LEU C C 125 175.750 175.750 174.861 0.889 18321 20918 1 16 . 1 1 125 125 LEU CA C 125 54.428 54.428 55.611 -1.183 18321 20919 1 16 . 1 1 125 125 LEU CB C 125 41.350 41.350 41.046 0.304 18321 20920 1 16 . 1 1 125 125 LEU H H 125 7.747 7.747 8.558 -0.811 18321 20921 1 16 . 1 1 126 126 GLU N N 126 122.485 122.485 118.705 3.780 18321 20922 1 16 . 1 1 126 126 GLU C C 126 174.008 174.008 174.271 -0.263 18321 20923 1 16 . 1 1 126 126 GLU CA C 126 54.855 54.855 56.200 -1.345 18321 20924 1 16 . 1 1 126 126 GLU CB C 126 30.472 30.472 31.110 -0.638 18321 20925 1 16 . 1 1 126 126 GLU H H 126 8.453 8.453 7.957 0.496 18321 20926 1 16 . 1 1 127 127 TYR N N 127 122.713 122.713 120.710 2.003 18321 20927 1 16 . 1 1 127 127 TYR C C 127 176.859 176.859 174.644 2.215 18321 20928 1 16 . 1 1 127 127 TYR CA C 127 56.528 56.528 57.323 -0.795 18321 20929 1 16 . 1 1 127 127 TYR CB C 127 40.982 40.982 40.163 0.819 18321 20930 1 16 . 1 1 127 127 TYR H H 127 8.469 8.469 8.369 0.100 18321 20931 1 16 . 1 1 128 128 VAL N N 128 112.432 112.432 123.610 -11.178 18321 20932 1 16 . 1 1 128 128 VAL C C 128 173.150 173.150 174.478 -1.328 18321 20933 1 16 . 1 1 128 128 VAL CA C 128 57.940 57.940 60.622 -2.682 18321 20934 1 16 . 1 1 128 128 VAL CB C 128 34.935 34.935 35.902 -0.967 18321 20935 1 16 . 1 1 128 128 VAL H H 128 9.078 9.078 8.995 0.083 18321 20936 1 16 . 1 1 129 129 ARG N N 129 120.373 120.373 121.935 -1.562 18321 20937 1 16 . 1 1 129 129 ARG C C 129 176.539 176.539 175.035 1.504 18321 20938 1 16 . 1 1 129 129 ARG CA C 129 52.534 52.534 53.015 -0.481 18321 20939 1 16 . 1 1 129 129 ARG CB C 129 32.942 32.942 33.327 -0.384 18321 20940 1 16 . 1 1 129 129 ARG H H 129 9.010 9.010 8.224 0.786 18321 20941 1 16 . 1 1 130 130 THR N N 130 116.637 116.637 110.793 5.844 18321 20942 1 16 . 1 1 130 130 THR CA C 130 60.618 60.618 60.414 0.204 18321 20943 1 16 . 1 1 130 130 THR CB C 130 69.170 69.170 70.890 -1.720 18321 20944 1 16 . 1 1 130 130 THR H H 130 9.045 9.045 9.211 -0.166 18321 20945 1 16 . 1 1 131 131 LEU N N 131 122.910 122.910 122.473 0.437 18321 20946 1 16 . 1 1 131 131 LEU C C 131 175.269 175.269 177.299 -2.030 18321 20947 1 16 . 1 1 131 131 LEU CA C 131 55.122 55.122 55.562 -0.440 18321 20948 1 16 . 1 1 131 131 LEU CB C 131 43.108 43.108 42.633 0.475 18321 20949 1 16 . 1 1 131 131 LEU H H 131 9.224 9.224 8.495 0.729 18321 20950 1 16 . 1 1 132 132 TYR N N 132 112.885 112.885 119.438 -6.553 18321 20951 1 16 . 1 1 132 132 TYR C C 132 173.818 173.818 175.707 -1.889 18321 20952 1 16 . 1 1 132 132 TYR CA C 132 54.230 54.230 59.339 -5.109 18321 20953 1 16 . 1 1 132 132 TYR CB C 132 42.672 42.672 40.153 2.519 18321 20954 1 16 . 1 1 132 132 TYR H H 132 7.284 7.284 7.722 -0.438 18321 20955 1 16 . 1 1 133 133 ASP N N 133 118.003 118.003 119.973 -1.970 18321 20956 1 16 . 1 1 133 133 ASP C C 133 175.779 175.779 174.121 1.658 18321 20957 1 16 . 1 1 133 133 ASP CA C 133 54.351 54.351 55.382 -1.031 18321 20958 1 16 . 1 1 133 133 ASP CB C 133 41.241 41.241 40.234 1.007 18321 20959 1 16 . 1 1 133 133 ASP H H 133 8.399 8.399 8.406 -0.007 18321 20960 1 16 . 1 1 134 134 PHE N N 134 121.081 121.081 123.726 -2.645 18321 20961 1 16 . 1 1 134 134 PHE CA C 134 52.552 52.552 54.830 -2.277 18321 20962 1 16 . 1 1 134 134 PHE CB C 134 41.217 41.217 41.014 0.203 18321 20963 1 16 . 1 1 134 134 PHE H H 134 8.797 8.797 7.280 1.517 18321 20964 1 16 . 1 1 136 136 GLY C C 136 171.616 171.616 174.332 -2.716 18321 20965 1 16 . 1 1 137 137 ASN N N 137 119.394 119.394 116.918 2.476 18321 20966 1 16 . 1 1 137 137 ASN C C 137 174.500 174.500 173.938 0.562 18321 20967 1 16 . 1 1 137 137 ASN CA C 137 44.670 44.670 54.238 -9.568 18321 20968 1 16 . 1 1 137 137 ASN H H 137 9.477 9.477 8.117 1.360 18321 20969 1 16 . 1 1 138 138 ASP N N 138 120.608 120.608 118.446 2.162 18321 20970 1 16 . 1 1 138 138 ASP C C 138 176.987 176.987 174.552 2.435 18321 20971 1 16 . 1 1 138 138 ASP CA C 138 52.992 52.992 52.627 0.365 18321 20972 1 16 . 1 1 138 138 ASP H H 138 8.216 8.216 7.656 0.560 18321 20973 1 16 . 1 1 139 139 ALA N N 139 124.371 124.371 120.925 3.446 18321 20974 1 16 . 1 1 139 139 ALA C C 139 178.472 178.472 176.855 1.617 18321 20975 1 16 . 1 1 139 139 ALA CA C 139 54.513 54.513 52.636 1.877 18321 20976 1 16 . 1 1 139 139 ALA CB C 139 18.045 18.045 20.106 -2.061 18321 20977 1 16 . 1 1 139 139 ALA H H 139 8.565 8.565 8.559 0.006 18321 20978 1 16 . 1 1 140 140 GLU N N 140 115.022 115.022 118.187 -3.165 18321 20979 1 16 . 1 1 140 140 GLU C C 140 177.027 177.027 175.140 1.887 18321 20980 1 16 . 1 1 140 140 GLU CA C 140 56.181 56.181 57.155 -0.974 18321 20981 1 16 . 1 1 140 140 GLU CB C 140 28.619 28.619 31.216 -2.597 18321 20982 1 16 . 1 1 140 140 GLU H H 140 8.616 8.616 8.184 0.432 18321 20983 1 16 . 1 1 141 141 ASP N N 141 121.913 121.913 120.928 0.985 18321 20984 1 16 . 1 1 141 141 ASP C C 141 175.923 175.923 174.706 1.217 18321 20985 1 16 . 1 1 141 141 ASP CA C 141 54.736 54.736 54.184 0.552 18321 20986 1 16 . 1 1 141 141 ASP CB C 141 41.305 41.305 42.503 -1.198 18321 20987 1 16 . 1 1 141 141 ASP H H 141 7.636 7.636 8.039 -0.403 18321 20988 1 16 . 1 1 142 142 LEU N N 142 127.651 127.651 125.667 1.984 18321 20989 1 16 . 1 1 142 142 LEU CA C 142 50.955 50.955 51.892 -0.937 18321 20990 1 16 . 1 1 142 142 LEU CB C 142 42.343 42.343 44.247 -1.904 18321 20991 1 16 . 1 1 142 142 LEU H H 142 9.479 9.479 8.333 1.146 18321 20992 1 16 . 1 1 143 143 PRO C C 143 177.924 177.924 175.991 1.933 18321 20993 1 16 . 1 1 144 144 PHE N N 144 114.483 114.483 121.856 -7.373 18321 20994 1 16 . 1 1 144 144 PHE C C 144 175.055 175.055 175.271 -0.216 18321 20995 1 16 . 1 1 144 144 PHE CA C 144 55.543 55.543 56.524 -0.981 18321 20996 1 16 . 1 1 144 144 PHE CB C 144 40.581 40.581 40.550 0.031 18321 20997 1 16 . 1 1 144 144 PHE H H 144 8.637 8.637 7.148 1.489 18321 20998 1 16 . 1 1 145 145 LYS N N 145 121.342 121.342 117.431 3.911 18321 20999 1 16 . 1 1 145 145 LYS C C 145 176.925 176.925 177.516 -0.591 18321 21000 1 16 . 1 1 145 145 LYS CA C 145 53.043 53.043 54.005 -0.962 18321 21001 1 16 . 1 1 145 145 LYS CB C 145 33.804 33.804 36.642 -2.838 18321 21002 1 16 . 1 1 145 145 LYS H H 145 9.418 9.418 8.055 1.363 18321 21003 1 16 . 1 1 146 146 LYS N N 146 123.378 123.378 120.590 2.788 18321 21004 1 16 . 1 1 146 146 LYS CA C 146 57.883 57.883 56.306 1.577 18321 21005 1 16 . 1 1 146 146 LYS CB C 146 32.008 32.008 31.473 0.535 18321 21006 1 16 . 1 1 146 146 LYS H H 146 9.002 9.002 8.779 0.223 18321 21007 1 16 . 1 1 147 147 GLY C C 147 174.315 174.315 173.397 0.918 18321 21008 1 16 . 1 1 148 148 GLU N N 148 121.392 121.392 118.817 2.575 18321 21009 1 16 . 1 1 148 148 GLU C C 148 174.998 174.998 175.269 -0.271 18321 21010 1 16 . 1 1 148 148 GLU CA C 148 56.867 56.867 54.470 2.397 18321 21011 1 16 . 1 1 148 148 GLU CB C 148 31.649 31.649 30.690 0.959 18321 21012 1 16 . 1 1 148 148 GLU H H 148 7.937 7.937 7.777 0.160 18321 21013 1 16 . 1 1 149 149 ILE N N 149 120.124 120.124 120.196 -0.072 18321 21014 1 16 . 1 1 149 149 ILE C C 149 176.647 176.647 174.725 1.922 18321 21015 1 16 . 1 1 149 149 ILE CA C 149 58.621 58.621 60.172 -1.552 18321 21016 1 16 . 1 1 149 149 ILE CB C 149 36.952 36.952 39.547 -2.595 18321 21017 1 16 . 1 1 149 149 ILE H H 149 8.346 8.346 8.388 -0.042 18321 21018 1 16 . 1 1 150 150 LEU N N 150 126.950 126.950 126.105 0.845 18321 21019 1 16 . 1 1 150 150 LEU CA C 150 51.967 51.967 53.047 -1.080 18321 21020 1 16 . 1 1 150 150 LEU CB C 150 44.182 44.182 45.843 -1.661 18321 21021 1 16 . 1 1 150 150 LEU H H 150 8.988 8.988 9.287 -0.299 18321 21022 1 16 . 1 1 151 151 VAL C C 151 175.670 175.670 175.557 0.113 18321 21023 1 16 . 1 1 152 152 ILE N N 152 124.997 124.997 128.778 -3.781 18321 21024 1 16 . 1 1 152 152 ILE CA C 152 58.331 58.331 59.984 -1.653 18321 21025 1 16 . 1 1 152 152 ILE CB C 152 34.093 34.093 34.941 -0.848 18321 21026 1 16 . 1 1 152 152 ILE H H 152 8.673 8.673 8.361 0.312 18321 21027 1 16 . 1 1 153 153 ILE N N 153 124.710 124.710 126.878 -2.168 18321 21028 1 16 . 1 1 153 153 ILE C C 153 176.264 176.264 175.105 1.159 18321 21029 1 16 . 1 1 154 154 GLU N N 154 117.398 117.398 117.515 -0.117 18321 21030 1 16 . 1 1 154 154 GLU C C 154 173.959 173.959 174.098 -0.139 18321 21031 1 16 . 1 1 154 154 GLU CA C 154 55.289 55.289 55.231 0.058 18321 21032 1 16 . 1 1 154 154 GLU CB C 154 32.842 32.842 32.999 -0.157 18321 21033 1 16 . 1 1 154 154 GLU H H 154 7.818 7.818 8.072 -0.254 18321 21034 1 16 . 1 1 155 155 LYS N N 155 121.130 121.130 124.488 -3.358 18321 21035 1 16 . 1 1 155 155 LYS CA C 155 53.022 53.022 52.887 0.135 18321 21036 1 16 . 1 1 155 155 LYS CB C 155 32.663 32.663 33.244 -0.581 18321 21037 1 16 . 1 1 155 155 LYS H H 155 8.654 8.654 9.071 -0.417 18321 21038 1 16 . 1 1 157 157 GLU C C 157 175.190 175.190 175.936 -0.746 18321 21039 1 16 . 1 1 157 157 GLU CA C 157 53.785 53.785 54.267 -0.482 18321 21040 1 16 . 1 1 157 157 GLU CB C 157 32.685 32.685 31.340 1.345 18321 21041 1 16 . 1 1 158 158 GLU N N 158 117.425 117.425 118.933 -1.508 18321 21042 1 16 . 1 1 158 158 GLU C C 158 178.600 178.600 177.174 1.426 18321 21043 1 16 . 1 1 158 158 GLU CA C 158 59.044 59.044 57.988 1.056 18321 21044 1 16 . 1 1 158 158 GLU CB C 158 29.706 29.706 30.213 -0.507 18321 21045 1 16 . 1 1 158 158 GLU H H 158 8.678 8.678 8.772 -0.094 18321 21046 1 16 . 1 1 159 159 GLN N N 159 110.925 110.925 116.900 -5.975 18321 21047 1 16 . 1 1 159 159 GLN C C 159 175.539 175.539 175.009 0.530 18321 21048 1 16 . 1 1 159 159 GLN CA C 159 54.942 54.942 56.428 -1.486 18321 21049 1 16 . 1 1 159 159 GLN CB C 159 28.572 28.572 29.578 -1.006 18321 21050 1 16 . 1 1 159 159 GLN H H 159 8.483 8.483 8.303 0.180 18321 21051 1 16 . 1 1 160 160 TRP N N 160 120.171 120.171 118.996 1.175 18321 21052 1 16 . 1 1 160 160 TRP C C 160 173.444 173.444 175.028 -1.584 18321 21053 1 16 . 1 1 160 160 TRP CA C 160 56.175 56.175 55.695 0.480 18321 21054 1 16 . 1 1 160 160 TRP CB C 160 31.796 31.796 32.142 -0.346 18321 21055 1 16 . 1 1 160 160 TRP H H 160 6.826 6.826 7.521 -0.695 18321 21056 1 16 . 1 1 161 161 TRP N N 161 120.687 120.687 122.442 -1.755 18321 21057 1 16 . 1 1 161 161 TRP C C 161 174.736 174.736 176.176 -1.440 18321 21058 1 16 . 1 1 161 161 TRP CA C 161 51.889 51.889 54.372 -2.483 18321 21059 1 16 . 1 1 161 161 TRP CB C 161 32.772 32.772 31.562 1.210 18321 21060 1 16 . 1 1 161 161 TRP H H 161 8.462 8.462 9.464 -1.002 18321 21061 1 16 . 1 1 162 162 SER N N 162 115.691 115.691 120.471 -4.780 18321 21062 1 16 . 1 1 162 162 SER C C 162 174.320 174.320 173.288 1.032 18321 21063 1 16 . 1 1 162 162 SER CA C 162 57.011 57.011 58.552 -1.541 18321 21064 1 16 . 1 1 162 162 SER CB C 162 63.948 63.948 62.932 1.016 18321 21065 1 16 . 1 1 162 162 SER H H 162 8.830 8.830 8.985 -0.155 18321 21066 1 16 . 1 1 163 163 ALA N N 163 130.630 130.630 127.865 2.765 18321 21067 1 16 . 1 1 163 163 ALA CA C 163 50.029 50.029 50.006 0.023 18321 21068 1 16 . 1 1 163 163 ALA CB C 163 25.500 25.500 22.236 3.264 18321 21069 1 16 . 1 1 163 163 ALA H H 163 9.585 9.585 9.181 0.404 18321 21070 1 16 . 1 1 164 164 ARG N N 164 117.526 117.526 121.434 -3.908 18321 21071 1 16 . 1 1 164 164 ARG C C 164 176.719 176.719 176.507 0.212 18321 21072 1 16 . 1 1 164 164 ARG CA C 164 52.975 52.975 54.324 -1.349 18321 21073 1 16 . 1 1 164 164 ARG CB C 164 34.260 34.260 31.078 3.182 18321 21074 1 16 . 1 1 164 164 ARG H H 164 9.097 9.097 8.977 0.120 18321 21075 1 16 . 1 1 165 165 ASN N N 165 123.935 123.935 122.637 1.298 18321 21076 1 16 . 1 1 165 165 ASN C C 165 178.484 178.484 176.524 1.960 18321 21077 1 16 . 1 1 165 165 ASN CA C 165 50.332 50.332 53.357 -3.025 18321 21078 1 16 . 1 1 165 165 ASN CB C 165 39.487 39.487 39.875 -0.388 18321 21079 1 16 . 1 1 165 165 ASN H H 165 8.756 8.756 8.746 0.010 18321 21080 1 16 . 1 1 166 166 LYS N N 166 118.464 118.464 119.052 -0.588 18321 21081 1 16 . 1 1 166 166 LYS C C 166 176.967 176.967 176.979 -0.012 18321 21082 1 16 . 1 1 166 166 LYS CA C 166 58.430 58.430 58.581 -0.151 18321 21083 1 16 . 1 1 166 166 LYS CB C 166 30.918 30.918 32.147 -1.229 18321 21084 1 16 . 1 1 166 166 LYS H H 166 8.915 8.915 8.804 0.111 18321 21085 1 16 . 1 1 167 167 ASP N N 167 118.138 118.138 115.763 2.375 18321 21086 1 16 . 1 1 167 167 ASP C C 167 176.464 176.464 176.795 -0.331 18321 21087 1 16 . 1 1 167 167 ASP CA C 167 54.212 54.212 54.794 -0.582 18321 21088 1 16 . 1 1 167 167 ASP CB C 167 41.178 41.178 40.743 0.435 18321 21089 1 16 . 1 1 167 167 ASP H H 167 7.508 7.508 8.098 -0.590 18321 21090 1 16 . 1 1 168 168 GLY N N 168 107.901 107.901 107.428 0.473 18321 21091 1 16 . 1 1 168 168 GLY C C 168 173.613 173.613 173.457 0.156 18321 21092 1 16 . 1 1 168 168 GLY CA C 168 44.783 44.783 44.925 -0.142 18321 21093 1 16 . 1 1 168 168 GLY H H 168 8.173 8.173 7.884 0.289 18321 21094 1 16 . 1 1 169 169 ARG N N 169 124.324 124.324 120.974 3.350 18321 21095 1 16 . 1 1 169 169 ARG CA C 169 56.106 56.106 55.732 0.374 18321 21096 1 16 . 1 1 169 169 ARG CB C 169 29.648 29.648 31.299 -1.651 18321 21097 1 16 . 1 1 169 169 ARG H H 169 7.998 7.998 7.975 0.023 18321 21098 1 16 . 1 1 170 170 VAL C C 170 177.590 177.590 175.675 1.915 18321 21099 1 16 . 1 1 171 171 GLY N N 171 112.582 112.582 113.941 -1.359 18321 21100 1 16 . 1 1 171 171 GLY C C 171 170.991 170.991 172.665 -1.674 18321 21101 1 16 . 1 1 171 171 GLY CA C 171 45.361 45.361 44.790 0.571 18321 21102 1 16 . 1 1 171 171 GLY H H 171 9.013 9.013 8.573 0.440 18321 21103 1 16 . 1 1 172 172 MET N N 172 117.368 117.368 121.157 -3.789 18321 21104 1 16 . 1 1 172 172 MET C C 172 177.921 177.921 176.629 1.292 18321 21105 1 16 . 1 1 172 172 MET CA C 172 53.536 53.536 56.874 -3.338 18321 21106 1 16 . 1 1 172 172 MET CB C 172 30.838 30.838 33.925 -3.087 18321 21107 1 16 . 1 1 172 172 MET H H 172 8.885 8.885 9.220 -0.335 18321 21108 1 16 . 1 1 173 173 ILE N N 173 113.130 113.130 117.125 -3.995 18321 21109 1 16 . 1 1 173 173 ILE CA C 173 56.284 56.284 58.060 -1.776 18321 21110 1 16 . 1 1 173 173 ILE CB C 173 40.870 40.870 40.598 0.272 18321 21111 1 16 . 1 1 173 173 ILE H H 173 9.704 9.704 9.301 0.403 18321 21112 1 16 . 1 1 174 174 PRO C C 174 176.714 176.714 177.722 -1.008 18321 21113 1 16 . 1 1 174 174 PRO CA C 174 66.290 66.290 61.387 4.903 18321 21114 1 16 . 1 1 174 174 PRO CB C 174 28.993 28.993 30.427 -1.434 18321 21115 1 16 . 1 1 175 175 VAL N N 175 128.066 128.066 124.367 3.699 18321 21116 1 16 . 1 1 175 175 VAL CA C 175 59.356 59.356 67.021 -7.665 18321 21117 1 16 . 1 1 175 175 VAL H H 175 7.327 7.327 8.122 -0.795 18321 21118 1 16 . 1 1 176 176 PRO C C 176 176.351 176.351 176.888 -0.537 18321 21119 1 16 . 1 1 177 177 TYR N N 177 115.756 115.756 115.615 0.141 18321 21120 1 16 . 1 1 177 177 TYR C C 177 175.011 175.011 175.589 -0.578 18321 21121 1 16 . 1 1 177 177 TYR CA C 177 56.756 56.756 56.461 0.295 18321 21122 1 16 . 1 1 177 177 TYR CB C 177 37.507 37.507 38.545 -1.038 18321 21123 1 16 . 1 1 177 177 TYR H H 177 7.784 7.784 7.447 0.337 18321 21124 1 16 . 1 1 178 178 VAL N N 178 111.428 111.428 115.731 -4.303 18321 21125 1 16 . 1 1 178 178 VAL C C 178 173.417 173.417 175.735 -2.318 18321 21126 1 16 . 1 1 178 178 VAL CA C 178 58.307 58.307 59.364 -1.057 18321 21127 1 16 . 1 1 178 178 VAL CB C 178 34.602 34.602 33.844 0.758 18321 21128 1 16 . 1 1 178 178 VAL H H 178 7.801 7.801 7.431 0.370 18321 21129 1 16 . 1 1 179 179 GLU N N 179 118.581 118.581 119.913 -1.332 18321 21130 1 16 . 1 1 179 179 GLU C C 179 175.225 175.225 175.569 -0.344 18321 21131 1 16 . 1 1 179 179 GLU CA C 179 53.114 53.114 55.716 -2.602 18321 21132 1 16 . 1 1 179 179 GLU CB C 179 32.712 32.712 30.417 2.295 18321 21133 1 16 . 1 1 179 179 GLU H H 179 8.819 8.819 8.384 0.435 18321 21134 1 16 . 1 1 180 180 LYS N N 180 124.167 124.167 121.674 2.493 18321 21135 1 16 . 1 1 180 180 LYS C C 180 176.303 176.303 176.814 -0.511 18321 21136 1 16 . 1 1 180 180 LYS CA C 180 57.318 57.318 57.067 0.251 18321 21137 1 16 . 1 1 180 180 LYS CB C 180 31.675 31.675 32.490 -0.815 18321 21138 1 16 . 1 1 180 180 LYS H H 180 8.775 8.775 8.131 0.644 18321 21139 1 16 . 1 1 181 181 LEU N N 181 125.157 125.157 125.263 -0.106 18321 21140 1 16 . 1 1 181 181 LEU C C 181 176.462 176.462 177.384 -0.922 18321 21141 1 16 . 1 1 181 181 LEU CA C 181 54.470 54.470 56.927 -2.457 18321 21142 1 16 . 1 1 181 181 LEU CB C 181 41.625 41.625 43.164 -1.539 18321 21143 1 16 . 1 1 181 181 LEU H H 181 8.084 8.084 8.530 -0.446 18321 21144 1 16 . 1 1 182 182 VAL N N 182 123.167 123.167 113.389 9.778 18321 21145 1 16 . 1 1 182 182 VAL C C 182 175.983 175.983 175.024 0.959 18321 21146 1 16 . 1 1 182 182 VAL CA C 182 61.613 61.613 62.181 -0.568 18321 21147 1 16 . 1 1 182 182 VAL CB C 182 32.085 32.085 31.660 0.424 18321 21148 1 16 . 1 1 182 182 VAL H H 182 8.345 8.345 8.196 0.149 18321 21149 1 16 . 1 1 183 183 ARG N N 183 125.775 125.775 128.272 -2.497 18321 21150 1 16 . 1 1 183 183 ARG CA C 183 57.801 57.801 56.553 1.248 18321 21151 1 16 . 1 1 183 183 ARG CB C 183 30.091 30.091 32.202 -2.111 18321 21152 1 16 . 1 1 183 183 ARG H H 183 8.530 8.530 8.833 -0.303 18321 21153 1 16 . 1 1 184 184 SER C C 184 173.239 173.239 173.587 -0.348 18321 21154 1 16 . 1 1 185 185 SER N N 185 116.511 116.511 119.726 -3.215 18321 21155 1 16 . 1 1 185 185 SER CA C 185 58.428 58.428 57.620 0.808 18321 21156 1 16 . 1 1 185 185 SER CB C 185 69.737 69.737 63.194 6.543 18321 21157 1 16 . 1 1 185 185 SER H H 185 7.944 7.944 8.183 -0.239 18321 21158 1 16 . 1 1 190 190 HIS C C 190 176.953 176.953 174.783 2.170 18321 21159 1 16 . 1 1 190 190 HIS CA C 190 54.229 54.229 54.663 -0.434 18321 21160 1 16 . 1 1 190 190 HIS CB C 190 35.112 35.112 31.760 3.352 18321 21161 1 16 . 1 1 191 191 GLY N N 191 109.491 109.491 110.340 -0.849 18321 21162 1 16 . 1 1 191 191 GLY C C 191 172.295 172.295 174.145 -1.850 18321 21163 1 16 . 1 1 191 191 GLY CA C 191 45.227 45.227 44.951 0.276 18321 21164 1 16 . 1 1 191 191 GLY H H 191 8.719 8.719 8.186 0.533 18321 21165 1 16 . 1 1 192 192 ASN N N 192 118.700 118.700 121.675 -2.975 18321 21166 1 16 . 1 1 192 192 ASN HA H 192 4.312 4.312 4.562 -0.250 18321 21167 1 16 . 1 1 192 192 ASN C C 192 176.369 176.369 176.299 0.070 18321 21168 1 16 . 1 1 192 192 ASN CA C 192 57.787 57.787 55.033 2.754 18321 21169 1 16 . 1 1 192 192 ASN H H 192 7.508 7.508 8.694 -1.186 18321 21170 1 16 . 1 1 193 193 ARG N N 193 120.743 120.743 115.760 4.983 18321 21171 1 16 . 1 1 193 193 ARG H H 193 9.032 9.032 8.222 0.810 18321 21172 1 16 . 1 1 197 197 SER HA H 197 4.388 4.388 4.275 0.113 18321 21173 1 16 . 1 1 197 197 SER C C 197 174.133 174.133 173.594 0.539 18321 21174 1 16 . 1 1 197 197 SER CA C 197 58.128 58.128 59.521 -1.393 18321 21175 1 16 . 1 1 197 197 SER CB C 197 62.966 62.966 62.385 0.581 18321 21176 1 16 . 1 1 198 198 TYR N N 198 121.435 121.435 121.162 0.273 18321 21177 1 16 . 1 1 198 198 TYR HA H 198 4.543 4.543 4.550 -0.006 18321 21178 1 16 . 1 1 198 198 TYR C C 198 176.230 176.230 175.951 0.279 18321 21179 1 16 . 1 1 198 198 TYR CA C 198 57.536 57.536 59.638 -2.102 18321 21180 1 16 . 1 1 198 198 TYR CB C 198 38.279 38.279 39.723 -1.444 18321 21181 1 16 . 1 1 198 198 TYR H H 198 8.071 8.071 8.229 -0.158 18321 21182 1 16 . 1 1 199 199 GLY N N 199 110.039 110.039 107.435 2.604 18321 21183 1 16 . 1 1 199 199 GLY C C 199 173.475 173.475 173.563 -0.088 18321 21184 1 16 . 1 1 199 199 GLY CA C 199 44.805 44.805 44.937 -0.132 18321 21185 1 16 . 1 1 199 199 GLY H H 199 8.162 8.162 8.337 -0.175 18321 21186 1 16 . 1 1 200 200 ILE N N 200 121.530 121.530 121.919 -0.389 18321 21187 1 16 . 1 1 200 200 ILE CA C 200 58.102 58.102 57.682 0.420 18321 21188 1 16 . 1 1 200 200 ILE CB C 200 37.760 37.760 39.360 -1.600 18321 21189 1 16 . 1 1 200 200 ILE H H 200 7.851 7.851 7.696 0.155 18321 21190 1 16 . 1 1 201 201 PRO C C 201 176.485 176.485 176.637 -0.152 18321 21191 1 16 . 1 1 201 201 PRO CA C 201 53.893 53.893 63.806 -9.913 18321 21192 1 16 . 1 1 201 201 PRO CB C 201 29.042 29.042 32.072 -3.030 18321 21193 1 16 . 1 1 202 202 GLU N N 202 122.468 122.468 120.000 2.468 18321 21194 1 16 . 1 1 202 202 GLU CA C 202 62.490 62.490 55.201 7.289 18321 21195 1 16 . 1 1 202 202 GLU CB C 202 31.170 31.170 29.520 1.650 18321 21196 1 16 . 1 1 202 202 GLU H H 202 8.328 8.328 8.496 -0.168 18321 21197 1 16 . 1 1 203 203 PRO CA C 203 62.803 62.803 61.866 0.937 18321 21198 1 16 . 1 1 203 203 PRO CB C 203 31.220 31.220 32.714 -1.494 18321 21199 1 16 . 1 1 204 204 ALA N N 204 123.251 123.251 122.371 0.880 18321 21200 1 16 . 1 1 204 204 ALA HA H 204 4.180 4.180 4.428 -0.248 18321 21201 1 16 . 1 1 204 204 ALA CA C 204 52.124 52.124 52.072 0.052 18321 21202 1 16 . 1 1 204 204 ALA CB C 204 18.892 18.892 18.061 0.831 18321 21203 1 16 . 1 1 204 204 ALA H H 204 8.308 8.308 8.620 -0.312 18321 21204 1 16 . 1 1 205 205 HIS N N 205 117.874 117.874 123.355 -5.481 18321 21205 1 16 . 1 1 205 205 HIS C C 205 173.282 173.282 174.289 -1.007 18321 21206 1 16 . 1 1 205 205 HIS H H 205 8.045 8.045 7.964 0.081 18321 21207 1 16 . 1 1 206 206 ALA N N 206 125.519 125.519 129.199 -3.680 18321 21208 1 16 . 1 1 206 206 ALA HA H 206 4.204 4.204 4.228 -0.024 18321 21209 1 16 . 1 1 206 206 ALA CA C 206 40.196 40.196 51.732 -11.536 18321 21210 1 16 . 1 1 206 206 ALA CB C 206 19.407 19.407 18.032 1.375 18321 21211 1 16 . 1 1 206 206 ALA H H 206 8.061 8.061 8.268 -0.207 18321 21212 1 16 . 1 1 207 207 TYR N N 207 120.381 120.381 122.782 -2.401 18321 21213 1 16 . 1 1 207 207 TYR HA H 207 4.570 4.570 4.657 -0.087 18321 21214 1 16 . 1 1 207 207 TYR CA C 207 52.572 52.572 57.527 -4.955 18321 21215 1 16 . 1 1 207 207 TYR CB C 207 41.333 41.333 39.460 1.873 18321 21216 1 16 . 1 1 207 207 TYR H H 207 8.199 8.199 8.237 -0.038 18321 21217 1 16 . 1 1 208 208 ALA HA H 208 4.281 4.281 4.423 -0.142 18321 21218 1 16 . 1 1 208 208 ALA C C 208 177.736 177.736 175.859 1.877 18321 21219 1 16 . 1 1 208 208 ALA CA C 208 52.084 52.084 51.851 0.233 18321 21220 1 16 . 1 1 208 208 ALA CB C 208 18.999 18.999 19.926 -0.927 18321 21221 1 16 . 1 1 209 209 GLN N N 209 119.295 119.295 122.073 -2.778 18321 21222 1 16 . 1 1 209 209 GLN CA C 209 61.474 61.474 53.323 8.151 18321 21223 1 16 . 1 1 209 209 GLN CB C 209 32.039 32.039 29.200 2.840 18321 21224 1 16 . 1 1 209 209 GLN H H 209 8.125 8.125 8.399 -0.274 18321 21225 1 16 . 1 1 210 210 PRO HA H 210 4.395 4.395 4.391 0.004 18321 21226 1 16 . 1 1 210 210 PRO CA C 210 62.584 62.584 63.303 -0.719 18321 21227 1 16 . 1 1 211 211 GLN HA H 211 4.377 4.377 4.341 0.036 18321 21228 1 16 . 1 1 211 211 GLN CA C 211 55.859 55.859 56.847 -0.988 18321 21229 1 16 . 1 1 211 211 GLN CB C 211 29.577 29.577 29.477 0.100 18321 21230 1 16 . 1 1 212 212 THR C C 212 176.551 176.551 174.084 2.467 18321 21231 1 16 . 1 1 212 212 THR CB C 212 69.890 69.890 70.061 -0.171 18321 21232 1 16 . 1 1 213 213 THR N N 213 108.487 108.487 119.458 -10.971 18321 21233 1 16 . 1 1 213 213 THR CA C 213 61.236 61.236 62.692 -1.456 18321 21234 1 16 . 1 1 213 213 THR CB C 213 69.091 69.091 69.893 -0.802 18321 21235 1 16 . 1 1 213 213 THR H H 213 8.243 8.243 8.513 -0.270 18321 21236 1 16 . 1 1 214 214 THR N N 214 119.445 119.445 115.366 4.079 18321 21237 1 16 . 1 1 214 214 THR CA C 214 59.425 59.425 60.235 -0.810 18321 21238 1 16 . 1 1 214 214 THR CB C 214 69.251 69.251 71.293 -2.042 18321 21239 1 16 . 1 1 214 214 THR H H 214 8.188 8.188 8.001 0.187 18321 21240 1 16 . 1 1 215 215 PRO HA H 215 4.361 4.361 4.373 -0.012 18321 21241 1 16 . 1 1 215 215 PRO C C 215 175.422 175.422 177.003 -1.581 18321 21242 1 16 . 1 1 215 215 PRO CA C 215 63.320 63.320 63.383 -0.063 18321 21243 1 16 . 1 1 215 215 PRO CB C 215 31.918 31.918 31.937 -0.019 18321 21244 1 16 . 1 1 216 216 LEU N N 216 121.602 121.602 120.124 1.478 18321 21245 1 16 . 1 1 216 216 LEU CA C 216 52.203 52.203 54.112 -1.909 18321 21246 1 16 . 1 1 216 216 LEU CB C 216 42.451 42.451 41.214 1.237 18321 21247 1 16 . 1 1 216 216 LEU H H 216 7.891 7.891 7.961 -0.070 18321 21248 1 16 . 1 1 217 217 PRO HA H 217 4.398 4.398 4.411 -0.013 18321 21249 1 16 . 1 1 217 217 PRO C C 217 176.577 176.577 176.722 -0.145 18321 21250 1 16 . 1 1 217 217 PRO CA C 217 62.984 62.984 63.891 -0.907 18321 21251 1 16 . 1 1 217 217 PRO CB C 217 32.056 32.056 32.133 -0.077 18321 21252 1 16 . 1 1 218 218 ALA N N 218 124.087 124.087 118.684 5.403 18321 21253 1 16 . 1 1 218 218 ALA HA H 218 4.309 4.309 4.494 -0.185 18321 21254 1 16 . 1 1 218 218 ALA C C 218 177.844 177.844 175.313 2.531 18321 21255 1 16 . 1 1 218 218 ALA CA C 218 52.379 52.379 51.379 1.000 18321 21256 1 16 . 1 1 218 218 ALA CB C 218 19.133 19.133 20.500 -1.367 18321 21257 1 16 . 1 1 218 218 ALA H H 218 8.261 8.261 7.626 0.635 18321 21258 1 16 . 1 1 219 219 VAL N N 219 118.942 118.942 119.020 -0.078 18321 21259 1 16 . 1 1 219 219 VAL HA H 219 4.142 4.142 4.384 -0.242 18321 21260 1 16 . 1 1 219 219 VAL CA C 219 62.102 62.102 62.032 0.070 18321 21261 1 16 . 1 1 219 219 VAL CB C 219 32.923 32.923 31.518 1.405 18321 21262 1 16 . 1 1 219 219 VAL H H 219 8.049 8.049 8.408 -0.359 18321 21263 1 16 . 1 1 220 220 SER N N 220 119.207 119.207 124.121 -4.914 18321 21264 1 16 . 1 1 220 220 SER HA H 220 4.436 4.436 4.615 -0.179 18321 21265 1 16 . 1 1 220 220 SER CA C 220 57.813 57.813 58.201 -0.388 18321 21266 1 16 . 1 1 220 220 SER CB C 220 63.375 63.375 63.179 0.195 18321 21267 1 16 . 1 1 220 220 SER H H 220 8.275 8.275 8.771 -0.496 18321 21268 1 16 . 1 1 221 221 GLY N N 221 110.973 110.973 113.867 -2.894 18321 21269 1 16 . 1 1 221 221 GLY C C 221 173.962 173.962 172.675 1.287 18321 21270 1 16 . 1 1 221 221 GLY CA C 221 45.286 45.286 44.366 0.920 18321 21271 1 16 . 1 1 221 221 GLY H H 221 8.374 8.374 8.145 0.229 18321 21272 1 16 . 1 1 222 222 SER N N 222 115.516 115.516 114.473 1.043 18321 21273 1 16 . 1 1 222 222 SER HA H 222 4.763 4.763 4.336 0.427 18321 21274 1 16 . 1 1 222 222 SER CA C 222 56.407 56.407 57.973 -1.566 18321 21275 1 16 . 1 1 222 222 SER CB C 222 63.993 63.993 62.532 1.461 18321 21276 1 16 . 1 1 222 222 SER H H 222 8.155 8.155 8.121 0.034 18321 21277 1 16 . 1 1 223 223 PRO HA H 223 4.417 4.417 4.391 0.026 18321 21278 1 16 . 1 1 223 223 PRO CA C 223 63.805 63.805 62.895 0.910 18321 21279 1 16 . 1 1 223 223 PRO CB C 223 32.090 32.090 31.884 0.206 18321 21280 1 16 . 1 1 224 224 GLY N N 224 109.149 109.149 112.420 -3.271 18321 21281 1 16 . 1 1 224 224 GLY C C 224 173.813 173.813 173.295 0.518 18321 21282 1 16 . 1 1 224 224 GLY CA C 224 44.512 44.512 44.898 -0.385 18321 21283 1 16 . 1 1 224 224 GLY H H 224 8.376 8.376 8.638 -0.262 18321 21284 1 16 . 1 1 225 225 ALA N N 225 123.599 123.599 122.191 1.408 18321 21285 1 16 . 1 1 225 225 ALA C C 225 177.341 177.341 175.313 2.028 18321 21286 1 16 . 1 1 225 225 ALA CA C 225 51.878 51.878 51.245 0.633 18321 21287 1 16 . 1 1 225 225 ALA CB C 225 19.169 19.169 21.251 -2.082 18321 21288 1 16 . 1 1 225 225 ALA H H 225 7.959 7.959 7.172 0.787 18321 21289 1 16 . 1 1 226 226 ALA N N 226 123.218 123.218 123.498 -0.280 18321 21290 1 16 . 1 1 226 226 ALA HA H 226 4.350 4.350 4.530 -0.180 18321 21291 1 16 . 1 1 226 226 ALA C C 226 177.520 177.520 176.834 0.686 18321 21292 1 16 . 1 1 226 226 ALA CA C 226 52.535 52.535 52.026 0.509 18321 21293 1 16 . 1 1 226 226 ALA CB C 226 19.171 19.171 18.136 1.035 18321 21294 1 16 . 1 1 226 226 ALA H H 226 8.169 8.169 8.593 -0.424 18321 21295 1 16 . 1 1 227 227 ILE N N 227 120.086 120.086 118.926 1.160 18321 21296 1 16 . 1 1 227 227 ILE HA H 227 4.201 4.201 4.439 -0.238 18321 21297 1 16 . 1 1 227 227 ILE C C 227 174.814 174.814 175.461 -0.647 18321 21298 1 16 . 1 1 227 227 ILE CA C 227 60.929 60.929 60.267 0.662 18321 21299 1 16 . 1 1 227 227 ILE CB C 227 38.872 38.872 37.154 1.718 18321 21300 1 16 . 1 1 227 227 ILE H H 227 8.037 8.037 7.921 0.116 18321 21301 1 16 . 1 1 228 228 THR N N 228 117.224 117.224 116.099 1.125 18321 21302 1 16 . 1 1 228 228 THR HA H 228 4.203 4.203 4.730 -0.527 18321 21303 1 16 . 1 1 228 228 THR CA C 228 57.108 57.108 59.944 -2.837 18321 21304 1 16 . 1 1 228 228 THR CB C 228 69.945 69.945 68.486 1.459 18321 21305 1 16 . 1 1 228 228 THR H H 228 7.775 7.775 7.612 0.163 18321 21306 1 16 . 1 1 229 229 PRO HA H 229 4.750 4.750 4.592 0.158 18321 21307 1 16 . 1 1 229 229 PRO CA C 229 62.480 62.480 62.705 -0.225 18321 21308 1 16 . 1 1 229 229 PRO CB C 229 33.995 33.995 32.178 1.817 18321 21309 1 16 . 1 1 230 230 LEU N N 230 123.629 123.629 120.200 3.429 18321 21310 1 16 . 1 1 230 230 LEU CA C 230 53.076 53.076 52.775 0.301 18321 21311 1 16 . 1 1 230 230 LEU CB C 230 40.608 40.608 43.415 -2.807 18321 21312 1 16 . 1 1 230 230 LEU H H 230 8.453 8.453 8.159 0.294 18321 21313 1 16 . 1 1 231 231 PRO HA H 231 4.412 4.412 4.507 -0.095 18321 21314 1 16 . 1 1 231 231 PRO C C 231 176.571 176.571 176.483 0.088 18321 21315 1 16 . 1 1 231 231 PRO CA C 231 63.225 63.225 63.210 0.015 18321 21316 1 16 . 1 1 231 231 PRO CB C 231 31.191 31.191 32.131 -0.940 18321 21317 1 16 . 1 1 232 232 SER N N 232 115.169 115.169 118.813 -3.644 18321 21318 1 16 . 1 1 232 232 SER HA H 232 4.450 4.450 4.309 0.141 18321 21319 1 16 . 1 1 232 232 SER CA C 232 58.604 58.604 59.265 -0.661 18321 21320 1 16 . 1 1 232 232 SER CB C 232 63.962 63.962 62.300 1.662 18321 21321 1 16 . 1 1 232 232 SER H H 232 8.280 8.280 8.629 -0.349 18321 21322 1 16 . 1 1 233 233 THR N N 233 115.155 115.155 117.337 -2.182 18321 21323 1 16 . 1 1 233 233 THR HA H 233 4.351 4.351 4.569 -0.217 18321 21324 1 16 . 1 1 233 233 THR C C 233 177.237 177.237 174.413 2.824 18321 21325 1 16 . 1 1 233 233 THR CA C 233 61.939 61.939 60.620 1.319 18321 21326 1 16 . 1 1 233 233 THR CB C 233 68.986 68.986 69.836 -0.850 18321 21327 1 16 . 1 1 233 233 THR H H 233 8.096 8.096 8.191 -0.095 18321 21328 1 16 . 1 1 234 234 GLN N N 234 122.040 122.040 123.934 -1.894 18321 21329 1 16 . 1 1 234 234 GLN HA H 234 4.681 4.681 4.508 0.173 18321 21330 1 16 . 1 1 234 234 GLN C C 234 176.177 176.177 176.259 -0.082 18321 21331 1 16 . 1 1 234 234 GLN CA C 234 55.861 55.861 56.781 -0.920 18321 21332 1 16 . 1 1 234 234 GLN CB C 234 28.583 28.583 28.496 0.087 18321 21333 1 16 . 1 1 234 234 GLN H H 234 8.256 8.256 8.388 -0.132 18321 21334 1 16 . 1 1 235 235 ASN N N 235 119.506 119.506 115.566 3.940 18321 21335 1 16 . 1 1 235 235 ASN HA H 235 4.775 4.775 4.616 0.159 18321 21336 1 16 . 1 1 235 235 ASN C C 235 174.974 174.974 175.707 -0.733 18321 21337 1 16 . 1 1 235 235 ASN CA C 235 53.191 53.191 53.750 -0.559 18321 21338 1 16 . 1 1 235 235 ASN CB C 235 38.511 38.511 38.202 0.310 18321 21339 1 16 . 1 1 235 235 ASN H H 235 8.346 8.346 7.922 0.424 18321 21340 1 16 . 1 1 236 236 GLY N N 236 109.378 109.378 109.582 -0.204 18321 21341 1 16 . 1 1 236 236 GLY CA C 236 44.023 44.023 45.355 -1.332 18321 21342 1 16 . 1 1 236 236 GLY H H 236 7.939 7.939 7.945 -0.006 18321 21343 1 16 . 1 1 237 237 PRO HA H 237 4.336 4.336 4.891 -0.555 18321 21344 1 16 . 1 1 237 237 PRO C C 237 175.942 175.942 175.783 0.159 18321 21345 1 16 . 1 1 237 237 PRO CA C 237 62.797 62.797 61.820 0.977 18321 21346 1 16 . 1 1 237 237 PRO CB C 237 27.421 27.421 31.826 -4.405 18321 21347 1 16 . 1 1 238 238 VAL N N 238 120.535 120.535 124.536 -4.001 18321 21348 1 16 . 1 1 238 238 VAL HA H 238 4.195 4.195 4.155 0.040 18321 21349 1 16 . 1 1 238 238 VAL C C 238 173.775 173.775 175.069 -1.294 18321 21350 1 16 . 1 1 238 238 VAL CA C 238 61.173 61.173 62.032 -0.859 18321 21351 1 16 . 1 1 238 238 VAL CB C 238 38.328 38.328 33.211 5.117 18321 21352 1 16 . 1 1 238 238 VAL H H 238 7.986 7.986 8.474 -0.488 18321 21353 1 16 . 1 1 239 239 PHE N N 239 123.522 123.522 124.866 -1.344 18321 21354 1 16 . 1 1 239 239 PHE HA H 239 5.539 5.539 5.294 0.245 18321 21355 1 16 . 1 1 239 239 PHE C C 239 174.207 174.207 175.277 -1.070 18321 21356 1 16 . 1 1 239 239 PHE CA C 239 56.993 56.993 56.698 0.295 18321 21357 1 16 . 1 1 239 239 PHE CB C 239 41.743 41.743 40.677 1.066 18321 21358 1 16 . 1 1 239 239 PHE H H 239 8.927 8.927 8.663 0.264 18321 21359 1 16 . 1 1 240 240 ALA N N 240 120.871 120.871 126.833 -5.962 18321 21360 1 16 . 1 1 240 240 ALA HA H 240 5.352 5.352 5.328 0.024 18321 21361 1 16 . 1 1 240 240 ALA C C 240 174.639 174.639 175.540 -0.901 18321 21362 1 16 . 1 1 240 240 ALA CA C 240 49.736 49.736 50.386 -0.651 18321 21363 1 16 . 1 1 240 240 ALA CB C 240 23.480 23.480 22.535 0.945 18321 21364 1 16 . 1 1 240 240 ALA H H 240 9.398 9.398 9.276 0.122 18321 21365 1 16 . 1 1 241 241 LYS N N 241 121.227 121.227 123.781 -2.554 18321 21366 1 16 . 1 1 241 241 LYS HA H 241 5.373 5.373 5.163 0.210 18321 21367 1 16 . 1 1 241 241 LYS C C 241 176.772 176.772 175.955 0.817 18321 21368 1 16 . 1 1 241 241 LYS CA C 241 53.128 53.128 54.305 -1.177 18321 21369 1 16 . 1 1 241 241 LYS CB C 241 34.850 34.850 34.536 0.313 18321 21370 1 16 . 1 1 241 241 LYS H H 241 8.947 8.947 8.391 0.556 18321 21371 1 16 . 1 1 242 242 ALA N N 242 126.833 126.833 130.400 -3.567 18321 21372 1 16 . 1 1 242 242 ALA HA H 242 4.764 4.764 4.629 0.135 18321 21373 1 16 . 1 1 242 242 ALA C C 242 178.506 178.506 177.629 0.877 18321 21374 1 16 . 1 1 242 242 ALA CA C 242 52.788 52.788 51.880 0.908 18321 21375 1 16 . 1 1 242 242 ALA CB C 242 19.084 19.084 18.863 0.222 18321 21376 1 16 . 1 1 242 242 ALA H H 242 9.373 9.373 8.434 0.939 18321 21377 1 16 . 1 1 243 243 ILE N N 243 118.731 118.731 120.400 -1.669 18321 21378 1 16 . 1 1 243 243 ILE HA H 243 4.454 4.454 4.084 0.370 18321 21379 1 16 . 1 1 243 243 ILE C C 243 174.773 174.773 176.132 -1.359 18321 21380 1 16 . 1 1 243 243 ILE CA C 243 60.613 60.613 61.761 -1.148 18321 21381 1 16 . 1 1 243 243 ILE CB C 243 39.232 39.232 37.831 1.401 18321 21382 1 16 . 1 1 243 243 ILE H H 243 8.933 8.933 8.121 0.812 18321 21383 1 16 . 1 1 244 244 GLN N N 244 121.616 121.616 118.323 3.293 18321 21384 1 16 . 1 1 244 244 GLN HA H 244 4.283 4.283 4.532 -0.249 18321 21385 1 16 . 1 1 244 244 GLN C C 244 172.815 172.815 174.510 -1.695 18321 21386 1 16 . 1 1 244 244 GLN CA C 244 54.750 54.750 54.304 0.446 18321 21387 1 16 . 1 1 244 244 GLN CB C 244 31.469 31.469 32.634 -1.165 18321 21388 1 16 . 1 1 244 244 GLN H H 244 7.438 7.438 7.407 0.031 18321 21389 1 16 . 1 1 245 245 LYS N N 245 124.215 124.215 120.574 3.641 18321 21390 1 16 . 1 1 245 245 LYS HA H 245 3.962 3.962 4.167 -0.205 18321 21391 1 16 . 1 1 245 245 LYS C C 245 175.679 175.679 175.951 -0.272 18321 21392 1 16 . 1 1 245 245 LYS CA C 245 56.413 56.413 57.112 -0.699 18321 21393 1 16 . 1 1 245 245 LYS CB C 245 32.847 32.847 32.879 -0.032 18321 21394 1 16 . 1 1 245 245 LYS H H 245 8.318 8.318 8.512 -0.194 18321 21395 1 16 . 1 1 246 246 ARG N N 246 127.327 127.327 123.397 3.930 18321 21396 1 16 . 1 1 246 246 ARG HA H 246 4.221 4.221 4.585 -0.364 18321 21397 1 16 . 1 1 246 246 ARG CA C 246 56.279 56.279 54.654 1.625 18321 21398 1 16 . 1 1 246 246 ARG CB C 246 32.987 32.987 30.989 1.998 18321 21399 1 16 . 1 1 246 246 ARG H H 246 9.248 9.248 8.402 0.846 18321 21400 1 16 . 1 1 249 249 CYS HA H 249 4.260 4.260 4.444 -0.184 18321 21401 1 16 . 1 1 249 249 CYS CA C 249 55.886 55.886 57.451 -1.565 18321 21402 1 16 . 1 1 249 249 CYS CB C 249 34.146 34.146 29.913 4.233 18321 21403 1 16 . 1 1 250 250 ALA HA H 250 3.926 3.926 4.159 -0.233 18321 21404 1 16 . 1 1 250 250 ALA CA C 250 54.344 54.344 54.133 0.211 18321 21405 1 16 . 1 1 250 250 ALA CB C 250 18.342 18.342 18.620 -0.278 18321 21406 1 16 . 1 1 251 251 TYR N N 251 110.618 110.618 113.152 -2.534 18321 21407 1 16 . 1 1 251 251 TYR HA H 251 4.489 4.489 4.714 -0.225 18321 21408 1 16 . 1 1 251 251 TYR C C 251 175.286 175.286 174.657 0.629 18321 21409 1 16 . 1 1 251 251 TYR CA C 251 56.137 56.137 54.069 2.068 18321 21410 1 16 . 1 1 251 251 TYR CB C 251 37.203 37.203 37.474 -0.271 18321 21411 1 16 . 1 1 251 251 TYR H H 251 7.037 7.037 7.377 -0.340 18321 21412 1 16 . 1 1 252 252 ASP N N 252 121.835 121.835 121.059 0.776 18321 21413 1 16 . 1 1 252 252 ASP HA H 252 4.763 4.763 4.449 0.314 18321 21414 1 16 . 1 1 252 252 ASP CA C 252 52.351 52.351 55.017 -2.666 18321 21415 1 16 . 1 1 252 252 ASP CB C 252 39.995 39.995 41.511 -1.516 18321 21416 1 16 . 1 1 252 252 ASP H H 252 7.339 7.339 7.322 0.017 18321 21417 1 16 . 1 1 253 253 LYS N N 253 123.177 123.177 123.512 -0.335 18321 21418 1 16 . 1 1 253 253 LYS HA H 253 4.270 4.270 4.473 -0.203 18321 21419 1 16 . 1 1 253 253 LYS C C 253 177.724 177.724 175.593 2.131 18321 21420 1 16 . 1 1 253 253 LYS CA C 253 57.036 57.036 56.294 0.742 18321 21421 1 16 . 1 1 253 253 LYS H H 253 8.396 8.396 8.257 0.139 18321 21422 1 16 . 1 1 254 254 THR N N 254 108.317 108.317 111.292 -2.975 18321 21423 1 16 . 1 1 254 254 THR HA H 254 4.517 4.517 4.589 -0.072 18321 21424 1 16 . 1 1 254 254 THR C C 254 174.012 174.012 173.050 0.962 18321 21425 1 16 . 1 1 254 254 THR CA C 254 61.036 61.036 61.503 -0.467 18321 21426 1 16 . 1 1 254 254 THR CB C 254 69.307 69.307 70.673 -1.366 18321 21427 1 16 . 1 1 254 254 THR H H 254 8.217 8.217 7.678 0.539 18321 21428 1 16 . 1 1 255 255 ALA N N 255 124.762 124.762 124.852 -0.090 18321 21429 1 16 . 1 1 255 255 ALA HA H 255 4.524 4.524 5.179 -0.655 18321 21430 1 16 . 1 1 255 255 ALA C C 255 176.630 176.630 175.443 1.187 18321 21431 1 16 . 1 1 255 255 ALA CA C 255 51.352 51.352 50.025 1.327 18321 21432 1 16 . 1 1 255 255 ALA CB C 255 20.135 20.135 20.353 -0.218 18321 21433 1 16 . 1 1 255 255 ALA H H 255 7.096 7.096 9.216 -2.120 18321 21434 1 16 . 1 1 256 256 LEU N N 256 124.379 124.379 125.075 -0.696 18321 21435 1 16 . 1 1 256 256 LEU HA H 256 4.328 4.328 4.446 -0.118 18321 21436 1 16 . 1 1 256 256 LEU C C 256 176.007 176.007 175.590 0.417 18321 21437 1 16 . 1 1 256 256 LEU CA C 256 53.502 53.502 54.309 -0.808 18321 21438 1 16 . 1 1 256 256 LEU CB C 256 44.665 44.665 43.914 0.751 18321 21439 1 16 . 1 1 256 256 LEU H H 256 8.889 8.889 7.883 1.006 18321 21440 1 16 . 1 1 257 257 ALA N N 257 129.619 129.619 127.337 2.282 18321 21441 1 16 . 1 1 257 257 ALA HA H 257 4.445 4.445 5.118 -0.673 18321 21442 1 16 . 1 1 257 257 ALA C C 257 176.813 176.813 176.485 0.328 18321 21443 1 16 . 1 1 257 257 ALA CA C 257 51.179 51.179 50.951 0.228 18321 21444 1 16 . 1 1 257 257 ALA CB C 257 18.973 18.973 19.664 -0.691 18321 21445 1 16 . 1 1 257 257 ALA H H 257 8.529 8.529 8.152 0.377 18321 21446 1 16 . 1 1 258 258 LEU N N 258 119.300 119.300 124.965 -5.665 18321 21447 1 16 . 1 1 258 258 LEU HA H 258 4.782 4.782 4.655 0.127 18321 21448 1 16 . 1 1 258 258 LEU CA C 258 53.259 53.259 53.799 -0.540 18321 21449 1 16 . 1 1 258 258 LEU CB C 258 45.972 45.972 45.075 0.896 18321 21450 1 16 . 1 1 258 258 LEU H H 258 8.505 8.505 8.860 -0.355 18321 21451 1 16 . 1 1 259 259 GLU N N 259 123.919 123.919 121.272 2.647 18321 21452 1 16 . 1 1 259 259 GLU HA H 259 4.516 4.516 4.494 0.022 18321 21453 1 16 . 1 1 259 259 GLU C C 259 175.795 175.795 175.924 -0.129 18321 21454 1 16 . 1 1 259 259 GLU CA C 259 52.896 52.896 54.071 -1.175 18321 21455 1 16 . 1 1 259 259 GLU H H 259 8.943 8.943 8.559 0.384 18321 21456 1 16 . 1 1 260 260 VAL N N 260 122.122 122.122 120.029 2.093 18321 21457 1 16 . 1 1 260 260 VAL HA H 260 2.923 2.923 4.130 -1.207 18321 21458 1 16 . 1 1 260 260 VAL C C 260 177.964 177.964 176.995 0.969 18321 21459 1 16 . 1 1 260 260 VAL CA C 260 65.417 65.417 62.412 3.005 18321 21460 1 16 . 1 1 260 260 VAL CB C 260 30.668 30.668 30.853 -0.185 18321 21461 1 16 . 1 1 260 260 VAL H H 260 8.956 8.956 8.312 0.644 18321 21462 1 16 . 1 1 261 261 GLY N N 261 116.009 116.009 117.626 -1.617 18321 21463 1 16 . 1 1 261 261 GLY C C 261 176.288 176.288 173.907 2.381 18321 21464 1 16 . 1 1 261 261 GLY CA C 261 44.210 44.210 44.905 -0.695 18321 21465 1 16 . 1 1 261 261 GLY H H 261 8.799 8.799 9.171 -0.372 18321 21466 1 16 . 1 1 262 262 ASP N N 262 121.945 121.945 120.442 1.503 18321 21467 1 16 . 1 1 262 262 ASP HA H 262 4.423 4.423 4.864 -0.441 18321 21468 1 16 . 1 1 262 262 ASP C C 262 175.381 175.381 175.140 0.241 18321 21469 1 16 . 1 1 262 262 ASP CA C 262 55.243 55.243 53.548 1.695 18321 21470 1 16 . 1 1 262 262 ASP CB C 262 41.819 41.819 42.656 -0.837 18321 21471 1 16 . 1 1 262 262 ASP H H 262 8.180 8.180 7.570 0.610 18321 21472 1 16 . 1 1 263 263 ILE N N 263 121.452 121.452 121.544 -0.092 18321 21473 1 16 . 1 1 263 263 ILE HA H 263 4.707 4.707 4.413 0.294 18321 21474 1 16 . 1 1 263 263 ILE C C 263 174.996 174.996 175.873 -0.877 18321 21475 1 16 . 1 1 263 263 ILE CA C 263 59.289 59.289 59.438 -0.149 18321 21476 1 16 . 1 1 263 263 ILE CB C 263 36.987 36.987 37.496 -0.509 18321 21477 1 16 . 1 1 263 263 ILE H H 263 8.460 8.460 8.367 0.093 18321 21478 1 16 . 1 1 264 264 VAL N N 264 128.756 128.756 129.748 -0.992 18321 21479 1 16 . 1 1 264 264 VAL HA H 264 4.309 4.309 4.126 0.183 18321 21480 1 16 . 1 1 264 264 VAL C C 264 175.486 175.486 174.721 0.765 18321 21481 1 16 . 1 1 264 264 VAL CA C 264 59.091 59.091 61.289 -2.198 18321 21482 1 16 . 1 1 264 264 VAL CB C 264 34.541 34.541 31.854 2.687 18321 21483 1 16 . 1 1 264 264 VAL H H 264 9.479 9.479 9.364 0.115 18321 21484 1 16 . 1 1 265 265 LYS N N 265 128.101 128.101 129.937 -1.836 18321 21485 1 16 . 1 1 265 265 LYS HA H 265 4.342 4.342 4.180 0.162 18321 21486 1 16 . 1 1 265 265 LYS C C 265 175.531 175.531 174.752 0.779 18321 21487 1 16 . 1 1 265 265 LYS CA C 265 55.620 55.620 55.751 -0.131 18321 21488 1 16 . 1 1 265 265 LYS CB C 265 33.149 33.149 32.626 0.523 18321 21489 1 16 . 1 1 265 265 LYS H H 265 8.715 8.715 8.630 0.085 18321 21490 1 16 . 1 1 266 266 VAL N N 266 129.537 129.537 128.088 1.449 18321 21491 1 16 . 1 1 266 266 VAL HA H 266 4.333 4.333 4.480 -0.147 18321 21492 1 16 . 1 1 266 266 VAL C C 266 176.166 176.166 174.600 1.566 18321 21493 1 16 . 1 1 266 266 VAL CA C 266 63.339 63.339 60.550 2.789 18321 21494 1 16 . 1 1 266 266 VAL CB C 266 30.712 30.712 33.874 -3.162 18321 21495 1 16 . 1 1 266 266 VAL H H 266 9.073 9.073 8.991 0.082 18321 21496 1 16 . 1 1 267 267 THR N N 267 120.020 120.020 124.521 -4.501 18321 21497 1 16 . 1 1 267 267 THR HA H 267 4.189 4.189 4.364 -0.175 18321 21498 1 16 . 1 1 267 267 THR C C 267 176.054 176.054 174.523 1.531 18321 21499 1 16 . 1 1 267 267 THR CA C 267 62.204 62.204 64.106 -1.902 18321 21500 1 16 . 1 1 267 267 THR CB C 267 68.200 68.200 69.397 -1.196 18321 21501 1 16 . 1 1 267 267 THR H H 267 9.130 9.130 8.368 0.762 18321 21502 1 16 . 1 1 268 268 ARG N N 268 120.839 120.839 122.440 -1.601 18321 21503 1 16 . 1 1 268 268 ARG HA H 268 4.236 4.236 4.529 -0.293 18321 21504 1 16 . 1 1 268 268 ARG CA C 268 56.321 56.321 55.213 1.108 18321 21505 1 16 . 1 1 268 268 ARG CB C 268 33.049 33.049 31.859 1.190 18321 21506 1 16 . 1 1 268 268 ARG H H 268 7.631 7.631 7.889 -0.258 18321 21507 1 16 . 1 1 269 269 MET N N 269 125.443 125.443 125.021 0.422 18321 21508 1 16 . 1 1 269 269 MET C C 269 174.392 174.392 175.060 -0.668 18321 21509 1 16 . 1 1 269 269 MET H H 269 8.532 8.532 8.592 -0.060 18321 21510 1 16 . 1 1 270 270 ASN N N 270 119.125 119.125 123.153 -4.028 18321 21511 1 16 . 1 1 270 270 ASN HA H 270 4.546 4.546 5.054 -0.508 18321 21512 1 16 . 1 1 270 270 ASN C C 270 172.133 172.133 175.824 -3.691 18321 21513 1 16 . 1 1 270 270 ASN CA C 270 53.639 53.639 52.726 0.913 18321 21514 1 16 . 1 1 270 270 ASN CB C 270 39.845 39.845 40.352 -0.507 18321 21515 1 16 . 1 1 270 270 ASN H H 270 6.631 6.631 8.800 -2.169 18321 21516 1 16 . 1 1 271 271 ILE N N 271 122.532 122.532 120.125 2.407 18321 21517 1 16 . 1 1 271 271 ILE HA H 271 4.417 4.417 3.866 0.551 18321 21518 1 16 . 1 1 271 271 ILE CA C 271 63.348 63.348 63.316 0.032 18321 21519 1 16 . 1 1 271 271 ILE CB C 271 38.198 38.198 38.019 0.179 18321 21520 1 16 . 1 1 271 271 ILE H H 271 8.565 8.565 8.593 -0.028 18321 21521 1 16 . 1 1 272 272 ASN HA H 272 4.527 4.527 4.558 -0.031 18321 21522 1 16 . 1 1 272 272 ASN C C 272 176.259 176.259 176.356 -0.097 18321 21523 1 16 . 1 1 272 272 ASN CA C 272 53.225 53.225 54.022 -0.797 18321 21524 1 16 . 1 1 272 272 ASN CB C 272 37.565 37.565 38.540 -0.975 18321 21525 1 16 . 1 1 273 273 GLY N N 273 107.043 107.043 106.662 0.381 18321 21526 1 16 . 1 1 273 273 GLY C C 273 173.216 173.216 173.290 -0.074 18321 21527 1 16 . 1 1 273 273 GLY CA C 273 45.299 45.299 44.755 0.544 18321 21528 1 16 . 1 1 273 273 GLY H H 273 8.086 8.086 7.701 0.385 18321 21529 1 16 . 1 1 274 274 GLN N N 274 120.624 120.624 122.245 -1.621 18321 21530 1 16 . 1 1 274 274 GLN HA H 274 4.551 4.551 4.247 0.304 18321 21531 1 16 . 1 1 274 274 GLN C C 274 175.039 175.039 175.534 -0.495 18321 21532 1 16 . 1 1 274 274 GLN CA C 274 54.556 54.556 55.905 -1.349 18321 21533 1 16 . 1 1 274 274 GLN CB C 274 33.698 33.698 28.990 4.708 18321 21534 1 16 . 1 1 274 274 GLN H H 274 8.045 8.045 8.172 -0.127 18321 21535 1 16 . 1 1 275 275 TRP N N 275 125.596 125.596 125.691 -0.095 18321 21536 1 16 . 1 1 275 275 TRP HA H 275 4.588 4.588 4.670 -0.082 18321 21537 1 16 . 1 1 275 275 TRP C C 275 172.832 172.832 175.652 -2.820 18321 21538 1 16 . 1 1 275 275 TRP CA C 275 55.296 55.296 53.887 1.409 18321 21539 1 16 . 1 1 275 275 TRP CB C 275 31.393 31.393 30.560 0.833 18321 21540 1 16 . 1 1 275 275 TRP H H 275 8.484 8.484 8.589 -0.105 18321 21541 1 16 . 1 1 276 276 GLU N N 276 119.012 119.012 122.291 -3.279 18321 21542 1 16 . 1 1 276 276 GLU HA H 276 5.190 5.190 5.588 -0.398 18321 21543 1 16 . 1 1 276 276 GLU C C 276 176.553 176.553 175.836 0.717 18321 21544 1 16 . 1 1 276 276 GLU CA C 276 54.288 54.288 54.822 -0.534 18321 21545 1 16 . 1 1 276 276 GLU CB C 276 32.851 32.851 32.323 0.528 18321 21546 1 16 . 1 1 276 276 GLU H H 276 8.643 8.643 9.116 -0.473 18321 21547 1 16 . 1 1 277 277 GLY N N 277 111.364 111.364 113.181 -1.817 18321 21548 1 16 . 1 1 277 277 GLY C C 277 170.707 170.707 172.659 -1.952 18321 21549 1 16 . 1 1 277 277 GLY CA C 277 46.723 46.723 43.951 2.772 18321 21550 1 16 . 1 1 277 277 GLY H H 277 9.072 9.072 8.737 0.335 18321 21551 1 16 . 1 1 278 278 GLU N N 278 117.733 117.733 122.122 -4.389 18321 21552 1 16 . 1 1 278 278 GLU HA H 278 5.748 5.748 4.664 1.084 18321 21553 1 16 . 1 1 278 278 GLU C C 278 176.051 176.051 175.423 0.628 18321 21554 1 16 . 1 1 278 278 GLU CA C 278 53.620 53.620 55.557 -1.937 18321 21555 1 16 . 1 1 278 278 GLU CB C 278 33.742 33.742 30.819 2.923 18321 21556 1 16 . 1 1 278 278 GLU H H 278 8.810 8.810 8.291 0.519 18321 21557 1 16 . 1 1 279 279 VAL N N 279 123.834 123.834 125.391 -1.557 18321 21558 1 16 . 1 1 279 279 VAL HA H 279 4.404 4.404 4.333 0.071 18321 21559 1 16 . 1 1 279 279 VAL C C 279 175.289 175.289 175.782 -0.493 18321 21560 1 16 . 1 1 279 279 VAL CA C 279 61.166 61.166 60.071 1.095 18321 21561 1 16 . 1 1 279 279 VAL CB C 279 34.123 34.123 32.605 1.518 18321 21562 1 16 . 1 1 279 279 VAL H H 279 8.887 8.887 8.841 0.046 18321 21563 1 16 . 1 1 280 280 ASN N N 280 126.025 126.025 126.623 -0.598 18321 21564 1 16 . 1 1 280 280 ASN HA H 280 4.435 4.435 4.416 0.019 18321 21565 1 16 . 1 1 280 280 ASN C C 280 175.205 175.205 175.301 -0.096 18321 21566 1 16 . 1 1 280 280 ASN CA C 280 45.615 45.615 54.255 -8.640 18321 21567 1 16 . 1 1 280 280 ASN CB C 280 37.386 37.386 37.555 -0.169 18321 21568 1 16 . 1 1 280 280 ASN H H 280 9.322 9.322 9.498 -0.176 18321 21569 1 16 . 1 1 281 281 GLY N N 281 104.588 104.588 103.312 1.276 18321 21570 1 16 . 1 1 281 281 GLY C C 281 173.944 173.944 173.783 0.161 18321 21571 1 16 . 1 1 281 281 GLY CA C 281 45.224 45.224 44.948 0.276 18321 21572 1 16 . 1 1 281 281 GLY H H 281 8.768 8.768 8.489 0.279 18321 21573 1 16 . 1 1 282 282 ARG N N 282 122.567 122.567 123.232 -0.665 18321 21574 1 16 . 1 1 282 282 ARG HA H 282 4.559 4.559 4.551 0.008 18321 21575 1 16 . 1 1 282 282 ARG C C 282 174.350 174.350 174.639 -0.289 18321 21576 1 16 . 1 1 282 282 ARG CA C 282 54.933 54.933 55.043 -0.110 18321 21577 1 16 . 1 1 282 282 ARG CB C 282 31.765 31.765 31.366 0.399 18321 21578 1 16 . 1 1 282 282 ARG H H 282 8.149 8.149 7.713 0.436 18321 21579 1 16 . 1 1 283 283 LYS N N 283 121.565 121.565 126.744 -5.179 18321 21580 1 16 . 1 1 283 283 LYS HA H 283 5.584 5.584 5.649 -0.065 18321 21581 1 16 . 1 1 283 283 LYS CA C 283 54.143 54.143 54.667 -0.524 18321 21582 1 16 . 1 1 283 283 LYS CB C 283 36.040 36.040 35.117 0.923 18321 21583 1 16 . 1 1 283 283 LYS H H 283 8.424 8.424 8.484 -0.060 18321 21584 1 16 . 1 1 284 284 GLY C C 284 173.006 173.006 172.575 0.431 18321 21585 1 16 . 1 1 284 284 GLY CA C 284 45.886 45.886 45.356 0.530 18321 21586 1 16 . 1 1 285 285 LEU N N 285 119.673 119.673 121.477 -1.804 18321 21587 1 16 . 1 1 285 285 LEU HA H 285 5.718 5.718 5.626 0.092 18321 21588 1 16 . 1 1 285 285 LEU C C 285 178.657 178.657 176.261 2.396 18321 21589 1 16 . 1 1 285 285 LEU CA C 285 53.656 53.656 54.152 -0.496 18321 21590 1 16 . 1 1 285 285 LEU CB C 285 44.813 44.813 43.664 1.149 18321 21591 1 16 . 1 1 285 285 LEU H H 285 8.734 8.734 8.698 0.036 18321 21592 1 16 . 1 1 286 286 PHE N N 286 118.785 118.785 119.423 -0.638 18321 21593 1 16 . 1 1 286 286 PHE HA H 286 4.521 4.521 5.115 -0.594 18321 21594 1 16 . 1 1 286 286 PHE CA C 286 57.592 57.592 54.721 2.871 18321 21595 1 16 . 1 1 286 286 PHE CB C 286 40.669 40.669 40.034 0.635 18321 21596 1 16 . 1 1 286 286 PHE H H 286 9.120 9.120 8.965 0.155 18321 21597 1 16 . 1 1 287 287 PRO HA H 287 4.385 4.385 4.570 -0.185 18321 21598 1 16 . 1 1 287 287 PRO CA C 287 62.814 62.814 62.242 0.572 18321 21599 1 16 . 1 1 287 287 PRO CB C 287 32.133 32.133 31.836 0.297 18321 21600 1 16 . 1 1 288 288 PHE C C 288 174.837 174.837 175.462 -0.625 18321 21601 1 16 . 1 1 288 288 PHE CA C 288 59.020 59.020 59.031 -0.010 18321 21602 1 16 . 1 1 288 288 PHE CB C 288 34.987 34.987 37.401 -2.414 18321 21603 1 16 . 1 1 289 289 THR N N 289 107.865 107.865 112.661 -4.796 18321 21604 1 16 . 1 1 289 289 THR HA H 289 3.589 3.589 3.825 -0.236 18321 21605 1 16 . 1 1 289 289 THR C C 289 176.125 176.125 175.079 1.046 18321 21606 1 16 . 1 1 289 289 THR CA C 289 62.243 62.243 64.334 -2.091 18321 21607 1 16 . 1 1 289 289 THR CB C 289 69.365 69.365 68.264 1.101 18321 21608 1 16 . 1 1 289 289 THR H H 289 6.453 6.453 7.337 -0.884 18321 21609 1 16 . 1 1 290 290 HIS N N 290 119.462 119.462 117.745 1.717 18321 21610 1 16 . 1 1 290 290 HIS HA H 290 4.196 4.196 4.615 -0.419 18321 21611 1 16 . 1 1 290 290 HIS C C 290 175.165 175.165 174.060 1.105 18321 21612 1 16 . 1 1 290 290 HIS CA C 290 57.635 57.635 57.658 -0.023 18321 21613 1 16 . 1 1 290 290 HIS CB C 290 29.840 29.840 31.340 -1.500 18321 21614 1 16 . 1 1 290 290 HIS H H 290 7.835 7.835 7.894 -0.059 18321 21615 1 16 . 1 1 291 291 VAL N N 291 110.050 110.050 110.285 -0.235 18321 21616 1 16 . 1 1 291 291 VAL HA H 291 5.445 5.445 4.977 0.468 18321 21617 1 16 . 1 1 291 291 VAL C C 291 173.386 173.386 174.692 -1.306 18321 21618 1 16 . 1 1 291 291 VAL CA C 291 57.794 57.794 58.989 -1.195 18321 21619 1 16 . 1 1 291 291 VAL CB C 291 35.784 35.784 35.620 0.164 18321 21620 1 16 . 1 1 291 291 VAL H H 291 7.562 7.562 7.084 0.478 18321 21621 1 16 . 1 1 292 292 LYS N N 292 119.445 119.445 121.006 -1.561 18321 21622 1 16 . 1 1 292 292 LYS HA H 292 4.857 4.857 4.804 0.053 18321 21623 1 16 . 1 1 292 292 LYS C C 292 176.512 176.512 175.649 0.863 18321 21624 1 16 . 1 1 292 292 LYS CA C 292 54.647 54.647 54.745 -0.098 18321 21625 1 16 . 1 1 292 292 LYS CB C 292 35.665 35.665 36.652 -0.987 18321 21626 1 16 . 1 1 292 292 LYS H H 292 8.753 8.753 8.398 0.355 18321 21627 1 16 . 1 1 293 293 ILE N N 293 128.707 128.707 124.575 4.132 18321 21628 1 16 . 1 1 293 293 ILE HA H 293 4.509 4.509 4.292 0.217 18321 21629 1 16 . 1 1 293 293 ILE C C 293 175.666 175.666 176.781 -1.115 18321 21630 1 16 . 1 1 293 293 ILE CA C 293 62.563 62.563 61.677 0.886 18321 21631 1 16 . 1 1 293 293 ILE CB C 293 38.076 38.076 36.355 1.721 18321 21632 1 16 . 1 1 293 293 ILE H H 293 9.107 9.107 8.869 0.238 18321 21633 1 16 . 1 1 294 294 PHE N N 294 126.638 126.638 125.180 1.458 18321 21634 1 16 . 1 1 294 294 PHE HA H 294 4.898 4.898 4.993 -0.095 18321 21635 1 16 . 1 1 294 294 PHE C C 294 175.838 175.838 173.641 2.197 18321 21636 1 16 . 1 1 294 294 PHE CA C 294 56.335 56.335 55.454 0.881 18321 21637 1 16 . 1 1 294 294 PHE CB C 294 41.196 41.196 41.361 -0.165 18321 21638 1 16 . 1 1 294 294 PHE H H 294 8.716 8.716 8.254 0.462 18321 21639 1 16 . 1 1 295 295 ASP N N 295 122.961 122.961 120.971 1.990 18321 21640 1 16 . 1 1 295 295 ASP HA H 295 5.003 5.003 4.775 0.228 18321 21641 1 16 . 1 1 295 295 ASP CA C 295 50.602 50.602 51.259 -0.657 18321 21642 1 16 . 1 1 295 295 ASP CB C 295 40.754 40.754 41.373 -0.619 18321 21643 1 16 . 1 1 295 295 ASP H H 295 8.418 8.418 8.454 -0.036 18321 21644 1 16 . 1 1 296 296 PRO HA H 296 4.524 4.524 3.945 0.579 18321 21645 1 16 . 1 1 296 296 PRO C C 296 176.807 176.807 176.958 -0.151 18321 21646 1 16 . 1 1 296 296 PRO CA C 296 62.987 62.987 63.910 -0.923 18321 21647 1 16 . 1 1 296 296 PRO CB C 296 32.033 32.033 31.965 0.068 18321 21648 1 16 . 1 1 297 297 GLN N N 297 120.729 120.729 119.386 1.343 18321 21649 1 16 . 1 1 297 297 GLN HA H 297 4.274 4.274 4.275 -0.001 18321 21650 1 16 . 1 1 297 297 GLN CA C 297 56.427 56.427 54.872 1.555 18321 21651 1 16 . 1 1 297 297 GLN CB C 297 28.819 28.819 27.438 1.381 18321 21652 1 16 . 1 1 297 297 GLN H H 297 8.551 8.551 8.013 0.538 18321 21653 1 16 . 1 1 299 299 PRO C C 299 176.936 176.936 177.756 -0.820 18321 21654 1 16 . 1 1 299 299 PRO CA C 299 63.406 63.406 64.803 -1.397 18321 21655 1 16 . 1 1 299 299 PRO CB C 299 31.421 31.421 31.918 -0.497 18321 21656 1 16 . 1 1 300 300 ASP N N 300 119.609 119.609 117.744 1.865 18321 21657 1 16 . 1 1 300 300 ASP C C 300 176.344 176.344 177.356 -1.012 18321 21658 1 16 . 1 1 300 300 ASP CA C 300 54.178 54.178 56.268 -2.090 18321 21659 1 16 . 1 1 300 300 ASP CB C 300 40.661 40.661 40.799 -0.138 18321 21660 1 16 . 1 1 300 300 ASP H H 300 8.239 8.239 8.752 -0.513 18321 21661 1 16 . 1 1 301 301 GLU N N 301 120.462 120.462 116.274 4.188 18321 21662 1 16 . 1 1 301 301 GLU CA C 301 56.188 56.188 56.228 -0.040 18321 21663 1 16 . 1 1 301 301 GLU CB C 301 29.507 29.507 30.333 -0.826 18321 21664 1 16 . 1 1 301 301 GLU H H 301 8.084 8.084 7.880 0.204 18321 21665 1 17 . 1 1 2 2 SER HA H 2 4.521 4.521 4.780 -0.259 18321 21666 1 17 . 1 1 2 2 SER CA C 2 58.326 58.326 57.537 0.789 18321 21667 1 17 . 1 1 2 2 SER CB C 2 64.062 64.062 65.179 -1.117 18321 21668 1 17 . 1 1 3 3 SER HA H 3 4.465 4.465 4.145 0.320 18321 21669 1 17 . 1 1 3 3 SER C C 3 173.887 173.887 174.321 -0.434 18321 21670 1 17 . 1 1 3 3 SER CA C 3 58.374 58.374 60.094 -1.720 18321 21671 1 17 . 1 1 3 3 SER CB C 3 63.920 63.920 63.219 0.701 18321 21672 1 17 . 1 1 4 4 ALA N N 4 124.755 124.755 123.270 1.485 18321 21673 1 17 . 1 1 4 4 ALA HA H 4 4.547 4.547 4.572 -0.025 18321 21674 1 17 . 1 1 4 4 ALA CA C 4 52.737 52.737 52.735 0.002 18321 21675 1 17 . 1 1 4 4 ALA CB C 4 19.636 19.636 18.685 0.951 18321 21676 1 17 . 1 1 4 4 ALA H H 4 8.244 8.244 7.874 0.370 18321 21677 1 17 . 1 1 5 5 ARG N N 5 120.383 120.383 123.505 -3.122 18321 21678 1 17 . 1 1 5 5 ARG HA H 5 4.524 4.524 4.671 -0.147 18321 21679 1 17 . 1 1 5 5 ARG C C 5 175.611 175.611 176.465 -0.854 18321 21680 1 17 . 1 1 5 5 ARG CA C 5 56.082 56.082 55.044 1.038 18321 21681 1 17 . 1 1 5 5 ARG CB C 5 30.695 30.695 31.301 -0.606 18321 21682 1 17 . 1 1 5 5 ARG H H 5 8.727 8.727 8.603 0.124 18321 21683 1 17 . 1 1 6 6 PHE N N 6 115.159 115.159 120.527 -5.368 18321 21684 1 17 . 1 1 6 6 PHE HA H 6 4.786 4.786 4.777 0.009 18321 21685 1 17 . 1 1 6 6 PHE C C 6 172.076 172.076 175.348 -3.272 18321 21686 1 17 . 1 1 6 6 PHE CA C 6 56.640 56.640 55.137 1.503 18321 21687 1 17 . 1 1 6 6 PHE CB C 6 40.378 40.378 39.459 0.919 18321 21688 1 17 . 1 1 6 6 PHE H H 6 7.536 7.536 7.976 -0.440 18321 21689 1 17 . 1 1 7 7 ASP N N 7 121.846 121.846 119.271 2.575 18321 21690 1 17 . 1 1 7 7 ASP HA H 7 4.846 4.846 4.353 0.493 18321 21691 1 17 . 1 1 7 7 ASP CA C 7 52.327 52.327 55.760 -3.433 18321 21692 1 17 . 1 1 7 7 ASP CB C 7 41.298 41.298 40.975 0.323 18321 21693 1 17 . 1 1 7 7 ASP H H 7 9.062 9.062 8.525 0.537 18321 21694 1 17 . 1 1 8 8 SER HA H 8 3.950 3.950 4.398 -0.448 18321 21695 1 17 . 1 1 8 8 SER C C 8 174.705 174.705 173.250 1.455 18321 21696 1 17 . 1 1 8 8 SER CA C 8 61.937 61.937 58.992 2.945 18321 21697 1 17 . 1 1 8 8 SER CB C 8 62.260 62.260 61.885 0.375 18321 21698 1 17 . 1 1 9 9 SER N N 9 114.373 114.373 112.397 1.976 18321 21699 1 17 . 1 1 9 9 SER HA H 9 4.529 4.529 4.875 -0.346 18321 21700 1 17 . 1 1 9 9 SER C C 9 175.089 175.089 173.106 1.983 18321 21701 1 17 . 1 1 9 9 SER CA C 9 59.851 59.851 59.558 0.293 18321 21702 1 17 . 1 1 9 9 SER CB C 9 64.246 64.246 66.017 -1.771 18321 21703 1 17 . 1 1 9 9 SER H H 9 8.722 8.722 9.369 -0.647 18321 21704 1 17 . 1 1 10 10 ASP N N 10 121.818 121.818 122.786 -0.968 18321 21705 1 17 . 1 1 10 10 ASP HA H 10 4.730 4.730 4.667 0.063 18321 21706 1 17 . 1 1 10 10 ASP C C 10 174.455 174.455 177.312 -2.857 18321 21707 1 17 . 1 1 10 10 ASP CA C 10 52.432 52.432 54.021 -1.589 18321 21708 1 17 . 1 1 10 10 ASP CB C 10 39.607 39.607 41.802 -2.195 18321 21709 1 17 . 1 1 10 10 ASP H H 10 7.600 7.600 9.321 -1.721 18321 21710 1 17 . 1 1 11 11 ARG N N 11 125.238 125.238 125.863 -0.625 18321 21711 1 17 . 1 1 11 11 ARG HA H 11 1.936 1.936 3.040 -1.104 18321 21712 1 17 . 1 1 11 11 ARG C C 11 176.916 176.916 177.366 -0.450 18321 21713 1 17 . 1 1 11 11 ARG CA C 11 57.451 57.451 58.255 -0.804 18321 21714 1 17 . 1 1 11 11 ARG CB C 11 43.014 43.014 29.420 13.594 18321 21715 1 17 . 1 1 11 11 ARG H H 11 7.739 7.739 8.448 -0.709 18321 21716 1 17 . 1 1 12 12 SER N N 12 112.065 112.065 112.779 -0.714 18321 21717 1 17 . 1 1 12 12 SER HA H 12 4.695 4.695 4.224 0.471 18321 21718 1 17 . 1 1 12 12 SER C C 12 175.092 175.092 174.381 0.711 18321 21719 1 17 . 1 1 12 12 SER CA C 12 60.785 60.785 59.686 1.099 18321 21720 1 17 . 1 1 12 12 SER CB C 12 62.889 62.889 62.530 0.359 18321 21721 1 17 . 1 1 12 12 SER H H 12 7.888 7.888 8.185 -0.297 18321 21722 1 17 . 1 1 13 13 ALA N N 13 122.249 122.249 123.403 -1.154 18321 21723 1 17 . 1 1 13 13 ALA HA H 13 4.216 4.216 4.303 -0.087 18321 21724 1 17 . 1 1 13 13 ALA C C 13 178.069 178.069 177.939 0.130 18321 21725 1 17 . 1 1 13 13 ALA CA C 13 53.562 53.562 53.646 -0.084 18321 21726 1 17 . 1 1 13 13 ALA CB C 13 19.339 19.339 19.540 -0.201 18321 21727 1 17 . 1 1 13 13 ALA H H 13 7.418 7.418 7.653 -0.235 18321 21728 1 17 . 1 1 14 14 TRP N N 14 107.433 107.433 113.757 -6.324 18321 21729 1 17 . 1 1 14 14 TRP HA H 14 4.785 4.785 4.679 0.106 18321 21730 1 17 . 1 1 14 14 TRP C C 14 175.286 175.286 175.844 -0.558 18321 21731 1 17 . 1 1 14 14 TRP CA C 14 55.212 55.212 55.920 -0.708 18321 21732 1 17 . 1 1 14 14 TRP CB C 14 32.776 32.776 31.058 1.718 18321 21733 1 17 . 1 1 14 14 TRP H H 14 6.273 6.273 6.878 -0.605 18321 21734 1 17 . 1 1 15 15 TYR N N 15 122.315 122.315 125.021 -2.706 18321 21735 1 17 . 1 1 15 15 TYR HA H 15 5.436 5.436 4.984 0.452 18321 21736 1 17 . 1 1 15 15 TYR C C 15 175.325 175.325 175.464 -0.139 18321 21737 1 17 . 1 1 15 15 TYR CA C 15 56.609 56.609 57.819 -1.210 18321 21738 1 17 . 1 1 15 15 TYR CB C 15 36.940 36.940 37.731 -0.791 18321 21739 1 17 . 1 1 15 15 TYR H H 15 8.221 8.221 7.829 0.392 18321 21740 1 17 . 1 1 16 16 MET N N 16 126.031 126.031 125.867 0.164 18321 21741 1 17 . 1 1 16 16 MET HA H 16 4.462 4.462 4.193 0.269 18321 21742 1 17 . 1 1 16 16 MET CA C 16 53.046 53.046 53.899 -0.853 18321 21743 1 17 . 1 1 16 16 MET CB C 16 41.114 41.114 31.251 9.863 18321 21744 1 17 . 1 1 16 16 MET H H 16 8.989 8.989 8.561 0.428 18321 21745 1 17 . 1 1 17 17 GLY CA C 17 45.803 45.803 45.008 0.795 18321 21746 1 17 . 1 1 18 18 PRO HA H 18 4.675 4.675 4.638 0.037 18321 21747 1 17 . 1 1 18 18 PRO C C 18 175.943 175.943 176.070 -0.127 18321 21748 1 17 . 1 1 18 18 PRO CA C 18 63.647 63.647 63.568 0.079 18321 21749 1 17 . 1 1 18 18 PRO CB C 18 29.276 29.276 31.291 -2.015 18321 21750 1 17 . 1 1 19 19 VAL N N 19 126.159 126.159 126.474 -0.315 18321 21751 1 17 . 1 1 19 19 VAL HA H 19 4.011 4.011 4.109 -0.098 18321 21752 1 17 . 1 1 19 19 VAL C C 19 175.812 175.812 175.543 0.269 18321 21753 1 17 . 1 1 19 19 VAL CA C 19 62.355 62.355 61.914 0.440 18321 21754 1 17 . 1 1 19 19 VAL CB C 19 33.468 33.468 33.640 -0.172 18321 21755 1 17 . 1 1 19 19 VAL H H 19 7.851 7.851 9.396 -1.545 18321 21756 1 17 . 1 1 20 20 SER N N 20 123.950 123.950 111.372 12.578 18321 21757 1 17 . 1 1 20 20 SER HA H 20 4.453 4.453 4.267 0.186 18321 21758 1 17 . 1 1 20 20 SER CA C 20 57.631 57.631 57.906 -0.275 18321 21759 1 17 . 1 1 20 20 SER CB C 20 65.951 65.951 63.106 2.845 18321 21760 1 17 . 1 1 20 20 SER H H 20 8.800 8.800 7.798 1.002 18321 21761 1 17 . 1 1 21 21 ARG N N 21 123.461 123.461 123.912 -0.451 18321 21762 1 17 . 1 1 21 21 ARG HA H 21 3.489 3.489 4.024 -0.535 18321 21763 1 17 . 1 1 21 21 ARG C C 21 178.164 178.164 177.937 0.227 18321 21764 1 17 . 1 1 21 21 ARG CA C 21 60.025 60.025 59.698 0.327 18321 21765 1 17 . 1 1 21 21 ARG CB C 21 30.334 30.334 30.263 0.071 18321 21766 1 17 . 1 1 21 21 ARG H H 21 9.307 9.307 8.939 0.368 18321 21767 1 17 . 1 1 22 22 GLN N N 22 116.591 116.591 117.385 -0.794 18321 21768 1 17 . 1 1 22 22 GLN HA H 22 4.008 4.008 4.098 -0.090 18321 21769 1 17 . 1 1 22 22 GLN CA C 22 59.095 59.095 58.440 0.655 18321 21770 1 17 . 1 1 22 22 GLN CB C 22 29.249 29.249 28.051 1.198 18321 21771 1 17 . 1 1 22 22 GLN H H 22 8.394 8.394 8.071 0.323 18321 21772 1 17 . 1 1 23 23 GLU N N 23 122.191 122.191 119.765 2.426 18321 21773 1 17 . 1 1 23 23 GLU HA H 23 4.037 4.037 4.237 -0.200 18321 21774 1 17 . 1 1 23 23 GLU C C 23 178.986 178.986 178.269 0.717 18321 21775 1 17 . 1 1 23 23 GLU CA C 23 59.081 59.081 58.044 1.037 18321 21776 1 17 . 1 1 23 23 GLU CB C 23 31.896 31.896 29.478 2.418 18321 21777 1 17 . 1 1 23 23 GLU H H 23 8.106 8.106 8.132 -0.026 18321 21778 1 17 . 1 1 24 24 ALA N N 24 121.964 121.964 122.018 -0.054 18321 21779 1 17 . 1 1 24 24 ALA HA H 24 3.762 3.762 4.003 -0.241 18321 21780 1 17 . 1 1 24 24 ALA C C 24 178.653 178.653 179.899 -1.246 18321 21781 1 17 . 1 1 24 24 ALA CA C 24 55.480 55.480 55.150 0.330 18321 21782 1 17 . 1 1 24 24 ALA CB C 24 18.049 18.049 18.375 -0.326 18321 21783 1 17 . 1 1 24 24 ALA H H 24 8.732 8.732 8.394 0.338 18321 21784 1 17 . 1 1 25 25 GLN N N 25 116.229 116.229 116.852 -0.623 18321 21785 1 17 . 1 1 25 25 GLN HA H 25 3.950 3.950 4.103 -0.153 18321 21786 1 17 . 1 1 25 25 GLN C C 25 177.442 177.442 178.125 -0.683 18321 21787 1 17 . 1 1 25 25 GLN CA C 25 59.651 59.651 58.841 0.810 18321 21788 1 17 . 1 1 25 25 GLN CB C 25 29.308 29.308 28.332 0.976 18321 21789 1 17 . 1 1 25 25 GLN H H 25 8.391 8.391 7.982 0.409 18321 21790 1 17 . 1 1 26 26 THR N N 26 115.105 115.105 112.342 2.763 18321 21791 1 17 . 1 1 26 26 THR HA H 26 3.920 3.920 4.166 -0.246 18321 21792 1 17 . 1 1 26 26 THR C C 26 176.835 176.835 176.024 0.811 18321 21793 1 17 . 1 1 26 26 THR CA C 26 66.335 66.335 64.061 2.274 18321 21794 1 17 . 1 1 26 26 THR CB C 26 68.876 68.876 68.366 0.510 18321 21795 1 17 . 1 1 26 26 THR H H 26 8.223 8.223 7.505 0.718 18321 21796 1 17 . 1 1 27 27 ARG N N 27 119.096 119.096 118.254 0.842 18321 21797 1 17 . 1 1 27 27 ARG HA H 27 4.047 4.047 4.264 -0.217 18321 21798 1 17 . 1 1 27 27 ARG C C 27 177.245 177.245 176.781 0.464 18321 21799 1 17 . 1 1 27 27 ARG CA C 27 58.528 58.528 57.164 1.364 18321 21800 1 17 . 1 1 27 27 ARG CB C 27 30.184 30.184 30.294 -0.110 18321 21801 1 17 . 1 1 27 27 ARG H H 27 8.093 8.093 7.798 0.295 18321 21802 1 17 . 1 1 28 28 LEU N N 28 114.602 114.602 116.360 -1.758 18321 21803 1 17 . 1 1 28 28 LEU HA H 28 4.325 4.325 4.499 -0.174 18321 21804 1 17 . 1 1 28 28 LEU C C 28 177.197 177.197 175.667 1.530 18321 21805 1 17 . 1 1 28 28 LEU CA C 28 55.143 55.143 54.338 0.805 18321 21806 1 17 . 1 1 28 28 LEU CB C 28 44.902 44.902 43.576 1.326 18321 21807 1 17 . 1 1 28 28 LEU H H 28 7.438 7.438 7.525 -0.087 18321 21808 1 17 . 1 1 29 29 GLN N N 29 121.312 121.312 120.558 0.754 18321 21809 1 17 . 1 1 29 29 GLN HA H 29 3.856 3.856 4.132 -0.276 18321 21810 1 17 . 1 1 29 29 GLN C C 29 178.048 178.048 177.071 0.977 18321 21811 1 17 . 1 1 29 29 GLN CA C 29 57.691 57.691 57.072 0.619 18321 21812 1 17 . 1 1 29 29 GLN CB C 29 27.293 27.293 28.182 -0.889 18321 21813 1 17 . 1 1 29 29 GLN H H 29 8.250 8.250 8.178 0.072 18321 21814 1 17 . 1 1 30 30 GLY N N 30 116.768 116.768 114.619 2.149 18321 21815 1 17 . 1 1 30 30 GLY C C 30 174.914 174.914 174.028 0.886 18321 21816 1 17 . 1 1 30 30 GLY CA C 30 45.491 45.491 45.065 0.426 18321 21817 1 17 . 1 1 30 30 GLY H H 30 9.135 9.135 8.721 0.414 18321 21818 1 17 . 1 1 31 31 GLN N N 31 117.979 117.979 119.637 -1.658 18321 21819 1 17 . 1 1 31 31 GLN HA H 31 4.329 4.329 4.327 0.002 18321 21820 1 17 . 1 1 31 31 GLN C C 31 177.174 177.174 175.724 1.450 18321 21821 1 17 . 1 1 31 31 GLN CA C 31 53.910 53.910 55.227 -1.317 18321 21822 1 17 . 1 1 31 31 GLN CB C 31 29.574 29.574 29.659 -0.085 18321 21823 1 17 . 1 1 31 31 GLN H H 31 7.695 7.695 7.494 0.201 18321 21824 1 17 . 1 1 32 32 ARG N N 32 123.918 123.918 120.683 3.235 18321 21825 1 17 . 1 1 32 32 ARG HA H 32 3.940 3.940 3.992 -0.052 18321 21826 1 17 . 1 1 32 32 ARG C C 32 175.810 175.810 175.947 -0.137 18321 21827 1 17 . 1 1 32 32 ARG CA C 32 56.770 56.770 56.438 0.332 18321 21828 1 17 . 1 1 32 32 ARG CB C 32 30.074 30.074 30.736 -0.662 18321 21829 1 17 . 1 1 32 32 ARG H H 32 8.955 8.955 8.597 0.358 18321 21830 1 17 . 1 1 33 33 HIS N N 33 122.248 122.248 123.358 -1.110 18321 21831 1 17 . 1 1 33 33 HIS HA H 33 4.627 4.627 4.569 0.058 18321 21832 1 17 . 1 1 33 33 HIS C C 33 177.089 177.089 175.690 1.399 18321 21833 1 17 . 1 1 33 33 HIS CA C 33 55.858 55.858 56.798 -0.940 18321 21834 1 17 . 1 1 33 33 HIS CB C 33 28.648 28.648 30.529 -1.881 18321 21835 1 17 . 1 1 33 33 HIS H H 33 8.302 8.302 8.472 -0.170 18321 21836 1 17 . 1 1 34 34 GLY N N 34 109.518 109.518 111.870 -2.352 18321 21837 1 17 . 1 1 34 34 GLY C C 34 176.730 176.730 173.859 2.871 18321 21838 1 17 . 1 1 34 34 GLY CA C 34 45.967 45.967 44.998 0.969 18321 21839 1 17 . 1 1 34 34 GLY H H 34 9.496 9.496 9.308 0.188 18321 21840 1 17 . 1 1 35 35 MET N N 35 125.193 125.193 122.562 2.631 18321 21841 1 17 . 1 1 35 35 MET HA H 35 5.750 5.750 5.704 0.046 18321 21842 1 17 . 1 1 35 35 MET C C 35 174.388 174.388 175.012 -0.624 18321 21843 1 17 . 1 1 35 35 MET CA C 35 55.762 55.762 56.175 -0.413 18321 21844 1 17 . 1 1 35 35 MET CB C 35 32.706 32.706 34.336 -1.630 18321 21845 1 17 . 1 1 35 35 MET H H 35 8.359 8.359 7.268 1.091 18321 21846 1 17 . 1 1 36 36 PHE N N 36 123.311 123.311 118.115 5.196 18321 21847 1 17 . 1 1 36 36 PHE HA H 36 5.985 5.985 5.752 0.233 18321 21848 1 17 . 1 1 36 36 PHE C C 36 172.140 172.140 172.871 -0.731 18321 21849 1 17 . 1 1 36 36 PHE CA C 36 55.755 55.755 55.102 0.653 18321 21850 1 17 . 1 1 36 36 PHE CB C 36 45.197 45.197 42.776 2.421 18321 21851 1 17 . 1 1 36 36 PHE H H 36 8.261 8.261 7.823 0.438 18321 21852 1 17 . 1 1 37 37 LEU N N 37 114.652 114.652 115.718 -1.066 18321 21853 1 17 . 