data_26022 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 26022 _Entry.PDB_ID 2NCH 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 26022 _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 VAL N N 2 122.187 122.187 120.621 1.566 26022 2 1 1 . 1 1 2 2 VAL HA H 2 4.091 4.091 4.020 0.071 26022 3 1 1 . 1 1 2 2 VAL C C 2 175.921 175.921 176.272 -0.351 26022 4 1 1 . 1 1 2 2 VAL CA C 2 62.057 62.057 64.117 -2.060 26022 5 1 1 . 1 1 2 2 VAL CB C 2 32.848 32.848 31.986 0.862 26022 6 1 1 . 1 1 3 3 LYS N N 3 125.437 125.437 120.123 5.314 26022 7 1 1 . 1 1 3 3 LYS HA H 3 4.289 4.289 4.583 -0.294 26022 8 1 1 . 1 1 3 3 LYS C C 3 176.155 176.155 175.266 0.889 26022 9 1 1 . 1 1 3 3 LYS CA C 3 56.323 56.323 56.126 0.197 26022 10 1 1 . 1 1 3 3 LYS CB C 3 33.320 33.320 29.890 3.430 26022 11 1 1 . 1 1 3 3 LYS H H 3 8.396 8.396 8.156 0.240 26022 12 1 1 . 1 1 4 4 ASP N N 4 121.937 121.937 120.727 1.210 26022 13 1 1 . 1 1 4 4 ASP HA H 4 4.289 4.289 4.727 -0.438 26022 14 1 1 . 1 1 4 4 ASP C C 4 176.319 176.319 176.224 0.095 26022 15 1 1 . 1 1 4 4 ASP CA C 4 54.029 54.029 55.274 -1.245 26022 16 1 1 . 1 1 4 4 ASP CB C 4 41.280 41.280 42.229 -0.949 26022 17 1 1 . 1 1 4 4 ASP H H 4 8.325 8.325 7.728 0.597 26022 18 1 1 . 1 1 5 5 GLU N N 5 122.369 122.369 120.724 1.645 26022 19 1 1 . 1 1 5 5 GLU HA H 5 4.250 4.250 4.257 -0.007 26022 20 1 1 . 1 1 5 5 GLU C C 5 177.045 177.045 176.235 0.810 26022 21 1 1 . 1 1 5 5 GLU CA C 5 56.930 56.930 57.773 -0.843 26022 22 1 1 . 1 1 5 5 GLU CB C 5 30.554 30.554 30.767 -0.213 26022 23 1 1 . 1 1 5 5 GLU H H 5 8.464 8.464 8.434 0.030 26022 24 1 1 . 1 1 6 6 LYS N N 6 121.437 121.437 118.988 2.449 26022 25 1 1 . 1 1 6 6 LYS HA H 6 4.282 4.282 4.516 -0.234 26022 26 1 1 . 1 1 6 6 LYS C C 6 177.185 177.185 175.950 1.235 26022 27 1 1 . 1 1 6 6 LYS CA C 6 56.930 56.930 55.895 1.035 26022 28 1 1 . 1 1 6 6 LYS CB C 6 32.713 32.713 33.673 -0.960 26022 29 1 1 . 1 1 6 6 LYS H H 6 8.390 8.390 7.786 0.604 26022 30 1 1 . 1 1 7 7 SER N N 7 115.822 115.822 111.035 4.787 26022 31 1 1 . 1 1 7 7 SER HA H 7 4.396 4.396 4.240 0.156 26022 32 1 1 . 1 1 7 7 SER C C 7 174.609 174.609 174.674 -0.065 26022 33 1 1 . 1 1 7 7 SER CA C 7 58.684 58.684 59.526 -0.842 26022 34 1 1 . 1 1 7 7 SER CB C 7 63.608 63.608 62.055 1.553 26022 35 1 1 . 1 1 7 7 SER H H 7 8.205 8.205 8.908 -0.703 26022 36 1 1 . 1 1 8 8 LYS N N 8 122.643 122.643 119.051 3.592 26022 37 1 1 . 