1 1 37 37 LEU HA H 37 4.489 4.489 5.055 -0.566 18321 21854 1 17 . 1 1 37 37 LEU C C 37 174.033 174.033 174.783 -0.750 18321 21855 1 17 . 1 1 37 37 LEU CA C 37 55.382 55.382 54.873 0.509 18321 21856 1 17 . 1 1 37 37 LEU CB C 37 44.791 44.791 45.442 -0.651 18321 21857 1 17 . 1 1 37 37 LEU H H 37 9.292 9.292 9.091 0.201 18321 21858 1 17 . 1 1 38 38 VAL N N 38 121.009 121.009 122.459 -1.450 18321 21859 1 17 . 1 1 38 38 VAL HA H 38 5.504 5.504 4.711 0.793 18321 21860 1 17 . 1 1 38 38 VAL C C 38 173.581 173.581 175.394 -1.813 18321 21861 1 17 . 1 1 38 38 VAL CA C 38 61.316 61.316 62.068 -0.752 18321 21862 1 17 . 1 1 38 38 VAL CB C 38 33.302 33.302 32.731 0.570 18321 21863 1 17 . 1 1 38 38 VAL H H 38 8.991 8.991 8.482 0.509 18321 21864 1 17 . 1 1 39 39 ARG N N 39 124.863 124.863 127.113 -2.250 18321 21865 1 17 . 1 1 39 39 ARG HA H 39 5.444 5.444 5.095 0.349 18321 21866 1 17 . 1 1 39 39 ARG C C 39 175.772 175.772 175.171 0.601 18321 21867 1 17 . 1 1 39 39 ARG CA C 39 52.558 52.558 53.668 -1.110 18321 21868 1 17 . 1 1 39 39 ARG CB C 39 34.980 34.980 32.977 2.003 18321 21869 1 17 . 1 1 39 39 ARG H H 39 9.569 9.569 8.643 0.926 18321 21870 1 17 . 1 1 40 40 ASP N N 40 122.330 122.330 119.753 2.577 18321 21871 1 17 . 1 1 40 40 ASP HA H 40 4.785 4.785 4.817 -0.032 18321 21872 1 17 . 1 1 40 40 ASP C C 40 176.332 176.332 175.783 0.549 18321 21873 1 17 . 1 1 40 40 ASP CA C 40 55.334 55.334 54.632 0.702 18321 21874 1 17 . 1 1 40 40 ASP CB C 40 40.650 40.650 41.373 -0.723 18321 21875 1 17 . 1 1 40 40 ASP H H 40 8.413 8.413 8.578 -0.165 18321 21876 1 17 . 1 1 41 41 SER N N 41 114.363 114.363 117.168 -2.805 18321 21877 1 17 . 1 1 41 41 SER HA H 41 4.506 4.506 4.566 -0.060 18321 21878 1 17 . 1 1 41 41 SER CA C 41 57.525 57.525 57.005 0.520 18321 21879 1 17 . 1 1 41 41 SER CB C 41 63.706 63.706 63.293 0.413 18321 21880 1 17 . 1 1 41 41 SER H H 41 7.791 7.791 8.207 -0.416 18321 21881 1 17 . 1 1 42 42 SER N N 42 126.932 126.932 124.344 2.588 18321 21882 1 17 . 1 1 42 42 SER HA H 42 4.410 4.410 4.421 -0.011 18321 21883 1 17 . 1 1 42 42 SER CA C 42 60.362 60.362 60.208 0.154 18321 21884 1 17 . 1 1 42 42 SER CB C 42 63.707 63.707 63.019 0.688 18321 21885 1 17 . 1 1 42 42 SER H H 42 10.519 10.519 8.823 1.696 18321 21886 1 17 . 1 1 43 43 THR HA H 43 4.097 4.097 4.313 -0.216 18321 21887 1 17 . 1 1 43 43 THR CA C 43 64.722 64.722 62.751 1.971 18321 21888 1 17 . 1 1 43 43 THR CB C 43 69.439 69.439 69.620 -0.181 18321 21889 1 17 . 1 1 44 44 CYS HA H 44 5.100 5.100 4.937 0.163 18321 21890 1 17 . 1 1 44 44 CYS CA C 44 51.779 51.779 56.737 -4.958 18321 21891 1 17 . 1 1 44 44 CYS CB C 44 41.314 41.314 29.773 11.541 18321 21892 1 17 . 1 1 45 45 PRO HA H 45 4.278 4.278 4.378 -0.100 18321 21893 1 17 . 1 1 45 45 PRO C C 45 178.127 178.127 176.722 1.405 18321 21894 1 17 . 1 1 45 45 PRO CA C 45 64.151 64.151 64.881 -0.730 18321 21895 1 17 . 1 1 45 45 PRO CB C 45 31.596 31.596 31.428 0.168 18321 21896 1 17 . 1 1 46 46 GLY N N 46 114.947 114.947 112.923 2.024 18321 21897 1 17 . 1 1 46 46 GLY C C 46 174.701 174.701 174.054 0.647 18321 21898 1 17 . 1 1 46 46 GLY CA C 46 45.225 45.225 44.849 0.376 18321 21899 1 17 . 1 1 46 46 GLY H H 46 8.812 8.812 8.499 0.313 18321 21900 1 17 . 1 1 47 47 ASP N N 47 120.862 120.862 121.686 -0.824 18321 21901 1 17 . 1 1 47 47 ASP HA H 47 5.235 5.235 4.676 0.559 18321 21902 1 17 . 1 1 47 47 ASP C C 47 176.480 176.480 174.841 1.639 18321 21903 1 17 . 1 1 47 47 ASP CA C 47 53.591 53.591 54.726 -1.135 18321 21904 1 17 . 1 1 47 47 ASP CB C 47 41.707 41.707 42.077 -0.370 18321 21905 1 17 . 1 1 47 47 ASP H H 47 7.997 7.997 7.844 0.153 18321 21906 1 17 . 1 1 48 48 TYR N N 48 118.473 118.473 115.570 2.903 18321 21907 1 17 . 1 1 48 48 TYR HA H 48 5.431 5.431 5.236 0.195 18321 21908 1 17 . 1 1 48 48 TYR C C 48 173.783 173.783 175.650 -1.867 18321 21909 1 17 . 1 1 48 48 TYR CA C 48 56.891 56.891 56.867 0.024 18321 21910 1 17 . 1 1 48 48 TYR CB C 48 43.274 43.274 43.028 0.246 18321 21911 1 17 . 1 1 48 48 TYR H H 48 8.892 8.892 8.907 -0.015 18321 21912 1 17 . 1 1 49 49 VAL N N 49 119.105 119.105 119.402 -0.297 18321 21913 1 17 . 1 1 49 49 VAL HA H 49 4.800 4.800 4.542 0.258 18321 21914 1 17 . 1 1 49 49 VAL C C 49 174.397 174.397 174.770 -0.373 18321 21915 1 17 . 1 1 49 49 VAL CA C 49 61.439 61.439 62.417 -0.978 18321 21916 1 17 . 1 1 49 49 VAL CB C 49 35.388 35.388 34.173 1.214 18321 21917 1 17 . 1 1 49 49 VAL H H 49 9.661 9.661 8.654 1.007 18321 21918 1 17 . 1 1 50 50 LEU N N 50 129.599 129.599 131.230 -1.631 18321 21919 1 17 . 1 1 50 50 LEU HA H 50 5.033 5.033 5.149 -0.116 18321 21920 1 17 . 1 1 50 50 LEU C C 50 175.001 175.001 175.418 -0.417 18321 21921 1 17 . 1 1 50 50 LEU CA C 50 53.352 53.352 53.827 -0.475 18321 21922 1 17 . 1 1 50 50 LEU CB C 50 44.062 44.062 42.481 1.581 18321 21923 1 17 . 1 1 50 50 LEU H H 50 9.405 9.405 9.329 0.076 18321 21924 1 17 . 1 1 51 51 SER N N 51 126.895 126.895 124.842 2.053 18321 21925 1 17 . 1 1 51 51 SER HA H 51 5.731 5.731 5.223 0.508 18321 21926 1 17 . 1 1 51 51 SER C C 51 173.094 173.094 173.359 -0.265 18321 21927 1 17 . 1 1 51 51 SER CA C 51 58.834 58.834 57.121 1.713 18321 21928 1 17 . 1 1 51 51 SER CB C 51 64.977 64.977 63.774 1.203 18321 21929 1 17 . 1 1 51 51 SER H H 51 9.094 9.094 9.149 -0.055 18321 21930 1 17 . 1 1 52 52 VAL N N 52 121.777 121.777 125.991 -4.214 18321 21931 1 17 . 1 1 52 52 VAL HA H 52 5.066 5.066 4.611 0.455 18321 21932 1 17 . 1 1 52 52 VAL C C 52 174.573 174.573 174.408 0.165 18321 21933 1 17 . 1 1 52 52 VAL CA C 52 59.535 59.535 60.556 -1.021 18321 21934 1 17 . 1 1 52 52 VAL CB C 52 36.834 36.834 34.905 1.929 18321 21935 1 17 . 1 1 52 52 VAL H H 52 8.816 8.816 8.778 0.038 18321 21936 1 17 . 1 1 53 53 SER N N 53 120.489 120.489 121.284 -0.795 18321 21937 1 17 . 1 1 53 53 SER HA H 53 4.811 4.811 4.494 0.317 18321 21938 1 17 . 1 1 53 53 SER C C 53 174.065 174.065 172.493 1.572 18321 21939 1 17 . 1 1 53 53 SER CA C 53 57.496 57.496 57.975 -0.479 18321 21940 1 17 . 1 1 53 53 SER CB C 53 62.623 62.623 63.199 -0.576 18321 21941 1 17 . 1 1 53 53 SER H H 53 8.780 8.780 9.186 -0.406 18321 21942 1 17 . 1 1 54 54 GLU N N 54 132.020 132.020 127.177 4.843 18321 21943 1 17 . 1 1 54 54 GLU HA H 54 4.250 4.250 4.359 -0.109 18321 21944 1 17 . 1 1 54 54 GLU C C 54 175.387 175.387 174.853 0.534 18321 21945 1 17 . 1 1 54 54 GLU CA C 54 56.999 56.999 55.090 1.909 18321 21946 1 17 . 1 1 54 54 GLU CB C 54 32.556 32.556 33.558 -1.002 18321 21947 1 17 . 1 1 54 54 GLU H H 54 8.472 8.472 7.683 0.789 18321 21948 1 17 . 1 1 55 55 ASN N N 55 126.517 126.517 118.095 8.422 18321 21949 1 17 . 1 1 55 55 ASN HA H 55 4.220 4.220 4.037 0.183 18321 21950 1 17 . 1 1 55 55 ASN C C 55 174.546 174.546 174.667 -0.121 18321 21951 1 17 . 1 1 55 55 ASN CA C 55 54.770 54.770 53.755 1.014 18321 21952 1 17 . 1 1 55 55 ASN CB C 55 37.314 37.314 36.368 0.946 18321 21953 1 17 . 1 1 55 55 ASN H H 55 8.853 8.853 8.123 0.730 18321 21954 1 17 . 1 1 56 56 SER N N 56 112.009 112.009 109.566 2.443 18321 21955 1 17 . 1 1 56 56 SER HA H 56 4.334 4.334 4.074 0.260 18321 21956 1 17 . 1 1 56 56 SER C C 56 173.354 173.354 173.668 -0.314 18321 21957 1 17 . 1 1 56 56 SER CA C 56 59.966 59.966 59.526 0.440 18321 21958 1 17 . 1 1 56 56 SER CB C 56 62.242 62.242 62.821 -0.579 18321 21959 1 17 . 1 1 56 56 SER H H 56 10.418 10.418 7.731 2.688 18321 21960 1 17 . 1 1 57 57 ARG N N 57 121.764 121.764 118.874 2.890 18321 21961 1 17 . 1 1 57 57 ARG HA H 57 5.167 5.167 4.397 0.770 18321 21962 1 17 . 1 1 57 57 ARG C C 57 174.983 174.983 174.346 0.637 18321 21963 1 17 . 1 1 57 57 ARG CA C 57 54.550 54.550 55.763 -1.212 18321 21964 1 17 . 1 1 57 57 ARG CB C 57 31.886 31.886 31.341 0.545 18321 21965 1 17 . 1 1 57 57 ARG H H 57 8.097 8.097 7.563 0.534 18321 21966 1 17 . 1 1 58 58 VAL N N 58 121.866 121.866 123.011 -1.145 18321 21967 1 17 . 1 1 58 58 VAL HA H 58 4.768 4.768 4.314 0.454 18321 21968 1 17 . 1 1 58 58 VAL C C 58 175.388 175.388 175.384 0.004 18321 21969 1 17 . 1 1 58 58 VAL CA C 58 61.818 61.818 62.532 -0.714 18321 21970 1 17 . 1 1 58 58 VAL CB C 58 34.135 34.135 31.292 2.843 18321 21971 1 17 . 1 1 58 58 VAL H H 58 8.081 8.081 8.357 -0.276 18321 21972 1 17 . 1 1 59 59 SER N N 59 124.445 124.445 122.825 1.620 18321 21973 1 17 . 1 1 59 59 SER HA H 59 4.462 4.462 4.341 0.121 18321 21974 1 17 . 1 1 59 59 SER C C 59 172.185 172.185 173.289 -1.104 18321 21975 1 17 . 1 1 59 59 SER CA C 59 56.629 56.629 57.840 -1.211 18321 21976 1 17 . 1 1 59 59 SER CB C 59 66.218 66.218 63.391 2.827 18321 21977 1 17 . 1 1 59 59 SER H H 59 9.082 9.082 8.360 0.722 18321 21978 1 17 . 1 1 60 60 HIS N N 60 121.224 121.224 125.895 -4.671 18321 21979 1 17 . 1 1 60 60 HIS HA H 60 4.885 4.885 4.655 0.230 18321 21980 1 17 . 1 1 60 60 HIS C C 60 174.674 174.674 174.330 0.344 18321 21981 1 17 . 1 1 60 60 HIS CA C 60 54.900 54.900 55.420 -0.520 18321 21982 1 17 . 1 1 60 60 HIS CB C 60 32.331 32.331 29.292 3.039 18321 21983 1 17 . 1 1 60 60 HIS H H 60 8.331 8.331 8.674 -0.343 18321 21984 1 17 . 1 1 61 61 TYR N N 61 124.780 124.780 125.347 -0.567 18321 21985 1 17 . 1 1 61 61 TYR HA H 61 4.655 4.655 4.729 -0.074 18321 21986 1 17 . 1 1 61 61 TYR CA C 61 57.409 57.409 57.186 0.223 18321 21987 1 17 . 1 1 61 61 TYR CB C 61 39.785 39.785 37.969 1.816 18321 21988 1 17 . 1 1 61 61 TYR H H 61 9.273 9.273 9.177 0.096 18321 21989 1 17 . 1 1 62 62 ILE HA H 62 4.298 4.298 4.304 -0.006 18321 21990 1 17 . 1 1 62 62 ILE C C 62 174.817 174.817 175.700 -0.883 18321 21991 1 17 . 1 1 62 62 ILE CA C 62 61.908 61.908 61.728 0.180 18321 21992 1 17 . 1 1 62 62 ILE CB C 62 38.321 38.321 38.836 -0.515 18321 21993 1 17 . 1 1 63 63 ILE N N 63 128.552 128.552 129.659 -1.107 18321 21994 1 17 . 1 1 63 63 ILE HA H 63 4.788 4.788 4.536 0.252 18321 21995 1 17 . 1 1 63 63 ILE C C 63 175.982 175.982 174.628 1.354 18321 21996 1 17 . 1 1 63 63 ILE CA C 63 59.629 59.629 60.185 -0.556 18321 21997 1 17 . 1 1 63 63 ILE CB C 63 39.747 39.747 38.266 1.481 18321 21998 1 17 . 1 1 63 63 ILE H H 63 9.155 9.155 8.836 0.319 18321 21999 1 17 . 1 1 64 64 ASN N N 64 123.240 123.240 127.932 -4.692 18321 22000 1 17 . 1 1 64 64 ASN HA H 64 4.857 4.857 5.499 -0.642 18321 22001 1 17 . 1 1 64 64 ASN C C 64 175.324 175.324 175.212 0.112 18321 22002 1 17 . 1 1 64 64 ASN CA C 64 53.736 53.736 53.116 0.620 18321 22003 1 17 . 1 1 64 64 ASN CB C 64 41.531 41.531 40.097 1.434 18321 22004 1 17 . 1 1 64 64 ASN H H 64 9.379 9.379 8.789 0.590 18321 22005 1 17 . 1 1 65 65 SER N N 65 121.157 121.157 120.805 0.352 18321 22006 1 17 . 1 1 65 65 SER HA H 65 4.548 4.548 4.595 -0.047 18321 22007 1 17 . 1 1 65 65 SER C C 65 174.328 174.328 174.010 0.318 18321 22008 1 17 . 1 1 65 65 SER CA C 65 58.306 58.306 58.024 0.282 18321 22009 1 17 . 1 1 65 65 SER CB C 65 62.878 62.878 62.786 0.092 18321 22010 1 17 . 1 1 65 65 SER H H 65 9.195 9.195 9.370 -0.175 18321 22011 1 17 . 1 1 66 66 LEU N N 66 127.417 127.417 128.678 -1.261 18321 22012 1 17 . 1 1 66 66 LEU HA H 66 4.605 4.605 4.582 0.023 18321 22013 1 17 . 1 1 66 66 LEU CA C 66 52.888 52.888 52.043 0.845 18321 22014 1 17 . 1 1 66 66 LEU CB C 66 41.799 41.799 41.481 0.318 18321 22015 1 17 . 1 1 66 66 LEU H H 66 8.143 8.143 8.056 0.087 18321 22016 1 17 . 1 1 68 68 ASN HA H 68 4.386 4.386 4.542 -0.156 18321 22017 1 17 . 1 1 68 68 ASN C C 68 174.487 174.487 175.278 -0.791 18321 22018 1 17 . 1 1 68 68 ASN CA C 68 53.365 53.365 52.205 1.160 18321 22019 1 17 . 1 1 68 68 ASN CB C 68 36.778 36.778 37.338 -0.560 18321 22020 1 17 . 1 1 69 69 ARG N N 69 111.329 111.329 118.570 -7.241 18321 22021 1 17 . 1 1 69 69 ARG HA H 69 3.876 3.876 3.834 0.042 18321 22022 1 17 . 1 1 69 69 ARG CA C 69 57.393 57.393 56.956 0.437 18321 22023 1 17 . 1 1 69 69 ARG CB C 69 26.665 26.665 27.843 -1.177 18321 22024 1 17 . 1 1 69 69 ARG H H 69 8.191 8.191 7.530 0.661 18321 22025 1 17 . 1 1 70 70 ARG N N 70 116.120 116.120 115.266 0.854 18321 22026 1 17 . 1 1 70 70 ARG HA H 70 4.556 4.556 4.838 -0.282 18321 22027 1 17 . 1 1 70 70 ARG C C 70 174.882 174.882 174.022 0.860 18321 22028 1 17 . 1 1 70 70 ARG CA C 70 55.509 55.509 53.928 1.581 18321 22029 1 17 . 1 1 70 70 ARG CB C 70 31.771 31.771 34.185 -2.414 18321 22030 1 17 . 1 1 70 70 ARG H H 70 6.667 6.667 7.458 -0.791 18321 22031 1 17 . 1 1 71 71 PHE N N 71 116.313 116.313 118.691 -2.378 18321 22032 1 17 . 1 1 71 71 PHE HA H 71 5.540 5.540 5.672 -0.132 18321 22033 1 17 . 1 1 71 71 PHE C C 71 174.391 174.391 175.015 -0.624 18321 22034 1 17 . 1 1 71 71 PHE CA C 71 57.528 57.528 56.299 1.229 18321 22035 1 17 . 1 1 71 71 PHE CB C 71 44.115 44.115 42.187 1.928 18321 22036 1 17 . 1 1 71 71 PHE H H 71 8.700 8.700 9.300 -0.600 18321 22037 1 17 . 1 1 72 72 LYS N N 72 122.770 122.770 126.575 -3.805 18321 22038 1 17 . 1 1 72 72 LYS HA H 72 5.483 5.483 5.007 0.476 18321 22039 1 17 . 1 1 72 72 LYS C C 72 173.923 173.923 176.131 -2.208 18321 22040 1 17 . 1 1 72 72 LYS CA C 72 54.855 54.855 54.919 -0.064 18321 22041 1 17 . 1 1 72 72 LYS CB C 72 37.710 37.710 34.017 3.693 18321 22042 1 17 . 1 1 72 72 LYS H H 72 9.138 9.138 8.819 0.319 18321 22043 1 17 . 1 1 73 73 ILE N N 73 124.576 124.576 130.038 -5.462 18321 22044 1 17 . 1 1 73 73 ILE HA H 73 4.955 4.955 4.570 0.385 18321 22045 1 17 . 1 1 73 73 ILE C C 73 175.728 175.728 175.909 -0.181 18321 22046 1 17 . 1 1 73 73 ILE CA C 73 58.935 58.935 60.764 -1.829 18321 22047 1 17 . 1 1 73 73 ILE CB C 73 40.965 40.965 37.354 3.611 18321 22048 1 17 . 1 1 73 73 ILE H H 73 8.826 8.826 8.525 0.301 18321 22049 1 17 . 1 1 74 74 GLY N N 74 118.718 118.718 115.245 3.473 18321 22050 1 17 . 1 1 74 74 GLY C C 74 174.436 174.436 173.419 1.017 18321 22051 1 17 . 1 1 74 74 GLY CA C 74 47.401 47.401 46.570 0.831 18321 22052 1 17 . 1 1 74 74 GLY H H 74 9.317 9.317 8.743 0.574 18321 22053 1 17 . 1 1 75 75 ASP N N 75 125.691 125.691 117.940 7.751 18321 22054 1 17 . 1 1 75 75 ASP HA H 75 4.713 4.713 4.531 0.182 18321 22055 1 17 . 1 1 75 75 ASP C C 75 175.841 175.841 174.509 1.332 18321 22056 1 17 . 1 1 75 75 ASP CA C 75 53.815 53.815 54.167 -0.352 18321 22057 1 17 . 1 1 75 75 ASP CB C 75 41.288 41.288 40.957 0.331 18321 22058 1 17 . 1 1 75 75 ASP H H 75 8.665 8.665 8.264 0.401 18321 22059 1 17 . 1 1 76 76 GLN N N 76 120.368 120.368 121.438 -1.070 18321 22060 1 17 . 1 1 76 76 GLN C C 76 173.630 173.630 174.788 -1.158 18321 22061 1 17 . 1 1 76 76 GLN CA C 76 54.254 54.254 55.684 -1.430 18321 22062 1 17 . 1 1 76 76 GLN CB C 76 31.248 31.248 28.612 2.636 18321 22063 1 17 . 1 1 76 76 GLN H H 76 8.289 8.289 8.206 0.083 18321 22064 1 17 . 1 1 77 77 GLU N N 77 120.435 120.435 122.687 -2.252 18321 22065 1 17 . 1 1 77 77 GLU C C 77 175.484 175.484 175.134 0.350 18321 22066 1 17 . 1 1 77 77 GLU CA C 77 54.203 54.203 54.764 -0.562 18321 22067 1 17 . 1 1 77 77 GLU CB C 77 33.141 33.141 29.441 3.700 18321 22068 1 17 . 1 1 77 77 GLU H H 77 7.732 7.732 8.239 -0.507 18321 22069 1 17 . 1 1 78 78 PHE N N 78 117.911 117.911 126.171 -8.260 18321 22070 1 17 . 1 1 78 78 PHE HA H 78 4.659 4.659 4.577 0.082 18321 22071 1 17 . 1 1 78 78 PHE C C 78 175.673 175.673 176.494 -0.821 18321 22072 1 17 . 1 1 78 78 PHE CA C 78 57.160 57.160 56.668 0.492 18321 22073 1 17 . 1 1 78 78 PHE CB C 78 45.405 45.405 40.437 4.968 18321 22074 1 17 . 1 1 78 78 PHE H H 78 9.235 9.235 8.386 0.849 18321 22075 1 17 . 1 1 79 79 ASP N N 79 119.296 119.296 118.970 0.326 18321 22076 1 17 . 1 1 79 79 ASP HA H 79 4.462 4.462 4.503 -0.041 18321 22077 1 17 . 1 1 79 79 ASP C C 79 174.482 174.482 176.150 -1.668 18321 22078 1 17 . 1 1 79 79 ASP CA C 79 56.629 56.629 56.486 0.143 18321 22079 1 17 . 1 1 79 79 ASP CB C 79 41.697 41.697 41.121 0.576 18321 22080 1 17 . 1 1 79 79 ASP H H 79 9.187 9.187 8.885 0.302 18321 22081 1 17 . 1 1 80 80 HIS N N 80 107.631 107.631 110.309 -2.678 18321 22082 1 17 . 1 1 80 80 HIS HA H 80 5.022 5.022 5.078 -0.056 18321 22083 1 17 . 1 1 80 80 HIS C C 80 174.626 174.626 175.040 -0.414 18321 22084 1 17 . 1 1 80 80 HIS CA C 80 54.223 54.223 55.020 -0.797 18321 22085 1 17 . 1 1 80 80 HIS CB C 80 32.205 32.205 31.274 0.931 18321 22086 1 17 . 1 1 80 80 HIS H H 80 7.200 7.200 7.160 0.040 18321 22087 1 17 . 1 1 81 81 LEU N N 81 120.710 120.710 121.326 -0.616 18321 22088 1 17 . 1 1 81 81 LEU HA H 81 3.804 3.804 4.090 -0.286 18321 22089 1 17 . 1 1 81 81 LEU CA C 81 58.709 58.709 59.921 -1.212 18321 22090 1 17 . 1 1 81 81 LEU CB C 81 39.646 39.646 39.857 -0.211 18321 22091 1 17 . 1 1 81 81 LEU H H 81 8.886 8.886 9.005 -0.119 18321 22092 1 17 . 1 1 82 82 PRO HA H 82 4.020 4.020 4.191 -0.171 18321 22093 1 17 . 1 1 82 82 PRO C C 82 175.619 175.619 177.086 -1.467 18321 22094 1 17 . 1 1 82 82 PRO CA C 82 67.025 67.025 64.732 2.293 18321 22095 1 17 . 1 1 82 82 PRO CB C 82 30.962 30.962 30.821 0.141 18321 22096 1 17 . 1 1 83 83 ALA N N 83 124.281 124.281 120.187 4.094 18321 22097 1 17 . 1 1 83 83 ALA HA H 83 4.019 4.019 4.099 -0.080 18321 22098 1 17 . 1 1 83 83 ALA C C 83 179.709 179.709 178.805 0.904 18321 22099 1 17 . 1 1 83 83 ALA CA C 83 54.985 54.985 54.164 0.821 18321 22100 1 17 . 1 1 83 83 ALA CB C 83 18.425 18.425 18.306 0.119 18321 22101 1 17 . 1 1 83 83 ALA H H 83 8.527 8.527 7.589 0.938 18321 22102 1 17 . 1 1 84 84 LEU N N 84 122.960 122.960 117.249 5.711 18321 22103 1 17 . 1 1 84 84 LEU HA H 84 1.917 1.917 2.926 -1.009 18321 22104 1 17 . 1 1 84 84 LEU C C 84 177.652 177.652 178.122 -0.470 18321 22105 1 17 . 1 1 84 84 LEU CA C 84 58.261 58.261 57.085 1.176 18321 22106 1 17 . 1 1 84 84 LEU CB C 84 42.544 42.544 41.130 1.414 18321 22107 1 17 . 1 1 84 84 LEU H H 84 6.982 6.982 7.331 -0.349 18321 22108 1 17 . 1 1 85 85 LEU N N 85 117.940 117.940 118.319 -0.379 18321 22109 1 17 . 1 1 85 85 LEU HA H 85 3.463 3.463 3.875 -0.412 18321 22110 1 17 . 1 1 85 85 LEU C C 85 178.809 178.809 178.161 0.648 18321 22111 1 17 . 1 1 85 85 LEU CA C 85 57.522 57.522 57.064 0.458 18321 22112 1 17 . 1 1 85 85 LEU CB C 85 41.242 41.242 41.312 -0.070 18321 22113 1 17 . 1 1 85 85 LEU H H 85 7.773 7.773 7.320 0.453 18321 22114 1 17 . 1 1 86 86 GLU N N 86 115.762 115.762 117.805 -2.043 18321 22115 1 17 . 1 1 86 86 GLU HA H 86 3.540 3.540 4.031 -0.491 18321 22116 1 17 . 1 1 86 86 GLU C C 86 180.228 180.228 178.483 1.745 18321 22117 1 17 . 1 1 86 86 GLU CA C 86 58.943 58.943 57.896 1.047 18321 22118 1 17 . 1 1 86 86 GLU CB C 86 29.561 29.561 29.572 -0.011 18321 22119 1 17 . 1 1 86 86 GLU H H 86 8.300 8.300 7.705 0.595 18321 22120 1 17 . 1 1 87 87 PHE N N 87 121.135 121.135 121.237 -0.102 18321 22121 1 17 . 1 1 87 87 PHE HA H 87 4.122 4.122 4.175 -0.053 18321 22122 1 17 . 1 1 87 87 PHE C C 87 179.497 179.497 176.309 3.188 18321 22123 1 17 . 1 1 87 87 PHE CA C 87 62.090 62.090 59.822 2.268 18321 22124 1 17 . 1 1 87 87 PHE CB C 87 40.103 40.103 39.011 1.092 18321 22125 1 17 . 1 1 87 87 PHE H H 87 7.717 7.717 7.387 0.330 18321 22126 1 17 . 1 1 88 88 TYR N N 88 116.579 116.579 117.071 -0.492 18321 22127 1 17 . 1 1 88 88 TYR HA H 88 4.933 4.933 4.377 0.556 18321 22128 1 17 . 1 1 88 88 TYR C C 88 174.799 174.799 176.520 -1.721 18321 22129 1 17 . 1 1 88 88 TYR CA C 88 61.333 61.333 58.294 3.039 18321 22130 1 17 . 1 1 88 88 TYR CB C 88 36.539 36.539 37.126 -0.587 18321 22131 1 17 . 1 1 88 88 TYR H H 88 7.478 7.478 7.712 -0.234 18321 22132 1 17 . 1 1 89 89 LYS N N 89 117.737 117.737 119.200 -1.463 18321 22133 1 17 . 1 1 89 89 LYS HA H 89 4.466 4.466 4.064 0.402 18321 22134 1 17 . 1 1 89 89 LYS C C 89 178.417 178.417 176.812 1.605 18321 22135 1 17 . 1 1 89 89 LYS CA C 89 59.486 59.486 59.000 0.486 18321 22136 1 17 . 1 1 89 89 LYS CB C 89 34.523 34.523 32.739 1.784 18321 22137 1 17 . 1 1 89 89 LYS H H 89 7.505 7.505 7.529 -0.024 18321 22138 1 17 . 1 1 90 90 ILE N N 90 110.972 110.972 110.633 0.339 18321 22139 1 17 . 1 1 90 90 ILE HA H 90 4.181 4.181 4.129 0.052 18321 22140 1 17 . 1 1 90 90 ILE C C 90 174.571 174.571 175.103 -0.532 18321 22141 1 17 . 1 1 90 90 ILE CA C 90 60.516 60.516 60.279 0.237 18321 22142 1 17 . 1 1 90 90 ILE CB C 90 39.979 39.979 38.379 1.600 18321 22143 1 17 . 1 1 90 90 ILE H H 90 6.710 6.710 7.076 -0.366 18321 22144 1 17 . 1 1 91 91 HIS N N 91 119.479 119.479 121.619 -2.140 18321 22145 1 17 . 1 1 91 91 HIS HA H 91 4.357 4.357 4.528 -0.171 18321 22146 1 17 . 1 1 91 91 HIS C C 91 172.751 172.751 173.838 -1.087 18321 22147 1 17 . 1 1 91 91 HIS CA C 91 55.066 55.066 54.918 0.148 18321 22148 1 17 . 1 1 91 91 HIS CB C 91 29.756 29.756 29.462 0.294 18321 22149 1 17 . 1 1 91 91 HIS H H 91 7.460 7.460 7.194 0.266 18321 22150 1 17 . 1 1 92 92 TYR N N 92 117.642 117.642 125.542 -7.900 18321 22151 1 17 . 1 1 92 92 TYR HA H 92 4.131 4.131 4.461 -0.330 18321 22152 1 17 . 1 1 92 92 TYR C C 92 177.348 177.348 176.257 1.091 18321 22153 1 17 . 1 1 92 92 TYR CA C 92 58.627 58.627 58.877 -0.250 18321 22154 1 17 . 1 1 92 92 TYR CB C 92 39.481 39.481 37.162 2.319 18321 22155 1 17 . 1 1 92 92 TYR H H 92 8.067 8.067 8.789 -0.722 18321 22156 1 17 . 1 1 93 93 LEU N N 93 123.560 123.560 125.139 -1.579 18321 22157 1 17 . 1 1 93 93 LEU HA H 93 4.104 4.104 4.296 -0.192 18321 22158 1 17 . 1 1 93 93 LEU C C 93 175.610 175.610 176.752 -1.142 18321 22159 1 17 . 1 1 93 93 LEU CA C 93 56.381 56.381 56.693 -0.312 18321 22160 1 17 . 1 1 93 93 LEU CB C 93 38.896 38.896 42.298 -3.402 18321 22161 1 17 . 1 1 93 93 LEU H H 93 7.907 7.907 8.296 -0.389 18321 22162 1 17 . 1 1 94 94 ASP N N 94 118.194 118.194 113.388 4.806 18321 22163 1 17 . 1 1 94 94 ASP HA H 94 4.940 4.940 4.748 0.192 18321 22164 1 17 . 1 1 94 94 ASP C C 94 176.123 176.123 175.280 0.843 18321 22165 1 17 . 1 1 94 94 ASP CA C 94 56.235 56.235 53.614 2.621 18321 22166 1 17 . 1 1 94 94 ASP CB C 94 42.078 42.078 39.626 2.452 18321 22167 1 17 . 1 1 94 94 ASP H H 94 8.640 8.640 7.769 0.871 18321 22168 1 17 . 1 1 95 95 THR N N 95 105.073 105.073 113.229 -8.156 18321 22169 1 17 . 1 1 95 95 THR HA H 95 4.318 4.318 3.917 0.401 18321 22170 1 17 . 1 1 95 95 THR C C 95 174.685 174.685 173.175 1.510 18321 22171 1 17 . 1 1 95 95 THR CA C 95 60.756 60.756 65.302 -4.546 18321 22172 1 17 . 1 1 95 95 THR CB C 95 71.058 71.058 68.962 2.096 18321 22173 1 17 . 1 1 95 95 THR H H 95 8.576 8.576 8.797 -0.221 18321 22174 1 17 . 1 1 96 96 THR N N 96 116.817 116.817 115.798 1.019 18321 22175 1 17 . 1 1 96 96 THR HA H 96 5.129 5.129 4.865 0.264 18321 22176 1 17 . 1 1 96 96 THR C C 96 172.464 172.464 173.433 -0.969 18321 22177 1 17 . 1 1 96 96 THR CA C 96 60.762 60.762 61.388 -0.626 18321 22178 1 17 . 1 1 96 96 THR CB C 96 71.425 71.425 71.888 -0.463 18321 22179 1 17 . 1 1 96 96 THR H H 96 8.205 8.205 7.864 0.341 18321 22180 1 17 . 1 1 97 97 THR N N 97 114.324 114.324 113.720 0.604 18321 22181 1 17 . 1 1 97 97 THR HA H 97 5.128 5.128 4.443 0.685 18321 22182 1 17 . 1 1 97 97 THR C C 97 175.480 175.480 174.469 1.011 18321 22183 1 17 . 1 1 97 97 THR CA C 97 60.233 60.233 59.414 0.819 18321 22184 1 17 . 1 1 97 97 THR CB C 97 70.415 70.415 70.130 0.285 18321 22185 1 17 . 1 1 97 97 THR H H 97 7.128 7.128 8.290 -1.162 18321 22186 1 17 . 1 1 98 98 LEU N N 98 116.674 116.674 121.653 -4.979 18321 22187 1 17 . 1 1 98 98 LEU HA H 98 4.075 4.075 3.995 0.080 18321 22188 1 17 . 1 1 98 98 LEU C C 98 177.892 177.892 176.592 1.300 18321 22189 1 17 . 1 1 98 98 LEU CA C 98 59.597 59.597 55.474 4.123 18321 22190 1 17 . 1 1 98 98 LEU CB C 98 41.172 41.172 40.766 0.406 18321 22191 1 17 . 1 1 98 98 LEU H H 98 8.743 8.743 7.887 0.856 18321 22192 1 17 . 1 1 99 99 ILE N N 99 122.988 122.988 123.429 -0.441 18321 22193 1 17 . 1 1 99 99 ILE HA H 99 4.415 4.415 4.234 0.181 18321 22194 1 17 . 1 1 99 99 ILE C C 99 175.055 175.055 175.944 -0.889 18321 22195 1 17 . 1 1 99 99 ILE CA C 99 62.183 62.183 61.613 0.570 18321 22196 1 17 . 1 1 99 99 ILE CB C 99 40.252 40.252 38.831 1.421 18321 22197 1 17 . 1 1 99 99 ILE H H 99 8.998 8.998 8.075 0.923 18321 22198 1 17 . 1 1 100 100 GLU N N 100 114.067 114.067 114.949 -0.882 18321 22199 1 17 . 1 1 100 100 GLU CA C 100 52.910 52.910 53.570 -0.660 18321 22200 1 17 . 1 1 100 100 GLU CB C 100 31.155 31.155 31.177 -0.022 18321 22201 1 17 . 1 1 100 100 GLU H H 100 7.332 7.332 7.905 -0.573 18321 22202 1 17 . 1 1 101 101 PRO HA H 101 4.952 4.952 3.588 1.364 18321 22203 1 17 . 1 1 101 101 PRO C C 101 175.976 175.976 176.040 -0.064 18321 22204 1 17 . 1 1 101 101 PRO CA C 101 53.312 53.312 61.861 -8.549 18321 22205 1 17 . 1 1 101 101 PRO CB C 101 31.598 31.598 32.053 -0.456 18321 22206 1 17 . 1 1 102 102 ALA N N 102 125.968 125.968 123.635 2.333 18321 22207 1 17 . 1 1 102 102 ALA HA H 102 4.516 4.516 4.291 0.225 18321 22208 1 17 . 1 1 102 102 ALA CA C 102 49.852 49.852 50.797 -0.945 18321 22209 1 17 . 1 1 102 102 ALA CB C 102 17.766 17.766 18.000 -0.234 18321 22210 1 17 . 1 1 102 102 ALA H H 102 8.232 8.232 8.208 0.024 18321 22211 1 17 . 1 1 103 103 PRO HA H 103 4.283 4.283 4.388 -0.105 18321 22212 1 17 . 1 1 103 103 PRO CA C 103 62.435 62.435 63.136 -0.701 18321 22213 1 17 . 1 1 103 103 PRO CB C 103 32.145 32.145 32.168 -0.023 18321 22214 1 17 . 1 1 104 104 ARG HA H 104 4.004 4.004 4.137 -0.133 18321 22215 1 17 . 1 1 104 104 ARG CA C 104 56.660 56.660 57.549 -0.889 18321 22216 1 17 . 1 1 106 106 PRO C C 106 174.587 174.587 176.315 -1.728 18321 22217 1 17 . 1 1 106 106 PRO CA C 106 57.867 57.867 64.014 -6.147 18321 22218 1 17 . 1 1 106 106 PRO CB C 106 31.942 31.942 31.644 0.298 18321 22219 1 17 . 1 1 107 107 SER N N 107 121.280 121.280 113.783 7.497 18321 22220 1 17 . 1 1 107 107 SER CA C 107 61.772 61.772 58.368 3.404 18321 22221 1 17 . 1 1 107 107 SER CB C 107 63.234 63.234 61.644 1.590 18321 22222 1 17 . 1 1 107 107 SER H H 107 8.132 8.132 8.237 -0.105 18321 22223 1 17 . 1 1 109 109 PRO C C 109 177.129 177.129 177.261 -0.132 18321 22224 1 17 . 1 1 109 109 PRO CA C 109 62.638 62.638 63.943 -1.305 18321 22225 1 17 . 1 1 109 109 PRO CB C 109 30.970 30.970 31.697 -0.727 18321 22226 1 17 . 1 1 110 110 MET N N 110 120.772 120.772 120.495 0.277 18321 22227 1 17 . 1 1 110 110 MET C C 110 176.892 176.892 175.355 1.537 18321 22228 1 17 . 1 1 110 110 MET CA C 110 55.310 55.310 54.307 1.003 18321 22229 1 17 . 1 1 110 110 MET CB C 110 32.202 32.202 31.707 0.495 18321 22230 1 17 . 1 1 110 110 MET H H 110 8.430 8.430 7.595 0.835 18321 22231 1 17 . 1 1 111 111 GLY N N 111 110.158 110.158 112.791 -2.633 18321 22232 1 17 . 1 1 111 111 GLY C C 111 177.430 177.430 173.887 3.543 18321 22233 1 17 . 1 1 111 111 GLY CA C 111 44.951 44.951 45.095 -0.144 18321 22234 1 17 . 1 1 111 111 GLY H H 111 8.384 8.384 8.099 0.285 18321 22235 1 17 . 1 1 112 112 SER N N 112 116.762 116.762 120.139 -3.377 18321 22236 1 17 . 1 1 112 112 SER CA C 112 55.948 55.948 57.451 -1.503 18321 22237 1 17 . 1 1 112 112 SER CB C 112 62.745 62.745 65.374 -2.629 18321 22238 1 17 . 1 1 112 112 SER H H 112 8.161 8.161 7.949 0.212 18321 22239 1 17 . 1 1 113 113 VAL C C 113 176.083 176.083 175.334 0.749 18321 22240 1 17 . 1 1 114 114 SER N N 114 119.151 119.151 124.807 -5.656 18321 22241 1 17 . 1 1 114 114 SER C C 114 173.638 173.638 173.841 -0.203 18321 22242 1 17 . 1 1 114 114 SER CA C 114 58.005 58.005 57.724 0.281 18321 22243 1 17 . 1 1 114 114 SER CB C 114 63.169 63.169 63.773 -0.604 18321 22244 1 17 . 1 1 114 114 SER H H 114 8.319 8.319 8.486 -0.167 18321 22245 1 17 . 1 1 115 115 ALA N N 115 126.914 126.914 130.389 -3.475 18321 22246 1 17 . 1 1 115 115 ALA CA C 115 51.561 51.561 49.498 2.063 18321 22247 1 17 . 1 1 115 115 ALA CB C 115 17.714 17.714 19.145 -1.431 18321 22248 1 17 . 1 1 115 115 ALA H H 115 8.197 8.197 8.216 -0.019 18321 22249 1 17 . 1 1 119 119 PRO C C 119 177.065 177.065 178.049 -0.984 18321 22250 1 17 . 1 1 120 120 THR N N 120 113.976 113.976 112.820 1.156 18321 22251 1 17 . 1 1 120 120 THR C C 120 174.461 174.461 173.756 0.705 18321 22252 1 17 . 1 1 120 120 THR CA C 120 61.215 61.215 62.079 -0.864 18321 22253 1 17 . 1 1 120 120 THR CB C 120 69.508 69.508 68.447 1.061 18321 22254 1 17 . 1 1 120 120 THR H H 120 8.138 8.138 8.101 0.037 18321 22255 1 17 . 1 1 121 121 ALA N N 121 125.859 125.859 125.382 0.477 18321 22256 1 17 . 1 1 121 121 ALA CA C 121 52.281 52.281 51.905 0.376 18321 22257 1 17 . 1 1 121 121 ALA CB C 121 18.623 18.623 18.271 0.352 18321 22258 1 17 . 1 1 121 121 ALA H H 121 8.272 8.272 8.175 0.097 18321 22259 1 17 . 1 1 122 122 GLU C C 122 176.316 176.316 176.906 -0.590 18321 22260 1 17 . 1 1 123 123 ASP N N 123 120.448 120.448 118.116 2.332 18321 22261 1 17 . 1 1 123 123 ASP C C 123 175.906 175.906 175.230 0.676 18321 22262 1 17 . 1 1 123 123 ASP CA C 123 54.167 54.167 56.169 -2.002 18321 22263 1 17 . 1 1 123 123 ASP CB C 123 40.695 40.695 40.906 -0.211 18321 22264 1 17 . 1 1 123 123 ASP H H 123 8.181 8.181 8.391 -0.210 18321 22265 1 17 . 1 1 124 124 ASN N N 124 118.207 118.207 115.970 2.237 18321 22266 1 17 . 1 1 124 124 ASN C C 124 174.851 174.851 174.490 0.361 18321 22267 1 17 . 1 1 124 124 ASN CA C 124 52.771 52.771 53.964 -1.193 18321 22268 1 17 . 1 1 124 124 ASN CB C 124 38.304 38.304 38.550 -0.246 18321 22269 1 17 . 1 1 124 124 ASN H H 124 8.307 8.307 8.360 -0.053 18321 22270 1 17 . 1 1 125 125 LEU N N 125 121.311 121.311 119.825 1.486 18321 22271 1 17 . 1 1 125 125 LEU C C 125 175.750 175.750 176.005 -0.255 18321 22272 1 17 . 1 1 125 125 LEU CA C 125 54.428 54.428 55.532 -1.104 18321 22273 1 17 . 1 1 125 125 LEU CB C 125 41.350 41.350 40.886 0.464 18321 22274 1 17 . 1 1 125 125 LEU H H 125 7.747 7.747 8.372 -0.625 18321 22275 1 17 . 1 1 126 126 GLU N N 126 122.485 122.485 121.009 1.476 18321 22276 1 17 . 1 1 126 126 GLU C C 126 174.008 174.008 174.049 -0.041 18321 22277 1 17 . 1 1 126 126 GLU CA C 126 54.855 54.855 56.557 -1.702 18321 22278 1 17 . 1 1 126 126 GLU CB C 126 30.472 30.472 30.883 -0.411 18321 22279 1 17 . 1 1 126 126 GLU H H 126 8.453 8.453 8.099 0.354 18321 22280 1 17 . 1 1 127 127 TYR N N 127 122.713 122.713 119.903 2.810 18321 22281 1 17 . 1 1 127 127 TYR C C 127 176.859 176.859 175.151 1.708 18321 22282 1 17 . 1 1 127 127 TYR CA C 127 56.528 56.528 56.845 -0.317 18321 22283 1 17 . 1 1 127 127 TYR CB C 127 40.982 40.982 38.965 2.017 18321 22284 1 17 . 1 1 127 127 TYR H H 127 8.469 8.469 8.261 0.208 18321 22285 1 17 . 1 1 128 128 VAL N N 128 112.432 112.432 124.597 -12.165 18321 22286 1 17 . 1 1 128 128 VAL C C 128 173.150 173.150 174.378 -1.228 18321 22287 1 17 . 1 1 128 128 VAL CA C 128 57.940 57.940 61.049 -3.109 18321 22288 1 17 . 1 1 128 128 VAL CB C 128 34.935 34.935 35.267 -0.331 18321 22289 1 17 . 1 1 128 128 VAL H H 128 9.078 9.078 9.191 -0.113 18321 22290 1 17 . 1 1 129 129 ARG N N 129 120.373 120.373 124.579 -4.206 18321 22291 1 17 . 1 1 129 129 ARG C C 129 176.539 176.539 175.618 0.921 18321 22292 1 17 . 1 1 129 129 ARG CA C 129 52.534 52.534 53.516 -0.981 18321 22293 1 17 . 1 1 129 129 ARG CB C 129 32.942 32.942 32.891 0.051 18321 22294 1 17 . 1 1 129 129 ARG H H 129 9.010 9.010 8.131 0.879 18321 22295 1 17 . 1 1 130 130 THR N N 130 116.637 116.637 111.854 4.783 18321 22296 1 17 . 1 1 130 130 THR CA C 130 60.618 60.618 60.679 -0.061 18321 22297 1 17 . 1 1 130 130 THR CB C 130 69.170 69.170 70.338 -1.168 18321 22298 1 17 . 1 1 130 130 THR H H 130 9.045 9.045 8.310 0.735 18321 22299 1 17 . 1 1 131 131 LEU N N 131 122.910 122.910 123.654 -0.744 18321 22300 1 17 . 1 1 131 131 LEU C C 131 175.269 175.269 176.420 -1.151 18321 22301 1 17 . 1 1 131 131 LEU CA C 131 55.122 55.122 54.834 0.288 18321 22302 1 17 . 1 1 131 131 LEU CB C 131 43.108 43.108 42.267 0.841 18321 22303 1 17 . 1 1 131 131 LEU H H 131 9.224 9.224 8.574 0.650 18321 22304 1 17 . 1 1 132 132 TYR N N 132 112.885 112.885 118.713 -5.828 18321 22305 1 17 . 1 1 132 132 TYR C C 132 173.818 173.818 175.027 -1.209 18321 22306 1 17 . 1 1 132 132 TYR CA C 132 54.230 54.230 58.886 -4.656 18321 22307 1 17 . 1 1 132 132 TYR CB C 132 42.672 42.672 40.645 2.027 18321 22308 1 17 . 1 1 132 132 TYR H H 132 7.284 7.284 7.726 -0.442 18321 22309 1 17 . 1 1 133 133 ASP N N 133 118.003 118.003 119.401 -1.398 18321 22310 1 17 . 1 1 133 133 ASP C C 133 175.779 175.779 173.907 1.872 18321 22311 1 17 . 1 1 133 133 ASP CA C 133 54.351 54.351 55.404 -1.053 18321 22312 1 17 . 1 1 133 133 ASP CB C 133 41.241 41.241 40.373 0.868 18321 22313 1 17 . 1 1 133 133 ASP H H 133 8.399 8.399 8.435 -0.036 18321 22314 1 17 . 1 1 134 134 PHE N N 134 121.081 121.081 123.505 -2.424 18321 22315 1 17 . 1 1 134 134 PHE CA C 134 52.552 52.552 54.389 -1.837 18321 22316 1 17 . 1 1 134 134 PHE CB C 134 41.217 41.217 41.541 -0.324 18321 22317 1 17 . 1 1 134 134 PHE H H 134 8.797 8.797 7.356 1.441 18321 22318 1 17 . 1 1 136 136 GLY C C 136 171.616 171.616 174.100 -2.484 18321 22319 1 17 . 1 1 137 137 ASN N N 137 119.394 119.394 117.062 2.332 18321 22320 1 17 . 1 1 137 137 ASN C C 137 174.500 174.500 174.078 0.422 18321 22321 1 17 . 1 1 137 137 ASN CA C 137 44.670 44.670 54.581 -9.911 18321 22322 1 17 . 1 1 137 137 ASN H H 137 9.477 9.477 7.920 1.557 18321 22323 1 17 . 1 1 138 138 ASP N N 138 120.608 120.608 118.906 1.702 18321 22324 1 17 . 1 1 138 138 ASP C C 138 176.987 176.987 174.639 2.348 18321 22325 1 17 . 1 1 138 138 ASP CA C 138 52.992 52.992 52.440 0.552 18321 22326 1 17 . 1 1 138 138 ASP H H 138 8.216 8.216 7.706 0.510 18321 22327 1 17 . 1 1 139 139 ALA N N 139 124.371 124.371 121.052 3.319 18321 22328 1 17 . 1 1 139 139 ALA C C 139 178.472 178.472 177.338 1.134 18321 22329 1 17 . 1 1 139 139 ALA CA C 139 54.513 54.513 52.631 1.882 18321 22330 1 17 . 1 1 139 139 ALA CB C 139 18.045 18.045 20.061 -2.016 18321 22331 1 17 . 1 1 139 139 ALA H H 139 8.565 8.565 8.522 0.043 18321 22332 1 17 . 1 1 140 140 GLU N N 140 115.022 115.022 117.924 -2.902 18321 22333 1 17 . 1 1 140 140 GLU C C 140 177.027 177.027 175.505 1.522 18321 22334 1 17 . 1 1 140 140 GLU CA C 140 56.181 56.181 57.733 -1.552 18321 22335 1 17 . 1 1 140 140 GLU CB C 140 28.619 28.619 31.873 -3.254 18321 22336 1 17 . 1 1 140 140 GLU H H 140 8.616 8.616 8.240 0.376 18321 22337 1 17 . 1 1 141 141 ASP N N 141 121.913 121.913 120.707 1.206 18321 22338 1 17 . 1 1 141 141 ASP C C 141 175.923 175.923 174.896 1.027 18321 22339 1 17 . 1 1 141 141 ASP CA C 141 54.736 54.736 54.046 0.690 18321 22340 1 17 . 1 1 141 141 ASP CB C 141 41.305 41.305 42.719 -1.414 18321 22341 1 17 . 1 1 141 141 ASP H H 141 7.636 7.636 8.016 -0.380 18321 22342 1 17 . 1 1 142 142 LEU N N 142 127.651 127.651 125.683 1.968 18321 22343 1 17 . 1 1 142 142 LEU CA C 142 50.955 50.955 52.162 -1.207 18321 22344 1 17 . 1 1 142 142 LEU CB C 142 42.343 42.343 44.239 -1.896 18321 22345 1 17 . 1 1 142 142 LEU H H 142 9.479 9.479 8.299 1.180 18321 22346 1 17 . 1 1 143 143 PRO C C 143 177.924 177.924 175.765 2.159 18321 22347 1 17 . 1 1 144 144 PHE N N 144 114.483 114.483 121.153 -6.670 18321 22348 1 17 . 1 1 144 144 PHE C C 144 175.055 175.055 175.006 0.049 18321 22349 1 17 . 1 1 144 144 PHE CA C 144 55.543 55.543 56.465 -0.923 18321 22350 1 17 . 1 1 144 144 PHE CB C 144 40.581 40.581 40.813 -0.232 18321 22351 1 17 . 1 1 144 144 PHE H H 144 8.637 8.637 7.129 1.508 18321 22352 1 17 . 1 1 145 145 LYS N N 145 121.342 121.342 117.770 3.572 18321 22353 1 17 . 1 1 145 145 LYS C C 145 176.925 176.925 177.741 -0.816 18321 22354 1 17 . 1 1 145 145 LYS CA C 145 53.043 53.043 53.693 -0.650 18321 22355 1 17 . 1 1 145 145 LYS CB C 145 33.804 33.804 35.931 -2.127 18321 22356 1 17 . 1 1 145 145 LYS H H 145 9.418 9.418 8.726 0.692 18321 22357 1 17 . 1 1 146 146 LYS N N 146 123.378 123.378 121.335 2.043 18321 22358 1 17 . 1 1 146 146 LYS CA C 146 57.883 57.883 56.363 1.520 18321 22359 1 17 . 1 1 146 146 LYS CB C 146 32.008 32.008 30.015 1.993 18321 22360 1 17 . 1 1 146 146 LYS H H 146 9.002 9.002 8.814 0.188 18321 22361 1 17 . 1 1 147 147 GLY C C 147 174.315 174.315 172.909 1.406 18321 22362 1 17 . 1 1 148 148 GLU N N 148 121.392 121.392 120.289 1.103 18321 22363 1 17 . 1 1 148 148 GLU C C 148 174.998 174.998 175.284 -0.286 18321 22364 1 17 . 1 1 148 148 GLU CA C 148 56.867 56.867 54.684 2.183 18321 22365 1 17 . 1 1 148 148 GLU CB C 148 31.649 31.649 32.017 -0.368 18321 22366 1 17 . 1 1 148 148 GLU H H 148 7.937 7.937 7.671 0.266 18321 22367 1 17 . 1 1 149 149 ILE N N 149 120.124 120.124 123.276 -3.152 18321 22368 1 17 . 1 1 149 149 ILE C C 149 176.647 176.647 175.083 1.564 18321 22369 1 17 . 1 1 149 149 ILE CA C 149 58.621 58.621 61.066 -2.445 18321 22370 1 17 . 1 1 149 149 ILE CB C 149 36.952 36.952 38.069 -1.117 18321 22371 1 17 . 1 1 149 149 ILE H H 149 8.346 8.346 8.736 -0.390 18321 22372 1 17 . 1 1 150 150 LEU N N 150 126.950 126.950 126.050 0.900 18321 22373 1 17 . 1 1 150 150 LEU CA C 150 51.967 51.967 53.109 -1.142 18321 22374 1 17 . 1 1 150 150 LEU CB C 150 44.182 44.182 45.664 -1.482 18321 22375 1 17 . 1 1 150 150 LEU H H 150 8.988 8.988 9.175 -0.187 18321 22376 1 17 . 1 1 151 151 VAL C C 151 175.670 175.670 175.874 -0.204 18321 22377 1 17 . 1 1 152 152 ILE N N 152 124.997 124.997 129.105 -4.108 18321 22378 1 17 . 1 1 152 152 ILE CA C 152 58.331 58.331 60.027 -1.696 18321 22379 1 17 . 1 1 152 152 ILE CB C 152 34.093 34.093 34.928 -0.835 18321 22380 1 17 . 1 1 152 152 ILE H H 152 8.673 8.673 8.272 0.401 18321 22381 1 17 . 1 1 153 153 ILE N N 153 124.710 124.710 126.086 -1.376 18321 22382 1 17 . 1 1 153 153 ILE C C 153 176.264 176.264 175.254 1.010 18321 22383 1 17 . 1 1 154 154 GLU N N 154 117.398 117.398 118.539 -1.141 18321 22384 1 17 . 1 1 154 154 GLU C C 154 173.959 173.959 174.697 -0.738 18321 22385 1 17 . 1 1 154 154 GLU CA C 154 55.289 55.289 54.493 0.796 18321 22386 1 17 . 1 1 154 154 GLU CB C 154 32.842 32.842 31.979 0.863 18321 22387 1 17 . 1 1 154 154 GLU H H 154 7.818 7.818 8.299 -0.481 18321 22388 1 17 . 1 1 155 155 LYS N N 155 121.130 121.130 124.076 -2.946 18321 22389 1 17 . 1 1 155 155 LYS CA C 155 53.022 53.022 52.547 0.475 18321 22390 1 17 . 1 1 155 155 LYS CB C 155 32.663 32.663 33.053 -0.390 18321 22391 1 17 . 1 1 155 155 LYS H H 155 8.654 8.654 8.660 -0.006 18321 22392 1 17 . 1 1 157 157 GLU C C 157 175.190 175.190 176.390 -1.200 18321 22393 1 17 . 1 1 157 157 GLU CA C 157 53.785 53.785 54.265 -0.480 18321 22394 1 17 . 1 1 157 157 GLU CB C 157 32.685 32.685 31.071 1.614 18321 22395 1 17 . 1 1 158 158 GLU N N 158 117.425 117.425 120.996 -3.571 18321 22396 1 17 . 1 1 158 158 GLU C C 158 178.600 178.600 177.522 1.078 18321 22397 1 17 . 1 1 158 158 GLU CA C 158 59.044 59.044 59.119 -0.075 18321 22398 1 17 . 1 1 158 158 GLU CB C 158 29.706 29.706 29.957 -0.251 18321 22399 1 17 . 1 1 158 158 GLU H H 158 8.678 8.678 8.879 -0.201 18321 22400 1 17 . 1 1 159 159 GLN N N 159 110.925 110.925 116.712 -5.787 18321 22401 1 17 . 1 1 159 159 GLN C C 159 175.539 175.539 175.220 0.319 18321 22402 1 17 . 1 1 159 159 GLN CA C 159 54.942 54.942 57.474 -2.532 18321 22403 1 17 . 1 1 159 159 GLN CB C 159 28.572 28.572 29.791 -1.219 18321 22404 1 17 . 1 1 159 159 GLN H H 159 8.483 8.483 8.697 -0.214 18321 22405 1 17 . 1 1 160 160 TRP N N 160 120.171 120.171 118.386 1.785 18321 22406 1 17 . 1 1 160 160 TRP C C 160 173.444 173.444 174.954 -1.510 18321 22407 1 17 . 1 1 160 160 TRP CA C 160 56.175 56.175 55.993 0.182 18321 22408 1 17 . 1 1 160 160 TRP CB C 160 31.796 31.796 32.460 -0.664 18321 22409 1 17 . 1 1 160 160 TRP H H 160 6.826 6.826 7.376 -0.550 18321 22410 1 17 . 1 1 161 161 TRP N N 161 120.687 120.687 121.998 -1.311 18321 22411 1 17 . 1 1 161 161 TRP C C 161 174.736 174.736 175.865 -1.129 18321 22412 1 17 . 1 1 161 161 TRP CA C 161 51.889 51.889 54.483 -2.594 18321 22413 1 17 . 1 1 161 161 TRP CB C 161 32.772 32.772 31.851 0.921 18321 22414 1 17 . 1 1 161 161 TRP H H 161 8.462 8.462 9.455 -0.993 18321 22415 1 17 . 1 1 162 162 SER N N 162 115.691 115.691 120.385 -4.694 18321 22416 1 17 . 1 1 162 162 SER C C 162 174.320 174.320 173.352 0.968 18321 22417 1 17 . 1 1 162 162 SER CA C 162 57.011 57.011 58.275 -1.264 18321 22418 1 17 . 1 1 162 162 SER CB C 162 63.948 63.948 63.317 0.631 18321 22419 1 17 . 1 1 162 162 SER H H 162 8.830 8.830 9.095 -0.265 18321 22420 1 17 . 1 1 163 163 ALA N N 163 130.630 130.630 128.103 2.527 18321 22421 1 17 . 1 1 163 163 ALA CA C 163 50.029 50.029 50.151 -0.122 18321 22422 1 17 . 1 1 163 163 ALA CB C 163 25.500 25.500 21.859 3.641 18321 22423 1 17 . 1 1 163 163 ALA H H 163 9.585 9.585 8.930 0.655 18321 22424 1 17 . 1 1 164 164 ARG N N 164 117.526 117.526 121.264 -3.738 18321 22425 1 17 . 1 1 164 164 ARG C C 164 176.719 176.719 176.739 -0.020 18321 22426 1 17 . 1 1 164 164 ARG CA C 164 52.975 52.975 54.300 -1.325 18321 22427 1 17 . 1 1 164 164 ARG CB C 164 34.260 34.260 30.594 3.666 18321 22428 1 17 . 1 1 164 164 ARG H H 164 9.097 9.097 9.100 -0.003 18321 22429 1 17 . 1 1 165 165 ASN N N 165 123.935 123.935 122.392 1.543 18321 22430 1 17 . 1 1 165 165 ASN C C 165 178.484 178.484 175.825 2.659 18321 22431 1 17 . 1 1 165 165 ASN CA C 165 50.332 50.332 54.806 -4.474 18321 22432 1 17 . 1 1 165 165 ASN CB C 165 39.487 39.487 39.832 -0.345 18321 22433 1 17 . 1 1 165 165 ASN H H 165 8.756 8.756 8.889 -0.133 18321 22434 1 17 . 1 1 166 166 LYS N N 166 118.464 118.464 119.656 -1.192 18321 22435 1 17 . 1 1 166 166 LYS C C 166 176.967 176.967 177.216 -0.249 18321 22436 1 17 . 1 1 166 166 LYS CA C 166 58.430 58.430 58.401 0.029 18321 22437 1 17 . 1 1 166 166 LYS CB C 166 30.918 30.918 32.367 -1.449 18321 22438 1 17 . 1 1 166 166 LYS H H 166 8.915 8.915 9.256 -0.341 18321 22439 1 17 . 1 1 167 167 ASP N N 167 118.138 118.138 115.793 2.345 18321 22440 1 17 . 1 1 167 167 ASP C C 167 176.464 176.464 176.782 -0.318 18321 22441 1 17 . 1 1 167 167 ASP CA C 167 54.212 54.212 55.376 -1.164 18321 22442 1 17 . 1 1 167 167 ASP CB C 167 41.178 41.178 41.590 -0.412 18321 22443 1 17 . 1 1 167 167 ASP H H 167 7.508 7.508 8.543 -1.035 18321 22444 1 17 . 1 1 168 168 GLY N N 168 107.901 107.901 105.533 2.368 18321 22445 1 17 . 1 1 168 168 GLY C C 168 173.613 173.613 173.666 -0.053 18321 22446 1 17 . 1 1 168 168 GLY CA C 168 44.783 44.783 44.655 0.128 18321 22447 1 17 . 1 1 168 168 GLY H H 168 8.173 8.173 7.622 0.551 18321 22448 1 17 . 1 1 169 169 ARG N N 169 124.324 124.324 121.954 2.370 18321 22449 1 17 . 1 1 169 169 ARG CA C 169 56.106 56.106 56.562 -0.456 18321 22450 1 17 . 1 1 169 169 ARG CB C 169 29.648 29.648 31.224 -1.576 18321 22451 1 17 . 1 1 169 169 ARG H H 169 7.998 7.998 7.981 0.017 18321 22452 1 17 . 1 1 170 170 VAL C C 170 177.590 177.590 175.199 2.391 18321 22453 1 17 . 1 1 171 171 GLY N N 171 112.582 112.582 113.434 -0.852 18321 22454 1 17 . 1 1 171 171 GLY C C 171 170.991 170.991 172.681 -1.690 18321 22455 1 17 . 1 1 171 171 GLY CA C 171 45.361 45.361 44.590 0.771 18321 22456 1 17 . 1 1 171 171 GLY H H 171 9.013 9.013 8.414 0.599 18321 22457 1 17 . 1 1 172 172 MET N N 172 117.368 117.368 121.204 -3.836 18321 22458 1 17 . 1 1 172 172 MET C C 172 177.921 177.921 176.443 1.478 18321 22459 1 17 . 1 1 172 172 MET CA C 172 53.536 53.536 56.850 -3.314 18321 22460 1 17 . 1 1 172 172 MET CB C 172 30.838 30.838 33.834 -2.997 18321 22461 1 17 . 1 1 172 172 MET H H 172 8.885 8.885 9.250 -0.365 18321 22462 1 17 . 1 1 173 173 ILE N N 173 113.130 113.130 117.300 -4.170 18321 22463 1 17 . 1 1 173 173 ILE CA C 173 56.284 56.284 57.969 -1.685 18321 22464 1 17 . 1 1 173 173 ILE CB C 173 40.870 40.870 40.452 0.418 18321 22465 1 17 . 1 1 173 173 ILE H H 173 9.704 9.704 9.365 0.339 18321 22466 1 17 . 1 1 174 174 PRO C C 174 176.714 176.714 177.554 -0.840 18321 22467 1 17 . 1 1 174 174 PRO CA C 174 66.290 66.290 61.674 4.616 18321 22468 1 17 . 1 1 174 174 PRO CB C 174 28.993 28.993 30.636 -1.643 18321 22469 1 17 . 1 1 175 175 VAL N N 175 128.066 128.066 124.977 3.089 18321 22470 1 17 . 1 1 175 175 VAL CA C 175 59.356 59.356 67.183 -7.827 18321 22471 1 17 . 1 1 175 175 VAL H H 175 7.327 7.327 8.251 -0.924 18321 22472 1 17 . 1 1 176 176 PRO C C 176 176.351 176.351 176.622 -0.271 18321 22473 1 17 . 1 1 177 177 TYR N N 177 115.756 115.756 114.545 1.211 18321 22474 1 17 . 1 1 177 177 TYR C C 177 175.011 175.011 175.405 -0.394 18321 22475 1 17 . 1 1 177 177 TYR CA C 177 56.756 56.756 56.690 0.066 18321 22476 1 17 . 1 1 177 177 TYR CB C 177 37.507 37.507 38.857 -1.350 18321 22477 1 17 . 1 1 177 177 TYR H H 177 7.784 7.784 7.414 0.370 18321 22478 1 17 . 1 1 178 178 VAL N N 178 111.428 111.428 115.472 -4.044 18321 22479 1 17 . 1 1 178 178 VAL C C 178 173.417 173.417 175.768 -2.351 18321 22480 1 17 . 1 1 178 178 VAL CA C 178 58.307 58.307 59.401 -1.095 18321 22481 1 17 . 1 1 178 178 VAL CB C 178 34.602 34.602 34.383 0.219 18321 22482 1 17 . 1 1 178 178 VAL H H 178 7.801 7.801 7.394 0.407 18321 22483 1 17 . 1 1 179 179 GLU N N 179 118.581 118.581 120.216 -1.635 18321 22484 1 17 . 1 1 179 179 GLU C C 179 175.225 175.225 175.625 -0.400 18321 22485 1 17 . 1 1 179 179 GLU CA C 179 53.114 53.114 55.898 -2.784 18321 22486 1 17 . 1 1 179 179 GLU CB C 179 32.712 32.712 30.247 2.465 18321 22487 1 17 . 1 1 179 179 GLU H H 179 8.819 8.819 8.362 0.457 18321 22488 1 17 . 1 1 180 180 LYS N N 180 124.167 124.167 121.627 2.540 18321 22489 1 17 . 1 1 180 180 LYS C C 180 176.303 176.303 176.316 -0.013 18321 22490 1 17 . 1 1 180 180 LYS CA C 180 57.318 57.318 57.089 0.229 18321 22491 1 17 . 1 1 180 180 LYS CB C 180 31.675 31.675 33.009 -1.334 18321 22492 1 17 . 1 1 180 180 LYS H H 180 8.775 8.775 8.116 0.659 18321 22493 1 17 . 1 1 181 181 LEU N N 181 125.157 125.157 126.277 -1.120 18321 22494 1 17 . 1 1 181 181 LEU C C 181 176.462 176.462 176.252 0.210 18321 22495 1 17 . 1 1 181 181 LEU CA C 181 54.470 54.470 54.418 0.052 18321 22496 1 17 . 1 1 181 181 LEU CB C 181 41.625 41.625 43.159 -1.534 18321 22497 1 17 . 1 1 181 181 LEU H H 181 8.084 8.084 8.336 -0.252 18321 22498 1 17 . 1 1 182 182 VAL N N 182 123.167 123.167 121.665 1.502 18321 22499 1 17 . 1 1 182 182 VAL C C 182 175.983 175.983 174.991 0.992 18321 22500 1 17 . 1 1 182 182 VAL CA C 182 61.613 61.613 63.542 -1.929 18321 22501 1 17 . 1 1 182 182 VAL CB C 182 32.085 32.085 30.228 1.857 18321 22502 1 17 . 1 1 182 182 VAL H H 182 8.345 8.345 8.626 -0.281 18321 22503 1 17 . 1 1 183 183 ARG N N 183 125.775 125.775 122.191 3.584 18321 22504 1 17 . 1 1 183 183 ARG CA C 183 57.801 57.801 55.592 2.209 18321 22505 1 17 . 1 1 183 183 ARG CB C 183 30.091 30.091 31.809 -1.718 18321 22506 1 17 . 1 1 183 183 ARG H H 183 8.530 8.530 8.216 0.314 18321 22507 1 17 . 1 1 184 184 SER C C 184 173.239 173.239 175.017 -1.778 18321 22508 1 17 . 1 1 185 185 SER N N 185 116.511 116.511 120.492 -3.981 18321 22509 1 17 . 1 1 185 185 SER CA C 185 58.428 58.428 61.420 -2.992 18321 22510 1 17 . 1 1 185 185 SER CB C 185 69.737 69.737 61.871 7.866 18321 22511 1 17 . 1 1 185 185 SER H H 185 7.944 7.944 7.858 0.086 18321 22512 1 17 . 1 1 190 190 HIS C C 190 176.953 176.953 176.126 0.827 18321 22513 1 17 . 1 1 190 190 HIS CA C 190 54.229 54.229 57.335 -3.106 18321 22514 1 17 . 1 1 190 190 HIS CB C 190 35.112 35.112 30.778 4.334 18321 22515 1 17 . 1 1 191 191 GLY N N 191 109.491 109.491 108.360 1.131 18321 22516 1 17 . 1 1 191 191 GLY C C 191 172.295 172.295 173.120 -0.825 18321 22517 1 17 . 1 1 191 191 GLY CA C 191 45.227 45.227 44.795 0.432 18321 22518 1 17 . 1 1 191 191 GLY H H 191 8.719 8.719 8.241 0.478 18321 22519 1 17 . 1 1 192 192 ASN N N 192 118.700 118.700 117.712 0.988 18321 22520 1 17 . 1 1 192 192 ASN HA H 192 4.312 4.312 5.055 -0.743 18321 22521 1 17 . 1 1 192 192 ASN C C 192 176.369 176.369 174.885 1.484 18321 22522 1 17 . 1 1 192 192 ASN CA C 192 57.787 57.787 52.659 5.128 18321 22523 1 17 . 1 1 192 192 ASN H H 192 7.508 7.508 8.333 -0.825 18321 22524 1 17 . 1 1 193 193 ARG N N 193 120.743 120.743 122.130 -1.387 18321 22525 1 17 . 1 1 193 193 ARG H H 193 9.032 9.032 8.819 0.213 18321 22526 1 17 . 1 1 197 197 SER HA H 197 4.388 4.388 4.915 -0.527 18321 22527 1 17 . 1 1 197 197 SER C C 197 174.133 174.133 173.646 0.487 18321 22528 1 17 . 1 1 197 197 SER CA C 197 58.128 58.128 58.145 -0.017 18321 22529 1 17 . 1 1 197 197 SER CB C 197 62.966 62.966 63.110 -0.144 18321 22530 1 17 . 1 1 198 198 TYR N N 198 121.435 121.435 125.322 -3.887 18321 22531 1 17 . 1 1 198 198 TYR HA H 198 4.543 4.543 4.711 -0.168 18321 22532 1 17 . 1 1 198 198 TYR C C 198 176.230 176.230 175.578 0.652 18321 22533 1 17 . 1 1 198 198 TYR CA C 198 57.536 57.536 57.355 0.181 18321 22534 1 17 . 1 1 198 198 TYR CB C 198 38.279 38.279 39.948 -1.669 18321 22535 1 17 . 1 1 198 198 TYR H H 198 8.071 8.071 8.261 -0.190 18321 22536 1 17 . 1 1 199 199 GLY N N 199 110.039 110.039 108.247 1.792 18321 22537 1 17 . 1 1 199 199 GLY C C 199 173.475 173.475 174.011 -0.536 18321 22538 1 17 . 1 1 199 199 GLY CA C 199 44.805 44.805 45.012 -0.207 18321 22539 1 17 . 1 1 199 199 GLY H H 199 8.162 8.162 8.903 -0.741 18321 22540 1 17 . 1 1 200 200 ILE N N 200 121.530 121.530 120.927 0.603 18321 22541 1 17 . 1 1 200 200 ILE CA C 200 58.102 58.102 56.916 1.186 18321 22542 1 17 . 1 1 200 200 ILE CB C 200 37.760 37.760 38.178 -0.418 18321 22543 1 17 . 1 1 200 200 ILE H H 200 7.851 7.851 7.694 0.157 18321 22544 1 17 . 1 1 201 201 PRO C C 201 176.485 176.485 176.347 0.138 18321 22545 1 17 . 1 1 201 201 PRO CA C 201 53.893 53.893 62.692 -8.799 18321 22546 1 17 . 1 1 201 201 PRO CB C 201 29.042 29.042 31.016 -1.974 18321 22547 1 17 . 1 1 202 202 GLU N N 202 122.468 122.468 125.175 -2.707 18321 22548 1 17 . 1 1 202 202 GLU CA C 202 62.490 62.490 54.959 7.530 18321 22549 1 17 . 1 1 202 202 GLU CB C 202 31.170 31.170 29.481 1.689 18321 22550 1 17 . 1 1 202 202 GLU H H 202 8.328 8.328 8.227 0.101 18321 22551 1 17 . 1 1 203 203 PRO CA C 203 62.803 62.803 62.664 0.139 18321 22552 1 17 . 1 1 203 203 PRO CB C 203 31.220 31.220 32.299 -1.079 18321 22553 1 17 . 1 1 204 204 ALA N N 204 123.251 123.251 122.164 1.087 18321 22554 1 17 . 1 1 204 204 ALA HA H 204 4.180 4.180 4.573 -0.393 18321 22555 1 17 . 1 1 204 204 ALA CA C 204 52.124 52.124 51.655 0.469 18321 22556 1 17 . 1 1 204 204 ALA CB C 204 18.892 18.892 20.401 -1.509 18321 22557 1 17 . 1 1 204 204 ALA H H 204 8.308 8.308 8.325 -0.017 18321 22558 1 17 . 1 1 205 205 HIS N N 205 117.874 117.874 121.655 -3.781 18321 22559 1 17 . 1 1 205 205 HIS C C 205 173.282 173.282 175.322 -2.040 18321 22560 1 17 . 1 1 205 205 HIS H H 205 8.045 8.045 8.744 -0.699 18321 22561 1 17 . 1 1 206 206 ALA N N 206 125.519 125.519 122.784 2.735 18321 22562 1 17 . 1 1 206 206 ALA HA H 206 4.204 4.204 4.073 0.131 18321 22563 1 17 . 1 1 206 206 ALA CA C 206 40.196 40.196 52.246 -12.050 18321 22564 1 17 . 1 1 206 206 ALA CB C 206 19.407 19.407 17.750 1.657 18321 22565 1 17 . 1 1 206 206 ALA H H 206 8.061 8.061 8.179 -0.118 18321 22566 1 17 . 1 1 207 207 TYR N N 207 120.381 120.381 117.247 3.134 18321 22567 1 17 . 1 1 207 207 TYR HA H 207 4.570 4.570 4.011 0.559 18321 22568 1 17 . 1 1 207 207 TYR CA C 207 52.572 52.572 59.745 -7.173 18321 22569 1 17 . 1 1 207 207 TYR CB C 207 41.333 41.333 37.072 4.261 18321 22570 1 17 . 1 1 207 207 TYR H H 207 8.199 8.199 8.612 -0.413 18321 22571 1 17 . 1 1 208 208 ALA HA H 208 4.281 4.281 4.358 -0.077 18321 22572 1 17 . 1 1 208 208 ALA C C 208 177.736 177.736 176.617 1.119 18321 22573 1 17 . 1 1 208 208 ALA CA C 208 52.084 52.084 52.123 -0.040 18321 22574 1 17 . 1 1 208 208 ALA CB C 208 18.999 18.999 18.072 0.927 18321 22575 1 17 . 1 1 209 209 GLN N N 209 119.295 119.295 121.802 -2.507 18321 22576 1 17 . 1 1 209 209 GLN CA C 209 61.474 61.474 56.184 5.290 18321 22577 1 17 . 1 1 209 209 GLN CB C 209 32.039 32.039 27.538 4.501 18321 22578 1 17 . 1 1 209 209 GLN H H 209 8.125 8.125 8.007 0.118 18321 22579 1 17 . 1 1 210 210 PRO HA H 210 4.395 4.395 4.672 -0.277 18321 22580 1 17 . 1 1 210 210 PRO CA C 210 62.584 62.584 62.214 0.370 18321 22581 1 17 . 1 1 211 211 GLN HA H 211 4.377 4.377 4.381 -0.004 18321 22582 1 17 . 1 1 211 211 GLN CA C 211 55.859 55.859 56.818 -0.959 18321 22583 1 17 . 1 1 211 211 GLN CB C 211 29.577 29.577 29.979 -0.402 18321 22584 1 17 . 1 1 212 212 THR C C 212 176.551 176.551 174.541 2.010 18321 22585 1 17 . 1 1 212 212 THR CB C 212 69.890 69.890 67.627 2.263 18321 22586 1 17 . 1 1 213 213 THR N N 213 108.487 108.487 114.265 -5.778 18321 22587 1 17 . 1 1 213 213 THR CA C 213 61.236 61.236 64.009 -2.773 18321 22588 1 17 . 1 1 213 213 THR CB C 213 69.091 69.091 68.996 0.095 18321 22589 1 17 . 1 1 213 213 THR H H 213 8.243 8.243 7.988 0.255 18321 22590 1 17 . 1 1 214 214 THR N N 214 119.445 119.445 116.618 2.827 18321 22591 1 17 . 1 1 214 214 THR CA C 214 59.425 59.425 60.074 -0.649 18321 22592 1 17 . 1 1 214 214 THR CB C 214 69.251 69.251 69.148 0.103 18321 22593 1 17 . 1 1 214 214 THR H H 214 8.188 8.188 7.739 0.449 18321 22594 1 17 . 1 1 215 215 PRO HA H 215 4.361 4.361 4.366 -0.005 18321 22595 1 17 . 1 1 215 215 PRO C C 215 175.422 175.422 175.759 -0.337 18321 22596 1 17 . 1 1 215 215 PRO CA C 215 63.320 63.320 64.276 -0.956 18321 22597 1 17 . 1 1 215 215 PRO CB C 215 31.918 31.918 32.116 -0.198 18321 22598 1 17 . 1 1 216 216 LEU N N 216 121.602 121.602 118.070 3.532 18321 22599 1 17 . 1 1 216 216 LEU CA C 216 52.203 52.203 52.391 -0.188 18321 22600 1 17 . 1 1 216 216 LEU CB C 216 42.451 42.451 43.885 -1.434 18321 22601 1 17 . 1 1 216 216 LEU H H 216 7.891 7.891 7.535 0.356 18321 22602 1 17 . 1 1 217 217 PRO HA H 217 4.398 4.398 4.544 -0.146 18321 22603 1 17 . 1 1 217 217 PRO C C 217 176.577 176.577 175.548 1.029 18321 22604 1 17 . 1 1 217 217 PRO CA C 217 62.984 62.984 63.230 -0.246 18321 22605 1 17 . 1 1 217 217 PRO CB C 217 32.056 32.056 31.039 1.017 18321 22606 1 17 . 1 1 218 218 ALA N N 218 124.087 124.087 125.238 -1.151 18321 22607 1 17 . 1 1 218 218 ALA HA H 218 4.309 4.309 4.452 -0.143 18321 22608 1 17 . 1 1 218 218 ALA C C 218 177.844 177.844 175.497 2.347 18321 22609 1 17 . 1 1 218 218 ALA CA C 218 52.379 52.379 51.944 0.435 18321 22610 1 17 . 1 1 218 218 ALA CB C 218 19.133 19.133 20.723 -1.590 18321 22611 1 17 . 1 1 218 218 ALA H H 218 8.261 8.261 7.553 0.708 18321 22612 1 17 . 1 1 219 219 VAL N N 219 118.942 118.942 119.394 -0.452 18321 22613 1 17 . 1 1 219 219 VAL HA H 219 4.142 4.142 4.420 -0.278 18321 22614 1 17 . 1 1 219 219 VAL CA C 219 62.102 62.102 62.914 -0.812 18321 22615 1 17 . 1 1 219 219 VAL CB C 219 32.923 32.923 32.781 0.142 18321 22616 1 17 . 1 1 219 219 VAL H H 219 8.049 8.049 8.267 -0.218 18321 22617 1 17 . 1 1 220 220 SER N N 220 119.207 119.207 114.107 5.100 18321 22618 1 17 . 1 1 220 220 SER HA H 220 4.436 4.436 4.671 -0.235 18321 22619 1 17 . 1 1 220 220 SER CA C 220 57.813 57.813 57.544 0.269 18321 22620 1 17 . 1 1 220 220 SER CB C 220 63.375 63.375 64.089 -0.714 18321 22621 1 17 . 1 1 220 220 SER H H 220 8.275 8.275 8.325 -0.050 18321 22622 1 17 . 1 1 221 221 GLY N N 221 110.973 110.973 108.555 2.418 18321 22623 1 17 . 1 1 221 221 GLY C C 221 173.962 173.962 173.163 0.799 18321 22624 1 17 . 1 1 221 221 GLY CA C 221 45.286 45.286 45.395 -0.110 18321 22625 1 17 . 1 1 221 221 GLY H H 221 8.374 8.374 8.100 0.274 18321 22626 1 17 . 1 1 222 222 SER N N 222 115.516 115.516 117.039 -1.523 18321 22627 1 17 . 1 1 222 222 SER HA H 222 4.763 4.763 4.363 0.400 18321 22628 1 17 . 1 1 222 222 SER CA C 222 56.407 56.407 57.628 -1.221 18321 22629 1 17 . 1 1 222 222 SER CB C 222 63.993 63.993 63.704 0.289 18321 22630 1 17 . 1 1 222 222 SER H H 222 8.155 8.155 8.347 -0.192 18321 22631 1 17 . 1 1 223 223 PRO HA H 223 4.417 4.417 4.653 -0.236 18321 22632 1 17 . 1 1 223 223 PRO CA C 223 63.805 63.805 62.654 1.151 18321 22633 1 17 . 1 1 223 223 PRO CB C 223 32.090 32.090 32.358 -0.268 18321 22634 1 17 . 1 1 224 224 GLY N N 224 109.149 109.149 106.661 2.488 18321 22635 1 17 . 1 1 224 224 GLY C C 224 173.813 173.813 172.902 0.911 18321 22636 1 17 . 1 1 224 224 GLY CA C 224 44.512 44.512 45.225 -0.713 18321 22637 1 17 . 1 1 224 224 GLY H H 224 8.376 8.376 8.431 -0.055 18321 22638 1 17 . 1 1 225 225 ALA N N 225 123.599 123.599 123.306 0.293 18321 22639 1 17 . 1 1 225 225 ALA C C 225 177.341 177.341 176.679 0.662 18321 22640 1 17 . 1 1 225 225 ALA CA C 225 51.878 51.878 52.058 -0.180 18321 22641 1 17 . 1 1 225 225 ALA CB C 225 19.169 19.169 17.308 1.861 18321 22642 1 17 . 1 1 225 225 ALA H H 225 7.959 7.959 8.428 -0.469 18321 22643 1 17 . 1 1 226 226 ALA N N 226 123.218 123.218 125.916 -2.698 18321 22644 1 17 . 1 1 226 226 ALA HA H 226 4.350 4.350 4.368 -0.018 18321 22645 1 17 . 1 1 226 226 ALA C C 226 177.520 177.520 177.988 -0.468 18321 22646 1 17 . 1 1 226 226 ALA CA C 226 52.535 52.535 52.915 -0.380 18321 22647 1 17 . 1 1 226 226 ALA CB C 226 19.171 19.171 19.566 -0.395 18321 22648 1 17 . 1 1 226 226 ALA H H 226 8.169 8.169 7.937 0.232 18321 22649 1 17 . 1 1 227 227 ILE N N 227 120.086 120.086 120.474 -0.388 18321 22650 1 17 . 1 1 227 227 ILE HA H 227 4.201 4.201 4.218 -0.017 18321 22651 1 17 . 1 1 227 227 ILE C C 227 174.814 174.814 175.204 -0.390 18321 22652 1 17 . 1 1 227 227 ILE CA C 227 60.929 60.929 61.290 -0.361 18321 22653 1 17 . 1 1 227 227 ILE CB C 227 38.872 38.872 37.287 1.585 18321 22654 1 17 . 1 1 227 227 ILE H H 227 8.037 8.037 7.978 0.059 18321 22655 1 17 . 1 1 228 228 THR N N 228 117.224 117.224 122.300 -5.076 18321 22656 1 17 . 1 1 228 228 THR HA H 228 4.203 4.203 4.722 -0.519 18321 22657 1 17 . 1 1 228 228 THR CA C 228 57.108 57.108 58.747 -1.639 18321 22658 1 17 . 1 1 228 228 THR CB C 228 69.945 69.945 69.579 0.366 18321 22659 1 17 . 1 1 228 228 THR H H 228 7.775 7.775 8.339 -0.564 18321 22660 1 17 . 1 1 229 229 PRO HA H 229 4.750 4.750 4.605 0.145 18321 22661 1 17 . 1 1 229 229 PRO CA C 229 62.480 62.480 63.933 -1.453 18321 22662 1 17 . 1 1 229 229 PRO CB C 229 33.995 33.995 32.261 1.734 18321 22663 1 17 . 1 1 230 230 LEU N N 230 123.629 123.629 116.346 7.283 18321 22664 1 17 . 1 1 230 230 LEU CA C 230 53.076 53.076 56.027 -2.951 18321 22665 1 17 . 1 1 230 230 LEU CB C 230 40.608 40.608 40.629 -0.021 18321 22666 1 17 . 1 1 230 230 LEU H H 230 8.453 8.453 7.670 0.783 18321 22667 1 17 . 1 1 231 231 PRO HA H 231 4.412 4.412 4.224 0.188 18321 22668 1 17 . 1 1 231 231 PRO C C 231 176.571 176.571 178.077 -1.506 18321 22669 1 17 . 1 1 231 231 PRO CA C 231 63.225 63.225 65.937 -2.712 18321 22670 1 17 . 1 1 231 231 PRO CB C 231 31.191 31.191 31.662 -0.471 18321 22671 1 17 . 1 1 232 232 SER N N 232 115.169 115.169 115.692 -0.523 18321 22672 1 17 . 1 1 232 232 SER HA H 232 4.450 4.450 4.615 -0.165 18321 22673 1 17 . 1 1 232 232 SER CA C 232 58.604 58.604 57.461 1.143 18321 22674 1 17 . 1 1 232 232 SER CB C 232 63.962 63.962 62.909 1.053 18321 22675 1 17 . 1 1 232 232 SER H H 232 8.280 8.280 8.018 0.262 18321 22676 1 17 . 1 1 233 233 THR N N 233 115.155 115.155 117.780 -2.625 18321 22677 1 17 . 1 1 233 233 THR HA H 233 4.351 4.351 4.723 -0.372 18321 22678 1 17 . 1 1 233 233 THR C C 233 177.237 177.237 174.190 3.047 18321 22679 1 17 . 1 1 233 233 THR CA C 233 61.939 61.939 60.674 1.265 18321 22680 1 17 . 1 1 233 233 THR CB C 233 68.986 68.986 71.210 -2.224 18321 22681 1 17 . 1 1 233 233 THR H H 233 8.096 8.096 7.934 0.162 18321 22682 1 17 . 1 1 234 234 GLN N N 234 122.040 122.040 121.728 0.312 18321 22683 1 17 . 1 1 234 234 GLN HA H 234 4.681 4.681 4.334 0.347 18321 22684 1 17 . 1 1 234 234 GLN C C 234 176.177 176.177 175.952 0.225 18321 22685 1 17 . 1 1 234 234 GLN CA C 234 55.861 55.861 56.240 -0.379 18321 22686 1 17 . 1 1 234 234 GLN CB C 234 28.583 28.583 29.751 -1.168 18321 22687 1 17 . 1 1 234 234 GLN H H 234 8.256 8.256 8.558 -0.302 18321 22688 1 17 . 1 1 235 235 ASN N N 235 119.506 119.506 116.553 2.953 18321 22689 1 17 . 1 1 235 235 ASN HA H 235 4.775 4.775 4.488 0.287 18321 22690 1 17 . 1 1 235 235 ASN C C 235 174.974 174.974 174.745 0.229 18321 22691 1 17 . 1 1 235 235 ASN CA C 235 53.191 53.191 53.539 -0.348 18321 22692 1 17 . 1 1 235 235 ASN CB C 235 38.511 38.511 38.256 0.255 18321 22693 1 17 . 1 1 235 235 ASN H H 235 8.346 8.346 8.217 0.129 18321 22694 1 17 . 1 1 236 236 GLY N N 236 109.378 109.378 108.008 1.370 18321 22695 1 17 . 1 1 236 236 GLY CA C 236 44.023 44.023 44.697 -0.674 18321 22696 1 17 . 1 1 236 236 GLY H H 236 7.939 7.939 8.515 -0.576 18321 22697 1 17 . 1 1 237 237 PRO HA H 237 4.336 4.336 4.372 -0.036 18321 22698 1 17 . 1 1 237 237 PRO C C 237 175.942 175.942 175.650 0.292 18321 22699 1 17 . 1 1 237 237 PRO CA C 237 62.797 62.797 62.502 0.295 18321 22700 1 17 . 1 1 237 237 PRO CB C 237 27.421 27.421 32.131 -4.710 18321 22701 1 17 . 1 1 238 238 VAL N N 238 120.535 120.535 122.955 -2.420 18321 22702 1 17 . 1 1 238 238 VAL HA H 238 4.195 4.195 3.991 0.204 18321 22703 1 17 . 1 1 238 238 VAL C C 238 173.775 173.775 174.327 -0.552 18321 22704 1 17 . 1 1 238 238 VAL CA C 238 61.173 61.173 62.189 -1.016 18321 22705 1 17 . 1 1 238 238 VAL CB C 238 38.328 38.328 32.344 5.984 18321 22706 1 17 . 1 1 238 238 VAL H H 238 7.986 7.986 7.706 0.280 18321 22707 1 17 . 1 1 239 239 PHE N N 239 123.522 123.522 126.497 -2.975 18321 22708 1 17 . 1 1 239 239 PHE HA H 239 5.539 5.539 5.151 0.388 18321 22709 1 17 . 1 1 239 239 PHE C C 239 174.207 174.207 175.022 -0.815 18321 22710 1 17 . 1 1 239 239 PHE CA C 239 56.993 56.993 56.164 0.829 18321 22711 1 17 . 1 1 239 239 PHE CB C 239 41.743 41.743 41.196 0.547 18321 22712 1 17 . 1 1 239 239 PHE H H 239 8.927 8.927 8.512 0.415 18321 22713 1 17 . 1 1 240 240 ALA N N 240 120.871 120.871 126.427 -5.556 18321 22714 1 17 . 1 1 240 240 ALA HA H 240 5.352 5.352 5.159 0.193 18321 22715 1 17 . 1 1 240 240 ALA C C 240 174.639 174.639 175.439 -0.800 18321 22716 1 17 . 1 1 240 240 ALA CA C 240 49.736 49.736 50.219 -0.483 18321 22717 1 17 . 1 1 240 240 ALA CB C 240 23.480 23.480 22.585 0.895 18321 22718 1 17 . 1 1 240 240 ALA H H 240 9.398 9.398 8.647 0.751 18321 22719 1 17 . 1 1 241 241 LYS N N 241 121.227 121.227 123.735 -2.508 18321 22720 1 17 . 1 1 241 241 LYS HA H 241 5.373 5.373 5.203 0.170 18321 22721 1 17 . 1 1 241 241 LYS C C 241 176.772 176.772 176.024 0.748 18321 22722 1 17 . 1 1 241 241 LYS CA C 241 53.128 53.128 54.724 -1.596 18321 22723 1 17 . 1 1 241 241 LYS CB C 241 34.850 34.850 34.778 0.072 18321 22724 1 17 . 1 1 241 241 LYS H H 241 8.947 8.947 8.516 0.431 18321 22725 1 17 . 1 1 242 242 ALA N N 242 126.833 126.833 130.725 -3.892 18321 22726 1 17 . 1 1 242 242 ALA HA H 242 4.764 4.764 4.669 0.095 18321 22727 1 17 . 1 1 242 242 ALA C C 242 178.506 178.506 178.052 0.454 18321 22728 1 17 . 1 1 242 242 ALA CA C 242 52.788 52.788 52.083 0.705 18321 22729 1 17 . 1 1 242 242 ALA CB C 242 19.084 19.084 18.752 0.332 18321 22730 1 17 . 1 1 242 242 ALA H H 242 9.373 9.373 9.037 0.336 18321 22731 1 17 . 1 1 243 243 ILE N N 243 118.731 118.731 119.705 -0.974 18321 22732 1 17 . 1 1 243 243 ILE HA H 243 4.454 4.454 4.130 0.325 18321 22733 1 17 . 1 1 243 243 ILE C C 243 174.773 174.773 176.137 -1.364 18321 22734 1 17 . 1 1 243 243 ILE CA C 243 60.613 60.613 62.610 -1.997 18321 22735 1 17 . 1 1 243 243 ILE CB C 243 39.232 39.232 38.716 0.516 18321 22736 1 17 . 1 1 243 243 ILE H H 243 8.933 8.933 8.786 0.147 18321 22737 1 17 . 1 1 244 244 GLN N N 244 121.616 121.616 119.331 2.285 18321 22738 1 17 . 1 1 244 244 GLN HA H 244 4.283 4.283 4.553 -0.270 18321 22739 1 17 . 1 1 244 244 GLN C C 244 172.815 172.815 174.516 -1.701 18321 22740 1 17 . 1 1 244 244 GLN CA C 244 54.750 54.750 54.157 0.592 18321 22741 1 17 . 1 1 244 244 GLN CB C 244 31.469 31.469 32.664 -1.195 18321 22742 1 17 . 1 1 244 244 GLN H H 244 7.438 7.438 7.554 -0.116 18321 22743 1 17 . 1 1 245 245 LYS N N 245 124.215 124.215 122.723 1.492 18321 22744 1 17 . 1 1 245 245 LYS HA H 245 3.962 3.962 4.305 -0.343 18321 22745 1 17 . 1 1 245 245 LYS C C 245 175.679 175.679 176.413 -0.734 18321 22746 1 17 . 1 1 245 245 LYS CA C 245 56.413 56.413 57.412 -0.999 18321 22747 1 17 . 1 1 245 245 LYS CB C 245 32.847 32.847 33.036 -0.189 18321 22748 1 17 . 1 1 245 245 LYS H H 245 8.318 8.318 8.555 -0.237 18321 22749 1 17 . 1 1 246 246 ARG N N 246 127.327 127.327 122.097 5.230 18321 22750 1 17 . 1 1 246 246 ARG HA H 246 4.221 4.221 4.741 -0.520 18321 22751 1 17 . 1 1 246 246 ARG CA C 246 56.279 56.279 55.114 1.165 18321 22752 1 17 . 1 1 246 246 ARG CB C 246 32.987 32.987 32.302 0.685 18321 22753 1 17 . 1 1 246 246 ARG H H 246 9.248 9.248 8.925 0.323 18321 22754 1 17 . 1 1 249 249 CYS HA H 249 4.260 4.260 4.447 -0.187 18321 22755 1 17 . 1 1 249 249 CYS CA C 249 55.886 55.886 56.757 -0.871 18321 22756 1 17 . 1 1 249 249 CYS CB C 249 34.146 34.146 29.346 4.800 18321 22757 1 17 . 1 1 250 250 ALA HA H 250 3.926 3.926 4.108 -0.182 18321 22758 1 17 . 1 1 250 250 ALA CA C 250 54.344 54.344 54.353 -0.009 18321 22759 1 17 . 1 1 250 250 ALA CB C 250 18.342 18.342 18.719 -0.377 18321 22760 1 17 . 1 1 251 251 TYR N N 251 110.618 110.618 114.945 -4.327 18321 22761 1 17 . 1 1 251 251 TYR HA H 251 4.489 4.489 4.727 -0.238 18321 22762 1 17 . 1 1 251 251 TYR C C 251 175.286 175.286 174.696 0.590 18321 22763 1 17 . 1 1 251 251 TYR CA C 251 56.137 56.137 53.826 2.311 18321 22764 1 17 . 1 1 251 251 TYR CB C 251 37.203 37.203 37.042 0.161 18321 22765 1 17 . 1 1 251 251 TYR H H 251 7.037 7.037 7.348 -0.311 18321 22766 1 17 . 1 1 252 252 ASP N N 252 121.835 121.835 122.839 -1.004 18321 22767 1 17 . 1 1 252 252 ASP HA H 252 4.763 4.763 4.442 0.321 18321 22768 1 17 . 1 1 252 252 ASP CA C 252 52.351 52.351 55.058 -2.707 18321 22769 1 17 . 1 1 252 252 ASP CB C 252 39.995 39.995 40.715 -0.720 18321 22770 1 17 . 1 1 252 252 ASP H H 252 7.339 7.339 7.561 -0.222 18321 22771 1 17 . 1 1 253 253 LYS N N 253 123.177 123.177 124.737 -1.560 18321 22772 1 17 . 1 1 253 253 LYS HA H 253 4.270 4.270 4.537 -0.267 18321 22773 1 17 . 1 1 253 253 LYS C C 253 177.724 177.724 175.805 1.919 18321 22774 1 17 . 1 1 253 253 LYS CA C 253 57.036 57.036 56.150 0.886 18321 22775 1 17 . 1 1 253 253 LYS H H 253 8.396 8.396 8.388 0.008 18321 22776 1 17 . 1 1 254 254 THR N N 254 108.317 108.317 113.291 -4.974 18321 22777 1 17 . 1 1 254 254 THR HA H 254 4.517 4.517 4.568 -0.051 18321 22778 1 17 . 1 1 254 254 THR C C 254 174.012 174.012 172.826 1.186 18321 22779 1 17 . 1 1 254 254 THR CA C 254 61.036 61.036 62.139 -1.103 18321 22780 1 17 . 1 1 254 254 THR CB C 254 69.307 69.307 69.299 0.008 18321 22781 1 17 . 1 1 254 254 THR H H 254 8.217 8.217 7.827 0.390 18321 22782 1 17 . 1 1 255 255 ALA N N 255 124.762 124.762 125.882 -1.120 18321 22783 1 17 . 1 1 255 255 ALA HA H 255 4.524 4.524 4.960 -0.436 18321 22784 1 17 . 1 1 255 255 ALA C C 255 176.630 176.630 175.359 1.271 18321 22785 1 17 . 1 1 255 255 ALA CA C 255 51.352 51.352 50.060 1.292 18321 22786 1 17 . 1 1 255 255 ALA CB C 255 20.135 20.135 20.241 -0.107 18321 22787 1 17 . 1 1 255 255 ALA H H 255 7.096 7.096 8.748 -1.652 18321 22788 1 17 . 1 1 256 256 LEU N N 256 124.379 124.379 123.496 0.883 18321 22789 1 17 . 1 1 256 256 LEU HA H 256 4.328 4.328 4.264 0.064 18321 22790 1 17 . 1 1 256 256 LEU C C 256 176.007 176.007 175.576 0.431 18321 22791 1 17 . 1 1 256 256 LEU CA C 256 53.502 53.502 54.814 -1.312 18321 22792 1 17 . 1 1 256 256 LEU CB C 256 44.665 44.665 43.301 1.364 18321 22793 1 17 . 1 1 256 256 LEU H H 256 8.889 8.889 8.510 0.379 18321 22794 1 17 . 1 1 257 257 ALA N N 257 129.619 129.619 125.759 3.860 18321 22795 1 17 . 