1 1 8 8 LYS HA H 8 4.407 4.407 4.200 0.207 26022 38 1 1 . 1 1 8 8 LYS C C 8 176.694 176.694 176.717 -0.023 26022 39 1 1 . 1 1 8 8 LYS CA C 8 56.390 56.390 57.383 -0.993 26022 40 1 1 . 1 1 8 8 LYS CB C 8 33.185 33.185 32.779 0.406 26022 41 1 1 . 1 1 8 8 LYS H H 8 8.201 8.201 8.507 -0.306 26022 42 1 1 . 1 1 9 9 THR N N 9 113.900 113.900 114.065 -0.165 26022 43 1 1 . 1 1 9 9 THR HA H 9 4.341 4.341 4.271 0.070 26022 44 1 1 . 1 1 9 9 THR C C 9 173.438 173.438 172.983 0.455 26022 45 1 1 . 1 1 9 9 THR CA C 9 62.529 62.529 62.329 0.200 26022 46 1 1 . 1 1 9 9 THR CB C 9 69.342 69.342 68.319 1.023 26022 47 1 1 . 1 1 10 10 LEU N N 10 124.082 124.082 126.697 -2.615 26022 48 1 1 . 1 1 10 10 LEU HA H 10 4.858 4.858 4.566 0.292 26022 49 1 1 . 1 1 10 10 LEU C C 10 175.804 175.804 174.678 1.126 26022 50 1 1 . 1 1 10 10 LEU CA C 10 53.759 53.759 54.332 -0.573 26022 51 1 1 . 1 1 10 10 LEU CB C 10 44.653 44.653 45.695 -1.042 26022 52 1 1 . 1 1 10 10 LEU H H 10 7.786 7.786 7.926 -0.140 26022 53 1 1 . 1 1 11 11 PHE N N 11 120.942 120.942 125.752 -4.810 26022 54 1 1 . 1 1 11 11 PHE HA H 11 4.862 4.862 4.901 -0.039 26022 55 1 1 . 1 1 11 11 PHE C C 11 173.578 173.578 173.743 -0.165 26022 56 1 1 . 1 1 11 11 PHE CA C 11 56.120 56.120 56.416 -0.296 26022 57 1 1 . 1 1 11 11 PHE CB C 11 41.212 41.212 42.904 -1.692 26022 58 1 1 . 1 1 11 11 PHE H H 11 8.889 8.889 9.322 -0.433 26022 59 1 1 . 1 1 12 12 GLU N N 12 119.958 119.958 125.267 -5.309 26022 60 1 1 . 1 1 12 12 GLU HA H 12 5.539 5.539 5.152 0.387 26022 61 1 1 . 1 1 12 12 GLU C C 12 176.295 176.295 174.932 1.363 26022 62 1 1 . 1 1 12 12 GLU CA C 12 54.501 54.501 54.402 0.099 26022 63 1 1 . 1 1 12 12 GLU CB C 12 31.768 31.768 32.245 -0.477 26022 64 1 1 . 1 1 12 12 GLU H H 12 8.285 8.285 7.738 0.547 26022 65 1 1 . 1 1 13 13 VAL N N 13 120.742 120.742 125.381 -4.639 26022 66 1 1 . 1 1 13 13 VAL HA H 13 4.570 4.570 4.283 0.287 26022 67 1 1 . 1 1 13 13 VAL C C 13 173.415 173.415 174.906 -1.491 26022 68 1 1 . 1 1 13 13 VAL CA C 13 59.696 59.696 60.532 -0.836 26022 69 1 1 . 1 1 13 13 VAL CB C 13 36.018 36.018 34.150 1.868 26022 70 1 1 . 1 1 14 14 GLU N N 14 122.848 122.848 126.741 -3.893 26022 71 1 1 . 1 1 14 14 GLU HA H 14 5.226 5.226 4.968 0.258 26022 72 1 1 . 1 1 14 14 GLU C C 14 176.295 176.295 175.998 0.297 26022 73 1 1 . 1 1 14 14 GLU CA C 14 55.243 55.243 55.816 -0.573 26022 74 1 1 . 1 1 14 14 GLU CB C 14 32.173 32.173 30.879 1.294 26022 75 1 1 . 1 1 14 14 GLU H H 14 8.492 8.492 8.921 -0.429 26022 76 1 1 . 1 1 15 15 GLY N N 15 105.005 105.005 111.202 -6.197 26022 77 1 1 . 1 1 15 15 GLY C C 15 170.393 170.393 171.977 -1.584 26022 78 1 1 . 1 1 15 15 GLY CA C 15 46.002 46.002 44.676 1.326 26022 79 1 1 . 1 1 15 15 GLY H H 15 8.454 8.454 8.547 -0.093 26022 80 1 1 . 1 1 16 16 ALA N N 16 120.909 120.909 120.408 0.501 26022 81 1 1 . 1 1 16 16 ALA HA H 16 5.526 5.526 4.866 0.660 26022 82 1 1 . 1 1 16 16 ALA C C 16 176.834 176.834 175.231 1.603 26022 83 1 1 . 1 1 16 16 ALA CA C 16 49.644 49.644 51.031 -1.387 26022 84 1 1 . 1 1 16 16 ALA CB C 16 22.054 22.054 22.616 -0.562 26022 85 1 1 . 1 1 16 16 ALA H H 16 8.206 8.206 7.885 0.321 26022 86 1 1 . 1 1 17 17 VAL N N 17 122.567 122.567 121.874 0.693 26022 87 1 1 . 1 1 17 17 VAL HA H 17 4.380 4.380 4.054 0.326 26022 88 1 1 . 1 1 17 17 VAL C C 17 178.099 178.099 175.421 2.678 26022 89 1 1 . 1 1 17 17 VAL CA C 17 63.608 63.608 63.041 0.568 26022 90 1 1 . 1 1 17 17 VAL CB C 17 32.105 32.105 33.334 -1.229 26022 91 1 1 . 1 1 18 18 THR N N 18 120.937 120.937 123.914 -2.977 26022 92 1 1 . 1 1 18 18 THR HA H 18 4.601 4.601 4.544 0.057 26022 93 1 1 . 1 1 18 18 THR C C 18 175.312 175.312 173.993 1.319 26022 94 1 1 . 1 1 18 18 THR CA C 18 61.517 61.517 62.072 -0.555 26022 95 1 1 . 1 1 18 18 THR CB C 18 69.814 69.814 69.391 0.423 26022 96 1 1 . 1 1 19 19 ALA N N 19 121.258 121.258 123.147 -1.889 26022 97 1 1 . 1 1 19 19 ALA HA H 19 4.458 4.458 4.654 -0.196 26022 98 1 1 . 1 1 19 19 ALA C C 19 174.703 174.703 174.570 0.133 26022 99 1 1 . 1 1 19 19 ALA CA C 19 53.017 53.017 51.994 1.023 26022 100 1 1 . 1 1 19 19 ALA CB C 19 22.054 22.054 21.089 0.965 26022 101 1 1 . 1 1 19 19 ALA H H 19 7.716 7.716 7.675 0.041 26022 102 1 1 . 1 1 20 20 LEU N N 20 123.420 123.420 118.911 4.509 26022 103 1 1 . 1 1 20 20 LEU HA H 20 4.393 4.393 5.542 -1.149 26022 104 1 1 . 1 1 20 20 LEU C C 20 175.499 175.499 175.015 0.484 26022 105 1 1 . 1 1 20 20 LEU CA C 20 54.839 54.839 52.790 2.049 26022 106 1 1 . 1 1 20 20 LEU CB C 20 41.212 41.212 45.051 -3.839 26022 107 1 1 . 1 1 20 20 LEU H H 20 8.711 8.711 8.301 0.410 26022 108 1 1 . 1 1 21 21 LEU N N 21 124.718 124.718 121.449 3.269 26022 109 1 1 . 1 1 21 21 LEU HA H 21 4.714 4.714 4.906 -0.192 26022 110 1 1 . 1 1 21 21 LEU C C 21 174.328 174.328 175.521 -1.193 26022 111 1 1 . 1 1 21 21 LEU CA C 21 52.680 52.680 52.003 0.677 26022 112 1 1 . 