1 1 257 257 ALA HA H 257 4.445 4.445 5.026 -0.581 18321 22796 1 17 . 1 1 257 257 ALA C C 257 176.813 176.813 176.185 0.628 18321 22797 1 17 . 1 1 257 257 ALA CA C 257 51.179 51.179 50.834 0.345 18321 22798 1 17 . 1 1 257 257 ALA CB C 257 18.973 18.973 20.046 -1.073 18321 22799 1 17 . 1 1 257 257 ALA H H 257 8.529 8.529 8.148 0.381 18321 22800 1 17 . 1 1 258 258 LEU N N 258 119.300 119.300 124.515 -5.215 18321 22801 1 17 . 1 1 258 258 LEU HA H 258 4.782 4.782 4.750 0.032 18321 22802 1 17 . 1 1 258 258 LEU CA C 258 53.259 53.259 53.916 -0.658 18321 22803 1 17 . 1 1 258 258 LEU CB C 258 45.972 45.972 46.195 -0.223 18321 22804 1 17 . 1 1 258 258 LEU H H 258 8.505 8.505 9.077 -0.572 18321 22805 1 17 . 1 1 259 259 GLU N N 259 123.919 123.919 121.934 1.985 18321 22806 1 17 . 1 1 259 259 GLU HA H 259 4.516 4.516 4.549 -0.033 18321 22807 1 17 . 1 1 259 259 GLU C C 259 175.795 175.795 175.299 0.496 18321 22808 1 17 . 1 1 259 259 GLU CA C 259 52.896 52.896 54.089 -1.193 18321 22809 1 17 . 1 1 259 259 GLU H H 259 8.943 8.943 8.524 0.419 18321 22810 1 17 . 1 1 260 260 VAL N N 260 122.122 122.122 119.256 2.866 18321 22811 1 17 . 1 1 260 260 VAL HA H 260 2.923 2.923 4.318 -1.395 18321 22812 1 17 . 1 1 260 260 VAL C C 260 177.964 177.964 177.378 0.586 18321 22813 1 17 . 1 1 260 260 VAL CA C 260 65.417 65.417 63.385 2.032 18321 22814 1 17 . 1 1 260 260 VAL CB C 260 30.668 30.668 31.367 -0.699 18321 22815 1 17 . 1 1 260 260 VAL H H 260 8.956 8.956 8.382 0.574 18321 22816 1 17 . 1 1 261 261 GLY N N 261 116.009 116.009 117.147 -1.138 18321 22817 1 17 . 1 1 261 261 GLY C C 261 176.288 176.288 173.601 2.687 18321 22818 1 17 . 1 1 261 261 GLY CA C 261 44.210 44.210 44.671 -0.461 18321 22819 1 17 . 1 1 261 261 GLY H H 261 8.799 8.799 9.061 -0.262 18321 22820 1 17 . 1 1 262 262 ASP N N 262 121.945 121.945 120.678 1.267 18321 22821 1 17 . 1 1 262 262 ASP HA H 262 4.423 4.423 4.870 -0.447 18321 22822 1 17 . 1 1 262 262 ASP C C 262 175.381 175.381 175.427 -0.046 18321 22823 1 17 . 1 1 262 262 ASP CA C 262 55.243 55.243 52.803 2.440 18321 22824 1 17 . 1 1 262 262 ASP CB C 262 41.819 41.819 42.577 -0.758 18321 22825 1 17 . 1 1 262 262 ASP H H 262 8.180 8.180 7.638 0.542 18321 22826 1 17 . 1 1 263 263 ILE N N 263 121.452 121.452 123.669 -2.217 18321 22827 1 17 . 1 1 263 263 ILE HA H 263 4.707 4.707 4.661 0.046 18321 22828 1 17 . 1 1 263 263 ILE C C 263 174.996 174.996 176.209 -1.213 18321 22829 1 17 . 1 1 263 263 ILE CA C 263 59.289 59.289 59.572 -0.283 18321 22830 1 17 . 1 1 263 263 ILE CB C 263 36.987 36.987 37.505 -0.518 18321 22831 1 17 . 1 1 263 263 ILE H H 263 8.460 8.460 8.601 -0.141 18321 22832 1 17 . 1 1 264 264 VAL N N 264 128.756 128.756 129.560 -0.804 18321 22833 1 17 . 1 1 264 264 VAL HA H 264 4.309 4.309 3.987 0.322 18321 22834 1 17 . 1 1 264 264 VAL C C 264 175.486 175.486 175.213 0.273 18321 22835 1 17 . 1 1 264 264 VAL CA C 264 59.091 59.091 62.043 -2.952 18321 22836 1 17 . 1 1 264 264 VAL CB C 264 34.541 34.541 31.498 3.043 18321 22837 1 17 . 1 1 264 264 VAL H H 264 9.479 9.479 9.124 0.355 18321 22838 1 17 . 1 1 265 265 LYS N N 265 128.101 128.101 130.340 -2.239 18321 22839 1 17 . 1 1 265 265 LYS HA H 265 4.342 4.342 4.104 0.238 18321 22840 1 17 . 1 1 265 265 LYS C C 265 175.531 175.531 174.884 0.647 18321 22841 1 17 . 1 1 265 265 LYS CA C 265 55.620 55.620 56.023 -0.403 18321 22842 1 17 . 1 1 265 265 LYS CB C 265 33.149 33.149 32.136 1.013 18321 22843 1 17 . 1 1 265 265 LYS H H 265 8.715 8.715 8.559 0.156 18321 22844 1 17 . 1 1 266 266 VAL N N 266 129.537 129.537 127.561 1.976 18321 22845 1 17 . 1 1 266 266 VAL HA H 266 4.333 4.333 4.492 -0.159 18321 22846 1 17 . 1 1 266 266 VAL C C 266 176.166 176.166 174.564 1.602 18321 22847 1 17 . 1 1 266 266 VAL CA C 266 63.339 63.339 60.632 2.707 18321 22848 1 17 . 1 1 266 266 VAL CB C 266 30.712 30.712 34.302 -3.590 18321 22849 1 17 . 1 1 266 266 VAL H H 266 9.073 9.073 7.787 1.286 18321 22850 1 17 . 1 1 267 267 THR N N 267 120.020 120.020 123.238 -3.218 18321 22851 1 17 . 1 1 267 267 THR HA H 267 4.189 4.189 4.339 -0.150 18321 22852 1 17 . 1 1 267 267 THR C C 267 176.054 176.054 175.305 0.749 18321 22853 1 17 . 1 1 267 267 THR CA C 267 62.204 62.204 63.310 -1.106 18321 22854 1 17 . 1 1 267 267 THR CB C 267 68.200 68.200 69.196 -0.996 18321 22855 1 17 . 1 1 267 267 THR H H 267 9.130 9.130 8.358 0.772 18321 22856 1 17 . 1 1 268 268 ARG N N 268 120.839 120.839 123.648 -2.809 18321 22857 1 17 . 1 1 268 268 ARG HA H 268 4.236 4.236 4.549 -0.313 18321 22858 1 17 . 1 1 268 268 ARG CA C 268 56.321 56.321 55.139 1.182 18321 22859 1 17 . 1 1 268 268 ARG CB C 268 33.049 33.049 30.938 2.111 18321 22860 1 17 . 1 1 268 268 ARG H H 268 7.631 7.631 7.751 -0.120 18321 22861 1 17 . 1 1 269 269 MET N N 269 125.443 125.443 125.389 0.054 18321 22862 1 17 . 1 1 269 269 MET C C 269 174.392 174.392 174.919 -0.527 18321 22863 1 17 . 1 1 269 269 MET H H 269 8.532 8.532 8.577 -0.045 18321 22864 1 17 . 1 1 270 270 ASN N N 270 119.125 119.125 122.090 -2.965 18321 22865 1 17 . 1 1 270 270 ASN HA H 270 4.546 4.546 5.019 -0.473 18321 22866 1 17 . 1 1 270 270 ASN C C 270 172.133 172.133 175.479 -3.346 18321 22867 1 17 . 1 1 270 270 ASN CA C 270 53.639 53.639 52.294 1.345 18321 22868 1 17 . 1 1 270 270 ASN CB C 270 39.845 39.845 39.215 0.630 18321 22869 1 17 . 1 1 270 270 ASN H H 270 6.631 6.631 8.483 -1.852 18321 22870 1 17 . 1 1 271 271 ILE N N 271 122.532 122.532 118.209 4.323 18321 22871 1 17 . 1 1 271 271 ILE HA H 271 4.417 4.417 4.080 0.337 18321 22872 1 17 . 1 1 271 271 ILE CA C 271 63.348 63.348 62.190 1.159 18321 22873 1 17 . 1 1 271 271 ILE CB C 271 38.198 38.198 38.112 0.086 18321 22874 1 17 . 1 1 271 271 ILE H H 271 8.565 8.565 8.578 -0.013 18321 22875 1 17 . 1 1 272 272 ASN HA H 272 4.527 4.527 4.545 -0.018 18321 22876 1 17 . 1 1 272 272 ASN C C 272 176.259 176.259 176.268 -0.009 18321 22877 1 17 . 1 1 272 272 ASN CA C 272 53.225 53.225 53.654 -0.429 18321 22878 1 17 . 1 1 272 272 ASN CB C 272 37.565 37.565 38.692 -1.127 18321 22879 1 17 . 1 1 273 273 GLY N N 273 107.043 107.043 108.673 -1.630 18321 22880 1 17 . 1 1 273 273 GLY C C 273 173.216 173.216 172.663 0.553 18321 22881 1 17 . 1 1 273 273 GLY CA C 273 45.299 45.299 44.735 0.564 18321 22882 1 17 . 1 1 273 273 GLY H H 273 8.086 8.086 8.054 0.032 18321 22883 1 17 . 1 1 274 274 GLN N N 274 120.624 120.624 121.568 -0.944 18321 22884 1 17 . 1 1 274 274 GLN HA H 274 4.551 4.551 4.304 0.247 18321 22885 1 17 . 1 1 274 274 GLN C C 274 175.039 175.039 175.383 -0.344 18321 22886 1 17 . 1 1 274 274 GLN CA C 274 54.556 54.556 55.336 -0.780 18321 22887 1 17 . 1 1 274 274 GLN CB C 274 33.698 33.698 28.972 4.726 18321 22888 1 17 . 1 1 274 274 GLN H H 274 8.045 8.045 7.915 0.130 18321 22889 1 17 . 1 1 275 275 TRP N N 275 125.596 125.596 125.018 0.578 18321 22890 1 17 . 1 1 275 275 TRP HA H 275 4.588 4.588 4.596 -0.008 18321 22891 1 17 . 1 1 275 275 TRP C C 275 172.832 172.832 175.553 -2.721 18321 22892 1 17 . 1 1 275 275 TRP CA C 275 55.296 55.296 54.606 0.690 18321 22893 1 17 . 1 1 275 275 TRP CB C 275 31.393 31.393 30.233 1.160 18321 22894 1 17 . 1 1 275 275 TRP H H 275 8.484 8.484 7.849 0.635 18321 22895 1 17 . 1 1 276 276 GLU N N 276 119.012 119.012 121.415 -2.403 18321 22896 1 17 . 1 1 276 276 GLU HA H 276 5.190 5.190 4.990 0.200 18321 22897 1 17 . 1 1 276 276 GLU C C 276 176.553 176.553 175.982 0.571 18321 22898 1 17 . 1 1 276 276 GLU CA C 276 54.288 54.288 55.356 -1.068 18321 22899 1 17 . 1 1 276 276 GLU CB C 276 32.851 32.851 31.482 1.369 18321 22900 1 17 . 1 1 276 276 GLU H H 276 8.643 8.643 8.289 0.354 18321 22901 1 17 . 1 1 277 277 GLY N N 277 111.364 111.364 113.145 -1.781 18321 22902 1 17 . 1 1 277 277 GLY C C 277 170.707 170.707 172.918 -2.211 18321 22903 1 17 . 1 1 277 277 GLY CA C 277 46.723 46.723 43.884 2.839 18321 22904 1 17 . 1 1 277 277 GLY H H 277 9.072 9.072 8.619 0.453 18321 22905 1 17 . 1 1 278 278 GLU N N 278 117.733 117.733 124.067 -6.334 18321 22906 1 17 . 1 1 278 278 GLU HA H 278 5.748 5.748 4.938 0.810 18321 22907 1 17 . 1 1 278 278 GLU C C 278 176.051 176.051 175.653 0.398 18321 22908 1 17 . 1 1 278 278 GLU CA C 278 53.620 53.620 54.802 -1.182 18321 22909 1 17 . 1 1 278 278 GLU CB C 278 33.742 33.742 30.535 3.207 18321 22910 1 17 . 1 1 278 278 GLU H H 278 8.810 8.810 8.271 0.539 18321 22911 1 17 . 1 1 279 279 VAL N N 279 123.834 123.834 125.171 -1.337 18321 22912 1 17 . 1 1 279 279 VAL HA H 279 4.404 4.404 4.403 0.001 18321 22913 1 17 . 1 1 279 279 VAL C C 279 175.289 175.289 176.063 -0.774 18321 22914 1 17 . 1 1 279 279 VAL CA C 279 61.166 61.166 60.914 0.252 18321 22915 1 17 . 1 1 279 279 VAL CB C 279 34.123 34.123 34.176 -0.053 18321 22916 1 17 . 1 1 279 279 VAL H H 279 8.887 8.887 8.800 0.087 18321 22917 1 17 . 1 1 280 280 ASN N N 280 126.025 126.025 126.077 -0.052 18321 22918 1 17 . 1 1 280 280 ASN HA H 280 4.435 4.435 4.340 0.095 18321 22919 1 17 . 1 1 280 280 ASN C C 280 175.205 175.205 175.384 -0.179 18321 22920 1 17 . 1 1 280 280 ASN CA C 280 45.615 45.615 53.446 -7.831 18321 22921 1 17 . 1 1 280 280 ASN CB C 280 37.386 37.386 37.117 0.269 18321 22922 1 17 . 1 1 280 280 ASN H H 280 9.322 9.322 9.229 0.093 18321 22923 1 17 . 1 1 281 281 GLY N N 281 104.588 104.588 104.183 0.405 18321 22924 1 17 . 1 1 281 281 GLY C C 281 173.944 173.944 173.398 0.546 18321 22925 1 17 . 1 1 281 281 GLY CA C 281 45.224 45.224 44.784 0.440 18321 22926 1 17 . 1 1 281 281 GLY H H 281 8.768 8.768 8.302 0.466 18321 22927 1 17 . 1 1 282 282 ARG N N 282 122.567 122.567 121.235 1.332 18321 22928 1 17 . 1 1 282 282 ARG HA H 282 4.559 4.559 4.674 -0.115 18321 22929 1 17 . 1 1 282 282 ARG C C 282 174.350 174.350 174.085 0.265 18321 22930 1 17 . 1 1 282 282 ARG CA C 282 54.933 54.933 54.781 0.152 18321 22931 1 17 . 1 1 282 282 ARG CB C 282 31.765 31.765 33.338 -1.573 18321 22932 1 17 . 1 1 282 282 ARG H H 282 8.149 8.149 7.996 0.153 18321 22933 1 17 . 1 1 283 283 LYS N N 283 121.565 121.565 126.075 -4.510 18321 22934 1 17 . 1 1 283 283 LYS HA H 283 5.584 5.584 5.632 -0.048 18321 22935 1 17 . 1 1 283 283 LYS CA C 283 54.143 54.143 54.654 -0.511 18321 22936 1 17 . 1 1 283 283 LYS CB C 283 36.040 36.040 34.500 1.540 18321 22937 1 17 . 1 1 283 283 LYS H H 283 8.424 8.424 8.550 -0.126 18321 22938 1 17 . 1 1 284 284 GLY C C 284 173.006 173.006 172.322 0.684 18321 22939 1 17 . 1 1 284 284 GLY CA C 284 45.886 45.886 45.421 0.465 18321 22940 1 17 . 1 1 285 285 LEU N N 285 119.673 119.673 123.562 -3.889 18321 22941 1 17 . 1 1 285 285 LEU HA H 285 5.718 5.718 5.398 0.320 18321 22942 1 17 . 1 1 285 285 LEU C C 285 178.657 178.657 176.462 2.195 18321 22943 1 17 . 1 1 285 285 LEU CA C 285 53.656 53.656 54.643 -0.987 18321 22944 1 17 . 1 1 285 285 LEU CB C 285 44.813 44.813 42.307 2.506 18321 22945 1 17 . 1 1 285 285 LEU H H 285 8.734 8.734 8.861 -0.127 18321 22946 1 17 . 1 1 286 286 PHE N N 286 118.785 118.785 121.762 -2.977 18321 22947 1 17 . 1 1 286 286 PHE HA H 286 4.521 4.521 5.051 -0.530 18321 22948 1 17 . 1 1 286 286 PHE CA C 286 57.592 57.592 54.176 3.416 18321 22949 1 17 . 1 1 286 286 PHE CB C 286 40.669 40.669 39.785 0.884 18321 22950 1 17 . 1 1 286 286 PHE H H 286 9.120 9.120 8.902 0.218 18321 22951 1 17 . 1 1 287 287 PRO HA H 287 4.385 4.385 4.450 -0.065 18321 22952 1 17 . 1 1 287 287 PRO CA C 287 62.814 62.814 61.485 1.329 18321 22953 1 17 . 1 1 287 287 PRO CB C 287 32.133 32.133 31.976 0.157 18321 22954 1 17 . 1 1 288 288 PHE C C 288 174.837 174.837 176.173 -1.336 18321 22955 1 17 . 1 1 288 288 PHE CA C 288 59.020 59.020 60.221 -1.201 18321 22956 1 17 . 1 1 288 288 PHE CB C 288 34.987 34.987 36.967 -1.980 18321 22957 1 17 . 1 1 289 289 THR N N 289 107.865 107.865 112.715 -4.850 18321 22958 1 17 . 1 1 289 289 THR HA H 289 3.589 3.589 4.045 -0.456 18321 22959 1 17 . 1 1 289 289 THR C C 289 176.125 176.125 174.838 1.287 18321 22960 1 17 . 1 1 289 289 THR CA C 289 62.243 62.243 64.518 -2.275 18321 22961 1 17 . 1 1 289 289 THR CB C 289 69.365 69.365 67.885 1.480 18321 22962 1 17 . 1 1 289 289 THR H H 289 6.453 6.453 7.654 -1.201 18321 22963 1 17 . 1 1 290 290 HIS N N 290 119.462 119.462 118.405 1.057 18321 22964 1 17 . 1 1 290 290 HIS HA H 290 4.196 4.196 4.715 -0.519 18321 22965 1 17 . 1 1 290 290 HIS C C 290 175.165 175.165 174.007 1.158 18321 22966 1 17 . 1 1 290 290 HIS CA C 290 57.635 57.635 56.644 0.991 18321 22967 1 17 . 1 1 290 290 HIS CB C 290 29.840 29.840 31.921 -2.081 18321 22968 1 17 . 1 1 290 290 HIS H H 290 7.835 7.835 8.033 -0.198 18321 22969 1 17 . 1 1 291 291 VAL N N 291 110.050 110.050 112.600 -2.550 18321 22970 1 17 . 1 1 291 291 VAL HA H 291 5.445 5.445 5.036 0.409 18321 22971 1 17 . 1 1 291 291 VAL C C 291 173.386 173.386 174.532 -1.146 18321 22972 1 17 . 1 1 291 291 VAL CA C 291 57.794 57.794 59.663 -1.869 18321 22973 1 17 . 1 1 291 291 VAL CB C 291 35.784 35.784 34.830 0.954 18321 22974 1 17 . 1 1 291 291 VAL H H 291 7.562 7.562 7.385 0.177 18321 22975 1 17 . 1 1 292 292 LYS N N 292 119.445 119.445 122.209 -2.764 18321 22976 1 17 . 1 1 292 292 LYS HA H 292 4.857 4.857 4.910 -0.053 18321 22977 1 17 . 1 1 292 292 LYS C C 292 176.512 176.512 175.408 1.104 18321 22978 1 17 . 1 1 292 292 LYS CA C 292 54.647 54.647 54.664 -0.017 18321 22979 1 17 . 1 1 292 292 LYS CB C 292 35.665 35.665 36.033 -0.368 18321 22980 1 17 . 1 1 292 292 LYS H H 292 8.753 8.753 8.114 0.639 18321 22981 1 17 . 1 1 293 293 ILE N N 293 128.707 128.707 125.052 3.655 18321 22982 1 17 . 1 1 293 293 ILE HA H 293 4.509 4.509 4.478 0.031 18321 22983 1 17 . 1 1 293 293 ILE C C 293 175.666 175.666 175.821 -0.155 18321 22984 1 17 . 1 1 293 293 ILE CA C 293 62.563 62.563 61.504 1.060 18321 22985 1 17 . 1 1 293 293 ILE CB C 293 38.076 38.076 38.590 -0.514 18321 22986 1 17 . 1 1 293 293 ILE H H 293 9.107 9.107 8.691 0.416 18321 22987 1 17 . 1 1 294 294 PHE N N 294 126.638 126.638 126.836 -0.198 18321 22988 1 17 . 1 1 294 294 PHE HA H 294 4.898 4.898 4.875 0.023 18321 22989 1 17 . 1 1 294 294 PHE C C 294 175.838 175.838 174.206 1.632 18321 22990 1 17 . 1 1 294 294 PHE CA C 294 56.335 56.335 55.294 1.041 18321 22991 1 17 . 1 1 294 294 PHE CB C 294 41.196 41.196 41.181 0.014 18321 22992 1 17 . 1 1 294 294 PHE H H 294 8.716 8.716 8.707 0.009 18321 22993 1 17 . 1 1 295 295 ASP N N 295 122.961 122.961 123.334 -0.373 18321 22994 1 17 . 1 1 295 295 ASP HA H 295 5.003 5.003 4.722 0.281 18321 22995 1 17 . 1 1 295 295 ASP CA C 295 50.602 50.602 52.746 -2.144 18321 22996 1 17 . 1 1 295 295 ASP CB C 295 40.754 40.754 41.668 -0.914 18321 22997 1 17 . 1 1 295 295 ASP H H 295 8.418 8.418 8.547 -0.129 18321 22998 1 17 . 1 1 296 296 PRO HA H 296 4.524 4.524 4.399 0.125 18321 22999 1 17 . 1 1 296 296 PRO C C 296 176.807 176.807 176.533 0.274 18321 23000 1 17 . 1 1 296 296 PRO CA C 296 62.987 62.987 63.646 -0.659 18321 23001 1 17 . 1 1 296 296 PRO CB C 296 32.033 32.033 31.821 0.212 18321 23002 1 17 . 1 1 297 297 GLN N N 297 120.729 120.729 118.279 2.450 18321 23003 1 17 . 1 1 297 297 GLN HA H 297 4.274 4.274 4.251 0.023 18321 23004 1 17 . 1 1 297 297 GLN CA C 297 56.427 56.427 55.483 0.944 18321 23005 1 17 . 1 1 297 297 GLN CB C 297 28.819 28.819 27.826 0.993 18321 23006 1 17 . 1 1 297 297 GLN H H 297 8.551 8.551 8.474 0.077 18321 23007 1 17 . 1 1 299 299 PRO C C 299 176.936 176.936 176.469 0.467 18321 23008 1 17 . 1 1 299 299 PRO CA C 299 63.406 63.406 63.048 0.358 18321 23009 1 17 . 1 1 299 299 PRO CB C 299 31.421 31.421 31.347 0.074 18321 23010 1 17 . 1 1 300 300 ASP N N 300 119.609 119.609 120.677 -1.068 18321 23011 1 17 . 1 1 300 300 ASP C C 300 176.344 176.344 176.515 -0.171 18321 23012 1 17 . 1 1 300 300 ASP CA C 300 54.178 54.178 55.660 -1.482 18321 23013 1 17 . 1 1 300 300 ASP CB C 300 40.661 40.661 41.079 -0.418 18321 23014 1 17 . 1 1 300 300 ASP H H 300 8.239 8.239 8.125 0.114 18321 23015 1 17 . 1 1 301 301 GLU N N 301 120.462 120.462 116.919 3.543 18321 23016 1 17 . 1 1 301 301 GLU CA C 301 56.188 56.188 55.343 0.845 18321 23017 1 17 . 1 1 301 301 GLU CB C 301 29.507 29.507 30.225 -0.718 18321 23018 1 17 . 1 1 301 301 GLU H H 301 8.084 8.084 8.359 -0.275 18321 23019 1 18 . 1 1 2 2 SER HA H 2 4.521 4.521 4.854 -0.333 18321 23020 1 18 . 1 1 2 2 SER CA C 2 58.326 58.326 57.688 0.638 18321 23021 1 18 . 1 1 2 2 SER CB C 2 64.062 64.062 64.584 -0.522 18321 23022 1 18 . 1 1 3 3 SER HA H 3 4.465 4.465 4.263 0.202 18321 23023 1 18 . 1 1 3 3 SER C C 3 173.887 173.887 174.839 -0.952 18321 23024 1 18 . 1 1 3 3 SER CA C 3 58.374 58.374 59.602 -1.228 18321 23025 1 18 . 1 1 3 3 SER CB C 3 63.920 63.920 63.449 0.471 18321 23026 1 18 . 1 1 4 4 ALA N N 4 124.755 124.755 124.646 0.109 18321 23027 1 18 . 1 1 4 4 ALA HA H 4 4.547 4.547 4.591 -0.044 18321 23028 1 18 . 1 1 4 4 ALA CA C 4 52.737 52.737 51.965 0.771 18321 23029 1 18 . 1 1 4 4 ALA CB C 4 19.636 19.636 18.867 0.769 18321 23030 1 18 . 1 1 4 4 ALA H H 4 8.244 8.244 7.894 0.350 18321 23031 1 18 . 1 1 5 5 ARG N N 5 120.383 120.383 125.675 -5.292 18321 23032 1 18 . 1 1 5 5 ARG HA H 5 4.524 4.524 4.689 -0.165 18321 23033 1 18 . 1 1 5 5 ARG C C 5 175.611 175.611 174.784 0.827 18321 23034 1 18 . 1 1 5 5 ARG CA C 5 56.082 56.082 55.597 0.485 18321 23035 1 18 . 1 1 5 5 ARG CB C 5 30.695 30.695 30.451 0.244 18321 23036 1 18 . 1 1 5 5 ARG H H 5 8.727 8.727 8.489 0.238 18321 23037 1 18 . 1 1 6 6 PHE N N 6 115.159 115.159 118.583 -3.424 18321 23038 1 18 . 1 1 6 6 PHE HA H 6 4.786 4.786 4.814 -0.028 18321 23039 1 18 . 1 1 6 6 PHE C C 6 172.076 172.076 173.621 -1.545 18321 23040 1 18 . 1 1 6 6 PHE CA C 6 56.640 56.640 55.825 0.815 18321 23041 1 18 . 1 1 6 6 PHE CB C 6 40.378 40.378 41.066 -0.689 18321 23042 1 18 . 1 1 6 6 PHE H H 6 7.536 7.536 7.577 -0.042 18321 23043 1 18 . 1 1 7 7 ASP N N 7 121.846 121.846 121.762 0.084 18321 23044 1 18 . 1 1 7 7 ASP HA H 7 4.846 4.846 4.661 0.185 18321 23045 1 18 . 1 1 7 7 ASP CA C 7 52.327 52.327 53.410 -1.083 18321 23046 1 18 . 1 1 7 7 ASP CB C 7 41.298 41.298 42.057 -0.759 18321 23047 1 18 . 1 1 7 7 ASP H H 7 9.062 9.062 8.705 0.357 18321 23048 1 18 . 1 1 8 8 SER HA H 8 3.950 3.950 4.299 -0.349 18321 23049 1 18 . 1 1 8 8 SER C C 8 174.705 174.705 175.507 -0.802 18321 23050 1 18 . 1 1 8 8 SER CA C 8 61.937 61.937 60.067 1.870 18321 23051 1 18 . 1 1 8 8 SER CB C 8 62.260 62.260 63.059 -0.799 18321 23052 1 18 . 1 1 9 9 SER N N 9 114.373 114.373 114.479 -0.106 18321 23053 1 18 . 1 1 9 9 SER HA H 9 4.529 4.529 4.700 -0.171 18321 23054 1 18 . 1 1 9 9 SER C C 9 175.089 175.089 174.294 0.795 18321 23055 1 18 . 1 1 9 9 SER CA C 9 59.851 59.851 58.886 0.965 18321 23056 1 18 . 1 1 9 9 SER CB C 9 64.246 64.246 63.870 0.376 18321 23057 1 18 . 1 1 9 9 SER H H 9 8.722 8.722 8.089 0.633 18321 23058 1 18 . 1 1 10 10 ASP N N 10 121.818 121.818 123.592 -1.774 18321 23059 1 18 . 1 1 10 10 ASP HA H 10 4.730 4.730 4.667 0.063 18321 23060 1 18 . 1 1 10 10 ASP C C 10 174.455 174.455 176.573 -2.118 18321 23061 1 18 . 1 1 10 10 ASP CA C 10 52.432 52.432 53.637 -1.205 18321 23062 1 18 . 1 1 10 10 ASP CB C 10 39.607 39.607 40.474 -0.867 18321 23063 1 18 . 1 1 10 10 ASP H H 10 7.600 7.600 7.885 -0.285 18321 23064 1 18 . 1 1 11 11 ARG N N 11 125.238 125.238 124.088 1.150 18321 23065 1 18 . 1 1 11 11 ARG HA H 11 1.936 1.936 2.238 -0.302 18321 23066 1 18 . 1 1 11 11 ARG C C 11 176.916 176.916 176.665 0.251 18321 23067 1 18 . 1 1 11 11 ARG CA C 11 57.451 57.451 57.551 -0.100 18321 23068 1 18 . 1 1 11 11 ARG CB C 11 43.014 43.014 29.100 13.914 18321 23069 1 18 . 1 1 11 11 ARG H H 11 7.739 7.739 7.967 -0.228 18321 23070 1 18 . 1 1 12 12 SER N N 12 112.065 112.065 113.002 -0.937 18321 23071 1 18 . 1 1 12 12 SER HA H 12 4.695 4.695 4.321 0.374 18321 23072 1 18 . 1 1 12 12 SER C C 12 175.092 175.092 173.506 1.586 18321 23073 1 18 . 1 1 12 12 SER CA C 12 60.785 60.785 57.855 2.930 18321 23074 1 18 . 1 1 12 12 SER CB C 12 62.889 62.889 62.079 0.810 18321 23075 1 18 . 1 1 12 12 SER H H 12 7.888 7.888 8.198 -0.310 18321 23076 1 18 . 1 1 13 13 ALA N N 13 122.249 122.249 124.258 -2.009 18321 23077 1 18 . 1 1 13 13 ALA HA H 13 4.216 4.216 4.368 -0.152 18321 23078 1 18 . 1 1 13 13 ALA C C 13 178.069 178.069 176.951 1.118 18321 23079 1 18 . 1 1 13 13 ALA CA C 13 53.562 53.562 53.365 0.197 18321 23080 1 18 . 1 1 13 13 ALA CB C 13 19.339 19.339 20.262 -0.922 18321 23081 1 18 . 1 1 13 13 ALA H H 13 7.418 7.418 7.709 -0.291 18321 23082 1 18 . 1 1 14 14 TRP N N 14 107.433 107.433 112.934 -5.501 18321 23083 1 18 . 1 1 14 14 TRP HA H 14 4.785 4.785 4.603 0.182 18321 23084 1 18 . 1 1 14 14 TRP C C 14 175.286 175.286 175.508 -0.222 18321 23085 1 18 . 1 1 14 14 TRP CA C 14 55.212 55.212 55.354 -0.142 18321 23086 1 18 . 1 1 14 14 TRP CB C 14 32.776 32.776 31.219 1.557 18321 23087 1 18 . 1 1 14 14 TRP H H 14 6.273 6.273 6.904 -0.631 18321 23088 1 18 . 1 1 15 15 TYR N N 15 122.315 122.315 123.982 -1.667 18321 23089 1 18 . 1 1 15 15 TYR HA H 15 5.436 5.436 5.034 0.402 18321 23090 1 18 . 1 1 15 15 TYR C C 15 175.325 175.325 174.948 0.377 18321 23091 1 18 . 1 1 15 15 TYR CA C 15 56.609 56.609 57.223 -0.614 18321 23092 1 18 . 1 1 15 15 TYR CB C 15 36.940 36.940 38.971 -2.031 18321 23093 1 18 . 1 1 15 15 TYR H H 15 8.221 8.221 7.503 0.718 18321 23094 1 18 . 1 1 16 16 MET N N 16 126.031 126.031 125.531 0.500 18321 23095 1 18 . 1 1 16 16 MET HA H 16 4.462 4.462 4.355 0.107 18321 23096 1 18 . 1 1 16 16 MET CA C 16 53.046 53.046 53.176 -0.130 18321 23097 1 18 . 1 1 16 16 MET CB C 16 41.114 41.114 31.693 9.421 18321 23098 1 18 . 1 1 16 16 MET H H 16 8.989 8.989 8.851 0.138 18321 23099 1 18 . 1 1 17 17 GLY CA C 17 45.803 45.803 45.439 0.364 18321 23100 1 18 . 1 1 18 18 PRO HA H 18 4.675 4.675 4.425 0.250 18321 23101 1 18 . 1 1 18 18 PRO C C 18 175.943 175.943 175.827 0.116 18321 23102 1 18 . 1 1 18 18 PRO CA C 18 63.647 63.647 63.053 0.594 18321 23103 1 18 . 1 1 18 18 PRO CB C 18 29.276 29.276 30.337 -1.061 18321 23104 1 18 . 1 1 19 19 VAL N N 19 126.159 126.159 120.256 5.903 18321 23105 1 18 . 1 1 19 19 VAL HA H 19 4.011 4.011 4.399 -0.388 18321 23106 1 18 . 1 1 19 19 VAL C C 19 175.812 175.812 174.646 1.166 18321 23107 1 18 . 1 1 19 19 VAL CA C 19 62.355 62.355 60.564 1.791 18321 23108 1 18 . 1 1 19 19 VAL CB C 19 33.468 33.468 34.313 -0.845 18321 23109 1 18 . 1 1 19 19 VAL H H 19 7.851 7.851 8.036 -0.185 18321 23110 1 18 . 1 1 20 20 SER N N 20 123.950 123.950 112.691 11.259 18321 23111 1 18 . 1 1 20 20 SER HA H 20 4.453 4.453 4.748 -0.295 18321 23112 1 18 . 1 1 20 20 SER CA C 20 57.631 57.631 56.611 1.020 18321 23113 1 18 . 1 1 20 20 SER CB C 20 65.951 65.951 64.850 1.101 18321 23114 1 18 . 1 1 20 20 SER H H 20 8.800 8.800 7.920 0.880 18321 23115 1 18 . 1 1 21 21 ARG N N 21 123.461 123.461 121.929 1.532 18321 23116 1 18 . 1 1 21 21 ARG HA H 21 3.489 3.489 4.045 -0.556 18321 23117 1 18 . 1 1 21 21 ARG C C 21 178.164 178.164 177.867 0.297 18321 23118 1 18 . 1 1 21 21 ARG CA C 21 60.025 60.025 59.733 0.292 18321 23119 1 18 . 1 1 21 21 ARG CB C 21 30.334 30.334 29.941 0.393 18321 23120 1 18 . 1 1 21 21 ARG H H 21 9.307 9.307 8.845 0.462 18321 23121 1 18 . 1 1 22 22 GLN N N 22 116.591 116.591 118.134 -1.543 18321 23122 1 18 . 1 1 22 22 GLN HA H 22 4.008 4.008 4.048 -0.040 18321 23123 1 18 . 1 1 22 22 GLN CA C 22 59.095 59.095 59.373 -0.278 18321 23124 1 18 . 1 1 22 22 GLN CB C 22 29.249 29.249 28.339 0.910 18321 23125 1 18 . 1 1 22 22 GLN H H 22 8.394 8.394 8.633 -0.239 18321 23126 1 18 . 1 1 23 23 GLU N N 23 122.191 122.191 118.808 3.383 18321 23127 1 18 . 1 1 23 23 GLU HA H 23 4.037 4.037 4.032 0.005 18321 23128 1 18 . 1 1 23 23 GLU C C 23 178.986 178.986 178.463 0.523 18321 23129 1 18 . 1 1 23 23 GLU CA C 23 59.081 59.081 58.992 0.089 18321 23130 1 18 . 1 1 23 23 GLU CB C 23 31.896 31.896 29.424 2.472 18321 23131 1 18 . 1 1 23 23 GLU H H 23 8.106 8.106 8.570 -0.464 18321 23132 1 18 . 1 1 24 24 ALA N N 24 121.964 121.964 121.527 0.437 18321 23133 1 18 . 1 1 24 24 ALA HA H 24 3.762 3.762 3.968 -0.206 18321 23134 1 18 . 1 1 24 24 ALA C C 24 178.653 178.653 179.831 -1.178 18321 23135 1 18 . 1 1 24 24 ALA CA C 24 55.480 55.480 55.238 0.242 18321 23136 1 18 . 1 1 24 24 ALA CB C 24 18.049 18.049 18.175 -0.126 18321 23137 1 18 . 1 1 24 24 ALA H H 24 8.732 8.732 8.213 0.519 18321 23138 1 18 . 1 1 25 25 GLN N N 25 116.229 116.229 117.228 -0.999 18321 23139 1 18 . 1 1 25 25 GLN HA H 25 3.950 3.950 4.089 -0.139 18321 23140 1 18 . 1 1 25 25 GLN C C 25 177.442 177.442 178.320 -0.878 18321 23141 1 18 . 1 1 25 25 GLN CA C 25 59.651 59.651 58.559 1.092 18321 23142 1 18 . 1 1 25 25 GLN CB C 25 29.308 29.308 29.150 0.158 18321 23143 1 18 . 1 1 25 25 GLN H H 25 8.391 8.391 7.857 0.534 18321 23144 1 18 . 1 1 26 26 THR N N 26 115.105 115.105 114.277 0.828 18321 23145 1 18 . 1 1 26 26 THR HA H 26 3.920 3.920 4.128 -0.208 18321 23146 1 18 . 1 1 26 26 THR C C 26 176.835 176.835 176.304 0.531 18321 23147 1 18 . 1 1 26 26 THR CA C 26 66.335 66.335 64.533 1.802 18321 23148 1 18 . 1 1 26 26 THR CB C 26 68.876 68.876 68.740 0.136 18321 23149 1 18 . 1 1 26 26 THR H H 26 8.223 8.223 7.721 0.502 18321 23150 1 18 . 1 1 27 27 ARG N N 27 119.096 119.096 117.023 2.073 18321 23151 1 18 . 1 1 27 27 ARG HA H 27 4.047 4.047 4.267 -0.220 18321 23152 1 18 . 1 1 27 27 ARG C C 27 177.245 177.245 176.724 0.521 18321 23153 1 18 . 1 1 27 27 ARG CA C 27 58.528 58.528 57.901 0.627 18321 23154 1 18 . 1 1 27 27 ARG CB C 27 30.184 30.184 30.804 -0.620 18321 23155 1 18 . 1 1 27 27 ARG H H 27 8.093 8.093 7.802 0.291 18321 23156 1 18 . 1 1 28 28 LEU N N 28 114.602 114.602 116.662 -2.060 18321 23157 1 18 . 1 1 28 28 LEU HA H 28 4.325 4.325 4.432 -0.107 18321 23158 1 18 . 1 1 28 28 LEU C C 28 177.197 177.197 176.927 0.270 18321 23159 1 18 . 1 1 28 28 LEU CA C 28 55.143 55.143 54.585 0.558 18321 23160 1 18 . 1 1 28 28 LEU CB C 28 44.902 44.902 43.064 1.838 18321 23161 1 18 . 1 1 28 28 LEU H H 28 7.438 7.438 7.395 0.043 18321 23162 1 18 . 1 1 29 29 GLN N N 29 121.312 121.312 119.897 1.415 18321 23163 1 18 . 1 1 29 29 GLN HA H 29 3.856 3.856 4.303 -0.447 18321 23164 1 18 . 1 1 29 29 GLN C C 29 178.048 178.048 176.594 1.454 18321 23165 1 18 . 1 1 29 29 GLN CA C 29 57.691 57.691 56.464 1.227 18321 23166 1 18 . 1 1 29 29 GLN CB C 29 27.293 27.293 28.959 -1.666 18321 23167 1 18 . 1 1 29 29 GLN H H 29 8.250 8.250 7.914 0.336 18321 23168 1 18 . 1 1 30 30 GLY N N 30 116.768 116.768 114.023 2.745 18321 23169 1 18 . 1 1 30 30 GLY C C 30 174.914 174.914 174.885 0.029 18321 23170 1 18 . 1 1 30 30 GLY CA C 30 45.491 45.491 46.034 -0.543 18321 23171 1 18 . 1 1 30 30 GLY H H 30 9.135 9.135 8.698 0.437 18321 23172 1 18 . 1 1 31 31 GLN N N 31 117.979 117.979 118.971 -0.992 18321 23173 1 18 . 1 1 31 31 GLN HA H 31 4.329 4.329 4.307 0.022 18321 23174 1 18 . 1 1 31 31 GLN C C 31 177.174 177.174 175.380 1.794 18321 23175 1 18 . 1 1 31 31 GLN CA C 31 53.910 53.910 56.787 -2.877 18321 23176 1 18 . 1 1 31 31 GLN CB C 31 29.574 29.574 30.368 -0.794 18321 23177 1 18 . 1 1 31 31 GLN H H 31 7.695 7.695 7.478 0.217 18321 23178 1 18 . 1 1 32 32 ARG N N 32 123.918 123.918 115.534 8.384 18321 23179 1 18 . 1 1 32 32 ARG HA H 32 3.940 3.940 4.097 -0.157 18321 23180 1 18 . 1 1 32 32 ARG C C 32 175.810 175.810 174.391 1.419 18321 23181 1 18 . 1 1 32 32 ARG CA C 32 56.770 56.770 56.211 0.559 18321 23182 1 18 . 1 1 32 32 ARG CB C 32 30.074 30.074 28.015 2.059 18321 23183 1 18 . 1 1 32 32 ARG H H 32 8.955 8.955 7.605 1.350 18321 23184 1 18 . 1 1 33 33 HIS N N 33 122.248 122.248 118.802 3.446 18321 23185 1 18 . 1 1 33 33 HIS HA H 33 4.627 4.627 4.443 0.184 18321 23186 1 18 . 1 1 33 33 HIS C C 33 177.089 177.089 175.287 1.802 18321 23187 1 18 . 1 1 33 33 HIS CA C 33 55.858 55.858 56.388 -0.529 18321 23188 1 18 . 1 1 33 33 HIS CB C 33 28.648 28.648 28.487 0.161 18321 23189 1 18 . 1 1 33 33 HIS H H 33 8.302 8.302 8.522 -0.220 18321 23190 1 18 . 1 1 34 34 GLY N N 34 109.518 109.518 109.333 0.185 18321 23191 1 18 . 1 1 34 34 GLY C C 34 176.730 176.730 173.987 2.743 18321 23192 1 18 . 1 1 34 34 GLY CA C 34 45.967 45.967 45.304 0.663 18321 23193 1 18 . 1 1 34 34 GLY H H 34 9.496 9.496 8.647 0.849 18321 23194 1 18 . 1 1 35 35 MET N N 35 125.193 125.193 122.894 2.299 18321 23195 1 18 . 1 1 35 35 MET HA H 35 5.750 5.750 5.284 0.466 18321 23196 1 18 . 1 1 35 35 MET C C 35 174.388 174.388 175.267 -0.879 18321 23197 1 18 . 1 1 35 35 MET CA C 35 55.762 55.762 56.259 -0.497 18321 23198 1 18 . 1 1 35 35 MET CB C 35 32.706 32.706 33.239 -0.533 18321 23199 1 18 . 1 1 35 35 MET H H 35 8.359 8.359 7.779 0.580 18321 23200 1 18 . 1 1 36 36 PHE N N 36 123.311 123.311 117.334 5.977 18321 23201 1 18 . 1 1 36 36 PHE HA H 36 5.985 5.985 5.774 0.211 18321 23202 1 18 . 1 1 36 36 PHE C C 36 172.140 172.140 173.072 -0.932 18321 23203 1 18 . 1 1 36 36 PHE CA C 36 55.755 55.755 55.244 0.511 18321 23204 1 18 . 1 1 36 36 PHE CB C 36 45.197 45.197 42.950 2.247 18321 23205 1 18 . 1 1 36 36 PHE H H 36 8.261 8.261 7.599 0.662 18321 23206 1 18 . 1 1 37 37 LEU N N 37 114.652 114.652 116.822 -2.170 18321 23207 1 18 . 1 1 37 37 LEU HA H 37 4.489 4.489 5.112 -0.623 18321 23208 1 18 . 1 1 37 37 LEU C C 37 174.033 174.033 174.757 -0.724 18321 23209 1 18 . 1 1 37 37 LEU CA C 37 55.382 55.382 54.436 0.946 18321 23210 1 18 . 1 1 37 37 LEU CB C 37 44.791 44.791 45.655 -0.864 18321 23211 1 18 . 1 1 37 37 LEU H H 37 9.292 9.292 8.965 0.327 18321 23212 1 18 . 1 1 38 38 VAL N N 38 121.009 121.009 122.623 -1.614 18321 23213 1 18 . 1 1 38 38 VAL HA H 38 5.504 5.504 4.939 0.565 18321 23214 1 18 . 1 1 38 38 VAL C C 38 173.581 173.581 175.339 -1.758 18321 23215 1 18 . 1 1 38 38 VAL CA C 38 61.316 61.316 61.750 -0.434 18321 23216 1 18 . 1 1 38 38 VAL CB C 38 33.302 33.302 33.807 -0.505 18321 23217 1 18 . 1 1 38 38 VAL H H 38 8.991 8.991 8.612 0.379 18321 23218 1 18 . 1 1 39 39 ARG N N 39 124.863 124.863 127.074 -2.211 18321 23219 1 18 . 1 1 39 39 ARG HA H 39 5.444 5.444 5.089 0.355 18321 23220 1 18 . 1 1 39 39 ARG C C 39 175.772 175.772 174.788 0.984 18321 23221 1 18 . 1 1 39 39 ARG CA C 39 52.558 52.558 53.553 -0.995 18321 23222 1 18 . 1 1 39 39 ARG CB C 39 34.980 34.980 33.331 1.649 18321 23223 1 18 . 1 1 39 39 ARG H H 39 9.569 9.569 8.430 1.139 18321 23224 1 18 . 1 1 40 40 ASP N N 40 122.330 122.330 120.091 2.239 18321 23225 1 18 . 1 1 40 40 ASP HA H 40 4.785 4.785 5.134 -0.349 18321 23226 1 18 . 1 1 40 40 ASP C C 40 176.332 176.332 175.842 0.490 18321 23227 1 18 . 1 1 40 40 ASP CA C 40 55.334 55.334 54.526 0.808 18321 23228 1 18 . 1 1 40 40 ASP CB C 40 40.650 40.650 42.864 -2.214 18321 23229 1 18 . 1 1 40 40 ASP H H 40 8.413 8.413 8.406 0.007 18321 23230 1 18 . 1 1 41 41 SER N N 41 114.363 114.363 121.056 -6.693 18321 23231 1 18 . 1 1 41 41 SER HA H 41 4.506 4.506 4.574 -0.068 18321 23232 1 18 . 1 1 41 41 SER CA C 41 57.525 57.525 57.852 -0.327 18321 23233 1 18 . 1 1 41 41 SER CB C 41 63.706 63.706 62.985 0.721 18321 23234 1 18 . 1 1 41 41 SER H H 41 7.791 7.791 8.516 -0.725 18321 23235 1 18 . 1 1 42 42 SER N N 42 126.932 126.932 125.799 1.133 18321 23236 1 18 . 1 1 42 42 SER HA H 42 4.410 4.410 4.423 -0.013 18321 23237 1 18 . 1 1 42 42 SER CA C 42 60.362 60.362 60.830 -0.468 18321 23238 1 18 . 1 1 42 42 SER CB C 42 63.707 63.707 63.041 0.666 18321 23239 1 18 . 1 1 42 42 SER H H 42 10.519 10.519 8.596 1.923 18321 23240 1 18 . 1 1 43 43 THR HA H 43 4.097 4.097 4.418 -0.321 18321 23241 1 18 . 1 1 43 43 THR CA C 43 64.722 64.722 61.877 2.845 18321 23242 1 18 . 1 1 43 43 THR CB C 43 69.439 69.439 69.682 -0.243 18321 23243 1 18 . 1 1 44 44 CYS HA H 44 5.100 5.100 4.817 0.283 18321 23244 1 18 . 1 1 44 44 CYS CA C 44 51.779 51.779 57.271 -5.492 18321 23245 1 18 . 1 1 44 44 CYS CB C 44 41.314 41.314 30.595 10.720 18321 23246 1 18 . 1 1 45 45 PRO HA H 45 4.278 4.278 4.462 -0.184 18321 23247 1 18 . 1 1 45 45 PRO C C 45 178.127 178.127 177.065 1.062 18321 23248 1 18 . 1 1 45 45 PRO CA C 45 64.151 64.151 63.969 0.181 18321 23249 1 18 . 1 1 45 45 PRO CB C 45 31.596 31.596 31.432 0.164 18321 23250 1 18 . 1 1 46 46 GLY N N 46 114.947 114.947 113.573 1.374 18321 23251 1 18 . 1 1 46 46 GLY C C 46 174.701 174.701 172.912 1.789 18321 23252 1 18 . 1 1 46 46 GLY CA C 46 45.225 45.225 44.913 0.312 18321 23253 1 18 . 1 1 46 46 GLY H H 46 8.812 8.812 8.725 0.087 18321 23254 1 18 . 1 1 47 47 ASP N N 47 120.862 120.862 118.444 2.418 18321 23255 1 18 . 1 1 47 47 ASP HA H 47 5.235 5.235 5.356 -0.121 18321 23256 1 18 . 1 1 47 47 ASP C C 47 176.480 176.480 174.545 1.935 18321 23257 1 18 . 1 1 47 47 ASP CA C 47 53.591 53.591 53.352 0.239 18321 23258 1 18 . 1 1 47 47 ASP CB C 47 41.707 41.707 45.289 -3.582 18321 23259 1 18 . 1 1 47 47 ASP H H 47 7.997 7.997 7.417 0.580 18321 23260 1 18 . 1 1 48 48 TYR N N 48 118.473 118.473 117.446 1.027 18321 23261 1 18 . 1 1 48 48 TYR HA H 48 5.431 5.431 5.368 0.063 18321 23262 1 18 . 1 1 48 48 TYR C C 48 173.783 173.783 175.495 -1.712 18321 23263 1 18 . 1 1 48 48 TYR CA C 48 56.891 56.891 55.907 0.984 18321 23264 1 18 . 1 1 48 48 TYR CB C 48 43.274 43.274 42.356 0.918 18321 23265 1 18 . 1 1 48 48 TYR H H 48 8.892 8.892 9.108 -0.216 18321 23266 1 18 . 1 1 49 49 VAL N N 49 119.105 119.105 120.008 -0.903 18321 23267 1 18 . 1 1 49 49 VAL HA H 49 4.800 4.800 4.631 0.169 18321 23268 1 18 . 1 1 49 49 VAL C C 49 174.397 174.397 174.897 -0.500 18321 23269 1 18 . 1 1 49 49 VAL CA C 49 61.439 61.439 61.874 -0.435 18321 23270 1 18 . 1 1 49 49 VAL CB C 49 35.388 35.388 33.467 1.921 18321 23271 1 18 . 1 1 49 49 VAL H H 49 9.661 9.661 8.683 0.978 18321 23272 1 18 . 1 1 50 50 LEU N N 50 129.599 129.599 131.595 -1.996 18321 23273 1 18 . 1 1 50 50 LEU HA H 50 5.033 5.033 5.168 -0.135 18321 23274 1 18 . 1 1 50 50 LEU C C 50 175.001 175.001 175.479 -0.478 18321 23275 1 18 . 1 1 50 50 LEU CA C 50 53.352 53.352 53.510 -0.158 18321 23276 1 18 . 1 1 50 50 LEU CB C 50 44.062 44.062 42.424 1.638 18321 23277 1 18 . 1 1 50 50 LEU H H 50 9.405 9.405 9.368 0.037 18321 23278 1 18 . 1 1 51 51 SER N N 51 126.895 126.895 124.414 2.481 18321 23279 1 18 . 1 1 51 51 SER HA H 51 5.731 5.731 4.987 0.744 18321 23280 1 18 . 1 1 51 51 SER C C 51 173.094 173.094 173.765 -0.671 18321 23281 1 18 . 1 1 51 51 SER CA C 51 58.834 58.834 57.294 1.540 18321 23282 1 18 . 1 1 51 51 SER CB C 51 64.977 64.977 63.465 1.512 18321 23283 1 18 . 1 1 51 51 SER H H 51 9.094 9.094 9.167 -0.073 18321 23284 1 18 . 1 1 52 52 VAL N N 52 121.777 121.777 126.065 -4.288 18321 23285 1 18 . 1 1 52 52 VAL HA H 52 5.066 5.066 4.533 0.533 18321 23286 1 18 . 1 1 52 52 VAL C C 52 174.573 174.573 174.705 -0.132 18321 23287 1 18 . 1 1 52 52 VAL CA C 52 59.535 59.535 60.859 -1.324 18321 23288 1 18 . 1 1 52 52 VAL CB C 52 36.834 36.834 34.996 1.838 18321 23289 1 18 . 1 1 52 52 VAL H H 52 8.816 8.816 8.986 -0.170 18321 23290 1 18 . 1 1 53 53 SER N N 53 120.489 120.489 121.448 -0.959 18321 23291 1 18 . 1 1 53 53 SER HA H 53 4.811 4.811 4.675 0.136 18321 23292 1 18 . 1 1 53 53 SER C C 53 174.065 174.065 172.456 1.609 18321 23293 1 18 . 1 1 53 53 SER CA C 53 57.496 57.496 57.254 0.242 18321 23294 1 18 . 1 1 53 53 SER CB C 53 62.623 62.623 63.033 -0.410 18321 23295 1 18 . 1 1 53 53 SER H H 53 8.780 8.780 9.060 -0.280 18321 23296 1 18 . 1 1 54 54 GLU N N 54 132.020 132.020 126.892 5.128 18321 23297 1 18 . 1 1 54 54 GLU HA H 54 4.250 4.250 4.589 -0.339 18321 23298 1 18 . 1 1 54 54 GLU C C 54 175.387 175.387 175.188 0.199 18321 23299 1 18 . 1 1 54 54 GLU CA C 54 56.999 56.999 55.219 1.780 18321 23300 1 18 . 1 1 54 54 GLU CB C 54 32.556 32.556 33.345 -0.789 18321 23301 1 18 . 1 1 54 54 GLU H H 54 8.472 8.472 7.609 0.863 18321 23302 1 18 . 1 1 55 55 ASN N N 55 126.517 126.517 119.219 7.298 18321 23303 1 18 . 1 1 55 55 ASN HA H 55 4.220 4.220 4.275 -0.055 18321 23304 1 18 . 1 1 55 55 ASN C C 55 174.546 174.546 174.820 -0.274 18321 23305 1 18 . 1 1 55 55 ASN CA C 55 54.770 54.770 53.980 0.790 18321 23306 1 18 . 1 1 55 55 ASN CB C 55 37.314 37.314 36.763 0.551 18321 23307 1 18 . 1 1 55 55 ASN H H 55 8.853 8.853 8.789 0.064 18321 23308 1 18 . 1 1 56 56 SER N N 56 112.009 112.009 109.921 2.088 18321 23309 1 18 . 1 1 56 56 SER HA H 56 4.334 4.334 4.011 0.323 18321 23310 1 18 . 1 1 56 56 SER C C 56 173.354 173.354 172.894 0.460 18321 23311 1 18 . 1 1 56 56 SER CA C 56 59.966 59.966 59.836 0.130 18321 23312 1 18 . 1 1 56 56 SER CB C 56 62.242 62.242 62.451 -0.209 18321 23313 1 18 . 1 1 56 56 SER H H 56 10.418 10.418 8.302 2.116 18321 23314 1 18 . 1 1 57 57 ARG N N 57 121.764 121.764 116.183 5.581 18321 23315 1 18 . 1 1 57 57 ARG HA H 57 5.167 5.167 4.427 0.740 18321 23316 1 18 . 1 1 57 57 ARG C C 57 174.983 174.983 174.620 0.363 18321 23317 1 18 . 1 1 57 57 ARG CA C 57 54.550 54.550 55.225 -0.675 18321 23318 1 18 . 1 1 57 57 ARG CB C 57 31.886 31.886 30.917 0.969 18321 23319 1 18 . 1 1 57 57 ARG H H 57 8.097 8.097 7.284 0.813 18321 23320 1 18 . 1 1 58 58 VAL N N 58 121.866 121.866 123.802 -1.936 18321 23321 1 18 . 1 1 58 58 VAL HA H 58 4.768 4.768 4.631 0.137 18321 23322 1 18 . 1 1 58 58 VAL C C 58 175.388 175.388 175.897 -0.509 18321 23323 1 18 . 1 1 58 58 VAL CA C 58 61.818 61.818 62.799 -0.981 18321 23324 1 18 . 1 1 58 58 VAL CB C 58 34.135 34.135 30.866 3.269 18321 23325 1 18 . 1 1 58 58 VAL H H 58 8.081 8.081 8.184 -0.103 18321 23326 1 18 . 1 1 59 59 SER N N 59 124.445 124.445 122.426 2.019 18321 23327 1 18 . 1 1 59 59 SER HA H 59 4.462 4.462 4.488 -0.026 18321 23328 1 18 . 1 1 59 59 SER C C 59 172.185 172.185 173.257 -1.072 18321 23329 1 18 . 1 1 59 59 SER CA C 59 56.629 56.629 57.701 -1.072 18321 23330 1 18 . 1 1 59 59 SER CB C 59 66.218 66.218 63.709 2.509 18321 23331 1 18 . 1 1 59 59 SER H H 59 9.082 9.082 8.241 0.841 18321 23332 1 18 . 1 1 60 60 HIS N N 60 121.224 121.224 126.205 -4.981 18321 23333 1 18 . 1 1 60 60 HIS HA H 60 4.885 4.885 4.730 0.155 18321 23334 1 18 . 1 1 60 60 HIS C C 60 174.674 174.674 174.431 0.243 18321 23335 1 18 . 1 1 60 60 HIS CA C 60 54.900 54.900 55.315 -0.415 18321 23336 1 18 . 1 1 60 60 HIS CB C 60 32.331 32.331 29.660 2.671 18321 23337 1 18 . 1 1 60 60 HIS H H 60 8.331 8.331 8.780 -0.449 18321 23338 1 18 . 1 1 61 61 TYR N N 61 124.780 124.780 125.082 -0.302 18321 23339 1 18 . 1 1 61 61 TYR HA H 61 4.655 4.655 4.620 0.035 18321 23340 1 18 . 1 1 61 61 TYR CA C 61 57.409 57.409 56.658 0.751 18321 23341 1 18 . 1 1 61 61 TYR CB C 61 39.785 39.785 38.575 1.210 18321 23342 1 18 . 1 1 61 61 TYR H H 61 9.273 9.273 9.305 -0.032 18321 23343 1 18 . 1 1 62 62 ILE HA H 62 4.298 4.298 4.438 -0.140 18321 23344 1 18 . 1 1 62 62 ILE C C 62 174.817 174.817 175.794 -0.977 18321 23345 1 18 . 1 1 62 62 ILE CA C 62 61.908 61.908 59.722 2.186 18321 23346 1 18 . 1 1 62 62 ILE CB C 62 38.321 38.321 37.605 0.716 18321 23347 1 18 . 1 1 63 63 ILE N N 63 128.552 128.552 129.834 -1.282 18321 23348 1 18 . 1 1 63 63 ILE HA H 63 4.788 4.788 4.587 0.201 18321 23349 1 18 . 1 1 63 63 ILE C C 63 175.982 175.982 174.728 1.254 18321 23350 1 18 . 1 1 63 63 ILE CA C 63 59.629 59.629 60.243 -0.614 18321 23351 1 18 . 1 1 63 63 ILE CB C 63 39.747 39.747 38.089 1.658 18321 23352 1 18 . 1 1 63 63 ILE H H 63 9.155 9.155 8.931 0.224 18321 23353 1 18 . 1 1 64 64 ASN N N 64 123.240 123.240 127.453 -4.213 18321 23354 1 18 . 1 1 64 64 ASN HA H 64 4.857 4.857 5.472 -0.615 18321 23355 1 18 . 1 1 64 64 ASN C C 64 175.324 175.324 175.272 0.052 18321 23356 1 18 . 1 1 64 64 ASN CA C 64 53.736 53.736 53.159 0.577 18321 23357 1 18 . 1 1 64 64 ASN CB C 64 41.531 41.531 40.208 1.323 18321 23358 1 18 . 1 1 64 64 ASN H H 64 9.379 9.379 8.719 0.660 18321 23359 1 18 . 1 1 65 65 SER N N 65 121.157 121.157 118.504 2.653 18321 23360 1 18 . 1 1 65 65 SER HA H 65 4.548 4.548 4.628 -0.080 18321 23361 1 18 . 1 1 65 65 SER C C 65 174.328 174.328 174.465 -0.137 18321 23362 1 18 . 1 1 65 65 SER CA C 65 58.306 58.306 58.245 0.062 18321 23363 1 18 . 1 1 65 65 SER CB C 65 62.878 62.878 63.139 -0.261 18321 23364 1 18 . 1 1 65 65 SER H H 65 9.195 9.195 8.027 1.168 18321 23365 1 18 . 1 1 66 66 LEU N N 66 127.417 127.417 128.733 -1.316 18321 23366 1 18 . 1 1 66 66 LEU HA H 66 4.605 4.605 4.635 -0.030 18321 23367 1 18 . 1 1 66 66 LEU CA C 66 52.888 52.888 52.781 0.107 18321 23368 1 18 . 1 1 66 66 LEU CB C 66 41.799 41.799 41.969 -0.170 18321 23369 1 18 . 1 1 66 66 LEU H H 66 8.143 8.143 8.554 -0.411 18321 23370 1 18 . 1 1 68 68 ASN HA H 68 4.386 4.386 4.617 -0.231 18321 23371 1 18 . 1 1 68 68 ASN C C 68 174.487 174.487 175.401 -0.914 18321 23372 1 18 . 1 1 68 68 ASN CA C 68 53.365 53.365 53.210 0.155 18321 23373 1 18 . 1 1 68 68 ASN CB C 68 36.778 36.778 37.761 -0.984 18321 23374 1 18 . 1 1 69 69 ARG N N 69 111.329 111.329 113.998 -2.669 18321 23375 1 18 . 1 1 69 69 ARG HA H 69 3.876 3.876 3.853 0.024 18321 23376 1 18 . 1 1 69 69 ARG CA C 69 57.393 57.393 57.064 0.329 18321 23377 1 18 . 1 1 69 69 ARG CB C 69 26.665 26.665 26.759 -0.094 18321 23378 1 18 . 1 1 69 69 ARG H H 69 8.191 8.191 7.958 0.233 18321 23379 1 18 . 1 1 70 70 ARG N N 70 116.120 116.120 113.864 2.256 18321 23380 1 18 . 1 1 70 70 ARG HA H 70 4.556 4.556 5.058 -0.502 18321 23381 1 18 . 1 1 70 70 ARG C C 70 174.882 174.882 173.998 0.884 18321 23382 1 18 . 1 1 70 70 ARG CA C 70 55.509 55.509 53.566 1.943 18321 23383 1 18 . 1 1 70 70 ARG CB C 70 31.771 31.771 33.029 -1.258 18321 23384 1 18 . 1 1 70 70 ARG H H 70 6.667 6.667 7.198 -0.531 18321 23385 1 18 . 1 1 71 71 PHE N N 71 116.313 116.313 118.612 -2.299 18321 23386 1 18 . 1 1 71 71 PHE HA H 71 5.540 5.540 5.628 -0.088 18321 23387 1 18 . 1 1 71 71 PHE C C 71 174.391 174.391 175.430 -1.039 18321 23388 1 18 . 1 1 71 71 PHE CA C 71 57.528 57.528 56.032 1.496 18321 23389 1 18 . 1 1 71 71 PHE CB C 71 44.115 44.115 41.854 2.261 18321 23390 1 18 . 1 1 71 71 PHE H H 71 8.700 8.700 8.234 0.466 18321 23391 1 18 . 1 1 72 72 LYS N N 72 122.770 122.770 126.725 -3.955 18321 23392 1 18 . 1 1 72 72 LYS HA H 72 5.483 5.483 5.082 0.401 18321 23393 1 18 . 1 1 72 72 LYS C C 72 173.923 173.923 175.796 -1.873 18321 23394 1 18 . 1 1 72 72 LYS CA C 72 54.855 54.855 54.827 0.028 18321 23395 1 18 . 1 1 72 72 LYS CB C 72 37.710 37.710 34.352 3.358 18321 23396 1 18 . 1 1 72 72 LYS H H 72 9.138 9.138 8.844 0.294 18321 23397 1 18 . 1 1 73 73 ILE N N 73 124.576 124.576 128.845 -4.269 18321 23398 1 18 . 1 1 73 73 ILE HA H 73 4.955 4.955 4.911 0.044 18321 23399 1 18 . 1 1 73 73 ILE C C 73 175.728 175.728 176.645 -0.917 18321 23400 1 18 . 1 1 73 73 ILE CA C 73 58.935 58.935 60.397 -1.462 18321 23401 1 18 . 1 1 73 73 ILE CB C 73 40.965 40.965 39.045 1.919 18321 23402 1 18 . 1 1 73 73 ILE H H 73 8.826 8.826 8.582 0.244 18321 23403 1 18 . 1 1 74 74 GLY N N 74 118.718 118.718 119.316 -0.598 18321 23404 1 18 . 1 1 74 74 GLY C C 74 174.436 174.436 173.960 0.476 18321 23405 1 18 . 1 1 74 74 GLY CA C 74 47.401 47.401 45.848 1.553 18321 23406 1 18 . 1 1 74 74 GLY H H 74 9.317 9.317 9.472 -0.155 18321 23407 1 18 . 1 1 75 75 ASP N N 75 125.691 125.691 115.156 10.535 18321 23408 1 18 . 1 1 75 75 ASP HA H 75 4.713 4.713 4.207 0.506 18321 23409 1 18 . 1 1 75 75 ASP C C 75 175.841 175.841 175.241 0.600 18321 23410 1 18 . 1 1 75 75 ASP CA C 75 53.815 53.815 55.846 -2.031 18321 23411 1 18 . 1 1 75 75 ASP CB C 75 41.288 41.288 40.970 0.318 18321 23412 1 18 . 1 1 75 75 ASP H H 75 8.665 8.665 8.180 0.485 18321 23413 1 18 . 1 1 76 76 GLN N N 76 120.368 120.368 119.412 0.956 18321 23414 1 18 . 1 1 76 76 GLN C C 76 173.630 173.630 175.248 -1.618 18321 23415 1 18 . 1 1 76 76 GLN CA C 76 54.254 54.254 54.433 -0.179 18321 23416 1 18 . 1 1 76 76 GLN CB C 76 31.248 31.248 29.299 1.949 18321 23417 1 18 . 1 1 76 76 GLN H H 76 8.289 8.289 7.787 0.502 18321 23418 1 18 . 1 1 77 77 GLU N N 77 120.435 120.435 123.921 -3.486 18321 23419 1 18 . 1 1 77 77 GLU C C 77 175.484 175.484 175.239 0.245 18321 23420 1 18 . 1 1 77 77 GLU CA C 77 54.203 54.203 56.497 -2.294 18321 23421 1 18 . 1 1 77 77 GLU CB C 77 33.141 33.141 30.191 2.950 18321 23422 1 18 . 1 1 77 77 GLU H H 77 7.732 7.732 8.428 -0.696 18321 23423 1 18 . 1 1 78 78 PHE N N 78 117.911 117.911 124.754 -6.843 18321 23424 1 18 . 1 1 78 78 PHE HA H 78 4.659 4.659 4.687 -0.028 18321 23425 1 18 . 1 1 78 78 PHE C C 78 175.673 175.673 176.206 -0.533 18321 23426 1 18 . 1 1 78 78 PHE CA C 78 57.160 57.160 56.655 0.505 18321 23427 1 18 . 1 1 78 78 PHE CB C 78 45.405 45.405 41.347 4.058 18321 23428 1 18 . 1 1 78 78 PHE H H 78 9.235 9.235 8.233 1.002 18321 23429 1 18 . 1 1 79 79 ASP N N 79 119.296 119.296 118.918 0.378 18321 23430 1 18 . 1 1 79 79 ASP HA H 79 4.462 4.462 4.327 0.135 18321 23431 1 18 . 1 1 79 79 ASP C C 79 174.482 174.482 175.641 -1.159 18321 23432 1 18 . 1 1 79 79 ASP CA C 79 56.629 56.629 57.274 -0.645 18321 23433 1 18 . 1 1 79 79 ASP CB C 79 41.697 41.697 40.719 0.977 18321 23434 1 18 . 1 1 79 79 ASP H H 79 9.187 9.187 8.774 0.413 18321 23435 1 18 . 1 1 80 80 HIS N N 80 107.631 107.631 110.268 -2.637 18321 23436 1 18 . 1 1 80 80 HIS HA H 80 5.022 5.022 4.999 0.023 18321 23437 1 18 . 1 1 80 80 HIS C C 80 174.626 174.626 175.354 -0.728 18321 23438 1 18 . 1 1 80 80 HIS CA C 80 54.223 54.223 55.203 -0.980 18321 23439 1 18 . 1 1 80 80 HIS CB C 80 32.205 32.205 31.021 1.184 18321 23440 1 18 . 1 1 80 80 HIS H H 80 7.200 7.200 7.079 0.121 18321 23441 1 18 . 1 1 81 81 LEU N N 81 120.710 120.710 121.557 -0.847 18321 23442 1 18 . 1 1 81 81 LEU HA H 81 3.804 3.804 4.201 -0.397 18321 23443 1 18 . 1 1 81 81 LEU CA C 81 58.709 58.709 60.031 -1.322 18321 23444 1 18 . 1 1 81 81 LEU CB C 81 39.646 39.646 39.972 -0.326 18321 23445 1 18 . 1 1 81 81 LEU H H 81 8.886 8.886 9.124 -0.238 18321 23446 1 18 . 1 1 82 82 PRO HA H 82 4.020 4.020 4.402 -0.382 18321 23447 1 18 . 1 1 82 82 PRO C C 82 175.619 175.619 177.449 -1.830 18321 23448 1 18 . 1 1 82 82 PRO CA C 82 67.025 67.025 64.655 2.370 18321 23449 1 18 . 1 1 82 82 PRO CB C 82 30.962 30.962 30.620 0.342 18321 23450 1 18 . 1 1 83 83 ALA N N 83 124.281 124.281 121.536 2.745 18321 23451 1 18 . 1 1 83 83 ALA HA H 83 4.019 4.019 4.311 -0.292 18321 23452 1 18 . 1 1 83 83 ALA C C 83 179.709 179.709 178.592 1.117 18321 23453 1 18 . 1 1 83 83 ALA CA C 83 54.985 54.985 54.379 0.606 18321 23454 1 18 . 1 1 83 83 ALA CB C 83 18.425 18.425 18.787 -0.362 18321 23455 1 18 . 1 1 83 83 ALA H H 83 8.527 8.527 7.946 0.581 18321 23456 1 18 . 1 1 84 84 LEU N N 84 122.960 122.960 117.796 5.164 18321 23457 1 18 . 1 1 84 84 LEU HA H 84 1.917 1.917 3.143 -1.226 18321 23458 1 18 . 1 1 84 84 LEU C C 84 177.652 177.652 178.119 -0.467 18321 23459 1 18 . 1 1 84 84 LEU CA C 84 58.261 58.261 57.240 1.021 18321 23460 1 18 . 1 1 84 84 LEU CB C 84 42.544 42.544 41.039 1.505 18321 23461 1 18 . 1 1 84 84 LEU H H 84 6.982 6.982 7.383 -0.401 18321 23462 1 18 . 1 1 85 85 LEU N N 85 117.940 117.940 118.050 -0.110 18321 23463 1 18 . 1 1 85 85 LEU HA H 85 3.463 3.463 3.837 -0.374 18321 23464 1 18 . 1 1 85 85 LEU C C 85 178.809 178.809 177.988 0.821 18321 23465 1 18 . 1 1 85 85 LEU CA C 85 57.522 57.522 56.964 0.558 18321 23466 1 18 . 1 1 85 85 LEU CB C 85 41.242 41.242 41.337 -0.095 18321 23467 1 18 . 1 1 85 85 LEU H H 85 7.773 7.773 7.397 0.376 18321 23468 1 18 . 1 1 86 86 GLU N N 86 115.762 115.762 117.702 -1.940 18321 23469 1 18 . 1 1 86 86 GLU HA H 86 3.540 3.540 4.042 -0.502 18321 23470 1 18 . 1 1 86 86 GLU C C 86 180.228 180.228 178.563 1.665 18321 23471 1 18 . 1 1 86 86 GLU CA C 86 58.943 58.943 58.094 0.849 18321 23472 1 18 . 1 1 86 86 GLU CB C 86 29.561 29.561 29.569 -0.008 18321 23473 1 18 . 1 1 86 86 GLU H H 86 8.300 8.300 7.324 0.976 18321 23474 1 18 . 1 1 87 87 PHE N N 87 121.135 121.135 122.022 -0.887 18321 23475 1 18 . 1 1 87 87 PHE HA H 87 4.122 4.122 4.177 -0.055 18321 23476 1 18 . 1 1 87 87 PHE C C 87 179.497 179.497 177.188 2.309 18321 23477 1 18 . 1 1 87 87 PHE CA C 87 62.090 62.090 60.540 1.550 18321 23478 1 18 . 1 1 87 87 PHE CB C 87 40.103 40.103 39.303 0.800 18321 23479 1 18 . 1 1 87 87 PHE H H 87 7.717 7.717 7.485 0.232 18321 23480 1 18 . 1 1 88 88 TYR N N 88 116.579 116.579 116.844 -0.265 18321 23481 1 18 . 1 1 88 88 TYR HA H 88 4.933 4.933 4.298 0.635 18321 23482 1 18 . 1 1 88 88 TYR C C 88 174.799 174.799 176.712 -1.913 18321 23483 1 18 . 1 1 88 88 TYR CA C 88 61.333 61.333 58.697 2.636 18321 23484 1 18 . 1 1 88 88 TYR CB C 88 36.539 36.539 37.047 -0.507 18321 23485 1 18 . 1 1 88 88 TYR H H 88 7.478 7.478 7.945 -0.467 18321 23486 1 18 . 1 1 89 89 LYS N N 89 117.737 117.737 119.046 -1.309 18321 23487 1 18 . 1 1 89 89 LYS HA H 89 4.466 4.466 4.022 0.444 18321 23488 1 18 . 1 1 89 89 LYS C C 89 178.417 178.417 176.982 1.435 18321 23489 1 18 . 1 1 89 89 LYS CA C 89 59.486 59.486 58.372 1.114 18321 23490 1 18 . 1 1 89 89 LYS CB C 89 34.523 34.523 32.583 1.940 18321 23491 1 18 . 1 1 89 89 LYS H H 89 7.505 7.505 7.461 0.044 18321 23492 1 18 . 1 1 90 90 ILE N N 90 110.972 110.972 108.858 2.114 18321 23493 1 18 . 1 1 90 90 ILE HA H 90 4.181 4.181 4.207 -0.026 18321 23494 1 18 . 1 1 90 90 ILE C C 90 174.571 174.571 174.737 -0.166 18321 23495 1 18 . 1 1 90 90 ILE CA C 90 60.516 60.516 59.823 0.693 18321 23496 1 18 . 1 1 90 90 ILE CB C 90 39.979 39.979 38.374 1.605 18321 23497 1 18 . 1 1 90 90 ILE H H 90 6.710 6.710 7.114 -0.404 18321 23498 1 18 . 1 1 91 91 HIS N N 91 119.479 119.479 119.003 0.476 18321 23499 1 18 . 1 1 91 91 HIS HA H 91 4.357 4.357 4.485 -0.128 18321 23500 1 18 . 1 1 91 91 HIS C C 91 172.751 172.751 175.128 -2.377 18321 23501 1 18 . 1 1 91 91 HIS CA C 91 55.066 55.066 57.293 -2.227 18321 23502 1 18 . 1 1 91 91 HIS CB C 91 29.756 29.756 32.545 -2.789 18321 23503 1 18 . 1 1 91 91 HIS H H 91 7.460 7.460 7.118 0.342 18321 23504 1 18 . 1 1 92 92 TYR N N 92 117.642 117.642 114.687 2.955 18321 23505 1 18 . 1 1 92 92 TYR HA H 92 4.131 4.131 4.406 -0.275 18321 23506 1 18 . 1 1 92 92 TYR C C 92 177.348 177.348 175.401 1.947 18321 23507 1 18 . 1 1 92 92 TYR CA C 92 58.627 58.627 58.618 0.009 18321 23508 1 18 . 1 1 92 92 TYR CB C 92 39.481 39.481 36.419 3.062 18321 23509 1 18 . 1 1 92 92 TYR H H 92 8.067 8.067 7.382 0.685 18321 23510 1 18 . 1 1 93 93 LEU N N 93 123.560 123.560 121.464 2.096 18321 23511 1 18 . 1 1 93 93 LEU HA H 93 4.104 4.104 4.269 -0.165 18321 23512 1 18 . 1 1 93 93 LEU C C 93 175.610 175.610 176.892 -1.282 18321 23513 1 18 . 1 1 93 93 LEU CA C 93 56.381 56.381 55.683 0.698 18321 23514 1 18 . 1 1 93 93 LEU CB C 93 38.896 38.896 41.860 -2.964 18321 23515 1 18 . 1 1 93 93 LEU H H 93 7.907 7.907 8.167 -0.260 18321 23516 1 18 . 1 1 94 94 ASP N N 94 118.194 118.194 115.899 2.295 18321 23517 1 18 . 1 1 94 94 ASP HA H 94 4.940 4.940 4.892 0.048 18321 23518 1 18 . 1 1 94 94 ASP C C 94 176.123 176.123 176.184 -0.061 18321 23519 1 18 . 1 1 94 94 ASP CA C 94 56.235 56.235 55.563 0.672 18321 23520 1 18 . 1 1 94 94 ASP CB C 94 42.078 42.078 43.064 -0.986 18321 23521 1 18 . 1 1 94 94 ASP H H 94 8.640 8.640 7.607 1.033 18321 23522 1 18 . 1 1 95 95 THR N N 95 105.073 105.073 109.024 -3.951 18321 23523 1 18 . 1 1 95 95 THR HA H 95 4.318 4.318 4.246 0.072 18321 23524 1 18 . 1 1 95 95 THR C C 95 174.685 174.685 172.751 1.934 18321 23525 1 18 . 1 1 95 95 THR CA C 95 60.756 60.756 63.231 -2.475 18321 23526 1 18 . 1 1 95 95 THR CB C 95 71.058 71.058 69.198 1.860 18321 23527 1 18 . 1 1 95 95 THR H H 95 8.576 8.576 8.202 0.374 18321 23528 1 18 . 1 1 96 96 THR N N 96 116.817 116.817 118.511 -1.694 18321 23529 1 18 . 1 1 96 96 THR HA H 96 5.129 5.129 4.847 0.282 18321 23530 1 18 . 1 1 96 96 THR C C 96 172.464 172.464 173.432 -0.968 18321 23531 1 18 . 1 1 96 96 THR CA C 96 60.762 60.762 61.435 -0.673 18321 23532 1 18 . 1 1 96 96 THR CB C 96 71.425 71.425 71.431 -0.006 18321 23533 1 18 . 1 1 96 96 THR H H 96 8.205 8.205 7.575 0.630 18321 23534 1 18 . 1 1 97 97 THR N N 97 114.324 114.324 114.052 0.272 18321 23535 1 18 . 1 1 97 97 THR HA H 97 5.128 5.128 4.403 0.725 18321 23536 1 18 . 1 1 97 97 THR C C 97 175.480 175.480 174.548 0.932 18321 23537 1 18 . 1 1 97 97 THR CA C 97 60.233 60.233 59.491 0.742 18321 23538 1 18 . 1 1 97 97 THR CB C 97 70.415 70.415 70.268 0.147 18321 23539 1 18 . 1 1 97 97 THR H H 97 7.128 7.128 8.284 -1.156 18321 23540 1 18 . 1 1 98 98 LEU N N 98 116.674 116.674 122.310 -5.636 18321 23541 1 18 . 1 1 98 98 LEU HA H 98 4.075 4.075 3.939 0.136 18321 23542 1 18 . 1 1 98 98 LEU C C 98 177.892 177.892 176.622 1.270 18321 23543 1 18 . 1 1 98 98 LEU CA C 98 59.597 59.597 55.404 4.192 18321 23544 1 18 . 1 1 98 98 LEU CB C 98 41.172 41.172 40.265 0.907 18321 23545 1 18 . 1 1 98 98 LEU H H 98 8.743 8.743 8.171 0.572 18321 23546 1 18 . 1 1 99 99 ILE N N 99 122.988 122.988 122.091 0.897 18321 23547 1 18 . 1 1 99 99 ILE HA H 99 4.415 4.415 4.123 0.292 18321 23548 1 18 . 1 1 99 99 ILE C C 99 175.055 175.055 176.025 -0.970 18321 23549 1 18 . 1 1 99 99 ILE CA C 99 62.183 62.183 61.600 0.583 18321 23550 1 18 . 1 1 99 99 ILE CB C 99 40.252 40.252 38.731 1.521 18321 23551 1 18 . 1 1 99 99 ILE H H 99 8.998 8.998 8.222 0.776 18321 23552 1 18 . 1 1 100 100 GLU N N 100 114.067 114.067 112.962 1.105 18321 23553 1 18 . 1 1 100 100 GLU CA C 100 52.910 52.910 53.892 -0.982 18321 23554 1 18 . 1 1 100 100 GLU CB C 100 31.155 31.155 29.995 1.160 18321 23555 1 18 . 1 1 100 100 GLU H H 100 7.332 7.332 7.673 -0.341 18321 23556 1 18 . 1 1 101 101 PRO HA H 101 4.952 4.952 3.774 1.178 18321 23557 1 18 . 1 1 101 101 PRO C C 101 175.976 175.976 176.423 -0.447 18321 23558 1 18 . 1 1 101 101 PRO CA C 101 53.312 53.312 61.965 -8.653 18321 23559 1 18 . 1 1 101 101 PRO CB C 101 31.598 31.598 32.228 -0.630 18321 23560 1 18 . 1 1 102 102 ALA N N 102 125.968 125.968 122.392 3.576 18321 23561 1 18 . 1 1 102 102 ALA HA H 102 4.516 4.516 4.290 0.226 18321 23562 1 18 . 1 1 102 102 ALA CA C 102 49.852 49.852 50.672 -0.820 18321 23563 1 18 . 1 1 102 102 ALA CB C 102 17.766 17.766 17.931 -0.165 18321 23564 1 18 . 1 1 102 102 ALA H H 102 8.232 8.232 8.082 0.150 18321 23565 1 18 . 1 1 103 103 PRO HA H 103 4.283 4.283 4.257 0.026 18321 23566 1 18 . 1 1 103 103 PRO CA C 103 62.435 62.435 63.690 -1.255 18321 23567 1 18 . 1 1 103 103 PRO CB C 103 32.145 32.145 30.739 1.406 18321 23568 1 18 . 1 1 104 104 ARG HA H 104 4.004 4.004 4.057 -0.053 18321 23569 1 18 . 1 1 104 104 ARG CA C 104 56.660 56.660 58.149 -1.489 18321 23570 1 18 . 1 1 106 106 PRO C C 106 174.587 174.587 175.619 -1.032 18321 23571 1 18 . 1 1 106 106 PRO CA C 106 57.867 57.867 62.932 -5.065 18321 23572 1 18 . 1 1 106 106 PRO CB C 106 31.942 31.942 31.468 0.474 18321 23573 1 18 . 1 1 107 107 SER N N 107 121.280 121.280 121.934 -0.654 18321 23574 1 18 . 1 1 107 107 SER CA C 107 61.772 61.772 55.953 5.819 18321 23575 1 18 . 1 1 107 107 SER CB C 107 63.234 63.234 63.450 -0.216 18321 23576 1 18 . 1 1 107 107 SER H H 107 8.132 8.132 8.217 -0.085 18321 23577 1 18 . 1 1 109 109 PRO C C 109 177.129 177.129 176.125 1.004 18321 23578 1 18 . 1 1 109 109 PRO CA C 109 62.638 62.638 62.892 -0.254 18321 23579 1 18 . 1 1 109 109 PRO CB C 109 30.970 30.970 30.677 0.293 18321 23580 1 18 . 1 1 110 110 MET N N 110 120.772 120.772 121.319 -0.547 18321 23581 1 18 . 1 1 110 110 MET C C 110 176.892 176.892 176.187 0.705 18321 23582 1 18 . 1 1 110 110 MET CA C 110 55.310 55.310 56.733 -1.423 18321 23583 1 18 . 1 1 110 110 MET CB C 110 32.202 32.202 33.319 -1.117 18321 23584 1 18 . 1 1 110 110 MET H H 110 8.430 8.430 8.340 0.090 18321 23585 1 18 . 1 1 111 111 GLY N N 111 110.158 110.158 106.407 3.751 18321 23586 1 18 . 1 1 111 111 GLY C C 111 177.430 177.430 172.813 4.617 18321 23587 1 18 . 1 1 111 111 GLY CA C 111 44.951 44.951 44.460 0.491 18321 23588 1 18 . 1 1 111 111 GLY H H 111 8.384 8.384 7.712 0.672 18321 23589 1 18 . 1 1 112 112 SER N N 112 116.762 116.762 116.662 0.100 18321 23590 1 18 . 1 1 112 112 SER CA C 112 55.948 55.948 58.722 -2.774 18321 23591 1 18 . 1 1 112 112 SER CB C 112 62.745 62.745 63.476 -0.731 18321 23592 1 18 . 1 1 112 112 SER H H 112 8.161 8.161 8.274 -0.113 18321 23593 1 18 . 1 1 113 113 VAL C C 113 176.083 176.083 176.883 -0.800 18321 23594 1 18 . 1 1 114 114 SER N N 114 119.151 119.151 116.522 2.629 18321 23595 1 18 . 1 1 114 114 SER C C 114 173.638 173.638 174.215 -0.577 18321 23596 1 18 . 1 1 114 114 SER CA C 114 58.005 58.005 57.979 0.026 18321 23597 1 18 . 1 1 114 114 SER CB C 114 63.169 63.169 64.122 -0.953 18321 23598 1 18 . 1 1 114 114 SER H H 114 8.319 8.319 8.034 0.285 18321 23599 1 18 . 1 1 115 115 ALA N N 115 126.914 126.914 126.214 0.700 18321 23600 1 18 . 1 1 115 115 ALA CA C 115 51.561 51.561 52.046 -0.485 18321 23601 1 18 . 1 1 115 115 ALA CB C 115 17.714 17.714 17.480 0.234 18321 23602 1 18 . 1 1 115 115 ALA H H 115 8.197 8.197 8.440 -0.243 18321 23603 1 18 . 1 1 119 119 PRO C C 119 177.065 177.065 175.716 1.349 18321 23604 1 18 . 1 1 120 120 THR N N 120 113.976 113.976 116.651 -2.675 18321 23605 1 18 . 1 1 120 120 THR C C 120 174.461 174.461 172.495 1.966 18321 23606 1 18 . 1 1 120 120 THR CA C 120 61.215 61.215 60.333 0.882 18321 23607 1 18 . 1 1 120 120 THR CB C 120 69.508 69.508 71.711 -2.203 18321 23608 1 18 . 1 1 120 120 THR H H 120 8.138 8.138 7.808 0.330 18321 23609 1 18 . 1 1 121 121 ALA N N 121 125.859 125.859 123.530 2.329 18321 23610 1 18 . 1 1 121 121 ALA CA C 121 52.281 52.281 52.034 0.247 18321 23611 1 18 . 1 1 121 121 ALA CB C 121 18.623 18.623 20.350 -1.727 18321 23612 1 18 . 1 1 121 121 ALA H H 121 8.272 8.272 8.024 0.248 18321 23613 1 18 . 1 1 122 122 GLU C C 122 176.316 176.316 175.446 0.870 18321 23614 1 18 . 1 1 123 123 ASP N N 123 120.448 120.448 118.713 1.735 18321 23615 1 18 . 1 1 123 123 ASP C C 123 175.906 175.906 175.743 0.163 18321 23616 1 18 . 1 1 123 123 ASP CA C 123 54.167 54.167 56.678 -2.511 18321 23617 1 18 . 1 1 123 123 ASP CB C 123 40.695 40.695 40.399 0.296 18321 23618 1 18 . 1 1 123 123 ASP H H 123 8.181 8.181 8.540 -0.359 18321 23619 1 18 . 1 1 124 124 ASN N N 124 118.207 118.207 117.997 0.210 18321 23620 1 18 . 1 1 124 124 ASN C C 124 174.851 174.851 173.986 0.865 18321 23621 1 18 . 1 1 124 124 ASN CA C 124 52.771 52.771 53.535 -0.764 18321 23622 1 18 . 1 1 124 124 ASN CB C 124 38.304 38.304 39.763 -1.459 18321 23623 1 18 . 1 1 124 124 ASN H H 124 8.307 8.307 8.056 0.251 18321 23624 1 18 . 1 1 125 125 LEU N N 125 121.311 121.311 121.947 -0.636 18321 23625 1 18 . 1 1 125 125 LEU C C 125 175.750 175.750 175.311 0.439 18321 23626 1 18 . 1 1 125 125 LEU CA C 125 54.428 54.428 55.534 -1.106 18321 23627 1 18 . 1 1 125 125 LEU CB C 125 41.350 41.350 40.365 0.985 18321 23628 1 18 . 1 1 125 125 LEU H H 125 7.747 7.747 8.416 -0.669 18321 23629 1 18 . 1 1 126 126 GLU N N 126 122.485 122.485 118.809 3.676 18321 23630 1 18 . 1 1 126 126 GLU C C 126 174.008 174.008 174.142 -0.134 18321 23631 1 18 . 1 1 126 126 GLU CA C 126 54.855 54.855 56.309 -1.454 18321 23632 1 18 . 1 1 126 126 GLU CB C 126 30.472 30.472 31.079 -0.607 18321 23633 1 18 . 1 1 126 126 GLU H H 126 8.453 8.453 8.172 0.281 18321 23634 1 18 . 1 1 127 127 TYR N N 127 122.713 122.713 120.947 1.766 18321 23635 1 18 . 1 1 127 127 TYR C C 127 176.859 176.859 174.501 2.358 18321 23636 1 18 . 1 1 127 127 TYR CA C 127 56.528 56.528 56.685 -0.157 18321 23637 1 18 . 1 1 127 127 TYR CB C 127 40.982 40.982 39.500 1.482 18321 23638 1 18 . 1 1 127 127 TYR H H 127 8.469 8.469 7.996 0.473 18321 23639 1 18 . 1 1 128 128 VAL N N 128 112.432 112.432 124.840 -12.408 18321 23640 1 18 . 1 1 128 128 VAL C C 128 173.150 173.150 174.158 -1.008 18321 23641 1 18 . 1 1 128 128 VAL CA C 128 57.940 57.940 60.583 -2.643 18321 23642 1 18 . 1 1 128 128 VAL CB C 128 34.935 34.935 35.423 -0.488 18321 23643 1 18 . 1 1 128 128 VAL H H 128 9.078 9.078 9.057 0.021 18321 23644 1 18 . 1 1 129 129 ARG N N 129 120.373 120.373 124.704 -4.331 18321 23645 1 18 . 1 1 129 129 ARG C C 129 176.539 176.539 175.430 1.109 18321 23646 1 18 . 1 1 129 129 ARG CA C 129 52.534 52.534 53.920 -1.386 18321 23647 1 18 . 1 1 129 129 ARG CB C 129 32.942 32.942 33.249 -0.307 18321 23648 1 18 . 1 1 129 129 ARG H H 129 9.010 9.010 8.139 0.871 18321 23649 1 18 . 1 1 130 130 THR N N 130 116.637 116.637 113.764 2.873 18321 23650 1 18 . 1 1 130 130 THR CA C 130 60.618 60.618 60.972 -0.354 18321 23651 1 18 . 1 1 130 130 THR CB C 130 69.170 69.170 70.407 -1.237 18321 23652 1 18 . 1 1 130 130 THR H H 130 9.045 9.045 8.487 0.558 18321 23653 1 18 . 1 1 131 131 LEU N N 131 122.910 122.910 124.114 -1.204 18321 23654 1 18 . 1 1 131 131 LEU C C 131 175.269 175.269 178.899 -3.630 18321 23655 1 18 . 1 1 131 131 LEU CA C 131 55.122 55.122 55.728 -0.606 18321 23656 1 18 . 1 1 131 131 LEU CB C 131 43.108 43.108 42.510 0.598 18321 23657 1 18 . 1 1 131 131 LEU H H 131 9.224 9.224 8.418 0.806 18321 23658 1 18 . 1 1 132 132 TYR N N 132 112.885 112.885 119.927 -7.042 18321 23659 1 18 . 1 1 132 132 TYR C C 132 173.818 173.818 175.879 -2.061 18321 23660 1 18 . 1 1 132 132 TYR CA C 132 54.230 54.230 60.551 -6.321 18321 23661 1 18 . 1 1 132 132 TYR CB C 132 42.672 42.672 39.933 2.739 18321 23662 1 18 . 1 1 132 132 TYR H H 132 7.284 7.284 7.601 -0.317 18321 23663 1 18 . 1 1 133 133 ASP N N 133 118.003 118.003 120.100 -2.097 18321 23664 1 18 . 1 1 133 133 ASP C C 133 175.779 175.779 174.472 1.307 18321 23665 1 18 . 1 1 133 133 ASP CA C 133 54.351 54.351 55.398 -1.047 18321 23666 1 18 . 1 1 133 133 ASP CB C 133 41.241 41.241 39.959 1.282 18321 23667 1 18 . 1 1 133 133 ASP H H 133 8.399 8.399 8.453 -0.054 18321 23668 1 18 . 1 1 134 134 PHE N N 134 121.081 121.081 124.085 -3.004 18321 23669 1 18 . 1 1 134 134 PHE CA C 134 52.552 52.552 54.830 -2.278 18321 23670 1 18 . 1 1 134 134 PHE CB C 134 41.217 41.217 41.583 -0.366 18321 23671 1 18 . 1 1 134 134 PHE H H 134 8.797 8.797 7.181 1.616 18321 23672 1 18 . 1 1 136 136 GLY C C 136 171.616 171.616 174.741 -3.125 18321 23673 1 18 . 1 1 137 137 ASN N N 137 119.394 119.394 118.034 1.360 18321 23674 1 18 . 1 1 137 137 ASN C C 137 174.500 174.500 173.739 0.761 18321 23675 1 18 . 1 1 137 137 ASN CA C 137 44.670 44.670 54.694 -10.024 18321 23676 1 18 . 1 1 137 137 ASN H H 137 9.477 9.477 8.407 1.070 18321 23677 1 18 . 1 1 138 138 ASP N N 138 120.608 120.608 119.659 0.949 18321 23678 1 18 . 1 1 138 138 ASP C C 138 176.987 176.987 174.299 2.688 18321 23679 1 18 . 1 1 138 138 ASP CA C 138 52.992 52.992 53.184 -0.193 18321 23680 1 18 . 1 1 138 138 ASP H H 138 8.216 8.216 7.972 0.244 18321 23681 1 18 . 1 1 139 139 ALA N N 139 124.371 124.371 120.677 3.694 18321 23682 1 18 . 1 1 139 139 ALA C C 139 178.472 178.472 177.769 0.703 18321 23683 1 18 . 1 1 139 139 ALA CA C 139 54.513 54.513 52.617 1.896 18321 23684 1 18 . 1 1 139 139 ALA CB C 139 18.045 18.045 20.115 -2.070 18321 23685 1 18 . 1 1 139 139 ALA H H 139 8.565 8.565 8.509 0.056 18321 23686 1 18 . 1 1 140 140 GLU N N 140 115.022 115.022 120.182 -5.160 18321 23687 1 18 . 1 1 140 140 GLU C C 140 177.027 177.027 175.263 1.764 18321 23688 1 18 . 1 1 140 140 GLU CA C 140 56.181 56.181 58.074 -1.893 18321 23689 1 18 . 1 1 140 140 GLU CB C 140 28.619 28.619 31.087 -2.468 18321 23690 1 18 . 1 1 140 140 GLU H H 140 8.616 8.616 8.155 0.461 18321 23691 1 18 . 1 1 141 141 ASP N N 141 121.913 121.913 120.942 0.971 18321 23692 1 18 . 1 1 141 141 ASP C C 141 175.923 175.923 175.013 0.910 18321 23693 1 18 . 1 1 141 141 ASP CA C 141 54.736 54.736 54.134 0.602 18321 23694 1 18 . 1 1 141 141 ASP CB C 141 41.305 41.305 41.912 -0.607 18321 23695 1 18 . 1 1 141 141 ASP H H 141 7.636 7.636 7.965 -0.329 18321 23696 1 18 . 1 1 142 142 LEU N N 142 127.651 127.651 125.281 2.370 18321 23697 1 18 . 1 1 142 142 LEU CA C 142 50.955 50.955 52.477 -1.522 18321 23698 1 18 . 1 1 142 142 LEU CB C 142 42.343 42.343 44.089 -1.746 18321 23699 1 18 . 1 1 142 142 LEU H H 142 9.479 9.479 8.512 0.967 18321 23700 1 18 . 1 1 143 143 PRO C C 143 177.924 177.924 175.726 2.198 18321 23701 1 18 . 1 1 144 144 PHE N N 144 114.483 114.483 120.863 -6.380 18321 23702 1 18 . 1 1 144 144 PHE C C 144 175.055 175.055 174.981 0.074 18321 23703 1 18 . 1 1 144 144 PHE CA C 144 55.543 55.543 54.648 0.895 18321 23704 1 18 . 1 1 144 144 PHE CB C 144 40.581 40.581 41.261 -0.680 18321 23705 1 18 . 1 1 144 144 PHE H H 144 8.637 8.637 7.515 1.122 18321 23706 1 18 . 1 1 145 145 LYS N N 145 121.342 121.342 120.470 0.872 18321 23707 1 18 . 1 1 145 145 LYS C C 145 176.925 176.925 177.693 -0.768 18321 23708 1 18 . 1 1 145 145 LYS CA C 145 53.043 53.043 54.533 -1.490 18321 23709 1 18 . 1 1 145 145 LYS CB C 145 33.804 33.804 34.360 -0.556 18321 23710 1 18 . 1 1 145 145 LYS H H 145 9.418 9.418 8.558 0.860 18321 23711 1 18 . 1 1 146 146 LYS N N 146 123.378 123.378 117.954 5.424 18321 23712 1 18 . 1 1 146 146 LYS CA C 146 57.883 57.883 57.850 0.033 18321 23713 1 18 . 1 1 146 146 LYS CB C 146 32.008 32.008 32.946 -0.938 18321 23714 1 18 . 1 1 146 146 LYS H H 146 9.002 9.002 8.603 0.399 18321 23715 1 18 . 1 1 147 147 GLY C C 147 174.315 174.315 173.633 0.682 18321 23716 1 18 . 1 1 148 148 GLU N N 148 121.392 121.392 119.790 1.602 18321 23717 1 18 . 1 1 148 148 GLU C C 148 174.998 174.998 175.378 -0.380 18321 23718 1 18 . 1 1 148 148 GLU CA C 148 56.867 56.867 55.302 1.565 18321 23719 1 18 . 1 1 148 148 GLU CB C 148 31.649 31.649 31.747 -0.098 18321 23720 1 18 . 1 1 148 148 GLU H H 148 7.937 7.937 7.688 0.249 18321 23721 1 18 . 1 1 149 149 ILE N N 149 120.124 120.124 122.252 -2.128 18321 23722 1 18 . 1 1 149 149 ILE C C 149 176.647 176.647 174.768 1.879 18321 23723 1 18 . 1 1 149 149 ILE CA C 149 58.621 58.621 60.236 -1.615 18321 23724 1 18 . 1 1 149 149 ILE CB C 149 36.952 36.952 38.079 -1.127 18321 23725 1 18 . 1 1 149 149 ILE H H 149 8.346 8.346 8.600 -0.254 18321 23726 1 18 . 1 1 150 150 LEU N N 150 126.950 126.950 125.680 1.270 18321 23727 1 18 . 1 1 150 150 LEU CA C 150 51.967 51.967 53.062 -1.095 18321 23728 1 18 . 1 1 150 150 LEU CB C 150 44.182 44.182 45.695 -1.513 18321 23729 1 18 . 1 1 150 150 LEU H H 150 8.988 8.988 9.241 -0.253 18321 23730 1 18 . 1 1 151 151 VAL C C 151 175.670 175.670 175.642 0.028 18321 23731 1 18 . 1 1 152 152 ILE N N 152 124.997 124.997 128.879 -3.882 18321 23732 1 18 . 1 1 152 152 ILE CA C 152 58.331 58.331 60.127 -1.796 18321 23733 1 18 . 1 1 152 152 ILE CB C 152 34.093 34.093 35.175 -1.082 18321 23734 1 18 . 1 1 152 152 ILE H H 152 8.673 8.673 8.755 -0.082 18321 23735 1 18 . 1 1 153 153 ILE N N 153 124.710 124.710 128.965 -4.255 18321 23736 1 18 . 1 1 153 153 ILE C C 153 176.264 176.264 174.358 1.906 18321 23737 1 18 . 1 1 154 154 GLU N N 154 117.398 117.398 115.927 1.471 18321 23738 1 18 . 1 1 154 154 GLU C C 154 173.959 173.959 174.335 -0.376 18321 23739 1 18 . 1 1 154 154 GLU CA C 154 55.289 55.289 54.474 0.815 18321 23740 1 18 . 1 1 154 154 GLU CB C 154 32.842 32.842 33.162 -0.320 18321 23741 1 18 . 1 1 154 154 GLU H H 154 7.818 7.818 8.284 -0.466 18321 23742 1 18 . 1 1 155 155 LYS N N 155 121.130 121.130 123.943 -2.813 18321 23743 1 18 . 1 1 155 155 LYS CA C 155 53.022 53.022 52.627 0.395 18321 23744 1 18 . 1 1 155 155 LYS CB C 155 32.663 32.663 32.816 -0.152 18321 23745 1 18 . 1 1 155 155 LYS H H 155 8.654 8.654 8.346 0.308 18321 23746 1 18 . 1 1 157 157 GLU C C 157 175.190 175.190 175.551 -0.361 18321 23747 1 18 . 1 1 157 157 GLU CA C 157 53.785 53.785 54.180 -0.395 18321 23748 1 18 . 1 1 157 157 GLU CB C 157 32.685 32.685 32.218 0.467 18321 23749 1 18 . 1 1 158 158 GLU N N 158 117.425 117.425 118.686 -1.261 18321 23750 1 18 . 1 1 158 158 GLU C C 158 178.600 178.600 176.809 1.791 18321 23751 1 18 . 1 1 158 158 GLU CA C 158 59.044 59.044 57.243 1.801 18321 23752 1 18 . 1 1 158 158 GLU CB C 158 29.706 29.706 30.017 -0.311 18321 23753 1 18 . 1 1 158 158 GLU H H 158 8.678 8.678 8.800 -0.122 18321 23754 1 18 . 1 1 159 159 GLN N N 159 110.925 110.925 117.168 -6.243 18321 23755 1 18 . 1 1 159 159 GLN C C 159 175.539 175.539 175.642 -0.103 18321 23756 1 18 . 1 1 159 159 GLN CA C 159 54.942 54.942 56.788 -1.846 18321 23757 1 18 . 1 1 159 159 GLN CB C 159 28.572 28.572 29.903 -1.331 18321 23758 1 18 . 1 1 159 159 GLN H H 159 8.483 8.483 8.139 0.344 18321 23759 1 18 . 1 1 160 160 TRP N N 160 120.171 120.171 119.318 0.853 18321 23760 1 18 . 1 1 160 160 TRP C C 160 173.444 173.444 174.633 -1.189 18321 23761 1 18 . 1 1 160 160 TRP CA C 160 56.175 56.175 56.563 -0.388 18321 23762 1 18 . 1 1 160 160 TRP CB C 160 31.796 31.796 32.611 -0.815 18321 23763 1 18 . 1 1 160 160 TRP H H 160 6.826 6.826 7.816 -0.990 18321 23764 1 18 . 1 1 161 161 TRP N N 161 120.687 120.687 120.767 -0.080 18321 23765 1 18 . 1 1 161 161 TRP C C 161 174.736 174.736 175.607 -0.871 18321 23766 1 18 . 1 1 161 161 TRP CA C 161 51.889 51.889 55.016 -3.127 18321 23767 1 18 . 1 1 161 161 TRP CB C 161 32.772 32.772 32.052 0.720 18321 23768 1 18 . 1 1 161 161 TRP H H 161 8.462 8.462 9.499 -1.037 18321 23769 1 18 . 1 1 162 162 SER N N 162 115.691 115.691 119.602 -3.911 18321 23770 1 18 . 1 1 162 162 SER C C 162 174.320 174.320 173.323 0.997 18321 23771 1 18 . 1 1 162 162 SER CA C 162 57.011 57.011 58.383 -1.372 18321 23772 1 18 . 1 1 162 162 SER CB C 162 63.948 63.948 63.558 0.390 18321 23773 1 18 . 1 1 162 162 SER H H 162 8.830 8.830 9.292 -0.462 18321 23774 1 18 . 1 1 163 163 ALA N N 163 130.630 130.630 128.530 2.100 18321 23775 1 18 . 1 1 163 163 ALA CA C 163 50.029 50.029 49.947 0.082 18321 23776 1 18 . 1 1 163 163 ALA CB C 163 25.500 25.500 22.557 2.943 18321 23777 1 18 . 1 1 163 163 ALA H H 163 9.585 9.585 9.179 0.406 18321 23778 1 18 . 1 1 164 164 ARG N N 164 117.526 117.526 120.898 -3.372 18321 23779 1 18 . 1 1 164 164 ARG C C 164 176.719 176.719 176.687 0.032 18321 23780 1 18 . 1 1 164 164 ARG CA C 164 52.975 52.975 54.312 -1.337 18321 23781 1 18 . 1 1 164 164 ARG CB C 164 34.260 34.260 30.641 3.619 18321 23782 1 18 . 1 1 164 164 ARG H H 164 9.097 9.097 9.038 0.059 18321 23783 1 18 . 1 1 165 165 ASN N N 165 123.935 123.935 122.712 1.223 18321 23784 1 18 . 1 1 165 165 ASN C C 165 178.484 178.484 176.858 1.626 18321 23785 1 18 . 1 1 165 165 ASN CA C 165 50.332 50.332 54.528 -4.196 18321 23786 1 18 . 1 1 165 165 ASN CB C 165 39.487 39.487 39.537 -0.050 18321 23787 1 18 . 1 1 165 165 ASN H H 165 8.756 8.756 9.133 -0.377 18321 23788 1 18 . 1 1 166 166 LYS N N 166 118.464 118.464 121.479 -3.015 18321 23789 1 18 . 1 1 166 166 LYS C C 166 176.967 176.967 177.131 -0.164 18321 23790 1 18 . 1 1 166 166 LYS CA C 166 58.430 58.430 58.445 -0.015 18321 23791 1 18 . 1 1 166 166 LYS CB C 166 30.918 30.918 32.348 -1.430 18321 23792 1 18 . 1 1 166 166 LYS H H 166 8.915 8.915 9.575 -0.660 18321 23793 1 18 . 1 1 167 167 ASP N N 167 118.138 118.138 116.195 1.943 18321 23794 1 18 . 1 1 167 167 ASP C C 167 176.464 176.464 176.967 -0.503 18321 23795 1 18 . 1 1 167 167 ASP CA C 167 54.212 54.212 55.133 -0.921 18321 23796 1 18 . 1 1 167 167 ASP CB C 167 41.178 41.178 41.566 -0.388 18321 23797 1 18 . 1 1 167 167 ASP H H 167 7.508 7.508 8.362 -0.854 18321 23798 1 18 . 1 1 168 168 GLY N N 168 107.901 107.901 107.042 0.859 18321 23799 1 18 . 1 1 168 168 GLY C C 168 173.613 173.613 173.483 0.130 18321 23800 1 18 . 1 1 168 168 GLY CA C 168 44.783 44.783 44.971 -0.188 18321 23801 1 18 . 1 1 168 168 GLY H H 168 8.173 8.173 8.111 0.062 18321 23802 1 18 . 1 1 169 169 ARG N N 169 124.324 124.324 120.989 3.335 18321 23803 1 18 . 1 1 169 169 ARG CA C 169 56.106 56.106 56.023 0.083 18321 23804 1 18 . 1 1 169 169 ARG CB C 169 29.648 29.648 31.081 -1.433 18321 23805 1 18 . 1 1 169 169 ARG H H 169 7.998 7.998 8.182 -0.184 18321 23806 1 18 . 1 1 170 170 VAL C C 170 177.590 177.590 174.905 2.685 18321 23807 1 18 . 1 1 171 171 GLY N N 171 112.582 112.582 113.711 -1.129 18321 23808 1 18 . 1 1 171 171 GLY C C 171 170.991 170.991 172.486 -1.495 18321 23809 1 18 . 1 1 171 171 GLY CA C 171 45.361 45.361 44.825 0.536 18321 23810 1 18 . 1 1 171 171 GLY H H 171 9.013 9.013 8.651 0.362 18321 23811 1 18 . 1 1 172 172 MET N N 172 117.368 117.368 120.504 -3.136 18321 23812 1 18 . 1 1 172 172 MET C C 172 177.921 177.921 176.091 1.830 18321 23813 1 18 . 1 1 172 172 MET CA C 172 53.536 53.536 54.615 -1.079 18321 23814 1 18 . 1 1 172 172 MET CB C 172 30.838 30.838 33.781 -2.943 18321 23815 1 18 . 1 1 172 172 MET H H 172 8.885 8.885 9.094 -0.209 18321 23816 1 18 . 1 1 173 173 ILE N N 173 113.130 113.130 117.555 -4.425 18321 23817 1 18 . 1 1 173 173 ILE CA C 173 56.284 56.284 58.029 -1.745 18321 23818 1 18 . 1 1 173 173 ILE CB C 173 40.870 40.870 40.843 0.027 18321 23819 1 18 . 1 1 173 173 ILE H H 173 9.704 9.704 9.349 0.355 18321 23820 1 18 . 1 1 174 174 PRO C C 174 176.714 176.714 177.627 -0.913 18321 23821 1 18 . 1 1 174 174 PRO CA C 174 66.290 66.290 61.164 5.126 18321 23822 1 18 . 1 1 174 174 PRO CB C 174 28.993 28.993 30.549 -1.556 18321 23823 1 18 . 1 1 175 175 VAL N N 175 128.066 128.066 124.242 3.824 18321 23824 1 18 . 1 1 175 175 VAL CA C 175 59.356 59.356 67.258 -7.902 18321 23825 1 18 . 1 1 175 175 VAL H H 175 7.327 7.327 8.179 -0.852 18321 23826 1 18 . 1 1 176 176 PRO C C 176 176.351 176.351 176.980 -0.629 18321 23827 1 18 . 1 1 177 177 TYR N N 177 115.756 115.756 114.395 1.361 18321 23828 1 18 . 1 1 177 177 TYR C C 177 175.011 175.011 175.587 -0.576 18321 23829 1 18 . 1 1 177 177 TYR CA C 177 56.756 56.756 57.104 -0.348 18321 23830 1 18 . 1 1 177 177 TYR CB C 177 37.507 37.507 38.908 -1.401 18321 23831 1 18 . 1 1 177 177 TYR H H 177 7.784 7.784 7.543 0.241 18321 23832 1 18 . 1 1 178 178 VAL N N 178 111.428 111.428 116.001 -4.573 18321 23833 1 18 . 1 1 178 178 VAL C C 178 173.417 173.417 175.958 -2.541 18321 23834 1 18 . 1 1 178 178 VAL CA C 178 58.307 58.307 59.366 -1.059 18321 23835 1 18 . 1 1 178 178 VAL CB C 178 34.602 34.602 34.014 0.588 18321 23836 1 18 . 1 1 178 178 VAL H H 178 7.801 7.801 7.535 0.266 18321 23837 1 18 . 1 1 179 179 GLU N N 179 118.581 118.581 120.338 -1.757 18321 23838 1 18 . 1 1 179 179 GLU C C 179 175.225 175.225 174.953 0.272 18321 23839 1 18 . 1 1 179 179 GLU CA C 179 53.114 53.114 56.210 -3.096 18321 23840 1 18 . 1 1 179 179 GLU CB C 179 32.712 32.712 30.158 2.554 18321 23841 1 18 . 1 1 179 179 GLU H H 179 8.819 8.819 8.524 0.295 18321 23842 1 18 . 1 1 180 180 LYS N N 180 124.167 124.167 119.591 4.576 18321 23843 1 18 . 1 1 180 180 LYS C C 180 176.303 176.303 176.375 -0.072 18321 23844 1 18 . 1 1 180 180 LYS CA C 180 57.318 57.318 55.584 1.734 18321 23845 1 18 . 1 1 180 180 LYS CB C 180 31.675 31.675 32.233 -0.557 18321 23846 1 18 . 1 1 180 180 LYS H H 180 8.775 8.775 7.768 1.007 18321 23847 1 18 . 1 1 181 181 LEU N N 181 125.157 125.157 124.745 0.412 18321 23848 1 18 . 1 1 181 181 LEU C C 181 176.462 176.462 177.259 -0.797 18321 23849 1 18 . 1 1 181 181 LEU CA C 181 54.470 54.470 56.454 -1.984 18321 23850 1 18 . 1 1 181 181 LEU CB C 181 41.625 41.625 42.874 -1.249 18321 23851 1 18 . 1 1 181 181 LEU H H 181 8.084 8.084 8.681 -0.597 18321 23852 1 18 . 1 1 182 182 VAL N N 182 123.167 123.167 114.956 8.211 18321 23853 1 18 . 1 1 182 182 VAL C C 182 175.983 175.983 174.690 1.293 18321 23854 1 18 . 1 1 182 182 VAL CA C 182 61.613 61.613 62.428 -0.815 18321 23855 1 18 . 1 1 182 182 VAL CB C 182 32.085 32.085 32.233 -0.148 18321 23856 1 18 . 1 1 182 182 VAL H H 182 8.345 8.345 8.100 0.245 18321 23857 1 18 . 1 1 183 183 ARG N N 183 125.775 125.775 125.312 0.463 18321 23858 1 18 . 1 1 183 183 ARG CA C 183 57.801 57.801 56.060 1.741 18321 23859 1 18 . 1 1 183 183 ARG CB C 183 30.091 30.091 33.390 -3.299 18321 23860 1 18 . 1 1 183 183 ARG H H 183 8.530 8.530 8.421 0.109 18321 23861 1 18 . 1 1 184 184 SER C C 184 173.239 173.239 174.006 -0.767 18321 23862 1 18 . 1 1 185 185 SER N N 185 116.511 116.511 120.341 -3.830 18321 23863 1 18 . 1 1 185 185 SER CA C 185 58.428 58.428 56.243 2.184 18321 23864 1 18 . 1 1 185 185 SER CB C 185 69.737 69.737 62.824 6.913 18321 23865 1 18 . 1 1 185 185 SER H H 185 7.944 7.944 8.547 -0.603 18321 23866 1 18 . 1 1 190 190 HIS C C 190 176.953 176.953 174.707 2.246 18321 23867 1 18 . 1 1 190 190 HIS CA C 190 54.229 54.229 55.609 -1.380 18321 23868 1 18 . 1 1 190 190 HIS CB C 190 35.112 35.112 31.938 3.174 18321 23869 1 18 . 1 1 191 191 GLY N N 191 109.491 109.491 111.858 -2.367 18321 23870 1 18 . 1 1 191 191 GLY C C 191 172.295 172.295 173.337 -1.042 18321 23871 1 18 . 1 1 191 191 GLY CA C 191 45.227 45.227 44.433 0.794 18321 23872 1 18 . 1 1 191 191 GLY H H 191 8.719 8.719 8.404 0.315 18321 23873 1 18 . 1 1 192 192 ASN N N 192 118.700 118.700 116.479 2.221 18321 23874 1 18 . 1 1 192 192 ASN HA H 192 4.312 4.312 4.482 -0.170 18321 23875 1 18 . 1 1 192 192 ASN C C 192 176.369 176.369 175.502 0.867 18321 23876 1 18 . 1 1 192 192 ASN CA C 192 57.787 57.787 54.275 3.512 18321 23877 1 18 . 1 1 192 192 ASN H H 192 7.508 7.508 8.450 -0.942 18321 23878 1 18 . 1 1 193 193 ARG N N 193 120.743 120.743 118.741 2.002 18321 23879 1 18 . 1 1 193 193 ARG H H 193 9.032 9.032 8.006 1.026 18321 23880 1 18 . 1 1 197 197 SER HA H 197 4.388 4.388 4.442 -0.054 18321 23881 1 18 . 1 1 197 197 SER C C 197 174.133 174.133 174.068 0.065 18321 23882 1 18 . 1 1 197 197 SER CA C 197 58.128 58.128 57.878 0.250 18321 23883 1 18 . 1 1 197 197 SER CB C 197 62.966 62.966 63.735 -0.769 18321 23884 1 18 . 1 1 198 198 TYR N N 198 121.435 121.435 123.796 -2.361 18321 23885 1 18 . 1 1 198 198 TYR HA H 198 4.543 4.543 4.111 0.432 18321 23886 1 18 . 1 1 198 198 TYR C C 198 176.230 176.230 177.271 -1.041 18321 23887 1 18 . 1 1 198 198 TYR CA C 198 57.536 57.536 58.974 -1.438 18321 23888 1 18 . 1 1 198 198 TYR CB C 198 38.279 38.279 37.035 1.244 18321 23889 1 18 . 1 1 198 198 TYR H H 198 8.071 8.071 8.251 -0.180 18321 23890 1 18 . 1 1 199 199 GLY N N 199 110.039 110.039 107.175 2.864 18321 23891 1 18 . 1 1 199 199 GLY C C 199 173.475 173.475 173.788 -0.313 18321 23892 1 18 . 1 1 199 199 GLY CA C 199 44.805 44.805 45.008 -0.203 18321 23893 1 18 . 1 1 199 199 GLY H H 199 8.162 8.162 8.535 -0.373 18321 23894 1 18 . 1 1 200 200 ILE N N 200 121.530 121.530 124.333 -2.803 18321 23895 1 18 . 1 1 200 200 ILE CA C 200 58.102 58.102 57.576 0.526 18321 23896 1 18 . 1 1 200 200 ILE CB C 200 37.760 37.760 38.327 -0.567 18321 23897 1 18 . 1 1 200 200 ILE H H 200 7.851 7.851 7.578 0.273 18321 23898 1 18 . 1 1 201 201 PRO C C 201 176.485 176.485 175.637 0.848 18321 23899 1 18 . 1 1 201 201 PRO CA C 201 53.893 53.893 62.485 -8.592 18321 23900 1 18 . 1 1 201 201 PRO CB C 201 29.042 29.042 31.468 -2.426 18321 23901 1 18 . 1 1 202 202 GLU N N 202 122.468 122.468 124.119 -1.651 18321 23902 1 18 . 1 1 202 202 GLU CA C 202 62.490 62.490 54.443 8.047 18321 23903 1 18 . 1 1 202 202 GLU CB C 202 31.170 31.170 30.601 0.569 18321 23904 1 18 . 1 1 202 202 GLU H H 202 8.328 8.328 8.433 -0.105 18321 23905 1 18 . 1 1 203 203 PRO CA C 203 62.803 62.803 63.363 -0.560 18321 23906 1 18 . 1 1 203 203 PRO CB C 203 31.220 31.220 32.445 -1.225 18321 23907 1 18 . 1 1 204 204 ALA N N 204 123.251 123.251 120.849 2.402 18321 23908 1 18 . 1 1 204 204 ALA HA H 204 4.180 4.180 4.472 -0.292 18321 23909 1 18 . 1 1 204 204 ALA CA C 204 52.124 52.124 51.648 0.476 18321 23910 1 18 . 1 1 204 204 ALA CB C 204 18.892 18.892 20.033 -1.141 18321 23911 1 18 . 1 1 204 204 ALA H H 204 8.308 8.308 7.790 0.518 18321 23912 1 18 . 1 1 205 205 HIS N N 205 117.874 117.874 121.114 -3.240 18321 23913 1 18 . 1 1 205 205 HIS C C 205 173.282 173.282 174.140 -0.858 18321 23914 1 18 . 1 1 205 205 HIS H H 205 8.045 8.045 8.587 -0.542 18321 23915 1 18 . 1 1 206 206 ALA N N 206 125.519 125.519 128.180 -2.661 18321 23916 1 18 . 1 1 206 206 ALA HA H 206 4.204 4.204 4.040 0.164 18321 23917 1 18 . 1 1 206 206 ALA CA C 206 40.196 40.196 52.578 -12.382 18321 23918 1 18 . 1 1 206 206 ALA CB C 206 19.407 19.407 19.182 0.225 18321 23919 1 18 . 1 1 206 206 ALA H H 206 8.061 8.061 8.743 -0.682 18321 23920 1 18 . 1 1 207 207 TYR N N 207 120.381 120.381 117.822 2.559 18321 23921 1 18 . 1 1 207 207 TYR HA H 207 4.570 4.570 4.595 -0.025 18321 23922 1 18 . 1 1 207 207 TYR CA C 207 52.572 52.572 58.281 -5.709 18321 23923 1 18 . 1 1 207 207 TYR CB C 207 41.333 41.333 39.382 1.951 18321 23924 1 18 . 1 1 207 207 TYR H H 207 8.199 8.199 8.334 -0.135 18321 23925 1 18 . 1 1 208 208 ALA HA H 208 4.281 4.281 4.056 0.225 18321 23926 1 18 . 1 1 208 208 ALA C C 208 177.736 177.736 177.287 0.449 18321 23927 1 18 . 1 1 208 208 ALA CA C 208 52.084 52.084 54.252 -2.168 18321 23928 1 18 . 1 1 208 208 ALA CB C 208 18.999 18.999 17.913 1.086 18321 23929 1 18 . 1 1 209 209 GLN N N 209 119.295 119.295 119.207 0.088 18321 23930 1 18 . 1 1 209 209 GLN CA C 209 61.474 61.474 53.450 8.024 18321 23931 1 18 . 1 1 209 209 GLN CB C 209 32.039 32.039 30.493 1.546 18321 23932 1 18 . 1 1 209 209 GLN H H 209 8.125 8.125 8.489 -0.364 18321 23933 1 18 . 1 1 210 210 PRO HA H 210 4.395 4.395 4.370 0.025 18321 23934 1 18 . 1 1 210 210 PRO CA C 210 62.584 62.584 64.291 -1.707 18321 23935 1 18 . 1 1 211 211 GLN HA H 211 4.377 4.377 4.484 -0.107 18321 23936 1 18 . 1 1 211 211 GLN CA C 211 55.859 55.859 55.823 0.036 18321 23937 1 18 . 1 1 211 211 GLN CB C 211 29.577 29.577 30.265 -0.688 18321 23938 1 18 . 1 1 212 212 THR C C 212 176.551 176.551 175.238 1.313 18321 23939 1 18 . 1 1 212 212 THR CB C 212 69.890 69.890 69.165 0.725 18321 23940 1 18 . 1 1 213 213 THR N N 213 108.487 108.487 115.679 -7.192 18321 23941 1 18 . 1 1 213 213 THR CA C 213 61.236 61.236 61.463 -0.227 18321 23942 1 18 . 1 1 213 213 THR CB C 213 69.091 69.091 68.635 0.456 18321 23943 1 18 . 1 1 213 213 THR H H 213 8.243 8.243 7.930 0.313 18321 23944 1 18 . 1 1 214 214 THR N N 214 119.445 119.445 112.311 7.134 18321 23945 1 18 . 1 1 214 214 THR CA C 214 59.425 59.425 62.943 -3.518 18321 23946 1 18 . 1 1 214 214 THR CB C 214 69.251 69.251 67.679 1.572 18321 23947 1 18 . 1 1 214 214 THR H H 214 8.188 8.188 7.793 0.395 18321 23948 1 18 . 1 1 215 215 PRO HA H 215 4.361 4.361 4.406 -0.045 18321 23949 1 18 . 1 1 215 215 PRO C C 215 175.422 175.422 177.586 -2.164 18321 23950 1 18 . 1 1 215 215 PRO CA C 215 63.320 63.320 65.055 -1.735 18321 23951 1 18 . 1 1 215 215 PRO CB C 215 31.918 31.918 31.734 0.184 18321 23952 1 18 . 1 1 216 216 LEU N N 216 121.602 121.602 117.215 4.387 18321 23953 1 18 . 1 1 216 216 LEU CA C 216 52.203 52.203 56.012 -3.809 18321 23954 1 18 . 1 1 216 216 LEU CB C 216 42.451 42.451 39.943 2.508 18321 23955 1 18 . 1 1 216 216 LEU H H 216 7.891 7.891 8.040 -0.149 18321 23956 1 18 . 1 1 217 217 PRO HA H 217 4.398 4.398 4.548 -0.150 18321 23957 1 18 . 1 1 217 217 PRO C C 217 176.577 176.577 175.066 1.511 18321 23958 1 18 . 1 1 217 217 PRO CA C 217 62.984 62.984 61.963 1.021 18321 23959 1 18 . 1 1 217 217 PRO CB C 217 32.056 32.056 31.970 0.086 18321 23960 1 18 . 1 1 218 218 ALA N N 218 124.087 124.087 128.807 -4.720 18321 23961 1 18 . 1 1 218 218 ALA HA H 218 4.309 4.309 4.374 -0.065 18321 23962 1 18 . 1 1 218 218 ALA C C 218 177.844 177.844 177.217 0.627 18321 23963 1 18 . 1 1 218 218 ALA CA C 218 52.379 52.379 51.617 0.762 18321 23964 1 18 . 1 1 218 218 ALA CB C 218 19.133 19.133 18.875 0.258 18321 23965 1 18 . 1 1 218 218 ALA H H 218 8.261 8.261 8.385 -0.124 18321 23966 1 18 . 1 1 219 219 VAL N N 219 118.942 118.942 120.360 -1.418 18321 23967 1 18 . 1 1 219 219 VAL HA H 219 4.142 4.142 4.567 -0.425 18321 23968 1 18 . 1 1 219 219 VAL CA C 219 62.102 62.102 61.726 0.376 18321 23969 1 18 . 1 1 219 219 VAL CB C 219 32.923 32.923 33.190 -0.267 18321 23970 1 18 . 1 1 219 219 VAL H H 219 8.049 8.049 8.042 0.007 18321 23971 1 18 . 1 1 220 220 SER N N 220 119.207 119.207 121.178 -1.971 18321 23972 1 18 . 1 1 220 220 SER HA H 220 4.436 4.436 4.614 -0.178 18321 23973 1 18 . 1 1 220 220 SER CA C 220 57.813 57.813 58.121 -0.308 18321 23974 1 18 . 1 1 220 220 SER CB C 220 63.375 63.375 64.161 -0.786 18321 23975 1 18 . 1 1 220 220 SER H H 220 8.275 8.275 8.340 -0.065 18321 23976 1 18 . 1 1 221 221 GLY N N 221 110.973 110.973 111.235 -0.262 18321 23977 1 18 . 1 1 221 221 GLY C C 221 173.962 173.962 173.081 0.881 18321 23978 1 18 . 1 1 221 221 GLY CA C 221 45.286 45.286 44.741 0.545 18321 23979 1 18 . 1 1 221 221 GLY H H 221 8.374 8.374 8.524 -0.150 18321 23980 1 18 . 1 1 222 222 SER N N 222 115.516 115.516 116.644 -1.128 18321 23981 1 18 . 1 1 222 222 SER HA H 222 4.763 4.763 4.851 -0.088 18321 23982 1 18 . 1 1 222 222 SER CA C 222 56.407 56.407 56.557 -0.150 18321 23983 1 18 . 1 1 222 222 SER CB C 222 63.993 63.993 65.571 -1.578 18321 23984 1 18 . 1 1 222 222 SER H H 222 8.155 8.155 8.213 -0.058 18321 23985 1 18 . 1 1 223 223 PRO HA H 223 4.417 4.417 4.496 -0.079 18321 23986 1 18 . 1 1 223 223 PRO CA C 223 63.805 63.805 63.230 0.575 18321 23987 1 18 . 1 1 223 223 PRO CB C 223 32.090 32.090 32.181 -0.091 18321 23988 1 18 . 1 1 224 224 GLY N N 224 109.149 109.149 109.200 -0.051 18321 23989 1 18 . 1 1 224 224 GLY C C 224 173.813 173.813 173.926 -0.113 18321 23990 1 18 . 1 1 224 224 GLY CA C 224 44.512 44.512 44.851 -0.339 18321 23991 1 18 . 1 1 224 224 GLY H H 224 8.376 8.376 8.407 -0.031 18321 23992 1 18 . 1 1 225 225 ALA N N 225 123.599 123.599 122.950 0.649 18321 23993 1 18 . 1 1 225 225 ALA C C 225 177.341 177.341 176.219 1.122 18321 23994 1 18 . 1 1 225 225 ALA CA C 225 51.878 51.878 52.156 -0.278 18321 23995 1 18 . 1 1 225 225 ALA CB C 225 19.169 19.169 20.157 -0.988 18321 23996 1 18 . 1 1 225 225 ALA H H 225 7.959 7.959 8.216 -0.257 18321 23997 1 18 . 1 1 226 226 ALA N N 226 123.218 123.218 121.671 1.547 18321 23998 1 18 . 1 1 226 226 ALA HA H 226 4.350 4.350 4.733 -0.383 18321 23999 1 18 . 1 1 226 226 ALA C C 226 177.520 177.520 177.429 0.091 18321 24000 1 18 . 1 1 226 226 ALA CA C 226 52.535 52.535 51.464 1.071 18321 24001 1 18 . 1 1 226 226 ALA CB C 226 19.171 19.171 20.399 -1.228 18321 24002 1 18 . 1 1 226 226 ALA H H 226 8.169 8.169 7.521 0.648 18321 24003 1 18 . 1 1 227 227 ILE N N 227 120.086 120.086 114.936 5.150 18321 24004 1 18 . 1 1 227 227 ILE HA H 227 4.201 4.201 4.152 0.049 18321 24005 1 18 . 1 1 227 227 ILE C C 227 174.814 174.814 175.309 -0.495 18321 24006 1 18 . 1 1 227 227 ILE CA C 227 60.929 60.929 63.400 -2.470 18321 24007 1 18 . 1 1 227 227 ILE CB C 227 38.872 38.872 38.140 0.732 18321 24008 1 18 . 1 1 227 227 ILE H H 227 8.037 8.037 8.245 -0.208 18321 24009 1 18 . 1 1 228 228 THR N N 228 117.224 117.224 117.502 -0.278 18321 24010 1 18 . 1 1 228 228 THR HA H 228 4.203 4.203 4.678 -0.475 18321 24011 1 18 . 1 1 228 228 THR CA C 228 57.108 57.108 60.630 -3.522 18321 24012 1 18 . 1 1 228 228 THR CB C 228 69.945 69.945 69.602 0.343 18321 24013 1 18 . 1 1 228 228 THR H H 228 7.775 7.775 8.019 -0.244 18321 24014 1 18 . 1 1 229 229 PRO HA H 229 4.750 4.750 4.556 0.194 18321 24015 1 18 . 1 1 229 229 PRO CA C 229 62.480 62.480 62.493 -0.014 18321 24016 1 18 . 1 1 229 229 PRO CB C 229 33.995 33.995 33.083 0.912 18321 24017 1 18 . 1 1 230 230 LEU N N 230 123.629 123.629 123.037 0.592 18321 24018 1 18 . 1 1 230 230 LEU CA C 230 53.076 53.076 52.353 0.723 18321 24019 1 18 . 1 1 230 230 LEU CB C 230 40.608 40.608 41.602 -0.994 18321 24020 1 18 . 1 1 230 230 LEU H H 230 8.453 8.453 8.439 0.014 18321 24021 1 18 . 1 1 231 231 PRO HA H 231 4.412 4.412 4.648 -0.236 18321 24022 1 18 . 1 1 231 231 PRO C C 231 176.571 176.571 176.704 -0.133 18321 24023 1 18 . 1 1 231 231 PRO CA C 231 63.225 63.225 62.090 1.135 18321 24024 1 18 . 1 1 231 231 PRO CB C 231 31.191 31.191 32.522 -1.331 18321 24025 1 18 . 1 1 232 232 SER N N 232 115.169 115.169 115.734 -0.565 18321 24026 1 18 . 1 1 232 232 SER HA H 232 4.450 4.450 4.503 -0.053 18321 24027 1 18 . 1 1 232 232 SER CA C 232 58.604 58.604 58.745 -0.141 18321 24028 1 18 . 1 1 232 232 SER CB C 232 63.962 63.962 60.884 3.078 18321 24029 1 18 . 1 1 232 232 SER H H 232 8.280 8.280 8.511 -0.231 18321 24030 1 18 . 1 1 233 233 THR N N 233 115.155 115.155 117.050 -1.895 18321 24031 1 18 . 1 1 233 233 THR HA H 233 4.351 4.351 4.172 0.179 18321 24032 1 18 . 1 1 233 233 THR C C 233 177.237 177.237 176.643 0.594 18321 24033 1 18 . 1 1 233 233 THR CA C 233 61.939 61.939 63.727 -1.788 18321 24034 1 18 . 1 1 233 233 THR CB C 233 68.986 68.986 69.174 -0.188 18321 24035 1 18 . 1 1 233 233 THR H H 233 8.096 8.096 8.465 -0.369 18321 24036 1 18 . 1 1 234 234 GLN N N 234 122.040 122.040 119.744 2.296 18321 24037 1 18 . 1 1 234 234 GLN HA H 234 4.681 4.681 3.935 0.746 18321 24038 1 18 . 1 1 234 234 GLN C C 234 176.177 176.177 174.597 1.580 18321 24039 1 18 . 1 1 234 234 GLN CA C 234 55.861 55.861 56.929 -1.068 18321 24040 1 18 . 1 1 234 234 GLN CB C 234 28.583 28.583 28.131 0.452 18321 24041 1 18 . 1 1 234 234 GLN H H 234 8.256 8.256 8.770 -0.514 18321 24042 1 18 . 1 1 235 235 ASN N N 235 119.506 119.506 118.743 0.763 18321 24043 1 18 . 1 1 235 235 ASN HA H 235 4.775 4.775 4.504 0.271 18321 24044 1 18 . 1 1 235 235 ASN C C 235 174.974 174.974 174.473 0.501 18321 24045 1 18 . 1 1 235 235 ASN CA C 235 53.191 53.191 54.321 -1.130 18321 24046 1 18 . 1 1 235 235 ASN CB C 235 38.511 38.511 38.019 0.492 18321 24047 1 18 . 1 1 235 235 ASN H H 235 8.346 8.346 8.263 0.083 18321 24048 1 18 . 1 1 236 236 GLY N N 236 109.378 109.378 109.058 0.320 18321 24049 1 18 . 1 1 236 236 GLY CA C 236 44.023 44.023 44.361 -0.338 18321 24050 1 18 . 1 1 236 236 GLY H H 236 7.939 7.939 8.271 -0.332 18321 24051 1 18 . 1 1 237 237 PRO HA H 237 4.336 4.336 4.160 0.176 18321 24052 1 18 . 1 1 237 237 PRO C C 237 175.942 175.942 176.319 -0.377 18321 24053 1 18 . 1 1 237 237 PRO CA C 237 62.797 62.797 62.391 0.407 18321 24054 1 18 . 1 1 237 237 PRO CB C 237 27.421 27.421 32.025 -4.604 18321 24055 1 18 . 1 1 238 238 VAL N N 238 120.535 120.535 123.539 -3.004 18321 24056 1 18 . 1 1 238 238 VAL HA H 238 4.195 4.195 3.889 0.306 18321 24057 1 18 . 1 1 238 238 VAL C C 238 173.775 173.775 175.138 -1.363 18321 24058 1 18 . 1 1 238 238 VAL CA C 238 61.173 61.173 62.656 -1.483 18321 24059 1 18 . 1 1 238 238 VAL CB C 238 38.328 38.328 31.627 6.701 18321 24060 1 18 . 1 1 238 238 VAL H H 238 7.986 7.986 8.111 -0.125 18321 24061 1 18 . 1 1 239 239 PHE N N 239 123.522 123.522 125.138 -1.616 18321 24062 1 18 . 1 1 239 239 PHE HA H 239 5.539 5.539 4.959 0.580 18321 24063 1 18 . 1 1 239 239 PHE C C 239 174.207 174.207 175.440 -1.233 18321 24064 1 18 . 1 1 239 239 PHE CA C 239 56.993 56.993 57.338 -0.345 18321 24065 1 18 . 1 1 239 239 PHE CB C 239 41.743 41.743 40.116 1.627 18321 24066 1 18 . 1 1 239 239 PHE H H 239 8.927 8.927 8.670 0.257 18321 24067 1 18 . 1 1 240 240 ALA N N 240 120.871 120.871 126.442 -5.571 18321 24068 1 18 . 1 1 240 240 ALA HA H 240 5.352 5.352 5.276 0.076 18321 24069 1 18 . 1 1 240 240 ALA C C 240 174.639 174.639 175.745 -1.106 18321 24070 1 18 . 1 1 240 240 ALA CA C 240 49.736 49.736 50.364 -0.628 18321 24071 1 18 . 1 1 240 240 ALA CB C 240 23.480 23.480 22.612 0.868 18321 24072 1 18 . 1 1 240 240 ALA H H 240 9.398 9.398 9.067 0.331 18321 24073 1 18 . 1 1 241 241 LYS N N 241 121.227 121.227 122.879 -1.652 18321 24074 1 18 . 1 1 241 241 LYS HA H 241 5.373 5.373 4.931 0.443 18321 24075 1 18 . 1 1 241 241 LYS C C 241 176.772 176.772 176.036 0.736 18321 24076 1 18 . 1 1 241 241 LYS CA C 241 53.128 53.128 53.944 -0.816 18321 24077 1 18 . 1 1 241 241 LYS CB C 241 34.850 34.850 34.122 0.728 18321 24078 1 18 . 1 1 241 241 LYS H H 241 8.947 8.947 8.905 0.042 18321 24079 1 18 . 1 1 242 242 ALA N N 242 126.833 126.833 130.882 -4.049 18321 24080 1 18 . 1 1 242 242 ALA HA H 242 4.764 4.764 4.641 0.123 18321 24081 1 18 . 1 1 242 242 ALA C C 242 178.506 178.506 177.674 0.832 18321 24082 1 18 . 1 1 242 242 ALA CA C 242 52.788 52.788 51.779 1.009 18321 24083 1 18 . 1 1 242 242 ALA CB C 242 19.084 19.084 18.481 0.603 18321 24084 1 18 . 1 1 242 242 ALA H H 242 9.373 9.373 8.348 1.025 18321 24085 1 18 . 1 1 243 243 ILE N N 243 118.731 118.731 117.863 0.868 18321 24086 1 18 . 1 1 243 243 ILE HA H 243 4.454 4.454 4.160 0.294 18321 24087 1 18 . 1 1 243 243 ILE C C 243 174.773 174.773 175.914 -1.141 18321 24088 1 18 . 1 1 243 243 ILE CA C 243 60.613 60.613 61.965 -1.352 18321 24089 1 18 . 1 1 243 243 ILE CB C 243 39.232 39.232 38.224 1.008 18321 24090 1 18 . 1 1 243 243 ILE H H 243 8.933 8.933 8.470 0.463 18321 24091 1 18 . 1 1 244 244 GLN N N 244 121.616 121.616 119.588 2.028 18321 24092 1 18 . 1 1 244 244 GLN HA H 244 4.283 4.283 4.474 -0.191 18321 24093 1 18 . 1 1 244 244 GLN C C 244 172.815 172.815 174.118 -1.303 18321 24094 1 18 . 1 1 244 244 GLN CA C 244 54.750 54.750 54.389 0.361 18321 24095 1 18 . 1 1 244 244 GLN CB C 244 31.469 31.469 32.894 -1.425 18321 24096 1 18 . 1 1 244 244 GLN H H 244 7.438 7.438 7.547 -0.109 18321 24097 1 18 . 1 1 245 245 LYS N N 245 124.215 124.215 122.066 2.149 18321 24098 1 18 . 1 1 245 245 LYS HA H 245 3.962 3.962 4.423 -0.461 18321 24099 1 18 . 1 1 245 245 LYS C C 245 175.679 175.679 176.523 -0.844 18321 24100 1 18 . 1 1 245 245 LYS CA C 245 56.413 56.413 56.329 0.084 18321 24101 1 18 . 1 1 245 245 LYS CB C 245 32.847 32.847 32.237 0.610 18321 24102 1 18 . 1 1 245 245 LYS H H 245 8.318 8.318 8.586 -0.268 18321 24103 1 18 . 1 1 246 246 ARG N N 246 127.327 127.327 127.627 -0.300 18321 24104 1 18 . 1 1 246 246 ARG HA H 246 4.221 4.221 4.493 -0.272 18321 24105 1 18 . 1 1 246 246 ARG CA C 246 56.279 56.279 54.961 1.318 18321 24106 1 18 . 1 1 246 246 ARG CB C 246 32.987 32.987 29.291 3.696 18321 24107 1 18 . 1 1 246 246 ARG H H 246 9.248 9.248 8.433 0.815 18321 24108 1 18 . 1 1 249 249 CYS HA H 249 4.260 4.260 4.359 -0.099 18321 24109 1 18 . 1 1 249 249 CYS CA C 249 55.886 55.886 56.619 -0.733 18321 24110 1 18 . 1 1 249 249 CYS CB C 249 34.146 34.146 29.185 4.961 18321 24111 1 18 . 1 1 250 250 ALA HA H 250 3.926 3.926 4.043 -0.117 18321 24112 1 18 . 1 1 250 250 ALA CA C 250 54.344 54.344 54.323 0.021 18321 24113 1 18 . 1 1 250 250 ALA CB C 250 18.342 18.342 18.270 0.072 18321 24114 1 18 . 1 1 251 251 TYR N N 251 110.618 110.618 110.026 0.592 18321 24115 1 18 . 1 1 251 251 TYR HA H 251 4.489 4.489 4.684 -0.196 18321 24116 1 18 . 1 1 251 251 TYR C C 251 175.286 175.286 175.055 0.231 18321 24117 1 18 . 1 1 251 251 TYR CA C 251 56.137 56.137 55.065 1.072 18321 24118 1 18 . 1 1 251 251 TYR CB C 251 37.203 37.203 38.314 -1.111 18321 24119 1 18 . 1 1 251 251 TYR H H 251 7.037 7.037 7.213 -0.176 18321 24120 1 18 . 1 1 252 252 ASP N N 252 121.835 121.835 123.369 -1.534 18321 24121 1 18 . 1 1 252 252 ASP HA H 252 4.763 4.763 4.816 -0.053 18321 24122 1 18 . 1 1 252 252 ASP CA C 252 52.351 52.351 54.695 -2.344 18321 24123 1 18 . 1 1 252 252 ASP CB C 252 39.995 39.995 39.944 0.051 18321 24124 1 18 . 1 1 252 252 ASP H H 252 7.339 7.339 7.372 -0.033 18321 24125 1 18 . 1 1 253 253 LYS N N 253 123.177 123.177 122.060 1.117 18321 24126 1 18 . 1 1 253 253 LYS HA H 253 4.270 4.270 4.413 -0.143 18321 24127 1 18 . 1 1 253 253 LYS C C 253 177.724 177.724 177.322 0.402 18321 24128 1 18 . 1 1 253 253 LYS CA C 253 57.036 57.036 56.963 0.073 18321 24129 1 18 . 1 1 253 253 LYS H H 253 8.396 8.396 7.958 0.438 18321 24130 1 18 . 1 1 254 254 THR N N 254 108.317 108.317 108.270 0.047 18321 24131 1 18 . 1 1 254 254 THR HA H 254 4.517 4.517 4.455 0.062 18321 24132 1 18 . 1 1 254 254 THR C C 254 174.012 174.012 173.383 0.629 18321 24133 1 18 . 1 1 254 254 THR CA C 254 61.036 61.036 60.525 0.511 18321 24134 1 18 . 1 1 254 254 THR CB C 254 69.307 69.307 68.683 0.624 18321 24135 1 18 . 1 1 254 254 THR H H 254 8.217 8.217 8.098 0.119 18321 24136 1 18 . 1 1 255 255 ALA N N 255 124.762 124.762 124.254 0.508 18321 24137 1 18 . 1 1 255 255 ALA HA H 255 4.524 4.524 5.066 -0.542 18321 24138 1 18 . 1 1 255 255 ALA C C 255 176.630 176.630 176.311 0.319 18321 24139 1 18 . 1 1 255 255 ALA CA C 255 51.352 51.352 50.648 0.704 18321 24140 1 18 . 1 1 255 255 ALA CB C 255 20.135 20.135 20.232 -0.097 18321 24141 1 18 . 1 1 255 255 ALA H H 255 7.096 7.096 7.490 -0.394 18321 24142 1 18 . 1 1 256 256 LEU N N 256 124.379 124.379 122.635 1.744 18321 24143 1 18 . 1 1 256 256 LEU HA H 256 4.328 4.328 4.452 -0.124 18321 24144 1 18 . 1 1 256 256 LEU C C 256 176.007 176.007 175.796 0.211 18321 24145 1 18 . 1 1 256 256 LEU CA C 256 53.502 53.502 54.183 -0.681 18321 24146 1 18 . 1 1 256 256 LEU CB C 256 44.665 44.665 43.931 0.734 18321 24147 1 18 . 1 1 256 256 LEU H H 256 8.889 8.889 8.045 0.844 18321 24148 1 18 . 1 1 257 257 ALA N N 257 129.619 129.619 126.857 2.762 18321 24149 1 18 . 1 1 257 257 ALA HA H 257 4.445 4.445 5.092 -0.647 18321 24150 1 18 . 1 1 257 257 ALA C C 257 176.813 176.813 176.553 0.260 18321 24151 1 18 . 1 1 257 257 ALA CA C 257 51.179 51.179 50.785 0.394 18321 24152 1 18 . 1 1 257 257 ALA CB C 257 18.973 18.973 19.330 -0.357 18321 24153 1 18 . 1 1 257 257 ALA H H 257 8.529 8.529 8.208 0.321 18321 24154 1 18 . 1 1 258 258 LEU N N 258 119.300 119.300 124.794 -5.494 18321 24155 1 18 . 1 1 258 258 LEU HA H 258 4.782 4.782 4.593 0.189 18321 24156 1 18 . 1 1 258 258 LEU CA C 258 53.259 53.259 53.701 -0.442 18321 24157 1 18 . 1 1 258 258 LEU CB C 258 45.972 45.972 44.668 1.304 18321 24158 1 18 . 1 1 258 258 LEU H H 258 8.505 8.505 8.459 0.046 18321 24159 1 18 . 1 1 259 259 GLU N N 259 123.919 123.919 122.860 1.059 18321 24160 1 18 . 1 1 259 259 GLU HA H 259 4.516 4.516 4.416 0.100 18321 24161 1 18 . 1 1 259 259 GLU C C 259 175.795 175.795 175.446 0.349 18321 24162 1 18 . 1 1 259 259 GLU CA C 259 52.896 52.896 54.934 -2.038 18321 24163 1 18 . 1 1 259 259 GLU H H 259 8.943 8.943 8.623 0.320 18321 24164 1 18 . 1 1 260 260 VAL N N 260 122.122 122.122 125.308 -3.186 18321 24165 1 18 . 1 1 260 260 VAL HA H 260 2.923 2.923 3.987 -1.064 18321 24166 1 18 . 1 1 260 260 VAL C C 260 177.964 177.964 176.882 1.082 18321 24167 1 18 . 1 1 260 260 VAL CA C 260 65.417 65.417 63.099 2.318 18321 24168 1 18 . 1 1 260 260 VAL CB C 260 30.668 30.668 31.432 -0.764 18321 24169 1 18 . 1 1 260 260 VAL H H 260 8.956 8.956 8.557 0.399 18321 24170 1 18 . 1 1 261 261 GLY N N 261 116.009 116.009 117.157 -1.148 18321 24171 1 18 . 1 1 261 261 GLY C C 261 176.288 176.288 173.209 3.079 18321 24172 1 18 . 1 1 261 261 GLY CA C 261 44.210 44.210 44.672 -0.462 18321 24173 1 18 . 1 1 261 261 GLY H H 261 8.799 8.799 8.817 -0.018 18321 24174 1 18 . 1 1 262 262 ASP N N 262 121.945 121.945 120.641 1.304 18321 24175 1 18 . 1 1 262 262 ASP HA H 262 4.423 4.423 4.927 -0.504 18321 24176 1 18 . 1 1 262 262 ASP C C 262 175.381 175.381 175.133 0.248 18321 24177 1 18 . 1 1 262 262 ASP CA C 262 55.243 55.243 52.199 3.044 18321 24178 1 18 . 1 1 262 262 ASP CB C 262 41.819 41.819 42.880 -1.061 18321 24179 1 18 . 1 1 262 262 ASP H H 262 8.180 8.180 7.811 0.369 18321 24180 1 18 . 1 1 263 263 ILE N N 263 121.452 121.452 122.048 -0.596 18321 24181 1 18 . 1 1 263 263 ILE HA H 263 4.707 4.707 4.584 0.123 18321 24182 1 18 . 1 1 263 263 ILE C C 263 174.996 174.996 176.191 -1.195 18321 24183 1 18 . 1 1 263 263 ILE CA C 263 59.289 59.289 59.930 -0.641 18321 24184 1 18 . 1 1 263 263 ILE CB C 263 36.987 36.987 37.825 -0.838 18321 24185 1 18 . 1 1 263 263 ILE H H 263 8.460 8.460 8.488 -0.028 18321 24186 1 18 . 1 1 264 264 VAL N N 264 128.756 128.756 129.812 -1.056 18321 24187 1 18 . 1 1 264 264 VAL HA H 264 4.309 4.309 4.210 0.099 18321 24188 1 18 . 1 1 264 264 VAL C C 264 175.486 175.486 174.869 0.617 18321 24189 1 18 . 1 1 264 264 VAL CA C 264 59.091 59.091 60.797 -1.706 18321 24190 1 18 . 1 1 264 264 VAL CB C 264 34.541 34.541 30.888 3.653 18321 24191 1 18 . 1 1 264 264 VAL H H 264 9.479 9.479 9.311 0.168 18321 24192 1 18 . 1 1 265 265 LYS N N 265 128.101 128.101 130.142 -2.041 18321 24193 1 18 . 1 1 265 265 LYS HA H 265 4.342 4.342 4.348 -0.006 18321 24194 1 18 . 1 1 265 265 LYS C C 265 175.531 175.531 175.071 0.460 18321 24195 1 18 . 1 1 265 265 LYS CA C 265 55.620 55.620 56.065 -0.445 18321 24196 1 18 . 1 1 265 265 LYS CB C 265 33.149 33.149 32.324 0.825 18321 24197 1 18 . 1 1 265 265 LYS H H 265 8.715 8.715 8.679 0.036 18321 24198 1 18 . 1 1 266 266 VAL N N 266 129.537 129.537 127.934 1.603 18321 24199 1 18 . 1 1 266 266 VAL HA H 266 4.333 4.333 4.370 -0.037 18321 24200 1 18 . 1 1 266 266 VAL C C 266 176.166 176.166 174.288 1.878 18321 24201 1 18 . 1 1 266 266 VAL CA C 266 63.339 63.339 61.676 1.663 18321 24202 1 18 . 1 1 266 266 VAL CB C 266 30.712 30.712 33.666 -2.954 18321 24203 1 18 . 1 1 266 266 VAL H H 266 9.073 9.073 8.352 0.721 18321 24204 1 18 . 1 1 267 267 THR N N 267 120.020 120.020 124.553 -4.533 18321 24205 1 18 . 1 1 267 267 THR HA H 267 4.189 4.189 4.316 -0.127 18321 24206 1 18 . 1 1 267 267 THR C C 267 176.054 176.054 174.944 1.110 18321 24207 1 18 . 1 1 267 267 THR CA C 267 62.204 62.204 64.084 -1.880 18321 24208 1 18 . 1 1 267 267 THR CB C 267 68.200 68.200 69.437 -1.237 18321 24209 1 18 . 1 1 267 267 THR H H 267 9.130 9.130 8.415 0.715 18321 24210 1 18 . 1 1 268 268 ARG N N 268 120.839 120.839 121.253 -0.414 18321 24211 1 18 . 1 1 268 268 ARG HA H 268 4.236 4.236 4.636 -0.400 18321 24212 1 18 . 1 1 268 268 ARG CA C 268 56.321 56.321 54.110 2.211 18321 24213 1 18 . 1 1 268 268 ARG CB C 268 33.049 33.049 31.928 1.121 18321 24214 1 18 . 1 1 268 268 ARG H H 268 7.631 7.631 8.189 -0.558 18321 24215 1 18 . 1 1 269 269 MET N N 269 125.443 125.443 123.147 2.296 18321 24216 1 18 . 1 1 269 269 MET C C 269 174.392 174.392 175.013 -0.621 18321 24217 1 18 . 1 1 269 269 MET H H 269 8.532 8.532 8.545 -0.013 18321 24218 1 18 . 1 1 270 270 ASN N N 270 119.125 119.125 123.907 -4.782 18321 24219 1 18 . 1 1 270 270 ASN HA H 270 4.546 4.546 5.052 -0.506 18321 24220 1 18 . 1 1 270 270 ASN C C 270 172.133 172.133 175.843 -3.710 18321 24221 1 18 . 1 1 270 270 ASN CA C 270 53.639 53.639 52.539 1.099 18321 24222 1 18 . 1 1 270 270 ASN CB C 270 39.845 39.845 40.545 -0.700 18321 24223 1 18 . 1 1 270 270 ASN H H 270 6.631 6.631 8.947 -2.316 18321 24224 1 18 . 1 1 271 271 ILE N N 271 122.532 122.532 118.337 4.195 18321 24225 1 18 . 1 1 271 271 ILE HA H 271 4.417 4.417 4.164 0.253 18321 24226 1 18 . 1 1 271 271 ILE CA C 271 63.348 63.348 63.017 0.331 18321 24227 1 18 . 1 1 271 271 ILE CB C 271 38.198 38.198 36.875 1.323 18321 24228 1 18 . 1 1 271 271 ILE H H 271 8.565 8.565 8.410 0.155 18321 24229 1 18 . 1 1 272 272 ASN HA H 272 4.527 4.527 4.646 -0.119 18321 24230 1 18 . 1 1 272 272 ASN C C 272 176.259 176.259 176.264 -0.005 18321 24231 1 18 . 1 1 272 272 ASN CA C 272 53.225 53.225 53.380 -0.155 18321 24232 1 18 . 1 1 272 272 ASN CB C 272 37.565 37.565 38.634 -1.069 18321 24233 1 18 . 1 1 273 273 GLY N N 273 107.043 107.043 107.916 -0.873 18321 24234 1 18 . 1 1 273 273 GLY C C 273 173.216 173.216 172.827 0.389 18321 24235 1 18 . 1 1 273 273 GLY CA C 273 45.299 45.299 44.926 0.373 18321 24236 1 18 . 1 1 273 273 GLY H H 273 8.086 8.086 7.802 0.284 18321 24237 1 18 . 1 1 274 274 GLN N N 274 120.624 120.624 121.205 -0.581 18321 24238 1 18 . 1 1 274 274 GLN HA H 274 4.551 4.551 4.528 0.023 18321 24239 1 18 . 1 1 274 274 GLN C C 274 175.039 175.039 175.407 -0.368 18321 24240 1 18 . 1 1 274 274 GLN CA C 274 54.556 54.556 55.133 -0.577 18321 24241 1 18 . 1 1 274 274 GLN CB C 274 33.698 33.698 29.753 3.945 18321 24242 1 18 . 1 1 274 274 GLN H H 274 8.045 8.045 7.573 0.472 18321 24243 1 18 . 1 1 275 275 TRP N N 275 125.596 125.596 124.916 0.680 18321 24244 1 18 . 1 1 275 275 TRP HA H 275 4.588 4.588 4.694 -0.106 18321 24245 1 18 . 1 1 275 275 TRP C C 275 172.832 172.832 175.683 -2.851 18321 24246 1 18 . 1 1 275 275 TRP CA C 275 55.296 55.296 53.880 1.416 18321 24247 1 18 . 1 1 275 275 TRP CB C 275 31.393 31.393 30.768 0.625 18321 24248 1 18 . 1 1 275 275 TRP H H 275 8.484 8.484 8.622 -0.138 18321 24249 1 18 . 1 1 276 276 GLU N N 276 119.012 119.012 122.245 -3.233 18321 24250 1 18 . 1 1 276 276 GLU HA H 276 5.190 5.190 5.344 -0.154 18321 24251 1 18 . 1 1 276 276 GLU C C 276 176.553 176.553 175.798 0.755 18321 24252 1 18 . 1 1 276 276 GLU CA C 276 54.288 54.288 55.018 -0.730 18321 24253 1 18 . 1 1 276 276 GLU CB C 276 32.851 32.851 31.827 1.024 18321 24254 1 18 . 1 1 276 276 GLU H H 276 8.643 8.643 9.055 -0.412 18321 24255 1 18 . 1 1 277 277 GLY N N 277 111.364 111.364 113.025 -1.661 18321 24256 1 18 . 1 1 277 277 GLY C C 277 170.707 170.707 172.106 -1.399 18321 24257 1 18 . 1 1 277 277 GLY CA C 277 46.723 46.723 44.107 2.616 18321 24258 1 18 . 1 1 277 277 GLY H H 277 9.072 9.072 8.435 0.637 18321 24259 1 18 . 1 1 278 278 GLU N N 278 117.733 117.733 123.207 -5.474 18321 24260 1 18 . 1 1 278 278 GLU HA H 278 5.748 5.748 4.984 0.764 18321 24261 1 18 . 1 1 278 278 GLU C C 278 176.051 176.051 175.281 0.770 18321 24262 1 18 . 1 1 278 278 GLU CA C 278 53.620 53.620 55.144 -1.524 18321 24263 1 18 . 1 1 278 278 GLU CB C 278 33.742 33.742 31.488 2.254 18321 24264 1 18 . 1 1 278 278 GLU H H 278 8.810 8.810 8.185 0.625 18321 24265 1 18 . 1 1 279 279 VAL N N 279 123.834 123.834 126.672 -2.838 18321 24266 1 18 . 1 1 279 279 VAL HA H 279 4.404 4.404 4.413 -0.009 18321 24267 1 18 . 1 1 279 279 VAL C C 279 175.289 175.289 175.599 -0.310 18321 24268 1 18 . 1 1 279 279 VAL CA C 279 61.166 61.166 60.117 1.050 18321 24269 1 18 . 1 1 279 279 VAL CB C 279 34.123 34.123 34.601 -0.478 18321 24270 1 18 . 1 1 279 279 VAL H H 279 8.887 8.887 9.173 -0.286 18321 24271 1 18 . 1 1 280 280 ASN N N 280 126.025 126.025 126.463 -0.438 18321 24272 1 18 . 1 1 280 280 ASN HA H 280 4.435 4.435 4.442 -0.007 18321 24273 1 18 . 1 1 280 280 ASN C C 280 175.205 175.205 175.658 -0.453 18321 24274 1 18 . 1 1 280 280 ASN CA C 280 45.615 45.615 53.878 -8.263 18321 24275 1 18 . 1 1 280 280 ASN CB C 280 37.386 37.386 37.458 -0.072 18321 24276 1 18 . 1 1 280 280 ASN H H 280 9.322 9.322 9.260 0.062 18321 24277 1 18 . 1 1 281 281 GLY N N 281 104.588 104.588 102.780 1.808 18321 24278 1 18 . 1 1 281 281 GLY C C 281 173.944 173.944 173.652 0.292 18321 24279 1 18 . 1 1 281 281 GLY CA C 281 45.224 45.224 44.973 0.251 18321 24280 1 18 . 1 1 281 281 GLY H H 281 8.768 8.768 8.316 0.452 18321 24281 1 18 . 1 1 282 282 ARG N N 282 122.567 122.567 122.319 0.248 18321 24282 1 18 . 1 1 282 282 ARG HA H 282 4.559 4.559 4.612 -0.052 18321 24283 1 18 . 1 1 282 282 ARG C C 282 174.350 174.350 174.513 -0.163 18321 24284 1 18 . 1 1 282 282 ARG CA C 282 54.933 54.933 54.922 0.011 18321 24285 1 18 . 1 1 282 282 ARG CB C 282 31.765 31.765 32.472 -0.707 18321 24286 1 18 . 1 1 282 282 ARG H H 282 8.149 8.149 8.045 0.104 18321 24287 1 18 . 1 1 283 283 LYS N N 283 121.565 121.565 124.062 -2.497 18321 24288 1 18 . 1 1 283 283 LYS HA H 283 5.584 5.584 5.570 0.014 18321 24289 1 18 . 1 1 283 283 LYS CA C 283 54.143 54.143 54.919 -0.776 18321 24290 1 18 . 1 1 283 283 LYS CB C 283 36.040 36.040 34.807 1.233 18321 24291 1 18 . 1 1 283 283 LYS H H 283 8.424 8.424 8.632 -0.208 18321 24292 1 18 . 1 1 284 284 GLY C C 284 173.006 173.006 172.226 0.780 18321 24293 1 18 . 1 1 284 284 GLY CA C 284 45.886 45.886 45.025 0.861 18321 24294 1 18 . 1 1 285 285 LEU N N 285 119.673 119.673 121.085 -1.412 18321 24295 1 18 . 1 1 285 285 LEU HA H 285 5.718 5.718 5.625 0.093 18321 24296 1 18 . 1 1 285 285 LEU C C 285 178.657 178.657 176.185 2.472 18321 24297 1 18 . 1 1 285 285 LEU CA C 285 53.656 53.656 53.713 -0.057 18321 24298 1 18 . 1 1 285 285 LEU CB C 285 44.813 44.813 43.441 1.372 18321 24299 1 18 . 1 1 285 285 LEU H H 285 8.734 8.734 8.803 -0.069 18321 24300 1 18 . 1 1 286 286 PHE N N 286 118.785 118.785 120.463 -1.678 18321 24301 1 18 . 1 1 286 286 PHE HA H 286 4.521 4.521 5.108 -0.587 18321 24302 1 18 . 1 1 286 286 PHE CA C 286 57.592 57.592 54.284 3.308 18321 24303 1 18 . 1 1 286 286 PHE CB C 286 40.669 40.669 40.422 0.247 18321 24304 1 18 . 1 1 286 286 PHE H H 286 9.120 9.120 8.815 0.305 18321 24305 1 18 . 1 1 287 287 PRO HA H 287 4.385 4.385 4.736 -0.351 18321 24306 1 18 . 1 1 287 287 PRO CA C 287 62.814 62.814 61.946 0.868 18321 24307 1 18 . 1 1 287 287 PRO CB C 287 32.133 32.133 32.031 0.102 18321 24308 1 18 . 1 1 288 288 PHE C C 288 174.837 174.837 176.334 -1.497 18321 24309 1 18 . 1 1 288 288 PHE CA C 288 59.020 59.020 59.704 -0.684 18321 24310 1 18 . 1 1 288 288 PHE CB C 288 34.987 34.987 37.019 -2.031 18321 24311 1 18 . 1 1 289 289 THR N N 289 107.865 107.865 114.209 -6.344 18321 24312 1 18 . 1 1 289 289 THR HA H 289 3.589 3.589 3.887 -0.298 18321 24313 1 18 . 1 1 289 289 THR C C 289 176.125 176.125 175.103 1.022 18321 24314 1 18 . 1 1 289 289 THR CA C 289 62.243 62.243 65.074 -2.831 18321 24315 1 18 . 1 1 289 289 THR CB C 289 69.365 69.365 68.190 1.175 18321 24316 1 18 . 1 1 289 289 THR H H 289 6.453 6.453 7.652 -1.199 18321 24317 1 18 . 1 1 290 290 HIS N N 290 119.462 119.462 116.857 2.605 18321 24318 1 18 . 1 1 290 290 HIS HA H 290 4.196 4.196 4.723 -0.527 18321 24319 1 18 . 1 1 290 290 HIS C C 290 175.165 175.165 174.055 1.110 18321 24320 1 18 . 1 1 290 290 HIS CA C 290 57.635 57.635 56.353 1.282 18321 24321 1 18 . 1 1 290 290 HIS CB C 290 29.840 29.840 31.624 -1.784 18321 24322 1 18 . 1 1 290 290 HIS H H 290 7.835 7.835 7.932 -0.097 18321 24323 1 18 . 1 1 291 291 VAL N N 291 110.050 110.050 113.247 -3.197 18321 24324 1 18 . 1 1 291 291 VAL HA H 291 5.445 5.445 5.141 0.304 18321 24325 1 18 . 1 1 291 291 VAL C C 291 173.386 173.386 175.067 -1.681 18321 24326 1 18 . 1 1 291 291 VAL CA C 291 57.794 57.794 59.008 -1.214 18321 24327 1 18 . 1 1 291 291 VAL CB C 291 35.784 35.784 35.306 0.478 18321 24328 1 18 . 1 1 291 291 VAL H H 291 7.562 7.562 7.291 0.271 18321 24329 1 18 . 1 1 292 292 LYS N N 292 119.445 119.445 120.914 -1.469 18321 24330 1 18 . 1 1 292 292 LYS HA H 292 4.857 4.857 4.853 0.004 18321 24331 1 18 . 1 1 292 292 LYS C C 292 176.512 176.512 175.529 0.983 18321 24332 1 18 . 1 1 292 292 LYS CA C 292 54.647 54.647 53.700 0.947 18321 24333 1 18 . 1 1 292 292 LYS CB C 292 35.665 35.665 36.709 -1.044 18321 24334 1 18 . 1 1 292 292 LYS H H 292 8.753 8.753 8.603 0.150 18321 24335 1 18 . 1 1 293 293 ILE N N 293 128.707 128.707 124.887 3.820 18321 24336 1 18 . 1 1 293 293 ILE HA H 293 4.509 4.509 4.414 0.095 18321 24337 1 18 . 1 1 293 293 ILE C C 293 175.666 175.666 176.912 -1.246 18321 24338 1 18 . 1 1 293 293 ILE CA C 293 62.563 62.563 60.686 1.877 18321 24339 1 18 . 1 1 293 293 ILE CB C 293 38.076 38.076 35.787 2.289 18321 24340 1 18 . 1 1 293 293 ILE H H 293 9.107 9.107 9.031 0.076 18321 24341 1 18 . 1 1 294 294 PHE N N 294 126.638 126.638 123.588 3.050 18321 24342 1 18 . 1 1 294 294 PHE HA H 294 4.898 4.898 4.799 0.099 18321 24343 1 18 . 1 1 294 294 PHE C C 294 175.838 175.838 175.793 0.045 18321 24344 1 18 . 1 1 294 294 PHE CA C 294 56.335 56.335 56.264 0.071 18321 24345 1 18 . 1 1 294 294 PHE CB C 294 41.196 41.196 39.920 1.276 18321 24346 1 18 . 1 1 294 294 PHE H H 294 8.716 8.716 8.589 0.127 18321 24347 1 18 . 1 1 295 295 ASP N N 295 122.961 122.961 121.100 1.861 18321 24348 1 18 . 1 1 295 295 ASP HA H 295 5.003 5.003 4.277 0.726 18321 24349 1 18 . 1 1 295 295 ASP CA C 295 50.602 50.602 54.200 -3.598 18321 24350 1 18 . 1 1 295 295 ASP CB C 295 40.754 40.754 40.538 0.216 18321 24351 1 18 . 1 1 295 295 ASP H H 295 8.418 8.418 8.232 0.186 18321 24352 1 18 . 1 1 296 296 PRO HA H 296 4.524 4.524 4.185 0.339 18321 24353 1 18 . 1 1 296 296 PRO C C 296 176.807 176.807 177.015 -0.208 18321 24354 1 18 . 1 1 296 296 PRO CA C 296 62.987 62.987 63.008 -0.021 18321 24355 1 18 . 1 1 296 296 PRO CB C 296 32.033 32.033 29.751 2.282 18321 24356 1 18 . 1 1 297 297 GLN N N 297 120.729 120.729 120.553 0.176 18321 24357 1 18 . 1 1 297 297 GLN HA H 297 4.274 4.274 3.793 0.481 18321 24358 1 18 . 1 1 297 297 GLN CA C 297 56.427 56.427 58.119 -1.692 18321 24359 1 18 . 1 1 297 297 GLN CB C 297 28.819 28.819 27.878 0.941 18321 24360 1 18 . 1 1 297 297 GLN H H 297 8.551 8.551 8.646 -0.095 18321 24361 1 18 . 1 1 299 299 PRO C C 299 176.936 176.936 176.435 0.501 18321 24362 1 18 . 1 1 299 299 PRO CA C 299 63.406 63.406 64.400 -0.994 18321 24363 1 18 . 1 1 299 299 PRO CB C 299 31.421 31.421 32.025 -0.604 18321 24364 1 18 . 1 1 300 300 ASP N N 300 119.609 119.609 120.045 -0.436 18321 24365 1 18 . 1 1 300 300 ASP C C 300 176.344 176.344 175.999 0.345 18321 24366 1 18 . 1 1 300 300 ASP CA C 300 54.178 54.178 55.741 -1.563 18321 24367 1 18 . 1 1 300 300 ASP CB C 300 40.661 40.661 39.940 0.721 18321 24368 1 18 . 1 1 300 300 ASP H H 300 8.239 8.239 8.467 -0.228 18321 24369 1 18 . 1 1 301 301 GLU N N 301 120.462 120.462 122.807 -2.345 18321 24370 1 18 . 1 1 301 301 GLU CA C 301 56.188 56.188 57.387 -1.199 18321 24371 1 18 . 1 1 301 301 GLU CB C 301 29.507 29.507 29.965 -0.458 18321 24372 1 18 . 1 1 301 301 GLU H H 301 8.084 8.084 8.390 -0.306 18321 24373 1 19 . 1 1 2 2 SER HA H 2 4.521 4.521 4.717 -0.196 18321 24374 1 19 . 1 1 2 2 SER CA C 2 58.326 58.326 58.326 -0.000 18321 24375 1 19 . 1 1 2 2 SER CB C 2 64.062 64.062 65.509 -1.447 18321 24376 1 19 . 1 1 3 3 SER HA H 3 4.465 4.465 4.286 0.179 18321 24377 1 19 . 1 1 3 3 SER C C 3 173.887 173.887 174.256 -0.369 18321 24378 1 19 . 1 1 3 3 SER CA C 3 58.374 58.374 59.291 -0.917 18321 24379 1 19 . 1 1 3 3 SER CB C 3 63.920 63.920 63.417 0.503 18321 24380 1 19 . 1 1 4 4 ALA N N 4 124.755 124.755 123.007 1.748 18321 24381 1 19 . 1 1 4 4 ALA HA H 4 4.547 4.547 4.646 -0.099 18321 24382 1 19 . 1 1 4 4 ALA CA C 4 52.737 52.737 52.505 0.232 18321 24383 1 19 . 1 1 4 4 ALA CB C 4 19.636 19.636 18.562 1.074 18321 24384 1 19 . 1 1 4 4 ALA H H 4 8.244 8.244 7.866 0.378 18321 24385 1 19 . 1 1 5 5 ARG N N 5 120.383 120.383 123.727 -3.344 18321 24386 1 19 . 1 1 5 5 ARG HA H 5 4.524 4.524 4.579 -0.055 18321 24387 1 19 . 1 1 5 5 ARG C C 5 175.611 175.611 174.964 0.647 18321 24388 1 19 . 1 1 5 5 ARG CA C 5 56.082 56.082 55.555 0.527 18321 24389 1 19 . 1 1 5 5 ARG CB C 5 30.695 30.695 30.380 0.315 18321 24390 1 19 . 1 1 5 5 ARG H H 5 8.727 8.727 8.087 0.640 18321 24391 1 19 . 1 1 6 6 PHE N N 6 115.159 115.159 117.593 -2.434 18321 24392 1 19 . 1 1 6 6 PHE HA H 6 4.786 4.786 4.840 -0.054 18321 24393 1 19 . 1 1 6 6 PHE C C 6 172.076 172.076 174.613 -2.537 18321 24394 1 19 . 1 1 6 6 PHE CA C 6 56.640 56.640 55.397 1.243 18321 24395 1 19 . 1 1 6 6 PHE CB C 6 40.378 40.378 40.948 -0.570 18321 24396 1 19 . 1 1 6 6 PHE H H 6 7.536 7.536 7.485 0.051 18321 24397 1 19 . 1 1 7 7 ASP N N 7 121.846 121.846 122.832 -0.986 18321 24398 1 19 . 1 1 7 7 ASP HA H 7 4.846 4.846 4.760 0.086 18321 24399 1 19 . 1 1 7 7 ASP CA C 7 52.327 52.327 54.166 -1.839 18321 24400 1 19 . 1 1 7 7 ASP CB C 7 41.298 41.298 41.989 -0.691 18321 24401 1 19 . 1 1 7 7 ASP H H 7 9.062 9.062 8.793 0.269 18321 24402 1 19 . 1 1 8 8 SER HA H 8 3.950 3.950 4.352 -0.402 18321 24403 1 19 . 1 1 8 8 SER C C 8 174.705 174.705 175.558 -0.853 18321 24404 1 19 . 1 1 8 8 SER CA C 8 61.937 61.937 60.549 1.388 18321 24405 1 19 . 1 1 8 8 SER CB C 8 62.260 62.260 63.157 -0.898 18321 24406 1 19 . 1 1 9 9 SER N N 9 114.373 114.373 112.891 1.482 18321 24407 1 19 . 1 1 9 9 SER HA H 9 4.529 4.529 4.728 -0.199 18321 24408 1 19 . 1 1 9 9 SER C C 9 175.089 175.089 174.411 0.678 18321 24409 1 19 . 1 1 9 9 SER CA C 9 59.851 59.851 58.319 1.532 18321 24410 1 19 . 1 1 9 9 SER CB C 9 64.246 64.246 63.518 0.728 18321 24411 1 19 . 1 1 9 9 SER H H 9 8.722 8.722 8.077 0.645 18321 24412 1 19 . 1 1 10 10 ASP N N 10 121.818 121.818 123.851 -2.033 18321 24413 1 19 . 1 1 10 10 ASP HA H 10 4.730 4.730 4.650 0.080 18321 24414 1 19 . 1 1 10 10 ASP C C 10 174.455 174.455 176.401 -1.946 18321 24415 1 19 . 1 1 10 10 ASP CA C 10 52.432 52.432 53.757 -1.325 18321 24416 1 19 . 1 1 10 10 ASP CB C 10 39.607 39.607 40.998 -1.391 18321 24417 1 19 . 1 1 10 10 ASP H H 10 7.600 7.600 7.998 -0.398 18321 24418 1 19 . 1 1 11 11 ARG N N 11 125.238 125.238 125.901 -0.663 18321 24419 1 19 . 1 1 11 11 ARG HA H 11 1.936 1.936 2.410 -0.474 18321 24420 1 19 . 1 1 11 11 ARG C C 11 176.916 176.916 176.586 0.330 18321 24421 1 19 . 1 1 11 11 ARG CA C 11 57.451 57.451 58.956 -1.505 18321 24422 1 19 . 1 1 11 11 ARG CB C 11 43.014 43.014 29.869 13.145 18321 24423 1 19 . 1 1 11 11 ARG H H 11 7.739 7.739 7.815 -0.076 18321 24424 1 19 . 1 1 12 12 SER N N 12 112.065 112.065 112.322 -0.257 18321 24425 1 19 . 1 1 12 12 SER HA H 12 4.695 4.695 4.219 0.476 18321 24426 1 19 . 1 1 12 12 SER C C 12 175.092 175.092 174.031 1.061 18321 24427 1 19 . 1 1 12 12 SER CA C 12 60.785 60.785 60.006 0.779 18321 24428 1 19 . 1 1 12 12 SER CB C 12 62.889 62.889 62.298 0.591 18321 24429 1 19 . 1 1 12 12 SER H H 12 7.888 7.888 8.145 -0.257 18321 24430 1 19 . 1 1 13 13 ALA N N 13 122.249 122.249 122.440 -0.191 18321 24431 1 19 . 1 1 13 13 ALA HA H 13 4.216 4.216 4.675 -0.459 18321 24432 1 19 . 1 1 13 13 ALA C C 13 178.069 178.069 177.417 0.652 18321 24433 1 19 . 1 1 13 13 ALA CA C 13 53.562 53.562 53.532 0.030 18321 24434 1 19 . 1 1 13 13 ALA CB C 13 19.339 19.339 19.814 -0.475 18321 24435 1 19 . 1 1 13 13 ALA H H 13 7.418 7.418 7.578 -0.160 18321 24436 1 19 . 1 1 14 14 TRP N N 14 107.433 107.433 112.592 -5.159 18321 24437 1 19 . 1 1 14 14 TRP HA H 14 4.785 4.785 4.705 0.080 18321 24438 1 19 . 1 1 14 14 TRP C C 14 175.286 175.286 175.582 -0.296 18321 24439 1 19 . 1 1 14 14 TRP CA C 14 55.212 55.212 55.370 -0.158 18321 24440 1 19 . 1 1 14 14 TRP CB C 14 32.776 32.776 31.137 1.639 18321 24441 1 19 . 1 1 14 14 TRP H H 14 6.273 6.273 6.849 -0.576 18321 24442 1 19 . 1 1 15 15 TYR N N 15 122.315 122.315 124.108 -1.793 18321 24443 1 19 . 1 1 15 15 TYR HA H 15 5.436 5.436 5.009 0.427 18321 24444 1 19 . 1 1 15 15 TYR C C 15 175.325 175.325 175.052 0.273 18321 24445 1 19 . 1 1 15 15 TYR CA C 15 56.609 56.609 58.110 -1.501 18321 24446 1 19 . 1 1 15 15 TYR CB C 15 36.940 36.940 39.400 -2.460 18321 24447 1 19 . 1 1 15 15 TYR H H 15 8.221 8.221 7.908 0.313 18321 24448 1 19 . 1 1 16 16 MET N N 16 126.031 126.031 126.168 -0.137 18321 24449 1 19 . 1 1 16 16 MET HA H 16 4.462 4.462 4.451 0.011 18321 24450 1 19 . 1 1 16 16 MET CA C 16 53.046 53.046 53.072 -0.026 18321 24451 1 19 . 1 1 16 16 MET CB C 16 41.114 41.114 31.956 9.158 18321 24452 1 19 . 1 1 16 16 MET H H 16 8.989 8.989 8.691 0.298 18321 24453 1 19 . 1 1 17 17 GLY CA C 17 45.803 45.803 45.520 0.283 18321 24454 1 19 . 1 1 18 18 PRO HA H 18 4.675 4.675 4.413 0.262 18321 24455 1 19 . 1 1 18 18 PRO C C 18 175.943 175.943 175.754 0.189 18321 24456 1 19 . 1 1 18 18 PRO CA C 18 63.647 63.647 63.420 0.227 18321 24457 1 19 . 1 1 18 18 PRO CB C 18 29.276 29.276 30.520 -1.244 18321 24458 1 19 . 1 1 19 19 VAL N N 19 126.159 126.159 124.432 1.727 18321 24459 1 19 . 1 1 19 19 VAL HA H 19 4.011 4.011 4.400 -0.389 18321 24460 1 19 . 1 1 19 19 VAL C C 19 175.812 175.812 174.545 1.267 18321 24461 1 19 . 1 1 19 19 VAL CA C 19 62.355 62.355 60.643 1.712 18321 24462 1 19 . 1 1 19 19 VAL CB C 19 33.468 33.468 36.080 -2.612 18321 24463 1 19 . 1 1 19 19 VAL H H 19 7.851 7.851 7.791 0.060 18321 24464 1 19 . 1 1 20 20 SER N N 20 123.950 123.950 116.939 7.011 18321 24465 1 19 . 1 1 20 20 SER HA H 20 4.453 4.453 4.936 -0.483 18321 24466 1 19 . 1 1 20 20 SER CA C 20 57.631 57.631 55.514 2.117 18321 24467 1 19 . 1 1 20 20 SER CB C 20 65.951 65.951 64.808 1.143 18321 24468 1 19 . 1 1 20 20 SER H H 20 8.800 8.800 8.263 0.537 18321 24469 1 19 . 1 1 21 21 ARG N N 21 123.461 123.461 121.584 1.877 18321 24470 1 19 . 1 1 21 21 ARG HA H 21 3.489 3.489 4.069 -0.580 18321 24471 1 19 . 1 1 21 21 ARG C C 21 178.164 178.164 178.276 -0.112 18321 24472 1 19 . 1 1 21 21 ARG CA C 21 60.025 60.025 60.470 -0.445 18321 24473 1 19 . 1 1 21 21 ARG CB C 21 30.334 30.334 30.163 0.171 18321 24474 1 19 . 1 1 21 21 ARG H H 21 9.307 9.307 8.852 0.455 18321 24475 1 19 . 1 1 22 22 GLN N N 22 116.591 116.591 118.412 -1.821 18321 24476 1 19 . 1 1 22 22 GLN HA H 22 4.008 4.008 4.033 -0.025 18321 24477 1 19 . 1 1 22 22 GLN CA C 22 59.095 59.095 59.612 -0.517 18321 24478 1 19 . 1 1 22 22 GLN CB C 22 29.249 29.249 28.092 1.157 18321 24479 1 19 . 1 1 22 22 GLN H H 22 8.394 8.394 8.697 -0.303 18321 24480 1 19 . 1 1 23 23 GLU N N 23 122.191 122.191 119.342 2.849 18321 24481 1 19 . 1 1 23 23 GLU HA H 23 4.037 4.037 4.066 -0.029 18321 24482 1 19 . 1 1 23 23 GLU C C 23 178.986 178.986 178.689 0.297 18321 24483 1 19 . 1 1 23 23 GLU CA C 23 59.081 59.081 59.302 -0.221 18321 24484 1 19 . 1 1 23 23 GLU CB C 23 31.896 31.896 28.784 3.112 18321 24485 1 19 . 1 1 23 23 GLU H H 23 8.106 8.106 8.642 -0.536 18321 24486 1 19 . 1 1 24 24 ALA N N 24 121.964 121.964 121.381 0.583 18321 24487 1 19 . 1 1 24 24 ALA HA H 24 3.762 3.762 3.934 -0.172 18321 24488 1 19 . 1 1 24 24 ALA C C 24 178.653 178.653 179.468 -0.815 18321 24489 1 19 . 1 1 24 24 ALA CA C 24 55.480 55.480 55.349 0.131 18321 24490 1 19 . 1 1 24 24 ALA CB C 24 18.049 18.049 18.477 -0.428 18321 24491 1 19 . 1 1 24 24 ALA H H 24 8.732 8.732 8.324 0.408 18321 24492 1 19 . 1 1 25 25 GLN N N 25 116.229 116.229 117.805 -1.576 18321 24493 1 19 . 1 1 25 25 GLN HA H 25 3.950 3.950 4.117 -0.167 18321 24494 1 19 . 1 1 25 25 GLN C C 25 177.442 177.442 178.436 -0.994 18321 24495 1 19 . 1 1 25 25 GLN CA C 25 59.651 59.651 58.402 1.249 18321 24496 1 19 . 1 1 25 25 GLN CB C 25 29.308 29.308 28.558 0.750 18321 24497 1 19 . 1 1 25 25 GLN H H 25 8.391 8.391 8.229 0.162 18321 24498 1 19 . 1 1 26 26 THR N N 26 115.105 115.105 114.058 1.047 18321 24499 1 19 . 1 1 26 26 THR HA H 26 3.920 3.920 4.177 -0.257 18321 24500 1 19 . 1 1 26 26 THR C C 26 176.835 176.835 176.784 0.051 18321 24501 1 19 . 1 1 26 26 THR CA C 26 66.335 66.335 64.300 2.035 18321 24502 1 19 . 1 1 26 26 THR CB C 26 68.876 68.876 68.908 -0.032 18321 24503 1 19 . 1 1 26 26 THR H H 26 8.223 8.223 8.203 0.020 18321 24504 1 19 . 1 1 27 27 ARG N N 27 119.096 119.096 117.888 1.208 18321 24505 1 19 . 1 1 27 27 ARG HA H 27 4.047 4.047 4.250 -0.203 18321 24506 1 19 . 1 1 27 27 ARG C C 27 177.245 177.245 176.387 0.858 18321 24507 1 19 . 1 1 27 27 ARG CA C 27 58.528 58.528 58.177 0.351 18321 24508 1 19 . 1 1 27 27 ARG CB C 27 30.184 30.184 30.693 -0.509 18321 24509 1 19 . 1 1 27 27 ARG H H 27 8.093 8.093 7.880 0.213 18321 24510 1 19 . 1 1 28 28 LEU N N 28 114.602 114.602 116.020 -1.418 18321 24511 1 19 . 1 1 28 28 LEU HA H 28 4.325 4.325 4.529 -0.204 18321 24512 1 19 . 1 1 28 28 LEU C C 28 177.197 177.197 176.143 1.054 18321 24513 1 19 . 1 1 28 28 LEU CA C 28 55.143 55.143 53.764 1.379 18321 24514 1 19 . 1 1 28 28 LEU CB C 28 44.902 44.902 43.272 1.630 18321 24515 1 19 . 1 1 28 28 LEU H H 28 7.438 7.438 7.161 0.277 18321 24516 1 19 . 1 1 29 29 GLN N N 29 121.312 121.312 119.721 1.591 18321 24517 1 19 . 1 1 29 29 GLN HA H 29 3.856 3.856 4.110 -0.254 18321 24518 1 19 . 1 1 29 29 GLN C C 29 178.048 178.048 176.691 1.357 18321 24519 1 19 . 1 1 29 29 GLN CA C 29 57.691 57.691 57.099 0.592 18321 24520 1 19 . 1 1 29 29 GLN CB C 29 27.293 27.293 27.979 -0.686 18321 24521 1 19 . 1 1 29 29 GLN H H 29 8.250 8.250 7.591 0.659 18321 24522 1 19 . 1 1 30 30 GLY N N 30 116.768 116.768 114.896 1.872 18321 24523 1 19 . 1 1 30 30 GLY C C 30 174.914 174.914 174.407 0.507 18321 24524 1 19 . 1 1 30 30 GLY CA C 30 45.491 45.491 45.629 -0.138 18321 24525 1 19 . 1 1 30 30 GLY H H 30 9.135 9.135 8.378 0.757 18321 24526 1 19 . 1 1 31 31 GLN N N 31 117.979 117.979 119.278 -1.299 18321 24527 1 19 . 1 1 31 31 GLN HA H 31 4.329 4.329 4.225 0.104 18321 24528 1 19 . 1 1 31 31 GLN C C 31 177.174 177.174 176.964 0.210 18321 24529 1 19 . 1 1 31 31 GLN CA C 31 53.910 53.910 55.254 -1.344 18321 24530 1 19 . 1 1 31 31 GLN CB C 31 29.574 29.574 29.203 0.371 18321 24531 1 19 . 1 1 31 31 GLN H H 31 7.695 7.695 7.537 0.158 18321 24532 1 19 . 1 1 32 32 ARG N N 32 123.918 123.918 121.468 2.450 18321 24533 1 19 . 1 1 32 32 ARG HA H 32 3.940 3.940 4.221 -0.281 18321 24534 1 19 . 1 1 32 32 ARG C C 32 175.810 175.810 176.604 -0.794 18321 24535 1 19 . 1 1 32 32 ARG CA C 32 56.770 56.770 56.569 0.201 18321 24536 1 19 . 1 1 32 32 ARG CB C 32 30.074 30.074 30.136 -0.062 18321 24537 1 19 . 1 1 32 32 ARG H H 32 8.955 8.955 8.684 0.271 18321 24538 1 19 . 1 1 33 33 HIS N N 33 122.248 122.248 125.601 -3.353 18321 24539 1 19 . 1 1 33 33 HIS HA H 33 4.627 4.627 4.388 0.239 18321 24540 1 19 . 1 1 33 33 HIS C C 33 177.089 177.089 175.712 1.377 18321 24541 1 19 . 1 1 33 33 HIS CA C 33 55.858 55.858 57.160 -1.302 18321 24542 1 19 . 1 1 33 33 HIS CB C 33 28.648 28.648 29.797 -1.149 18321 24543 1 19 . 1 1 33 33 HIS H H 33 8.302 8.302 9.452 -1.150 18321 24544 1 19 . 1 1 34 34 GLY N N 34 109.518 109.518 111.919 -2.401 18321 24545 1 19 . 1 1 34 34 GLY C C 34 176.730 176.730 173.690 3.040 18321 24546 1 19 . 1 1 34 34 GLY CA C 34 45.967 45.967 44.914 1.053 18321 24547 1 19 . 1 1 34 34 GLY H H 34 9.496 9.496 9.278 0.218 18321 24548 1 19 . 1 1 35 35 MET N N 35 125.193 125.193 123.494 1.699 18321 24549 1 19 . 1 1 35 35 MET HA H 35 5.750 5.750 5.829 -0.079 18321 24550 1 19 . 1 1 35 35 MET C C 35 174.388 174.388 174.340 0.048 18321 24551 1 19 . 1 1 35 35 MET CA C 35 55.762 55.762 55.743 0.019 18321 24552 1 19 . 1 1 35 35 MET CB C 35 32.706 32.706 33.975 -1.269 18321 24553 1 19 . 1 1 35 35 MET H H 35 8.359 8.359 7.675 0.684 18321 24554 1 19 . 1 1 36 36 PHE N N 36 123.311 123.311 121.968 1.343 18321 24555 1 19 . 1 1 36 36 PHE HA H 36 5.985 5.985 5.780 0.205 18321 24556 1 19 . 1 1 36 36 PHE C C 36 172.140 172.140 172.937 -0.797 18321 24557 1 19 . 1 1 36 36 PHE CA C 36 55.755 55.755 54.792 0.963 18321 24558 1 19 . 1 1 36 36 PHE CB C 36 45.197 45.197 42.558 2.639 18321 24559 1 19 . 1 1 36 36 PHE H H 36 8.261 8.261 7.737 0.524 18321 24560 1 19 . 1 1 37 37 LEU N N 37 114.652 114.652 116.122 -1.470 18321 24561 1 19 . 1 1 37 37 LEU HA H 37 4.489 4.489 5.136 -0.647 18321 24562 1 19 . 1 1 37 37 LEU C C 37 174.033 174.033 174.920 -0.887 18321 24563 1 19 . 1 1 37 37 LEU CA C 37 55.382 55.382 54.467 0.915 18321 24564 1 19 . 1 1 37 37 LEU CB C 37 44.791 44.791 45.650 -0.859 18321 24565 1 19 . 1 1 37 37 LEU H H 37 9.292 9.292 8.959 0.333 18321 24566 1 19 . 1 1 38 38 VAL N N 38 121.009 121.009 122.009 -1.000 18321 24567 1 19 . 1 1 38 38 VAL HA H 38 5.504 5.504 4.823 0.681 18321 24568 1 19 . 1 1 38 38 VAL C C 38 173.581 173.581 175.314 -1.733 18321 24569 1 19 . 1 1 38 38 VAL CA C 38 61.316 61.316 61.582 -0.266 18321 24570 1 19 . 1 1 38 38 VAL CB C 38 33.302 33.302 33.059 0.243 18321 24571 1 19 . 1 1 38 38 VAL H H 38 8.991 8.991 8.520 0.471 18321 24572 1 19 . 1 1 39 39 ARG N N 39 124.863 124.863 127.033 -2.170 18321 24573 1 19 . 1 1 39 39 ARG HA H 39 5.444 5.444 4.919 0.525 18321 24574 1 19 . 1 1 39 39 ARG C C 39 175.772 175.772 174.700 1.072 18321 24575 1 19 . 1 1 39 39 ARG CA C 39 52.558 52.558 53.138 -0.580 18321 24576 1 19 . 1 1 39 39 ARG CB C 39 34.980 34.980 32.932 2.048 18321 24577 1 19 . 1 1 39 39 ARG H H 39 9.569 9.569 8.438 1.131 18321 24578 1 19 . 1 1 40 40 ASP N N 40 122.330 122.330 120.208 2.122 18321 24579 1 19 . 1 1 40 40 ASP HA H 40 4.785 4.785 5.052 -0.267 18321 24580 1 19 . 1 1 40 40 ASP C C 40 176.332 176.332 175.911 0.421 18321 24581 1 19 . 1 1 40 40 ASP CA C 40 55.334 55.334 54.573 0.761 18321 24582 1 19 . 1 1 40 40 ASP CB C 40 40.650 40.650 42.041 -1.391 18321 24583 1 19 . 1 1 40 40 ASP H H 40 8.413 8.413 8.461 -0.048 18321 24584 1 19 . 1 1 41 41 SER N N 41 114.363 114.363 121.294 -6.931 18321 24585 1 19 . 1 1 41 41 SER HA H 41 4.506 4.506 4.443 0.063 18321 24586 1 19 . 1 1 41 41 SER CA C 41 57.525 57.525 58.896 -1.371 18321 24587 1 19 . 1 1 41 41 SER CB C 41 63.706 63.706 63.733 -0.027 18321 24588 1 19 . 1 1 41 41 SER H H 41 7.791 7.791 8.515 -0.724 18321 24589 1 19 . 1 1 42 42 SER N N 42 126.932 126.932 123.161 3.771 18321 24590 1 19 . 1 1 42 42 SER HA H 42 4.410 4.410 4.457 -0.047 18321 24591 1 19 . 1 1 42 42 SER CA C 42 60.362 60.362 59.549 0.813 18321 24592 1 19 . 1 1 42 42 SER CB C 42 63.707 63.707 63.065 0.642 18321 24593 1 19 . 1 1 42 42 SER H H 42 10.519 10.519 9.101 1.418 18321 24594 1 19 . 1 1 43 43 THR HA H 43 4.097 4.097 4.166 -0.069 18321 24595 1 19 . 1 1 43 43 THR CA C 43 64.722 64.722 64.704 0.018 18321 24596 1 19 . 1 1 43 43 THR CB C 43 69.439 69.439 69.336 0.103 18321 24597 1 19 . 1 1 44 44 CYS HA H 44 5.100 5.100 4.934 0.166 18321 24598 1 19 . 1 1 44 44 CYS CA C 44 51.779 51.779 56.223 -4.444 18321 24599 1 19 . 1 1 44 44 CYS CB C 44 41.314 41.314 29.347 11.967 18321 24600 1 19 . 1 1 45 45 PRO HA H 45 4.278 4.278 4.513 -0.235 18321 24601 1 19 . 1 1 45 45 PRO C C 45 178.127 178.127 177.444 0.683 18321 24602 1 19 . 1 1 45 45 PRO CA C 45 64.151 64.151 64.725 -0.574 18321 24603 1 19 . 1 1 45 45 PRO CB C 45 31.596 31.596 31.401 0.195 18321 24604 1 19 . 1 1 46 46 GLY N N 46 114.947 114.947 114.329 0.618 18321 24605 1 19 . 1 1 46 46 GLY C C 46 174.701 174.701 174.221 0.480 18321 24606 1 19 . 1 1 46 46 GLY CA C 46 45.225 45.225 44.946 0.279 18321 24607 1 19 . 1 1 46 46 GLY H H 46 8.812 8.812 8.590 0.222 18321 24608 1 19 . 1 1 47 47 ASP N N 47 120.862 120.862 122.562 -1.700 18321 24609 1 19 . 1 1 47 47 ASP HA H 47 5.235 5.235 4.614 0.621 18321 24610 1 19 . 1 1 47 47 ASP C C 47 176.480 176.480 175.119 1.361 18321 24611 1 19 . 1 1 47 47 ASP CA C 47 53.591 53.591 55.102 -1.511 18321 24612 1 19 . 1 1 47 47 ASP CB C 47 41.707 41.707 41.891 -0.184 18321 24613 1 19 . 1 1 47 47 ASP H H 47 7.997 7.997 7.772 0.225 18321 24614 1 19 . 1 1 48 48 TYR N N 48 118.473 118.473 115.599 2.874 18321 24615 1 19 . 1 1 48 48 TYR HA H 48 5.431 5.431 5.376 0.055 18321 24616 1 19 . 1 1 48 48 TYR C C 48 173.783 173.783 175.662 -1.879 18321 24617 1 19 . 1 1 48 48 TYR CA C 48 56.891 56.891 56.346 0.545 18321 24618 1 19 . 1 1 48 48 TYR CB C 48 43.274 43.274 42.817 0.457 18321 24619 1 19 . 1 1 48 48 TYR H H 48 8.892 8.892 8.990 -0.098 18321 24620 1 19 . 1 1 49 49 VAL N N 49 119.105 119.105 119.870 -0.765 18321 24621 1 19 . 1 1 49 49 VAL HA H 49 4.800 4.800 4.584 0.216 18321 24622 1 19 . 1 1 49 49 VAL C C 49 174.397 174.397 174.614 -0.217 18321 24623 1 19 . 1 1 49 49 VAL CA C 49 61.439 61.439 62.017 -0.578 18321 24624 1 19 . 1 1 49 49 VAL CB C 49 35.388 35.388 33.913 1.475 18321 24625 1 19 . 1 1 49 49 VAL H H 49 9.661 9.661 8.734 0.927 18321 24626 1 19 . 1 1 50 50 LEU N N 50 129.599 129.599 131.431 -1.832 18321 24627 1 19 . 1 1 50 50 LEU HA H 50 5.033 5.033 5.056 -0.023 18321 24628 1 19 . 1 1 50 50 LEU C C 50 175.001 175.001 175.273 -0.272 18321 24629 1 19 . 1 1 50 50 LEU CA C 50 53.352 53.352 53.549 -0.197 18321 24630 1 19 . 1 1 50 50 LEU CB C 50 44.062 44.062 42.410 1.652 18321 24631 1 19 . 1 1 50 50 LEU H H 50 9.405 9.405 9.320 0.085 18321 24632 1 19 . 1 1 51 51 SER N N 51 126.895 126.895 124.564 2.331 18321 24633 1 19 . 1 1 51 51 SER HA H 51 5.731 5.731 5.069 0.662 18321 24634 1 19 . 1 1 51 51 SER C C 51 173.094 173.094 173.478 -0.384 18321 24635 1 19 . 1 1 51 51 SER CA C 51 58.834 58.834 57.261 1.573 18321 24636 1 19 . 1 1 51 51 SER CB C 51 64.977 64.977 63.815 1.162 18321 24637 1 19 . 1 1 51 51 SER H H 51 9.094 9.094 8.857 0.237 18321 24638 1 19 . 1 1 52 52 VAL N N 52 121.777 121.777 126.786 -5.009 18321 24639 1 19 . 1 1 52 52 VAL HA H 52 5.066 5.066 4.652 0.414 18321 24640 1 19 . 1 1 52 52 VAL C C 52 174.573 174.573 174.433 0.140 18321 24641 1 19 . 1 1 52 52 VAL CA C 52 59.535 59.535 61.054 -1.519 18321 24642 1 19 . 1 1 52 52 VAL CB C 52 36.834 36.834 34.840 1.994 18321 24643 1 19 . 1 1 52 52 VAL H H 52 8.816 8.816 8.913 -0.097 18321 24644 1 19 . 1 1 53 53 SER N N 53 120.489 120.489 121.410 -0.921 18321 24645 1 19 . 1 1 53 53 SER HA H 53 4.811 4.811 4.640 0.171 18321 24646 1 19 . 1 1 53 53 SER C C 53 174.065 174.065 173.048 1.017 18321 24647 1 19 . 1 1 53 53 SER CA C 53 57.496 57.496 57.737 -0.241 18321 24648 1 19 . 1 1 53 53 SER CB C 53 62.623 62.623 63.347 -0.724 18321 24649 1 19 . 1 1 53 53 SER H H 53 8.780 8.780 9.139 -0.359 18321 24650 1 19 . 1 1 54 54 GLU N N 54 132.020 132.020 127.100 4.920 18321 24651 1 19 . 1 1 54 54 GLU HA H 54 4.250 4.250 4.386 -0.136 18321 24652 1 19 . 1 1 54 54 GLU C C 54 175.387 175.387 174.885 0.502 18321 24653 1 19 . 1 1 54 54 GLU CA C 54 56.999 56.999 55.508 1.491 18321 24654 1 19 . 1 1 54 54 GLU CB C 54 32.556 32.556 34.008 -1.452 18321 24655 1 19 . 1 1 54 54 GLU H H 54 8.472 8.472 7.628 0.844 18321 24656 1 19 . 1 1 55 55 ASN N N 55 126.517 126.517 118.351 8.166 18321 24657 1 19 . 1 1 55 55 ASN HA H 55 4.220 4.220 4.056 0.164 18321 24658 1 19 . 1 1 55 55 ASN C C 55 174.546 174.546 174.763 -0.217 18321 24659 1 19 . 1 1 55 55 ASN CA C 55 54.770 54.770 53.660 1.110 18321 24660 1 19 . 1 1 55 55 ASN CB C 55 37.314 37.314 36.621 0.693 18321 24661 1 19 . 1 1 55 55 ASN H H 55 8.853 8.853 8.040 0.813 18321 24662 1 19 . 1 1 56 56 SER N N 56 112.009 112.009 108.622 3.387 18321 24663 1 19 . 1 1 56 56 SER HA H 56 4.334 4.334 4.250 0.084 18321 24664 1 19 . 1 1 56 56 SER C C 56 173.354 173.354 173.888 -0.534 18321 24665 1 19 . 1 1 56 56 SER CA C 56 59.966 59.966 60.022 -0.056 18321 24666 1 19 . 1 1 56 56 SER CB C 56 62.242 62.242 62.512 -0.270 18321 24667 1 19 . 1 1 56 56 SER H H 56 10.418 10.418 8.075 2.343 18321 24668 1 19 . 1 1 57 57 ARG N N 57 121.764 121.764 119.602 2.162 18321 24669 1 19 . 1 1 57 57 ARG HA H 57 5.167 5.167 4.339 0.828 18321 24670 1 19 . 1 1 57 57 ARG C C 57 174.983 174.983 174.208 0.775 18321 24671 1 19 . 1 1 57 57 ARG CA C 57 54.550 54.550 55.783 -1.233 18321 24672 1 19 . 1 1 57 57 ARG CB C 57 31.886 31.886 30.924 0.962 18321 24673 1 19 . 1 1 57 57 ARG H H 57 8.097 8.097 8.061 0.036 18321 24674 1 19 . 1 1 58 58 VAL N N 58 121.866 121.866 123.162 -1.296 18321 24675 1 19 . 1 1 58 58 VAL HA H 58 4.768 4.768 4.345 0.423 18321 24676 1 19 . 1 1 58 58 VAL C C 58 175.388 175.388 175.915 -0.527 18321 24677 1 19 . 1 1 58 58 VAL CA C 58 61.818 61.818 62.471 -0.652 18321 24678 1 19 . 1 1 58 58 VAL CB C 58 34.135 34.135 30.437 3.698 18321 24679 1 19 . 1 1 58 58 VAL H H 58 8.081 8.081 8.141 -0.060 18321 24680 1 19 . 1 1 59 59 SER N N 59 124.445 124.445 124.281 0.164 18321 24681 1 19 . 1 1 59 59 SER HA H 59 4.462 4.462 4.278 0.184 18321 24682 1 19 . 1 1 59 59 SER C C 59 172.185 172.185 173.311 -1.126 18321 24683 1 19 . 1 1 59 59 SER CA C 59 56.629 56.629 58.008 -1.379 18321 24684 1 19 . 1 1 59 59 SER CB C 59 66.218 66.218 63.581 2.636 18321 24685 1 19 . 1 1 59 59 SER H H 59 9.082 9.082 8.842 0.240 18321 24686 1 19 . 1 1 60 60 HIS N N 60 121.224 121.224 125.780 -4.556 18321 24687 1 19 . 1 1 60 60 HIS HA H 60 4.885 4.885 4.600 0.285 18321 24688 1 19 . 1 1 60 60 HIS C C 60 174.674 174.674 174.335 0.339 18321 24689 1 19 . 