1 1 21 21 LEU CB C 21 41.684 41.684 43.566 -1.883 26022 113 1 1 . 1 1 21 21 LEU H H 21 7.773 7.773 8.429 -0.656 26022 114 1 1 . 1 1 22 22 PRO HA H 22 4.380 4.380 4.312 0.068 26022 115 1 1 . 1 1 22 22 PRO C C 22 175.616 175.616 176.016 -0.400 26022 116 1 1 . 1 1 22 22 PRO CA C 22 62.529 62.529 64.439 -1.910 26022 117 1 1 . 1 1 22 22 PRO CB C 22 32.240 32.240 31.328 0.913 26022 118 1 1 . 1 1 23 23 ALA N N 23 120.693 120.693 119.483 1.210 26022 119 1 1 . 1 1 23 23 ALA HA H 23 4.302 4.302 4.496 -0.194 26022 120 1 1 . 1 1 23 23 ALA C C 23 176.178 176.178 176.661 -0.483 26022 121 1 1 . 1 1 23 23 ALA CA C 23 52.882 52.882 50.838 2.044 26022 122 1 1 . 1 1 23 23 ALA CB C 23 17.336 17.336 18.186 -0.850 26022 123 1 1 . 1 1 23 23 ALA H H 23 8.675 8.675 7.668 1.007 26022 124 1 1 . 1 1 24 24 ALA N N 24 115.540 115.540 119.890 -4.350 26022 125 1 1 . 1 1 24 24 ALA HA H 24 3.820 3.820 3.694 0.126 26022 126 1 1 . 1 1 24 24 ALA C C 24 175.546 175.546 175.422 0.124 26022 127 1 1 . 1 1 24 24 ALA CA C 24 52.613 52.613 52.932 -0.319 26022 128 1 1 . 1 1 24 24 ALA CB C 24 16.590 16.590 17.032 -0.442 26022 129 1 1 . 1 1 24 24 ALA H H 24 8.381 8.381 7.788 0.593 26022 130 1 1 . 1 1 25 25 GLU N N 25 114.082 114.082 117.435 -3.353 26022 131 1 1 . 1 1 25 25 GLU HA H 25 5.148 5.148 3.715 1.433 26022 132 1 1 . 1 1 25 25 GLU C C 25 175.757 175.757 174.392 1.365 26022 133 1 1 . 1 1 25 25 GLU CA C 25 54.911 54.911 54.319 0.592 26022 134 1 1 . 1 1 25 25 GLU CB C 25 32.645 32.645 31.306 1.339 26022 135 1 1 . 1 1 25 25 GLU H H 25 6.378 6.378 7.120 -0.742 26022 136 1 1 . 1 1 26 26 PHE N N 26 117.365 117.365 124.576 -7.211 26022 137 1 1 . 1 1 26 26 PHE HA H 26 4.979 4.979 4.875 0.104 26022 138 1 1 . 1 1 26 26 PHE C C 26 174.960 174.960 175.014 -0.054 26022 139 1 1 . 1 1 26 26 PHE CA C 26 56.862 56.862 56.699 0.163 26022 140 1 1 . 1 1 26 26 PHE CB C 26 43.371 43.371 40.354 3.017 26022 141 1 1 . 1 1 26 26 PHE H H 26 8.950 8.950 8.659 0.291 26022 142 1 1 . 1 1 27 27 ARG N N 27 125.082 125.082 123.938 1.144 26022 143 1 1 . 1 1 27 27 ARG HA H 27 4.992 4.992 5.097 -0.105 26022 144 1 1 . 1 1 27 27 ARG C C 27 175.148 175.148 175.569 -0.421 26022 145 1 1 . 1 1 27 27 ARG CA C 27 56.323 56.323 55.231 1.092 26022 146 1 1 . 1 1 27 27 ARG CB C 27 32.240 32.240 31.732 0.508 26022 147 1 1 . 1 1 27 27 ARG H H 27 8.799 8.799 8.749 0.050 26022 148 1 1 . 1 1 28 28 VAL N N 28 127.456 127.456 120.217 7.239 26022 149 1 1 . 