1 1 60 60 HIS CA C 60 54.900 54.900 55.502 -0.602 18321 24690 1 19 . 1 1 60 60 HIS CB C 60 32.331 32.331 29.396 2.934 18321 24691 1 19 . 1 1 60 60 HIS H H 60 8.331 8.331 8.687 -0.356 18321 24692 1 19 . 1 1 61 61 TYR N N 61 124.780 124.780 125.521 -0.741 18321 24693 1 19 . 1 1 61 61 TYR HA H 61 4.655 4.655 4.762 -0.107 18321 24694 1 19 . 1 1 61 61 TYR CA C 61 57.409 57.409 57.114 0.296 18321 24695 1 19 . 1 1 61 61 TYR CB C 61 39.785 39.785 38.367 1.418 18321 24696 1 19 . 1 1 61 61 TYR H H 61 9.273 9.273 9.201 0.072 18321 24697 1 19 . 1 1 62 62 ILE HA H 62 4.298 4.298 4.326 -0.028 18321 24698 1 19 . 1 1 62 62 ILE C C 62 174.817 174.817 175.516 -0.699 18321 24699 1 19 . 1 1 62 62 ILE CA C 62 61.908 61.908 61.796 0.112 18321 24700 1 19 . 1 1 62 62 ILE CB C 62 38.321 38.321 38.959 -0.638 18321 24701 1 19 . 1 1 63 63 ILE N N 63 128.552 128.552 128.556 -0.004 18321 24702 1 19 . 1 1 63 63 ILE HA H 63 4.788 4.788 4.703 0.085 18321 24703 1 19 . 1 1 63 63 ILE C C 63 175.982 175.982 174.869 1.113 18321 24704 1 19 . 1 1 63 63 ILE CA C 63 59.629 59.629 59.982 -0.353 18321 24705 1 19 . 1 1 63 63 ILE CB C 63 39.747 39.747 38.948 0.799 18321 24706 1 19 . 1 1 63 63 ILE H H 63 9.155 9.155 8.870 0.285 18321 24707 1 19 . 1 1 64 64 ASN N N 64 123.240 123.240 127.044 -3.804 18321 24708 1 19 . 1 1 64 64 ASN HA H 64 4.857 4.857 5.513 -0.656 18321 24709 1 19 . 1 1 64 64 ASN C C 64 175.324 175.324 174.767 0.557 18321 24710 1 19 . 1 1 64 64 ASN CA C 64 53.736 53.736 52.798 0.938 18321 24711 1 19 . 1 1 64 64 ASN CB C 64 41.531 41.531 40.437 1.094 18321 24712 1 19 . 1 1 64 64 ASN H H 64 9.379 9.379 8.911 0.468 18321 24713 1 19 . 1 1 65 65 SER N N 65 121.157 121.157 119.751 1.406 18321 24714 1 19 . 1 1 65 65 SER HA H 65 4.548 4.548 4.754 -0.206 18321 24715 1 19 . 1 1 65 65 SER C C 65 174.328 174.328 174.498 -0.170 18321 24716 1 19 . 1 1 65 65 SER CA C 65 58.306 58.306 57.694 0.612 18321 24717 1 19 . 1 1 65 65 SER CB C 65 62.878 62.878 63.386 -0.508 18321 24718 1 19 . 1 1 65 65 SER H H 65 9.195 9.195 8.998 0.197 18321 24719 1 19 . 1 1 66 66 LEU N N 66 127.417 127.417 128.685 -1.268 18321 24720 1 19 . 1 1 66 66 LEU HA H 66 4.605 4.605 4.352 0.253 18321 24721 1 19 . 1 1 66 66 LEU CA C 66 52.888 52.888 53.303 -0.416 18321 24722 1 19 . 1 1 66 66 LEU CB C 66 41.799 41.799 41.377 0.422 18321 24723 1 19 . 1 1 66 66 LEU H H 66 8.143 8.143 8.650 -0.507 18321 24724 1 19 . 1 1 68 68 ASN HA H 68 4.386 4.386 4.628 -0.242 18321 24725 1 19 . 1 1 68 68 ASN C C 68 174.487 174.487 174.860 -0.373 18321 24726 1 19 . 1 1 68 68 ASN CA C 68 53.365 53.365 53.020 0.345 18321 24727 1 19 . 1 1 68 68 ASN CB C 68 36.778 36.778 37.929 -1.151 18321 24728 1 19 . 1 1 69 69 ARG N N 69 111.329 111.329 114.666 -3.337 18321 24729 1 19 . 1 1 69 69 ARG HA H 69 3.876 3.876 3.794 0.082 18321 24730 1 19 . 1 1 69 69 ARG CA C 69 57.393 57.393 57.091 0.302 18321 24731 1 19 . 1 1 69 69 ARG CB C 69 26.665 26.665 26.951 -0.286 18321 24732 1 19 . 1 1 69 69 ARG H H 69 8.191 8.191 8.189 0.002 18321 24733 1 19 . 1 1 70 70 ARG N N 70 116.120 116.120 116.278 -0.158 18321 24734 1 19 . 1 1 70 70 ARG HA H 70 4.556 4.556 4.891 -0.335 18321 24735 1 19 . 1 1 70 70 ARG C C 70 174.882 174.882 173.968 0.914 18321 24736 1 19 . 1 1 70 70 ARG CA C 70 55.509 55.509 53.620 1.889 18321 24737 1 19 . 1 1 70 70 ARG CB C 70 31.771 31.771 34.680 -2.909 18321 24738 1 19 . 1 1 70 70 ARG H H 70 6.667 6.667 7.254 -0.587 18321 24739 1 19 . 1 1 71 71 PHE N N 71 116.313 116.313 118.371 -2.058 18321 24740 1 19 . 1 1 71 71 PHE HA H 71 5.540 5.540 5.839 -0.299 18321 24741 1 19 . 1 1 71 71 PHE C C 71 174.391 174.391 175.143 -0.752 18321 24742 1 19 . 1 1 71 71 PHE CA C 71 57.528 57.528 56.324 1.204 18321 24743 1 19 . 1 1 71 71 PHE CB C 71 44.115 44.115 42.627 1.488 18321 24744 1 19 . 1 1 71 71 PHE H H 71 8.700 8.700 8.234 0.466 18321 24745 1 19 . 1 1 72 72 LYS N N 72 122.770 122.770 126.080 -3.310 18321 24746 1 19 . 1 1 72 72 LYS HA H 72 5.483 5.483 5.078 0.405 18321 24747 1 19 . 1 1 72 72 LYS C C 72 173.923 173.923 175.081 -1.158 18321 24748 1 19 . 1 1 72 72 LYS CA C 72 54.855 54.855 55.191 -0.336 18321 24749 1 19 . 1 1 72 72 LYS CB C 72 37.710 37.710 35.723 1.987 18321 24750 1 19 . 1 1 72 72 LYS H H 72 9.138 9.138 8.616 0.522 18321 24751 1 19 . 1 1 73 73 ILE N N 73 124.576 124.576 129.377 -4.801 18321 24752 1 19 . 1 1 73 73 ILE HA H 73 4.955 4.955 5.342 -0.387 18321 24753 1 19 . 1 1 73 73 ILE C C 73 175.728 175.728 175.897 -0.169 18321 24754 1 19 . 1 1 73 73 ILE CA C 73 58.935 58.935 59.697 -0.762 18321 24755 1 19 . 1 1 73 73 ILE CB C 73 40.965 40.965 39.450 1.515 18321 24756 1 19 . 1 1 73 73 ILE H H 73 8.826 8.826 8.616 0.210 18321 24757 1 19 . 1 1 74 74 GLY N N 74 118.718 118.718 119.022 -0.304 18321 24758 1 19 . 1 1 74 74 GLY C C 74 174.436 174.436 174.890 -0.454 18321 24759 1 19 . 1 1 74 74 GLY CA C 74 47.401 47.401 45.592 1.809 18321 24760 1 19 . 1 1 74 74 GLY H H 74 9.317 9.317 8.780 0.537 18321 24761 1 19 . 1 1 75 75 ASP N N 75 125.691 125.691 117.825 7.866 18321 24762 1 19 . 1 1 75 75 ASP HA H 75 4.713 4.713 4.222 0.491 18321 24763 1 19 . 1 1 75 75 ASP C C 75 175.841 175.841 175.313 0.528 18321 24764 1 19 . 1 1 75 75 ASP CA C 75 53.815 53.815 56.203 -2.388 18321 24765 1 19 . 1 1 75 75 ASP CB C 75 41.288 41.288 40.543 0.745 18321 24766 1 19 . 1 1 75 75 ASP H H 75 8.665 8.665 8.785 -0.120 18321 24767 1 19 . 1 1 76 76 GLN N N 76 120.368 120.368 121.266 -0.898 18321 24768 1 19 . 1 1 76 76 GLN C C 76 173.630 173.630 175.038 -1.408 18321 24769 1 19 . 1 1 76 76 GLN CA C 76 54.254 54.254 55.315 -1.061 18321 24770 1 19 . 1 1 76 76 GLN CB C 76 31.248 31.248 29.108 2.140 18321 24771 1 19 . 1 1 76 76 GLN H H 76 8.289 8.289 7.880 0.409 18321 24772 1 19 . 1 1 77 77 GLU N N 77 120.435 120.435 123.338 -2.903 18321 24773 1 19 . 1 1 77 77 GLU C C 77 175.484 175.484 175.077 0.407 18321 24774 1 19 . 1 1 77 77 GLU CA C 77 54.203 54.203 55.989 -1.786 18321 24775 1 19 . 1 1 77 77 GLU CB C 77 33.141 33.141 30.783 2.358 18321 24776 1 19 . 1 1 77 77 GLU H H 77 7.732 7.732 8.376 -0.644 18321 24777 1 19 . 1 1 78 78 PHE N N 78 117.911 117.911 124.345 -6.434 18321 24778 1 19 . 1 1 78 78 PHE HA H 78 4.659 4.659 4.737 -0.078 18321 24779 1 19 . 1 1 78 78 PHE C C 78 175.673 175.673 176.442 -0.769 18321 24780 1 19 . 1 1 78 78 PHE CA C 78 57.160 57.160 56.614 0.546 18321 24781 1 19 . 1 1 78 78 PHE CB C 78 45.405 45.405 41.027 4.378 18321 24782 1 19 . 1 1 78 78 PHE H H 78 9.235 9.235 8.246 0.989 18321 24783 1 19 . 1 1 79 79 ASP N N 79 119.296 119.296 118.926 0.370 18321 24784 1 19 . 1 1 79 79 ASP HA H 79 4.462 4.462 4.521 -0.059 18321 24785 1 19 . 1 1 79 79 ASP C C 79 174.482 174.482 175.922 -1.440 18321 24786 1 19 . 1 1 79 79 ASP CA C 79 56.629 56.629 57.247 -0.618 18321 24787 1 19 . 1 1 79 79 ASP CB C 79 41.697 41.697 41.035 0.662 18321 24788 1 19 . 1 1 79 79 ASP H H 79 9.187 9.187 8.716 0.471 18321 24789 1 19 . 1 1 80 80 HIS N N 80 107.631 107.631 111.913 -4.282 18321 24790 1 19 . 1 1 80 80 HIS HA H 80 5.022 5.022 5.225 -0.203 18321 24791 1 19 . 1 1 80 80 HIS C C 80 174.626 174.626 175.968 -1.342 18321 24792 1 19 . 1 1 80 80 HIS CA C 80 54.223 54.223 54.894 -0.671 18321 24793 1 19 . 1 1 80 80 HIS CB C 80 32.205 32.205 31.052 1.153 18321 24794 1 19 . 1 1 80 80 HIS H H 80 7.200 7.200 7.429 -0.229 18321 24795 1 19 . 1 1 81 81 LEU N N 81 120.710 120.710 120.981 -0.271 18321 24796 1 19 . 1 1 81 81 LEU HA H 81 3.804 3.804 4.111 -0.307 18321 24797 1 19 . 1 1 81 81 LEU CA C 81 58.709 58.709 60.421 -1.712 18321 24798 1 19 . 1 1 81 81 LEU CB C 81 39.646 39.646 40.066 -0.420 18321 24799 1 19 . 1 1 81 81 LEU H H 81 8.886 8.886 9.162 -0.276 18321 24800 1 19 . 1 1 82 82 PRO HA H 82 4.020 4.020 4.519 -0.499 18321 24801 1 19 . 1 1 82 82 PRO C C 82 175.619 175.619 176.886 -1.267 18321 24802 1 19 . 1 1 82 82 PRO CA C 82 67.025 67.025 64.496 2.530 18321 24803 1 19 . 1 1 82 82 PRO CB C 82 30.962 30.962 31.018 -0.056 18321 24804 1 19 . 1 1 83 83 ALA N N 83 124.281 124.281 120.109 4.172 18321 24805 1 19 . 1 1 83 83 ALA HA H 83 4.019 4.019 4.366 -0.347 18321 24806 1 19 . 1 1 83 83 ALA C C 83 179.709 179.709 178.902 0.807 18321 24807 1 19 . 1 1 83 83 ALA CA C 83 54.985 54.985 54.204 0.781 18321 24808 1 19 . 1 1 83 83 ALA CB C 83 18.425 18.425 19.098 -0.673 18321 24809 1 19 . 1 1 83 83 ALA H H 83 8.527 8.527 7.780 0.747 18321 24810 1 19 . 1 1 84 84 LEU N N 84 122.960 122.960 118.021 4.939 18321 24811 1 19 . 1 1 84 84 LEU HA H 84 1.917 1.917 3.193 -1.276 18321 24812 1 19 . 1 1 84 84 LEU C C 84 177.652 177.652 178.313 -0.661 18321 24813 1 19 . 1 1 84 84 LEU CA C 84 58.261 58.261 57.374 0.887 18321 24814 1 19 . 1 1 84 84 LEU CB C 84 42.544 42.544 40.945 1.599 18321 24815 1 19 . 1 1 84 84 LEU H H 84 6.982 6.982 7.528 -0.546 18321 24816 1 19 . 1 1 85 85 LEU N N 85 117.940 117.940 119.663 -1.723 18321 24817 1 19 . 1 1 85 85 LEU HA H 85 3.463 3.463 3.791 -0.328 18321 24818 1 19 . 1 1 85 85 LEU C C 85 178.809 178.809 179.228 -0.419 18321 24819 1 19 . 1 1 85 85 LEU CA C 85 57.522 57.522 57.988 -0.466 18321 24820 1 19 . 1 1 85 85 LEU CB C 85 41.242 41.242 40.941 0.301 18321 24821 1 19 . 1 1 85 85 LEU H H 85 7.773 7.773 7.958 -0.185 18321 24822 1 19 . 1 1 86 86 GLU N N 86 115.762 115.762 118.767 -3.005 18321 24823 1 19 . 1 1 86 86 GLU HA H 86 3.540 3.540 3.954 -0.414 18321 24824 1 19 . 1 1 86 86 GLU C C 86 180.228 180.228 178.182 2.046 18321 24825 1 19 . 1 1 86 86 GLU CA C 86 58.943 58.943 58.596 0.347 18321 24826 1 19 . 1 1 86 86 GLU CB C 86 29.561 29.561 29.207 0.353 18321 24827 1 19 . 1 1 86 86 GLU H H 86 8.300 8.300 7.854 0.446 18321 24828 1 19 . 1 1 87 87 PHE N N 87 121.135 121.135 119.694 1.441 18321 24829 1 19 . 1 1 87 87 PHE HA H 87 4.122 4.122 4.111 0.011 18321 24830 1 19 . 1 1 87 87 PHE C C 87 179.497 179.497 177.565 1.932 18321 24831 1 19 . 1 1 87 87 PHE CA C 87 62.090 62.090 60.602 1.488 18321 24832 1 19 . 1 1 87 87 PHE CB C 87 40.103 40.103 39.160 0.943 18321 24833 1 19 . 1 1 87 87 PHE H H 87 7.717 7.717 7.379 0.338 18321 24834 1 19 . 1 1 88 88 TYR N N 88 116.579 116.579 119.192 -2.613 18321 24835 1 19 . 1 1 88 88 TYR HA H 88 4.933 4.933 4.167 0.766 18321 24836 1 19 . 1 1 88 88 TYR C C 88 174.799 174.799 177.271 -2.472 18321 24837 1 19 . 1 1 88 88 TYR CA C 88 61.333 61.333 59.792 1.541 18321 24838 1 19 . 1 1 88 88 TYR CB C 88 36.539 36.539 37.629 -1.090 18321 24839 1 19 . 1 1 88 88 TYR H H 88 7.478 7.478 7.949 -0.471 18321 24840 1 19 . 1 1 89 89 LYS N N 89 117.737 117.737 117.060 0.677 18321 24841 1 19 . 1 1 89 89 LYS HA H 89 4.466 4.466 3.997 0.469 18321 24842 1 19 . 1 1 89 89 LYS C C 89 178.417 178.417 177.020 1.397 18321 24843 1 19 . 1 1 89 89 LYS CA C 89 59.486 59.486 58.808 0.678 18321 24844 1 19 . 1 1 89 89 LYS CB C 89 34.523 34.523 32.572 1.951 18321 24845 1 19 . 1 1 89 89 LYS H H 89 7.505 7.505 7.806 -0.301 18321 24846 1 19 . 1 1 90 90 ILE N N 90 110.972 110.972 110.025 0.947 18321 24847 1 19 . 1 1 90 90 ILE HA H 90 4.181 4.181 4.193 -0.012 18321 24848 1 19 . 1 1 90 90 ILE C C 90 174.571 174.571 175.516 -0.945 18321 24849 1 19 . 1 1 90 90 ILE CA C 90 60.516 60.516 60.455 0.061 18321 24850 1 19 . 1 1 90 90 ILE CB C 90 39.979 39.979 37.903 2.076 18321 24851 1 19 . 1 1 90 90 ILE H H 90 6.710 6.710 7.232 -0.522 18321 24852 1 19 . 1 1 91 91 HIS N N 91 119.479 119.479 120.526 -1.047 18321 24853 1 19 . 1 1 91 91 HIS HA H 91 4.357 4.357 4.408 -0.051 18321 24854 1 19 . 1 1 91 91 HIS C C 91 172.751 172.751 174.578 -1.827 18321 24855 1 19 . 1 1 91 91 HIS CA C 91 55.066 55.066 55.812 -0.746 18321 24856 1 19 . 1 1 91 91 HIS CB C 91 29.756 29.756 32.450 -2.694 18321 24857 1 19 . 1 1 91 91 HIS H H 91 7.460 7.460 7.256 0.204 18321 24858 1 19 . 1 1 92 92 TYR N N 92 117.642 117.642 115.762 1.880 18321 24859 1 19 . 1 1 92 92 TYR HA H 92 4.131 4.131 4.338 -0.207 18321 24860 1 19 . 1 1 92 92 TYR C C 92 177.348 177.348 175.580 1.768 18321 24861 1 19 . 1 1 92 92 TYR CA C 92 58.627 58.627 58.303 0.323 18321 24862 1 19 . 1 1 92 92 TYR CB C 92 39.481 39.481 35.904 3.577 18321 24863 1 19 . 1 1 92 92 TYR H H 92 8.067 8.067 7.496 0.571 18321 24864 1 19 . 1 1 93 93 LEU N N 93 123.560 123.560 118.159 5.401 18321 24865 1 19 . 1 1 93 93 LEU HA H 93 4.104 4.104 4.152 -0.048 18321 24866 1 19 . 1 1 93 93 LEU C C 93 175.610 175.610 176.999 -1.389 18321 24867 1 19 . 1 1 93 93 LEU CA C 93 56.381 56.381 56.525 -0.144 18321 24868 1 19 . 1 1 93 93 LEU CB C 93 38.896 38.896 41.516 -2.620 18321 24869 1 19 . 1 1 93 93 LEU H H 93 7.907 7.907 8.704 -0.797 18321 24870 1 19 . 1 1 94 94 ASP N N 94 118.194 118.194 114.853 3.341 18321 24871 1 19 . 1 1 94 94 ASP HA H 94 4.940 4.940 4.641 0.299 18321 24872 1 19 . 1 1 94 94 ASP C C 94 176.123 176.123 175.752 0.371 18321 24873 1 19 . 1 1 94 94 ASP CA C 94 56.235 56.235 54.333 1.902 18321 24874 1 19 . 1 1 94 94 ASP CB C 94 42.078 42.078 41.230 0.848 18321 24875 1 19 . 1 1 94 94 ASP H H 94 8.640 8.640 7.789 0.851 18321 24876 1 19 . 1 1 95 95 THR N N 95 105.073 105.073 112.384 -7.311 18321 24877 1 19 . 1 1 95 95 THR HA H 95 4.318 4.318 4.549 -0.231 18321 24878 1 19 . 1 1 95 95 THR C C 95 174.685 174.685 174.544 0.141 18321 24879 1 19 . 1 1 95 95 THR CA C 95 60.756 60.756 62.480 -1.724 18321 24880 1 19 . 1 1 95 95 THR CB C 95 71.058 71.058 69.037 2.021 18321 24881 1 19 . 1 1 95 95 THR H H 95 8.576 8.576 8.097 0.479 18321 24882 1 19 . 1 1 96 96 THR N N 96 116.817 116.817 114.623 2.194 18321 24883 1 19 . 1 1 96 96 THR HA H 96 5.129 5.129 4.600 0.529 18321 24884 1 19 . 1 1 96 96 THR C C 96 172.464 172.464 173.756 -1.292 18321 24885 1 19 . 1 1 96 96 THR CA C 96 60.762 60.762 62.095 -1.333 18321 24886 1 19 . 1 1 96 96 THR CB C 96 71.425 71.425 69.933 1.492 18321 24887 1 19 . 1 1 96 96 THR H H 96 8.205 8.205 7.829 0.376 18321 24888 1 19 . 1 1 97 97 THR N N 97 114.324 114.324 110.483 3.841 18321 24889 1 19 . 1 1 97 97 THR HA H 97 5.128 5.128 3.879 1.249 18321 24890 1 19 . 1 1 97 97 THR C C 97 175.480 175.480 172.632 2.848 18321 24891 1 19 . 1 1 97 97 THR CA C 97 60.233 60.233 62.719 -2.486 18321 24892 1 19 . 1 1 97 97 THR CB C 97 70.415 70.415 67.936 2.478 18321 24893 1 19 . 1 1 97 97 THR H H 97 7.128 7.128 7.602 -0.474 18321 24894 1 19 . 1 1 98 98 LEU N N 98 116.674 116.674 121.448 -4.774 18321 24895 1 19 . 1 1 98 98 LEU HA H 98 4.075 4.075 4.232 -0.157 18321 24896 1 19 . 1 1 98 98 LEU C C 98 177.892 177.892 176.816 1.076 18321 24897 1 19 . 1 1 98 98 LEU CA C 98 59.597 59.597 54.905 4.692 18321 24898 1 19 . 1 1 98 98 LEU CB C 98 41.172 41.172 41.697 -0.525 18321 24899 1 19 . 1 1 98 98 LEU H H 98 8.743 8.743 8.263 0.480 18321 24900 1 19 . 1 1 99 99 ILE N N 99 122.988 122.988 123.369 -0.381 18321 24901 1 19 . 1 1 99 99 ILE HA H 99 4.415 4.415 4.521 -0.106 18321 24902 1 19 . 1 1 99 99 ILE C C 99 175.055 175.055 175.610 -0.555 18321 24903 1 19 . 1 1 99 99 ILE CA C 99 62.183 62.183 60.780 1.403 18321 24904 1 19 . 1 1 99 99 ILE CB C 99 40.252 40.252 39.689 0.563 18321 24905 1 19 . 1 1 99 99 ILE H H 99 8.998 8.998 8.072 0.926 18321 24906 1 19 . 1 1 100 100 GLU N N 100 114.067 114.067 117.546 -3.479 18321 24907 1 19 . 1 1 100 100 GLU CA C 100 52.910 52.910 53.391 -0.481 18321 24908 1 19 . 1 1 100 100 GLU CB C 100 31.155 31.155 33.073 -1.918 18321 24909 1 19 . 1 1 100 100 GLU H H 100 7.332 7.332 7.938 -0.606 18321 24910 1 19 . 1 1 101 101 PRO HA H 101 4.952 4.952 3.969 0.983 18321 24911 1 19 . 1 1 101 101 PRO C C 101 175.976 175.976 175.824 0.152 18321 24912 1 19 . 1 1 101 101 PRO CA C 101 53.312 53.312 62.069 -8.757 18321 24913 1 19 . 1 1 101 101 PRO CB C 101 31.598 31.598 32.450 -0.853 18321 24914 1 19 . 1 1 102 102 ALA N N 102 125.968 125.968 121.212 4.756 18321 24915 1 19 . 1 1 102 102 ALA HA H 102 4.516 4.516 4.426 0.090 18321 24916 1 19 . 1 1 102 102 ALA CA C 102 49.852 49.852 49.596 0.256 18321 24917 1 19 . 1 1 102 102 ALA CB C 102 17.766 17.766 18.237 -0.471 18321 24918 1 19 . 1 1 102 102 ALA H H 102 8.232 8.232 7.986 0.246 18321 24919 1 19 . 1 1 103 103 PRO HA H 103 4.283 4.283 4.349 -0.066 18321 24920 1 19 . 1 1 103 103 PRO CA C 103 62.435 62.435 63.196 -0.761 18321 24921 1 19 . 1 1 103 103 PRO CB C 103 32.145 32.145 31.433 0.712 18321 24922 1 19 . 1 1 104 104 ARG HA H 104 4.004 4.004 4.204 -0.200 18321 24923 1 19 . 1 1 104 104 ARG CA C 104 56.660 56.660 56.758 -0.098 18321 24924 1 19 . 1 1 106 106 PRO C C 106 174.587 174.587 176.058 -1.471 18321 24925 1 19 . 1 1 106 106 PRO CA C 106 57.867 57.867 63.339 -5.472 18321 24926 1 19 . 1 1 106 106 PRO CB C 106 31.942 31.942 32.800 -0.859 18321 24927 1 19 . 1 1 107 107 SER N N 107 121.280 121.280 118.410 2.870 18321 24928 1 19 . 1 1 107 107 SER CA C 107 61.772 61.772 58.106 3.666 18321 24929 1 19 . 1 1 107 107 SER CB C 107 63.234 63.234 63.223 0.011 18321 24930 1 19 . 1 1 107 107 SER H H 107 8.132 8.132 8.662 -0.530 18321 24931 1 19 . 1 1 109 109 PRO C C 109 177.129 177.129 178.181 -1.052 18321 24932 1 19 . 1 1 109 109 PRO CA C 109 62.638 62.638 61.940 0.698 18321 24933 1 19 . 1 1 109 109 PRO CB C 109 30.970 30.970 32.497 -1.527 18321 24934 1 19 . 1 1 110 110 MET N N 110 120.772 120.772 117.460 3.312 18321 24935 1 19 . 1 1 110 110 MET C C 110 176.892 176.892 177.764 -0.872 18321 24936 1 19 . 1 1 110 110 MET CA C 110 55.310 55.310 56.511 -1.201 18321 24937 1 19 . 1 1 110 110 MET CB C 110 32.202 32.202 31.706 0.496 18321 24938 1 19 . 1 1 110 110 MET H H 110 8.430 8.430 8.341 0.089 18321 24939 1 19 . 1 1 111 111 GLY N N 111 110.158 110.158 107.646 2.512 18321 24940 1 19 . 1 1 111 111 GLY C C 111 177.430 177.430 173.805 3.625 18321 24941 1 19 . 1 1 111 111 GLY CA C 111 44.951 44.951 44.759 0.192 18321 24942 1 19 . 1 1 111 111 GLY H H 111 8.384 8.384 8.350 0.034 18321 24943 1 19 . 1 1 112 112 SER N N 112 116.762 116.762 118.981 -2.219 18321 24944 1 19 . 1 1 112 112 SER CA C 112 55.948 55.948 57.658 -1.710 18321 24945 1 19 . 1 1 112 112 SER CB C 112 62.745 62.745 64.501 -1.756 18321 24946 1 19 . 1 1 112 112 SER H H 112 8.161 8.161 7.987 0.174 18321 24947 1 19 . 1 1 113 113 VAL C C 113 176.083 176.083 175.838 0.245 18321 24948 1 19 . 1 1 114 114 SER N N 114 119.151 119.151 115.532 3.619 18321 24949 1 19 . 1 1 114 114 SER C C 114 173.638 173.638 175.510 -1.872 18321 24950 1 19 . 1 1 114 114 SER CA C 114 58.005 58.005 59.172 -1.167 18321 24951 1 19 . 1 1 114 114 SER CB C 114 63.169 63.169 63.283 -0.114 18321 24952 1 19 . 1 1 114 114 SER H H 114 8.319 8.319 8.282 0.037 18321 24953 1 19 . 1 1 115 115 ALA N N 115 126.914 126.914 124.072 2.842 18321 24954 1 19 . 1 1 115 115 ALA CA C 115 51.561 51.561 52.950 -1.389 18321 24955 1 19 . 1 1 115 115 ALA CB C 115 17.714 17.714 17.191 0.523 18321 24956 1 19 . 1 1 115 115 ALA H H 115 8.197 8.197 8.025 0.172 18321 24957 1 19 . 1 1 119 119 PRO C C 119 177.065 177.065 176.285 0.780 18321 24958 1 19 . 1 1 120 120 THR N N 120 113.976 113.976 118.213 -4.237 18321 24959 1 19 . 1 1 120 120 THR C C 120 174.461 174.461 173.892 0.569 18321 24960 1 19 . 1 1 120 120 THR CA C 120 61.215 61.215 61.884 -0.669 18321 24961 1 19 . 1 1 120 120 THR CB C 120 69.508 69.508 69.146 0.362 18321 24962 1 19 . 1 1 120 120 THR H H 120 8.138 8.138 8.499 -0.361 18321 24963 1 19 . 1 1 121 121 ALA N N 121 125.859 125.859 123.503 2.356 18321 24964 1 19 . 1 1 121 121 ALA CA C 121 52.281 52.281 53.159 -0.878 18321 24965 1 19 . 1 1 121 121 ALA CB C 121 18.623 18.623 17.834 0.789 18321 24966 1 19 . 1 1 121 121 ALA H H 121 8.272 8.272 8.273 -0.001 18321 24967 1 19 . 1 1 122 122 GLU C C 122 176.316 176.316 175.786 0.530 18321 24968 1 19 . 1 1 123 123 ASP N N 123 120.448 120.448 120.768 -0.320 18321 24969 1 19 . 1 1 123 123 ASP C C 123 175.906 175.906 175.085 0.821 18321 24970 1 19 . 1 1 123 123 ASP CA C 123 54.167 54.167 53.919 0.248 18321 24971 1 19 . 1 1 123 123 ASP CB C 123 40.695 40.695 40.091 0.604 18321 24972 1 19 . 1 1 123 123 ASP H H 123 8.181 8.181 8.668 -0.487 18321 24973 1 19 . 1 1 124 124 ASN N N 124 118.207 118.207 114.390 3.817 18321 24974 1 19 . 1 1 124 124 ASN C C 124 174.851 174.851 173.695 1.156 18321 24975 1 19 . 1 1 124 124 ASN CA C 124 52.771 52.771 52.880 -0.109 18321 24976 1 19 . 1 1 124 124 ASN CB C 124 38.304 38.304 39.689 -1.385 18321 24977 1 19 . 1 1 124 124 ASN H H 124 8.307 8.307 7.547 0.760 18321 24978 1 19 . 1 1 125 125 LEU N N 125 121.311 121.311 119.705 1.606 18321 24979 1 19 . 1 1 125 125 LEU C C 125 175.750 175.750 175.594 0.156 18321 24980 1 19 . 1 1 125 125 LEU CA C 125 54.428 54.428 55.226 -0.798 18321 24981 1 19 . 1 1 125 125 LEU CB C 125 41.350 41.350 39.483 1.867 18321 24982 1 19 . 1 1 125 125 LEU H H 125 7.747 7.747 8.629 -0.882 18321 24983 1 19 . 1 1 126 126 GLU N N 126 122.485 122.485 118.772 3.713 18321 24984 1 19 . 1 1 126 126 GLU C C 126 174.008 174.008 173.830 0.178 18321 24985 1 19 . 1 1 126 126 GLU CA C 126 54.855 54.855 56.626 -1.771 18321 24986 1 19 . 1 1 126 126 GLU CB C 126 30.472 30.472 30.689 -0.216 18321 24987 1 19 . 1 1 126 126 GLU H H 126 8.453 8.453 8.219 0.234 18321 24988 1 19 . 1 1 127 127 TYR N N 127 122.713 122.713 120.116 2.597 18321 24989 1 19 . 1 1 127 127 TYR C C 127 176.859 176.859 174.624 2.235 18321 24990 1 19 . 1 1 127 127 TYR CA C 127 56.528 56.528 57.036 -0.508 18321 24991 1 19 . 1 1 127 127 TYR CB C 127 40.982 40.982 39.086 1.896 18321 24992 1 19 . 1 1 127 127 TYR H H 127 8.469 8.469 7.996 0.473 18321 24993 1 19 . 1 1 128 128 VAL N N 128 112.432 112.432 125.410 -12.978 18321 24994 1 19 . 1 1 128 128 VAL C C 128 173.150 173.150 174.222 -1.072 18321 24995 1 19 . 1 1 128 128 VAL CA C 128 57.940 57.940 60.622 -2.682 18321 24996 1 19 . 1 1 128 128 VAL CB C 128 34.935 34.935 34.621 0.314 18321 24997 1 19 . 1 1 128 128 VAL H H 128 9.078 9.078 8.891 0.187 18321 24998 1 19 . 1 1 129 129 ARG N N 129 120.373 120.373 126.371 -5.998 18321 24999 1 19 . 1 1 129 129 ARG C C 129 176.539 176.539 175.808 0.731 18321 25000 1 19 . 1 1 129 129 ARG CA C 129 52.534 52.534 54.067 -1.533 18321 25001 1 19 . 1 1 129 129 ARG CB C 129 32.942 32.942 32.765 0.177 18321 25002 1 19 . 1 1 129 129 ARG H H 129 9.010 9.010 8.053 0.957 18321 25003 1 19 . 1 1 130 130 THR N N 130 116.637 116.637 114.168 2.469 18321 25004 1 19 . 1 1 130 130 THR CA C 130 60.618 60.618 60.582 0.036 18321 25005 1 19 . 1 1 130 130 THR CB C 130 69.170 69.170 70.359 -1.189 18321 25006 1 19 . 1 1 130 130 THR H H 130 9.045 9.045 8.664 0.381 18321 25007 1 19 . 1 1 131 131 LEU N N 131 122.910 122.910 122.648 0.262 18321 25008 1 19 . 1 1 131 131 LEU C C 131 175.269 175.269 176.363 -1.094 18321 25009 1 19 . 1 1 131 131 LEU CA C 131 55.122 55.122 54.828 0.294 18321 25010 1 19 . 1 1 131 131 LEU CB C 131 43.108 43.108 42.684 0.424 18321 25011 1 19 . 1 1 131 131 LEU H H 131 9.224 9.224 8.260 0.964 18321 25012 1 19 . 1 1 132 132 TYR N N 132 112.885 112.885 119.268 -6.383 18321 25013 1 19 . 1 1 132 132 TYR C C 132 173.818 173.818 175.410 -1.592 18321 25014 1 19 . 1 1 132 132 TYR CA C 132 54.230 54.230 59.159 -4.929 18321 25015 1 19 . 1 1 132 132 TYR CB C 132 42.672 42.672 40.170 2.502 18321 25016 1 19 . 1 1 132 132 TYR H H 132 7.284 7.284 7.672 -0.388 18321 25017 1 19 . 1 1 133 133 ASP N N 133 118.003 118.003 119.263 -1.260 18321 25018 1 19 . 1 1 133 133 ASP C C 133 175.779 175.779 174.461 1.318 18321 25019 1 19 . 1 1 133 133 ASP CA C 133 54.351 54.351 55.269 -0.918 18321 25020 1 19 . 1 1 133 133 ASP CB C 133 41.241 41.241 39.954 1.287 18321 25021 1 19 . 1 1 133 133 ASP H H 133 8.399 8.399 8.307 0.092 18321 25022 1 19 . 1 1 134 134 PHE N N 134 121.081 121.081 123.971 -2.890 18321 25023 1 19 . 1 1 134 134 PHE CA C 134 52.552 52.552 54.711 -2.159 18321 25024 1 19 . 1 1 134 134 PHE CB C 134 41.217 41.217 41.737 -0.520 18321 25025 1 19 . 1 1 134 134 PHE H H 134 8.797 8.797 7.215 1.582 18321 25026 1 19 . 1 1 136 136 GLY C C 136 171.616 171.616 174.801 -3.185 18321 25027 1 19 . 1 1 137 137 ASN N N 137 119.394 119.394 115.352 4.042 18321 25028 1 19 . 1 1 137 137 ASN C C 137 174.500 174.500 173.834 0.666 18321 25029 1 19 . 1 1 137 137 ASN CA C 137 44.670 44.670 54.244 -9.574 18321 25030 1 19 . 1 1 137 137 ASN H H 137 9.477 9.477 8.244 1.233 18321 25031 1 19 . 1 1 138 138 ASP N N 138 120.608 120.608 118.134 2.474 18321 25032 1 19 . 1 1 138 138 ASP C C 138 176.987 176.987 174.974 2.013 18321 25033 1 19 . 1 1 138 138 ASP CA C 138 52.992 52.992 52.619 0.373 18321 25034 1 19 . 1 1 138 138 ASP H H 138 8.216 8.216 8.156 0.060 18321 25035 1 19 . 1 1 139 139 ALA N N 139 124.371 124.371 121.812 2.559 18321 25036 1 19 . 1 1 139 139 ALA C C 139 178.472 178.472 179.169 -0.697 18321 25037 1 19 . 1 1 139 139 ALA CA C 139 54.513 54.513 54.332 0.181 18321 25038 1 19 . 1 1 139 139 ALA CB C 139 18.045 18.045 19.503 -1.458 18321 25039 1 19 . 1 1 139 139 ALA H H 139 8.565 8.565 8.565 -0.000 18321 25040 1 19 . 1 1 140 140 GLU N N 140 115.022 115.022 117.524 -2.502 18321 25041 1 19 . 1 1 140 140 GLU C C 140 177.027 177.027 175.620 1.407 18321 25042 1 19 . 1 1 140 140 GLU CA C 140 56.181 56.181 57.611 -1.430 18321 25043 1 19 . 1 1 140 140 GLU CB C 140 28.619 28.619 30.389 -1.770 18321 25044 1 19 . 1 1 140 140 GLU H H 140 8.616 8.616 8.492 0.124 18321 25045 1 19 . 1 1 141 141 ASP N N 141 121.913 121.913 118.852 3.061 18321 25046 1 19 . 1 1 141 141 ASP C C 141 175.923 175.923 174.902 1.021 18321 25047 1 19 . 1 1 141 141 ASP CA C 141 54.736 54.736 53.361 1.375 18321 25048 1 19 . 1 1 141 141 ASP CB C 141 41.305 41.305 42.876 -1.571 18321 25049 1 19 . 1 1 141 141 ASP H H 141 7.636 7.636 7.822 -0.186 18321 25050 1 19 . 1 1 142 142 LEU N N 142 127.651 127.651 126.901 0.750 18321 25051 1 19 . 1 1 142 142 LEU CA C 142 50.955 50.955 53.303 -2.348 18321 25052 1 19 . 1 1 142 142 LEU CB C 142 42.343 42.343 43.550 -1.208 18321 25053 1 19 . 1 1 142 142 LEU H H 142 9.479 9.479 8.362 1.117 18321 25054 1 19 . 1 1 143 143 PRO C C 143 177.924 177.924 175.740 2.184 18321 25055 1 19 . 1 1 144 144 PHE N N 144 114.483 114.483 120.994 -6.511 18321 25056 1 19 . 1 1 144 144 PHE C C 144 175.055 175.055 174.705 0.350 18321 25057 1 19 . 1 1 144 144 PHE CA C 144 55.543 55.543 54.699 0.844 18321 25058 1 19 . 1 1 144 144 PHE CB C 144 40.581 40.581 41.691 -1.110 18321 25059 1 19 . 1 1 144 144 PHE H H 144 8.637 8.637 7.567 1.070 18321 25060 1 19 . 1 1 145 145 LYS N N 145 121.342 121.342 118.715 2.627 18321 25061 1 19 . 1 1 145 145 LYS C C 145 176.925 176.925 177.446 -0.521 18321 25062 1 19 . 1 1 145 145 LYS CA C 145 53.043 53.043 53.845 -0.802 18321 25063 1 19 . 1 1 145 145 LYS CB C 145 33.804 33.804 35.329 -1.525 18321 25064 1 19 . 1 1 145 145 LYS H H 145 9.418 9.418 8.515 0.903 18321 25065 1 19 . 1 1 146 146 LYS N N 146 123.378 123.378 120.114 3.264 18321 25066 1 19 . 1 1 146 146 LYS CA C 146 57.883 57.883 56.544 1.339 18321 25067 1 19 . 1 1 146 146 LYS CB C 146 32.008 32.008 31.442 0.566 18321 25068 1 19 . 1 1 146 146 LYS H H 146 9.002 9.002 8.715 0.287 18321 25069 1 19 . 1 1 147 147 GLY C C 147 174.315 174.315 173.091 1.224 18321 25070 1 19 . 1 1 148 148 GLU N N 148 121.392 121.392 120.306 1.086 18321 25071 1 19 . 1 1 148 148 GLU C C 148 174.998 174.998 174.886 0.112 18321 25072 1 19 . 1 1 148 148 GLU CA C 148 56.867 56.867 54.575 2.292 18321 25073 1 19 . 1 1 148 148 GLU CB C 148 31.649 31.649 32.597 -0.948 18321 25074 1 19 . 1 1 148 148 GLU H H 148 7.937 7.937 7.772 0.165 18321 25075 1 19 . 1 1 149 149 ILE N N 149 120.124 120.124 122.395 -2.271 18321 25076 1 19 . 1 1 149 149 ILE C C 149 176.647 176.647 174.959 1.688 18321 25077 1 19 . 1 1 149 149 ILE CA C 149 58.621 58.621 60.710 -2.089 18321 25078 1 19 . 1 1 149 149 ILE CB C 149 36.952 36.952 38.600 -1.648 18321 25079 1 19 . 1 1 149 149 ILE H H 149 8.346 8.346 8.640 -0.294 18321 25080 1 19 . 1 1 150 150 LEU N N 150 126.950 126.950 124.771 2.179 18321 25081 1 19 . 1 1 150 150 LEU CA C 150 51.967 51.967 52.827 -0.860 18321 25082 1 19 . 1 1 150 150 LEU CB C 150 44.182 44.182 45.430 -1.248 18321 25083 1 19 . 1 1 150 150 LEU H H 150 8.988 8.988 9.117 -0.129 18321 25084 1 19 . 1 1 151 151 VAL C C 151 175.670 175.670 175.712 -0.042 18321 25085 1 19 . 1 1 152 152 ILE N N 152 124.997 124.997 128.872 -3.875 18321 25086 1 19 . 1 1 152 152 ILE CA C 152 58.331 58.331 60.568 -2.237 18321 25087 1 19 . 1 1 152 152 ILE CB C 152 34.093 34.093 34.995 -0.902 18321 25088 1 19 . 1 1 152 152 ILE H H 152 8.673 8.673 8.333 0.340 18321 25089 1 19 . 1 1 153 153 ILE N N 153 124.710 124.710 129.015 -4.305 18321 25090 1 19 . 1 1 153 153 ILE C C 153 176.264 176.264 175.309 0.955 18321 25091 1 19 . 1 1 154 154 GLU N N 154 117.398 117.398 119.573 -2.175 18321 25092 1 19 . 1 1 154 154 GLU C C 154 173.959 173.959 174.474 -0.515 18321 25093 1 19 . 1 1 154 154 GLU CA C 154 55.289 55.289 54.809 0.480 18321 25094 1 19 . 1 1 154 154 GLU CB C 154 32.842 32.842 32.161 0.680 18321 25095 1 19 . 1 1 154 154 GLU H H 154 7.818 7.818 8.155 -0.337 18321 25096 1 19 . 1 1 155 155 LYS N N 155 121.130 121.130 124.355 -3.225 18321 25097 1 19 . 1 1 155 155 LYS CA C 155 53.022 53.022 52.693 0.329 18321 25098 1 19 . 1 1 155 155 LYS CB C 155 32.663 32.663 32.804 -0.141 18321 25099 1 19 . 1 1 155 155 LYS H H 155 8.654 8.654 8.907 -0.253 18321 25100 1 19 . 1 1 157 157 GLU C C 157 175.190 175.190 176.065 -0.875 18321 25101 1 19 . 1 1 157 157 GLU CA C 157 53.785 53.785 54.562 -0.777 18321 25102 1 19 . 1 1 157 157 GLU CB C 157 32.685 32.685 32.497 0.188 18321 25103 1 19 . 1 1 158 158 GLU N N 158 117.425 117.425 118.223 -0.798 18321 25104 1 19 . 1 1 158 158 GLU C C 158 178.600 178.600 176.284 2.316 18321 25105 1 19 . 1 1 158 158 GLU CA C 158 59.044 59.044 58.173 0.870 18321 25106 1 19 . 1 1 158 158 GLU CB C 158 29.706 29.706 29.942 -0.236 18321 25107 1 19 . 1 1 158 158 GLU H H 158 8.678 8.678 8.839 -0.161 18321 25108 1 19 . 1 1 159 159 GLN N N 159 110.925 110.925 117.311 -6.386 18321 25109 1 19 . 1 1 159 159 GLN C C 159 175.539 175.539 175.412 0.127 18321 25110 1 19 . 1 1 159 159 GLN CA C 159 54.942 54.942 57.081 -2.139 18321 25111 1 19 . 1 1 159 159 GLN CB C 159 28.572 28.572 29.607 -1.035 18321 25112 1 19 . 1 1 159 159 GLN H H 159 8.483 8.483 8.024 0.459 18321 25113 1 19 . 1 1 160 160 TRP N N 160 120.171 120.171 118.102 2.069 18321 25114 1 19 . 1 1 160 160 TRP C C 160 173.444 173.444 174.649 -1.205 18321 25115 1 19 . 1 1 160 160 TRP CA C 160 56.175 56.175 56.252 -0.077 18321 25116 1 19 . 1 1 160 160 TRP CB C 160 31.796 31.796 32.775 -0.979 18321 25117 1 19 . 1 1 160 160 TRP H H 160 6.826 6.826 7.601 -0.775 18321 25118 1 19 . 1 1 161 161 TRP N N 161 120.687 120.687 121.044 -0.357 18321 25119 1 19 . 1 1 161 161 TRP C C 161 174.736 174.736 175.560 -0.824 18321 25120 1 19 . 1 1 161 161 TRP CA C 161 51.889 51.889 55.190 -3.301 18321 25121 1 19 . 1 1 161 161 TRP CB C 161 32.772 32.772 32.536 0.236 18321 25122 1 19 . 1 1 161 161 TRP H H 161 8.462 8.462 9.432 -0.970 18321 25123 1 19 . 1 1 162 162 SER N N 162 115.691 115.691 120.130 -4.439 18321 25124 1 19 . 1 1 162 162 SER C C 162 174.320 174.320 173.310 1.010 18321 25125 1 19 . 1 1 162 162 SER CA C 162 57.011 57.011 58.508 -1.496 18321 25126 1 19 . 1 1 162 162 SER CB C 162 63.948 63.948 63.153 0.795 18321 25127 1 19 . 1 1 162 162 SER H H 162 8.830 8.830 9.420 -0.590 18321 25128 1 19 . 1 1 163 163 ALA N N 163 130.630 130.630 128.381 2.249 18321 25129 1 19 . 1 1 163 163 ALA CA C 163 50.029 50.029 49.949 0.080 18321 25130 1 19 . 1 1 163 163 ALA CB C 163 25.500 25.500 22.064 3.436 18321 25131 1 19 . 1 1 163 163 ALA H H 163 9.585 9.585 9.200 0.385 18321 25132 1 19 . 1 1 164 164 ARG N N 164 117.526 117.526 122.072 -4.546 18321 25133 1 19 . 1 1 164 164 ARG C C 164 176.719 176.719 176.756 -0.037 18321 25134 1 19 . 1 1 164 164 ARG CA C 164 52.975 52.975 54.325 -1.350 18321 25135 1 19 . 1 1 164 164 ARG CB C 164 34.260 34.260 30.425 3.835 18321 25136 1 19 . 1 1 164 164 ARG H H 164 9.097 9.097 9.012 0.085 18321 25137 1 19 . 1 1 165 165 ASN N N 165 123.935 123.935 122.858 1.077 18321 25138 1 19 . 1 1 165 165 ASN C C 165 178.484 178.484 176.754 1.730 18321 25139 1 19 . 1 1 165 165 ASN CA C 165 50.332 50.332 54.444 -4.112 18321 25140 1 19 . 1 1 165 165 ASN CB C 165 39.487 39.487 39.553 -0.067 18321 25141 1 19 . 1 1 165 165 ASN H H 165 8.756 8.756 9.049 -0.293 18321 25142 1 19 . 1 1 166 166 LYS N N 166 118.464 118.464 121.842 -3.378 18321 25143 1 19 . 1 1 166 166 LYS C C 166 176.967 176.967 177.113 -0.146 18321 25144 1 19 . 1 1 166 166 LYS CA C 166 58.430 58.430 58.376 0.054 18321 25145 1 19 . 1 1 166 166 LYS CB C 166 30.918 30.918 32.358 -1.440 18321 25146 1 19 . 1 1 166 166 LYS H H 166 8.915 8.915 9.136 -0.221 18321 25147 1 19 . 1 1 167 167 ASP N N 167 118.138 118.138 117.112 1.026 18321 25148 1 19 . 1 1 167 167 ASP C C 167 176.464 176.464 176.504 -0.040 18321 25149 1 19 . 1 1 167 167 ASP CA C 167 54.212 54.212 54.816 -0.604 18321 25150 1 19 . 1 1 167 167 ASP CB C 167 41.178 41.178 41.377 -0.199 18321 25151 1 19 . 1 1 167 167 ASP H H 167 7.508 7.508 8.224 -0.716 18321 25152 1 19 . 1 1 168 168 GLY N N 168 107.901 107.901 108.925 -1.024 18321 25153 1 19 . 1 1 168 168 GLY C C 168 173.613 173.613 172.973 0.640 18321 25154 1 19 . 1 1 168 168 GLY CA C 168 44.783 44.783 45.161 -0.378 18321 25155 1 19 . 1 1 168 168 GLY H H 168 8.173 8.173 8.165 0.008 18321 25156 1 19 . 1 1 169 169 ARG N N 169 124.324 124.324 120.096 4.228 18321 25157 1 19 . 1 1 169 169 ARG CA C 169 56.106 56.106 54.519 1.587 18321 25158 1 19 . 1 1 169 169 ARG CB C 169 29.648 29.648 33.227 -3.579 18321 25159 1 19 . 1 1 169 169 ARG H H 169 7.998 7.998 7.699 0.299 18321 25160 1 19 . 1 1 170 170 VAL C C 170 177.590 177.590 174.667 2.923 18321 25161 1 19 . 1 1 171 171 GLY N N 171 112.582 112.582 114.172 -1.590 18321 25162 1 19 . 1 1 171 171 GLY C C 171 170.991 170.991 172.758 -1.767 18321 25163 1 19 . 1 1 171 171 GLY CA C 171 45.361 45.361 44.838 0.523 18321 25164 1 19 . 1 1 171 171 GLY H H 171 9.013 9.013 8.463 0.550 18321 25165 1 19 . 1 1 172 172 MET N N 172 117.368 117.368 121.029 -3.661 18321 25166 1 19 . 1 1 172 172 MET C C 172 177.921 177.921 176.637 1.284 18321 25167 1 19 . 1 1 172 172 MET CA C 172 53.536 53.536 55.284 -1.748 18321 25168 1 19 . 1 1 172 172 MET CB C 172 30.838 30.838 32.735 -1.897 18321 25169 1 19 . 1 1 172 172 MET H H 172 8.885 8.885 8.465 0.420 18321 25170 1 19 . 1 1 173 173 ILE N N 173 113.130 113.130 119.204 -6.074 18321 25171 1 19 . 1 1 173 173 ILE CA C 173 56.284 56.284 57.644 -1.360 18321 25172 1 19 . 1 1 173 173 ILE CB C 173 40.870 40.870 40.184 0.686 18321 25173 1 19 . 1 1 173 173 ILE H H 173 9.704 9.704 9.544 0.160 18321 25174 1 19 . 1 1 174 174 PRO C C 174 176.714 176.714 177.447 -0.733 18321 25175 1 19 . 1 1 174 174 PRO CA C 174 66.290 66.290 61.654 4.636 18321 25176 1 19 . 1 1 174 174 PRO CB C 174 28.993 28.993 30.673 -1.680 18321 25177 1 19 . 1 1 175 175 VAL N N 175 128.066 128.066 124.223 3.843 18321 25178 1 19 . 1 1 175 175 VAL CA C 175 59.356 59.356 67.108 -7.752 18321 25179 1 19 . 1 1 175 175 VAL H H 175 7.327 7.327 8.278 -0.951 18321 25180 1 19 . 1 1 176 176 PRO C C 176 176.351 176.351 176.317 0.034 18321 25181 1 19 . 1 1 177 177 TYR N N 177 115.756 115.756 116.933 -1.177 18321 25182 1 19 . 1 1 177 177 TYR C C 177 175.011 175.011 174.383 0.628 18321 25183 1 19 . 1 1 177 177 TYR CA C 177 56.756 56.756 57.259 -0.503 18321 25184 1 19 . 1 1 177 177 TYR CB C 177 37.507 37.507 39.902 -2.395 18321 25185 1 19 . 1 1 177 177 TYR H H 177 7.784 7.784 7.425 0.359 18321 25186 1 19 . 1 1 178 178 VAL N N 178 111.428 111.428 113.437 -2.009 18321 25187 1 19 . 1 1 178 178 VAL C C 178 173.417 173.417 175.076 -1.659 18321 25188 1 19 . 1 1 178 178 VAL CA C 178 58.307 58.307 59.109 -0.802 18321 25189 1 19 . 1 1 178 178 VAL CB C 178 34.602 34.602 35.690 -1.088 18321 25190 1 19 . 1 1 178 178 VAL H H 178 7.801 7.801 7.548 0.253 18321 25191 1 19 . 1 1 179 179 GLU N N 179 118.581 118.581 119.714 -1.133 18321 25192 1 19 . 1 1 179 179 GLU C C 179 175.225 175.225 175.598 -0.373 18321 25193 1 19 . 1 1 179 179 GLU CA C 179 53.114 53.114 54.509 -1.395 18321 25194 1 19 . 1 1 179 179 GLU CB C 179 32.712 32.712 29.434 3.277 18321 25195 1 19 . 1 1 179 179 GLU H H 179 8.819 8.819 8.666 0.153 18321 25196 1 19 . 1 1 180 180 LYS N N 180 124.167 124.167 120.069 4.098 18321 25197 1 19 . 1 1 180 180 LYS C C 180 176.303 176.303 176.689 -0.386 18321 25198 1 19 . 1 1 180 180 LYS CA C 180 57.318 57.318 56.056 1.262 18321 25199 1 19 . 1 1 180 180 LYS CB C 180 31.675 31.675 32.025 -0.350 18321 25200 1 19 . 1 1 180 180 LYS H H 180 8.775 8.775 8.014 0.761 18321 25201 1 19 . 1 1 181 181 LEU N N 181 125.157 125.157 125.527 -0.370 18321 25202 1 19 . 1 1 181 181 LEU C C 181 176.462 176.462 178.004 -1.542 18321 25203 1 19 . 1 1 181 181 LEU CA C 181 54.470 54.470 57.074 -2.604 18321 25204 1 19 . 1 1 181 181 LEU CB C 181 41.625 41.625 42.669 -1.044 18321 25205 1 19 . 1 1 181 181 LEU H H 181 8.084 8.084 8.221 -0.137 18321 25206 1 19 . 1 1 182 182 VAL N N 182 123.167 123.167 118.570 4.597 18321 25207 1 19 . 1 1 182 182 VAL C C 182 175.983 175.983 174.945 1.038 18321 25208 1 19 . 1 1 182 182 VAL CA C 182 61.613 61.613 62.961 -1.348 18321 25209 1 19 . 1 1 182 182 VAL CB C 182 32.085 32.085 30.332 1.753 18321 25210 1 19 . 1 1 182 182 VAL H H 182 8.345 8.345 8.155 0.190 18321 25211 1 19 . 1 1 183 183 ARG N N 183 125.775 125.775 125.718 0.057 18321 25212 1 19 . 1 1 183 183 ARG CA C 183 57.801 57.801 55.004 2.797 18321 25213 1 19 . 1 1 183 183 ARG CB C 183 30.091 30.091 32.387 -2.296 18321 25214 1 19 . 1 1 183 183 ARG H H 183 8.530 8.530 8.089 0.441 18321 25215 1 19 . 1 1 184 184 SER C C 184 173.239 173.239 173.589 -0.350 18321 25216 1 19 . 1 1 185 185 SER N N 185 116.511 116.511 119.385 -2.874 18321 25217 1 19 . 1 1 185 185 SER CA C 185 58.428 58.428 57.059 1.369 18321 25218 1 19 . 1 1 185 185 SER CB C 185 69.737 69.737 63.101 6.636 18321 25219 1 19 . 1 1 185 185 SER H H 185 7.944 7.944 8.057 -0.113 18321 25220 1 19 . 1 1 190 190 HIS C C 190 176.953 176.953 175.355 1.598 18321 25221 1 19 . 1 1 190 190 HIS CA C 190 54.229 54.229 55.913 -1.684 18321 25222 1 19 . 1 1 190 190 HIS CB C 190 35.112 35.112 31.512 3.600 18321 25223 1 19 . 1 1 191 191 GLY N N 191 109.491 109.491 108.871 0.620 18321 25224 1 19 . 1 1 191 191 GLY C C 191 172.295 172.295 173.993 -1.698 18321 25225 1 19 . 1 1 191 191 GLY CA C 191 45.227 45.227 44.867 0.360 18321 25226 1 19 . 1 1 191 191 GLY H H 191 8.719 8.719 8.463 0.256 18321 25227 1 19 . 1 1 192 192 ASN N N 192 118.700 118.700 117.675 1.025 18321 25228 1 19 . 1 1 192 192 ASN HA H 192 4.312 4.312 4.319 -0.007 18321 25229 1 19 . 1 1 192 192 ASN C C 192 176.369 176.369 175.855 0.514 18321 25230 1 19 . 1 1 192 192 ASN CA C 192 57.787 57.787 53.566 4.221 18321 25231 1 19 . 1 1 192 192 ASN H H 192 7.508 7.508 8.277 -0.769 18321 25232 1 19 . 1 1 193 193 ARG N N 193 120.743 120.743 116.591 4.152 18321 25233 1 19 . 1 1 193 193 ARG H H 193 9.032 9.032 8.460 0.572 18321 25234 1 19 . 1 1 197 197 SER HA H 197 4.388 4.388 4.563 -0.175 18321 25235 1 19 . 1 1 197 197 SER C C 197 174.133 174.133 174.598 -0.465 18321 25236 1 19 . 1 1 197 197 SER CA C 197 58.128 58.128 58.631 -0.503 18321 25237 1 19 . 1 1 197 197 SER CB C 197 62.966 62.966 63.140 -0.174 18321 25238 1 19 . 1 1 198 198 TYR N N 198 121.435 121.435 121.331 0.104 18321 25239 1 19 . 1 1 198 198 TYR HA H 198 4.543 4.543 4.365 0.178 18321 25240 1 19 . 1 1 198 198 TYR C C 198 176.230 176.230 176.927 -0.697 18321 25241 1 19 . 1 1 198 198 TYR CA C 198 57.536 57.536 59.114 -1.578 18321 25242 1 19 . 1 1 198 198 TYR CB C 198 38.279 38.279 38.555 -0.276 18321 25243 1 19 . 1 1 198 198 TYR H H 198 8.071 8.071 7.767 0.304 18321 25244 1 19 . 1 1 199 199 GLY N N 199 110.039 110.039 106.838 3.201 18321 25245 1 19 . 1 1 199 199 GLY C C 199 173.475 173.475 173.149 0.326 18321 25246 1 19 . 1 1 199 199 GLY CA C 199 44.805 44.805 44.874 -0.069 18321 25247 1 19 . 1 1 199 199 GLY H H 199 8.162 8.162 7.917 0.245 18321 25248 1 19 . 1 1 200 200 ILE N N 200 121.530 121.530 119.423 2.107 18321 25249 1 19 . 1 1 200 200 ILE CA C 200 58.102 58.102 57.575 0.527 18321 25250 1 19 . 1 1 200 200 ILE CB C 200 37.760 37.760 39.261 -1.501 18321 25251 1 19 . 1 1 200 200 ILE H H 200 7.851 7.851 7.992 -0.141 18321 25252 1 19 . 1 1 201 201 PRO C C 201 176.485 176.485 175.716 0.769 18321 25253 1 19 . 1 1 201 201 PRO CA C 201 53.893 53.893 63.284 -9.391 18321 25254 1 19 . 1 1 201 201 PRO CB C 201 29.042 29.042 30.850 -1.808 18321 25255 1 19 . 1 1 202 202 GLU N N 202 122.468 122.468 122.696 -0.228 18321 25256 1 19 . 1 1 202 202 GLU CA C 202 62.490 62.490 54.571 7.919 18321 25257 1 19 . 1 1 202 202 GLU CB C 202 31.170 31.170 31.488 -0.317 18321 25258 1 19 . 1 1 202 202 GLU H H 202 8.328 8.328 7.973 0.355 18321 25259 1 19 . 1 1 203 203 PRO CA C 203 62.803 62.803 63.037 -0.234 18321 25260 1 19 . 1 1 203 203 PRO CB C 203 31.220 31.220 32.335 -1.115 18321 25261 1 19 . 1 1 204 204 ALA N N 204 123.251 123.251 121.833 1.418 18321 25262 1 19 . 1 1 204 204 ALA HA H 204 4.180 4.180 4.320 -0.140 18321 25263 1 19 . 1 1 204 204 ALA CA C 204 52.124 52.124 51.595 0.529 18321 25264 1 19 . 1 1 204 204 ALA CB C 204 18.892 18.892 20.506 -1.614 18321 25265 1 19 . 1 1 204 204 ALA H H 204 8.308 8.308 7.554 0.754 18321 25266 1 19 . 1 1 205 205 HIS N N 205 117.874 117.874 118.460 -0.586 18321 25267 1 19 . 1 1 205 205 HIS C C 205 173.282 173.282 174.593 -1.311 18321 25268 1 19 . 1 1 205 205 HIS H H 205 8.045 8.045 8.253 -0.208 18321 25269 1 19 . 1 1 206 206 ALA N N 206 125.519 125.519 122.544 2.975 18321 25270 1 19 . 1 1 206 206 ALA HA H 206 4.204 4.204 4.459 -0.255 18321 25271 1 19 . 1 1 206 206 ALA CA C 206 40.196 40.196 51.636 -11.440 18321 25272 1 19 . 1 1 206 206 ALA CB C 206 19.407 19.407 20.401 -0.994 18321 25273 1 19 . 1 1 206 206 ALA H H 206 8.061 8.061 8.299 -0.238 18321 25274 1 19 . 1 1 207 207 TYR N N 207 120.381 120.381 119.705 0.676 18321 25275 1 19 . 1 1 207 207 TYR HA H 207 4.570 4.570 4.709 -0.139 18321 25276 1 19 . 1 1 207 207 TYR CA C 207 52.572 52.572 58.354 -5.782 18321 25277 1 19 . 1 1 207 207 TYR CB C 207 41.333 41.333 39.304 2.029 18321 25278 1 19 . 1 1 207 207 TYR H H 207 8.199 8.199 8.527 -0.328 18321 25279 1 19 . 1 1 208 208 ALA HA H 208 4.281 4.281 4.546 -0.265 18321 25280 1 19 . 1 1 208 208 ALA C C 208 177.736 177.736 176.140 1.596 18321 25281 1 19 . 1 1 208 208 ALA CA C 208 52.084 52.084 51.676 0.408 18321 25282 1 19 . 1 1 208 208 ALA CB C 208 18.999 18.999 20.555 -1.556 18321 25283 1 19 . 1 1 209 209 GLN N N 209 119.295 119.295 120.666 -1.371 18321 25284 1 19 . 1 1 209 209 GLN CA C 209 61.474 61.474 53.398 8.076 18321 25285 1 19 . 1 1 209 209 GLN CB C 209 32.039 32.039 29.148 2.891 18321 25286 1 19 . 1 1 209 209 GLN H H 209 8.125 8.125 8.473 -0.348 18321 25287 1 19 . 1 1 210 210 PRO HA H 210 4.395 4.395 4.313 0.082 18321 25288 1 19 . 1 1 210 210 PRO CA C 210 62.584 62.584 63.675 -1.091 18321 25289 1 19 . 1 1 211 211 GLN HA H 211 4.377 4.377 4.479 -0.102 18321 25290 1 19 . 1 1 211 211 GLN CA C 211 55.859 55.859 55.513 0.346 18321 25291 1 19 . 1 1 211 211 GLN CB C 211 29.577 29.577 29.522 0.055 18321 25292 1 19 . 1 1 212 212 THR C C 212 176.551 176.551 174.504 2.047 18321 25293 1 19 . 1 1 212 212 THR CB C 212 69.890 69.890 69.641 0.249 18321 25294 1 19 . 1 1 213 213 THR N N 213 108.487 108.487 119.602 -11.115 18321 25295 1 19 . 1 1 213 213 THR CA C 213 61.236 61.236 62.919 -1.683 18321 25296 1 19 . 1 1 213 213 THR CB C 213 69.091 69.091 69.037 0.054 18321 25297 1 19 . 1 1 213 213 THR H H 213 8.243 8.243 7.839 0.404 18321 25298 1 19 . 1 1 214 214 THR N N 214 119.445 119.445 120.916 -1.471 18321 25299 1 19 . 1 1 214 214 THR CA C 214 59.425 59.425 63.545 -4.120 18321 25300 1 19 . 1 1 214 214 THR CB C 214 69.251 69.251 68.058 1.193 18321 25301 1 19 . 1 1 214 214 THR H H 214 8.188 8.188 8.253 -0.065 18321 25302 1 19 . 1 1 215 215 PRO HA H 215 4.361 4.361 4.572 -0.211 18321 25303 1 19 . 1 1 215 215 PRO C C 215 175.422 175.422 176.015 -0.593 18321 25304 1 19 . 1 1 215 215 PRO CA C 215 63.320 63.320 62.621 0.699 18321 25305 1 19 . 1 1 215 215 PRO CB C 215 31.918 31.918 31.644 0.274 18321 25306 1 19 . 1 1 216 216 LEU N N 216 121.602 121.602 126.516 -4.914 18321 25307 1 19 . 1 1 216 216 LEU CA C 216 52.203 52.203 52.737 -0.534 18321 25308 1 19 . 1 1 216 216 LEU CB C 216 42.451 42.451 42.301 0.150 18321 25309 1 19 . 1 1 216 216 LEU H H 216 7.891 7.891 7.965 -0.074 18321 25310 1 19 . 1 1 217 217 PRO HA H 217 4.398 4.398 4.552 -0.154 18321 25311 1 19 . 1 1 217 217 PRO C C 217 176.577 176.577 176.240 0.337 18321 25312 1 19 . 1 1 217 217 PRO CA C 217 62.984 62.984 62.190 0.795 18321 25313 1 19 . 1 1 217 217 PRO CB C 217 32.056 32.056 32.355 -0.299 18321 25314 1 19 . 1 1 218 218 ALA N N 218 124.087 124.087 123.002 1.085 18321 25315 1 19 . 1 1 218 218 ALA HA H 218 4.309 4.309 4.384 -0.075 18321 25316 1 19 . 1 1 218 218 ALA C C 218 177.844 177.844 177.886 -0.042 18321 25317 1 19 . 1 1 218 218 ALA CA C 218 52.379 52.379 51.751 0.628 18321 25318 1 19 . 1 1 218 218 ALA CB C 218 19.133 19.133 18.788 0.345 18321 25319 1 19 . 1 1 218 218 ALA H H 218 8.261 8.261 7.788 0.473 18321 25320 1 19 . 1 1 219 219 VAL N N 219 118.942 118.942 120.707 -1.765 18321 25321 1 19 . 1 1 219 219 VAL HA H 219 4.142 4.142 4.131 0.011 18321 25322 1 19 . 1 1 219 219 VAL CA C 219 62.102 62.102 62.394 -0.291 18321 25323 1 19 . 1 1 219 219 VAL CB C 219 32.923 32.923 30.820 2.103 18321 25324 1 19 . 1 1 219 219 VAL H H 219 8.049 8.049 7.650 0.399 18321 25325 1 19 . 1 1 220 220 SER N N 220 119.207 119.207 123.701 -4.494 18321 25326 1 19 . 1 1 220 220 SER HA H 220 4.436 4.436 4.549 -0.113 18321 25327 1 19 . 1 1 220 220 SER CA C 220 57.813 57.813 57.809 0.005 18321 25328 1 19 . 1 1 220 220 SER CB C 220 63.375 63.375 63.351 0.024 18321 25329 1 19 . 1 1 220 220 SER H H 220 8.275 8.275 8.023 0.252 18321 25330 1 19 . 1 1 221 221 GLY N N 221 110.973 110.973 114.959 -3.986 18321 25331 1 19 . 1 1 221 221 GLY C C 221 173.962 173.962 173.652 0.310 18321 25332 1 19 . 1 1 221 221 GLY CA C 221 45.286 45.286 44.519 0.767 18321 25333 1 19 . 1 1 221 221 GLY H H 221 8.374 8.374 8.656 -0.282 18321 25334 1 19 . 1 1 222 222 SER N N 222 115.516 115.516 119.014 -3.498 18321 25335 1 19 . 1 1 222 222 SER HA H 222 4.763 4.763 4.646 0.117 18321 25336 1 19 . 1 1 222 222 SER CA C 222 56.407 56.407 55.583 0.825 18321 25337 1 19 . 1 1 222 222 SER CB C 222 63.993 63.993 63.794 0.199 18321 25338 1 19 . 1 1 222 222 SER H H 222 8.155 8.155 7.803 0.352 18321 25339 1 19 . 1 1 223 223 PRO HA H 223 4.417 4.417 4.491 -0.074 18321 25340 1 19 . 1 1 223 223 PRO CA C 223 63.805 63.805 62.588 1.217 18321 25341 1 19 . 1 1 223 223 PRO CB C 223 32.090 32.090 31.592 0.498 18321 25342 1 19 . 1 1 224 224 GLY N N 224 109.149 109.149 112.214 -3.065 18321 25343 1 19 . 1 1 224 224 GLY C C 224 173.813 173.813 173.815 -0.002 18321 25344 1 19 . 1 1 224 224 GLY CA C 224 44.512 44.512 44.666 -0.154 18321 25345 1 19 . 1 1 224 224 GLY H H 224 8.376 8.376 8.080 0.296 18321 25346 1 19 . 1 1 225 225 ALA N N 225 123.599 123.599 125.628 -2.029 18321 25347 1 19 . 1 1 225 225 ALA C C 225 177.341 177.341 176.967 0.374 18321 25348 1 19 . 1 1 225 225 ALA CA C 225 51.878 51.878 52.438 -0.560 18321 25349 1 19 . 1 1 225 225 ALA CB C 225 19.169 19.169 18.158 1.011 18321 25350 1 19 . 1 1 225 225 ALA H H 225 7.959 7.959 7.966 -0.007 18321 25351 1 19 . 1 1 226 226 ALA N N 226 123.218 123.218 117.716 5.502 18321 25352 1 19 . 1 1 226 226 ALA HA H 226 4.350 4.350 4.338 0.012 18321 25353 1 19 . 1 1 226 226 ALA C C 226 177.520 177.520 177.141 0.379 18321 25354 1 19 . 1 1 226 226 ALA CA C 226 52.535 52.535 52.904 -0.369 18321 25355 1 19 . 1 1 226 226 ALA CB C 226 19.171 19.171 17.428 1.743 18321 25356 1 19 . 1 1 226 226 ALA H H 226 8.169 8.169 8.256 -0.087 18321 25357 1 19 . 1 1 227 227 ILE N N 227 120.086 120.086 112.850 7.236 18321 25358 1 19 . 1 1 227 227 ILE HA H 227 4.201 4.201 4.167 0.034 18321 25359 1 19 . 1 1 227 227 ILE C C 227 174.814 174.814 175.328 -0.514 18321 25360 1 19 . 1 1 227 227 ILE CA C 227 60.929 60.929 61.909 -0.980 18321 25361 1 19 . 1 1 227 227 ILE CB C 227 38.872 38.872 38.468 0.404 18321 25362 1 19 . 1 1 227 227 ILE H H 227 8.037 8.037 7.660 0.377 18321 25363 1 19 . 1 1 228 228 THR N N 228 117.224 117.224 119.698 -2.474 18321 25364 1 19 . 1 1 228 228 THR HA H 228 4.203 4.203 4.542 -0.339 18321 25365 1 19 . 1 1 228 228 THR CA C 228 57.108 57.108 59.936 -2.828 18321 25366 1 19 . 1 1 228 228 THR CB C 228 69.945 69.945 68.960 0.985 18321 25367 1 19 . 1 1 228 228 THR H H 228 7.775 7.775 8.379 -0.604 18321 25368 1 19 . 1 1 229 229 PRO HA H 229 4.750 4.750 4.728 0.022 18321 25369 1 19 . 1 1 229 229 PRO CA C 229 62.480 62.480 62.396 0.084 18321 25370 1 19 . 1 1 229 229 PRO CB C 229 33.995 33.995 31.981 2.014 18321 25371 1 19 . 1 1 230 230 LEU N N 230 123.629 123.629 124.535 -0.906 18321 25372 1 19 . 1 1 230 230 LEU CA C 230 53.076 53.076 52.207 0.869 18321 25373 1 19 . 1 1 230 230 LEU CB C 230 40.608 40.608 41.115 -0.507 18321 25374 1 19 . 1 1 230 230 LEU H H 230 8.453 8.453 8.037 0.416 18321 25375 1 19 . 1 1 231 231 PRO HA H 231 4.412 4.412 4.542 -0.130 18321 25376 1 19 . 1 1 231 231 PRO C C 231 176.571 176.571 175.706 0.865 18321 25377 1 19 . 1 1 231 231 PRO CA C 231 63.225 63.225 62.852 0.373 18321 25378 1 19 . 1 1 231 231 PRO CB C 231 31.191 31.191 29.903 1.288 18321 25379 1 19 . 1 1 232 232 SER N N 232 115.169 115.169 114.566 0.603 18321 25380 1 19 . 1 1 232 232 SER HA H 232 4.450 4.450 4.132 0.318 18321 25381 1 19 . 1 1 232 232 SER CA C 232 58.604 58.604 59.485 -0.881 18321 25382 1 19 . 1 1 232 232 SER CB C 232 63.962 63.962 61.813 2.148 18321 25383 1 19 . 1 1 232 232 SER H H 232 8.280 8.280 8.424 -0.144 18321 25384 1 19 . 1 1 233 233 THR N N 233 115.155 115.155 112.816 2.339 18321 25385 1 19 . 1 1 233 233 THR HA H 233 4.351 4.351 4.105 0.246 18321 25386 1 19 . 1 1 233 233 THR C C 233 177.237 177.237 174.243 2.994 18321 25387 1 19 . 1 1 233 233 THR CA C 233 61.939 61.939 63.689 -1.750 18321 25388 1 19 . 1 1 233 233 THR CB C 233 68.986 68.986 69.223 -0.237 18321 25389 1 19 . 1 1 233 233 THR H H 233 8.096 8.096 7.705 0.391 18321 25390 1 19 . 1 1 234 234 GLN N N 234 122.040 122.040 117.278 4.762 18321 25391 1 19 . 1 1 234 234 GLN HA H 234 4.681 4.681 4.003 0.678 18321 25392 1 19 . 1 1 234 234 GLN C C 234 176.177 176.177 174.570 1.607 18321 25393 1 19 . 1 1 234 234 GLN CA C 234 55.861 55.861 56.644 -0.783 18321 25394 1 19 . 1 1 234 234 GLN CB C 234 28.583 28.583 26.586 1.997 18321 25395 1 19 . 1 1 234 234 GLN H H 234 8.256 8.256 8.441 -0.185 18321 25396 1 19 . 1 1 235 235 ASN N N 235 119.506 119.506 117.016 2.490 18321 25397 1 19 . 1 1 235 235 ASN HA H 235 4.775 4.775 4.682 0.093 18321 25398 1 19 . 1 1 235 235 ASN C C 235 174.974 174.974 175.656 -0.682 18321 25399 1 19 . 1 1 235 235 ASN CA C 235 53.191 53.191 52.763 0.428 18321 25400 1 19 . 1 1 235 235 ASN CB C 235 38.511 38.511 38.391 0.120 18321 25401 1 19 . 1 1 235 235 ASN H H 235 8.346 8.346 8.274 0.072 18321 25402 1 19 . 1 1 236 236 GLY N N 236 109.378 109.378 108.487 0.891 18321 25403 1 19 . 1 1 236 236 GLY CA C 236 44.023 44.023 44.423 -0.400 18321 25404 1 19 . 1 1 236 236 GLY H H 236 7.939 7.939 7.768 0.171 18321 25405 1 19 . 1 1 237 237 PRO HA H 237 4.336 4.336 4.244 0.092 18321 25406 1 19 . 1 1 237 237 PRO C C 237 175.942 175.942 175.684 0.258 18321 25407 1 19 . 1 1 237 237 PRO CA C 237 62.797 62.797 62.599 0.198 18321 25408 1 19 . 1 1 237 237 PRO CB C 237 27.421 27.421 31.805 -4.384 18321 25409 1 19 . 1 1 238 238 VAL N N 238 120.535 120.535 120.946 -0.411 18321 25410 1 19 . 1 1 238 238 VAL HA H 238 4.195 4.195 4.036 0.159 18321 25411 1 19 . 1 1 238 238 VAL C C 238 173.775 173.775 174.968 -1.193 18321 25412 1 19 . 1 1 238 238 VAL CA C 238 61.173 61.173 61.782 -0.609 18321 25413 1 19 . 1 1 238 238 VAL CB C 238 38.328 38.328 32.133 6.195 18321 25414 1 19 . 1 1 238 238 VAL H H 238 7.986 7.986 7.973 0.013 18321 25415 1 19 . 1 1 239 239 PHE N N 239 123.522 123.522 123.577 -0.055 18321 25416 1 19 . 1 1 239 239 PHE HA H 239 5.539 5.539 4.825 0.714 18321 25417 1 19 . 1 1 239 239 PHE C C 239 174.207 174.207 174.317 -0.110 18321 25418 1 19 . 1 1 239 239 PHE CA C 239 56.993 56.993 56.445 0.548 18321 25419 1 19 . 1 1 239 239 PHE CB C 239 41.743 41.743 41.669 0.074 18321 25420 1 19 . 1 1 239 239 PHE H H 239 8.927 8.927 8.479 0.448 18321 25421 1 19 . 1 1 240 240 ALA N N 240 120.871 120.871 125.215 -4.344 18321 25422 1 19 . 1 1 240 240 ALA HA H 240 5.352 5.352 5.866 -0.514 18321 25423 1 19 . 1 1 240 240 ALA C C 240 174.639 174.639 175.504 -0.865 18321 25424 1 19 . 1 1 240 240 ALA CA C 240 49.736 49.736 50.606 -0.870 18321 25425 1 19 . 1 1 240 240 ALA CB C 240 23.480 23.480 23.149 0.331 18321 25426 1 19 . 1 1 240 240 ALA H H 240 9.398 9.398 8.604 0.794 18321 25427 1 19 . 1 1 241 241 LYS N N 241 121.227 121.227 121.360 -0.133 18321 25428 1 19 . 1 1 241 241 LYS HA H 241 5.373 5.373 5.494 -0.121 18321 25429 1 19 . 1 1 241 241 LYS C C 241 176.772 176.772 176.285 0.487 18321 25430 1 19 . 1 1 241 241 LYS CA C 241 53.128 53.128 53.754 -0.626 18321 25431 1 19 . 1 1 241 241 LYS CB C 241 34.850 34.850 34.819 0.031 18321 25432 1 19 . 1 1 241 241 LYS H H 241 8.947 8.947 8.768 0.179 18321 25433 1 19 . 1 1 242 242 ALA N N 242 126.833 126.833 128.245 -1.412 18321 25434 1 19 . 1 1 242 242 ALA HA H 242 4.764 4.764 4.626 0.138 18321 25435 1 19 . 1 1 242 242 ALA C C 242 178.506 178.506 177.627 0.879 18321 25436 1 19 . 1 1 242 242 ALA CA C 242 52.788 52.788 52.451 0.337 18321 25437 1 19 . 1 1 242 242 ALA CB C 242 19.084 19.084 19.003 0.081 18321 25438 1 19 . 1 1 242 242 ALA H H 242 9.373 9.373 8.802 0.571 18321 25439 1 19 . 1 1 243 243 ILE N N 243 118.731 118.731 118.979 -0.248 18321 25440 1 19 . 1 1 243 243 ILE HA H 243 4.454 4.454 4.343 0.111 18321 25441 1 19 . 1 1 243 243 ILE C C 243 174.773 174.773 176.130 -1.357 18321 25442 1 19 . 1 1 243 243 ILE CA C 243 60.613 60.613 61.873 -1.260 18321 25443 1 19 . 1 1 243 243 ILE CB C 243 39.232 39.232 38.928 0.304 18321 25444 1 19 . 1 1 243 243 ILE H H 243 8.933 8.933 8.555 0.378 18321 25445 1 19 . 1 1 244 244 GLN N N 244 121.616 121.616 120.282 1.334 18321 25446 1 19 . 1 1 244 244 GLN HA H 244 4.283 4.283 4.558 -0.275 18321 25447 1 19 . 1 1 244 244 GLN C C 244 172.815 172.815 174.534 -1.719 18321 25448 1 19 . 1 1 244 244 GLN CA C 244 54.750 54.750 54.065 0.685 18321 25449 1 19 . 1 1 244 244 GLN CB C 244 31.469 31.469 33.246 -1.777 18321 25450 1 19 . 1 1 244 244 GLN H H 244 7.438 7.438 7.654 -0.216 18321 25451 1 19 . 1 1 245 245 LYS N N 245 124.215 124.215 124.473 -0.258 18321 25452 1 19 . 1 1 245 245 LYS HA H 245 3.962 3.962 4.381 -0.419 18321 25453 1 19 . 1 1 245 245 LYS C C 245 175.679 175.679 176.868 -1.189 18321 25454 1 19 . 1 1 245 245 LYS CA C 245 56.413 56.413 57.632 -1.219 18321 25455 1 19 . 1 1 245 245 LYS CB C 245 32.847 32.847 32.819 0.028 18321 25456 1 19 . 1 1 245 245 LYS H H 245 8.318 8.318 8.571 -0.253 18321 25457 1 19 . 1 1 246 246 ARG N N 246 127.327 127.327 125.714 1.613 18321 25458 1 19 . 1 1 246 246 ARG HA H 246 4.221 4.221 4.632 -0.411 18321 25459 1 19 . 1 1 246 246 ARG CA C 246 56.279 56.279 54.287 1.992 18321 25460 1 19 . 1 1 246 246 ARG CB C 246 32.987 32.987 30.628 2.359 18321 25461 1 19 . 1 1 246 246 ARG H H 246 9.248 9.248 8.814 0.434 18321 25462 1 19 . 1 1 249 249 CYS HA H 249 4.260 4.260 4.433 -0.173 18321 25463 1 19 . 1 1 249 249 CYS CA C 249 55.886 55.886 56.371 -0.485 18321 25464 1 19 . 1 1 249 249 CYS CB C 249 34.146 34.146 29.445 4.701 18321 25465 1 19 . 1 1 250 250 ALA HA H 250 3.926 3.926 4.088 -0.162 18321 25466 1 19 . 1 1 250 250 ALA CA C 250 54.344 54.344 54.625 -0.281 18321 25467 1 19 . 1 1 250 250 ALA CB C 250 18.342 18.342 18.739 -0.397 18321 25468 1 19 . 1 1 251 251 TYR N N 251 110.618 110.618 112.359 -1.741 18321 25469 1 19 . 1 1 251 251 TYR HA H 251 4.489 4.489 4.539 -0.050 18321 25470 1 19 . 1 1 251 251 TYR C C 251 175.286 175.286 175.543 -0.257 18321 25471 1 19 . 1 1 251 251 TYR CA C 251 56.137 56.137 57.384 -1.247 18321 25472 1 19 . 1 1 251 251 TYR CB C 251 37.203 37.203 38.454 -1.251 18321 25473 1 19 . 1 1 251 251 TYR H H 251 7.037 7.037 7.595 -0.558 18321 25474 1 19 . 1 1 252 252 ASP N N 252 121.835 121.835 120.954 0.881 18321 25475 1 19 . 1 1 252 252 ASP HA H 252 4.763 4.763 4.897 -0.134 18321 25476 1 19 . 1 1 252 252 ASP CA C 252 52.351 52.351 52.852 -0.500 18321 25477 1 19 . 1 1 252 252 ASP CB C 252 39.995 39.995 39.833 0.162 18321 25478 1 19 . 1 1 252 252 ASP H H 252 7.339 7.339 7.038 0.301 18321 25479 1 19 . 1 1 253 253 LYS N N 253 123.177 123.177 120.773 2.404 18321 25480 1 19 . 1 1 253 253 LYS HA H 253 4.270 4.270 4.148 0.122 18321 25481 1 19 . 1 1 253 253 LYS C C 253 177.724 177.724 177.543 0.181 18321 25482 1 19 . 1 1 253 253 LYS CA C 253 57.036 57.036 58.410 -1.375 18321 25483 1 19 . 1 1 253 253 LYS H H 253 8.396 8.396 8.057 0.339 18321 25484 1 19 . 1 1 254 254 THR N N 254 108.317 108.317 110.742 -2.425 18321 25485 1 19 . 1 1 254 254 THR HA H 254 4.517 4.517 4.222 0.295 18321 25486 1 19 . 1 1 254 254 THR C C 254 174.012 174.012 174.251 -0.239 18321 25487 1 19 . 1 1 254 254 THR CA C 254 61.036 61.036 61.897 -0.861 18321 25488 1 19 . 1 1 254 254 THR CB C 254 69.307 69.307 67.924 1.383 18321 25489 1 19 . 1 1 254 254 THR H H 254 8.217 8.217 8.076 0.141 18321 25490 1 19 . 1 1 255 255 ALA N N 255 124.762 124.762 123.809 0.953 18321 25491 1 19 . 1 1 255 255 ALA HA H 255 4.524 4.524 4.806 -0.282 18321 25492 1 19 . 1 1 255 255 ALA C C 255 176.630 176.630 176.600 0.030 18321 25493 1 19 . 1 1 255 255 ALA CA C 255 51.352 51.352 51.094 0.258 18321 25494 1 19 . 1 1 255 255 ALA CB C 255 20.135 20.135 19.866 0.269 18321 25495 1 19 . 1 1 255 255 ALA H H 255 7.096 7.096 7.077 0.019 18321 25496 1 19 . 1 1 256 256 LEU N N 256 124.379 124.379 124.343 0.036 18321 25497 1 19 . 1 1 256 256 LEU HA H 256 4.328 4.328 4.444 -0.116 18321 25498 1 19 . 1 1 256 256 LEU C C 256 176.007 176.007 175.686 0.321 18321 25499 1 19 . 1 1 256 256 LEU CA C 256 53.502 53.502 54.076 -0.574 18321 25500 1 19 . 1 1 256 256 LEU CB C 256 44.665 44.665 43.441 1.224 18321 25501 1 19 . 1 1 256 256 LEU H H 256 8.889 8.889 8.028 0.861 18321 25502 1 19 . 1 1 257 257 ALA N N 257 129.619 129.619 129.160 0.459 18321 25503 1 19 . 1 1 257 257 ALA HA H 257 4.445 4.445 4.656 -0.211 18321 25504 1 19 . 1 1 257 257 ALA C C 257 176.813 176.813 176.785 0.028 18321 25505 1 19 . 1 1 257 257 ALA CA C 257 51.179 51.179 51.667 -0.488 18321 25506 1 19 . 1 1 257 257 ALA CB C 257 18.973 18.973 18.686 0.287 18321 25507 1 19 . 1 1 257 257 ALA H H 257 8.529 8.529 8.414 0.115 18321 25508 1 19 . 1 1 258 258 LEU N N 258 119.300 119.300 126.187 -6.887 18321 25509 1 19 . 1 1 258 258 LEU HA H 258 4.782 4.782 4.550 0.232 18321 25510 1 19 . 1 1 258 258 LEU CA C 258 53.259 53.259 53.880 -0.621 18321 25511 1 19 . 1 1 258 258 LEU CB C 258 45.972 45.972 43.868 2.104 18321 25512 1 19 . 1 1 258 258 LEU H H 258 8.505 8.505 8.624 -0.119 18321 25513 1 19 . 1 1 259 259 GLU N N 259 123.919 123.919 124.993 -1.074 18321 25514 1 19 . 1 1 259 259 GLU HA H 259 4.516 4.516 4.479 0.037 18321 25515 1 19 . 1 1 259 259 GLU C C 259 175.795 175.795 175.632 0.163 18321 25516 1 19 . 1 1 259 259 GLU CA C 259 52.896 52.896 54.292 -1.396 18321 25517 1 19 . 1 1 259 259 GLU H H 259 8.943 8.943 8.615 0.328 18321 25518 1 19 . 1 1 260 260 VAL N N 260 122.122 122.122 120.915 1.207 18321 25519 1 19 . 1 1 260 260 VAL HA H 260 2.923 2.923 4.256 -1.333 18321 25520 1 19 . 1 1 260 260 VAL C C 260 177.964 177.964 177.044 0.920 18321 25521 1 19 . 1 1 260 260 VAL CA C 260 65.417 65.417 63.706 1.711 18321 25522 1 19 . 1 1 260 260 VAL CB C 260 30.668 30.668 31.402 -0.734 18321 25523 1 19 . 1 1 260 260 VAL H H 260 8.956 8.956 8.430 0.527 18321 25524 1 19 . 1 1 261 261 GLY N N 261 116.009 116.009 116.948 -0.939 18321 25525 1 19 . 1 1 261 261 GLY C C 261 176.288 176.288 173.790 2.498 18321 25526 1 19 . 1 1 261 261 GLY CA C 261 44.210 44.210 44.817 -0.607 18321 25527 1 19 . 1 1 261 261 GLY H H 261 8.799 8.799 8.980 -0.181 18321 25528 1 19 . 1 1 262 262 ASP N N 262 121.945 121.945 121.433 0.512 18321 25529 1 19 . 1 1 262 262 ASP HA H 262 4.423 4.423 4.921 -0.498 18321 25530 1 19 . 1 1 262 262 ASP C C 262 175.381 175.381 175.356 0.025 18321 25531 1 19 . 1 1 262 262 ASP CA C 262 55.243 55.243 52.978 2.265 18321 25532 1 19 . 1 1 262 262 ASP CB C 262 41.819 41.819 42.256 -0.437 18321 25533 1 19 . 1 1 262 262 ASP H H 262 8.180 8.180 7.812 0.368 18321 25534 1 19 . 1 1 263 263 ILE N N 263 121.452 121.452 124.144 -2.692 18321 25535 1 19 . 1 1 263 263 ILE HA H 263 4.707 4.707 4.259 0.448 18321 25536 1 19 . 1 1 263 263 ILE C C 263 174.996 174.996 176.077 -1.081 18321 25537 1 19 . 1 1 263 263 ILE CA C 263 59.289 59.289 60.204 -0.915 18321 25538 1 19 . 1 1 263 263 ILE CB C 263 36.987 36.987 37.634 -0.647 18321 25539 1 19 . 1 1 263 263 ILE H H 263 8.460 8.460 8.707 -0.247 18321 25540 1 19 . 1 1 264 264 VAL N N 264 128.756 128.756 129.320 -0.564 18321 25541 1 19 . 1 1 264 264 VAL HA H 264 4.309 4.309 4.154 0.155 18321 25542 1 19 . 1 1 264 264 VAL C C 264 175.486 175.486 174.761 0.725 18321 25543 1 19 . 1 1 264 264 VAL CA C 264 59.091 59.091 61.486 -2.395 18321 25544 1 19 . 1 1 264 264 VAL CB C 264 34.541 34.541 32.000 2.541 18321 25545 1 19 . 1 1 264 264 VAL H H 264 9.479 9.479 9.186 0.293 18321 25546 1 19 . 1 1 265 265 LYS N N 265 128.101 128.101 130.403 -2.302 18321 25547 1 19 . 1 1 265 265 LYS HA H 265 4.342 4.342 4.113 0.229 18321 25548 1 19 . 1 1 265 265 LYS C C 265 175.531 175.531 174.871 0.660 18321 25549 1 19 . 1 1 265 265 LYS CA C 265 55.620 55.620 55.604 0.016 18321 25550 1 19 . 1 1 265 265 LYS CB C 265 33.149 33.149 32.309 0.840 18321 25551 1 19 . 1 1 265 265 LYS H H 265 8.715 8.715 8.636 0.079 18321 25552 1 19 . 1 1 266 266 VAL N N 266 129.537 129.537 127.503 2.034 18321 25553 1 19 . 1 1 266 266 VAL HA H 266 4.333 4.333 4.384 -0.051 18321 25554 1 19 . 1 1 266 266 VAL C C 266 176.166 176.166 174.906 1.260 18321 25555 1 19 . 1 1 266 266 VAL CA C 266 63.339 63.339 61.054 2.285 18321 25556 1 19 . 1 1 266 266 VAL CB C 266 30.712 30.712 33.866 -3.154 18321 25557 1 19 . 1 1 266 266 VAL H H 266 9.073 9.073 7.678 1.395 18321 25558 1 19 . 1 1 267 267 THR N N 267 120.020 120.020 121.404 -1.384 18321 25559 1 19 . 1 1 267 267 THR HA H 267 4.189 4.189 4.321 -0.132 18321 25560 1 19 . 1 1 267 267 THR C C 267 176.054 176.054 175.026 1.028 18321 25561 1 19 . 1 1 267 267 THR CA C 267 62.204 62.204 62.695 -0.491 18321 25562 1 19 . 1 1 267 267 THR CB C 267 68.200 68.200 69.472 -1.272 18321 25563 1 19 . 1 1 267 267 THR H H 267 9.130 9.130 8.363 0.767 18321 25564 1 19 . 1 1 268 268 ARG N N 268 120.839 120.839 122.643 -1.804 18321 25565 1 19 . 1 1 268 268 ARG HA H 268 4.236 4.236 4.535 -0.299 18321 25566 1 19 . 1 1 268 268 ARG CA C 268 56.321 56.321 55.193 1.129 18321 25567 1 19 . 1 1 268 268 ARG CB C 268 33.049 33.049 32.737 0.312 18321 25568 1 19 . 1 1 268 268 ARG H H 268 7.631 7.631 7.671 -0.040 18321 25569 1 19 . 1 1 269 269 MET N N 269 125.443 125.443 125.629 -0.186 18321 25570 1 19 . 1 1 269 269 MET C C 269 174.392 174.392 174.822 -0.430 18321 25571 1 19 . 1 1 269 269 MET H H 269 8.532 8.532 8.543 -0.011 18321 25572 1 19 . 1 1 270 270 ASN N N 270 119.125 119.125 122.994 -3.869 18321 25573 1 19 . 1 1 270 270 ASN HA H 270 4.546 4.546 4.827 -0.281 18321 25574 1 19 . 1 1 270 270 ASN C C 270 172.133 172.133 175.386 -3.253 18321 25575 1 19 . 1 1 270 270 ASN CA C 270 53.639 53.639 52.886 0.753 18321 25576 1 19 . 1 1 270 270 ASN CB C 270 39.845 39.845 39.990 -0.145 18321 25577 1 19 . 1 1 270 270 ASN H H 270 6.631 6.631 8.486 -1.855 18321 25578 1 19 . 1 1 271 271 ILE N N 271 122.532 122.532 124.586 -2.054 18321 25579 1 19 . 1 1 271 271 ILE HA H 271 4.417 4.417 4.098 0.319 18321 25580 1 19 . 1 1 271 271 ILE CA C 271 63.348 63.348 61.819 1.529 18321 25581 1 19 . 1 1 271 271 ILE CB C 271 38.198 38.198 35.874 2.324 18321 25582 1 19 . 1 1 271 271 ILE H H 271 8.565 8.565 8.817 -0.252 18321 25583 1 19 . 1 1 272 272 ASN HA H 272 4.527 4.527 4.954 -0.427 18321 25584 1 19 . 1 1 272 272 ASN C C 272 176.259 176.259 174.945 1.314 18321 25585 1 19 . 1 1 272 272 ASN CA C 272 53.225 53.225 53.185 0.040 18321 25586 1 19 . 1 1 272 272 ASN CB C 272 37.565 37.565 40.964 -3.399 18321 25587 1 19 . 1 1 273 273 GLY N N 273 107.043 107.043 109.181 -2.138 18321 25588 1 19 . 1 1 273 273 GLY C C 273 173.216 173.216 172.302 0.914 18321 25589 1 19 . 1 1 273 273 GLY CA C 273 45.299 45.299 45.503 -0.204 18321 25590 1 19 . 1 1 273 273 GLY H H 273 8.086 8.086 7.962 0.124 18321 25591 1 19 . 1 1 274 274 GLN N N 274 120.624 120.624 119.420 1.204 18321 25592 1 19 . 1 1 274 274 GLN HA H 274 4.551 4.551 4.779 -0.228 18321 25593 1 19 . 1 1 274 274 GLN C C 274 175.039 175.039 175.041 -0.002 18321 25594 1 19 . 1 1 274 274 GLN CA C 274 54.556 54.556 53.853 0.702 18321 25595 1 19 . 1 1 274 274 GLN CB C 274 33.698 33.698 30.014 3.684 18321 25596 1 19 . 1 1 274 274 GLN H H 274 8.045 8.045 7.788 0.257 18321 25597 1 19 . 1 1 275 275 TRP N N 275 125.596 125.596 124.065 1.531 18321 25598 1 19 . 1 1 275 275 TRP HA H 275 4.588 4.588 4.854 -0.266 18321 25599 1 19 . 1 1 275 275 TRP C C 275 172.832 172.832 175.914 -3.082 18321 25600 1 19 . 1 1 275 275 TRP CA C 275 55.296 55.296 53.310 1.986 18321 25601 1 19 . 1 1 275 275 TRP CB C 275 31.393 31.393 31.408 -0.015 18321 25602 1 19 . 1 1 275 275 TRP H H 275 8.484 8.484 8.517 -0.033 18321 25603 1 19 . 1 1 276 276 GLU N N 276 119.012 119.012 120.669 -1.657 18321 25604 1 19 . 1 1 276 276 GLU HA H 276 5.190 5.190 4.775 0.415 18321 25605 1 19 . 1 1 276 276 GLU C C 276 176.553 176.553 176.202 0.351 18321 25606 1 19 . 1 1 276 276 GLU CA C 276 54.288 54.288 56.056 -1.768 18321 25607 1 19 . 1 1 276 276 GLU CB C 276 32.851 32.851 30.922 1.929 18321 25608 1 19 . 1 1 276 276 GLU H H 276 8.643 8.643 9.023 -0.380 18321 25609 1 19 . 1 1 277 277 GLY N N 277 111.364 111.364 111.646 -0.282 18321 25610 1 19 . 1 1 277 277 GLY C C 277 170.707 170.707 172.413 -1.706 18321 25611 1 19 . 1 1 277 277 GLY CA C 277 46.723 46.723 44.354 2.369 18321 25612 1 19 . 1 1 277 277 GLY H H 277 9.072 9.072 8.250 0.822 18321 25613 1 19 . 1 1 278 278 GLU N N 278 117.733 117.733 122.657 -4.924 18321 25614 1 19 . 1 1 278 278 GLU HA H 278 5.748 5.748 5.183 0.565 18321 25615 1 19 . 1 1 278 278 GLU C C 278 176.051 176.051 175.538 0.513 18321 25616 1 19 . 1 1 278 278 GLU CA C 278 53.620 53.620 55.455 -1.835 18321 25617 1 19 . 1 1 278 278 GLU CB C 278 33.742 33.742 31.616 2.126 18321 25618 1 19 . 1 1 278 278 GLU H H 278 8.810 8.810 8.232 0.578 18321 25619 1 19 . 1 1 279 279 VAL N N 279 123.834 123.834 123.370 0.464 18321 25620 1 19 . 1 1 279 279 VAL HA H 279 4.404 4.404 4.372 0.032 18321 25621 1 19 . 1 1 279 279 VAL C C 279 175.289 175.289 175.747 -0.458 18321 25622 1 19 . 1 1 279 279 VAL CA C 279 61.166 61.166 60.620 0.546 18321 25623 1 19 . 1 1 279 279 VAL CB C 279 34.123 34.123 35.341 -1.218 18321 25624 1 19 . 1 1 279 279 VAL H H 279 8.887 8.887 8.997 -0.110 18321 25625 1 19 . 1 1 280 280 ASN N N 280 126.025 126.025 124.296 1.729 18321 25626 1 19 . 1 1 280 280 ASN HA H 280 4.435 4.435 4.405 0.030 18321 25627 1 19 . 1 1 280 280 ASN C C 280 175.205 175.205 175.538 -0.333 18321 25628 1 19 . 1 1 280 280 ASN CA C 280 45.615 45.615 53.996 -8.381 18321 25629 1 19 . 1 1 280 280 ASN CB C 280 37.386 37.386 37.966 -0.580 18321 25630 1 19 . 1 1 280 280 ASN H H 280 9.322 9.322 9.299 0.023 18321 25631 1 19 . 1 1 281 281 GLY N N 281 104.588 104.588 103.482 1.106 18321 25632 1 19 . 1 1 281 281 GLY C C 281 173.944 173.944 173.656 0.288 18321 25633 1 19 . 1 1 281 281 GLY CA C 281 45.224 45.224 44.994 0.230 18321 25634 1 19 . 1 1 281 281 GLY H H 281 8.768 8.768 8.323 0.445 18321 25635 1 19 . 1 1 282 282 ARG N N 282 122.567 122.567 122.091 0.476 18321 25636 1 19 . 1 1 282 282 ARG HA H 282 4.559 4.559 4.563 -0.004 18321 25637 1 19 . 1 1 282 282 ARG C C 282 174.350 174.350 174.703 -0.353 18321 25638 1 19 . 1 1 282 282 ARG CA C 282 54.933 54.933 54.774 0.159 18321 25639 1 19 . 1 1 282 282 ARG CB C 282 31.765 31.765 32.089 -0.324 18321 25640 1 19 . 1 1 282 282 ARG H H 282 8.149 8.149 7.953 0.196 18321 25641 1 19 . 1 1 283 283 LYS N N 283 121.565 121.565 126.567 -5.002 18321 25642 1 19 . 1 1 283 283 LYS HA H 283 5.584 5.584 5.379 0.205 18321 25643 1 19 . 1 1 283 283 LYS CA C 283 54.143 54.143 55.425 -1.282 18321 25644 1 19 . 1 1 283 283 LYS CB C 283 36.040 36.040 34.192 1.848 18321 25645 1 19 . 1 1 283 283 LYS H H 283 8.424 8.424 8.776 -0.352 18321 25646 1 19 . 1 1 284 284 GLY C C 284 173.006 173.006 172.416 0.590 18321 25647 1 19 . 1 1 284 284 GLY CA C 284 45.886 45.886 44.589 1.297 18321 25648 1 19 . 1 1 285 285 LEU N N 285 119.673 119.673 121.229 -1.556 18321 25649 1 19 . 1 1 285 285 LEU HA H 285 5.718 5.718 5.696 0.022 18321 25650 1 19 . 1 1 285 285 LEU C C 285 178.657 178.657 176.655 2.002 18321 25651 1 19 . 1 1 285 285 LEU CA C 285 53.656 53.656 53.905 -0.249 18321 25652 1 19 . 1 1 285 285 LEU CB C 285 44.813 44.813 43.583 1.230 18321 25653 1 19 . 1 1 285 285 LEU H H 285 8.734 8.734 8.552 0.182 18321 25654 1 19 . 1 1 286 286 PHE N N 286 118.785 118.785 119.227 -0.442 18321 25655 1 19 . 1 1 286 286 PHE HA H 286 4.521 4.521 5.008 -0.487 18321 25656 1 19 . 1 1 286 286 PHE CA C 286 57.592 57.592 54.735 2.857 18321 25657 1 19 . 1 1 286 286 PHE CB C 286 40.669 40.669 39.909 0.760 18321 25658 1 19 . 1 1 286 286 PHE H H 286 9.120 9.120 8.221 0.899 18321 25659 1 19 . 1 1 287 287 PRO HA H 287 4.385 4.385 4.999 -0.614 18321 25660 1 19 . 1 1 287 287 PRO CA C 287 62.814 62.814 61.499 1.315 18321 25661 1 19 . 1 1 287 287 PRO CB C 287 32.133 32.133 32.388 -0.255 18321 25662 1 19 . 1 1 288 288 PHE C C 288 174.837 174.837 176.603 -1.766 18321 25663 1 19 . 1 1 288 288 PHE CA C 288 59.020 59.020 59.658 -0.638 18321 25664 1 19 . 1 1 288 288 PHE CB C 288 34.987 34.987 37.262 -2.275 18321 25665 1 19 . 1 1 289 289 THR N N 289 107.865 107.865 109.377 -1.512 18321 25666 1 19 . 1 1 289 289 THR HA H 289 3.589 3.589 3.893 -0.304 18321 25667 1 19 . 1 1 289 289 THR C C 289 176.125 176.125 175.103 1.022 18321 25668 1 19 . 1 1 289 289 THR CA C 289 62.243 62.243 63.678 -1.435 18321 25669 1 19 . 1 1 289 289 THR CB C 289 69.365 69.365 68.087 1.278 18321 25670 1 19 . 1 1 289 289 THR H H 289 6.453 6.453 7.590 -1.137 18321 25671 1 19 . 1 1 290 290 HIS N N 290 119.462 119.462 118.421 1.041 18321 25672 1 19 . 1 1 290 290 HIS HA H 290 4.196 4.196 4.796 -0.600 18321 25673 1 19 . 1 1 290 290 HIS C C 290 175.165 175.165 173.637 1.528 18321 25674 1 19 . 1 1 290 290 HIS CA C 290 57.635 57.635 56.078 1.557 18321 25675 1 19 . 1 1 290 290 HIS CB C 290 29.840 29.840 31.567 -1.727 18321 25676 1 19 . 1 1 290 290 HIS H H 290 7.835 7.835 7.773 0.062 18321 25677 1 19 . 1 1 291 291 VAL N N 291 110.050 110.050 113.307 -3.257 18321 25678 1 19 . 1 1 291 291 VAL HA H 291 5.445 5.445 4.858 0.587 18321 25679 1 19 . 1 1 291 291 VAL C C 291 173.386 173.386 174.473 -1.087 18321 25680 1 19 . 1 1 291 291 VAL CA C 291 57.794 57.794 59.187 -1.393 18321 25681 1 19 . 1 1 291 291 VAL CB C 291 35.784 35.784 34.694 1.090 18321 25682 1 19 . 1 1 291 291 VAL H H 291 7.562 7.562 7.462 0.100 18321 25683 1 19 . 1 1 292 292 LYS N N 292 119.445 119.445 122.622 -3.177 18321 25684 1 19 . 1 1 292 292 LYS HA H 292 4.857 4.857 4.825 0.032 18321 25685 1 19 . 1 1 292 292 LYS C C 292 176.512 176.512 175.628 0.884 18321 25686 1 19 . 1 1 292 292 LYS CA C 292 54.647 54.647 54.344 0.303 18321 25687 1 19 . 1 1 292 292 LYS CB C 292 35.665 35.665 33.976 1.689 18321 25688 1 19 . 1 1 292 292 LYS H H 292 8.753 8.753 8.472 0.281 18321 25689 1 19 . 1 1 293 293 ILE N N 293 128.707 128.707 128.424 0.283 18321 25690 1 19 . 1 1 293 293 ILE HA H 293 4.509 4.509 4.641 -0.132 18321 25691 1 19 . 1 1 293 293 ILE C C 293 175.666 175.666 175.849 -0.183 18321 25692 1 19 . 1 1 293 293 ILE CA C 293 62.563 62.563 62.195 0.368 18321 25693 1 19 . 1 1 293 293 ILE CB C 293 38.076 38.076 39.162 -1.086 18321 25694 1 19 . 1 1 293 293 ILE H H 293 9.107 9.107 8.900 0.207 18321 25695 1 19 . 1 1 294 294 PHE N N 294 126.638 126.638 125.875 0.763 18321 25696 1 19 . 1 1 294 294 PHE HA H 294 4.898 4.898 4.842 0.056 18321 25697 1 19 . 1 1 294 294 PHE C C 294 175.838 175.838 172.838 3.000 18321 25698 1 19 . 1 1 294 294 PHE CA C 294 56.335 56.335 56.546 -0.211 18321 25699 1 19 . 1 1 294 294 PHE CB C 294 41.196 41.196 40.681 0.515 18321 25700 1 19 . 1 1 294 294 PHE H H 294 8.716 8.716 8.985 -0.269 18321 25701 1 19 . 1 1 295 295 ASP N N 295 122.961 122.961 120.491 2.470 18321 25702 1 19 . 1 1 295 295 ASP HA H 295 5.003 5.003 4.810 0.193 18321 25703 1 19 . 1 1 295 295 ASP CA C 295 50.602 50.602 50.787 -0.185 18321 25704 1 19 . 1 1 295 295 ASP CB C 295 40.754 40.754 42.010 -1.256 18321 25705 1 19 . 1 1 295 295 ASP H H 295 8.418 8.418 8.618 -0.200 18321 25706 1 19 . 1 1 296 296 PRO HA H 296 4.524 4.524 4.501 0.023 18321 25707 1 19 . 1 1 296 296 PRO C C 296 176.807 176.807 176.775 0.032 18321 25708 1 19 . 1 1 296 296 PRO CA C 296 62.987 62.987 63.438 -0.451 18321 25709 1 19 . 1 1 296 296 PRO CB C 296 32.033 32.033 31.708 0.325 18321 25710 1 19 . 1 1 297 297 GLN N N 297 120.729 120.729 116.470 4.259 18321 25711 1 19 . 1 1 297 297 GLN HA H 297 4.274 4.274 4.268 0.006 18321 25712 1 19 . 1 1 297 297 GLN CA C 297 56.427 56.427 55.843 0.584 18321 25713 1 19 . 1 1 297 297 GLN CB C 297 28.819 28.819 29.227 -0.408 18321 25714 1 19 . 1 1 297 297 GLN H H 297 8.551 8.551 8.067 0.484 18321 25715 1 19 . 1 1 299 299 PRO C C 299 176.936 176.936 175.638 1.298 18321 25716 1 19 . 1 1 299 299 PRO CA C 299 63.406 63.406 63.049 0.357 18321 25717 1 19 . 1 1 299 299 PRO CB C 299 31.421 31.421 31.125 0.296 18321 25718 1 19 . 1 1 300 300 ASP N N 300 119.609 119.609 120.922 -1.313 18321 25719 1 19 . 1 1 300 300 ASP C C 300 176.344 176.344 177.259 -0.915 18321 25720 1 19 . 1 1 300 300 ASP CA C 300 54.178 54.178 55.523 -1.345 18321 25721 1 19 . 1 1 300 300 ASP CB C 300 40.661 40.661 40.145 0.516 18321 25722 1 19 . 1 1 300 300 ASP H H 300 8.239 8.239 7.870 0.369 18321 25723 1 19 . 1 1 301 301 GLU N N 301 120.462 120.462 120.264 0.198 18321 25724 1 19 . 1 1 301 301 GLU CA C 301 56.188 56.188 57.104 -0.916 18321 25725 1 19 . 1 1 301 301 GLU CB C 301 29.507 29.507 30.494 -0.987 18321 25726 1 19 . 1 1 301 301 GLU H H 301 8.084 8.084 8.354 -0.270 18321 25727 1 20 . 1 1 2 2 SER HA H 2 4.521 4.521 4.656 -0.135 18321 25728 1 20 . 1 1 2 2 SER CA C 2 58.326 58.326 58.075 0.251 18321 25729 1 20 . 1 1 2 2 SER CB C 2 64.062 64.062 64.261 -0.199 18321 25730 1 20 . 1 1 3 3 SER HA H 3 4.465 4.465 4.295 0.170 18321 25731 1 20 . 1 1 3 3 SER C C 3 173.887 173.887 173.761 0.126 18321 25732 1 20 . 1 1 3 3 SER CA C 3 58.374 58.374 59.320 -0.946 18321 25733 1 20 . 1 1 3 3 SER CB C 3 63.920 63.920 63.477 0.443 18321 25734 1 20 . 1 1 4 4 ALA N N 4 124.755 124.755 122.963 1.792 18321 25735 1 20 . 1 1 4 4 ALA HA H 4 4.547 4.547 4.527 0.020 18321 25736 1 20 . 1 1 4 4 ALA CA C 4 52.737 52.737 52.264 0.473 18321 25737 1 20 . 1 1 4 4 ALA CB C 4 19.636 19.636 18.609 1.027 18321 25738 1 20 . 1 1 4 4 ALA H H 4 8.244 8.244 7.929 0.315 18321 25739 1 20 . 1 1 5 5 ARG N N 5 120.383 120.383 127.592 -7.209 18321 25740 1 20 . 1 1 5 5 ARG HA H 5 4.524 4.524 4.677 -0.153 18321 25741 1 20 . 1 1 5 5 ARG C C 5 175.611 175.611 174.346 1.265 18321 25742 1 20 . 1 1 5 5 ARG CA C 5 56.082 56.082 55.922 0.160 18321 25743 1 20 . 1 1 5 5 ARG CB C 5 30.695 30.695 31.856 -1.161 18321 25744 1 20 . 1 1 5 5 ARG H H 5 8.727 8.727 8.334 0.393 18321 25745 1 20 . 1 1 6 6 PHE N N 6 115.159 115.159 120.209 -5.050 18321 25746 1 20 . 1 1 6 6 PHE HA H 6 4.786 4.786 4.804 -0.018 18321 25747 1 20 . 1 1 6 6 PHE C C 6 172.076 172.076 173.442 -1.366 18321 25748 1 20 . 1 1 6 6 PHE CA C 6 56.640 56.640 56.814 -0.174 18321 25749 1 20 . 1 1 6 6 PHE CB C 6 40.378 40.378 40.807 -0.429 18321 25750 1 20 . 1 1 6 6 PHE H H 6 7.536 7.536 8.084 -0.548 18321 25751 1 20 . 1 1 7 7 ASP N N 7 121.846 121.846 124.262 -2.416 18321 25752 1 20 . 1 1 7 7 ASP HA H 7 4.846 4.846 4.732 0.114 18321 25753 1 20 . 1 1 7 7 ASP CA C 7 52.327 52.327 55.055 -2.728 18321 25754 1 20 . 1 1 7 7 ASP CB C 7 41.298 41.298 41.358 -0.060 18321 25755 1 20 . 1 1 7 7 ASP H H 7 9.062 9.062 8.807 0.255 18321 25756 1 20 . 1 1 8 8 SER HA H 8 3.950 3.950 4.343 -0.393 18321 25757 1 20 . 1 1 8 8 SER C C 8 174.705 174.705 175.970 -1.265 18321 25758 1 20 . 1 1 8 8 SER CA C 8 61.937 61.937 61.510 0.427 18321 25759 1 20 . 1 1 8 8 SER CB C 8 62.260 62.260 63.149 -0.889 18321 25760 1 20 . 1 1 9 9 SER N N 9 114.373 114.373 114.883 -0.510 18321 25761 1 20 . 1 1 9 9 SER HA H 9 4.529 4.529 4.569 -0.040 18321 25762 1 20 . 1 1 9 9 SER C C 9 175.089 175.089 173.255 1.834 18321 25763 1 20 . 1 1 9 9 SER CA C 9 59.851 59.851 58.484 1.367 18321 25764 1 20 . 1 1 9 9 SER CB C 9 64.246 64.246 63.219 1.026 18321 25765 1 20 . 1 1 9 9 SER H H 9 8.722 8.722 8.181 0.541 18321 25766 1 20 . 1 1 10 10 ASP N N 10 121.818 121.818 120.724 1.094 18321 25767 1 20 . 1 1 10 10 ASP HA H 10 4.730 4.730 4.858 -0.128 18321 25768 1 20 . 1 1 10 10 ASP C C 10 174.455 174.455 176.288 -1.833 18321 25769 1 20 . 1 1 10 10 ASP CA C 10 52.432 52.432 52.283 0.149 18321 25770 1 20 . 1 1 10 10 ASP CB C 10 39.607 39.607 41.460 -1.853 18321 25771 1 20 . 1 1 10 10 ASP H H 10 7.600 7.600 7.885 -0.285 18321 25772 1 20 . 1 1 11 11 ARG N N 11 125.238 125.238 125.890 -0.652 18321 25773 1 20 . 1 1 11 11 ARG HA H 11 1.936 1.936 2.612 -0.676 18321 25774 1 20 . 1 1 11 11 ARG C C 11 176.916 176.916 177.221 -0.305 18321 25775 1 20 . 1 1 11 11 ARG CA C 11 57.451 57.451 58.414 -0.963 18321 25776 1 20 . 1 1 11 11 ARG CB C 11 43.014 43.014 29.962 13.052 18321 25777 1 20 . 1 1 11 11 ARG H H 11 7.739 7.739 8.512 -0.773 18321 25778 1 20 . 1 1 12 12 SER N N 12 112.065 112.065 113.423 -1.358 18321 25779 1 20 . 1 1 12 12 SER HA H 12 4.695 4.695 4.224 0.471 18321 25780 1 20 . 1 1 12 12 SER C C 12 175.092 175.092 173.818 1.274 18321 25781 1 20 . 1 1 12 12 SER CA C 12 60.785 60.785 60.427 0.358 18321 25782 1 20 . 1 1 12 12 SER CB C 12 62.889 62.889 62.679 0.210 18321 25783 1 20 . 1 1 12 12 SER H H 12 7.888 7.888 8.061 -0.173 18321 25784 1 20 . 1 1 13 13 ALA N N 13 122.249 122.249 121.647 0.602 18321 25785 1 20 . 1 1 13 13 ALA HA H 13 4.216 4.216 4.322 -0.106 18321 25786 1 20 . 1 1 13 13 ALA C C 13 178.069 178.069 176.788 1.281 18321 25787 1 20 . 1 1 13 13 ALA CA C 13 53.562 53.562 53.224 0.339 18321 25788 1 20 . 1 1 13 13 ALA CB C 13 19.339 19.339 19.978 -0.639 18321 25789 1 20 . 1 1 13 13 ALA H H 13 7.418 7.418 7.548 -0.130 18321 25790 1 20 . 1 1 14 14 TRP N N 14 107.433 107.433 111.931 -4.498 18321 25791 1 20 . 1 1 14 14 TRP HA H 14 4.785 4.785 4.691 0.094 18321 25792 1 20 . 1 1 14 14 TRP C C 14 175.286 175.286 175.365 -0.079 18321 25793 1 20 . 1 1 14 14 TRP CA C 14 55.212 55.212 55.614 -0.402 18321 25794 1 20 . 1 1 14 14 TRP CB C 14 32.776 32.776 31.022 1.754 18321 25795 1 20 . 1 1 14 14 TRP H H 14 6.273 6.273 6.879 -0.606 18321 25796 1 20 . 1 1 15 15 TYR N N 15 122.315 122.315 124.945 -2.630 18321 25797 1 20 . 1 1 15 15 TYR HA H 15 5.436 5.436 5.045 0.391 18321 25798 1 20 . 1 1 15 15 TYR C C 15 175.325 175.325 175.216 0.109 18321 25799 1 20 . 1 1 15 15 TYR CA C 15 56.609 56.609 58.339 -1.730 18321 25800 1 20 . 1 1 15 15 TYR CB C 15 36.940 36.940 38.194 -1.254 18321 25801 1 20 . 1 1 15 15 TYR H H 15 8.221 8.221 7.953 0.268 18321 25802 1 20 . 1 1 16 16 MET N N 16 126.031 126.031 124.988 1.043 18321 25803 1 20 . 1 1 16 16 MET HA H 16 4.462 4.462 4.381 0.081 18321 25804 1 20 . 1 1 16 16 MET CA C 16 53.046 53.046 53.750 -0.704 18321 25805 1 20 . 1 1 16 16 MET CB C 16 41.114 41.114 32.289 8.825 18321 25806 1 20 . 1 1 16 16 MET H H 16 8.989 8.989 8.632 0.357 18321 25807 1 20 . 1 1 17 17 GLY CA C 17 45.803 45.803 45.416 0.387 18321 25808 1 20 . 1 1 18 18 PRO HA H 18 4.675 4.675 4.526 0.149 18321 25809 1 20 . 1 1 18 18 PRO C C 18 175.943 175.943 175.341 0.602 18321 25810 1 20 . 1 1 18 18 PRO CA C 18 63.647 63.647 63.562 0.085 18321 25811 1 20 . 1 1 18 18 PRO CB C 18 29.276 29.276 30.929 -1.653 18321 25812 1 20 . 1 1 19 19 VAL N N 19 126.159 126.159 124.166 1.993 18321 25813 1 20 . 1 1 19 19 VAL HA H 19 4.011 4.011 4.141 -0.130 18321 25814 1 20 . 1 1 19 19 VAL C C 19 175.812 175.812 175.062 0.750 18321 25815 1 20 . 1 1 19 19 VAL CA C 19 62.355 62.355 61.482 0.873 18321 25816 1 20 . 1 1 19 19 VAL CB C 19 33.468 33.468 33.733 -0.265 18321 25817 1 20 . 1 1 19 19 VAL H H 19 7.851 7.851 7.918 -0.067 18321 25818 1 20 . 1 1 20 20 SER N N 20 123.950 123.950 110.562 13.388 18321 25819 1 20 . 1 1 20 20 SER HA H 20 4.453 4.453 4.206 0.247 18321 25820 1 20 . 1 1 20 20 SER CA C 20 57.631 57.631 57.886 -0.255 18321 25821 1 20 . 1 1 20 20 SER CB C 20 65.951 65.951 63.533 2.418 18321 25822 1 20 . 1 1 20 20 SER H H 20 8.800 8.800 8.071 0.729 18321 25823 1 20 . 1 1 21 21 ARG N N 21 123.461 123.461 123.184 0.277 18321 25824 1 20 . 1 1 21 21 ARG HA H 21 3.489 3.489 4.005 -0.516 18321 25825 1 20 . 1 1 21 21 ARG C C 21 178.164 178.164 178.203 -0.039 18321 25826 1 20 . 1 1 21 21 ARG CA C 21 60.025 60.025 60.170 -0.145 18321 25827 1 20 . 1 1 21 21 ARG CB C 21 30.334 30.334 30.169 0.165 18321 25828 1 20 . 1 1 21 21 ARG H H 21 9.307 9.307 8.388 0.919 18321 25829 1 20 . 1 1 22 22 GLN N N 22 116.591 116.591 118.107 -1.516 18321 25830 1 20 . 1 1 22 22 GLN HA H 22 4.008 4.008 4.041 -0.033 18321 25831 1 20 . 1 1 22 22 GLN CA C 22 59.095 59.095 58.963 0.132 18321 25832 1 20 . 1 1 22 22 GLN CB C 22 29.249 29.249 28.187 1.062 18321 25833 1 20 . 1 1 22 22 GLN H H 22 8.394 8.394 8.424 -0.030 18321 25834 1 20 . 1 1 23 23 GLU N N 23 122.191 122.191 119.362 2.829 18321 25835 1 20 . 1 1 23 23 GLU HA H 23 4.037 4.037 4.155 -0.118 18321 25836 1 20 . 1 1 23 23 GLU C C 23 178.986 178.986 178.468 0.518 18321 25837 1 20 . 1 1 23 23 GLU CA C 23 59.081 59.081 58.659 0.422 18321 25838 1 20 . 1 1 23 23 GLU CB C 23 31.896 31.896 29.202 2.694 18321 25839 1 20 . 1 1 23 23 GLU H H 23 8.106 8.106 7.513 0.593 18321 25840 1 20 . 1 1 24 24 ALA N N 24 121.964 121.964 122.228 -0.264 18321 25841 1 20 . 1 1 24 24 ALA HA H 24 3.762 3.762 3.938 -0.176 18321 25842 1 20 . 1 1 24 24 ALA C C 24 178.653 178.653 179.631 -0.978 18321 25843 1 20 . 1 1 24 24 ALA CA C 24 55.480 55.480 55.432 0.048 18321 25844 1 20 . 1 1 24 24 ALA CB C 24 18.049 18.049 18.675 -0.626 18321 25845 1 20 . 1 1 24 24 ALA H H 24 8.732 8.732 8.422 0.310 18321 25846 1 20 . 1 1 25 25 GLN N N 25 116.229 116.229 115.221 1.008 18321 25847 1 20 . 1 1 25 25 GLN HA H 25 3.950 3.950 4.091 -0.141 18321 25848 1 20 . 1 1 25 25 GLN C C 25 177.442 177.442 177.289 0.153 18321 25849 1 20 . 1 1 25 25 GLN CA C 25 59.651 59.651 58.223 1.428 18321 25850 1 20 . 1 1 25 25 GLN CB C 25 29.308 29.308 28.520 0.788 18321 25851 1 20 . 1 1 25 25 GLN H H 25 8.391 8.391 8.149 0.242 18321 25852 1 20 . 1 1 26 26 THR N N 26 115.105 115.105 114.099 1.006 18321 25853 1 20 . 1 1 26 26 THR HA H 26 3.920 3.920 4.183 -0.263 18321 25854 1 20 . 1 1 26 26 THR C C 26 176.835 176.835 176.651 0.184 18321 25855 1 20 . 1 1 26 26 THR CA C 26 66.335 66.335 64.212 2.123 18321 25856 1 20 . 1 1 26 26 THR CB C 26 68.876 68.876 68.987 -0.111 18321 25857 1 20 . 1 1 26 26 THR H H 26 8.223 8.223 7.531 0.692 18321 25858 1 20 . 1 1 27 27 ARG N N 27 119.096 119.096 119.050 0.046 18321 25859 1 20 . 1 1 27 27 ARG HA H 27 4.047 4.047 4.326 -0.279 18321 25860 1 20 . 1 1 27 27 ARG C C 27 177.245 177.245 176.483 0.762 18321 25861 1 20 . 1 1 27 27 ARG CA C 27 58.528 58.528 57.824 0.704 18321 25862 1 20 . 1 1 27 27 ARG CB C 27 30.184 30.184 30.166 0.018 18321 25863 1 20 . 1 1 27 27 ARG H H 27 8.093 8.093 7.779 0.314 18321 25864 1 20 . 1 1 28 28 LEU N N 28 114.602 114.602 117.847 -3.245 18321 25865 1 20 . 1 1 28 28 LEU HA H 28 4.325 4.325 4.532 -0.207 18321 25866 1 20 . 1 1 28 28 LEU C C 28 177.197 177.197 175.860 1.337 18321 25867 1 20 . 1 1 28 28 LEU CA C 28 55.143 55.143 53.195 1.948 18321 25868 1 20 . 1 1 28 28 LEU CB C 28 44.902 44.902 42.799 2.103 18321 25869 1 20 . 1 1 28 28 LEU H H 28 7.438 7.438 7.281 0.157 18321 25870 1 20 . 1 1 29 29 GLN N N 29 121.312 121.312 120.706 0.606 18321 25871 1 20 . 1 1 29 29 GLN HA H 29 3.856 3.856 4.144 -0.288 18321 25872 1 20 . 1 1 29 29 GLN C C 29 178.048 178.048 177.054 0.994 18321 25873 1 20 . 1 1 29 29 GLN CA C 29 57.691 57.691 55.600 2.091 18321 25874 1 20 . 1 1 29 29 GLN CB C 29 27.293 27.293 26.905 0.388 18321 25875 1 20 . 1 1 29 29 GLN H H 29 8.250 8.250 7.428 0.822 18321 25876 1 20 . 1 1 30 30 GLY N N 30 116.768 116.768 114.792 1.976 18321 25877 1 20 . 1 1 30 30 GLY C C 30 174.914 174.914 174.096 0.818 18321 25878 1 20 . 1 1 30 30 GLY CA C 30 45.491 45.491 45.453 0.038 18321 25879 1 20 . 1 1 30 30 GLY H H 30 9.135 9.135 8.618 0.517 18321 25880 1 20 . 1 1 31 31 GLN N N 31 117.979 117.979 120.016 -2.037 18321 25881 1 20 . 1 1 31 31 GLN HA H 31 4.329 4.329 3.806 0.523 18321 25882 1 20 . 1 1 31 31 GLN C C 31 177.174 177.174 175.579 1.595 18321 25883 1 20 . 1 1 31 31 GLN CA C 31 53.910 53.910 57.711 -3.801 18321 25884 1 20 . 1 1 31 31 GLN CB C 31 29.574 29.574 27.296 2.278 18321 25885 1 20 . 1 1 31 31 GLN H H 31 7.695 7.695 8.324 -0.629 18321 25886 1 20 . 1 1 32 32 ARG N N 32 123.918 123.918 119.768 4.150 18321 25887 1 20 . 1 1 32 32 ARG HA H 32 3.940 3.940 4.277 -0.337 18321 25888 1 20 . 1 1 32 32 ARG C C 32 175.810 175.810 175.441 0.369 18321 25889 1 20 . 1 1 32 32 ARG CA C 32 56.770 56.770 55.378 1.392 18321 25890 1 20 . 1 1 32 32 ARG CB C 32 30.074 30.074 31.585 -1.511 18321 25891 1 20 . 1 1 32 32 ARG H H 32 8.955 8.955 8.373 0.582 18321 25892 1 20 . 1 1 33 33 HIS N N 33 122.248 122.248 116.966 5.282 18321 25893 1 20 . 1 1 33 33 HIS HA H 33 4.627 4.627 4.357 0.270 18321 25894 1 20 . 1 1 33 33 HIS C C 33 177.089 177.089 175.392 1.697 18321 25895 1 20 . 1 1 33 33 HIS CA C 33 55.858 55.858 56.736 -0.878 18321 25896 1 20 . 1 1 33 33 HIS CB C 33 28.648 28.648 29.045 -0.397 18321 25897 1 20 . 1 1 33 33 HIS H H 33 8.302 8.302 7.545 0.757 18321 25898 1 20 . 1 1 34 34 GLY N N 34 109.518 109.518 104.807 4.711 18321 25899 1 20 . 1 1 34 34 GLY C C 34 176.730 176.730 173.720 3.010 18321 25900 1 20 . 1 1 34 34 GLY CA C 34 45.967 45.967 45.443 0.524 18321 25901 1 20 . 1 1 34 34 GLY H H 34 9.496 9.496 9.182 0.314 18321 25902 1 20 . 1 1 35 35 MET N N 35 125.193 125.193 119.892 5.301 18321 25903 1 20 . 1 1 35 35 MET HA H 35 5.750 5.750 5.935 -0.185 18321 25904 1 20 . 1 1 35 35 MET C C 35 174.388 174.388 174.852 -0.464 18321 25905 1 20 . 1 1 35 35 MET CA C 35 55.762 55.762 54.625 1.137 18321 25906 1 20 . 1 1 35 35 MET CB C 35 32.706 32.706 35.666 -2.960 18321 25907 1 20 . 1 1 35 35 MET H H 35 8.359 8.359 7.411 0.948 18321 25908 1 20 . 1 1 36 36 PHE N N 36 123.311 123.311 116.927 6.384 18321 25909 1 20 . 1 1 36 36 PHE HA H 36 5.985 5.985 5.765 0.220 18321 25910 1 20 . 1 1 36 36 PHE C C 36 172.140 172.140 172.789 -0.649 18321 25911 1 20 . 1 1 36 36 PHE CA C 36 55.755 55.755 55.401 0.354 18321 25912 1 20 . 1 1 36 36 PHE CB C 36 45.197 45.197 42.766 2.431 18321 25913 1 20 . 1 1 36 36 PHE H H 36 8.261 8.261 7.749 0.512 18321 25914 1 20 . 1 1 37 37 LEU N N 37 114.652 114.652 115.343 -0.691 18321 25915 1 20 . 1 1 37 37 LEU HA H 37 4.489 4.489 4.860 -0.371 18321 25916 1 20 . 1 1 37 37 LEU C C 37 174.033 174.033 174.565 -0.532 18321 25917 1 20 . 1 1 37 37 LEU CA C 37 55.382 55.382 54.747 0.635 18321 25918 1 20 . 1 1 37 37 LEU CB C 37 44.791 44.791 45.678 -0.887 18321 25919 1 20 . 1 1 37 37 LEU H H 37 9.292 9.292 9.197 0.095 18321 25920 1 20 . 1 1 38 38 VAL N N 38 121.009 121.009 122.331 -1.322 18321 25921 1 20 . 1 1 38 38 VAL HA H 38 5.504 5.504 5.009 0.495 18321 25922 1 20 . 1 1 38 38 VAL C C 38 173.581 173.581 175.166 -1.585 18321 25923 1 20 . 1 1 38 38 VAL CA C 38 61.316 61.316 61.684 -0.368 18321 25924 1 20 . 1 1 38 38 VAL CB C 38 33.302 33.302 33.304 -0.002 18321 25925 1 20 . 1 1 38 38 VAL H H 38 8.991 8.991 8.578 0.413 18321 25926 1 20 . 1 1 39 39 ARG N N 39 124.863 124.863 128.087 -3.224 18321 25927 1 20 . 1 1 39 39 ARG HA H 39 5.444 5.444 4.849 0.595 18321 25928 1 20 . 1 1 39 39 ARG C C 39 175.772 175.772 174.527 1.245 18321 25929 1 20 . 1 1 39 39 ARG CA C 39 52.558 52.558 53.129 -0.571 18321 25930 1 20 . 1 1 39 39 ARG CB C 39 34.980 34.980 33.152 1.828 18321 25931 1 20 . 1 1 39 39 ARG H H 39 9.569 9.569 8.245 1.324 18321 25932 1 20 . 1 1 40 40 ASP N N 40 122.330 122.330 121.702 0.628 18321 25933 1 20 . 1 1 40 40 ASP HA H 40 4.785 4.785 4.786 -0.001 18321 25934 1 20 . 1 1 40 40 ASP C C 40 176.332 176.332 176.056 0.276 18321 25935 1 20 . 1 1 40 40 ASP CA C 40 55.334 55.334 55.872 -0.538 18321 25936 1 20 . 1 1 40 40 ASP CB C 40 40.650 40.650 41.159 -0.509 18321 25937 1 20 . 1 1 40 40 ASP H H 40 8.413 8.413 8.187 0.226 18321 25938 1 20 . 1 1 41 41 SER N N 41 114.363 114.363 117.435 -3.072 18321 25939 1 20 . 1 1 41 41 SER HA H 41 4.506 4.506 4.420 0.086 18321 25940 1 20 . 1 1 41 41 SER CA C 41 57.525 57.525 58.886 -1.361 18321 25941 1 20 . 1 1 41 41 SER CB C 41 63.706 63.706 63.714 -0.008 18321 25942 1 20 . 1 1 41 41 SER H H 41 7.791 7.791 8.369 -0.578 18321 25943 1 20 . 1 1 42 42 SER N N 42 126.932 126.932 122.614 4.318 18321 25944 1 20 . 1 1 42 42 SER HA H 42 4.410 4.410 4.569 -0.159 18321 25945 1 20 . 1 1 42 42 SER CA C 42 60.362 60.362 59.870 0.492 18321 25946 1 20 . 1 1 42 42 SER CB C 42 63.707 63.707 63.089 0.619 18321 25947 1 20 . 1 1 42 42 SER H H 42 10.519 10.519 8.858 1.661 18321 25948 1 20 . 1 1 43 43 THR HA H 43 4.097 4.097 4.459 -0.362 18321 25949 1 20 . 1 1 43 43 THR CA C 43 64.722 64.722 63.581 1.141 18321 25950 1 20 . 1 1 43 43 THR CB C 43 69.439 69.439 69.777 -0.338 18321 25951 1 20 . 1 1 44 44 CYS HA H 44 5.100 5.100 4.883 0.217 18321 25952 1 20 . 1 1 44 44 CYS CA C 44 51.779 51.779 55.859 -4.080 18321 25953 1 20 . 1 1 44 44 CYS CB C 44 41.314 41.314 30.189 11.125 18321 25954 1 20 . 1 1 45 45 PRO HA H 45 4.278 4.278 4.441 -0.163 18321 25955 1 20 . 1 1 45 45 PRO C C 45 178.127 178.127 177.366 0.761 18321 25956 1 20 . 1 1 45 45 PRO CA C 45 64.151 64.151 64.333 -0.182 18321 25957 1 20 . 1 1 45 45 PRO CB C 45 31.596 31.596 32.299 -0.703 18321 25958 1 20 . 1 1 46 46 GLY N N 46 114.947 114.947 105.146 9.801 18321 25959 1 20 . 1 1 46 46 GLY C C 46 174.701 174.701 172.733 1.968 18321 25960 1 20 . 1 1 46 46 GLY CA C 46 45.225 45.225 44.404 0.821 18321 25961 1 20 . 1 1 46 46 GLY H H 46 8.812 8.812 8.099 0.713 18321 25962 1 20 . 1 1 47 47 ASP N N 47 120.862 120.862 118.491 2.371 18321 25963 1 20 . 1 1 47 47 ASP HA H 47 5.235 5.235 4.983 0.252 18321 25964 1 20 . 1 1 47 47 ASP C C 47 176.480 176.480 174.458 2.022 18321 25965 1 20 . 1 1 47 47 ASP CA C 47 53.591 53.591 53.526 0.065 18321 25966 1 20 . 1 1 47 47 ASP CB C 47 41.707 41.707 45.361 -3.654 18321 25967 1 20 . 1 1 47 47 ASP H H 47 7.997 7.997 7.489 0.508 18321 25968 1 20 . 1 1 48 48 TYR N N 48 118.473 118.473 117.375 1.098 18321 25969 1 20 . 1 1 48 48 TYR HA H 48 5.431 5.431 5.049 0.382 18321 25970 1 20 . 1 1 48 48 TYR C C 48 173.783 173.783 175.292 -1.509 18321 25971 1 20 . 1 1 48 48 TYR CA C 48 56.891 56.891 56.152 0.739 18321 25972 1 20 . 1 1 48 48 TYR CB C 48 43.274 43.274 42.121 1.153 18321 25973 1 20 . 1 1 48 48 TYR H H 48 8.892 8.892 9.199 -0.307 18321 25974 1 20 . 1 1 49 49 VAL N N 49 119.105 119.105 119.193 -0.088 18321 25975 1 20 . 1 1 49 49 VAL HA H 49 4.800 4.800 4.596 0.204 18321 25976 1 20 . 1 1 49 49 VAL C C 49 174.397 174.397 174.468 -0.071 18321 25977 1 20 . 1 1 49 49 VAL CA C 49 61.439 61.439 62.306 -0.867 18321 25978 1 20 . 1 1 49 49 VAL CB C 49 35.388 35.388 34.858 0.530 18321 25979 1 20 . 1 1 49 49 VAL H H 49 9.661 9.661 8.773 0.888 18321 25980 1 20 . 1 1 50 50 LEU N N 50 129.599 129.599 130.631 -1.032 18321 25981 1 20 . 1 1 50 50 LEU HA H 50 5.033 5.033 5.177 -0.144 18321 25982 1 20 . 1 1 50 50 LEU C C 50 175.001 175.001 175.404 -0.403 18321 25983 1 20 . 1 1 50 50 LEU CA C 50 53.352 53.352 53.841 -0.489 18321 25984 1 20 . 1 1 50 50 LEU CB C 50 44.062 44.062 42.623 1.439 18321 25985 1 20 . 1 1 50 50 LEU H H 50 9.405 9.405 9.304 0.101 18321 25986 1 20 . 1 1 51 51 SER N N 51 126.895 126.895 124.627 2.268 18321 25987 1 20 . 1 1 51 51 SER HA H 51 5.731 5.731 5.096 0.635 18321 25988 1 20 . 1 1 51 51 SER C C 51 173.094 173.094 173.282 -0.188 18321 25989 1 20 . 1 1 51 51 SER CA C 51 58.834 58.834 57.128 1.706 18321 25990 1 20 . 1 1 51 51 SER CB C 51 64.977 64.977 63.937 1.040 18321 25991 1 20 . 1 1 51 51 SER H H 51 9.094 9.094 9.266 -0.172 18321 25992 1 20 . 1 1 52 52 VAL N N 52 121.777 121.777 125.381 -3.604 18321 25993 1 20 . 1 1 52 52 VAL HA H 52 5.066 5.066 4.606 0.460 18321 25994 1 20 . 1 1 52 52 VAL C C 52 174.573 174.573 174.871 -0.298 18321 25995 1 20 . 1 1 52 52 VAL CA C 52 59.535 59.535 60.581 -1.046 18321 25996 1 20 . 1 1 52 52 VAL CB C 52 36.834 36.834 34.984 1.850 18321 25997 1 20 . 1 1 52 52 VAL H H 52 8.816 8.816 8.647 0.169 18321 25998 1 20 . 1 1 53 53 SER N N 53 120.489 120.489 122.759 -2.270 18321 25999 1 20 . 1 1 53 53 SER HA H 53 4.811 4.811 4.564 0.247 18321 26000 1 20 . 1 1 53 53 SER C C 53 174.065 174.065 173.208 0.857 18321 26001 1 20 . 1 1 53 53 SER CA C 53 57.496 57.496 57.861 -0.365 18321 26002 1 20 . 1 1 53 53 SER CB C 53 62.623 62.623 62.758 -0.135 18321 26003 1 20 . 1 1 53 53 SER H H 53 8.780 8.780 9.165 -0.385 18321 26004 1 20 . 1 1 54 54 GLU N N 54 132.020 132.020 127.906 4.114 18321 26005 1 20 . 1 1 54 54 GLU HA H 54 4.250 4.250 4.740 -0.490 18321 26006 1 20 . 1 1 54 54 GLU C C 54 175.387 175.387 175.708 -0.321 18321 26007 1 20 . 1 1 54 54 GLU CA C 54 56.999 56.999 55.298 1.701 18321 26008 1 20 . 1 1 54 54 GLU CB C 54 32.556 32.556 34.022 -1.466 18321 26009 1 20 . 1 1 54 54 GLU H H 54 8.472 8.472 7.702 0.770 18321 26010 1 20 . 1 1 55 55 ASN N N 55 126.517 126.517 118.153 8.364 18321 26011 1 20 . 1 1 55 55 ASN HA H 55 4.220 4.220 4.099 0.121 18321 26012 1 20 . 1 1 55 55 ASN C C 55 174.546 174.546 174.547 -0.001 18321 26013 1 20 . 1 1 55 55 ASN CA C 55 54.770 54.770 54.510 0.260 18321 26014 1 20 . 1 1 55 55 ASN CB C 55 37.314 37.314 37.710 -0.396 18321 26015 1 20 . 1 1 55 55 ASN H H 55 8.853 8.853 8.892 -0.039 18321 26016 1 20 . 1 1 56 56 SER N N 56 112.009 112.009 110.595 1.414 18321 26017 1 20 . 1 1 56 56 SER HA H 56 4.334 4.334 4.236 0.098 18321 26018 1 20 . 1 1 56 56 SER C C 56 173.354 173.354 172.885 0.469 18321 26019 1 20 . 1 1 56 56 SER CA C 56 59.966 59.966 59.806 0.160 18321 26020 1 20 . 1 1 56 56 SER CB C 56 62.242 62.242 62.442 -0.200 18321 26021 1 20 . 1 1 56 56 SER H H 56 10.418 10.418 8.288 2.130 18321 26022 1 20 . 1 1 57 57 ARG N N 57 121.764 121.764 119.558 2.206 18321 26023 1 20 . 1 1 57 57 ARG HA H 57 5.167 5.167 4.400 0.767 18321 26024 1 20 . 1 1 57 57 ARG C C 57 174.983 174.983 174.082 0.901 18321 26025 1 20 . 1 1 57 57 ARG CA C 57 54.550 54.550 55.355 -0.805 18321 26026 1 20 . 1 1 57 57 ARG CB C 57 31.886 31.886 31.458 0.428 18321 26027 1 20 . 1 1 57 57 ARG H H 57 8.097 8.097 8.369 -0.272 18321 26028 1 20 . 1 1 58 58 VAL N N 58 121.866 121.866 123.271 -1.405 18321 26029 1 20 . 1 1 58 58 VAL HA H 58 4.768 4.768 4.395 0.373 18321 26030 1 20 . 1 1 58 58 VAL C C 58 175.388 175.388 175.868 -0.480 18321 26031 1 20 . 1 1 58 58 VAL CA C 58 61.818 61.818 62.581 -0.763 18321 26032 1 20 . 1 1 58 58 VAL CB C 58 34.135 34.135 30.779 3.356 18321 26033 1 20 . 1 1 58 58 VAL H H 58 8.081 8.081 8.076 0.005 18321 26034 1 20 . 1 1 59 59 SER N N 59 124.445 124.445 123.755 0.690 18321 26035 1 20 . 1 1 59 59 SER HA H 59 4.462 4.462 4.256 0.206 18321 26036 1 20 . 1 1 59 59 SER C C 59 172.185 172.185 173.359 -1.174 18321 26037 1 20 . 1 1 59 59 SER CA C 59 56.629 56.629 58.436 -1.807 18321 26038 1 20 . 1 1 59 59 SER CB C 59 66.218 66.218 63.306 2.912 18321 26039 1 20 . 1 1 59 59 SER H H 59 9.082 9.082 8.009 1.073 18321 26040 1 20 . 1 1 60 60 HIS N N 60 121.224 121.224 126.029 -4.805 18321 26041 1 20 . 1 1 60 60 HIS HA H 60 4.885 4.885 4.688 0.197 18321 26042 1 20 . 1 1 60 60 HIS C C 60 174.674 174.674 174.637 0.037 18321 26043 1 20 . 1 1 60 60 HIS CA C 60 54.900 54.900 55.341 -0.441 18321 26044 1 20 . 1 1 60 60 HIS CB C 60 32.331 32.331 29.227 3.104 18321 26045 1 20 . 1 1 60 60 HIS H H 60 8.331 8.331 8.812 -0.481 18321 26046 1 20 . 1 1 61 61 TYR N N 61 124.780 124.780 124.773 0.007 18321 26047 1 20 . 1 1 61 61 TYR HA H 61 4.655 4.655 4.624 0.031 18321 26048 1 20 . 1 1 61 61 TYR CA C 61 57.409 57.409 56.734 0.675 18321 26049 1 20 . 1 1 61 61 TYR CB C 61 39.785 39.785 37.642 2.143 18321 26050 1 20 . 1 1 61 61 TYR H H 61 9.273 9.273 9.194 0.079 18321 26051 1 20 . 1 1 62 62 ILE HA H 62 4.298 4.298 4.309 -0.011 18321 26052 1 20 . 1 1 62 62 ILE C C 62 174.817 174.817 175.361 -0.544 18321 26053 1 20 . 1 1 62 62 ILE CA C 62 61.908 61.908 61.750 0.158 18321 26054 1 20 . 1 1 62 62 ILE CB C 62 38.321 38.321 38.702 -0.381 18321 26055 1 20 . 1 1 63 63 ILE N N 63 128.552 128.552 128.991 -0.439 18321 26056 1 20 . 1 1 63 63 ILE HA H 63 4.788 4.788 4.723 0.065 18321 26057 1 20 . 1 1 63 63 ILE C C 63 175.982 175.982 175.129 0.853 18321 26058 1 20 . 1 1 63 63 ILE CA C 63 59.629 59.629 60.118 -0.489 18321 26059 1 20 . 1 1 63 63 ILE CB C 63 39.747 39.747 38.113 1.634 18321 26060 1 20 . 1 1 63 63 ILE H H 63 9.155 9.155 8.756 0.399 18321 26061 1 20 . 1 1 64 64 ASN N N 64 123.240 123.240 126.987 -3.747 18321 26062 1 20 . 1 1 64 64 ASN HA H 64 4.857 4.857 5.851 -0.994 18321 26063 1 20 . 1 1 64 64 ASN C C 64 175.324 175.324 175.145 0.179 18321 26064 1 20 . 1 1 64 64 ASN CA C 64 53.736 53.736 52.844 0.892 18321 26065 1 20 . 1 1 64 64 ASN CB C 64 41.531 41.531 40.356 1.175 18321 26066 1 20 . 1 1 64 64 ASN H H 64 9.379 9.379 8.944 0.435 18321 26067 1 20 . 1 1 65 65 SER N N 65 121.157 121.157 116.678 4.479 18321 26068 1 20 . 1 1 65 65 SER HA H 65 4.548 4.548 4.770 -0.222 18321 26069 1 20 . 1 1 65 65 SER C C 65 174.328 174.328 174.405 -0.077 18321 26070 1 20 . 1 1 65 65 SER CA C 65 58.306 58.306 57.456 0.850 18321 26071 1 20 . 1 1 65 65 SER CB C 65 62.878 62.878 63.221 -0.343 18321 26072 1 20 . 1 1 65 65 SER H H 65 9.195 9.195 8.438 0.757 18321 26073 1 20 . 1 1 66 66 LEU N N 66 127.417 127.417 128.656 -1.239 18321 26074 1 20 . 1 1 66 66 LEU HA H 66 4.605 4.605 4.644 -0.039 18321 26075 1 20 . 1 1 66 66 LEU CA C 66 52.888 52.888 52.834 0.054 18321 26076 1 20 . 1 1 66 66 LEU CB C 66 41.799 41.799 41.588 0.211 18321 26077 1 20 . 1 1 66 66 LEU H H 66 8.143 8.143 8.791 -0.648 18321 26078 1 20 . 1 1 68 68 ASN HA H 68 4.386 4.386 4.580 -0.194 18321 26079 1 20 . 1 1 68 68 ASN C C 68 174.487 174.487 175.377 -0.890 18321 26080 1 20 . 1 1 68 68 ASN CA C 68 53.365 53.365 53.485 -0.120 18321 26081 1 20 . 1 1 68 68 ASN CB C 68 36.778 36.778 37.687 -0.909 18321 26082 1 20 . 1 1 69 69 ARG N N 69 111.329 111.329 114.240 -2.911 18321 26083 1 20 . 1 1 69 69 ARG HA H 69 3.876 3.876 3.900 -0.024 18321 26084 1 20 . 1 1 69 69 ARG CA C 69 57.393 57.393 57.251 0.143 18321 26085 1 20 . 1 1 69 69 ARG CB C 69 26.665 26.665 26.880 -0.215 18321 26086 1 20 . 1 1 69 69 ARG H H 69 8.191 8.191 7.755 0.436 18321 26087 1 20 . 1 1 70 70 ARG N N 70 116.120 116.120 115.905 0.215 18321 26088 1 20 . 1 1 70 70 ARG HA H 70 4.556 4.556 4.495 0.061 18321 26089 1 20 . 1 1 70 70 ARG C C 70 174.882 174.882 174.224 0.658 18321 26090 1 20 . 1 1 70 70 ARG CA C 70 55.509 55.509 53.707 1.802 18321 26091 1 20 . 1 1 70 70 ARG CB C 70 31.771 31.771 33.927 -2.156 18321 26092 1 20 . 1 1 70 70 ARG H H 70 6.667 6.667 7.175 -0.508 18321 26093 1 20 . 1 1 71 71 PHE N N 71 116.313 116.313 116.704 -0.391 18321 26094 1 20 . 1 1 71 71 PHE HA H 71 5.540 5.540 5.625 -0.085 18321 26095 1 20 . 1 1 71 71 PHE C C 71 174.391 174.391 174.986 -0.595 18321 26096 1 20 . 1 1 71 71 PHE CA C 71 57.528 57.528 56.245 1.282 18321 26097 1 20 . 1 1 71 71 PHE CB C 71 44.115 44.115 43.191 0.924 18321 26098 1 20 . 1 1 71 71 PHE H H 71 8.700 8.700 8.144 0.556 18321 26099 1 20 . 1 1 72 72 LYS N N 72 122.770 122.770 122.778 -0.008 18321 26100 1 20 . 1 1 72 72 LYS HA H 72 5.483 5.483 4.915 0.568 18321 26101 1 20 . 1 1 72 72 LYS C C 72 173.923 173.923 174.697 -0.774 18321 26102 1 20 . 1 1 72 72 LYS CA C 72 54.855 54.855 55.628 -0.773 18321 26103 1 20 . 1 1 72 72 LYS CB C 72 37.710 37.710 36.374 1.336 18321 26104 1 20 . 1 1 72 72 LYS H H 72 9.138 9.138 8.742 0.396 18321 26105 1 20 . 1 1 73 73 ILE N N 73 124.576 124.576 129.791 -5.215 18321 26106 1 20 . 1 1 73 73 ILE HA H 73 4.955 4.955 4.852 0.103 18321 26107 1 20 . 1 1 73 73 ILE C C 73 175.728 175.728 176.618 -0.890 18321 26108 1 20 . 1 1 73 73 ILE CA C 73 58.935 58.935 60.663 -1.728 18321 26109 1 20 . 1 1 73 73 ILE CB C 73 40.965 40.965 38.391 2.574 18321 26110 1 20 . 1 1 73 73 ILE H H 73 8.826 8.826 8.597 0.229 18321 26111 1 20 . 1 1 74 74 GLY N N 74 118.718 118.718 119.425 -0.707 18321 26112 1 20 . 1 1 74 74 GLY C C 74 174.436 174.436 173.956 0.480 18321 26113 1 20 . 1 1 74 74 GLY CA C 74 47.401 47.401 46.939 0.462 18321 26114 1 20 . 1 1 74 74 GLY H H 74 9.317 9.317 9.474 -0.157 18321 26115 1 20 . 1 1 75 75 ASP N N 75 125.691 125.691 121.956 3.735 18321 26116 1 20 . 1 1 75 75 ASP HA H 75 4.713 4.713 4.669 0.044 18321 26117 1 20 . 1 1 75 75 ASP C C 75 175.841 175.841 174.989 0.852 18321 26118 1 20 . 1 1 75 75 ASP CA C 75 53.815 53.815 54.363 -0.548 18321 26119 1 20 . 1 1 75 75 ASP CB C 75 41.288 41.288 43.325 -2.037 18321 26120 1 20 . 1 1 75 75 ASP H H 75 8.665 8.665 8.542 0.123 18321 26121 1 20 . 1 1 76 76 GLN N N 76 120.368 120.368 121.169 -0.801 18321 26122 1 20 . 1 1 76 76 GLN C C 76 173.630 173.630 174.431 -0.801 18321 26123 1 20 . 1 1 76 76 GLN CA C 76 54.254 54.254 55.275 -1.021 18321 26124 1 20 . 1 1 76 76 GLN CB C 76 31.248 31.248 29.754 1.494 18321 26125 1 20 . 1 1 76 76 GLN H H 76 8.289 8.289 7.620 0.669 18321 26126 1 20 . 1 1 77 77 GLU N N 77 120.435 120.435 123.428 -2.993 18321 26127 1 20 . 1 1 77 77 GLU C C 77 175.484 175.484 175.052 0.432 18321 26128 1 20 . 1 1 77 77 GLU CA C 77 54.203 54.203 55.082 -0.879 18321 26129 1 20 . 1 1 77 77 GLU CB C 77 33.141 33.141 31.003 2.138 18321 26130 1 20 . 1 1 77 77 GLU H H 77 7.732 7.732 8.261 -0.529 18321 26131 1 20 . 1 1 78 78 PHE N N 78 117.911 117.911 121.314 -3.403 18321 26132 1 20 . 1 1 78 78 PHE HA H 78 4.659 4.659 4.703 -0.044 18321 26133 1 20 . 1 1 78 78 PHE C C 78 175.673 175.673 176.290 -0.617 18321 26134 1 20 . 1 1 78 78 PHE CA C 78 57.160 57.160 56.678 0.482 18321 26135 1 20 . 1 1 78 78 PHE CB C 78 45.405 45.405 41.129 4.276 18321 26136 1 20 . 1 1 78 78 PHE H H 78 9.235 9.235 8.499 0.736 18321 26137 1 20 . 1 1 79 79 ASP N N 79 119.296 119.296 119.199 0.097 18321 26138 1 20 . 1 1 79 79 ASP HA H 79 4.462 4.462 4.534 -0.072 18321 26139 1 20 . 1 1 79 79 ASP C C 79 174.482 174.482 176.370 -1.888 18321 26140 1 20 . 1 1 79 79 ASP CA C 79 56.629 56.629 56.932 -0.303 18321 26141 1 20 . 1 1 79 79 ASP CB C 79 41.697 41.697 41.118 0.579 18321 26142 1 20 . 1 1 79 79 ASP H H 79 9.187 9.187 8.727 0.460 18321 26143 1 20 . 1 1 80 80 HIS N N 80 107.631 107.631 112.534 -4.903 18321 26144 1 20 . 1 1 80 80 HIS HA H 80 5.022 5.022 5.158 -0.136 18321 26145 1 20 . 1 1 80 80 HIS C C 80 174.626 174.626 175.577 -0.951 18321 26146 1 20 . 1 1 80 80 HIS CA C 80 54.223 54.223 54.958 -0.735 18321 26147 1 20 . 1 1 80 80 HIS CB C 80 32.205 32.205 31.331 0.874 18321 26148 1 20 . 1 1 80 80 HIS H H 80 7.200 7.200 7.496 -0.296 18321 26149 1 20 . 1 1 81 81 LEU N N 81 120.710 120.710 120.512 0.198 18321 26150 1 20 . 1 1 81 81 LEU HA H 81 3.804 3.804 4.093 -0.289 18321 26151 1 20 . 1 1 81 81 LEU CA C 81 58.709 58.709 60.019 -1.310 18321 26152 1 20 . 1 1 81 81 LEU CB C 81 39.646 39.646 40.172 -0.526 18321 26153 1 20 . 1 1 81 81 LEU H H 81 8.886 8.886 9.072 -0.186 18321 26154 1 20 . 1 1 82 82 PRO HA H 82 4.020 4.020 4.187 -0.167 18321 26155 1 20 . 1 1 82 82 PRO C C 82 175.619 175.619 177.122 -1.503 18321 26156 1 20 . 1 1 82 82 PRO CA C 82 67.025 67.025 65.156 1.869 18321 26157 1 20 . 1 1 82 82 PRO CB C 82 30.962 30.962 31.079 -0.117 18321 26158 1 20 . 1 1 83 83 ALA N N 83 124.281 124.281 119.209 5.072 18321 26159 1 20 . 1 1 83 83 ALA HA H 83 4.019 4.019 4.125 -0.106 18321 26160 1 20 . 1 1 83 83 ALA C C 83 179.709 179.709 178.676 1.033 18321 26161 1 20 . 1 1 83 83 ALA CA C 83 54.985 54.985 54.118 0.867 18321 26162 1 20 . 1 1 83 83 ALA CB C 83 18.425 18.425 18.332 0.093 18321 26163 1 20 . 1 1 83 83 ALA H H 83 8.527 8.527 7.558 0.969 18321 26164 1 20 . 1 1 84 84 LEU N N 84 122.960 122.960 117.298 5.662 18321 26165 1 20 . 1 1 84 84 LEU HA H 84 1.917 1.917 2.874 -0.957 18321 26166 1 20 . 1 1 84 84 LEU C C 84 177.652 177.652 178.080 -0.428 18321 26167 1 20 . 1 1 84 84 LEU CA C 84 58.261 58.261 57.059 1.202 18321 26168 1 20 . 1 1 84 84 LEU CB C 84 42.544 42.544 40.968 1.575 18321 26169 1 20 . 1 1 84 84 LEU H H 84 6.982 6.982 7.269 -0.286 18321 26170 1 20 . 1 1 85 85 LEU N N 85 117.940 117.940 118.586 -0.646 18321 26171 1 20 . 1 1 85 85 LEU HA H 85 3.463 3.463 3.815 -0.352 18321 26172 1 20 . 1 1 85 85 LEU C C 85 178.809 178.809 178.722 0.087 18321 26173 1 20 . 1 1 85 85 LEU CA C 85 57.522 57.522 57.453 0.069 18321 26174 1 20 . 1 1 85 85 LEU CB C 85 41.242 41.242 41.150 0.092 18321 26175 1 20 . 1 1 85 85 LEU H H 85 7.773 7.773 7.362 0.411 18321 26176 1 20 . 1 1 86 86 GLU N N 86 115.762 115.762 118.101 -2.339 18321 26177 1 20 . 1 1 86 86 GLU HA H 86 3.540 3.540 3.946 -0.406 18321 26178 1 20 . 1 1 86 86 GLU C C 86 180.228 180.228 178.957 1.271 18321 26179 1 20 . 1 1 86 86 GLU CA C 86 58.943 58.943 58.432 0.511 18321 26180 1 20 . 1 1 86 86 GLU CB C 86 29.561 29.561 29.515 0.046 18321 26181 1 20 . 1 1 86 86 GLU H H 86 8.300 8.300 7.361 0.939 18321 26182 1 20 . 1 1 87 87 PHE N N 87 121.135 121.135 121.301 -0.166 18321 26183 1 20 . 1 1 87 87 PHE HA H 87 4.122 4.122 4.137 -0.015 18321 26184 1 20 . 1 1 87 87 PHE C C 87 179.497 179.497 177.152 2.345 18321 26185 1 20 . 1 1 87 87 PHE CA C 87 62.090 62.090 60.457 1.633 18321 26186 1 20 . 1 1 87 87 PHE CB C 87 40.103 40.103 39.121 0.982 18321 26187 1 20 . 1 1 87 87 PHE H H 87 7.717 7.717 7.323 0.394 18321 26188 1 20 . 1 1 88 88 TYR N N 88 116.579 116.579 116.548 0.031 18321 26189 1 20 . 1 1 88 88 TYR HA H 88 4.933 4.933 4.265 0.668 18321 26190 1 20 . 1 1 88 88 TYR C C 88 174.799 174.799 176.638 -1.839 18321 26191 1 20 . 1 1 88 88 TYR CA C 88 61.333 61.333 58.243 3.090 18321 26192 1 20 . 1 1 88 88 TYR CB C 88 36.539 36.539 36.703 -0.164 18321 26193 1 20 . 1 1 88 88 TYR H H 88 7.478 7.478 7.651 -0.173 18321 26194 1 20 . 1 1 89 89 LYS N N 89 117.737 117.737 119.972 -2.235 18321 26195 1 20 . 1 1 89 89 LYS HA H 89 4.466 4.466 4.090 0.376 18321 26196 1 20 . 1 1 89 89 LYS C C 89 178.417 178.417 176.910 1.507 18321 26197 1 20 . 1 1 89 89 LYS CA C 89 59.486 59.486 58.535 0.951 18321 26198 1 20 . 1 1 89 89 LYS CB C 89 34.523 34.523 32.727 1.796 18321 26199 1 20 . 1 1 89 89 LYS H H 89 7.505 7.505 7.489 0.016 18321 26200 1 20 . 1 1 90 90 ILE N N 90 110.972 110.972 111.266 -0.294 18321 26201 1 20 . 1 1 90 90 ILE HA H 90 4.181 4.181 4.105 0.076 18321 26202 1 20 . 1 1 90 90 ILE C C 90 174.571 174.571 176.262 -1.691 18321 26203 1 20 . 1 1 90 90 ILE CA C 90 60.516 60.516 61.842 -1.326 18321 26204 1 20 . 1 1 90 90 ILE CB C 90 39.979 39.979 37.735 2.244 18321 26205 1 20 . 1 1 90 90 ILE H H 90 6.710 6.710 7.243 -0.533 18321 26206 1 20 . 1 1 91 91 HIS N N 91 119.479 119.479 120.228 -0.749 18321 26207 1 20 . 1 1 91 91 HIS HA H 91 4.357 4.357 4.291 0.066 18321 26208 1 20 . 1 1 91 91 HIS C C 91 172.751 172.751 175.175 -2.424 18321 26209 1 20 . 1 1 91 91 HIS CA C 91 55.066 55.066 57.149 -2.083 18321 26210 1 20 . 1 1 91 91 HIS CB C 91 29.756 29.756 31.312 -1.556 18321 26211 1 20 . 1 1 91 91 HIS H H 91 7.460 7.460 7.478 -0.018 18321 26212 1 20 . 1 1 92 92 TYR N N 92 117.642 117.642 116.701 0.941 18321 26213 1 20 . 1 1 92 92 TYR HA H 92 4.131 4.131 4.279 -0.148 18321 26214 1 20 . 1 1 92 92 TYR C C 92 177.348 177.348 175.783 1.565 18321 26215 1 20 . 1 1 92 92 TYR CA C 92 58.627 58.627 58.558 0.069 18321 26216 1 20 . 1 1 92 92 TYR CB C 92 39.481 39.481 36.184 3.297 18321 26217 1 20 . 1 1 92 92 TYR H H 92 8.067 8.067 7.539 0.528 18321 26218 1 20 . 1 1 93 93 LEU N N 93 123.560 123.560 122.193 1.367 18321 26219 1 20 . 1 1 93 93 LEU HA H 93 4.104 4.104 4.272 -0.168 18321 26220 1 20 . 1 1 93 93 LEU C C 93 175.610 175.610 178.394 -2.784 18321 26221 1 20 . 1 1 93 93 LEU CA C 93 56.381 56.381 56.937 -0.556 18321 26222 1 20 . 1 1 93 93 LEU CB C 93 38.896 38.896 42.480 -3.584 18321 26223 1 20 . 1 1 93 93 LEU H H 93 7.907 7.907 7.972 -0.065 18321 26224 1 20 . 1 1 94 94 ASP N N 94 118.194 118.194 116.666 1.528 18321 26225 1 20 . 1 1 94 94 ASP HA H 94 4.940 4.940 4.658 0.282 18321 26226 1 20 . 1 1 94 94 ASP C C 94 176.123 176.123 175.965 0.158 18321 26227 1 20 . 1 1 94 94 ASP CA C 94 56.235 56.235 53.727 2.507 18321 26228 1 20 . 1 1 94 94 ASP CB C 94 42.078 42.078 40.083 1.996 18321 26229 1 20 . 1 1 94 94 ASP H H 94 8.640 8.640 8.327 0.313 18321 26230 1 20 . 1 1 95 95 THR N N 95 105.073 105.073 116.635 -11.562 18321 26231 1 20 . 1 1 95 95 THR HA H 95 4.318 4.318 3.965 0.353 18321 26232 1 20 . 1 1 95 95 THR C C 95 174.685 174.685 173.108 1.577 18321 26233 1 20 . 1 1 95 95 THR CA C 95 60.756 60.756 64.118 -3.361 18321 26234 1 20 . 1 1 95 95 THR CB C 95 71.058 71.058 68.480 2.578 18321 26235 1 20 . 1 1 95 95 THR H H 95 8.576 8.576 7.981 0.595 18321 26236 1 20 . 1 1 96 96 THR N N 96 116.817 116.817 112.395 4.422 18321 26237 1 20 . 1 1 96 96 THR HA H 96 5.129 5.129 4.791 0.338 18321 26238 1 20 . 1 1 96 96 THR C C 96 172.464 172.464 172.704 -0.240 18321 26239 1 20 . 1 1 96 96 THR CA C 96 60.762 60.762 61.305 -0.543 18321 26240 1 20 . 1 1 96 96 THR CB C 96 71.425 71.425 71.963 -0.537 18321 26241 1 20 . 1 1 96 96 THR H H 96 8.205 8.205 7.897 0.308 18321 26242 1 20 . 1 1 97 97 THR N N 97 114.324 114.324 113.191 1.133 18321 26243 1 20 . 1 1 97 97 THR HA H 97 5.128 5.128 4.598 0.530 18321 26244 1 20 . 1 1 97 97 THR C C 97 175.480 175.480 174.566 0.914 18321 26245 1 20 . 1 1 97 97 THR CA C 97 60.233 60.233 59.553 0.680 18321 26246 1 20 . 1 1 97 97 THR CB C 97 70.415 70.415 70.679 -0.264 18321 26247 1 20 . 1 1 97 97 THR H H 97 7.128 7.128 8.088 -0.960 18321 26248 1 20 . 1 1 98 98 LEU N N 98 116.674 116.674 122.518 -5.844 18321 26249 1 20 . 1 1 98 98 LEU HA H 98 4.075 4.075 4.071 0.004 18321 26250 1 20 . 1 1 98 98 LEU C C 98 177.892 177.892 176.561 1.331 18321 26251 1 20 . 1 1 98 98 LEU CA C 98 59.597 59.597 55.214 4.383 18321 26252 1 20 . 1 1 98 98 LEU CB C 98 41.172 41.172 40.631 0.541 18321 26253 1 20 . 1 1 98 98 LEU H H 98 8.743 8.743 7.878 0.865 18321 26254 1 20 . 1 1 99 99 ILE N N 99 122.988 122.988 123.458 -0.470 18321 26255 1 20 . 1 1 99 99 ILE HA H 99 4.415 4.415 4.070 0.345 18321 26256 1 20 . 1 1 99 99 ILE C C 99 175.055 175.055 176.033 -0.978 18321 26257 1 20 . 1 1 99 99 ILE CA C 99 62.183 62.183 62.026 0.157 18321 26258 1 20 . 1 1 99 99 ILE CB C 99 40.252 40.252 38.744 1.508 18321 26259 1 20 . 1 1 99 99 ILE H H 99 8.998 8.998 8.189 0.809 18321 26260 1 20 . 1 1 100 100 GLU N N 100 114.067 114.067 116.538 -2.471 18321 26261 1 20 . 1 1 100 100 GLU CA C 100 52.910 52.910 53.263 -0.353 18321 26262 1 20 . 1 1 100 100 GLU CB C 100 31.155 31.155 33.113 -1.958 18321 26263 1 20 . 1 1 100 100 GLU H H 100 7.332 7.332 8.132 -0.800 18321 26264 1 20 . 1 1 101 101 PRO HA H 101 4.952 4.952 3.594 1.358 18321 26265 1 20 . 1 1 101 101 PRO C C 101 175.976 175.976 175.988 -0.012 18321 26266 1 20 . 1 1 101 101 PRO CA C 101 53.312 53.312 62.332 -9.020 18321 26267 1 20 . 1 1 101 101 PRO CB C 101 31.598 31.598 31.970 -0.372 18321 26268 1 20 . 1 1 102 102 ALA N N 102 125.968 125.968 123.544 2.424 18321 26269 1 20 . 1 1 102 102 ALA HA H 102 4.516 4.516 4.234 0.282 18321 26270 1 20 . 1 1 102 102 ALA CA C 102 49.852 49.852 50.012 -0.160 18321 26271 1 20 . 1 1 102 102 ALA CB C 102 17.766 17.766 18.576 -0.810 18321 26272 1 20 . 1 1 102 102 ALA H H 102 8.232 8.232 7.976 0.256 18321 26273 1 20 . 1 1 103 103 PRO HA H 103 4.283 4.283 4.369 -0.086 18321 26274 1 20 . 1 1 103 103 PRO CA C 103 62.435 62.435 63.063 -0.628 18321 26275 1 20 . 1 1 103 103 PRO CB C 103 32.145 32.145 32.227 -0.082 18321 26276 1 20 . 1 1 104 104 ARG HA H 104 4.004 4.004 4.335 -0.331 18321 26277 1 20 . 1 1 104 104 ARG CA C 104 56.660 56.660 57.009 -0.349 18321 26278 1 20 . 1 1 106 106 PRO C C 106 174.587 174.587 175.831 -1.244 18321 26279 1 20 . 1 1 106 106 PRO CA C 106 57.867 57.867 63.811 -5.944 18321 26280 1 20 . 1 1 106 106 PRO CB C 106 31.942 31.942 31.437 0.505 18321 26281 1 20 . 1 1 107 107 SER N N 107 121.280 121.280 120.154 1.126 18321 26282 1 20 . 1 1 107 107 SER CA C 107 61.772 61.772 56.758 5.014 18321 26283 1 20 . 1 1 107 107 SER CB C 107 63.234 63.234 64.227 -0.993 18321 26284 1 20 . 1 1 107 107 SER H H 107 8.132 8.132 8.332 -0.200 18321 26285 1 20 . 1 1 109 109 PRO C C 109 177.129 177.129 177.297 -0.168 18321 26286 1 20 . 1 1 109 109 PRO CA C 109 62.638 62.638 64.814 -2.176 18321 26287 1 20 . 1 1 109 109 PRO CB C 109 30.970 30.970 31.714 -0.744 18321 26288 1 20 . 1 1 110 110 MET N N 110 120.772 120.772 114.229 6.543 18321 26289 1 20 . 1 1 110 110 MET C C 110 176.892 176.892 176.395 0.497 18321 26290 1 20 . 1 1 110 110 MET CA C 110 55.310 55.310 54.948 0.362 18321 26291 1 20 . 1 1 110 110 MET CB C 110 32.202 32.202 31.686 0.515 18321 26292 1 20 . 1 1 110 110 MET H H 110 8.430 8.430 7.686 0.744 18321 26293 1 20 . 1 1 111 111 GLY N N 111 110.158 110.158 110.772 -0.614 18321 26294 1 20 . 1 1 111 111 GLY C C 111 177.430 177.430 174.049 3.381 18321 26295 1 20 . 1 1 111 111 GLY CA C 111 44.951 44.951 44.653 0.298 18321 26296 1 20 . 1 1 111 111 GLY H H 111 8.384 8.384 7.728 0.656 18321 26297 1 20 . 1 1 112 112 SER N N 112 116.762 116.762 120.347 -3.585 18321 26298 1 20 . 1 1 112 112 SER CA C 112 55.948 55.948 57.706 -1.758 18321 26299 1 20 . 1 1 112 112 SER CB C 112 62.745 62.745 63.351 -0.606 18321 26300 1 20 . 1 1 112 112 SER H H 112 8.161 8.161 7.985 0.176 18321 26301 1 20 . 1 1 113 113 VAL C C 113 176.083 176.083 176.117 -0.034 18321 26302 1 20 . 1 1 114 114 SER N N 114 119.151 119.151 125.093 -5.942 18321 26303 1 20 . 1 1 114 114 SER C C 114 173.638 173.638 174.073 -0.435 18321 26304 1 20 . 1 1 114 114 SER CA C 114 58.005 58.005 58.603 -0.598 18321 26305 1 20 . 1 1 114 114 SER CB C 114 63.169 63.169 63.566 -0.397 18321 26306 1 20 . 1 1 114 114 SER H H 114 8.319 8.319 9.169 -0.850 18321 26307 1 20 . 1 1 115 115 ALA N N 115 126.914 126.914 124.131 2.783 18321 26308 1 20 . 1 1 115 115 ALA CA C 115 51.561 51.561 50.726 0.835 18321 26309 1 20 . 1 1 115 115 ALA CB C 115 17.714 17.714 19.794 -2.080 18321 26310 1 20 . 1 1 115 115 ALA H H 115 8.197 8.197 7.879 0.318 18321 26311 1 20 . 1 1 119 119 PRO C C 119 177.065 177.065 175.997 1.068 18321 26312 1 20 . 1 1 120 120 THR N N 120 113.976 113.976 113.211 0.765 18321 26313 1 20 . 1 1 120 120 THR C C 120 174.461 174.461 174.500 -0.039 18321 26314 1 20 . 1 1 120 120 THR CA C 120 61.215 61.215 61.314 -0.099 18321 26315 1 20 . 1 1 120 120 THR CB C 120 69.508 69.508 69.414 0.094 18321 26316 1 20 . 1 1 120 120 THR H H 120 8.138 8.138 8.063 0.075 18321 26317 1 20 . 1 1 121 121 ALA N N 121 125.859 125.859 131.228 -5.369 18321 26318 1 20 . 1 1 121 121 ALA CA C 121 52.281 52.281 53.294 -1.013 18321 26319 1 20 . 1 1 121 121 ALA CB C 121 18.623 18.623 19.500 -0.877 18321 26320 1 20 . 1 1 121 121 ALA H H 121 8.272 8.272 8.365 -0.093 18321 26321 1 20 . 1 1 122 122 GLU C C 122 176.316 176.316 174.777 1.539 18321 26322 1 20 . 1 1 123 123 ASP N N 123 120.448 120.448 128.547 -8.099 18321 26323 1 20 . 1 1 123 123 ASP C C 123 175.906 175.906 175.186 0.720 18321 26324 1 20 . 1 1 123 123 ASP CA C 123 54.167 54.167 54.284 -0.117 18321 26325 1 20 . 1 1 123 123 ASP CB C 123 40.695 40.695 40.117 0.578 18321 26326 1 20 . 1 1 123 123 ASP H H 123 8.181 8.181 8.725 -0.544 18321 26327 1 20 . 1 1 124 124 ASN N N 124 118.207 118.207 118.850 -0.643 18321 26328 1 20 . 1 1 124 124 ASN C C 124 174.851 174.851 173.240 1.611 18321 26329 1 20 . 1 1 124 124 ASN CA C 124 52.771 52.771 52.752 0.019 18321 26330 1 20 . 1 1 124 124 ASN CB C 124 38.304 38.304 41.261 -2.957 18321 26331 1 20 . 1 1 124 124 ASN H H 124 8.307 8.307 8.119 0.188 18321 26332 1 20 . 1 1 125 125 LEU N N 125 121.311 121.311 120.025 1.286 18321 26333 1 20 . 1 1 125 125 LEU C C 125 175.750 175.750 176.263 -0.513 18321 26334 1 20 . 1 1 125 125 LEU CA C 125 54.428 54.428 55.433 -1.005 18321 26335 1 20 . 1 1 125 125 LEU CB C 125 41.350 41.350 40.923 0.427 18321 26336 1 20 . 1 1 125 125 LEU H H 125 7.747 7.747 8.331 -0.584 18321 26337 1 20 . 1 1 126 126 GLU N N 126 122.485 122.485 118.280 4.205 18321 26338 1 20 . 1 1 126 126 GLU C C 126 174.008 174.008 174.066 -0.058 18321 26339 1 20 . 1 1 126 126 GLU CA C 126 54.855 54.855 56.690 -1.835 18321 26340 1 20 . 1 1 126 126 GLU CB C 126 30.472 30.472 30.283 0.189 18321 26341 1 20 . 1 1 126 126 GLU H H 126 8.453 8.453 8.175 0.278 18321 26342 1 20 . 1 1 127 127 TYR N N 127 122.713 122.713 121.833 0.880 18321 26343 1 20 . 1 1 127 127 TYR C C 127 176.859 176.859 174.743 2.116 18321 26344 1 20 . 1 1 127 127 TYR CA C 127 56.528 56.528 56.944 -0.416 18321 26345 1 20 . 1 1 127 127 TYR CB C 127 40.982 40.982 39.171 1.811 18321 26346 1 20 . 1 1 127 127 TYR H H 127 8.469 8.469 8.092 0.377 18321 26347 1 20 . 1 1 128 128 VAL N N 128 112.432 112.432 123.948 -11.516 18321 26348 1 20 . 1 1 128 128 VAL C C 128 173.150 173.150 174.367 -1.217 18321 26349 1 20 . 1 1 128 128 VAL CA C 128 57.940 57.940 60.852 -2.912 18321 26350 1 20 . 1 1 128 128 VAL CB C 128 34.935 34.935 35.215 -0.280 18321 26351 1 20 . 1 1 128 128 VAL H H 128 9.078 9.078 8.879 0.199 18321 26352 1 20 . 1 1 129 129 ARG N N 129 120.373 120.373 124.707 -4.334 18321 26353 1 20 . 1 1 129 129 ARG C C 129 176.539 176.539 175.355 1.184 18321 26354 1 20 . 1 1 129 129 ARG CA C 129 52.534 52.534 53.736 -1.202 18321 26355 1 20 . 1 1 129 129 ARG CB C 129 32.942 32.942 33.252 -0.310 18321 26356 1 20 . 1 1 129 129 ARG H H 129 9.010 9.010 8.234 0.776 18321 26357 1 20 . 1 1 130 130 THR N N 130 116.637 116.637 110.766 5.871 18321 26358 1 20 . 1 1 130 130 THR CA C 130 60.618 60.618 60.428 0.190 18321 26359 1 20 . 1 1 130 130 THR CB C 130 69.170 69.170 71.015 -1.845 18321 26360 1 20 . 1 1 130 130 THR H H 130 9.045 9.045 9.260 -0.215 18321 26361 1 20 . 1 1 131 131 LEU N N 131 122.910 122.910 122.539 0.371 18321 26362 1 20 . 1 1 131 131 LEU C C 131 175.269 175.269 178.173 -2.904 18321 26363 1 20 . 1 1 131 131 LEU CA C 131 55.122 55.122 55.235 -0.113 18321 26364 1 20 . 1 1 131 131 LEU CB C 131 43.108 43.108 42.709 0.399 18321 26365 1 20 . 1 1 131 131 LEU H H 131 9.224 9.224 8.413 0.811 18321 26366 1 20 . 1 1 132 132 TYR N N 132 112.885 112.885 120.016 -7.131 18321 26367 1 20 . 1 1 132 132 TYR C C 132 173.818 173.818 175.907 -2.089 18321 26368 1 20 . 1 1 132 132 TYR CA C 132 54.230 54.230 60.028 -5.798 18321 26369 1 20 . 1 1 132 132 TYR CB C 132 42.672 42.672 39.726 2.946 18321 26370 1 20 . 1 1 132 132 TYR H H 132 7.284 7.284 7.628 -0.344 18321 26371 1 20 . 1 1 133 133 ASP N N 133 118.003 118.003 119.491 -1.488 18321 26372 1 20 . 1 1 133 133 ASP C C 133 175.779 175.779 174.128 1.651 18321 26373 1 20 . 1 1 133 133 ASP CA C 133 54.351 54.351 55.418 -1.067 18321 26374 1 20 . 1 1 133 133 ASP CB C 133 41.241 41.241 40.267 0.973 18321 26375 1 20 . 1 1 133 133 ASP H H 133 8.399 8.399 8.435 -0.036 18321 26376 1 20 . 1 1 134 134 PHE N N 134 121.081 121.081 124.054 -2.973 18321 26377 1 20 . 1 1 134 134 PHE CA C 134 52.552 52.552 54.893 -2.341 18321 26378 1 20 . 1 1 134 134 PHE CB C 134 41.217 41.217 41.724 -0.507 18321 26379 1 20 . 1 1 134 134 PHE H H 134 8.797 8.797 6.859 1.938 18321 26380 1 20 . 1 1 136 136 GLY C C 136 171.616 171.616 174.686 -3.070 18321 26381 1 20 . 1 1 137 137 ASN N N 137 119.394 119.394 116.487 2.907 18321 26382 1 20 . 1 1 137 137 ASN C C 137 174.500 174.500 173.554 0.946 18321 26383 1 20 . 1 1 137 137 ASN CA C 137 44.670 44.670 54.705 -10.035 18321 26384 1 20 . 1 1 137 137 ASN H H 137 9.477 9.477 8.377 1.100 18321 26385 1 20 . 1 1 138 138 ASP N N 138 120.608 120.608 118.985 1.623 18321 26386 1 20 . 1 1 138 138 ASP C C 138 176.987 176.987 174.512 2.475 18321 26387 1 20 . 1 1 138 138 ASP CA C 138 52.992 52.992 53.186 -0.194 18321 26388 1 20 . 1 1 138 138 ASP H H 138 8.216 8.216 8.266 -0.050 18321 26389 1 20 . 1 1 139 139 ALA N N 139 124.371 124.371 121.527 2.844 18321 26390 1 20 . 1 1 139 139 ALA C C 139 178.472 178.472 178.844 -0.372 18321 26391 1 20 . 1 1 139 139 ALA CA C 139 54.513 54.513 54.172 0.341 18321 26392 1 20 . 1 1 139 139 ALA CB C 139 18.045 18.045 19.509 -1.464 18321 26393 1 20 . 1 1 139 139 ALA H H 139 8.565 8.565 8.517 0.048 18321 26394 1 20 . 1 1 140 140 GLU N N 140 115.022 115.022 117.810 -2.788 18321 26395 1 20 . 1 1 140 140 GLU C C 140 177.027 177.027 175.894 1.133 18321 26396 1 20 . 1 1 140 140 GLU CA C 140 56.181 56.181 58.236 -2.055 18321 26397 1 20 . 1 1 140 140 GLU CB C 140 28.619 28.619 30.080 -1.461 18321 26398 1 20 . 1 1 140 140 GLU H H 140 8.616 8.616 8.504 0.112 18321 26399 1 20 . 1 1 141 141 ASP N N 141 121.913 121.913 119.637 2.276 18321 26400 1 20 . 1 1 141 141 ASP C C 141 175.923 175.923 174.759 1.164 18321 26401 1 20 . 1 1 141 141 ASP CA C 141 54.736 54.736 53.138 1.599 18321 26402 1 20 . 1 1 141 141 ASP CB C 141 41.305 41.305 42.785 -1.480 18321 26403 1 20 . 1 1 141 141 ASP H H 141 7.636 7.636 7.879 -0.243 18321 26404 1 20 . 1 1 142 142 LEU N N 142 127.651 127.651 126.758 0.893 18321 26405 1 20 . 1 1 142 142 LEU CA C 142 50.955 50.955 52.883 -1.928 18321 26406 1 20 . 1 1 142 142 LEU CB C 142 42.343 42.343 43.758 -1.415 18321 26407 1 20 . 1 1 142 142 LEU H H 142 9.479 9.479 8.414 1.065 18321 26408 1 20 . 1 1 143 143 PRO C C 143 177.924 177.924 176.215 1.709 18321 26409 1 20 . 1 1 144 144 PHE N N 144 114.483 114.483 122.315 -7.832 18321 26410 1 20 . 1 1 144 144 PHE C C 144 175.055 175.055 174.696 0.359 18321 26411 1 20 . 1 1 144 144 PHE CA C 144 55.543 55.543 55.654 -0.111 18321 26412 1 20 . 1 1 144 144 PHE CB C 144 40.581 40.581 41.377 -0.796 18321 26413 1 20 . 1 1 144 144 PHE H H 144 8.637 8.637 7.546 1.091 18321 26414 1 20 . 1 1 145 145 LYS N N 145 121.342 121.342 118.088 3.254 18321 26415 1 20 . 1 1 145 145 LYS C C 145 176.925 176.925 177.633 -0.708 18321 26416 1 20 . 1 1 145 145 LYS CA C 145 53.043 53.043 53.816 -0.772 18321 26417 1 20 . 1 1 145 145 LYS CB C 145 33.804 33.804 35.347 -1.543 18321 26418 1 20 . 1 1 145 145 LYS H H 145 9.418 9.418 8.099 1.319 18321 26419 1 20 . 1 1 146 146 LYS N N 146 123.378 123.378 118.665 4.713 18321 26420 1 20 . 1 1 146 146 LYS CA C 146 57.883 57.883 56.975 0.908 18321 26421 1 20 . 1 1 146 146 LYS CB C 146 32.008 32.008 33.018 -1.010 18321 26422 1 20 . 1 1 146 146 LYS H H 146 9.002 9.002 8.688 0.314 18321 26423 1 20 . 1 1 147 147 GLY C C 147 174.315 174.315 173.384 0.931 18321 26424 1 20 . 1 1 148 148 GLU N N 148 121.392 121.392 119.659 1.733 18321 26425 1 20 . 1 1 148 148 GLU C C 148 174.998 174.998 175.320 -0.322 18321 26426 1 20 . 1 1 148 148 GLU CA C 148 56.867 56.867 54.949 1.918 18321 26427 1 20 . 1 1 148 148 GLU CB C 148 31.649 31.649 30.706 0.943 18321 26428 1 20 . 1 1 148 148 GLU H H 148 7.937 7.937 8.084 -0.147 18321 26429 1 20 . 1 1 149 149 ILE N N 149 120.124 120.124 119.906 0.218 18321 26430 1 20 . 1 1 149 149 ILE C C 149 176.647 176.647 174.735 1.912 18321 26431 1 20 . 1 1 149 149 ILE CA C 149 58.621 58.621 60.458 -1.837 18321 26432 1 20 . 1 1 149 149 ILE CB C 149 36.952 36.952 39.773 -2.821 18321 26433 1 20 . 1 1 149 149 ILE H H 149 8.346 8.346 8.293 0.053 18321 26434 1 20 . 1 1 150 150 LEU N N 150 126.950 126.950 125.436 1.514 18321 26435 1 20 . 1 1 150 150 LEU CA C 150 51.967 51.967 52.674 -0.707 18321 26436 1 20 . 1 1 150 150 LEU CB C 150 44.182 44.182 46.088 -1.906 18321 26437 1 20 . 1 1 150 150 LEU H H 150 8.988 8.988 9.019 -0.031 18321 26438 1 20 . 1 1 151 151 VAL C C 151 175.670 175.670 175.817 -0.147 18321 26439 1 20 . 1 1 152 152 ILE N N 152 124.997 124.997 128.746 -3.749 18321 26440 1 20 . 1 1 152 152 ILE CA C 152 58.331 58.331 59.933 -1.602 18321 26441 1 20 . 1 1 152 152 ILE CB C 152 34.093 34.093 34.891 -0.798 18321 26442 1 20 . 1 1 152 152 ILE H H 152 8.673 8.673 8.260 0.413 18321 26443 1 20 . 1 1 153 153 ILE N N 153 124.710 124.710 127.307 -2.597 18321 26444 1 20 . 1 1 153 153 ILE C C 153 176.264 176.264 174.574 1.690 18321 26445 1 20 . 1 1 154 154 GLU N N 154 117.398 117.398 116.263 1.135 18321 26446 1 20 . 1 1 154 154 GLU C C 154 173.959 173.959 174.367 -0.408 18321 26447 1 20 . 1 1 154 154 GLU CA C 154 55.289 55.289 54.596 0.693 18321 26448 1 20 . 1 1 154 154 GLU CB C 154 32.842 32.842 32.316 0.526 18321 26449 1 20 . 1 1 154 154 GLU H H 154 7.818 7.818 8.237 -0.419 18321 26450 1 20 . 1 1 155 155 LYS N N 155 121.130 121.130 123.353 -2.223 18321 26451 1 20 . 1 1 155 155 LYS CA C 155 53.022 53.022 52.845 0.177 18321 26452 1 20 . 1 1 155 155 LYS CB C 155 32.663 32.663 33.074 -0.411 18321 26453 1 20 . 1 1 155 155 LYS H H 155 8.654 8.654 9.547 -0.893 18321 26454 1 20 . 1 1 157 157 GLU C C 157 175.190 175.190 175.837 -0.647 18321 26455 1 20 . 1 1 157 157 GLU CA C 157 53.785 53.785 54.771 -0.986 18321 26456 1 20 . 1 1 157 157 GLU CB C 157 32.685 32.685 31.859 0.826 18321 26457 1 20 . 1 1 158 158 GLU N N 158 117.425 117.425 116.546 0.879 18321 26458 1 20 . 1 1 158 158 GLU C C 158 178.600 178.600 176.643 1.957 18321 26459 1 20 . 1 1 158 158 GLU CA C 158 59.044 59.044 57.303 1.741 18321 26460 1 20 . 1 1 158 158 GLU CB C 158 29.706 29.706 30.438 -0.732 18321 26461 1 20 . 1 1 158 158 GLU H H 158 8.678 8.678 8.663 0.015 18321 26462 1 20 . 1 1 159 159 GLN N N 159 110.925 110.925 117.755 -6.830 18321 26463 1 20 . 1 1 159 159 GLN C C 159 175.539 175.539 174.977 0.562 18321 26464 1 20 . 1 1 159 159 GLN CA C 159 54.942 54.942 56.460 -1.518 18321 26465 1 20 . 1 1 159 159 GLN CB C 159 28.572 28.572 29.514 -0.942 18321 26466 1 20 . 1 1 159 159 GLN H H 159 8.483 8.483 8.520 -0.037 18321 26467 1 20 . 1 1 160 160 TRP N N 160 120.171 120.171 119.680 0.491 18321 26468 1 20 . 1 1 160 160 TRP C C 160 173.444 173.444 175.000 -1.556 18321 26469 1 20 . 1 1 160 160 TRP CA C 160 56.175 56.175 56.320 -0.145 18321 26470 1 20 . 1 1 160 160 TRP CB C 160 31.796 31.796 32.566 -0.770 18321 26471 1 20 . 1 1 160 160 TRP H H 160 6.826 6.826 7.779 -0.953 18321 26472 1 20 . 1 1 161 161 TRP N N 161 120.687 120.687 121.282 -0.595 18321 26473 1 20 . 1 1 161 161 TRP C C 161 174.736 174.736 175.459 -0.723 18321 26474 1 20 . 1 1 161 161 TRP CA C 161 51.889 51.889 54.806 -2.917 18321 26475 1 20 . 1 1 161 161 TRP CB C 161 32.772 32.772 32.119 0.653 18321 26476 1 20 . 1 1 161 161 TRP H H 161 8.462 8.462 9.591 -1.129 18321 26477 1 20 . 1 1 162 162 SER N N 162 115.691 115.691 119.813 -4.122 18321 26478 1 20 . 1 1 162 162 SER C C 162 174.320 174.320 173.561 0.759 18321 26479 1 20 . 1 1 162 162 SER CA C 162 57.011 57.011 57.791 -0.780 18321 26480 1 20 . 1 1 162 162 SER CB C 162 63.948 63.948 62.740 1.208 18321 26481 1 20 . 1 1 162 162 SER H H 162 8.830 8.830 9.268 -0.438 18321 26482 1 20 . 1 1 163 163 ALA N N 163 130.630 130.630 128.401 2.229 18321 26483 1 20 . 1 1 163 163 ALA CA C 163 50.029 50.029 49.884 0.145 18321 26484 1 20 . 1 1 163 163 ALA CB C 163 25.500 25.500 22.347 3.153 18321 26485 1 20 . 1 1 163 163 ALA H H 163 9.585 9.585 9.204 0.381 18321 26486 1 20 . 1 1 164 164 ARG N N 164 117.526 117.526 121.185 -3.659 18321 26487 1 20 . 1 1 164 164 ARG C C 164 176.719 176.719 176.424 0.295 18321 26488 1 20 . 1 1 164 164 ARG CA C 164 52.975 52.975 54.461 -1.486 18321 26489 1 20 . 1 1 164 164 ARG CB C 164 34.260 34.260 30.872 3.388 18321 26490 1 20 . 1 1 164 164 ARG H H 164 9.097 9.097 8.789 0.308 18321 26491 1 20 . 1 1 165 165 ASN N N 165 123.935 123.935 121.543 2.392 18321 26492 1 20 . 1 1 165 165 ASN C C 165 178.484 178.484 176.392 2.092 18321 26493 1 20 . 1 1 165 165 ASN CA C 165 50.332 50.332 53.663 -3.332 18321 26494 1 20 . 1 1 165 165 ASN CB C 165 39.487 39.487 39.974 -0.487 18321 26495 1 20 . 1 1 165 165 ASN H H 165 8.756 8.756 8.650 0.106 18321 26496 1 20 . 1 1 166 166 LYS N N 166 118.464 118.464 119.811 -1.347 18321 26497 1 20 . 1 1 166 166 LYS C C 166 176.967 176.967 177.415 -0.448 18321 26498 1 20 . 1 1 166 166 LYS CA C 166 58.430 58.430 58.565 -0.135 18321 26499 1 20 . 1 1 166 166 LYS CB C 166 30.918 30.918 32.181 -1.263 18321 26500 1 20 . 1 1 166 166 LYS H H 166 8.915 8.915 8.568 0.347 18321 26501 1 20 . 1 1 167 167 ASP N N 167 118.138 118.138 114.553 3.585 18321 26502 1 20 . 1 1 167 167 ASP C C 167 176.464 176.464 177.151 -0.687 18321 26503 1 20 . 1 1 167 167 ASP CA C 167 54.212 54.212 55.183 -0.971 18321 26504 1 20 . 1 1 167 167 ASP CB C 167 41.178 41.178 40.948 0.230 18321 26505 1 20 . 1 1 167 167 ASP H H 167 7.508 7.508 8.483 -0.975 18321 26506 1 20 . 1 1 168 168 GLY N N 168 107.901 107.901 106.700 1.201 18321 26507 1 20 . 1 1 168 168 GLY C C 168 173.613 173.613 173.293 0.320 18321 26508 1 20 . 1 1 168 168 GLY CA C 168 44.783 44.783 44.747 0.036 18321 26509 1 20 . 1 1 168 168 GLY H H 168 8.173 8.173 7.829 0.344 18321 26510 1 20 . 1 1 169 169 ARG N N 169 124.324 124.324 121.250 3.074 18321 26511 1 20 . 1 1 169 169 ARG CA C 169 56.106 56.106 55.955 0.151 18321 26512 1 20 . 1 1 169 169 ARG CB C 169 29.648 29.648 31.226 -1.578 18321 26513 1 20 . 1 1 169 169 ARG H H 169 7.998 7.998 7.983 0.015 18321 26514 1 20 . 1 1 170 170 VAL C C 170 177.590 177.590 175.127 2.463 18321 26515 1 20 . 1 1 171 171 GLY N N 171 112.582 112.582 113.994 -1.412 18321 26516 1 20 . 1 1 171 171 GLY C C 171 170.991 170.991 172.484 -1.493 18321 26517 1 20 . 1 1 171 171 GLY CA C 171 45.361 45.361 44.899 0.462 18321 26518 1 20 . 1 1 171 171 GLY H H 171 9.013 9.013 8.501 0.512 18321 26519 1 20 . 1 1 172 172 MET N N 172 117.368 117.368 120.443 -3.075 18321 26520 1 20 . 1 1 172 172 MET C C 172 177.921 177.921 176.310 1.611 18321 26521 1 20 . 1 1 172 172 MET CA C 172 53.536 53.536 54.651 -1.115 18321 26522 1 20 . 1 1 172 172 MET CB C 172 30.838 30.838 33.237 -2.399 18321 26523 1 20 . 1 1 172 172 MET H H 172 8.885 8.885 8.300 0.585 18321 26524 1 20 . 1 1 173 173 ILE N N 173 113.130 113.130 118.664 -5.534 18321 26525 1 20 . 1 1 173 173 ILE CA C 173 56.284 56.284 57.803 -1.520 18321 26526 1 20 . 1 1 173 173 ILE CB C 173 40.870 40.870 40.543 0.327 18321 26527 1 20 . 1 1 173 173 ILE H H 173 9.704 9.704 9.566 0.138 18321 26528 1 20 . 1 1 174 174 PRO C C 174 176.714 176.714 177.985 -1.271 18321 26529 1 20 . 1 1 174 174 PRO CA C 174 66.290 66.290 61.143 5.147 18321 26530 1 20 . 1 1 174 174 PRO CB C 174 28.993 28.993 30.570 -1.577 18321 26531 1 20 . 1 1 175 175 VAL N N 175 128.066 128.066 124.138 3.928 18321 26532 1 20 . 1 1 175 175 VAL CA C 175 59.356 59.356 67.889 -8.533 18321 26533 1 20 . 1 1 175 175 VAL H H 175 7.327 7.327 8.117 -0.790 18321 26534 1 20 . 1 1 176 176 PRO C C 176 176.351 176.351 176.698 -0.347 18321 26535 1 20 . 1 1 177 177 TYR N N 177 115.756 115.756 115.920 -0.164 18321 26536 1 20 . 1 1 177 177 TYR C C 177 175.011 175.011 175.280 -0.269 18321 26537 1 20 . 1 1 177 177 TYR CA C 177 56.756 56.756 56.775 -0.019 18321 26538 1 20 . 1 1 177 177 TYR CB C 177 37.507 37.507 39.093 -1.586 18321 26539 1 20 . 1 1 177 177 TYR H H 177 7.784 7.784 7.827 -0.043 18321 26540 1 20 . 1 1 178 178 VAL N N 178 111.428 111.428 114.348 -2.920 18321 26541 1 20 . 1 1 178 178 VAL C C 178 173.417 173.417 175.609 -2.192 18321 26542 1 20 . 1 1 178 178 VAL CA C 178 58.307 58.307 59.484 -1.177 18321 26543 1 20 . 1 1 178 178 VAL CB C 178 34.602 34.602 33.934 0.668 18321 26544 1 20 . 1 1 178 178 VAL H H 178 7.801 7.801 7.433 0.368 18321 26545 1 20 . 1 1 179 179 GLU N N 179 118.581 118.581 120.056 -1.475 18321 26546 1 20 . 1 1 179 179 GLU C C 179 175.225 175.225 175.580 -0.355 18321 26547 1 20 . 1 1 179 179 GLU CA C 179 53.114 53.114 55.659 -2.545 18321 26548 1 20 . 1 1 179 179 GLU CB C 179 32.712 32.712 30.671 2.041 18321 26549 1 20 . 1 1 179 179 GLU H H 179 8.819 8.819 8.345 0.474 18321 26550 1 20 . 1 1 180 180 LYS N N 180 124.167 124.167 122.034 2.133 18321 26551 1 20 . 1 1 180 180 LYS C C 180 176.303 176.303 177.066 -0.763 18321 26552 1 20 . 1 1 180 180 LYS CA C 180 57.318 57.318 57.142 0.176 18321 26553 1 20 . 1 1 180 180 LYS CB C 180 31.675 31.675 32.620 -0.945 18321 26554 1 20 . 1 1 180 180 LYS H H 180 8.775 8.775 7.943 0.832 18321 26555 1 20 . 1 1 181 181 LEU N N 181 125.157 125.157 127.302 -2.145 18321 26556 1 20 . 1 1 181 181 LEU C C 181 176.462 176.462 177.576 -1.114 18321 26557 1 20 . 1 1 181 181 LEU CA C 181 54.470 54.470 57.805 -3.335 18321 26558 1 20 . 1 1 181 181 LEU CB C 181 41.625 41.625 42.383 -0.758 18321 26559 1 20 . 1 1 181 181 LEU H H 181 8.084 8.084 8.226 -0.142 18321 26560 1 20 . 1 1 182 182 VAL N N 182 123.167 123.167 111.320 11.847 18321 26561 1 20 . 1 1 182 182 VAL C C 182 175.983 175.983 177.098 -1.115 18321 26562 1 20 . 1 1 182 182 VAL CA C 182 61.613 61.613 62.345 -0.732 18321 26563 1 20 . 1 1 182 182 VAL CB C 182 32.085 32.085 32.420 -0.336 18321 26564 1 20 . 1 1 182 182 VAL H H 182 8.345 8.345 8.000 0.345 18321 26565 1 20 . 1 1 183 183 ARG N N 183 125.775 125.775 120.428 5.347 18321 26566 1 20 . 1 1 183 183 ARG CA C 183 57.801 57.801 58.642 -0.841 18321 26567 1 20 . 1 1 183 183 ARG CB C 183 30.091 30.091 29.237 0.854 18321 26568 1 20 . 1 1 183 183 ARG H H 183 8.530 8.530 8.443 0.087 18321 26569 1 20 . 1 1 184 184 SER C C 184 173.239 173.239 173.624 -0.385 18321 26570 1 20 . 1 1 185 185 SER N N 185 116.511 116.511 112.627 3.884 18321 26571 1 20 . 1 1 185 185 SER CA C 185 58.428 58.428 56.557 1.871 18321 26572 1 20 . 1 1 185 185 SER CB C 185 69.737 69.737 63.589 6.148 18321 26573 1 20 . 1 1 185 185 SER H H 185 7.944 7.944 8.064 -0.120 18321 26574 1 20 . 1 1 190 190 HIS C C 190 176.953 176.953 175.128 1.825 18321 26575 1 20 . 1 1 190 190 HIS CA C 190 54.229 54.229 54.137 0.092 18321 26576 1 20 . 1 1 190 190 HIS CB C 190 35.112 35.112 27.253 7.859 18321 26577 1 20 . 1 1 191 191 GLY N N 191 109.491 109.491 113.582 -4.091 18321 26578 1 20 . 1 1 191 191 GLY C C 191 172.295 172.295 173.708 -1.413 18321 26579 1 20 . 1 1 191 191 GLY CA C 191 45.227 45.227 44.512 0.715 18321 26580 1 20 . 1 1 191 191 GLY H H 191 8.719 8.719 8.095 0.624 18321 26581 1 20 . 1 1 192 192 ASN N N 192 118.700 118.700 124.411 -5.711 18321 26582 1 20 . 1 1 192 192 ASN HA H 192 4.312 4.312 4.692 -0.380 18321 26583 1 20 . 1 1 192 192 ASN C C 192 176.369 176.369 175.750 0.619 18321 26584 1 20 . 1 1 192 192 ASN CA C 192 57.787 57.787 51.871 5.916 18321 26585 1 20 . 1 1 192 192 ASN H H 192 7.508 7.508 8.622 -1.114 18321 26586 1 20 . 1 1 193 193 ARG N N 193 120.743 120.743 124.282 -3.539 18321 26587 1 20 . 1 1 193 193 ARG H H 193 9.032 9.032 8.723 0.309 18321 26588 1 20 . 1 1 197 197 SER HA H 197 4.388 4.388 4.331 0.057 18321 26589 1 20 . 1 1 197 197 SER C C 197 174.133 174.133 175.073 -0.940 18321 26590 1 20 . 1 1 197 197 SER CA C 197 58.128 58.128 59.818 -1.690 18321 26591 1 20 . 1 1 197 197 SER CB C 197 62.966 62.966 63.515 -0.549 18321 26592 1 20 . 1 1 198 198 TYR N N 198 121.435 121.435 120.433 1.002 18321 26593 1 20 . 1 1 198 198 TYR HA H 198 4.543 4.543 4.411 0.132 18321 26594 1 20 . 1 1 198 198 TYR C C 198 176.230 176.230 176.113 0.117 18321 26595 1 20 . 1 1 198 198 TYR CA C 198 57.536 57.536 58.698 -1.162 18321 26596 1 20 . 1 1 198 198 TYR CB C 198 38.279 38.279 39.323 -1.044 18321 26597 1 20 . 1 1 198 198 TYR H H 198 8.071 8.071 8.261 -0.190 18321 26598 1 20 . 1 1 199 199 GLY N N 199 110.039 110.039 106.088 3.951 18321 26599 1 20 . 1 1 199 199 GLY C C 199 173.475 173.475 173.811 -0.336 18321 26600 1 20 . 1 1 199 199 GLY CA C 199 44.805 44.805 44.733 0.072 18321 26601 1 20 . 1 1 199 199 GLY H H 199 8.162 8.162 8.685 -0.523 18321 26602 1 20 . 1 1 200 200 ILE N N 200 121.530 121.530 121.121 0.409 18321 26603 1 20 . 1 1 200 200 ILE CA C 200 58.102 58.102 59.881 -1.779 18321 26604 1 20 . 1 1 200 200 ILE CB C 200 37.760 37.760 37.141 0.619 18321 26605 1 20 . 1 1 200 200 ILE H H 200 7.851 7.851 8.191 -0.340 18321 26606 1 20 . 1 1 201 201 PRO C C 201 176.485 176.485 177.855 -1.370 18321 26607 1 20 . 1 1 201 201 PRO CA C 201 53.893 53.893 62.168 -8.275 18321 26608 1 20 . 1 1 201 201 PRO CB C 201 29.042 29.042 32.646 -3.604 18321 26609 1 20 . 1 1 202 202 GLU N N 202 122.468 122.468 122.503 -0.035 18321 26610 1 20 . 1 1 202 202 GLU CA C 202 62.490 62.490 59.707 2.783 18321 26611 1 20 . 1 1 202 202 GLU CB C 202 31.170 31.170 27.789 3.381 18321 26612 1 20 . 1 1 202 202 GLU H H 202 8.328 8.328 8.861 -0.533 18321 26613 1 20 . 1 1 203 203 PRO CA C 203 62.803 62.803 62.476 0.327 18321 26614 1 20 . 1 1 203 203 PRO CB C 203 31.220 31.220 30.638 0.582 18321 26615 1 20 . 1 1 204 204 ALA N N 204 123.251 123.251 123.340 -0.089 18321 26616 1 20 . 1 1 204 204 ALA HA H 204 4.180 4.180 4.091 0.089 18321 26617 1 20 . 1 1 204 204 ALA CA C 204 52.124 52.124 53.572 -1.448 18321 26618 1 20 . 1 1 204 204 ALA CB C 204 18.892 18.892 19.295 -0.403 18321 26619 1 20 . 1 1 204 204 ALA H H 204 8.308 8.308 7.636 0.672 18321 26620 1 20 . 1 1 205 205 HIS N N 205 117.874 117.874 117.893 -0.019 18321 26621 1 20 . 1 1 205 205 HIS C C 205 173.282 173.282 173.637 -0.355 18321 26622 1 20 . 1 1 205 205 HIS H H 205 8.045 8.045 8.155 -0.110 18321 26623 1 20 . 1 1 206 206 ALA N N 206 125.519 125.519 128.249 -2.730 18321 26624 1 20 . 1 1 206 206 ALA HA H 206 4.204 4.204 4.652 -0.448 18321 26625 1 20 . 1 1 206 206 ALA CA C 206 40.196 40.196 51.483 -11.287 18321 26626 1 20 . 1 1 206 206 ALA CB C 206 19.407 19.407 19.695 -0.288 18321 26627 1 20 . 1 1 206 206 ALA H H 206 8.061 8.061 8.494 -0.433 18321 26628 1 20 . 1 1 207 207 TYR N N 207 120.381 120.381 122.770 -2.389 18321 26629 1 20 . 1 1 207 207 TYR HA H 207 4.570 4.570 4.297 0.273 18321 26630 1 20 . 1 1 207 207 TYR CA C 207 52.572 52.572 58.477 -5.904 18321 26631 1 20 . 1 1 207 207 TYR CB C 207 41.333 41.333 38.902 2.431 18321 26632 1 20 . 1 1 207 207 TYR H H 207 8.199 8.199 8.688 -0.489 18321 26633 1 20 . 1 1 208 208 ALA HA H 208 4.281 4.281 4.413 -0.132 18321 26634 1 20 . 1 1 208 208 ALA C C 208 177.736 177.736 177.080 0.656 18321 26635 1 20 . 1 1 208 208 ALA CA C 208 52.084 52.084 51.904 0.180 18321 26636 1 20 . 1 1 208 208 ALA CB C 208 18.999 18.999 19.480 -0.481 18321 26637 1 20 . 1 1 209 209 GLN N N 209 119.295 119.295 121.974 -2.679 18321 26638 1 20 . 1 1 209 209 GLN CA C 209 61.474 61.474 54.533 6.941 18321 26639 1 20 . 1 1 209 209 GLN CB C 209 32.039 32.039 28.835 3.204 18321 26640 1 20 . 1 1 209 209 GLN H H 209 8.125 8.125 8.586 -0.462 18321 26641 1 20 . 1 1 210 210 PRO HA H 210 4.395 4.395 4.516 -0.121 18321 26642 1 20 . 1 1 210 210 PRO CA C 210 62.584 62.584 62.784 -0.200 18321 26643 1 20 . 1 1 211 211 GLN HA H 211 4.377 4.377 4.617 -0.240 18321 26644 1 20 . 1 1 211 211 GLN CA C 211 55.859 55.859 55.210 0.649 18321 26645 1 20 . 1 1 211 211 GLN CB C 211 29.577 29.577 30.652 -1.075 18321 26646 1 20 . 1 1 212 212 THR C C 212 176.551 176.551 173.566 2.985 18321 26647 1 20 . 1 1 212 212 THR CB C 212 69.890 69.890 69.840 0.050 18321 26648 1 20 . 1 1 213 213 THR N N 213 108.487 108.487 123.090 -14.603 18321 26649 1 20 . 1 1 213 213 THR CA C 213 61.236 61.236 62.717 -1.481 18321 26650 1 20 . 1 1 213 213 THR CB C 213 69.091 69.091 68.923 0.168 18321 26651 1 20 . 1 1 213 213 THR H H 213 8.243 8.243 8.541 -0.298 18321 26652 1 20 . 1 1 214 214 THR N N 214 119.445 119.445 119.711 -0.266 18321 26653 1 20 . 1 1 214 214 THR CA C 214 59.425 59.425 62.913 -3.488 18321 26654 1 20 . 1 1 214 214 THR CB C 214 69.251 69.251 67.613 1.638 18321 26655 1 20 . 1 1 214 214 THR H H 214 8.188 8.188 8.156 0.032 18321 26656 1 20 . 1 1 215 215 PRO HA H 215 4.361 4.361 4.408 -0.047 18321 26657 1 20 . 1 1 215 215 PRO C C 215 175.422 175.422 175.935 -0.513 18321 26658 1 20 . 1 1 215 215 PRO CA C 215 63.320 63.320 63.441 -0.121 18321 26659 1 20 . 1 1 215 215 PRO CB C 215 31.918 31.918 31.180 0.738 18321 26660 1 20 . 1 1 216 216 LEU N N 216 121.602 121.602 125.331 -3.729 18321 26661 1 20 . 1 1 216 216 LEU CA C 216 52.203 52.203 56.456 -4.253 18321 26662 1 20 . 1 1 216 216 LEU CB C 216 42.451 42.451 40.005 2.446 18321 26663 1 20 . 1 1 216 216 LEU H H 216 7.891 7.891 8.279 -0.388 18321 26664 1 20 . 1 1 217 217 PRO HA H 217 4.398 4.398 4.340 0.058 18321 26665 1 20 . 1 1 217 217 PRO C C 217 176.577 176.577 176.498 0.079 18321 26666 1 20 . 1 1 217 217 PRO CA C 217 62.984 62.984 63.170 -0.186 18321 26667 1 20 . 1 1 217 217 PRO CB C 217 32.056 32.056 31.468 0.588 18321 26668 1 20 . 1 1 218 218 ALA N N 218 124.087 124.087 120.666 3.421 18321 26669 1 20 . 1 1 218 218 ALA HA H 218 4.309 4.309 4.127 0.182 18321 26670 1 20 . 1 1 218 218 ALA C C 218 177.844 177.844 177.511 0.333 18321 26671 1 20 . 1 1 218 218 ALA CA C 218 52.379 52.379 52.872 -0.493 18321 26672 1 20 . 1 1 218 218 ALA CB C 218 19.133 19.133 18.426 0.707 18321 26673 1 20 . 1 1 218 218 ALA H H 218 8.261 8.261 7.909 0.352 18321 26674 1 20 . 1 1 219 219 VAL N N 219 118.942 118.942 113.733 5.209 18321 26675 1 20 . 1 1 219 219 VAL HA H 219 4.142 4.142 4.286 -0.144 18321 26676 1 20 . 1 1 219 219 VAL CA C 219 62.102 62.102 63.026 -0.924 18321 26677 1 20 . 1 1 219 219 VAL CB C 219 32.923 32.923 32.557 0.366 18321 26678 1 20 . 1 1 219 219 VAL H H 219 8.049 8.049 8.212 -0.163 18321 26679 1 20 . 1 1 220 220 SER N N 220 119.207 119.207 119.174 0.033 18321 26680 1 20 . 1 1 220 220 SER HA H 220 4.436 4.436 4.544 -0.108 18321 26681 1 20 . 1 1 220 220 SER CA C 220 57.813 57.813 59.381 -1.568 18321 26682 1 20 . 1 1 220 220 SER CB C 220 63.375 63.375 63.039 0.336 18321 26683 1 20 . 1 1 220 220 SER H H 220 8.275 8.275 7.924 0.351 18321 26684 1 20 . 1 1 221 221 GLY N N 221 110.973 110.973 113.440 -2.467 18321 26685 1 20 . 1 1 221 221 GLY C C 221 173.962 173.962 173.319 0.643 18321 26686 1 20 . 1 1 221 221 GLY CA C 221 45.286 45.286 45.242 0.044 18321 26687 1 20 . 1 1 221 221 GLY H H 221 8.374 8.374 8.272 0.102 18321 26688 1 20 . 1 1 222 222 SER N N 222 115.516 115.516 118.687 -3.171 18321 26689 1 20 . 1 1 222 222 SER HA H 222 4.763 4.763 4.746 0.017 18321 26690 1 20 . 1 1 222 222 SER CA C 222 56.407 56.407 56.513 -0.106 18321 26691 1 20 . 1 1 222 222 SER CB C 222 63.993 63.993 64.158 -0.165 18321 26692 1 20 . 1 1 222 222 SER H H 222 8.155 8.155 8.282 -0.127 18321 26693 1 20 . 1 1 223 223 PRO HA H 223 4.417 4.417 4.585 -0.168 18321 26694 1 20 . 1 1 223 223 PRO CA C 223 63.805 63.805 62.536 1.269 18321 26695 1 20 . 1 1 223 223 PRO CB C 223 32.090 32.090 32.430 -0.340 18321 26696 1 20 . 1 1 224 224 GLY N N 224 109.149 109.149 109.974 -0.825 18321 26697 1 20 . 1 1 224 224 GLY C C 224 173.813 173.813 174.067 -0.254 18321 26698 1 20 . 1 1 224 224 GLY CA C 224 44.512 44.512 44.600 -0.088 18321 26699 1 20 . 1 1 224 224 GLY H H 224 8.376 8.376 8.446 -0.070 18321 26700 1 20 . 1 1 225 225 ALA N N 225 123.599 123.599 128.050 -4.451 18321 26701 1 20 . 1 1 225 225 ALA C C 225 177.341 177.341 177.013 0.328 18321 26702 1 20 . 1 1 225 225 ALA CA C 225 51.878 51.878 51.077 0.801 18321 26703 1 20 . 1 1 225 225 ALA CB C 225 19.169 19.169 18.893 0.276 18321 26704 1 20 . 1 1 225 225 ALA H H 225 7.959 7.959 8.644 -0.685 18321 26705 1 20 . 1 1 226 226 ALA N N 226 123.218 123.218 127.905 -4.687 18321 26706 1 20 . 1 1 226 226 ALA HA H 226 4.350 4.350 4.369 -0.019 18321 26707 1 20 . 1 1 226 226 ALA C C 226 177.520 177.520 176.618 0.902 18321 26708 1 20 . 1 1 226 226 ALA CA C 226 52.535 52.535 52.173 0.362 18321 26709 1 20 . 1 1 226 226 ALA CB C 226 19.171 19.171 17.327 1.844 18321 26710 1 20 . 1 1 226 226 ALA H H 226 8.169 8.169 8.612 -0.443 18321 26711 1 20 . 1 1 227 227 ILE N N 227 120.086 120.086 117.545 2.541 18321 26712 1 20 . 1 1 227 227 ILE HA H 227 4.201 4.201 4.344 -0.143 18321 26713 1 20 . 1 1 227 227 ILE C C 227 174.814 174.814 176.764 -1.950 18321 26714 1 20 . 1 1 227 227 ILE CA C 227 60.929 60.929 61.777 -0.848 18321 26715 1 20 . 1 1 227 227 ILE CB C 227 38.872 38.872 38.968 -0.096 18321 26716 1 20 . 1 1 227 227 ILE H H 227 8.037 8.037 8.035 0.002 18321 26717 1 20 . 1 1 228 228 THR N N 228 117.224 117.224 114.767 2.457 18321 26718 1 20 . 1 1 228 228 THR HA H 228 4.203 4.203 4.578 -0.375 18321 26719 1 20 . 1 1 228 228 THR CA C 228 57.108 57.108 63.372 -6.264 18321 26720 1 20 . 1 1 228 228 THR CB C 228 69.945 69.945 68.661 1.284 18321 26721 1 20 . 1 1 228 228 THR H H 228 7.775 7.775 8.359 -0.584 18321 26722 1 20 . 1 1 229 229 PRO HA H 229 4.750 4.750 4.454 0.296 18321 26723 1 20 . 1 1 229 229 PRO CA C 229 62.480 62.480 63.643 -1.163 18321 26724 1 20 . 1 1 229 229 PRO CB C 229 33.995 33.995 31.838 2.157 18321 26725 1 20 . 1 1 230 230 LEU N N 230 123.629 123.629 122.355 1.274 18321 26726 1 20 . 1 1 230 230 LEU CA C 230 53.076 53.076 51.725 1.351 18321 26727 1 20 . 1 1 230 230 LEU CB C 230 40.608 40.608 42.934 -2.326 18321 26728 1 20 . 1 1 230 230 LEU H H 230 8.453 8.453 7.405 1.048 18321 26729 1 20 . 1 1 231 231 PRO HA H 231 4.412 4.412 4.776 -0.364 18321 26730 1 20 . 1 1 231 231 PRO C C 231 176.571 176.571 177.154 -0.583 18321 26731 1 20 . 1 1 231 231 PRO CA C 231 63.225 63.225 62.745 0.480 18321 26732 1 20 . 1 1 231 231 PRO CB C 231 31.191 31.191 31.790 -0.599 18321 26733 1 20 . 1 1 232 232 SER N N 232 115.169 115.169 120.648 -5.479 18321 26734 1 20 . 1 1 232 232 SER HA H 232 4.450 4.450 3.996 0.454 18321 26735 1 20 . 1 1 232 232 SER CA C 232 58.604 58.604 60.323 -1.719 18321 26736 1 20 . 1 1 232 232 SER CB C 232 63.962 63.962 62.487 1.474 18321 26737 1 20 . 1 1 232 232 SER H H 232 8.280 8.280 8.815 -0.535 18321 26738 1 20 . 1 1 233 233 THR N N 233 115.155 115.155 113.239 1.916 18321 26739 1 20 . 1 1 233 233 THR HA H 233 4.351 4.351 3.910 0.441 18321 26740 1 20 . 1 1 233 233 THR C C 233 177.237 177.237 173.602 3.635 18321 26741 1 20 . 1 1 233 233 THR CA C 233 61.939 61.939 63.319 -1.380 18321 26742 1 20 . 1 1 233 233 THR CB C 233 68.986 68.986 67.989 0.997 18321 26743 1 20 . 1 1 233 233 THR H H 233 8.096 8.096 8.089 0.007 18321 26744 1 20 . 1 1 234 234 GLN N N 234 122.040 122.040 121.327 0.713 18321 26745 1 20 . 1 1 234 234 GLN HA H 234 4.681 4.681 4.612 0.069 18321 26746 1 20 . 1 1 234 234 GLN C C 234 176.177 176.177 175.635 0.542 18321 26747 1 20 . 1 1 234 234 GLN CA C 234 55.861 55.861 56.007 -0.146 18321 26748 1 20 . 1 1 234 234 GLN CB C 234 28.583 28.583 28.319 0.264 18321 26749 1 20 . 1 1 234 234 GLN H H 234 8.256 8.256 8.512 -0.256 18321 26750 1 20 . 1 1 235 235 ASN N N 235 119.506 119.506 120.909 -1.403 18321 26751 1 20 . 1 1 235 235 ASN HA H 235 4.775 4.775 4.792 -0.017 18321 26752 1 20 . 1 1 235 235 ASN C C 235 174.974 174.974 175.107 -0.133 18321 26753 1 20 . 1 1 235 235 ASN CA C 235 53.191 53.191 52.906 0.285 18321 26754 1 20 . 1 1 235 235 ASN CB C 235 38.511 38.511 39.069 -0.558 18321 26755 1 20 . 1 1 235 235 ASN H H 235 8.346 8.346 8.450 -0.104 18321 26756 1 20 . 1 1 236 236 GLY N N 236 109.378 109.378 109.163 0.215 18321 26757 1 20 . 1 1 236 236 GLY CA C 236 44.023 44.023 45.118 -1.095 18321 26758 1 20 . 1 1 236 236 GLY H H 236 7.939 7.939 7.725 0.214 18321 26759 1 20 . 1 1 237 237 PRO HA H 237 4.336 4.336 4.434 -0.098 18321 26760 1 20 . 1 1 237 237 PRO C C 237 175.942 175.942 175.847 0.095 18321 26761 1 20 . 1 1 237 237 PRO CA C 237 62.797 62.797 62.346 0.451 18321 26762 1 20 . 1 1 237 237 PRO CB C 237 27.421 27.421 32.311 -4.890 18321 26763 1 20 . 1 1 238 238 VAL N N 238 120.535 120.535 123.644 -3.109 18321 26764 1 20 . 1 1 238 238 VAL HA H 238 4.195 4.195 4.130 0.065 18321 26765 1 20 . 1 1 238 238 VAL C C 238 173.775 173.775 174.888 -1.113 18321 26766 1 20 . 1 1 238 238 VAL CA C 238 61.173 61.173 61.948 -0.775 18321 26767 1 20 . 1 1 238 238 VAL CB C 238 38.328 38.328 33.020 5.308 18321 26768 1 20 . 1 1 238 238 VAL H H 238 7.986 7.986 7.844 0.142 18321 26769 1 20 . 1 1 239 239 PHE N N 239 123.522 123.522 124.668 -1.146 18321 26770 1 20 . 1 1 239 239 PHE HA H 239 5.539 5.539 5.389 0.150 18321 26771 1 20 . 1 1 239 239 PHE C C 239 174.207 174.207 174.909 -0.702 18321 26772 1 20 . 1 1 239 239 PHE CA C 239 56.993 56.993 56.568 0.425 18321 26773 1 20 . 1 1 239 239 PHE CB C 239 41.743 41.743 41.017 0.726 18321 26774 1 20 . 1 1 239 239 PHE H H 239 8.927 8.927 8.886 0.041 18321 26775 1 20 . 1 1 240 240 ALA N N 240 120.871 120.871 126.598 -5.727 18321 26776 1 20 . 1 1 240 240 ALA HA H 240 5.352 5.352 5.652 -0.300 18321 26777 1 20 . 1 1 240 240 ALA C C 240 174.639 174.639 175.879 -1.240 18321 26778 1 20 . 1 1 240 240 ALA CA C 240 49.736 49.736 50.154 -0.418 18321 26779 1 20 . 1 1 240 240 ALA CB C 240 23.480 23.480 22.011 1.469 18321 26780 1 20 . 1 1 240 240 ALA H H 240 9.398 9.398 9.215 0.183 18321 26781 1 20 . 1 1 241 241 LYS N N 241 121.227 121.227 126.123 -4.896 18321 26782 1 20 . 1 1 241 241 LYS HA H 241 5.373 5.373 4.797 0.576 18321 26783 1 20 . 1 1 241 241 LYS C C 241 176.772 176.772 176.016 0.756 18321 26784 1 20 . 1 1 241 241 LYS CA C 241 53.128 53.128 55.119 -1.991 18321 26785 1 20 . 1 1 241 241 LYS CB C 241 34.850 34.850 33.939 0.911 18321 26786 1 20 . 1 1 241 241 LYS H H 241 8.947 8.947 8.802 0.145 18321 26787 1 20 . 1 1 242 242 ALA N N 242 126.833 126.833 130.355 -3.522 18321 26788 1 20 . 1 1 242 242 ALA HA H 242 4.764 4.764 4.427 0.337 18321 26789 1 20 . 1 1 242 242 ALA C C 242 178.506 178.506 176.921 1.585 18321 26790 1 20 . 1 1 242 242 ALA CA C 242 52.788 52.788 52.302 0.486 18321 26791 1 20 . 1 1 242 242 ALA CB C 242 19.084 19.084 18.903 0.181 18321 26792 1 20 . 1 1 242 242 ALA H H 242 9.373 9.373 8.860 0.513 18321 26793 1 20 . 1 1 243 243 ILE N N 243 118.731 118.731 119.866 -1.135 18321 26794 1 20 . 1 1 243 243 ILE HA H 243 4.454 4.454 4.380 0.074 18321 26795 1 20 . 1 1 243 243 ILE C C 243 174.773 174.773 175.994 -1.221 18321 26796 1 20 . 1 1 243 243 ILE CA C 243 60.613 60.613 61.422 -0.809 18321 26797 1 20 . 1 1 243 243 ILE CB C 243 39.232 39.232 39.131 0.101 18321 26798 1 20 . 1 1 243 243 ILE H H 243 8.933 8.933 8.207 0.726 18321 26799 1 20 . 1 1 244 244 GLN N N 244 121.616 121.616 119.761 1.855 18321 26800 1 20 . 1 1 244 244 GLN HA H 244 4.283 4.283 4.545 -0.262 18321 26801 1 20 . 1 1 244 244 GLN C C 244 172.815 172.815 174.467 -1.652 18321 26802 1 20 . 1 1 244 244 GLN CA C 244 54.750 54.750 54.455 0.295 18321 26803 1 20 . 1 1 244 244 GLN CB C 244 31.469 31.469 32.685 -1.216 18321 26804 1 20 . 1 1 244 244 GLN H H 244 7.438 7.438 7.977 -0.539 18321 26805 1 20 . 1 1 245 245 LYS N N 245 124.215 124.215 123.170 1.045 18321 26806 1 20 . 1 1 245 245 LYS HA H 245 3.962 3.962 4.319 -0.357 18321 26807 1 20 . 1 1 245 245 LYS C C 245 175.679 175.679 176.289 -0.610 18321 26808 1 20 . 1 1 245 245 LYS CA C 245 56.413 56.413 57.121 -0.708 18321 26809 1 20 . 1 1 245 245 LYS CB C 245 32.847 32.847 33.237 -0.390 18321 26810 1 20 . 1 1 245 245 LYS H H 245 8.318 8.318 8.448 -0.130 18321 26811 1 20 . 1 1 246 246 ARG N N 246 127.327 127.327 121.284 6.043 18321 26812 1 20 . 1 1 246 246 ARG HA H 246 4.221 4.221 4.765 -0.544 18321 26813 1 20 . 1 1 246 246 ARG CA C 246 56.279 56.279 54.913 1.366 18321 26814 1 20 . 1 1 246 246 ARG CB C 246 32.987 32.987 32.920 0.067 18321 26815 1 20 . 1 1 246 246 ARG H H 246 9.248 9.248 8.797 0.451 18321 26816 1 20 . 1 1 249 249 CYS HA H 249 4.260 4.260 4.289 -0.029 18321 26817 1 20 . 1 1 249 249 CYS CA C 249 55.886 55.886 56.845 -0.959 18321 26818 1 20 . 1 1 249 249 CYS CB C 249 34.146 34.146 29.906 4.240 18321 26819 1 20 . 1 1 250 250 ALA HA H 250 3.926 3.926 4.102 -0.176 18321 26820 1 20 . 1 1 250 250 ALA CA C 250 54.344 54.344 54.801 -0.457 18321 26821 1 20 . 1 1 250 250 ALA CB C 250 18.342 18.342 18.805 -0.463 18321 26822 1 20 . 1 1 251 251 TYR N N 251 110.618 110.618 112.192 -1.574 18321 26823 1 20 . 1 1 251 251 TYR HA H 251 4.489 4.489 4.632 -0.143 18321 26824 1 20 . 1 1 251 251 TYR C C 251 175.286 175.286 175.286 0.000 18321 26825 1 20 . 1 1 251 251 TYR CA C 251 56.137 56.137 57.320 -1.183 18321 26826 1 20 . 1 1 251 251 TYR CB C 251 37.203 37.203 38.369 -1.166 18321 26827 1 20 . 1 1 251 251 TYR H H 251 7.037 7.037 7.729 -0.692 18321 26828 1 20 . 1 1 252 252 ASP N N 252 121.835 121.835 121.021 0.814 18321 26829 1 20 . 1 1 252 252 ASP HA H 252 4.763 4.763 4.859 -0.096 18321 26830 1 20 . 1 1 252 252 ASP CA C 252 52.351 52.351 53.614 -1.263 18321 26831 1 20 . 1 1 252 252 ASP CB C 252 39.995 39.995 39.490 0.505 18321 26832 1 20 . 1 1 252 252 ASP H H 252 7.339 7.339 7.920 -0.581 18321 26833 1 20 . 1 1 253 253 LYS N N 253 123.177 123.177 118.654 4.523 18321 26834 1 20 . 1 1 253 253 LYS HA H 253 4.270 4.270 4.153 0.117 18321 26835 1 20 . 1 1 253 253 LYS C C 253 177.724 177.724 177.076 0.648 18321 26836 1 20 . 1 1 253 253 LYS CA C 253 57.036 57.036 58.185 -1.149 18321 26837 1 20 . 1 1 253 253 LYS H H 253 8.396 8.396 8.042 0.354 18321 26838 1 20 . 1 1 254 254 THR N N 254 108.317 108.317 109.181 -0.864 18321 26839 1 20 . 1 1 254 254 THR HA H 254 4.517 4.517 4.376 0.141 18321 26840 1 20 . 1 1 254 254 THR C C 254 174.012 174.012 173.877 0.135 18321 26841 1 20 . 1 1 254 254 THR CA C 254 61.036 61.036 61.769 -0.733 18321 26842 1 20 . 1 1 254 254 THR CB C 254 69.307 69.307 69.128 0.179 18321 26843 1 20 . 1 1 254 254 THR H H 254 8.217 8.217 7.950 0.267 18321 26844 1 20 . 1 1 255 255 ALA N N 255 124.762 124.762 125.124 -0.362 18321 26845 1 20 . 1 1 255 255 ALA HA H 255 4.524 4.524 4.816 -0.292 18321 26846 1 20 . 1 1 255 255 ALA C C 255 176.630 176.630 176.380 0.250 18321 26847 1 20 . 1 1 255 255 ALA CA C 255 51.352 51.352 51.347 0.005 18321 26848 1 20 . 1 1 255 255 ALA CB C 255 20.135 20.135 19.545 0.590 18321 26849 1 20 . 1 1 255 255 ALA H H 255 7.096 7.096 7.496 -0.400 18321 26850 1 20 . 1 1 256 256 LEU N N 256 124.379 124.379 124.503 -0.124 18321 26851 1 20 . 1 1 256 256 LEU HA H 256 4.328 4.328 4.334 -0.006 18321 26852 1 20 . 1 1 256 256 LEU C C 256 176.007 176.007 176.146 -0.139 18321 26853 1 20 . 1 1 256 256 LEU CA C 256 53.502 53.502 54.607 -1.105 18321 26854 1 20 . 1 1 256 256 LEU CB C 256 44.665 44.665 43.691 0.974 18321 26855 1 20 . 1 1 256 256 LEU H H 256 8.889 8.889 8.495 0.394 18321 26856 1 20 . 1 1 257 257 ALA N N 257 129.619 129.619 127.197 2.422 18321 26857 1 20 . 1 1 257 257 ALA HA H 257 4.445 4.445 4.851 -0.406 18321 26858 1 20 . 1 1 257 257 ALA C C 257 176.813 176.813 176.494 0.319 18321 26859 1 20 . 1 1 257 257 ALA CA C 257 51.179 51.179 51.094 0.085 18321 26860 1 20 . 1 1 257 257 ALA CB C 257 18.973 18.973 19.221 -0.248 18321 26861 1 20 . 1 1 257 257 ALA H H 257 8.529 8.529 8.179 0.350 18321 26862 1 20 . 1 1 258 258 LEU N N 258 119.300 119.300 123.943 -4.643 18321 26863 1 20 . 1 1 258 258 LEU HA H 258 4.782 4.782 4.709 0.073 18321 26864 1 20 . 1 1 258 258 LEU CA C 258 53.259 53.259 53.866 -0.607 18321 26865 1 20 . 1 1 258 258 LEU CB C 258 45.972 45.972 46.141 -0.169 18321 26866 1 20 . 1 1 258 258 LEU H H 258 8.505 8.505 8.252 0.253 18321 26867 1 20 . 1 1 259 259 GLU N N 259 123.919 123.919 120.607 3.312 18321 26868 1 20 . 1 1 259 259 GLU HA H 259 4.516 4.516 4.602 -0.086 18321 26869 1 20 . 1 1 259 259 GLU C C 259 175.795 175.795 175.000 0.795 18321 26870 1 20 . 1 1 259 259 GLU CA C 259 52.896 52.896 54.438 -1.542 18321 26871 1 20 . 1 1 259 259 GLU H H 259 8.943 8.943 8.569 0.374 18321 26872 1 20 . 1 1 260 260 VAL N N 260 122.122 122.122 121.695 0.427 18321 26873 1 20 . 1 1 260 260 VAL HA H 260 2.923 2.923 4.251 -1.328 18321 26874 1 20 . 1 1 260 260 VAL C C 260 177.964 177.964 177.035 0.929 18321 26875 1 20 . 1 1 260 260 VAL CA C 260 65.417 65.417 63.510 1.907 18321 26876 1 20 . 1 1 260 260 VAL CB C 260 30.668 30.668 29.883 0.785 18321 26877 1 20 . 1 1 260 260 VAL H H 260 8.956 8.956 8.496 0.460 18321 26878 1 20 . 1 1 261 261 GLY N N 261 116.009 116.009 117.696 -1.687 18321 26879 1 20 . 1 1 261 261 GLY C C 261 176.288 176.288 173.293 2.995 18321 26880 1 20 . 1 1 261 261 GLY CA C 261 44.210 44.210 44.779 -0.569 18321 26881 1 20 . 1 1 261 261 GLY H H 261 8.799 8.799 8.893 -0.094 18321 26882 1 20 . 1 1 262 262 ASP N N 262 121.945 121.945 120.028 1.917 18321 26883 1 20 . 1 1 262 262 ASP HA H 262 4.423 4.423 5.002 -0.579 18321 26884 1 20 . 1 1 262 262 ASP C C 262 175.381 175.381 174.930 0.451 18321 26885 1 20 . 1 1 262 262 ASP CA C 262 55.243 55.243 51.995 3.248 18321 26886 1 20 . 1 1 262 262 ASP CB C 262 41.819 41.819 43.594 -1.776 18321 26887 1 20 . 1 1 262 262 ASP H H 262 8.180 8.180 7.657 0.523 18321 26888 1 20 . 1 1 263 263 ILE N N 263 121.452 121.452 122.287 -0.835 18321 26889 1 20 . 1 1 263 263 ILE HA H 263 4.707 4.707 4.360 0.347 18321 26890 1 20 . 1 1 263 263 ILE C C 263 174.996 174.996 175.929 -0.933 18321 26891 1 20 . 1 1 263 263 ILE CA C 263 59.289 59.289 59.594 -0.305 18321 26892 1 20 . 1 1 263 263 ILE CB C 263 36.987 36.987 38.103 -1.117 18321 26893 1 20 . 1 1 263 263 ILE H H 263 8.460 8.460 8.534 -0.074 18321 26894 1 20 . 1 1 264 264 VAL N N 264 128.756 128.756 129.161 -0.405 18321 26895 1 20 . 1 1 264 264 VAL HA H 264 4.309 4.309 4.056 0.253 18321 26896 1 20 . 1 1 264 264 VAL C C 264 175.486 175.486 174.482 1.004 18321 26897 1 20 . 1 1 264 264 VAL CA C 264 59.091 59.091 61.572 -2.481 18321 26898 1 20 . 1 1 264 264 VAL CB C 264 34.541 34.541 31.800 2.740 18321 26899 1 20 . 1 1 264 264 VAL H H 264 9.479 9.479 9.244 0.235 18321 26900 1 20 . 1 1 265 265 LYS N N 265 128.101 128.101 129.983 -1.882 18321 26901 1 20 . 1 1 265 265 LYS HA H 265 4.342 4.342 4.393 -0.051 18321 26902 1 20 . 1 1 265 265 LYS C C 265 175.531 175.531 174.700 0.831 18321 26903 1 20 . 1 1 265 265 LYS CA C 265 55.620 55.620 55.305 0.315 18321 26904 1 20 . 1 1 265 265 LYS CB C 265 33.149 33.149 33.082 0.067 18321 26905 1 20 . 1 1 265 265 LYS H H 265 8.715 8.715 8.497 0.218 18321 26906 1 20 . 1 1 266 266 VAL N N 266 129.537 129.537 128.617 0.920 18321 26907 1 20 . 1 1 266 266 VAL HA H 266 4.333 4.333 4.488 -0.155 18321 26908 1 20 . 1 1 266 266 VAL C C 266 176.166 176.166 175.530 0.636 18321 26909 1 20 . 1 1 266 266 VAL CA C 266 63.339 63.339 61.021 2.318 18321 26910 1 20 . 1 1 266 266 VAL CB C 266 30.712 30.712 34.881 -4.169 18321 26911 1 20 . 1 1 266 266 VAL H H 266 9.073 9.073 8.453 0.620 18321 26912 1 20 . 1 1 267 267 THR N N 267 120.020 120.020 121.860 -1.840 18321 26913 1 20 . 1 1 267 267 THR HA H 267 4.189 4.189 4.312 -0.123 18321 26914 1 20 . 1 1 267 267 THR C C 267 176.054 176.054 174.264 1.790 18321 26915 1 20 . 1 1 267 267 THR CA C 267 62.204 62.204 64.237 -2.033 18321 26916 1 20 . 1 1 267 267 THR CB C 267 68.200 68.200 69.641 -1.441 18321 26917 1 20 . 1 1 267 267 THR H H 267 9.130 9.130 8.617 0.513 18321 26918 1 20 . 1 1 268 268 ARG N N 268 120.839 120.839 119.854 0.985 18321 26919 1 20 . 1 1 268 268 ARG HA H 268 4.236 4.236 4.716 -0.480 18321 26920 1 20 . 1 1 268 268 ARG CA C 268 56.321 56.321 54.505 1.816 18321 26921 1 20 . 1 1 268 268 ARG CB C 268 33.049 33.049 32.632 0.417 18321 26922 1 20 . 1 1 268 268 ARG H H 268 7.631 7.631 7.405 0.226 18321 26923 1 20 . 1 1 269 269 MET N N 269 125.443 125.443 122.190 3.253 18321 26924 1 20 . 1 1 269 269 MET C C 269 174.392 174.392 175.345 -0.953 18321 26925 1 20 . 1 1 269 269 MET H H 269 8.532 8.532 8.445 0.087 18321 26926 1 20 . 1 1 270 270 ASN N N 270 119.125 119.125 122.965 -3.840 18321 26927 1 20 . 1 1 270 270 ASN HA H 270 4.546 4.546 4.914 -0.368 18321 26928 1 20 . 1 1 270 270 ASN C C 270 172.133 172.133 176.611 -4.478 18321 26929 1 20 . 1 1 270 270 ASN CA C 270 53.639 53.639 52.659 0.980 18321 26930 1 20 . 1 1 270 270 ASN CB C 270 39.845 39.845 39.308 0.537 18321 26931 1 20 . 1 1 270 270 ASN H H 270 6.631 6.631 8.791 -2.160 18321 26932 1 20 . 1 1 271 271 ILE N N 271 122.532 122.532 121.993 0.539 18321 26933 1 20 . 1 1 271 271 ILE HA H 271 4.417 4.417 3.932 0.485 18321 26934 1 20 . 1 1 271 271 ILE CA C 271 63.348 63.348 63.267 0.081 18321 26935 1 20 . 1 1 271 271 ILE CB C 271 38.198 38.198 37.451 0.747 18321 26936 1 20 . 1 1 271 271 ILE H H 271 8.565 8.565 8.722 -0.157 18321 26937 1 20 . 1 1 272 272 ASN HA H 272 4.527 4.527 4.591 -0.064 18321 26938 1 20 . 1 1 272 272 ASN C C 272 176.259 176.259 176.361 -0.102 18321 26939 1 20 . 1 1 272 272 ASN CA C 272 53.225 53.225 53.708 -0.483 18321 26940 1 20 . 1 1 272 272 ASN CB C 272 37.565 37.565 38.574 -1.008 18321 26941 1 20 . 1 1 273 273 GLY N N 273 107.043 107.043 109.263 -2.220 18321 26942 1 20 . 1 1 273 273 GLY C C 273 173.216 173.216 172.494 0.722 18321 26943 1 20 . 1 1 273 273 GLY CA C 273 45.299 45.299 44.838 0.461 18321 26944 1 20 . 1 1 273 273 GLY H H 273 8.086 8.086 7.950 0.136 18321 26945 1 20 . 1 1 274 274 GLN N N 274 120.624 120.624 118.548 2.076 18321 26946 1 20 . 1 1 274 274 GLN HA H 274 4.551 4.551 4.374 0.177 18321 26947 1 20 . 1 1 274 274 GLN C C 274 175.039 175.039 174.770 0.269 18321 26948 1 20 . 1 1 274 274 GLN CA C 274 54.556 54.556 54.810 -0.254 18321 26949 1 20 . 1 1 274 274 GLN CB C 274 33.698 33.698 31.577 2.121 18321 26950 1 20 . 1 1 274 274 GLN H H 274 8.045 8.045 7.686 0.359 18321 26951 1 20 . 1 1 275 275 TRP N N 275 125.596 125.596 123.815 1.781 18321 26952 1 20 . 1 1 275 275 TRP HA H 275 4.588 4.588 4.819 -0.231 18321 26953 1 20 . 1 1 275 275 TRP C C 275 172.832 172.832 175.763 -2.931 18321 26954 1 20 . 1 1 275 275 TRP CA C 275 55.296 55.296 54.638 0.659 18321 26955 1 20 . 1 1 275 275 TRP CB C 275 31.393 31.393 30.081 1.312 18321 26956 1 20 . 1 1 275 275 TRP H H 275 8.484 8.484 8.148 0.336 18321 26957 1 20 . 1 1 276 276 GLU N N 276 119.012 119.012 119.439 -0.427 18321 26958 1 20 . 1 1 276 276 GLU HA H 276 5.190 5.190 5.163 0.027 18321 26959 1 20 . 1 1 276 276 GLU C C 276 176.553 176.553 176.316 0.237 18321 26960 1 20 . 1 1 276 276 GLU CA C 276 54.288 54.288 55.753 -1.465 18321 26961 1 20 . 1 1 276 276 GLU CB C 276 32.851 32.851 31.908 0.943 18321 26962 1 20 . 1 1 276 276 GLU H H 276 8.643 8.643 8.363 0.280 18321 26963 1 20 . 1 1 277 277 GLY N N 277 111.364 111.364 111.674 -0.310 18321 26964 1 20 . 1 1 277 277 GLY C C 277 170.707 170.707 172.462 -1.755 18321 26965 1 20 . 1 1 277 277 GLY CA C 277 46.723 46.723 44.077 2.646 18321 26966 1 20 . 1 1 277 277 GLY H H 277 9.072 9.072 9.160 -0.088 18321 26967 1 20 . 1 1 278 278 GLU N N 278 117.733 117.733 124.061 -6.328 18321 26968 1 20 . 1 1 278 278 GLU HA H 278 5.748 5.748 4.742 1.006 18321 26969 1 20 . 1 1 278 278 GLU C C 278 176.051 176.051 175.333 0.718 18321 26970 1 20 . 1 1 278 278 GLU CA C 278 53.620 53.620 55.286 -1.666 18321 26971 1 20 . 1 1 278 278 GLU CB C 278 33.742 33.742 30.411 3.331 18321 26972 1 20 . 1 1 278 278 GLU H H 278 8.810 8.810 8.337 0.473 18321 26973 1 20 . 1 1 279 279 VAL N N 279 123.834 123.834 123.945 -0.111 18321 26974 1 20 . 1 1 279 279 VAL HA H 279 4.404 4.404 4.384 0.020 18321 26975 1 20 . 1 1 279 279 VAL C C 279 175.289 175.289 175.656 -0.367 18321 26976 1 20 . 1 1 279 279 VAL CA C 279 61.166 61.166 59.260 1.906 18321 26977 1 20 . 1 1 279 279 VAL CB C 279 34.123 34.123 35.531 -1.408 18321 26978 1 20 . 1 1 279 279 VAL H H 279 8.887 8.887 8.363 0.524 18321 26979 1 20 . 1 1 280 280 ASN N N 280 126.025 126.025 121.226 4.799 18321 26980 1 20 . 1 1 280 280 ASN HA H 280 4.435 4.435 4.520 -0.085 18321 26981 1 20 . 1 1 280 280 ASN C C 280 175.205 175.205 175.771 -0.566 18321 26982 1 20 . 1 1 280 280 ASN CA C 280 45.615 45.615 54.288 -8.673 18321 26983 1 20 . 1 1 280 280 ASN CB C 280 37.386 37.386 37.144 0.242 18321 26984 1 20 . 1 1 280 280 ASN H H 280 9.322 9.322 9.013 0.309 18321 26985 1 20 . 1 1 281 281 GLY N N 281 104.588 104.588 109.930 -5.342 18321 26986 1 20 . 1 1 281 281 GLY C C 281 173.944 173.944 173.134 0.810 18321 26987 1 20 . 1 1 281 281 GLY CA C 281 45.224 45.224 45.133 0.091 18321 26988 1 20 . 1 1 281 281 GLY H H 281 8.768 8.768 8.600 0.168 18321 26989 1 20 . 1 1 282 282 ARG N N 282 122.567 122.567 119.277 3.290 18321 26990 1 20 . 1 1 282 282 ARG HA H 282 4.559 4.559 4.412 0.147 18321 26991 1 20 . 1 1 282 282 ARG C C 282 174.350 174.350 173.404 0.946 18321 26992 1 20 . 1 1 282 282 ARG CA C 282 54.933 54.933 55.848 -0.915 18321 26993 1 20 . 1 1 282 282 ARG CB C 282 31.765 31.765 32.388 -0.623 18321 26994 1 20 . 1 1 282 282 ARG H H 282 8.149 8.149 8.002 0.147 18321 26995 1 20 . 1 1 283 283 LYS N N 283 121.565 121.565 123.780 -2.215 18321 26996 1 20 . 1 1 283 283 LYS HA H 283 5.584 5.584 5.345 0.239 18321 26997 1 20 . 1 1 283 283 LYS CA C 283 54.143 54.143 55.173 -1.030 18321 26998 1 20 . 1 1 283 283 LYS CB C 283 36.040 36.040 32.858 3.182 18321 26999 1 20 . 1 1 283 283 LYS H H 283 8.424 8.424 8.473 -0.049 18321 27000 1 20 . 1 1 284 284 GLY C C 284 173.006 173.006 172.436 0.570 18321 27001 1 20 . 1 1 284 284 GLY CA C 284 45.886 45.886 44.608 1.278 18321 27002 1 20 . 1 1 285 285 LEU N N 285 119.673 119.673 120.504 -0.831 18321 27003 1 20 . 1 1 285 285 LEU HA H 285 5.718 5.718 5.718 -0.000 18321 27004 1 20 . 1 1 285 285 LEU C C 285 178.657 178.657 176.459 2.198 18321 27005 1 20 . 1 1 285 285 LEU CA C 285 53.656 53.656 53.954 -0.298 18321 27006 1 20 . 1 1 285 285 LEU CB C 285 44.813 44.813 43.590 1.223 18321 27007 1 20 . 1 1 285 285 LEU H H 285 8.734 8.734 8.596 0.138 18321 27008 1 20 . 1 1 286 286 PHE N N 286 118.785 118.785 117.079 1.706 18321 27009 1 20 . 1 1 286 286 PHE HA H 286 4.521 4.521 4.999 -0.478 18321 27010 1 20 . 1 1 286 286 PHE CA C 286 57.592 57.592 54.727 2.865 18321 27011 1 20 . 1 1 286 286 PHE CB C 286 40.669 40.669 39.614 1.055 18321 27012 1 20 . 1 1 286 286 PHE H H 286 9.120 9.120 7.726 1.394 18321 27013 1 20 . 1 1 287 287 PRO HA H 287 4.385 4.385 3.924 0.461 18321 27014 1 20 . 1 1 287 287 PRO CA C 287 62.814 62.814 61.605 1.208 18321 27015 1 20 . 1 1 287 287 PRO CB C 287 32.133 32.133 32.417 -0.284 18321 27016 1 20 . 1 1 288 288 PHE C C 288 174.837 174.837 176.183 -1.346 18321 27017 1 20 . 1 1 288 288 PHE CA C 288 59.020 59.020 57.928 1.092 18321 27018 1 20 . 1 1 288 288 PHE CB C 288 34.987 34.987 37.897 -2.909 18321 27019 1 20 . 1 1 289 289 THR N N 289 107.865 107.865 111.962 -4.097 18321 27020 1 20 . 1 1 289 289 THR HA H 289 3.589 3.589 4.419 -0.830 18321 27021 1 20 . 1 1 289 289 THR C C 289 176.125 176.125 175.438 0.687 18321 27022 1 20 . 1 1 289 289 THR CA C 289 62.243 62.243 63.826 -1.583 18321 27023 1 20 . 1 1 289 289 THR CB C 289 69.365 69.365 68.773 0.592 18321 27024 1 20 . 1 1 289 289 THR H H 289 6.453 6.453 8.084 -1.631 18321 27025 1 20 . 1 1 290 290 HIS N N 290 119.462 119.462 119.650 -0.188 18321 27026 1 20 . 1 1 290 290 HIS HA H 290 4.196 4.196 4.536 -0.340 18321 27027 1 20 . 1 1 290 290 HIS C C 290 175.165 175.165 174.445 0.720 18321 27028 1 20 . 1 1 290 290 HIS CA C 290 57.635 57.635 57.499 0.136 18321 27029 1 20 . 1 1 290 290 HIS CB C 290 29.840 29.840 30.704 -0.865 18321 27030 1 20 . 1 1 290 290 HIS H H 290 7.835 7.835 8.081 -0.246 18321 27031 1 20 . 1 1 291 291 VAL N N 291 110.050 110.050 112.246 -2.196 18321 27032 1 20 . 1 1 291 291 VAL HA H 291 5.445 5.445 4.938 0.507 18321 27033 1 20 . 1 1 291 291 VAL C C 291 173.386 173.386 175.050 -1.664 18321 27034 1 20 . 1 1 291 291 VAL CA C 291 57.794 57.794 58.818 -1.024 18321 27035 1 20 . 1 1 291 291 VAL CB C 291 35.784 35.784 34.201 1.583 18321 27036 1 20 . 1 1 291 291 VAL H H 291 7.562 7.562 7.446 0.116 18321 27037 1 20 . 1 1 292 292 LYS N N 292 119.445 119.445 121.723 -2.278 18321 27038 1 20 . 1 1 292 292 LYS HA H 292 4.857 4.857 4.717 0.140 18321 27039 1 20 . 1 1 292 292 LYS C C 292 176.512 176.512 175.621 0.891 18321 27040 1 20 . 1 1 292 292 LYS CA C 292 54.647 54.647 54.577 0.070 18321 27041 1 20 . 1 1 292 292 LYS CB C 292 35.665 35.665 34.905 0.760 18321 27042 1 20 . 1 1 292 292 LYS H H 292 8.753 8.753 8.307 0.446 18321 27043 1 20 . 1 1 293 293 ILE N N 293 128.707 128.707 126.162 2.545 18321 27044 1 20 . 1 1 293 293 ILE HA H 293 4.509 4.509 4.330 0.179 18321 27045 1 20 . 1 1 293 293 ILE C C 293 175.666 175.666 176.704 -1.038 18321 27046 1 20 . 1 1 293 293 ILE CA C 293 62.563 62.563 61.215 1.348 18321 27047 1 20 . 1 1 293 293 ILE CB C 293 38.076 38.076 36.081 1.995 18321 27048 1 20 . 1 1 293 293 ILE H H 293 9.107 9.107 8.966 0.141 18321 27049 1 20 . 1 1 294 294 PHE N N 294 126.638 126.638 127.887 -1.249 18321 27050 1 20 . 1 1 294 294 PHE HA H 294 4.898 4.898 4.974 -0.076 18321 27051 1 20 . 1 1 294 294 PHE C C 294 175.838 175.838 173.649 2.189 18321 27052 1 20 . 1 1 294 294 PHE CA C 294 56.335 56.335 55.169 1.166 18321 27053 1 20 . 1 1 294 294 PHE CB C 294 41.196 41.196 40.552 0.644 18321 27054 1 20 . 1 1 294 294 PHE H H 294 8.716 8.716 8.518 0.199 18321 27055 1 20 . 1 1 295 295 ASP N N 295 122.961 122.961 120.619 2.342 18321 27056 1 20 . 1 1 295 295 ASP HA H 295 5.003 5.003 4.777 0.226 18321 27057 1 20 . 1 1 295 295 ASP CA C 295 50.602 50.602 51.619 -1.017 18321 27058 1 20 . 1 1 295 295 ASP CB C 295 40.754 40.754 41.361 -0.606 18321 27059 1 20 . 1 1 295 295 ASP H H 295 8.418 8.418 8.409 0.009 18321 27060 1 20 . 1 1 296 296 PRO HA H 296 4.524 4.524 4.205 0.319 18321 27061 1 20 . 1 1 296 296 PRO C C 296 176.807 176.807 176.587 0.220 18321 27062 1 20 . 1 1 296 296 PRO CA C 296 62.987 62.987 63.566 -0.579 18321 27063 1 20 . 1 1 296 296 PRO CB C 296 32.033 32.033 32.187 -0.154 18321 27064 1 20 . 1 1 297 297 GLN N N 297 120.729 120.729 119.655 1.074 18321 27065 1 20 . 1 1 297 297 GLN HA H 297 4.274 4.274 4.348 -0.074 18321 27066 1 20 . 1 1 297 297 GLN CA C 297 56.427 56.427 54.521 1.906 18321 27067 1 20 . 1 1 297 297 GLN CB C 297 28.819 28.819 27.336 1.483 18321 27068 1 20 . 1 1 297 297 GLN H H 297 8.551 8.551 8.062 0.489 18321 27069 1 20 . 1 1 299 299 PRO C C 299 176.936 176.936 176.079 0.857 18321 27070 1 20 . 1 1 299 299 PRO CA C 299 63.406 63.406 63.322 0.084 18321 27071 1 20 . 1 1 299 299 PRO CB C 299 31.421 31.421 32.052 -0.631 18321 27072 1 20 . 1 1 300 300 ASP N N 300 119.609 119.609 118.853 0.756 18321 27073 1 20 . 1 1 300 300 ASP C C 300 176.344 176.344 177.025 -0.681 18321 27074 1 20 . 1 1 300 300 ASP CA C 300 54.178 54.178 56.169 -1.991 18321 27075 1 20 . 1 1 300 300 ASP CB C 300 40.661 40.661 41.117 -0.457 18321 27076 1 20 . 1 1 300 300 ASP H H 300 8.239 8.239 8.294 -0.055 18321 27077 1 20 . 1 1 301 301 GLU N N 301 120.462 120.462 117.078 3.384 18321 27078 1 20 . 1 1 301 301 GLU CA C 301 56.188 56.188 56.355 -0.167 18321 27079 1 20 . 1 1 301 301 GLU CB C 301 29.507 29.507 31.238 -1.731 18321 27080 1 20 . 1 1 301 301 GLU H H 301 8.084 8.084 8.114 -0.030 18321 stop_ loop_ _SPARTA_output.Data_ID _SPARTA_output.Entity_delta_chem_shifts_ID _SPARTA_output.Conformer_ID _SPARTA_output.Data_type _SPARTA_output.Data_atom _SPARTA_output.Data_num_shifts _SPARTA_output.Data_value _SPARTA_output.Data_low_range _SPARTA_output.Data_high_range _SPARTA_output.Entry_ID 1 1 1 "Average Difference" N 232 3.304 0.137 3.308 18321 2 1 1 "Average Difference" HA 198 0.387 -0.018 0.388 18321 3 1 1 "Average Difference" C 211 1.334 -0.132 1.330 18321 4 1 1 "Average Difference" CA 267 2.182 0.339 2.159 18321 5 1 1 "Average Difference" CB 242 2.082 -0.421 2.044 18321 6 1 1 "Average Difference" HN 231 0.606 -0.147 0.589 18321 7 1 2 "Average Difference" N 232 3.293 0.251 3.290 18321 8 1 2 "Average Difference" HA 198 0.372 -0.001 0.373 18321 9 1 2 "Average Difference" C 211 1.227 -0.130 1.223 18321 10 1 2 "Average Difference" CA 267 2.250 0.353 2.227 18321 11 1 2 "Average Difference" CB 242 2.058 -0.391 2.024 18321 12 1 2 "Average Difference" HN 231 0.544 -0.137 0.528 18321 13 1 3 "Average Difference" N 232 3.330 0.177 3.332 18321 14 1 3 "Average Difference" HA 198 0.386 -0.017 0.387 18321 15 1 3 "Average Difference" C 211 1.241 -0.097 1.240 18321 16 1 3 "Average Difference" CA 267 2.128 0.340 2.105 18321 17 1 3 "Average Difference" CB 242 2.075 -0.418 2.037 18321 18 1 3 "Average Difference" HN 231 0.591 -0.144 0.575 18321 19 1 4 "Average Difference" N 232 3.270 0.355 3.258 18321 20 1 4 "Average Difference" HA 198 0.367 -0.035 0.366 18321 21 1 4 "Average Difference" C 211 1.180 -0.087 1.180 18321 22 1 4 "Average Difference" CA 267 2.246 0.421 2.210 18321 23 1 4 "Average Difference" CB 242 2.067 -0.439 2.024 18321 24 1 4 "Average Difference" HN 231 0.559 -0.158 0.537 18321 25 1 5 "Average Difference" N 232 3.320 0.440 3.298 18321 26 1 5 "Average Difference" HA 198 0.386 0.005 0.387 18321 27 1 5 "Average Difference" C 211 1.232 -0.109 1.230 18321 28 1 5 "Average Difference" CA 267 2.235 0.281 2.221 18321 29 1 5 "Average Difference" CB 242 2.033 -0.326 2.011 18321 30 1 5 "Average Difference" HN 231 0.521 -0.103 0.511 18321 31 1 6 "Average Difference" N 232 3.417 0.162 3.421 18321 32 1 6 "Average Difference" HA 198 0.368 -0.024 0.368 18321 33 1 6 "Average Difference" C 211 1.170 -0.148 1.163 18321 34 1 6 "Average Difference" CA 267 2.139 0.288 2.124 18321 35 1 6 "Average Difference" CB 242 2.136 -0.434 2.096 18321 36 1 6 "Average Difference" HN 231 0.572 -0.148 0.554 18321 37 1 7 "Average Difference" N 232 3.431 0.164 3.434 18321 38 1 7 "Average Difference" HA 198 0.356 -0.019 0.357 18321 39 1 7 "Average Difference" C 211 1.189 -0.056 1.191 18321 40 1 7 "Average Difference" CA 267 2.199 0.326 2.179 18321 41 1 7 "Average Difference" CB 242 2.070 -0.387 2.038 18321 42 1 7 "Average Difference" HN 231 0.545 -0.137 0.528 18321 43 1 8 "Average Difference" N 232 3.467 0.607 3.421 18321 44 1 8 "Average Difference" HA 198 0.345 -0.027 0.345 18321 45 1 8 "Average Difference" C 211 1.244 -0.104 1.243 18321 46 1 8 "Average Difference" CA 267 2.100 0.315 2.080 18321 47 1 8 "Average Difference" CB 242 2.114 -0.446 2.071 18321 48 1 8 "Average Difference" HN 231 0.538 -0.120 0.525 18321 49 1 9 "Average Difference" N 232 3.452 0.153 3.456 18321 50 1 9 "Average Difference" HA 198 0.367 -0.003 0.368 18321 51 1 9 "Average Difference" C 211 1.216 -0.141 1.211 18321 52 1 9 "Average Difference" CA 267 2.122 0.305 2.104 18321 53 1 9 "Average Difference" CB 242 2.076 -0.374 2.046 18321 54 1 9 "Average Difference" HN 231 0.579 -0.108 0.570 18321 55 1 10 "Average Difference" N 232 3.582 0.239 3.582 18321 56 1 10 "Average Difference" HA 198 0.361 0.005 0.362 18321 57 1 10 "Average Difference" C 211 1.212 -0.152 1.206 18321 58 1 10 "Average Difference" CA 267 2.168 0.253 2.157 18321 59 1 10 "Average Difference" CB 242 2.061 -0.260 2.049 18321 60 1 10 "Average Difference" HN 231 0.544 -0.113 0.534 18321 61 1 11 "Average Difference" N 232 3.316 0.359 3.304 18321 62 1 11 "Average Difference" HA 198 0.356 -0.023 0.356 18321 63 1 11 "Average Difference" C 211 1.272 -0.082 1.272 18321 64 1 11 "Average Difference" CA 267 2.182 0.346 2.159 18321 65 1 11 "Average Difference" CB 242 2.142 -0.383 2.111 18321 66 1 11 "Average Difference" HN 231 0.554 -0.135 0.538 18321 67 1 12 "Average Difference" N 232 3.426 0.353 3.415 18321 68 1 12 "Average Difference" HA 198 0.389 0.005 0.390 18321 69 1 12 "Average Difference" C 211 1.258 -0.096 1.258 18321 70 1 12 "Average Difference" CA 267 2.156 0.333 2.135 18321 71 1 12 "Average Difference" CB 242 2.069 -0.359 2.042 18321 72 1 12 "Average Difference" HN 231 0.541 -0.088 0.535 18321 73 1 13 "Average Difference" N 232 3.408 0.211 3.408 18321 74 1 13 "Average Difference" HA 198 0.359 0.000 0.360 18321 75 1 13 "Average Difference" C 211 1.215 -0.116 1.212 18321 76 1 13 "Average Difference" CA 267 2.176 0.275 2.163 18321 77 1 13 "Average Difference" CB 242 2.054 -0.369 2.025 18321 78 1 13 "Average Difference" HN 231 0.538 -0.132 0.523 18321 79 1 14 "Average Difference" N 232 3.520 0.138 3.525 18321 80 1 14 "Average Difference" HA 198 0.388 -0.033 0.388 18321 81 1 14 "Average Difference" C 211 1.255 -0.108 1.253 18321 82 1 14 "Average Difference" CA 267 2.294 0.395 2.264 18321 83 1 14 "Average Difference" CB 242 1.997 -0.408 1.959 18321 84 1 14 "Average Difference" HN 231 0.587 -0.155 0.567 18321 85 1 15 "Average Difference" N 232 3.366 0.171 3.369 18321 86 1 15 "Average Difference" HA 198 0.365 -0.011 0.366 18321 87 1 15 "Average Difference" C 211 1.237 -0.136 1.232 18321 88 1 15 "Average Difference" CA 267 2.093 0.318 2.072 18321 89 1 15 "Average Difference" CB 242 1.988 -0.416 1.948 18321 90 1 15 "Average Difference" HN 231 0.553 -0.131 0.538 18321 91 1 16 "Average Difference" N 232 3.355 0.124 3.360 18321 92 1 16 "Average Difference" HA 198 0.364 0.003 0.365 18321 93 1 16 "Average Difference" C 211 1.262 -0.168 1.254 18321 94 1 16 "Average Difference" CA 267 2.162 0.300 2.146 18321 95 1 16 "Average Difference" CB 242 2.056 -0.314 2.036 18321 96 1 16 "Average Difference" HN 231 0.550 -0.125 0.537 18321 97 1 17 "Average Difference" N 232 3.287 0.439 3.265 18321 98 1 17 "Average Difference" HA 198 0.363 -0.020 0.364 18321 99 1 17 "Average Difference" C 211 1.227 -0.156 1.220 18321 100 1 17 "Average Difference" CA 267 2.176 0.332 2.154 18321 101 1 17 "Average Difference" CB 242 2.148 -0.465 2.101 18321 102 1 17 "Average Difference" HN 231 0.576 -0.115 0.566 18321 103 1 18 "Average Difference" N 232 3.225 0.195 3.226 18321 104 1 18 "Average Difference" HA 198 0.352 -0.010 0.353 18321 105 1 18 "Average Difference" C 211 1.263 -0.130 1.259 18321 106 1 18 "Average Difference" CA 267 2.233 0.314 2.215 18321 107 1 18 "Average Difference" CB 242 2.054 -0.404 2.018 18321 108 1 18 "Average Difference" HN 231 0.554 -0.132 0.539 18321 109 1 19 "Average Difference" N 232 3.136 0.305 3.128 18321 110 1 19 "Average Difference" HA 198 0.368 -0.002 0.369 18321 111 1 19 "Average Difference" C 211 1.195 -0.100 1.194 18321 112 1 19 "Average Difference" CA 267 2.119 0.312 2.100 18321 113 1 19 "Average Difference" CB 242 2.067 -0.399 2.032 18321 114 1 19 "Average Difference" HN 231 0.526 -0.142 0.507 18321 115 1 20 "Average Difference" N 232 3.621 0.230 3.621 18321 116 1 20 "Average Difference" HA 198 0.359 -0.015 0.359 18321 117 1 20 "Average Difference" C 211 1.262 -0.117 1.259 18321 118 1 20 "Average Difference" CA 267 2.162 0.393 2.129 18321 119 1 20 "Average Difference" CB 242 2.083 -0.382 2.052 18321 120 1 20 "Average Difference" HN 231 0.569 -0.134 0.554 18321 stop_ save_ save_delta_chem_shifts_average _Entity_delta_chem_shifts.Sf_category delta_chem_shifts _Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average _Entity_delta_chem_shifts.Model_type average _Entity_delta_chem_shifts.Entry_ID 18321 _Entity_delta_chem_shifts.ID 2 _Entity_delta_chem_shifts.Details ; This saveframe contains the averaged SPARTA chemical shift over all the models used. ; loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 . 1 1 2 2 SER HA H 2 4.521 4.521 4.701 -0.180 18321 2 1 . 1 1 2 2 SER CA C 2 58.326 58.326 58.041 0.285 18321 3 1 . 1 1 2 2 SER CB C 2 64.062 64.062 64.332 -0.270 18321 4 1 . 1 1 3 3 SER HA H 3 4.465 4.465 4.262 0.203 18321 5 1 . 1 1 3 3 SER C C 3 173.887 173.887 174.292 -0.405 18321 6 1 . 1 1 3 3 SER CA C 3 58.374 58.374 59.714 -1.340 18321 7 1 . 1 1 3 3 SER CB C 3 63.920 63.920 63.289 0.631 18321 8 1 . 1 1 4 4 ALA N N 4 124.755 124.755 124.506 0.249 18321 9 1 . 1 1 4 4 ALA HA H 4 4.547 4.547 4.614 -0.067 18321 10 1 . 1 1 4 4 ALA CA C 4 52.737 52.737 52.221 0.515 18321 11 1 . 1 1 4 4 ALA CB C 4 19.636 19.636 18.709 0.928 18321 12 1 . 1 1 4 4 ALA H H 4 8.244 8.244 7.977 0.267 18321 13 1 . 1 1 5 5 ARG N N 5 120.383 120.383 125.166 -4.783 18321 14 1 . 1 1 5 5 ARG HA H 5 4.524 4.524 4.655 -0.131 18321 15 1 . 1 1 5 5 ARG C C 5 175.611 175.611 175.007 0.604 18321 16 1 . 1 1 5 5 ARG CA C 5 56.082 56.082 55.532 0.550 18321 17 1 . 1 1 5 5 ARG CB C 5 30.695 30.695 30.826 -0.131 18321 18 1 . 1 1 5 5 ARG H H 5 8.727 8.727 8.377 0.350 18321 19 1 . 1 1 6 6 PHE N N 6 115.159 115.159 120.120 -4.961 18321 20 1 . 1 1 6 6 PHE HA H 6 4.786 4.786 4.772 0.014 18321 21 1 . 1 1 6 6 PHE C C 6 172.076 172.076 174.146 -2.070 18321 22 1 . 1 1 6 6 PHE CA C 6 56.640 56.640 56.031 0.609 18321 23 1 . 1 1 6 6 PHE CB C 6 40.378 40.378 40.396 -0.018 18321 24 1 . 1 1 6 6 PHE H H 6 7.536 7.536 7.821 -0.285 18321 25 1 . 1 1 7 7 ASP N N 7 121.846 121.846 121.952 -0.106 18321 26 1 . 1 1 7 7 ASP HA H 7 4.846 4.846 4.622 0.225 18321 27 1 . 1 1 7 7 ASP CA C 7 52.327 52.327 54.561 -2.234 18321 28 1 . 1 1 7 7 ASP CB C 7 41.298 41.298 41.445 -0.147 18321 29 1 . 1 1 7 7 ASP H H 7 9.062 9.062 8.782 0.280 18321 30 1 . 1 1 8 8 SER HA H 8 3.950 3.950 4.353 -0.403 18321 31 1 . 1 1 8 8 SER C C 8 174.705 174.705 174.603 0.102 18321 32 1 . 1 1 8 8 SER CA C 8 61.937 61.937 59.824 2.113 18321 33 1 . 1 1 8 8 SER CB C 8 62.260 62.260 62.705 -0.445 18321 34 1 . 1 1 9 9 SER N N 9 114.373 114.373 114.911 -0.538 18321 35 1 . 1 1 9 9 SER HA H 9 4.529 4.529 4.829 -0.300 18321 36 1 . 1 1 9 9 SER C C 9 175.089 175.089 173.608 1.481 18321 37 1 . 1 1 9 9 SER CA C 9 59.851 59.851 59.049 0.802 18321 38 1 . 1 1 9 9 SER CB C 9 64.246 64.246 64.315 -0.069 18321 39 1 . 1 1 9 9 SER H H 9 8.722 8.722 8.483 0.239 18321 40 1 . 1 1 10 10 ASP N N 10 121.818 121.818 123.363 -1.545 18321 41 1 . 1 1 10 10 ASP HA H 10 4.730 4.730 4.592 0.138 18321 42 1 . 1 1 10 10 ASP C C 10 174.455 174.455 177.004 -2.549 18321 43 1 . 1 1 10 10 ASP CA C 10 52.432 52.432 54.294 -1.863 18321 44 1 . 1 1 10 10 ASP CB C 10 39.607 39.607 41.142 -1.535 18321 45 1 . 1 1 10 10 ASP H H 10 7.600 7.600 8.351 -0.751 18321 46 1 . 1 1 11 11 ARG N N 11 125.238 125.238 125.336 -0.098 18321 47 1 . 1 1 11 11 ARG HA H 11 1.936 1.936 2.913 -0.976 18321 48 1 . 1 1 11 11 ARG C C 11 176.916 176.916 177.327 -0.411 18321 49 1 . 1 1 11 11 ARG CA C 11 57.451 57.451 58.106 -0.655 18321 50 1 . 1 1 11 11 ARG CB C 11 43.014 43.014 29.372 13.642 18321 51 1 . 1 1 11 11 ARG H H 11 7.739 7.739 8.227 -0.488 18321 52 1 . 1 1 12 12 SER N N 12 112.065 112.065 112.632 -0.567 18321 53 1 . 1 1 12 12 SER HA H 12 4.695 4.695 4.241 0.454 18321 54 1 . 1 1 12 12 SER C C 12 175.092 175.092 174.422 0.670 18321 55 1 . 1 1 12 12 SER CA C 12 60.785 60.785 59.753 1.032 18321 56 1 . 1 1 12 12 SER CB C 12 62.889 62.889 62.532 0.357 18321 57 1 . 1 1 12 12 SER H H 12 7.888 7.888 8.080 -0.192 18321 58 1 . 1 1 13 13 ALA N N 13 122.249 122.249 123.058 -0.809 18321 59 1 . 1 1 13 13 ALA HA H 13 4.216 4.216 4.385 -0.169 18321 60 1 . 1 1 13 13 ALA C C 13 178.069 178.069 177.498 0.571 18321 61 1 . 1 1 13 13 ALA CA C 13 53.562 53.562 53.647 -0.085 18321 62 1 . 1 1 13 13 ALA CB C 13 19.339 19.339 19.730 -0.391 18321 63 1 . 1 1 13 13 ALA H H 13 7.418 7.418 7.604 -0.186 18321 64 1 . 1 1 14 14 TRP N N 14 107.433 107.433 112.357 -4.924 18321 65 1 . 1 1 14 14 TRP HA H 14 4.785 4.785 4.664 0.121 18321 66 1 . 1 1 14 14 TRP C C 14 175.286 175.286 175.671 -0.385 18321 67 1 . 1 1 14 14 TRP CA C 14 55.212 55.212 55.444 -0.232 18321 68 1 . 1 1 14 14 TRP CB C 14 32.776 32.776 31.064 1.712 18321 69 1 . 1 1 14 14 TRP H H 14 6.273 6.273 6.910 -0.637 18321 70 1 . 1 1 15 15 TYR N N 15 122.315 122.315 124.520 -2.205 18321 71 1 . 1 1 15 15 TYR HA H 15 5.436 5.436 4.857 0.579 18321 72 1 . 1 1 15 15 TYR C C 15 175.325 175.325 174.931 0.394 18321 73 1 . 1 1 15 15 TYR CA C 15 56.609 56.609 58.210 -1.601 18321 74 1 . 1 1 15 15 TYR CB C 15 36.940 36.940 38.168 -1.228 18321 75 1 . 1 1 15 15 TYR H H 15 8.221 8.221 7.634 0.587 18321 76 1 . 1 1 16 16 MET N N 16 126.031 126.031 126.783 -0.752 18321 77 1 . 1 1 16 16 MET HA H 16 4.462 4.462 4.362 0.100 18321 78 1 . 1 1 16 16 MET CA C 16 53.046 53.046 53.150 -0.104 18321 79 1 . 1 1 16 16 MET CB C 16 41.114 41.114 32.697 8.417 18321 80 1 . 1 1 16 16 MET H H 16 8.989 8.989 8.613 0.376 18321 81 1 . 1 1 17 17 GLY CA C 17 45.803 45.803 45.388 0.415 18321 82 1 . 1 1 18 18 PRO HA H 18 4.675 4.675 4.521 0.154 18321 83 1 . 1 1 18 18 PRO C C 18 175.943 175.943 175.555 0.388 18321 84 1 . 1 1 18 18 PRO CA C 18 63.647 63.647 63.383 0.264 18321 85 1 . 1 1 18 18 PRO CB C 18 29.276 29.276 30.621 -1.345 18321 86 1 . 1 1 19 19 VAL N N 19 126.159 126.159 122.864 3.295 18321 87 1 . 1 1 19 19 VAL HA H 19 4.011 4.011 4.309 -0.298 18321 88 1 . 1 1 19 19 VAL C C 19 175.812 175.812 174.863 0.949 18321 89 1 . 1 1 19 19 VAL CA C 19 62.355 62.355 60.878 1.477 18321 90 1 . 1 1 19 19 VAL CB C 19 33.468 33.468 35.073 -1.605 18321 91 1 . 1 1 19 19 VAL H H 19 7.851 7.851 7.925 -0.074 18321 92 1 . 1 1 20 20 SER N N 20 123.950 123.950 114.291 9.659 18321 93 1 . 1 1 20 20 SER HA H 20 4.453 4.453 4.677 -0.224 18321 94 1 . 1 1 20 20 SER CA C 20 57.631 57.631 57.214 0.417 18321 95 1 . 1 1 20 20 SER CB C 20 65.951 65.951 64.757 1.194 18321 96 1 . 1 1 20 20 SER H H 20 8.800 8.800 8.137 0.663 18321 97 1 . 1 1 21 21 ARG N N 21 123.461 123.461 122.104 1.357 18321 98 1 . 1 1 21 21 ARG HA H 21 3.489 3.489 4.021 -0.531 18321 99 1 . 1 1 21 21 ARG C C 21 178.164 178.164 178.388 -0.224 18321 100 1 . 1 1 21 21 ARG CA C 21 60.025 60.025 60.089 -0.064 18321 101 1 . 1 1 21 21 ARG CB C 21 30.334 30.334 30.005 0.329 18321 102 1 . 1 1 21 21 ARG H H 21 9.307 9.307 8.834 0.473 18321 103 1 . 1 1 22 22 GLN N N 22 116.591 116.591 118.300 -1.710 18321 104 1 . 1 1 22 22 GLN HA H 22 4.008 4.008 4.065 -0.057 18321 105 1 . 1 1 22 22 GLN CA C 22 59.095 59.095 59.102 -0.007 18321 106 1 . 1 1 22 22 GLN CB C 22 29.249 29.249 28.037 1.212 18321 107 1 . 1 1 22 22 GLN H H 22 8.394 8.394 8.500 -0.106 18321 108 1 . 1 1 23 23 GLU N N 23 122.191 122.191 119.760 2.431 18321 109 1 . 1 1 23 23 GLU HA H 23 4.037 4.037 4.058 -0.022 18321 110 1 . 1 1 23 23 GLU C C 23 178.986 178.986 178.668 0.318 18321 111 1 . 1 1 23 23 GLU CA C 23 59.081 59.081 58.914 0.167 18321 112 1 . 1 1 23 23 GLU CB C 23 31.896 31.896 29.234 2.662 18321 113 1 . 1 1 23 23 GLU H H 23 8.106 8.106 8.139 -0.033 18321 114 1 . 1 1 24 24 ALA N N 24 121.964 121.964 121.687 0.277 18321 115 1 . 1 1 24 24 ALA HA H 24 3.762 3.762 3.941 -0.179 18321 116 1 . 1 1 24 24 ALA C C 24 178.653 178.653 179.579 -0.926 18321 117 1 . 1 1 24 24 ALA CA C 24 55.480 55.480 55.331 0.149 18321 118 1 . 1 1 24 24 ALA CB C 24 18.049 18.049 18.358 -0.309 18321 119 1 . 1 1 24 24 ALA H H 24 8.732 8.732 8.284 0.448 18321 120 1 . 1 1 25 25 GLN N N 25 116.229 116.229 117.477 -1.248 18321 121 1 . 1 1 25 25 GLN HA H 25 3.950 3.950 4.068 -0.118 18321 122 1 . 1 1 25 25 GLN C C 25 177.442 177.442 178.341 -0.899 18321 123 1 . 1 1 25 25 GLN CA C 25 59.651 59.651 58.575 1.076 18321 124 1 . 1 1 25 25 GLN CB C 25 29.308 29.308 28.564 0.744 18321 125 1 . 1 1 25 25 GLN H H 25 8.391 8.391 8.045 0.345 18321 126 1 . 1 1 26 26 THR N N 26 115.105 115.105 113.866 1.239 18321 127 1 . 1 1 26 26 THR HA H 26 3.920 3.920 4.165 -0.245 18321 128 1 . 1 1 26 26 THR C C 26 176.835 176.835 176.416 0.419 18321 129 1 . 1 1 26 26 THR CA C 26 66.335 66.335 64.508 1.827 18321 130 1 . 1 1 26 26 THR CB C 26 68.876 68.876 68.704 0.172 18321 131 1 . 1 1 26 26 THR H H 26 8.223 8.223 7.822 0.401 18321 132 1 . 1 1 27 27 ARG N N 27 119.096 119.096 118.347 0.749 18321 133 1 . 1 1 27 27 ARG HA H 27 4.047 4.047 4.272 -0.225 18321 134 1 . 1 1 27 27 ARG C C 27 177.245 177.245 176.755 0.490 18321 135 1 . 1 1 27 27 ARG CA C 27 58.528 58.528 57.771 0.757 18321 136 1 . 1 1 27 27 ARG CB C 27 30.184 30.184 30.648 -0.464 18321 137 1 . 1 1 27 27 ARG H H 27 8.093 8.093 7.755 0.338 18321 138 1 . 1 1 28 28 LEU N N 28 114.602 114.602 116.603 -2.001 18321 139 1 . 1 1 28 28 LEU HA H 28 4.325 4.325 4.519 -0.194 18321 140 1 . 1 1 28 28 LEU C C 28 177.197 177.197 176.164 1.033 18321 141 1 . 1 1 28 28 LEU CA C 28 55.143 55.143 53.957 1.186 18321 142 1 . 1 1 28 28 LEU CB C 28 44.902 44.902 43.047 1.855 18321 143 1 . 1 1 28 28 LEU H H 28 7.438 7.438 7.447 -0.009 18321 144 1 . 1 1 29 29 GLN N N 29 121.312 121.312 120.907 0.405 18321 145 1 . 1 1 29 29 GLN HA H 29 3.856 3.856 4.203 -0.347 18321 146 1 . 1 1 29 29 GLN C C 29 178.048 178.048 176.807 1.241 18321 147 1 . 1 1 29 29 GLN CA C 29 57.691 57.691 56.377 1.314 18321 148 1 . 1 1 29 29 GLN CB C 29 27.293 27.293 27.602 -0.309 18321 149 1 . 1 1 29 29 GLN H H 29 8.250 8.250 7.809 0.441 18321 150 1 . 1 1 30 30 GLY N N 30 116.768 116.768 114.639 2.129 18321 151 1 . 1 1 30 30 GLY C C 30 174.914 174.914 174.348 0.566 18321 152 1 . 1 1 30 30 GLY CA C 30 45.491 45.491 45.653 -0.162 18321 153 1 . 1 1 30 30 GLY H H 30 9.135 9.135 8.596 0.539 18321 154 1 . 1 1 31 31 GLN N N 31 117.979 117.979 119.423 -1.444 18321 155 1 . 1 1 31 31 GLN HA H 31 4.329 4.329 4.186 0.143 18321 156 1 . 1 1 31 31 GLN C C 31 177.174 177.174 176.180 0.994 18321 157 1 . 1 1 31 31 GLN CA C 31 53.910 53.910 56.152 -2.242 18321 158 1 . 1 1 31 31 GLN CB C 31 29.574 29.574 29.321 0.253 18321 159 1 . 1 1 31 31 GLN H H 31 7.695 7.695 7.755 -0.060 18321 160 1 . 1 1 32 32 ARG N N 32 123.918 123.918 118.876 5.042 18321 161 1 . 1 1 32 32 ARG HA H 32 3.940 3.940 4.206 -0.266 18321 162 1 . 1 1 32 32 ARG C C 32 175.810 175.810 175.862 -0.052 18321 163 1 . 1 1 32 32 ARG CA C 32 56.770 56.770 56.020 0.750 18321 164 1 . 1 1 32 32 ARG CB C 32 30.074 30.074 30.973 -0.899 18321 165 1 . 1 1 32 32 ARG H H 32 8.955 8.955 8.287 0.668 18321 166 1 . 1 1 33 33 HIS N N 33 122.248 122.248 121.203 1.045 18321 167 1 . 1 1 33 33 HIS HA H 33 4.627 4.627 4.559 0.068 18321 168 1 . 1 1 33 33 HIS C C 33 177.089 177.089 176.061 1.028 18321 169 1 . 1 1 33 33 HIS CA C 33 55.858 55.858 56.622 -0.764 18321 170 1 . 1 1 33 33 HIS CB C 33 28.648 28.648 29.664 -1.016 18321 171 1 . 1 1 33 33 HIS H H 33 8.302 8.302 8.387 -0.085 18321 172 1 . 1 1 34 34 GLY N N 34 109.518 109.518 110.105 -0.587 18321 173 1 . 1 1 34 34 GLY C C 34 176.730 176.730 173.723 3.007 18321 174 1 . 1 1 34 34 GLY CA C 34 45.967 45.967 45.124 0.843 18321 175 1 . 1 1 34 34 GLY H H 34 9.496 9.496 9.063 0.433 18321 176 1 . 1 1 35 35 MET N N 35 125.193 125.193 122.073 3.120 18321 177 1 . 1 1 35 35 MET HA H 35 5.750 5.750 5.612 0.138 18321 178 1 . 1 1 35 35 MET C C 35 174.388 174.388 174.980 -0.592 18321 179 1 . 1 1 35 35 MET CA C 35 55.762 55.762 55.962 -0.200 18321 180 1 . 1 1 35 35 MET CB C 35 32.706 32.706 34.262 -1.556 18321 181 1 . 1 1 35 35 MET H H 35 8.359 8.359 7.439 0.920 18321 182 1 . 1 1 36 36 PHE N N 36 123.311 123.311 118.080 5.231 18321 183 1 . 1 1 36 36 PHE HA H 36 5.985 5.985 5.758 0.227 18321 184 1 . 1 1 36 36 PHE C C 36 172.140 172.140 172.893 -0.753 18321 185 1 . 1 1 36 36 PHE CA C 36 55.755 55.755 55.280 0.474 18321 186 1 . 1 1 36 36 PHE CB C 36 45.197 45.197 42.740 2.457 18321 187 1 . 1 1 36 36 PHE H H 36 8.261 8.261 7.881 0.380 18321 188 1 . 1 1 37 37 LEU N N 37 114.652 114.652 116.098 -1.446 18321 189 1 . 1 1 37 37 LEU HA H 37 4.489 4.489 5.056 -0.567 18321 190 1 . 1 1 37 37 LEU C C 37 174.033 174.033 174.857 -0.824 18321 191 1 . 1 1 37 37 LEU CA C 37 55.382 55.382 54.585 0.797 18321 192 1 . 1 1 37 37 LEU CB C 37 44.791 44.791 45.590 -0.799 18321 193 1 . 1 1 37 37 LEU H H 37 9.292 9.292 9.052 0.240 18321 194 1 . 1 1 38 38 VAL N N 38 121.009 121.009 122.617 -1.608 18321 195 1 . 1 1 38 38 VAL HA H 38 5.504 5.504 4.791 0.713 18321 196 1 . 1 1 38 38 VAL C C 38 173.581 173.581 175.380 -1.799 18321 197 1 . 1 1 38 38 VAL CA C 38 61.316 61.316 61.800 -0.484 18321 198 1 . 1 1 38 38 VAL CB C 38 33.302 33.302 32.906 0.396 18321 199 1 . 1 1 38 38 VAL H H 38 8.991 8.991 8.537 0.454 18321 200 1 . 1 1 39 39 ARG N N 39 124.863 124.863 127.486 -2.623 18321 201 1 . 1 1 39 39 ARG HA H 39 5.444 5.444 4.900 0.544 18321 202 1 . 1 1 39 39 ARG C C 39 175.772 175.772 174.841 0.931 18321 203 1 . 1 1 39 39 ARG CA C 39 52.558 52.558 53.322 -0.764 18321 204 1 . 1 1 39 39 ARG CB C 39 34.980 34.980 32.861 2.119 18321 205 1 . 1 1 39 39 ARG H H 39 9.569 9.569 8.359 1.210 18321 206 1 . 1 1 40 40 ASP N N 40 122.330 122.330 120.451 1.879 18321 207 1 . 1 1 40 40 ASP HA H 40 4.785 4.785 4.995 -0.210 18321 208 1 . 1 1 40 40 ASP C C 40 176.332 176.332 175.979 0.353 18321 209 1 . 1 1 40 40 ASP CA C 40 55.334 55.334 55.095 0.239 18321 210 1 . 1 1 40 40 ASP CB C 40 40.650 40.650 41.806 -1.156 18321 211 1 . 1 1 40 40 ASP H H 40 8.413 8.413 8.400 0.013 18321 212 1 . 1 1 41 41 SER N N 41 114.363 114.363 119.592 -5.229 18321 213 1 . 1 1 41 41 SER HA H 41 4.506 4.506 4.469 0.037 18321 214 1 . 1 1 41 41 SER CA C 41 57.525 57.525 58.487 -0.962 18321 215 1 . 1 1 41 41 SER CB C 41 63.706 63.706 63.724 -0.018 18321 216 1 . 1 1 41 41 SER H H 41 7.791 7.791 8.367 -0.577 18321 217 1 . 1 1 42 42 SER N N 42 126.932 126.932 120.631 6.301 18321 218 1 . 1 1 42 42 SER HA H 42 4.410 4.410 4.535 -0.125 18321 219 1 . 1 1 42 42 SER CA C 42 60.362 60.362 59.762 0.600 18321 220 1 . 1 1 42 42 SER CB C 42 63.707 63.707 63.167 0.541 18321 221 1 . 1 1 42 42 SER H H 42 10.519 10.519 8.738 1.781 18321 222 1 . 1 1 43 43 THR HA H 43 4.097 4.097 4.353 -0.256 18321 223 1 . 1 1 43 43 THR CA C 43 64.722 64.722 63.271 1.451 18321 224 1 . 1 1 43 43 THR CB C 43 69.439 69.439 69.822 -0.383 18321 225 1 . 1 1 44 44 CYS HA H 44 5.100 5.100 4.917 0.183 18321 226 1 . 1 1 44 44 CYS CA C 44 51.779 51.779 56.056 -4.277 18321 227 1 . 1 1 44 44 CYS CB C 44 41.314 41.314 29.780 11.534 18321 228 1 . 1 1 45 45 PRO HA H 45 4.278 4.278 4.375 -0.097 18321 229 1 . 1 1 45 45 PRO C C 45 178.127 178.127 177.196 0.931 18321 230 1 . 1 1 45 45 PRO CA C 45 64.151 64.151 64.443 -0.292 18321 231 1 . 1 1 45 45 PRO CB C 45 31.596 31.596 31.307 0.289 18321 232 1 . 1 1 46 46 GLY N N 46 114.947 114.947 112.235 2.712 18321 233 1 . 1 1 46 46 GLY C C 46 174.701 174.701 173.738 0.963 18321 234 1 . 1 1 46 46 GLY CA C 46 45.225 45.225 44.839 0.386 18321 235 1 . 1 1 46 46 GLY H H 46 8.812 8.812 8.625 0.187 18321 236 1 . 1 1 47 47 ASP N N 47 120.862 120.862 121.329 -0.467 18321 237 1 . 1 1 47 47 ASP HA H 47 5.235 5.235 4.793 0.442 18321 238 1 . 1 1 47 47 ASP C C 47 176.480 176.480 174.930 1.550 18321 239 1 . 1 1 47 47 ASP CA C 47 53.591 53.591 54.167 -0.576 18321 240 1 . 1 1 47 47 ASP CB C 47 41.707 41.707 42.749 -1.042 18321 241 1 . 1 1 47 47 ASP H H 47 7.997 7.997 7.668 0.329 18321 242 1 . 1 1 48 48 TYR N N 48 118.473 118.473 116.439 2.034 18321 243 1 . 1 1 48 48 TYR HA H 48 5.431 5.431 5.285 0.147 18321 244 1 . 1 1 48 48 TYR C C 48 173.783 173.783 175.592 -1.809 18321 245 1 . 1 1 48 48 TYR CA C 48 56.891 56.891 56.404 0.487 18321 246 1 . 1 1 48 48 TYR CB C 48 43.274 43.274 42.753 0.520 18321 247 1 . 1 1 48 48 TYR H H 48 8.892 8.892 9.086 -0.194 18321 248 1 . 1 1 49 49 VAL N N 49 119.105 119.105 119.477 -0.372 18321 249 1 . 1 1 49 49 VAL HA H 49 4.800 4.800 4.580 0.220 18321 250 1 . 1 1 49 49 VAL C C 49 174.397 174.397 174.661 -0.264 18321 251 1 . 1 1 49 49 VAL CA C 49 61.439 61.439 62.063 -0.624 18321 252 1 . 1 1 49 49 VAL CB C 49 35.388 35.388 34.198 1.190 18321 253 1 . 1 1 49 49 VAL H H 49 9.661 9.661 8.674 0.987 18321 254 1 . 1 1 50 50 LEU N N 50 129.599 129.599 131.147 -1.548 18321 255 1 . 1 1 50 50 LEU HA H 50 5.033 5.033 5.105 -0.072 18321 256 1 . 1 1 50 50 LEU C C 50 175.001 175.001 175.432 -0.431 18321 257 1 . 1 1 50 50 LEU CA C 50 53.352 53.352 53.823 -0.471 18321 258 1 . 1 1 50 50 LEU CB C 50 44.062 44.062 42.323 1.739 18321 259 1 . 1 1 50 50 LEU H H 50 9.405 9.405 9.188 0.217 18321 260 1 . 1 1 51 51 SER N N 51 126.895 126.895 124.441 2.454 18321 261 1 . 1 1 51 51 SER HA H 51 5.731 5.731 5.123 0.608 18321 262 1 . 1 1 51 51 SER C C 51 173.094 173.094 173.560 -0.466 18321 263 1 . 1 1 51 51 SER CA C 51 58.834 58.834 57.353 1.481 18321 264 1 . 1 1 51 51 SER CB C 51 64.977 64.977 63.942 1.034 18321 265 1 . 1 1 51 51 SER H H 51 9.094 9.094 9.078 0.016 18321 266 1 . 1 1 52 52 VAL N N 52 121.777 121.777 125.674 -3.897 18321 267 1 . 1 1 52 52 VAL HA H 52 5.066 5.066 4.626 0.440 18321 268 1 . 1 1 52 52 VAL C C 52 174.573 174.573 174.638 -0.065 18321 269 1 . 1 1 52 52 VAL CA C 52 59.535 59.535 60.783 -1.248 18321 270 1 . 1 1 52 52 VAL CB C 52 36.834 36.834 35.297 1.537 18321 271 1 . 1 1 52 52 VAL H H 52 8.816 8.816 8.784 0.032 18321 272 1 . 1 1 53 53 SER N N 53 120.489 120.489 121.558 -1.069 18321 273 1 . 1 1 53 53 SER HA H 53 4.811 4.811 4.778 0.033 18321 274 1 . 1 1 53 53 SER C C 53 174.065 174.065 172.969 1.096 18321 275 1 . 1 1 53 53 SER CA C 53 57.496 57.496 57.697 -0.201 18321 276 1 . 1 1 53 53 SER CB C 53 62.623 62.623 63.257 -0.634 18321 277 1 . 1 1 53 53 SER H H 53 8.780 8.780 9.108 -0.328 18321 278 1 . 1 1 54 54 GLU N N 54 132.020 132.020 127.247 4.773 18321 279 1 . 1 1 54 54 GLU HA H 54 4.250 4.250 4.376 -0.126 18321 280 1 . 1 1 54 54 GLU C C 54 175.387 175.387 175.112 0.275 18321 281 1 . 1 1 54 54 GLU CA C 54 56.999 56.999 55.500 1.500 18321 282 1 . 1 1 54 54 GLU CB C 54 32.556 32.556 33.389 -0.833 18321 283 1 . 1 1 54 54 GLU H H 54 8.472 8.472 7.871 0.601 18321 284 1 . 1 1 55 55 ASN N N 55 126.517 126.517 119.383 7.134 18321 285 1 . 1 1 55 55 ASN HA H 55 4.220 4.220 4.134 0.086 18321 286 1 . 1 1 55 55 ASN C C 55 174.546 174.546 174.797 -0.251 18321 287 1 . 1 1 55 55 ASN CA C 55 54.770 54.770 54.342 0.427 18321 288 1 . 1 1 55 55 ASN CB C 55 37.314 37.314 37.314 -0.000 18321 289 1 . 1 1 55 55 ASN H H 55 8.853 8.853 8.393 0.460 18321 290 1 . 1 1 56 56 SER N N 56 112.009 112.009 109.842 2.167 18321 291 1 . 1 1 56 56 SER HA H 56 4.334 4.334 4.217 0.117 18321 292 1 . 1 1 56 56 SER C C 56 173.354 173.354 173.180 0.174 18321 293 1 . 1 1 56 56 SER CA C 56 59.966 59.966 59.945 0.021 18321 294 1 . 1 1 56 56 SER CB C 56 62.242 62.242 62.812 -0.570 18321 295 1 . 1 1 56 56 SER H H 56 10.418 10.418 8.225 2.193 18321 296 1 . 1 1 57 57 ARG N N 57 121.764 121.764 118.306 3.458 18321 297 1 . 1 1 57 57 ARG HA H 57 5.167 5.167 4.514 0.653 18321 298 1 . 1 1 57 57 ARG C C 57 174.983 174.983 174.205 0.778 18321 299 1 . 1 1 57 57 ARG CA C 57 54.550 54.550 55.384 -0.834 18321 300 1 . 1 1 57 57 ARG CB C 57 31.886 31.886 31.504 0.382 18321 301 1 . 1 1 57 57 ARG H H 57 8.097 8.097 7.894 0.203 18321 302 1 . 1 1 58 58 VAL N N 58 121.866 121.866 122.245 -0.379 18321 303 1 . 1 1 58 58 VAL HA H 58 4.768 4.768 4.501 0.267 18321 304 1 . 1 1 58 58 VAL C C 58 175.388 175.388 175.566 -0.178 18321 305 1 . 1 1 58 58 VAL CA C 58 61.818 61.818 62.020 -0.203 18321 306 1 . 1 1 58 58 VAL CB C 58 34.135 34.135 31.516 2.619 18321 307 1 . 1 1 58 58 VAL H H 58 8.081 8.081 8.079 0.002 18321 308 1 . 1 1 59 59 SER N N 59 124.445 124.445 123.101 1.344 18321 309 1 . 1 1 59 59 SER HA H 59 4.462 4.462 4.321 0.141 18321 310 1 . 1 1 59 59 SER C C 59 172.185 172.185 173.291 -1.106 18321 311 1 . 1 1 59 59 SER CA C 59 56.629 56.629 57.899 -1.270 18321 312 1 . 1 1 59 59 SER CB C 59 66.218 66.218 63.567 2.651 18321 313 1 . 1 1 59 59 SER H H 59 9.082 9.082 8.378 0.704 18321 314 1 . 1 1 60 60 HIS N N 60 121.224 121.224 126.050 -4.826 18321 315 1 . 1 1 60 60 HIS HA H 60 4.885 4.885 4.670 0.215 18321 316 1 . 1 1 60 60 HIS C C 60 174.674 174.674 174.301 0.373 18321 317 1 . 1 1 60 60 HIS CA C 60 54.900 54.900 55.463 -0.563 18321 318 1 . 1 1 60 60 HIS CB C 60 32.331 32.331 29.610 2.721 18321 319 1 . 1 1 60 60 HIS H H 60 8.331 8.331 8.635 -0.304 18321 320 1 . 1 1 61 61 TYR N N 61 124.780 124.780 125.080 -0.300 18321 321 1 . 1 1 61 61 TYR HA H 61 4.655 4.655 4.733 -0.078 18321 322 1 . 1 1 61 61 TYR CA C 61 57.409 57.409 56.756 0.653 18321 323 1 . 1 1 61 61 TYR CB C 61 39.785 39.785 38.344 1.441 18321 324 1 . 1 1 61 61 TYR H H 61 9.273 9.273 9.194 0.079 18321 325 1 . 1 1 62 62 ILE HA H 62 4.298 4.298 4.318 -0.020 18321 326 1 . 1 1 62 62 ILE C C 62 174.817 174.817 175.498 -0.681 18321 327 1 . 1 1 62 62 ILE CA C 62 61.908 61.908 61.540 0.368 18321 328 1 . 1 1 62 62 ILE CB C 62 38.321 38.321 38.743 -0.422 18321 329 1 . 1 1 63 63 ILE N N 63 128.552 128.552 128.391 0.161 18321 330 1 . 1 1 63 63 ILE HA H 63 4.788 4.788 4.714 0.074 18321 331 1 . 1 1 63 63 ILE C C 63 175.982 175.982 174.858 1.124 18321 332 1 . 1 1 63 63 ILE CA C 63 59.629 59.629 60.001 -0.372 18321 333 1 . 1 1 63 63 ILE CB C 63 39.747 39.747 38.946 0.801 18321 334 1 . 1 1 63 63 ILE H H 63 9.155 9.155 8.839 0.316 18321 335 1 . 1 1 64 64 ASN N N 64 123.240 123.240 127.276 -4.036 18321 336 1 . 1 1 64 64 ASN HA H 64 4.857 4.857 5.377 -0.520 18321 337 1 . 1 1 64 64 ASN C C 64 175.324 175.324 174.692 0.632 18321 338 1 . 1 1 64 64 ASN CA C 64 53.736 53.736 53.079 0.657 18321 339 1 . 1 1 64 64 ASN CB C 64 41.531 41.531 40.375 1.156 18321 340 1 . 1 1 64 64 ASN H H 64 9.379 9.379 8.863 0.516 18321 341 1 . 1 1 65 65 SER N N 65 121.157 121.157 118.474 2.683 18321 342 1 . 1 1 65 65 SER HA H 65 4.548 4.548 4.598 -0.050 18321 343 1 . 1 1 65 65 SER C C 65 174.328 174.328 174.481 -0.153 18321 344 1 . 1 1 65 65 SER CA C 65 58.306 58.306 58.078 0.228 18321 345 1 . 1 1 65 65 SER CB C 65 62.878 62.878 63.021 -0.143 18321 346 1 . 1 1 65 65 SER H H 65 9.195 9.195 8.906 0.289 18321 347 1 . 1 1 66 66 LEU N N 66 127.417 127.417 128.965 -1.548 18321 348 1 . 1 1 66 66 LEU HA H 66 4.605 4.605 4.557 0.048 18321 349 1 . 1 1 66 66 LEU CA C 66 52.888 52.888 52.896 -0.008 18321 350 1 . 1 1 66 66 LEU CB C 66 41.799 41.799 41.645 0.154 18321 351 1 . 1 1 66 66 LEU H H 66 8.143 8.143 8.452 -0.309 18321 352 1 . 1 1 68 68 ASN HA H 68 4.386 4.386 4.626 -0.240 18321 353 1 . 1 1 68 68 ASN C C 68 174.487 174.487 175.112 -0.625 18321 354 1 . 1 1 68 68 ASN CA C 68 53.365 53.365 52.923 0.442 18321 355 1 . 1 1 68 68 ASN CB C 68 36.778 36.778 37.703 -0.926 18321 356 1 . 1 1 69 69 ARG N N 69 111.329 111.329 115.067 -3.738 18321 357 1 . 1 1 69 69 ARG HA H 69 3.876 3.876 3.807 0.069 18321 358 1 . 1 1 69 69 ARG CA C 69 57.393 57.393 57.181 0.212 18321 359 1 . 1 1 69 69 ARG CB C 69 26.665 26.665 27.387 -0.722 18321 360 1 . 1 1 69 69 ARG H H 69 8.191 8.191 7.880 0.311 18321 361 1 . 1 1 70 70 ARG N N 70 116.120 116.120 115.233 0.887 18321 362 1 . 1 1 70 70 ARG HA H 70 4.556 4.556 4.898 -0.342 18321 363 1 . 1 1 70 70 ARG C C 70 174.882 174.882 174.170 0.712 18321 364 1 . 1 1 70 70 ARG CA C 70 55.509 55.509 53.701 1.808 18321 365 1 . 1 1 70 70 ARG CB C 70 31.771 31.771 33.592 -1.821 18321 366 1 . 1 1 70 70 ARG H H 70 6.667 6.667 7.284 -0.617 18321 367 1 . 1 1 71 71 PHE N N 71 116.313 116.313 117.761 -1.448 18321 368 1 . 1 1 71 71 PHE HA H 71 5.540 5.540 5.617 -0.077 18321 369 1 . 1 1 71 71 PHE C C 71 174.391 174.391 175.072 -0.681 18321 370 1 . 1 1 71 71 PHE CA C 71 57.528 57.528 56.388 1.140 18321 371 1 . 1 1 71 71 PHE CB C 71 44.115 44.115 42.643 1.472 18321 372 1 . 1 1 71 71 PHE H H 71 8.700 8.700 8.466 0.234 18321 373 1 . 1 1 72 72 LYS N N 72 122.770 122.770 125.457 -2.687 18321 374 1 . 1 1 72 72 LYS HA H 72 5.483 5.483 4.968 0.515 18321 375 1 . 1 1 72 72 LYS C C 72 173.923 173.923 175.335 -1.412 18321 376 1 . 1 1 72 72 LYS CA C 72 54.855 54.855 55.210 -0.355 18321 377 1 . 1 1 72 72 LYS CB C 72 37.710 37.710 34.947 2.763 18321 378 1 . 1 1 72 72 LYS H H 72 9.138 9.138 8.741 0.397 18321 379 1 . 1 1 73 73 ILE N N 73 124.576 124.576 129.303 -4.727 18321 380 1 . 1 1 73 73 ILE HA H 73 4.955 4.955 4.983 -0.028 18321 381 1 . 1 1 73 73 ILE C C 73 175.728 175.728 176.144 -0.416 18321 382 1 . 1 1 73 73 ILE CA C 73 58.935 58.935 60.117 -1.182 18321 383 1 . 1 1 73 73 ILE CB C 73 40.965 40.965 38.617 2.348 18321 384 1 . 1 1 73 73 ILE H H 73 8.826 8.826 8.700 0.126 18321 385 1 . 1 1 74 74 GLY N N 74 118.718 118.718 118.792 -0.074 18321 386 1 . 1 1 74 74 GLY C C 74 174.436 174.436 174.316 0.120 18321 387 1 . 1 1 74 74 GLY CA C 74 47.401 47.401 46.071 1.330 18321 388 1 . 1 1 74 74 GLY H H 74 9.317 9.317 9.051 0.266 18321 389 1 . 1 1 75 75 ASP N N 75 125.691 125.691 118.889 6.802 18321 390 1 . 1 1 75 75 ASP HA H 75 4.713 4.713 4.378 0.335 18321 391 1 . 1 1 75 75 ASP C C 75 175.841 175.841 175.280 0.561 18321 392 1 . 1 1 75 75 ASP CA C 75 53.815 53.815 55.665 -1.850 18321 393 1 . 1 1 75 75 ASP CB C 75 41.288 41.288 41.056 0.232 18321 394 1 . 1 1 75 75 ASP H H 75 8.665 8.665 8.617 0.048 18321 395 1 . 1 1 76 76 GLN N N 76 120.368 120.368 120.722 -0.354 18321 396 1 . 1 1 76 76 GLN C C 76 173.630 173.630 174.688 -1.058 18321 397 1 . 1 1 76 76 GLN CA C 76 54.254 54.254 55.340 -1.086 18321 398 1 . 1 1 76 76 GLN CB C 76 31.248 31.248 29.354 1.894 18321 399 1 . 1 1 76 76 GLN H H 76 8.289 8.289 7.805 0.484 18321 400 1 . 1 1 77 77 GLU N N 77 120.435 120.435 122.684 -2.249 18321 401 1 . 1 1 77 77 GLU C C 77 175.484 175.484 175.120 0.364 18321 402 1 . 1 1 77 77 GLU CA C 77 54.203 54.203 55.158 -0.955 18321 403 1 . 1 1 77 77 GLU CB C 77 33.141 33.141 30.769 2.372 18321 404 1 . 1 1 77 77 GLU H H 77 7.732 7.732 8.228 -0.496 18321 405 1 . 1 1 78 78 PHE N N 78 117.911 117.911 122.933 -5.022 18321 406 1 . 1 1 78 78 PHE HA H 78 4.659 4.659 4.708 -0.049 18321 407 1 . 1 1 78 78 PHE C C 78 175.673 175.673 176.114 -0.441 18321 408 1 . 1 1 78 78 PHE CA C 78 57.160 57.160 56.598 0.562 18321 409 1 . 1 1 78 78 PHE CB C 78 45.405 45.405 41.415 3.990 18321 410 1 . 1 1 78 78 PHE H H 78 9.235 9.235 8.402 0.833 18321 411 1 . 1 1 79 79 ASP N N 79 119.296 119.296 118.684 0.612 18321 412 1 . 1 1 79 79 ASP HA H 79 4.462 4.462 4.514 -0.052 18321 413 1 . 1 1 79 79 ASP C C 79 174.482 174.482 175.703 -1.221 18321 414 1 . 1 1 79 79 ASP CA C 79 56.629 56.629 56.595 0.034 18321 415 1 . 1 1 79 79 ASP CB C 79 41.697 41.697 41.139 0.558 18321 416 1 . 1 1 79 79 ASP H H 79 9.187 9.187 8.783 0.404 18321 417 1 . 1 1 80 80 HIS N N 80 107.631 107.631 111.162 -3.531 18321 418 1 . 1 1 80 80 HIS HA H 80 5.022 5.022 5.100 -0.078 18321 419 1 . 1 1 80 80 HIS C C 80 174.626 174.626 175.136 -0.510 18321 420 1 . 1 1 80 80 HIS CA C 80 54.223 54.223 54.942 -0.719 18321 421 1 . 1 1 80 80 HIS CB C 80 32.205 32.205 31.220 0.985 18321 422 1 . 1 1 80 80 HIS H H 80 7.200 7.200 7.226 -0.026 18321 423 1 . 1 1 81 81 LEU N N 81 120.710 120.710 121.125 -0.415 18321 424 1 . 1 1 81 81 LEU HA H 81 3.804 3.804 4.127 -0.323 18321 425 1 . 1 1 81 81 LEU CA C 81 58.709 58.709 59.936 -1.227 18321 426 1 . 1 1 81 81 LEU CB C 81 39.646 39.646 40.060 -0.414 18321 427 1 . 1 1 81 81 LEU H H 81 8.886 8.886 9.116 -0.230 18321 428 1 . 1 1 82 82 PRO HA H 82 4.020 4.020 4.283 -0.263 18321 429 1 . 1 1 82 82 PRO C C 82 175.619 175.619 176.959 -1.340 18321 430 1 . 1 1 82 82 PRO CA C 82 67.025 67.025 64.758 2.267 18321 431 1 . 1 1 82 82 PRO CB C 82 30.962 30.962 30.878 0.084 18321 432 1 . 1 1 83 83 ALA N N 83 124.281 124.281 119.739 4.542 18321 433 1 . 1 1 83 83 ALA HA H 83 4.019 4.019 4.216 -0.197 18321 434 1 . 1 1 83 83 ALA C C 83 179.709 179.709 178.682 1.027 18321 435 1 . 1 1 83 83 ALA CA C 83 54.985 54.985 53.998 0.988 18321 436 1 . 1 1 83 83 ALA CB C 83 18.425 18.425 18.850 -0.425 18321 437 1 . 1 1 83 83 ALA H H 83 8.527 8.527 7.646 0.881 18321 438 1 . 1 1 84 84 LEU N N 84 122.960 122.960 117.401 5.559 18321 439 1 . 1 1 84 84 LEU HA H 84 1.917 1.917 2.982 -1.065 18321 440 1 . 1 1 84 84 LEU C C 84 177.652 177.652 178.126 -0.474 18321 441 1 . 1 1 84 84 LEU CA C 84 58.261 58.261 57.121 1.140 18321 442 1 . 1 1 84 84 LEU CB C 84 42.544 42.544 41.012 1.532 18321 443 1 . 1 1 84 84 LEU H H 84 6.982 6.982 7.314 -0.332 18321 444 1 . 1 1 85 85 LEU N N 85 117.940 117.940 118.761 -0.821 18321 445 1 . 1 1 85 85 LEU HA H 85 3.463 3.463 3.822 -0.359 18321 446 1 . 1 1 85 85 LEU C C 85 178.809 178.809 178.545 0.264 18321 447 1 . 1 1 85 85 LEU CA C 85 57.522 57.522 57.370 0.152 18321 448 1 . 1 1 85 85 LEU CB C 85 41.242 41.242 41.162 0.080 18321 449 1 . 1 1 85 85 LEU H H 85 7.773 7.773 7.538 0.235 18321 450 1 . 1 1 86 86 GLU N N 86 115.762 115.762 117.899 -2.137 18321 451 1 . 1 1 86 86 GLU HA H 86 3.540 3.540 4.005 -0.465 18321 452 1 . 1 1 86 86 GLU C C 86 180.228 180.228 178.249 1.979 18321 453 1 . 1 1 86 86 GLU CA C 86 58.943 58.943 58.218 0.725 18321 454 1 . 1 1 86 86 GLU CB C 86 29.561 29.561 29.488 0.073 18321 455 1 . 1 1 86 86 GLU H H 86 8.300 8.300 7.587 0.713 18321 456 1 . 1 1 87 87 PHE N N 87 121.135 121.135 120.552 0.583 18321 457 1 . 1 1 87 87 PHE HA H 87 4.122 4.122 4.200 -0.078 18321 458 1 . 1 1 87 87 PHE C C 87 179.497 179.497 176.936 2.561 18321 459 1 . 1 1 87 87 PHE CA C 87 62.090 62.090 60.120 1.970 18321 460 1 . 1 1 87 87 PHE CB C 87 40.103 40.103 39.348 0.755 18321 461 1 . 1 1 87 87 PHE H H 87 7.717 7.717 7.379 0.338 18321 462 1 . 1 1 88 88 TYR N N 88 116.579 116.579 117.445 -0.867 18321 463 1 . 1 1 88 88 TYR HA H 88 4.933 4.933 4.242 0.691 18321 464 1 . 1 1 88 88 TYR C C 88 174.799 174.799 176.807 -2.008 18321 465 1 . 1 1 88 88 TYR CA C 88 61.333 61.333 58.623 2.710 18321 466 1 . 1 1 88 88 TYR CB C 88 36.539 36.539 37.013 -0.474 18321 467 1 . 1 1 88 88 TYR H H 88 7.478 7.478 7.801 -0.323 18321 468 1 . 1 1 89 89 LYS N N 89 117.737 117.737 118.984 -1.247 18321 469 1 . 1 1 89 89 LYS HA H 89 4.466 4.466 4.032 0.434 18321 470 1 . 1 1 89 89 LYS C C 89 178.417 178.417 176.900 1.517 18321 471 1 . 1 1 89 89 LYS CA C 89 59.486 59.486 58.569 0.917 18321 472 1 . 1 1 89 89 LYS CB C 89 34.523 34.523 32.523 2.000 18321 473 1 . 1 1 89 89 LYS H H 89 7.505 7.505 7.534 -0.029 18321 474 1 . 1 1 90 90 ILE N N 90 110.972 110.972 110.885 0.087 18321 475 1 . 1 1 90 90 ILE HA H 90 4.181 4.181 4.155 0.026 18321 476 1 . 1 1 90 90 ILE C C 90 174.571 174.571 175.754 -1.183 18321 477 1 . 1 1 90 90 ILE CA C 90 60.516 60.516 61.123 -0.607 18321 478 1 . 1 1 90 90 ILE CB C 90 39.979 39.979 38.134 1.845 18321 479 1 . 1 1 90 90 ILE H H 90 6.710 6.710 7.200 -0.490 18321 480 1 . 1 1 91 91 HIS N N 91 119.479 119.479 120.133 -0.654 18321 481 1 . 1 1 91 91 HIS HA H 91 4.357 4.357 4.391 -0.034 18321 482 1 . 1 1 91 91 HIS C C 91 172.751 172.751 174.796 -2.045 18321 483 1 . 1 1 91 91 HIS CA C 91 55.066 55.066 56.559 -1.493 18321 484 1 . 1 1 91 91 HIS CB C 91 29.756 29.756 31.453 -1.697 18321 485 1 . 1 1 91 91 HIS H H 91 7.460 7.460 7.297 0.163 18321 486 1 . 1 1 92 92 TYR N N 92 117.642 117.642 116.889 0.753 18321 487 1 . 1 1 92 92 TYR HA H 92 4.131 4.131 4.354 -0.223 18321 488 1 . 1 1 92 92 TYR C C 92 177.348 177.348 175.814 1.534 18321 489 1 . 1 1 92 92 TYR CA C 92 58.627 58.627 58.524 0.103 18321 490 1 . 1 1 92 92 TYR CB C 92 39.481 39.481 36.151 3.330 18321 491 1 . 1 1 92 92 TYR H H 92 8.067 8.067 7.722 0.345 18321 492 1 . 1 1 93 93 LEU N N 93 123.560 123.560 120.152 3.408 18321 493 1 . 1 1 93 93 LEU HA H 93 4.104 4.104 4.218 -0.114 18321 494 1 . 1 1 93 93 LEU C C 93 175.610 175.610 177.303 -1.693 18321 495 1 . 1 1 93 93 LEU CA C 93 56.381 56.381 56.574 -0.193 18321 496 1 . 1 1 93 93 LEU CB C 93 38.896 38.896 41.951 -3.055 18321 497 1 . 1 1 93 93 LEU H H 93 7.907 7.907 8.205 -0.298 18321 498 1 . 1 1 94 94 ASP N N 94 118.194 118.194 115.327 2.867 18321 499 1 . 1 1 94 94 ASP HA H 94 4.940 4.940 4.750 0.190 18321 500 1 . 1 1 94 94 ASP C C 94 176.123 176.123 176.107 0.016 18321 501 1 . 1 1 94 94 ASP CA C 94 56.235 56.235 54.478 1.756 18321 502 1 . 1 1 94 94 ASP CB C 94 42.078 42.078 41.415 0.663 18321 503 1 . 1 1 94 94 ASP H H 94 8.640 8.640 7.997 0.643 18321 504 1 . 1 1 95 95 THR N N 95 105.073 105.073 113.167 -8.094 18321 505 1 . 1 1 95 95 THR HA H 95 4.318 4.318 4.245 0.073 18321 506 1 . 1 1 95 95 THR C C 95 174.685 174.685 173.644 1.041 18321 507 1 . 1 1 95 95 THR CA C 95 60.756 60.756 63.428 -2.672 18321 508 1 . 1 1 95 95 THR CB C 95 71.058 71.058 69.025 2.033 18321 509 1 . 1 1 95 95 THR H H 95 8.576 8.576 8.224 0.352 18321 510 1 . 1 1 96 96 THR N N 96 116.817 116.817 114.698 2.119 18321 511 1 . 1 1 96 96 THR HA H 96 5.129 5.129 4.806 0.323 18321 512 1 . 1 1 96 96 THR C C 96 172.464 172.464 173.071 -0.607 18321 513 1 . 1 1 96 96 THR CA C 96 60.762 60.762 60.956 -0.194 18321 514 1 . 1 1 96 96 THR CB C 96 71.425 71.425 70.737 0.688 18321 515 1 . 1 1 96 96 THR H H 96 8.205 8.205 7.814 0.391 18321 516 1 . 1 1 97 97 THR N N 97 114.324 114.324 113.198 1.126 18321 517 1 . 1 1 97 97 THR HA H 97 5.128 5.128 4.350 0.778 18321 518 1 . 1 1 97 97 THR C C 97 175.480 175.480 174.181 1.299 18321 519 1 . 1 1 97 97 THR CA C 97 60.233 60.233 60.239 -0.006 18321 520 1 . 1 1 97 97 THR CB C 97 70.415 70.415 70.034 0.381 18321 521 1 . 1 1 97 97 THR H H 97 7.128 7.128 8.075 -0.947 18321 522 1 . 1 1 98 98 LEU N N 98 116.674 116.674 122.165 -5.491 18321 523 1 . 1 1 98 98 LEU HA H 98 4.075 4.075 4.082 -0.007 18321 524 1 . 1 1 98 98 LEU C C 98 177.892 177.892 176.717 1.175 18321 525 1 . 1 1 98 98 LEU CA C 98 59.597 59.597 55.138 4.459 18321 526 1 . 1 1 98 98 LEU CB C 98 41.172 41.172 40.552 0.620 18321 527 1 . 1 1 98 98 LEU H H 98 8.743 8.743 8.015 0.727 18321 528 1 . 1 1 99 99 ILE N N 99 122.988 122.988 123.022 -0.034 18321 529 1 . 1 1 99 99 ILE HA H 99 4.415 4.415 4.197 0.218 18321 530 1 . 1 1 99 99 ILE C C 99 175.055 175.055 176.015 -0.960 18321 531 1 . 1 1 99 99 ILE CA C 99 62.183 62.183 61.838 0.345 18321 532 1 . 1 1 99 99 ILE CB C 99 40.252 40.252 38.810 1.442 18321 533 1 . 1 1 99 99 ILE H H 99 8.998 8.998 8.161 0.837 18321 534 1 . 1 1 100 100 GLU N N 100 114.067 114.067 114.973 -0.906 18321 535 1 . 1 1 100 100 GLU CA C 100 52.910 52.910 53.483 -0.573 18321 536 1 . 1 1 100 100 GLU CB C 100 31.155 31.155 31.351 -0.196 18321 537 1 . 1 1 100 100 GLU H H 100 7.332 7.332 7.919 -0.587 18321 538 1 . 1 1 101 101 PRO HA H 101 4.952 4.952 3.777 1.175 18321 539 1 . 1 1 101 101 PRO C C 101 175.976 175.976 175.997 -0.021 18321 540 1 . 1 1 101 101 PRO CA C 101 53.312 53.312 61.942 -8.630 18321 541 1 . 1 1 101 101 PRO CB C 101 31.598 31.598 32.075 -0.477 18321 542 1 . 1 1 102 102 ALA N N 102 125.968 125.968 123.421 2.547 18321 543 1 . 1 1 102 102 ALA HA H 102 4.516 4.516 4.357 0.159 18321 544 1 . 1 1 102 102 ALA CA C 102 49.852 49.852 50.016 -0.164 18321 545 1 . 1 1 102 102 ALA CB C 102 17.766 17.766 18.258 -0.492 18321 546 1 . 1 1 102 102 ALA H H 102 8.232 8.232 8.025 0.207 18321 547 1 . 1 1 103 103 PRO HA H 103 4.283 4.283 4.352 -0.069 18321 548 1 . 1 1 103 103 PRO CA C 103 62.435 62.435 63.062 -0.627 18321 549 1 . 1 1 103 103 PRO CB C 103 32.145 32.145 31.948 0.197 18321 550 1 . 1 1 104 104 ARG HA H 104 4.004 4.004 4.173 -0.169 18321 551 1 . 1 1 104 104 ARG CA C 104 56.660 56.660 57.354 -0.694 18321 552 1 . 1 1 106 106 PRO C C 106 174.587 174.587 175.974 -1.387 18321 553 1 . 1 1 106 106 PRO CA C 106 57.867 57.867 63.040 -5.173 18321 554 1 . 1 1 106 106 PRO CB C 106 31.942 31.942 31.792 0.150 18321 555 1 . 1 1 107 107 SER N N 107 121.280 121.280 117.938 3.342 18321 556 1 . 1 1 107 107 SER CA C 107 61.772 61.772 57.395 4.377 18321 557 1 . 1 1 107 107 SER CB C 107 63.234 63.234 63.138 0.096 18321 558 1 . 1 1 107 107 SER H H 107 8.132 8.132 8.242 -0.111 18321 559 1 . 1 1 109 109 PRO C C 109 177.129 177.129 176.511 0.618 18321 560 1 . 1 1 109 109 PRO CA C 109 62.638 62.638 63.329 -0.691 18321 561 1 . 1 1 109 109 PRO CB C 109 30.970 30.970 31.861 -0.891 18321 562 1 . 1 1 110 110 MET N N 110 120.772 120.772 119.721 1.051 18321 563 1 . 1 1 110 110 MET C C 110 176.892 176.892 176.152 0.740 18321 564 1 . 1 1 110 110 MET CA C 110 55.310 55.310 55.624 -0.314 18321 565 1 . 1 1 110 110 MET CB C 110 32.202 32.202 32.946 -0.744 18321 566 1 . 1 1 110 110 MET H H 110 8.430 8.430 8.167 0.263 18321 567 1 . 1 1 111 111 GLY N N 111 110.158 110.158 109.660 0.498 18321 568 1 . 1 1 111 111 GLY C C 111 177.430 177.430 173.937 3.493 18321 569 1 . 1 1 111 111 GLY CA C 111 44.951 44.951 44.979 -0.028 18321 570 1 . 1 1 111 111 GLY H H 111 8.384 8.384 8.220 0.164 18321 571 1 . 1 1 112 112 SER N N 112 116.762 116.762 117.404 -0.642 18321 572 1 . 1 1 112 112 SER CA C 112 55.948 55.948 58.147 -2.199 18321 573 1 . 1 1 112 112 SER CB C 112 62.745 62.745 63.538 -0.793 18321 574 1 . 1 1 112 112 SER H H 112 8.161 8.161 8.161 0.000 18321 575 1 . 1 1 113 113 VAL C C 113 176.083 176.083 175.830 0.253 18321 576 1 . 1 1 114 114 SER N N 114 119.151 119.151 119.400 -0.249 18321 577 1 . 1 1 114 114 SER C C 114 173.638 173.638 173.868 -0.230 18321 578 1 . 1 1 114 114 SER CA C 114 58.005 58.005 58.328 -0.323 18321 579 1 . 1 1 114 114 SER CB C 114 63.169 63.169 63.400 -0.231 18321 580 1 . 1 1 114 114 SER H H 114 8.319 8.319 8.369 -0.050 18321 581 1 . 1 1 115 115 ALA N N 115 126.914 126.914 125.561 1.353 18321 582 1 . 1 1 115 115 ALA CA C 115 51.561 51.561 51.170 0.391 18321 583 1 . 1 1 115 115 ALA CB C 115 17.714 17.714 18.716 -1.002 18321 584 1 . 1 1 115 115 ALA H H 115 8.197 8.197 7.941 0.256 18321 585 1 . 1 1 119 119 PRO C C 119 177.065 177.065 176.679 0.386 18321 586 1 . 1 1 120 120 THR N N 120 113.976 113.976 114.372 -0.396 18321 587 1 . 1 1 120 120 THR C C 120 174.461 174.461 173.816 0.645 18321 588 1 . 1 1 120 120 THR CA C 120 61.215 61.215 62.523 -1.308 18321 589 1 . 1 1 120 120 THR CB C 120 69.508 69.508 69.413 0.095 18321 590 1 . 1 1 120 120 THR H H 120 8.138 8.138 8.200 -0.062 18321 591 1 . 1 1 121 121 ALA N N 121 125.859 125.859 126.032 -0.173 18321 592 1 . 1 1 121 121 ALA CA C 121 52.281 52.281 52.076 0.205 18321 593 1 . 1 1 121 121 ALA CB C 121 18.623 18.623 19.368 -0.745 18321 594 1 . 1 1 121 121 ALA H H 121 8.272 8.272 8.241 0.031 18321 595 1 . 1 1 122 122 GLU C C 122 176.316 176.316 175.846 0.470 18321 596 1 . 1 1 123 123 ASP N N 123 120.448 120.448 120.287 0.161 18321 597 1 . 1 1 123 123 ASP C C 123 175.906 175.906 175.255 0.651 18321 598 1 . 1 1 123 123 ASP CA C 123 54.167 54.167 54.960 -0.793 18321 599 1 . 1 1 123 123 ASP CB C 123 40.695 40.695 41.122 -0.427 18321 600 1 . 1 1 123 123 ASP H H 123 8.181 8.181 8.462 -0.281 18321 601 1 . 1 1 124 124 ASN N N 124 118.207 118.207 117.389 0.818 18321 602 1 . 1 1 124 124 ASN C C 124 174.851 174.851 174.018 0.833 18321 603 1 . 1 1 124 124 ASN CA C 124 52.771 52.771 53.059 -0.288 18321 604 1 . 1 1 124 124 ASN CB C 124 38.304 38.304 39.712 -1.408 18321 605 1 . 1 1 124 124 ASN H H 124 8.307 8.307 8.143 0.164 18321 606 1 . 1 1 125 125 LEU N N 125 121.311 121.311 120.878 0.433 18321 607 1 . 1 1 125 125 LEU C C 125 175.750 175.750 175.683 0.067 18321 608 1 . 1 1 125 125 LEU CA C 125 54.428 54.428 55.527 -1.099 18321 609 1 . 1 1 125 125 LEU CB C 125 41.350 41.350 40.535 0.815 18321 610 1 . 1 1 125 125 LEU H H 125 7.747 7.747 8.482 -0.735 18321 611 1 . 1 1 126 126 GLU N N 126 122.485 122.485 119.404 3.081 18321 612 1 . 1 1 126 126 GLU C C 126 174.008 174.008 174.178 -0.170 18321 613 1 . 1 1 126 126 GLU CA C 126 54.855 54.855 56.656 -1.800 18321 614 1 . 1 1 126 126 GLU CB C 126 30.472 30.472 30.826 -0.354 18321 615 1 . 1 1 126 126 GLU H H 126 8.453 8.453 8.164 0.289 18321 616 1 . 1 1 127 127 TYR N N 127 122.713 122.713 120.219 2.494 18321 617 1 . 1 1 127 127 TYR C C 127 176.859 176.859 174.826 2.033 18321 618 1 . 1 1 127 127 TYR CA C 127 56.528 56.528 57.290 -0.761 18321 619 1 . 1 1 127 127 TYR CB C 127 40.982 40.982 39.797 1.185 18321 620 1 . 1 1 127 127 TYR H H 127 8.469 8.469 8.138 0.331 18321 621 1 . 1 1 128 128 VAL N N 128 112.432 112.432 124.061 -11.629 18321 622 1 . 1 1 128 128 VAL C C 128 173.150 173.150 174.350 -1.200 18321 623 1 . 1 1 128 128 VAL CA C 128 57.940 57.940 60.619 -2.679 18321 624 1 . 1 1 128 128 VAL CB C 128 34.935 34.935 35.558 -0.623 18321 625 1 . 1 1 128 128 VAL H H 128 9.078 9.078 9.010 0.068 18321 626 1 . 1 1 129 129 ARG N N 129 120.373 120.373 123.778 -3.405 18321 627 1 . 1 1 129 129 ARG C C 129 176.539 176.539 175.481 1.058 18321 628 1 . 1 1 129 129 ARG CA C 129 52.534 52.534 53.920 -1.386 18321 629 1 . 1 1 129 129 ARG CB C 129 32.942 32.942 33.093 -0.151 18321 630 1 . 1 1 129 129 ARG H H 129 9.010 9.010 8.366 0.644 18321 631 1 . 1 1 130 130 THR N N 130 116.637 116.637 113.241 3.396 18321 632 1 . 1 1 130 130 THR CA C 130 60.618 60.618 60.893 -0.275 18321 633 1 . 1 1 130 130 THR CB C 130 69.170 69.170 70.411 -1.241 18321 634 1 . 1 1 130 130 THR H H 130 9.045 9.045 8.748 0.297 18321 635 1 . 1 1 131 131 LEU N N 131 122.910 122.910 123.248 -0.338 18321 636 1 . 1 1 131 131 LEU C C 131 175.269 175.269 177.362 -2.093 18321 637 1 . 1 1 131 131 LEU CA C 131 55.122 55.122 55.432 -0.310 18321 638 1 . 1 1 131 131 LEU CB C 131 43.108 43.108 42.578 0.530 18321 639 1 . 1 1 131 131 LEU H H 131 9.224 9.224 8.502 0.722 18321 640 1 . 1 1 132 132 TYR N N 132 112.885 112.885 119.131 -6.246 18321 641 1 . 1 1 132 132 TYR C C 132 173.818 173.818 175.521 -1.703 18321 642 1 . 1 1 132 132 TYR CA C 132 54.230 54.230 59.381 -5.151 18321 643 1 . 1 1 132 132 TYR CB C 132 42.672 42.672 40.192 2.480 18321 644 1 . 1 1 132 132 TYR H H 132 7.284 7.284 7.721 -0.437 18321 645 1 . 1 1 133 133 ASP N N 133 118.003 118.003 119.294 -1.291 18321 646 1 . 1 1 133 133 ASP C C 133 175.779 175.779 174.334 1.445 18321 647 1 . 1 1 133 133 ASP CA C 133 54.351 54.351 55.416 -1.065 18321 648 1 . 1 1 133 133 ASP CB C 133 41.241 41.241 40.096 1.144 18321 649 1 . 1 1 133 133 ASP H H 133 8.399 8.399 8.383 0.016 18321 650 1 . 1 1 134 134 PHE N N 134 121.081 121.081 123.615 -2.534 18321 651 1 . 1 1 134 134 PHE CA C 134 52.552 52.552 54.944 -2.392 18321 652 1 . 1 1 134 134 PHE CB C 134 41.217 41.217 41.719 -0.502 18321 653 1 . 1 1 134 134 PHE H H 134 8.797 8.797 7.364 1.433 18321 654 1 . 1 1 136 136 GLY C C 136 171.616 171.616 174.676 -3.060 18321 655 1 . 1 1 137 137 ASN N N 137 119.394 119.394 116.617 2.777 18321 656 1 . 1 1 137 137 ASN C C 137 174.500 174.500 173.735 0.765 18321 657 1 . 1 1 137 137 ASN CA C 137 44.670 44.670 54.326 -9.656 18321 658 1 . 1 1 137 137 ASN H H 137 9.477 9.477 8.269 1.208 18321 659 1 . 1 1 138 138 ASP N N 138 120.608 120.608 118.765 1.843 18321 660 1 . 1 1 138 138 ASP C C 138 176.987 176.987 174.655 2.333 18321 661 1 . 1 1 138 138 ASP CA C 138 52.992 52.992 52.976 0.016 18321 662 1 . 1 1 138 138 ASP H H 138 8.216 8.216 7.966 0.250 18321 663 1 . 1 1 139 139 ALA N N 139 124.371 124.371 121.149 3.222 18321 664 1 . 1 1 139 139 ALA C C 139 178.472 178.472 178.155 0.318 18321 665 1 . 1 1 139 139 ALA CA C 139 54.513 54.513 53.388 1.125 18321 666 1 . 1 1 139 139 ALA CB C 139 18.045 18.045 19.685 -1.640 18321 667 1 . 1 1 139 139 ALA H H 139 8.565 8.565 8.537 0.028 18321 668 1 . 1 1 140 140 GLU N N 140 115.022 115.022 117.685 -2.663 18321 669 1 . 1 1 140 140 GLU C C 140 177.027 177.027 175.427 1.600 18321 670 1 . 1 1 140 140 GLU CA C 140 56.181 56.181 57.271 -1.090 18321 671 1 . 1 1 140 140 GLU CB C 140 28.619 28.619 30.929 -2.310 18321 672 1 . 1 1 140 140 GLU H H 140 8.616 8.616 8.373 0.243 18321 673 1 . 1 1 141 141 ASP N N 141 121.913 121.913 120.061 1.852 18321 674 1 . 1 1 141 141 ASP C C 141 175.923 175.923 174.743 1.180 18321 675 1 . 1 1 141 141 ASP CA C 141 54.736 54.736 53.548 1.188 18321 676 1 . 1 1 141 141 ASP CB C 141 41.305 41.305 42.725 -1.420 18321 677 1 . 1 1 141 141 ASP H H 141 7.636 7.636 7.968 -0.332 18321 678 1 . 1 1 142 142 LEU N N 142 127.651 127.651 126.217 1.434 18321 679 1 . 1 1 142 142 LEU CA C 142 50.955 50.955 52.590 -1.635 18321 680 1 . 1 1 142 142 LEU CB C 142 42.343 42.343 43.828 -1.485 18321 681 1 . 1 1 142 142 LEU H H 142 9.479 9.479 8.198 1.281 18321 682 1 . 1 1 143 143 PRO C C 143 177.924 177.924 175.785 2.139 18321 683 1 . 1 1 144 144 PHE N N 144 114.483 114.483 120.883 -6.400 18321 684 1 . 1 1 144 144 PHE C C 144 175.055 175.055 174.851 0.204 18321 685 1 . 1 1 144 144 PHE CA C 144 55.543 55.543 55.221 0.322 18321 686 1 . 1 1 144 144 PHE CB C 144 40.581 40.581 41.033 -0.452 18321 687 1 . 1 1 144 144 PHE H H 144 8.637 8.637 7.430 1.207 18321 688 1 . 1 1 145 145 LYS N N 145 121.342 121.342 119.186 2.156 18321 689 1 . 1 1 145 145 LYS C C 145 176.925 176.925 177.573 -0.648 18321 690 1 . 1 1 145 145 LYS CA C 145 53.043 53.043 54.280 -1.237 18321 691 1 . 1 1 145 145 LYS CB C 145 33.804 33.804 35.279 -1.474 18321 692 1 . 1 1 145 145 LYS H H 145 9.418 9.418 8.630 0.788 18321 693 1 . 1 1 146 146 LYS N N 146 123.378 123.378 119.502 3.876 18321 694 1 . 1 1 146 146 LYS CA C 146 57.883 57.883 56.822 1.062 18321 695 1 . 1 1 146 146 LYS CB C 146 32.008 32.008 31.778 0.230 18321 696 1 . 1 1 146 146 LYS H H 146 9.002 9.002 8.690 0.312 18321 697 1 . 1 1 147 147 GLY C C 147 174.315 174.315 173.313 1.002 18321 698 1 . 1 1 148 148 GLU N N 148 121.392 121.392 119.798 1.594 18321 699 1 . 1 1 148 148 GLU C C 148 174.998 174.998 175.201 -0.203 18321 700 1 . 1 1 148 148 GLU CA C 148 56.867 56.867 54.575 2.292 18321 701 1 . 1 1 148 148 GLU CB C 148 31.649 31.649 31.617 0.032 18321 702 1 . 1 1 148 148 GLU H H 148 7.937 7.937 7.748 0.189 18321 703 1 . 1 1 149 149 ILE N N 149 120.124 120.124 121.615 -1.491 18321 704 1 . 1 1 149 149 ILE C C 149 176.647 176.647 175.006 1.641 18321 705 1 . 1 1 149 149 ILE CA C 149 58.621 58.621 60.310 -1.689 18321 706 1 . 1 1 149 149 ILE CB C 149 36.952 36.952 38.665 -1.713 18321 707 1 . 1 1 149 149 ILE H H 149 8.346 8.346 8.537 -0.191 18321 708 1 . 1 1 150 150 LEU N N 150 126.950 126.950 125.320 1.630 18321 709 1 . 1 1 150 150 LEU CA C 150 51.967 51.967 52.843 -0.876 18321 710 1 . 1 1 150 150 LEU CB C 150 44.182 44.182 45.695 -1.513 18321 711 1 . 1 1 150 150 LEU H H 150 8.988 8.988 9.141 -0.153 18321 712 1 . 1 1 151 151 VAL C C 151 175.670 175.670 175.735 -0.065 18321 713 1 . 1 1 152 152 ILE N N 152 124.997 124.997 128.808 -3.811 18321 714 1 . 1 1 152 152 ILE CA C 152 58.331 58.331 60.016 -1.685 18321 715 1 . 1 1 152 152 ILE CB C 152 34.093 34.093 34.848 -0.755 18321 716 1 . 1 1 152 152 ILE H H 152 8.673 8.673 8.521 0.152 18321 717 1 . 1 1 153 153 ILE N N 153 124.710 124.710 127.380 -2.670 18321 718 1 . 1 1 153 153 ILE C C 153 176.264 176.264 175.142 1.122 18321 719 1 . 1 1 154 154 GLU N N 154 117.398 117.398 117.658 -0.260 18321 720 1 . 1 1 154 154 GLU C C 154 173.959 173.959 174.393 -0.434 18321 721 1 . 1 1 154 154 GLU CA C 154 55.289 55.289 54.836 0.453 18321 722 1 . 1 1 154 154 GLU CB C 154 32.842 32.842 32.732 0.110 18321 723 1 . 1 1 154 154 GLU H H 154 7.818 7.818 8.275 -0.457 18321 724 1 . 1 1 155 155 LYS N N 155 121.130 121.130 123.941 -2.811 18321 725 1 . 1 1 155 155 LYS CA C 155 53.022 53.022 52.755 0.267 18321 726 1 . 1 1 155 155 LYS CB C 155 32.663 32.663 33.063 -0.400 18321 727 1 . 1 1 155 155 LYS H H 155 8.654 8.654 8.865 -0.211 18321 728 1 . 1 1 157 157 GLU C C 157 175.190 175.190 176.073 -0.883 18321 729 1 . 1 1 157 157 GLU CA C 157 53.785 53.785 54.363 -0.578 18321 730 1 . 1 1 157 157 GLU CB C 157 32.685 32.685 31.810 0.875 18321 731 1 . 1 1 158 158 GLU N N 158 117.425 117.425 118.977 -1.552 18321 732 1 . 1 1 158 158 GLU C C 158 178.600 178.600 177.248 1.352 18321 733 1 . 1 1 158 158 GLU CA C 158 59.044 59.044 58.106 0.938 18321 734 1 . 1 1 158 158 GLU CB C 158 29.706 29.706 30.122 -0.416 18321 735 1 . 1 1 158 158 GLU H H 158 8.678 8.678 8.804 -0.126 18321 736 1 . 1 1 159 159 GLN N N 159 110.925 110.925 117.302 -6.377 18321 737 1 . 1 1 159 159 GLN C C 159 175.539 175.539 175.052 0.487 18321 738 1 . 1 1 159 159 GLN CA C 159 54.942 54.942 56.748 -1.806 18321 739 1 . 1 1 159 159 GLN CB C 159 28.572 28.572 29.638 -1.066 18321 740 1 . 1 1 159 159 GLN H H 159 8.483 8.483 8.373 0.110 18321 741 1 . 1 1 160 160 TRP N N 160 120.171 120.171 119.198 0.973 18321 742 1 . 1 1 160 160 TRP C C 160 173.444 173.444 174.839 -1.395 18321 743 1 . 1 1 160 160 TRP CA C 160 56.175 56.175 56.165 0.010 18321 744 1 . 1 1 160 160 TRP CB C 160 31.796 31.796 32.378 -0.582 18321 745 1 . 1 1 160 160 TRP H H 160 6.826 6.826 7.660 -0.834 18321 746 1 . 1 1 161 161 TRP N N 161 120.687 120.687 121.693 -1.006 18321 747 1 . 1 1 161 161 TRP C C 161 174.736 174.736 175.848 -1.112 18321 748 1 . 1 1 161 161 TRP CA C 161 51.889 51.889 54.628 -2.739 18321 749 1 . 1 1 161 161 TRP CB C 161 32.772 32.772 31.882 0.890 18321 750 1 . 1 1 161 161 TRP H H 161 8.462 8.462 9.417 -0.955 18321 751 1 . 1 1 162 162 SER N N 162 115.691 115.691 120.031 -4.340 18321 752 1 . 1 1 162 162 SER C C 162 174.320 174.320 173.406 0.914 18321 753 1 . 1 1 162 162 SER CA C 162 57.011 57.011 58.423 -1.412 18321 754 1 . 1 1 162 162 SER CB C 162 63.948 63.948 63.173 0.775 18321 755 1 . 1 1 162 162 SER H H 162 8.830 8.830 9.113 -0.283 18321 756 1 . 1 1 163 163 ALA N N 163 130.630 130.630 128.294 2.336 18321 757 1 . 1 1 163 163 ALA CA C 163 50.029 50.029 49.954 0.075 18321 758 1 . 1 1 163 163 ALA CB C 163 25.500 25.500 22.366 3.134 18321 759 1 . 1 1 163 163 ALA H H 163 9.585 9.585 9.119 0.466 18321 760 1 . 1 1 164 164 ARG N N 164 117.526 117.526 120.795 -3.269 18321 761 1 . 1 1 164 164 ARG C C 164 176.719 176.719 176.614 0.105 18321 762 1 . 1 1 164 164 ARG CA C 164 52.975 52.975 54.219 -1.244 18321 763 1 . 1 1 164 164 ARG CB C 164 34.260 34.260 30.915 3.344 18321 764 1 . 1 1 164 164 ARG H H 164 9.097 9.097 8.923 0.174 18321 765 1 . 1 1 165 165 ASN N N 165 123.935 123.935 122.669 1.266 18321 766 1 . 1 1 165 165 ASN C C 165 178.484 178.484 176.698 1.786 18321 767 1 . 1 1 165 165 ASN CA C 165 50.332 50.332 53.779 -3.447 18321 768 1 . 1 1 165 165 ASN CB C 165 39.487 39.487 39.690 -0.203 18321 769 1 . 1 1 165 165 ASN H H 165 8.756 8.756 8.901 -0.145 18321 770 1 . 1 1 166 166 LYS N N 166 118.464 118.464 120.542 -2.078 18321 771 1 . 1 1 166 166 LYS C C 166 176.967 176.967 177.267 -0.300 18321 772 1 . 1 1 166 166 LYS CA C 166 58.430 58.430 58.573 -0.143 18321 773 1 . 1 1 166 166 LYS CB C 166 30.918 30.918 32.292 -1.374 18321 774 1 . 1 1 166 166 LYS H H 166 8.915 8.915 9.033 -0.118 18321 775 1 . 1 1 167 167 ASP N N 167 118.138 118.138 115.955 2.183 18321 776 1 . 1 1 167 167 ASP C C 167 176.464 176.464 176.840 -0.376 18321 777 1 . 1 1 167 167 ASP CA C 167 54.212 54.212 54.941 -0.729 18321 778 1 . 1 1 167 167 ASP CB C 167 41.178 41.178 41.139 0.039 18321 779 1 . 1 1 167 167 ASP H H 167 7.508 7.508 8.272 -0.764 18321 780 1 . 1 1 168 168 GLY N N 168 107.901 107.901 107.155 0.746 18321 781 1 . 1 1 168 168 GLY C C 168 173.613 173.613 173.427 0.186 18321 782 1 . 1 1 168 168 GLY CA C 168 44.783 44.783 44.938 -0.155 18321 783 1 . 1 1 168 168 GLY H H 168 8.173 8.173 8.010 0.163 18321 784 1 . 1 1 169 169 ARG N N 169 124.324 124.324 120.624 3.700 18321 785 1 . 1 1 169 169 ARG CA C 169 56.106 56.106 55.644 0.462 18321 786 1 . 1 1 169 169 ARG CB C 169 29.648 29.648 31.702 -2.054 18321 787 1 . 1 1 169 169 ARG H H 169 7.998 7.998 8.019 -0.021 18321 788 1 . 1 1 170 170 VAL C C 170 177.590 177.590 175.111 2.479 18321 789 1 . 1 1 171 171 GLY N N 171 112.582 112.582 113.344 -0.762 18321 790 1 . 1 1 171 171 GLY C C 171 170.991 170.991 172.523 -1.532 18321 791 1 . 1 1 171 171 GLY CA C 171 45.361 45.361 44.806 0.555 18321 792 1 . 1 1 171 171 GLY H H 171 9.013 9.013 8.617 0.396 18321 793 1 . 1 1 172 172 MET N N 172 117.368 117.368 120.924 -3.556 18321 794 1 . 1 1 172 172 MET C C 172 177.921 177.921 176.467 1.454 18321 795 1 . 1 1 172 172 MET CA C 172 53.536 53.536 55.667 -2.132 18321 796 1 . 1 1 172 172 MET CB C 172 30.838 30.838 33.441 -2.603 18321 797 1 . 1 1 172 172 MET H H 172 8.885 8.885 8.668 0.217 18321 798 1 . 1 1 173 173 ILE N N 173 113.130 113.130 118.122 -4.992 18321 799 1 . 1 1 173 173 ILE CA C 173 56.284 56.284 57.893 -1.609 18321 800 1 . 1 1 173 173 ILE CB C 173 40.870 40.870 40.593 0.277 18321 801 1 . 1 1 173 173 ILE H H 173 9.704 9.704 9.385 0.319 18321 802 1 . 1 1 174 174 PRO C C 174 176.714 176.714 177.629 -0.915 18321 803 1 . 1 1 174 174 PRO CA C 174 66.290 66.290 61.341 4.949 18321 804 1 . 1 1 174 174 PRO CB C 174 28.993 28.993 30.615 -1.622 18321 805 1 . 1 1 175 175 VAL N N 175 128.066 128.066 124.292 3.774 18321 806 1 . 1 1 175 175 VAL CA C 175 59.356 59.356 67.295 -7.939 18321 807 1 . 1 1 175 175 VAL H H 175 7.327 7.327 8.107 -0.780 18321 808 1 . 1 1 176 176 PRO C C 176 176.351 176.351 176.785 -0.434 18321 809 1 . 1 1 177 177 TYR N N 177 115.756 115.756 115.455 0.301 18321 810 1 . 1 1 177 177 TYR C C 177 175.011 175.011 175.437 -0.426 18321 811 1 . 1 1 177 177 TYR CA C 177 56.756 56.756 57.204 -0.448 18321 812 1 . 1 1 177 177 TYR CB C 177 37.507 37.507 38.974 -1.467 18321 813 1 . 1 1 177 177 TYR H H 177 7.784 7.784 7.555 0.229 18321 814 1 . 1 1 178 178 VAL N N 178 111.428 111.428 114.565 -3.137 18321 815 1 . 1 1 178 178 VAL C C 178 173.417 173.417 175.517 -2.100 18321 816 1 . 1 1 178 178 VAL CA C 178 58.307 58.307 59.220 -0.913 18321 817 1 . 1 1 178 178 VAL CB C 178 34.602 34.602 34.463 0.139 18321 818 1 . 1 1 178 178 VAL H H 178 7.801 7.801 7.466 0.335 18321 819 1 . 1 1 179 179 GLU N N 179 118.581 118.581 119.497 -0.916 18321 820 1 . 1 1 179 179 GLU C C 179 175.225 175.225 175.347 -0.122 18321 821 1 . 1 1 179 179 GLU CA C 179 53.114 53.114 55.488 -2.374 18321 822 1 . 1 1 179 179 GLU CB C 179 32.712 32.712 30.892 1.820 18321 823 1 . 1 1 179 179 GLU H H 179 8.819 8.819 8.579 0.240 18321 824 1 . 1 1 180 180 LYS N N 180 124.167 124.167 120.476 3.691 18321 825 1 . 1 1 180 180 LYS C C 180 176.303 176.303 176.378 -0.075 18321 826 1 . 1 1 180 180 LYS CA C 180 57.318 57.318 56.236 1.082 18321 827 1 . 1 1 180 180 LYS CB C 180 31.675 31.675 32.951 -1.276 18321 828 1 . 1 1 180 180 LYS H H 180 8.775 8.775 8.047 0.728 18321 829 1 . 1 1 181 181 LEU N N 181 125.157 125.157 124.585 0.572 18321 830 1 . 1 1 181 181 LEU C C 181 176.462 176.462 177.347 -0.885 18321 831 1 . 1 1 181 181 LEU CA C 181 54.470 54.470 56.365 -1.895 18321 832 1 . 1 1 181 181 LEU CB C 181 41.625 41.625 42.956 -1.331 18321 833 1 . 1 1 181 181 LEU H H 181 8.084 8.084 8.442 -0.358 18321 834 1 . 1 1 182 182 VAL N N 182 123.167 123.167 117.155 6.012 18321 835 1 . 1 1 182 182 VAL C C 182 175.983 175.983 174.951 1.032 18321 836 1 . 1 1 182 182 VAL CA C 182 61.613 61.613 62.548 -0.935 18321 837 1 . 1 1 182 182 VAL CB C 182 32.085 32.085 31.138 0.947 18321 838 1 . 1 1 182 182 VAL H H 182 8.345 8.345 8.188 0.157 18321 839 1 . 1 1 183 183 ARG N N 183 125.775 125.775 123.755 2.020 18321 840 1 . 1 1 183 183 ARG CA C 183 57.801 57.801 55.968 1.832 18321 841 1 . 1 1 183 183 ARG CB C 183 30.091 30.091 31.455 -1.364 18321 842 1 . 1 1 183 183 ARG H H 183 8.530 8.530 8.143 0.387 18321 843 1 . 1 1 184 184 SER C C 184 173.239 173.239 174.141 -0.902 18321 844 1 . 1 1 185 185 SER N N 185 116.511 116.511 117.541 -1.030 18321 845 1 . 1 1 185 185 SER CA C 185 58.428 58.428 57.255 1.173 18321 846 1 . 1 1 185 185 SER CB C 185 69.737 69.737 63.087 6.650 18321 847 1 . 1 1 185 185 SER H H 185 7.944 7.944 8.086 -0.142 18321 848 1 . 1 1 190 190 HIS C C 190 176.953 176.953 174.997 1.956 18321 849 1 . 1 1 190 190 HIS CA C 190 54.229 54.229 56.037 -1.808 18321 850 1 . 1 1 190 190 HIS CB C 190 35.112 35.112 29.965 5.147 18321 851 1 . 1 1 191 191 GLY N N 191 109.491 109.491 110.588 -1.097 18321 852 1 . 1 1 191 191 GLY C C 191 172.295 172.295 173.459 -1.164 18321 853 1 . 1 1 191 191 GLY CA C 191 45.227 45.227 44.811 0.416 18321 854 1 . 1 1 191 191 GLY H H 191 8.719 8.719 8.171 0.548 18321 855 1 . 1 1 192 192 ASN N N 192 118.700 118.700 119.370 -0.670 18321 856 1 . 1 1 192 192 ASN HA H 192 4.312 4.312 4.708 -0.396 18321 857 1 . 1 1 192 192 ASN C C 192 176.369 176.369 175.290 1.079 18321 858 1 . 1 1 192 192 ASN CA C 192 57.787 57.787 53.478 4.309 18321 859 1 . 1 1 192 192 ASN H H 192 7.508 7.508 8.429 -0.921 18321 860 1 . 1 1 193 193 ARG N N 193 120.743 120.743 121.035 -0.292 18321 861 1 . 1 1 193 193 ARG H H 193 9.032 9.032 8.349 0.683 18321 862 1 . 1 1 197 197 SER HA H 197 4.388 4.388 4.362 0.027 18321 863 1 . 1 1 197 197 SER C C 197 174.133 174.133 173.932 0.201 18321 864 1 . 1 1 197 197 SER CA C 197 58.128 58.128 58.797 -0.669 18321 865 1 . 1 1 197 197 SER CB C 197 62.966 62.966 63.142 -0.176 18321 866 1 . 1 1 198 198 TYR N N 198 121.435 121.435 122.037 -0.602 18321 867 1 . 1 1 198 198 TYR HA H 198 4.543 4.543 4.488 0.055 18321 868 1 . 1 1 198 198 TYR C C 198 176.230 176.230 176.337 -0.107 18321 869 1 . 1 1 198 198 TYR CA C 198 57.536 57.536 58.297 -0.761 18321 870 1 . 1 1 198 198 TYR CB C 198 38.279 38.279 38.701 -0.422 18321 871 1 . 1 1 198 198 TYR H H 198 8.071 8.071 8.180 -0.109 18321 872 1 . 1 1 199 199 GLY N N 199 110.039 110.039 109.990 0.049 18321 873 1 . 1 1 199 199 GLY C C 199 173.475 173.475 173.528 -0.053 18321 874 1 . 1 1 199 199 GLY CA C 199 44.805 44.805 45.101 -0.296 18321 875 1 . 1 1 199 199 GLY H H 199 8.162 8.162 8.387 -0.225 18321 876 1 . 1 1 200 200 ILE N N 200 121.530 121.530 121.451 0.079 18321 877 1 . 1 1 200 200 ILE CA C 200 58.102 58.102 58.104 -0.002 18321 878 1 . 1 1 200 200 ILE CB C 200 37.760 37.760 38.947 -1.187 18321 879 1 . 1 1 200 200 ILE H H 200 7.851 7.851 7.942 -0.091 18321 880 1 . 1 1 201 201 PRO C C 201 176.485 176.485 176.203 0.282 18321 881 1 . 1 1 201 201 PRO CA C 201 53.893 53.893 63.093 -9.200 18321 882 1 . 1 1 201 201 PRO CB C 201 29.042 29.042 31.883 -2.841 18321 883 1 . 1 1 202 202 GLU N N 202 122.468 122.468 121.237 1.231 18321 884 1 . 1 1 202 202 GLU CA C 202 62.490 62.490 55.020 7.469 18321 885 1 . 1 1 202 202 GLU CB C 202 31.170 31.170 29.802 1.368 18321 886 1 . 1 1 202 202 GLU H H 202 8.328 8.328 8.335 -0.007 18321 887 1 . 1 1 203 203 PRO CA C 203 62.803 62.803 62.983 -0.180 18321 888 1 . 1 1 203 203 PRO CB C 203 31.220 31.220 32.033 -0.813 18321 889 1 . 1 1 204 204 ALA N N 204 123.251 123.251 124.617 -1.366 18321 890 1 . 1 1 204 204 ALA HA H 204 4.180 4.180 4.317 -0.137 18321 891 1 . 1 1 204 204 ALA CA C 204 52.124 52.124 52.363 -0.239 18321 892 1 . 1 1 204 204 ALA CB C 204 18.892 18.892 19.386 -0.494 18321 893 1 . 1 1 204 204 ALA H H 204 8.308 8.308 8.182 0.126 18321 894 1 . 1 1 205 205 HIS N N 205 117.874 117.874 119.769 -1.895 18321 895 1 . 1 1 205 205 HIS C C 205 173.282 173.282 174.520 -1.239 18321 896 1 . 1 1 205 205 HIS H H 205 8.045 8.045 8.388 -0.343 18321 897 1 . 1 1 206 206 ALA N N 206 125.519 125.519 125.657 -0.138 18321 898 1 . 1 1 206 206 ALA HA H 206 4.204 4.204 4.313 -0.109 18321 899 1 . 1 1 206 206 ALA CA C 206 40.196 40.196 52.209 -12.013 18321 900 1 . 1 1 206 206 ALA CB C 206 19.407 19.407 19.235 0.172 18321 901 1 . 1 1 206 206 ALA H H 206 8.061 8.061 8.238 -0.177 18321 902 1 . 1 1 207 207 TYR N N 207 120.381 120.381 120.134 0.247 18321 903 1 . 1 1 207 207 TYR HA H 207 4.570 4.570 4.457 0.114 18321 904 1 . 1 1 207 207 TYR CA C 207 52.572 52.572 57.855 -5.283 18321 905 1 . 1 1 207 207 TYR CB C 207 41.333 41.333 38.517 2.816 18321 906 1 . 1 1 207 207 TYR H H 207 8.199 8.199 8.202 -0.003 18321 907 1 . 1 1 208 208 ALA HA H 208 4.281 4.281 4.361 -0.080 18321 908 1 . 1 1 208 208 ALA C C 208 177.736 177.736 176.852 0.884 18321 909 1 . 1 1 208 208 ALA CA C 208 52.084 52.084 52.450 -0.366 18321 910 1 . 1 1 208 208 ALA CB C 208 18.999 18.999 19.210 -0.211 18321 911 1 . 1 1 209 209 GLN N N 209 119.295 119.295 121.088 -1.793 18321 912 1 . 1 1 209 209 GLN CA C 209 61.474 61.474 54.211 7.263 18321 913 1 . 1 1 209 209 GLN CB C 209 32.039 32.039 28.872 3.167 18321 914 1 . 1 1 209 209 GLN H H 209 8.125 8.125 8.365 -0.240 18321 915 1 . 1 1 210 210 PRO HA H 210 4.395 4.395 4.415 -0.020 18321 916 1 . 1 1 210 210 PRO CA C 210 62.584 62.584 63.305 -0.721 18321 917 1 . 1 1 211 211 GLN HA H 211 4.377 4.377 4.389 -0.012 18321 918 1 . 1 1 211 211 GLN CA C 211 55.859 55.859 55.997 -0.138 18321 919 1 . 1 1 211 211 GLN CB C 211 29.577 29.577 29.314 0.263 18321 920 1 . 1 1 212 212 THR C C 212 176.551 176.551 174.410 2.141 18321 921 1 . 1 1 212 212 THR CB C 212 69.890 69.890 69.039 0.851 18321 922 1 . 1 1 213 213 THR N N 213 108.487 108.487 118.527 -10.040 18321 923 1 . 1 1 213 213 THR CA C 213 61.236 61.236 62.773 -1.537 18321 924 1 . 1 1 213 213 THR CB C 213 69.091 69.091 69.228 -0.137 18321 925 1 . 1 1 213 213 THR H H 213 8.243 8.243 8.107 0.136 18321 926 1 . 1 1 214 214 THR N N 214 119.445 119.445 118.060 1.385 18321 927 1 . 1 1 214 214 THR CA C 214 59.425 59.425 61.072 -1.647 18321 928 1 . 1 1 214 214 THR CB C 214 69.251 69.251 69.045 0.206 18321 929 1 . 1 1 214 214 THR H H 214 8.188 8.188 8.144 0.044 18321 930 1 . 1 1 215 215 PRO HA H 215 4.361 4.361 4.546 -0.185 18321 931 1 . 1 1 215 215 PRO C C 215 175.422 175.422 176.083 -0.661 18321 932 1 . 1 1 215 215 PRO CA C 215 63.320 63.320 63.113 0.207 18321 933 1 . 1 1 215 215 PRO CB C 215 31.918 31.918 31.921 -0.003 18321 934 1 . 1 1 216 216 LEU N N 216 121.602 121.602 122.295 -0.693 18321 935 1 . 1 1 216 216 LEU CA C 216 52.203 52.203 53.944 -1.741 18321 936 1 . 1 1 216 216 LEU CB C 216 42.451 42.451 41.483 0.968 18321 937 1 . 1 1 216 216 LEU H H 216 7.891 7.891 8.032 -0.141 18321 938 1 . 1 1 217 217 PRO HA H 217 4.398 4.398 4.461 -0.063 18321 939 1 . 1 1 217 217 PRO C C 217 176.577 176.577 176.131 0.446 18321 940 1 . 1 1 217 217 PRO CA C 217 62.984 62.984 63.194 -0.210 18321 941 1 . 1 1 217 217 PRO CB C 217 32.056 32.056 31.781 0.275 18321 942 1 . 1 1 218 218 ALA N N 218 124.087 124.087 123.180 0.907 18321 943 1 . 1 1 218 218 ALA HA H 218 4.309 4.309 4.332 -0.023 18321 944 1 . 1 1 218 218 ALA C C 218 177.844 177.844 176.907 0.937 18321 945 1 . 1 1 218 218 ALA CA C 218 52.379 52.379 52.123 0.256 18321 946 1 . 1 1 218 218 ALA CB C 218 19.133 19.133 19.391 -0.258 18321 947 1 . 1 1 218 218 ALA H H 218 8.261 8.261 7.947 0.314 18321 948 1 . 1 1 219 219 VAL N N 219 118.942 118.942 119.424 -0.482 18321 949 1 . 1 1 219 219 VAL HA H 219 4.142 4.142 4.178 -0.036 18321 950 1 . 1 1 219 219 VAL CA C 219 62.102 62.102 62.702 -0.600 18321 951 1 . 1 1 219 219 VAL CB C 219 32.923 32.923 32.071 0.852 18321 952 1 . 1 1 219 219 VAL H H 219 8.049 8.049 8.183 -0.134 18321 953 1 . 1 1 220 220 SER N N 220 119.207 119.207 119.639 -0.432 18321 954 1 . 1 1 220 220 SER HA H 220 4.436 4.436 4.581 -0.145 18321 955 1 . 1 1 220 220 SER CA C 220 57.813 57.813 58.172 -0.359 18321 956 1 . 1 1 220 220 SER CB C 220 63.375 63.375 63.727 -0.352 18321 957 1 . 1 1 220 220 SER H H 220 8.275 8.275 8.307 -0.032 18321 958 1 . 1 1 221 221 GLY N N 221 110.973 110.973 111.071 -0.098 18321 959 1 . 1 1 221 221 GLY C C 221 173.962 173.962 173.699 0.263 18321 960 1 . 1 1 221 221 GLY CA C 221 45.286 45.286 44.999 0.287 18321 961 1 . 1 1 221 221 GLY H H 221 8.374 8.374 8.280 0.094 18321 962 1 . 1 1 222 222 SER N N 222 115.516 115.516 117.052 -1.536 18321 963 1 . 1 1 222 222 SER HA H 222 4.763 4.763 4.678 0.085 18321 964 1 . 1 1 222 222 SER CA C 222 56.407 56.407 56.900 -0.493 18321 965 1 . 1 1 222 222 SER CB C 222 63.993 63.993 63.953 0.040 18321 966 1 . 1 1 222 222 SER H H 222 8.155 8.155 8.141 0.014 18321 967 1 . 1 1 223 223 PRO HA H 223 4.417 4.417 4.478 -0.061 18321 968 1 . 1 1 223 223 PRO CA C 223 63.805 63.805 63.035 0.770 18321 969 1 . 1 1 223 223 PRO CB C 223 32.090 32.090 31.962 0.128 18321 970 1 . 1 1 224 224 GLY N N 224 109.149 109.149 110.253 -1.104 18321 971 1 . 1 1 224 224 GLY C C 224 173.813 173.813 173.824 -0.011 18321 972 1 . 1 1 224 224 GLY CA C 224 44.512 44.512 45.045 -0.533 18321 973 1 . 1 1 224 224 GLY H H 224 8.376 8.376 8.330 0.046 18321 974 1 . 1 1 225 225 ALA N N 225 123.599 123.599 124.416 -0.817 18321 975 1 . 1 1 225 225 ALA C C 225 177.341 177.341 176.911 0.430 18321 976 1 . 1 1 225 225 ALA CA C 225 51.878 51.878 52.029 -0.151 18321 977 1 . 1 1 225 225 ALA CB C 225 19.169 19.169 19.320 -0.151 18321 978 1 . 1 1 225 225 ALA H H 225 7.959 7.959 8.061 -0.102 18321 979 1 . 1 1 226 226 ALA N N 226 123.218 123.218 124.055 -0.837 18321 980 1 . 1 1 226 226 ALA HA H 226 4.350 4.350 4.396 -0.046 18321 981 1 . 1 1 226 226 ALA C C 226 177.520 177.520 177.002 0.518 18321 982 1 . 1 1 226 226 ALA CA C 226 52.535 52.535 52.118 0.417 18321 983 1 . 1 1 226 226 ALA CB C 226 19.171 19.171 18.643 0.528 18321 984 1 . 1 1 226 226 ALA H H 226 8.169 8.169 8.232 -0.063 18321 985 1 . 1 1 227 227 ILE N N 227 120.086 120.086 119.520 0.565 18321 986 1 . 1 1 227 227 ILE HA H 227 4.201 4.201 4.216 -0.015 18321 987 1 . 1 1 227 227 ILE C C 227 174.814 174.814 175.734 -0.920 18321 988 1 . 1 1 227 227 ILE CA C 227 60.929 60.929 61.410 -0.480 18321 989 1 . 1 1 227 227 ILE CB C 227 38.872 38.872 37.980 0.892 18321 990 1 . 1 1 227 227 ILE H H 227 8.037 8.037 8.079 -0.042 18321 991 1 . 1 1 228 228 THR N N 228 117.224 117.224 119.048 -1.824 18321 992 1 . 1 1 228 228 THR HA H 228 4.203 4.203 4.512 -0.309 18321 993 1 . 1 1 228 228 THR CA C 228 57.108 57.108 61.084 -3.976 18321 994 1 . 1 1 228 228 THR CB C 228 69.945 69.945 68.903 1.042 18321 995 1 . 1 1 228 228 THR H H 228 7.775 7.775 8.185 -0.410 18321 996 1 . 1 1 229 229 PRO HA H 229 4.750 4.750 4.515 0.235 18321 997 1 . 1 1 229 229 PRO CA C 229 62.480 62.480 62.921 -0.441 18321 998 1 . 1 1 229 229 PRO CB C 229 33.995 33.995 32.148 1.847 18321 999 1 . 1 1 230 230 LEU N N 230 123.629 123.629 121.479 2.150 18321 1000 1 . 1 1 230 230 LEU CA C 230 53.076 53.076 52.916 0.159 18321 1001 1 . 1 1 230 230 LEU CB C 230 40.608 40.608 41.560 -0.952 18321 1002 1 . 1 1 230 230 LEU H H 230 8.453 8.453 8.034 0.419 18321 1003 1 . 1 1 231 231 PRO HA H 231 4.412 4.412 4.503 -0.091 18321 1004 1 . 1 1 231 231 PRO C C 231 176.571 176.571 176.713 -0.142 18321 1005 1 . 1 1 231 231 PRO CA C 231 63.225 63.225 63.296 -0.071 18321 1006 1 . 1 1 231 231 PRO CB C 231 31.191 31.191 31.790 -0.599 18321 1007 1 . 1 1 232 232 SER N N 232 115.169 115.169 115.235 -0.066 18321 1008 1 . 1 1 232 232 SER HA H 232 4.450 4.450 4.388 0.062 18321 1009 1 . 1 1 232 232 SER CA C 232 58.604 58.604 58.965 -0.361 18321 1010 1 . 1 1 232 232 SER CB C 232 63.962 63.962 62.676 1.286 18321 1011 1 . 1 1 232 232 SER H H 232 8.280 8.280 8.318 -0.038 18321 1012 1 . 1 1 233 233 THR N N 233 115.155 115.155 115.490 -0.335 18321 1013 1 . 1 1 233 233 THR HA H 233 4.351 4.351 4.271 0.080 18321 1014 1 . 1 1 233 233 THR C C 233 177.237 177.237 174.466 2.771 18321 1015 1 . 1 1 233 233 THR CA C 233 61.939 61.939 62.367 -0.428 18321 1016 1 . 1 1 233 233 THR CB C 233 68.986 68.986 69.243 -0.257 18321 1017 1 . 1 1 233 233 THR H H 233 8.096 8.096 8.056 0.040 18321 1018 1 . 1 1 234 234 GLN N N 234 122.040 122.040 121.697 0.343 18321 1019 1 . 1 1 234 234 GLN HA H 234 4.681 4.681 4.234 0.447 18321 1020 1 . 1 1 234 234 GLN C C 234 176.177 176.177 175.196 0.981 18321 1021 1 . 1 1 234 234 GLN CA C 234 55.861 55.861 56.200 -0.339 18321 1022 1 . 1 1 234 234 GLN CB C 234 28.583 28.583 28.178 0.405 18321 1023 1 . 1 1 234 234 GLN H H 234 8.256 8.256 8.467 -0.211 18321 1024 1 . 1 1 235 235 ASN N N 235 119.506 119.506 119.595 -0.089 18321 1025 1 . 1 1 235 235 ASN HA H 235 4.775 4.775 4.727 0.048 18321 1026 1 . 1 1 235 235 ASN C C 235 174.974 174.974 174.987 -0.013 18321 1027 1 . 1 1 235 235 ASN CA C 235 53.191 53.191 53.242 -0.051 18321 1028 1 . 1 1 235 235 ASN CB C 235 38.511 38.511 39.050 -0.539 18321 1029 1 . 1 1 235 235 ASN H H 235 8.346 8.346 8.242 0.103 18321 1030 1 . 1 1 236 236 GLY N N 236 109.378 109.378 109.001 0.377 18321 1031 1 . 1 1 236 236 GLY CA C 236 44.023 44.023 44.662 -0.639 18321 1032 1 . 1 1 236 236 GLY H H 236 7.939 7.939 8.100 -0.161 18321 1033 1 . 1 1 237 237 PRO HA H 237 4.336 4.336 4.416 -0.080 18321 1034 1 . 1 1 237 237 PRO C C 237 175.942 175.942 175.847 0.095 18321 1035 1 . 1 1 237 237 PRO CA C 237 62.797 62.797 62.262 0.535 18321 1036 1 . 1 1 237 237 PRO CB C 237 27.421 27.421 31.982 -4.562 18321 1037 1 . 1 1 238 238 VAL N N 238 120.535 120.535 123.037 -2.502 18321 1038 1 . 1 1 238 238 VAL HA H 238 4.195 4.195 4.035 0.160 18321 1039 1 . 1 1 238 238 VAL C C 238 173.775 173.775 174.883 -1.108 18321 1040 1 . 1 1 238 238 VAL CA C 238 61.173 61.173 62.038 -0.865 18321 1041 1 . 1 1 238 238 VAL CB C 238 38.328 38.328 32.423 5.905 18321 1042 1 . 1 1 238 238 VAL H H 238 7.986 7.986 8.122 -0.136 18321 1043 1 . 1 1 239 239 PHE N N 239 123.522 123.522 125.803 -2.281 18321 1044 1 . 1 1 239 239 PHE HA H 239 5.539 5.539 5.147 0.392 18321 1045 1 . 1 1 239 239 PHE C C 239 174.207 174.207 174.800 -0.593 18321 1046 1 . 1 1 239 239 PHE CA C 239 56.993 56.993 56.523 0.470 18321 1047 1 . 1 1 239 239 PHE CB C 239 41.743 41.743 40.491 1.253 18321 1048 1 . 1 1 239 239 PHE H H 239 8.927 8.927 8.648 0.279 18321 1049 1 . 1 1 240 240 ALA N N 240 120.871 120.871 126.615 -5.744 18321 1050 1 . 1 1 240 240 ALA HA H 240 5.352 5.352 5.447 -0.095 18321 1051 1 . 1 1 240 240 ALA C C 240 174.639 174.639 175.694 -1.055 18321 1052 1 . 1 1 240 240 ALA CA C 240 49.736 49.736 50.311 -0.575 18321 1053 1 . 1 1 240 240 ALA CB C 240 23.480 23.480 22.368 1.112 18321 1054 1 . 1 1 240 240 ALA H H 240 9.398 9.398 8.999 0.399 18321 1055 1 . 1 1 241 241 LYS N N 241 121.227 121.227 124.526 -3.299 18321 1056 1 . 1 1 241 241 LYS HA H 241 5.373 5.373 5.088 0.285 18321 1057 1 . 1 1 241 241 LYS C C 241 176.772 176.772 176.017 0.755 18321 1058 1 . 1 1 241 241 LYS CA C 241 53.128 53.128 54.528 -1.400 18321 1059 1 . 1 1 241 241 LYS CB C 241 34.850 34.850 34.415 0.435 18321 1060 1 . 1 1 241 241 LYS H H 241 8.947 8.947 8.691 0.256 18321 1061 1 . 1 1 242 242 ALA N N 242 126.833 126.833 130.613 -3.780 18321 1062 1 . 1 1 242 242 ALA HA H 242 4.764 4.764 4.601 0.163 18321 1063 1 . 1 1 242 242 ALA C C 242 178.506 178.506 177.650 0.856 18321 1064 1 . 1 1 242 242 ALA CA C 242 52.788 52.788 51.873 0.915 18321 1065 1 . 1 1 242 242 ALA CB C 242 19.084 19.084 18.702 0.382 18321 1066 1 . 1 1 242 242 ALA H H 242 9.373 9.373 8.694 0.679 18321 1067 1 . 1 1 243 243 ILE N N 243 118.731 118.731 119.219 -0.488 18321 1068 1 . 1 1 243 243 ILE HA H 243 4.454 4.454 4.193 0.261 18321 1069 1 . 1 1 243 243 ILE C C 243 174.773 174.773 175.975 -1.202 18321 1070 1 . 1 1 243 243 ILE CA C 243 60.613 60.613 61.997 -1.384 18321 1071 1 . 1 1 243 243 ILE CB C 243 39.232 39.232 38.383 0.849 18321 1072 1 . 1 1 243 243 ILE H H 243 8.933 8.933 8.247 0.686 18321 1073 1 . 1 1 244 244 GLN N N 244 121.616 121.616 119.681 1.935 18321 1074 1 . 1 1 244 244 GLN HA H 244 4.283 4.283 4.521 -0.237 18321 1075 1 . 1 1 244 244 GLN C C 244 172.815 172.815 174.558 -1.743 18321 1076 1 . 1 1 244 244 GLN CA C 244 54.750 54.750 54.282 0.468 18321 1077 1 . 1 1 244 244 GLN CB C 244 31.469 31.469 32.319 -0.850 18321 1078 1 . 1 1 244 244 GLN H H 244 7.438 7.438 7.664 -0.227 18321 1079 1 . 1 1 245 245 LYS N N 245 124.215 124.215 123.049 1.166 18321 1080 1 . 1 1 245 245 LYS HA H 245 3.962 3.962 4.333 -0.371 18321 1081 1 . 1 1 245 245 LYS C C 245 175.679 175.679 176.279 -0.600 18321 1082 1 . 1 1 245 245 LYS CA C 245 56.413 56.413 56.958 -0.545 18321 1083 1 . 1 1 245 245 LYS CB C 245 32.847 32.847 33.007 -0.160 18321 1084 1 . 1 1 245 245 LYS H H 245 8.318 8.318 8.567 -0.249 18321 1085 1 . 1 1 246 246 ARG N N 246 127.327 127.327 123.825 3.502 18321 1086 1 . 1 1 246 246 ARG HA H 246 4.221 4.221 4.659 -0.438 18321 1087 1 . 1 1 246 246 ARG CA C 246 56.279 56.279 55.020 1.259 18321 1088 1 . 1 1 246 246 ARG CB C 246 32.987 32.987 31.866 1.121 18321 1089 1 . 1 1 246 246 ARG H H 246 9.248 9.248 8.700 0.548 18321 1090 1 . 1 1 249 249 CYS HA H 249 4.260 4.260 4.306 -0.046 18321 1091 1 . 1 1 249 249 CYS CA C 249 55.886 55.886 57.081 -1.195 18321 1092 1 . 1 1 249 249 CYS CB C 249 34.146 34.146 29.424 4.722 18321 1093 1 . 1 1 250 250 ALA HA H 250 3.926 3.926 4.077 -0.151 18321 1094 1 . 1 1 250 250 ALA CA C 250 54.344 54.344 54.449 -0.105 18321 1095 1 . 1 1 250 250 ALA CB C 250 18.342 18.342 18.530 -0.188 18321 1096 1 . 1 1 251 251 TYR N N 251 110.618 110.618 112.331 -1.713 18321 1097 1 . 1 1 251 251 TYR HA H 251 4.489 4.489 4.735 -0.246 18321 1098 1 . 1 1 251 251 TYR C C 251 175.286 175.286 175.075 0.211 18321 1099 1 . 1 1 251 251 TYR CA C 251 56.137 56.137 55.506 0.631 18321 1100 1 . 1 1 251 251 TYR CB C 251 37.203 37.203 38.047 -0.844 18321 1101 1 . 1 1 251 251 TYR H H 251 7.037 7.037 7.304 -0.267 18321 1102 1 . 1 1 252 252 ASP N N 252 121.835 121.835 121.770 0.065 18321 1103 1 . 1 1 252 252 ASP HA H 252 4.763 4.763 4.745 0.018 18321 1104 1 . 1 1 252 252 ASP CA C 252 52.351 52.351 54.307 -1.956 18321 1105 1 . 1 1 252 252 ASP CB C 252 39.995 39.995 40.813 -0.818 18321 1106 1 . 1 1 252 252 ASP H H 252 7.339 7.339 7.562 -0.223 18321 1107 1 . 1 1 253 253 LYS N N 253 123.177 123.177 121.524 1.653 18321 1108 1 . 1 1 253 253 LYS HA H 253 4.270 4.270 4.306 -0.035 18321 1109 1 . 1 1 253 253 LYS C C 253 177.724 177.724 177.070 0.654 18321 1110 1 . 1 1 253 253 LYS CA C 253 57.036 57.036 57.472 -0.436 18321 1111 1 . 1 1 253 253 LYS H H 253 8.396 8.396 8.265 0.131 18321 1112 1 . 1 1 254 254 THR N N 254 108.317 108.317 110.960 -2.643 18321 1113 1 . 1 1 254 254 THR HA H 254 4.517 4.517 4.319 0.198 18321 1114 1 . 1 1 254 254 THR C C 254 174.012 174.012 173.623 0.389 18321 1115 1 . 1 1 254 254 THR CA C 254 61.036 61.036 61.774 -0.738 18321 1116 1 . 1 1 254 254 THR CB C 254 69.307 69.307 68.650 0.657 18321 1117 1 . 1 1 254 254 THR H H 254 8.217 8.217 8.162 0.055 18321 1118 1 . 1 1 255 255 ALA N N 255 124.762 124.762 124.439 0.323 18321 1119 1 . 1 1 255 255 ALA HA H 255 4.524 4.524 4.916 -0.392 18321 1120 1 . 1 1 255 255 ALA C C 255 176.630 176.630 176.221 0.409 18321 1121 1 . 1 1 255 255 ALA CA C 255 51.352 51.352 50.763 0.589 18321 1122 1 . 1 1 255 255 ALA CB C 255 20.135 20.135 20.037 0.098 18321 1123 1 . 1 1 255 255 ALA H H 255 7.096 7.096 7.768 -0.672 18321 1124 1 . 1 1 256 256 LEU N N 256 124.379 124.379 124.116 0.263 18321 1125 1 . 1 1 256 256 LEU HA H 256 4.328 4.328 4.422 -0.094 18321 1126 1 . 1 1 256 256 LEU C C 256 176.007 176.007 175.777 0.230 18321 1127 1 . 1 1 256 256 LEU CA C 256 53.502 53.502 54.311 -0.809 18321 1128 1 . 1 1 256 256 LEU CB C 256 44.665 44.665 43.869 0.796 18321 1129 1 . 1 1 256 256 LEU H H 256 8.889 8.889 8.187 0.702 18321 1130 1 . 1 1 257 257 ALA N N 257 129.619 129.619 127.519 2.100 18321 1131 1 . 1 1 257 257 ALA HA H 257 4.445 4.445 4.862 -0.417 18321 1132 1 . 1 1 257 257 ALA C C 257 176.813 176.813 176.529 0.284 18321 1133 1 . 1 1 257 257 ALA CA C 257 51.179 51.179 51.190 -0.011 18321 1134 1 . 1 1 257 257 ALA CB C 257 18.973 18.973 19.272 -0.299 18321 1135 1 . 1 1 257 257 ALA H H 257 8.529 8.529 8.273 0.256 18321 1136 1 . 1 1 258 258 LEU N N 258 119.300 119.300 124.905 -5.605 18321 1137 1 . 1 1 258 258 LEU HA H 258 4.782 4.782 4.653 0.129 18321 1138 1 . 1 1 258 258 LEU CA C 258 53.259 53.259 53.838 -0.579 18321 1139 1 . 1 1 258 258 LEU CB C 258 45.972 45.972 45.222 0.750 18321 1140 1 . 1 1 258 258 LEU H H 258 8.505 8.505 8.660 -0.155 18321 1141 1 . 1 1 259 259 GLU N N 259 123.919 123.919 121.779 2.140 18321 1142 1 . 1 1 259 259 GLU HA H 259 4.516 4.516 4.541 -0.025 18321 1143 1 . 1 1 259 259 GLU C C 259 175.795 175.795 175.403 0.392 18321 1144 1 . 1 1 259 259 GLU CA C 259 52.896 52.896 54.321 -1.425 18321 1145 1 . 1 1 259 259 GLU H H 259 8.943 8.943 8.517 0.426 18321 1146 1 . 1 1 260 260 VAL N N 260 122.122 122.122 121.249 0.873 18321 1147 1 . 1 1 260 260 VAL HA H 260 2.923 2.923 4.131 -1.208 18321 1148 1 . 1 1 260 260 VAL C C 260 177.964 177.964 177.338 0.626 18321 1149 1 . 1 1 260 260 VAL CA C 260 65.417 65.417 63.671 1.746 18321 1150 1 . 1 1 260 260 VAL CB C 260 30.668 30.668 31.037 -0.368 18321 1151 1 . 1 1 260 260 VAL H H 260 8.956 8.956 8.469 0.487 18321 1152 1 . 1 1 261 261 GLY N N 261 116.009 116.009 116.881 -0.872 18321 1153 1 . 1 1 261 261 GLY C C 261 176.288 176.288 173.746 2.542 18321 1154 1 . 1 1 261 261 GLY CA C 261 44.210 44.210 44.773 -0.563 18321 1155 1 . 1 1 261 261 GLY H H 261 8.799 8.799 9.011 -0.212 18321 1156 1 . 1 1 262 262 ASP N N 262 121.945 121.945 120.672 1.273 18321 1157 1 . 1 1 262 262 ASP HA H 262 4.423 4.423 4.923 -0.500 18321 1158 1 . 1 1 262 262 ASP C C 262 175.381 175.381 175.038 0.343 18321 1159 1 . 1 1 262 262 ASP CA C 262 55.243 55.243 52.988 2.255 18321 1160 1 . 1 1 262 262 ASP CB C 262 41.819 41.819 42.861 -1.042 18321 1161 1 . 1 1 262 262 ASP H H 262 8.180 8.180 7.757 0.423 18321 1162 1 . 1 1 263 263 ILE N N 263 121.452 121.452 122.533 -1.081 18321 1163 1 . 1 1 263 263 ILE HA H 263 4.707 4.707 4.562 0.145 18321 1164 1 . 1 1 263 263 ILE C C 263 174.996 174.996 176.023 -1.027 18321 1165 1 . 1 1 263 263 ILE CA C 263 59.289 59.289 59.491 -0.202 18321 1166 1 . 1 1 263 263 ILE CB C 263 36.987 36.987 37.909 -0.922 18321 1167 1 . 1 1 263 263 ILE H H 263 8.460 8.460 8.498 -0.038 18321 1168 1 . 1 1 264 264 VAL N N 264 128.756 128.756 129.334 -0.578 18321 1169 1 . 1 1 264 264 VAL HA H 264 4.309 4.309 4.093 0.216 18321 1170 1 . 1 1 264 264 VAL C C 264 175.486 175.486 174.867 0.620 18321 1171 1 . 1 1 264 264 VAL CA C 264 59.091 59.091 61.526 -2.435 18321 1172 1 . 1 1 264 264 VAL CB C 264 34.541 34.541 31.713 2.828 18321 1173 1 . 1 1 264 264 VAL H H 264 9.479 9.479 9.241 0.239 18321 1174 1 . 1 1 265 265 LYS N N 265 128.101 128.101 129.957 -1.856 18321 1175 1 . 1 1 265 265 LYS HA H 265 4.342 4.342 4.312 0.030 18321 1176 1 . 1 1 265 265 LYS C C 265 175.531 175.531 175.024 0.507 18321 1177 1 . 1 1 265 265 LYS CA C 265 55.620 55.620 55.617 0.003 18321 1178 1 . 1 1 265 265 LYS CB C 265 33.149 33.149 32.338 0.811 18321 1179 1 . 1 1 265 265 LYS H H 265 8.715 8.715 8.606 0.109 18321 1180 1 . 1 1 266 266 VAL N N 266 129.537 129.537 127.710 1.827 18321 1181 1 . 1 1 266 266 VAL HA H 266 4.333 4.333 4.491 -0.158 18321 1182 1 . 1 1 266 266 VAL C C 266 176.166 176.166 174.853 1.313 18321 1183 1 . 1 1 266 266 VAL CA C 266 63.339 63.339 60.858 2.481 18321 1184 1 . 1 1 266 266 VAL CB C 266 30.712 30.712 34.196 -3.484 18321 1185 1 . 1 1 266 266 VAL H H 266 9.073 9.073 8.288 0.785 18321 1186 1 . 1 1 267 267 THR N N 267 120.020 120.020 122.528 -2.508 18321 1187 1 . 1 1 267 267 THR HA H 267 4.189 4.189 4.400 -0.211 18321 1188 1 . 1 1 267 267 THR C C 267 176.054 176.054 174.952 1.102 18321 1189 1 . 1 1 267 267 THR CA C 267 62.204 62.204 63.032 -0.828 18321 1190 1 . 1 1 267 267 THR CB C 267 68.200 68.200 69.587 -1.387 18321 1191 1 . 1 1 267 267 THR H H 267 9.130 9.130 8.366 0.764 18321 1192 1 . 1 1 268 268 ARG N N 268 120.839 120.839 122.530 -1.691 18321 1193 1 . 1 1 268 268 ARG HA H 268 4.236 4.236 4.619 -0.383 18321 1194 1 . 1 1 268 268 ARG CA C 268 56.321 56.321 54.873 1.448 18321 1195 1 . 1 1 268 268 ARG CB C 268 33.049 33.049 31.709 1.340 18321 1196 1 . 1 1 268 268 ARG H H 268 7.631 7.631 7.642 -0.011 18321 1197 1 . 1 1 269 269 MET N N 269 125.443 125.443 123.805 1.638 18321 1198 1 . 1 1 269 269 MET C C 269 174.392 174.392 174.877 -0.485 18321 1199 1 . 1 1 269 269 MET H H 269 8.532 8.532 8.512 0.020 18321 1200 1 . 1 1 270 270 ASN N N 270 119.125 119.125 122.900 -3.775 18321 1201 1 . 1 1 270 270 ASN HA H 270 4.546 4.546 4.910 -0.364 18321 1202 1 . 1 1 270 270 ASN C C 270 172.133 172.133 175.967 -3.834 18321 1203 1 . 1 1 270 270 ASN CA C 270 53.639 53.639 52.878 0.761 18321 1204 1 . 1 1 270 270 ASN CB C 270 39.845 39.845 39.725 0.120 18321 1205 1 . 1 1 270 270 ASN H H 270 6.631 6.631 8.816 -2.185 18321 1206 1 . 1 1 271 271 ILE N N 271 122.532 122.532 118.737 3.795 18321 1207 1 . 1 1 271 271 ILE HA H 271 4.417 4.417 4.060 0.357 18321 1208 1 . 1 1 271 271 ILE CA C 271 63.348 63.348 62.684 0.664 18321 1209 1 . 1 1 271 271 ILE CB C 271 38.198 38.198 37.067 1.131 18321 1210 1 . 1 1 271 271 ILE H H 271 8.565 8.565 8.532 0.033 18321 1211 1 . 1 1 272 272 ASN HA H 272 4.527 4.527 4.669 -0.142 18321 1212 1 . 1 1 272 272 ASN C C 272 176.259 176.259 176.254 0.005 18321 1213 1 . 1 1 272 272 ASN CA C 272 53.225 53.225 53.908 -0.683 18321 1214 1 . 1 1 272 272 ASN CB C 272 37.565 37.565 39.026 -1.461 18321 1215 1 . 1 1 273 273 GLY N N 273 107.043 107.043 107.481 -0.438 18321 1216 1 . 1 1 273 273 GLY C C 273 173.216 173.216 172.825 0.391 18321 1217 1 . 1 1 273 273 GLY CA C 273 45.299 45.299 45.011 0.288 18321 1218 1 . 1 1 273 273 GLY H H 273 8.086 8.086 7.998 0.088 18321 1219 1 . 1 1 274 274 GLN N N 274 120.624 120.624 120.966 -0.342 18321 1220 1 . 1 1 274 274 GLN HA H 274 4.551 4.551 4.398 0.153 18321 1221 1 . 1 1 274 274 GLN C C 274 175.039 175.039 175.297 -0.258 18321 1222 1 . 1 1 274 274 GLN CA C 274 54.556 54.556 55.078 -0.522 18321 1223 1 . 1 1 274 274 GLN CB C 274 33.698 33.698 29.441 4.257 18321 1224 1 . 1 1 274 274 GLN H H 274 8.045 8.045 7.902 0.143 18321 1225 1 . 1 1 275 275 TRP N N 275 125.596 125.596 124.926 0.670 18321 1226 1 . 1 1 275 275 TRP HA H 275 4.588 4.588 4.708 -0.120 18321 1227 1 . 1 1 275 275 TRP C C 275 172.832 172.832 175.707 -2.875 18321 1228 1 . 1 1 275 275 TRP CA C 275 55.296 55.296 54.057 1.239 18321 1229 1 . 1 1 275 275 TRP CB C 275 31.393 31.393 30.552 0.841 18321 1230 1 . 1 1 275 275 TRP H H 275 8.484 8.484 8.127 0.357 18321 1231 1 . 1 1 276 276 GLU N N 276 119.012 119.012 120.933 -1.921 18321 1232 1 . 1 1 276 276 GLU HA H 276 5.190 5.190 5.172 0.018 18321 1233 1 . 1 1 276 276 GLU C C 276 176.553 176.553 176.057 0.495 18321 1234 1 . 1 1 276 276 GLU CA C 276 54.288 54.288 55.426 -1.138 18321 1235 1 . 1 1 276 276 GLU CB C 276 32.851 32.851 31.436 1.415 18321 1236 1 . 1 1 276 276 GLU H H 276 8.643 8.643 8.821 -0.178 18321 1237 1 . 1 1 277 277 GLY N N 277 111.364 111.364 112.314 -0.950 18321 1238 1 . 1 1 277 277 GLY C C 277 170.707 170.707 172.437 -1.730 18321 1239 1 . 1 1 277 277 GLY CA C 277 46.723 46.723 44.084 2.639 18321 1240 1 . 1 1 277 277 GLY H H 277 9.072 9.072 8.632 0.440 18321 1241 1 . 1 1 278 278 GLU N N 278 117.733 117.733 123.251 -5.518 18321 1242 1 . 1 1 278 278 GLU HA H 278 5.748 5.748 4.941 0.807 18321 1243 1 . 1 1 278 278 GLU C C 278 176.051 176.051 175.305 0.746 18321 1244 1 . 1 1 278 278 GLU CA C 278 53.620 53.620 55.210 -1.590 18321 1245 1 . 1 1 278 278 GLU CB C 278 33.742 33.742 31.268 2.474 18321 1246 1 . 1 1 278 278 GLU H H 278 8.810 8.810 8.243 0.567 18321 1247 1 . 1 1 279 279 VAL N N 279 123.834 123.834 125.346 -1.512 18321 1248 1 . 1 1 279 279 VAL HA H 279 4.404 4.404 4.351 0.053 18321 1249 1 . 1 1 279 279 VAL C C 279 175.289 175.289 175.915 -0.626 18321 1250 1 . 1 1 279 279 VAL CA C 279 61.166 61.166 60.750 0.416 18321 1251 1 . 1 1 279 279 VAL CB C 279 34.123 34.123 33.920 0.203 18321 1252 1 . 1 1 279 279 VAL H H 279 8.887 8.887 8.714 0.173 18321 1253 1 . 1 1 280 280 ASN N N 280 126.025 126.025 124.575 1.450 18321 1254 1 . 1 1 280 280 ASN HA H 280 4.435 4.435 4.479 -0.044 18321 1255 1 . 1 1 280 280 ASN C C 280 175.205 175.205 175.537 -0.332 18321 1256 1 . 1 1 280 280 ASN CA C 280 45.615 45.615 53.780 -8.165 18321 1257 1 . 1 1 280 280 ASN CB C 280 37.386 37.386 37.412 -0.026 18321 1258 1 . 1 1 280 280 ASN H H 280 9.322 9.322 9.126 0.196 18321 1259 1 . 1 1 281 281 GLY N N 281 104.588 104.588 104.878 -0.290 18321 1260 1 . 1 1 281 281 GLY C C 281 173.944 173.944 173.518 0.426 18321 1261 1 . 1 1 281 281 GLY CA C 281 45.224 45.224 45.113 0.111 18321 1262 1 . 1 1 281 281 GLY H H 281 8.768 8.768 8.306 0.462 18321 1263 1 . 1 1 282 282 ARG N N 282 122.567 122.567 121.533 1.034 18321 1264 1 . 1 1 282 282 ARG HA H 282 4.559 4.559 4.567 -0.008 18321 1265 1 . 1 1 282 282 ARG C C 282 174.350 174.350 174.299 0.051 18321 1266 1 . 1 1 282 282 ARG CA C 282 54.933 54.933 54.987 -0.054 18321 1267 1 . 1 1 282 282 ARG CB C 282 31.765 31.765 32.267 -0.502 18321 1268 1 . 1 1 282 282 ARG H H 282 8.149 8.149 7.926 0.223 18321 1269 1 . 1 1 283 283 LYS N N 283 121.565 121.565 125.667 -4.102 18321 1270 1 . 1 1 283 283 LYS HA H 283 5.584 5.584 5.488 0.096 18321 1271 1 . 1 1 283 283 LYS CA C 283 54.143 54.143 55.032 -0.889 18321 1272 1 . 1 1 283 283 LYS CB C 283 36.040 36.040 34.339 1.701 18321 1273 1 . 1 1 283 283 LYS H H 283 8.424 8.424 8.576 -0.152 18321 1274 1 . 1 1 284 284 GLY C C 284 173.006 173.006 172.433 0.573 18321 1275 1 . 1 1 284 284 GLY CA C 284 45.886 45.886 44.961 0.925 18321 1276 1 . 1 1 285 285 LEU N N 285 119.673 119.673 121.590 -1.917 18321 1277 1 . 1 1 285 285 LEU HA H 285 5.718 5.718 5.555 0.163 18321 1278 1 . 1 1 285 285 LEU C C 285 178.657 178.657 176.398 2.259 18321 1279 1 . 1 1 285 285 LEU CA C 285 53.656 53.656 54.107 -0.451 18321 1280 1 . 1 1 285 285 LEU CB C 285 44.813 44.813 43.177 1.636 18321 1281 1 . 1 1 285 285 LEU H H 285 8.734 8.734 8.694 0.040 18321 1282 1 . 1 1 286 286 PHE N N 286 118.785 118.785 120.190 -1.405 18321 1283 1 . 1 1 286 286 PHE HA H 286 4.521 4.521 5.078 -0.557 18321 1284 1 . 1 1 286 286 PHE CA C 286 57.592 57.592 54.358 3.234 18321 1285 1 . 1 1 286 286 PHE CB C 286 40.669 40.669 39.924 0.745 18321 1286 1 . 1 1 286 286 PHE H H 286 9.120 9.120 8.635 0.485 18321 1287 1 . 1 1 287 287 PRO HA H 287 4.385 4.385 4.508 -0.123 18321 1288 1 . 1 1 287 287 PRO CA C 287 62.814 62.814 62.000 0.814 18321 1289 1 . 1 1 287 287 PRO CB C 287 32.133 32.133 31.637 0.496 18321 1290 1 . 1 1 288 288 PHE C C 288 174.837 174.837 176.035 -1.198 18321 1291 1 . 1 1 288 288 PHE CA C 288 59.020 59.020 59.413 -0.392 18321 1292 1 . 1 1 288 288 PHE CB C 288 34.987 34.987 37.069 -2.082 18321 1293 1 . 1 1 289 289 THR N N 289 107.865 107.865 112.162 -4.297 18321 1294 1 . 1 1 289 289 THR HA H 289 3.589 3.589 3.916 -0.327 18321 1295 1 . 1 1 289 289 THR C C 289 176.125 176.125 175.016 1.109 18321 1296 1 . 1 1 289 289 THR CA C 289 62.243 62.243 64.272 -2.029 18321 1297 1 . 1 1 289 289 THR CB C 289 69.365 69.365 68.136 1.229 18321 1298 1 . 1 1 289 289 THR H H 289 6.453 6.453 7.717 -1.264 18321 1299 1 . 1 1 290 290 HIS N N 290 119.462 119.462 117.775 1.687 18321 1300 1 . 1 1 290 290 HIS HA H 290 4.196 4.196 4.673 -0.477 18321 1301 1 . 1 1 290 290 HIS C C 290 175.165 175.165 174.046 1.119 18321 1302 1 . 1 1 290 290 HIS CA C 290 57.635 57.635 56.665 0.970 18321 1303 1 . 1 1 290 290 HIS CB C 290 29.840 29.840 31.026 -1.186 18321 1304 1 . 1 1 290 290 HIS H H 290 7.835 7.835 7.933 -0.098 18321 1305 1 . 1 1 291 291 VAL N N 291 110.050 110.050 112.878 -2.828 18321 1306 1 . 1 1 291 291 VAL HA H 291 5.445 5.445 5.056 0.389 18321 1307 1 . 1 1 291 291 VAL C C 291 173.386 173.386 174.841 -1.455 18321 1308 1 . 1 1 291 291 VAL CA C 291 57.794 57.794 59.097 -1.303 18321 1309 1 . 1 1 291 291 VAL CB C 291 35.784 35.784 34.807 0.976 18321 1310 1 . 1 1 291 291 VAL H H 291 7.562 7.562 7.463 0.099 18321 1311 1 . 1 1 292 292 LYS N N 292 119.445 119.445 121.284 -1.839 18321 1312 1 . 1 1 292 292 LYS HA H 292 4.857 4.857 4.795 0.062 18321 1313 1 . 1 1 292 292 LYS C C 292 176.512 176.512 175.627 0.885 18321 1314 1 . 1 1 292 292 LYS CA C 292 54.647 54.647 54.457 0.190 18321 1315 1 . 1 1 292 292 LYS CB C 292 35.665 35.665 35.677 -0.012 18321 1316 1 . 1 1 292 292 LYS H H 292 8.753 8.753 8.323 0.430 18321 1317 1 . 1 1 293 293 ILE N N 293 128.707 128.707 125.789 2.918 18321 1318 1 . 1 1 293 293 ILE HA H 293 4.509 4.509 4.507 0.002 18321 1319 1 . 1 1 293 293 ILE C C 293 175.666 175.666 176.518 -0.852 18321 1320 1 . 1 1 293 293 ILE CA C 293 62.563 62.563 61.577 0.986 18321 1321 1 . 1 1 293 293 ILE CB C 293 38.076 38.076 37.343 0.733 18321 1322 1 . 1 1 293 293 ILE H H 293 9.107 9.107 8.884 0.223 18321 1323 1 . 1 1 294 294 PHE N N 294 126.638 126.638 125.696 0.942 18321 1324 1 . 1 1 294 294 PHE HA H 294 4.898 4.898 4.902 -0.004 18321 1325 1 . 1 1 294 294 PHE C C 294 175.838 175.838 173.637 2.201 18321 1326 1 . 1 1 294 294 PHE CA C 294 56.335 56.335 56.154 0.181 18321 1327 1 . 1 1 294 294 PHE CB C 294 41.196 41.196 40.926 0.270 18321 1328 1 . 1 1 294 294 PHE H H 294 8.716 8.716 8.561 0.155 18321 1329 1 . 1 1 295 295 ASP N N 295 122.961 122.961 120.960 2.001 18321 1330 1 . 1 1 295 295 ASP HA H 295 5.003 5.003 4.688 0.315 18321 1331 1 . 1 1 295 295 ASP CA C 295 50.602 50.602 52.069 -1.467 18321 1332 1 . 1 1 295 295 ASP CB C 295 40.754 40.754 41.646 -0.892 18321 1333 1 . 1 1 295 295 ASP H H 295 8.418 8.418 8.430 -0.012 18321 1334 1 . 1 1 296 296 PRO HA H 296 4.524 4.524 4.326 0.198 18321 1335 1 . 1 1 296 296 PRO C C 296 176.807 176.807 176.638 0.169 18321 1336 1 . 1 1 296 296 PRO CA C 296 62.987 62.987 63.688 -0.701 18321 1337 1 . 1 1 296 296 PRO CB C 296 32.033 32.033 31.577 0.456 18321 1338 1 . 1 1 297 297 GLN N N 297 120.729 120.729 117.452 3.277 18321 1339 1 . 1 1 297 297 GLN HA H 297 4.274 4.274 4.212 0.062 18321 1340 1 . 1 1 297 297 GLN CA C 297 56.427 56.427 55.805 0.622 18321 1341 1 . 1 1 297 297 GLN CB C 297 28.819 28.819 28.793 0.026 18321 1342 1 . 1 1 297 297 GLN H H 297 8.551 8.551 8.196 0.355 18321 1343 1 . 1 1 299 299 PRO C C 299 176.936 176.936 176.605 0.331 18321 1344 1 . 1 1 299 299 PRO CA C 299 63.406 63.406 63.660 -0.254 18321 1345 1 . 1 1 299 299 PRO CB C 299 31.421 31.421 31.643 -0.222 18321 1346 1 . 1 1 300 300 ASP N N 300 119.609 119.609 119.664 -0.055 18321 1347 1 . 1 1 300 300 ASP C C 300 176.344 176.344 176.856 -0.512 18321 1348 1 . 1 1 300 300 ASP CA C 300 54.178 54.178 55.869 -1.691 18321 1349 1 . 1 1 300 300 ASP CB C 300 40.661 40.661 40.985 -0.324 18321 1350 1 . 1 1 300 300 ASP H H 300 8.239 8.239 8.268 -0.029 18321 1351 1 . 1 1 301 301 GLU N N 301 120.462 120.462 118.371 2.091 18321 1352 1 . 1 1 301 301 GLU CA C 301 56.188 56.188 56.581 -0.393 18321 1353 1 . 1 1 301 301 GLU CB C 301 29.507 29.507 29.625 -0.118 18321 1354 1 . 1 1 301 301 GLU H H 301 8.084 8.084 8.334 -0.250 18321 stop_ save_