1 1 28 28 VAL HA H 28 4.757 4.757 4.821 -0.064 26022 150 1 1 . 1 1 28 28 VAL C C 28 173.602 173.602 174.231 -0.629 26022 151 1 1 . 1 1 28 28 VAL CA C 28 60.303 60.303 59.782 0.521 26022 152 1 1 . 1 1 28 28 VAL CB C 28 35.681 35.681 34.863 0.818 26022 153 1 1 . 1 1 29 29 LYS N N 29 128.096 128.096 121.883 6.213 26022 154 1 1 . 1 1 29 29 LYS HA H 29 4.354 4.354 5.052 -0.698 26022 155 1 1 . 1 1 29 29 LYS C C 29 176.740 176.740 175.101 1.639 26022 156 1 1 . 1 1 29 29 LYS CA C 29 55.041 55.041 53.671 1.370 26022 157 1 1 . 1 1 29 29 LYS CB C 29 34.062 34.062 34.067 -0.005 26022 158 1 1 . 1 1 29 29 LYS H H 29 9.268 9.268 8.977 0.291 26022 159 1 1 . 1 1 30 30 LEU N N 30 129.600 129.600 126.151 3.449 26022 160 1 1 . 1 1 30 30 LEU HA H 30 4.653 4.653 4.452 0.201 26022 161 1 1 . 1 1 30 30 LEU C C 30 178.193 178.193 177.213 0.980 26022 162 1 1 . 1 1 30 30 LEU CA C 30 54.771 54.771 54.363 0.408 26022 163 1 1 . 1 1 30 30 LEU CB C 30 42.224 42.224 44.409 -2.185 26022 164 1 1 . 1 1 30 30 LEU H H 30 9.000 9.000 8.960 0.040 26022 165 1 1 . 1 1 31 31 ASP N N 31 120.478 120.478 124.798 -4.320 26022 166 1 1 . 1 1 31 31 ASP HA H 31 4.458 4.458 4.414 0.044 26022 167 1 1 . 1 1 31 31 ASP C C 31 176.155 176.155 176.329 -0.174 26022 168 1 1 . 1 1 31 31 ASP CA C 31 55.918 55.918 56.924 -1.006 26022 169 1 1 . 1 1 31 31 ASP CB C 31 39.593 39.593 40.555 -0.962 26022 170 1 1 . 1 1 31 31 ASP H H 31 8.698 8.698 8.802 -0.104 26022 171 1 1 . 1 1 32 32 ASN N N 32 115.450 115.450 117.033 -1.583 26022 172 1 1 . 1 1 32 32 ASN HA H 32 4.588 4.588 4.708 -0.120 26022 173 1 1 . 1 1 32 32 ASN C C 32 175.335 175.335 174.427 0.908 26022 174 1 1 . 1 1 32 32 ASN CA C 32 53.152 53.152 53.022 0.130 26022 175 1 1 . 1 1 32 32 ASN CB C 32 37.367 37.367 38.608 -1.241 26022 176 1 1 . 1 1 32 32 ASN H H 32 7.680 7.680 7.724 -0.044 26022 177 1 1 . 1 1 33 33 GLU N N 33 111.790 111.790 117.317 -5.527 26022 178 1 1 . 1 1 33 33 GLU HA H 33 3.898 3.898 3.859 0.039 26022 179 1 1 . 1 1 33 33 GLU C C 33 175.733 175.733 174.383 1.350 26022 180 1 1 . 1 1 33 33 GLU CA C 33 58.144 58.144 57.693 0.451 26022 181 1 1 . 1 1 33 33 GLU CB C 33 28.242 28.242 27.533 0.709 26022 182 1 1 . 1 1 33 33 GLU H H 33 8.097 8.097 7.759 0.338 26022 183 1 1 . 1 1 34 34 HIS N N 34 119.193 119.193 118.274 0.919 26022 184 1 1 . 1 1 34 34 HIS HA H 34 4.201 4.201 4.819 -0.618 26022 185 1 1 . 1 1 34 34 HIS C C 34 173.789 173.789 173.767 0.022 26022 186 1 1 . 1 1 34 34 HIS CA C 34 56.053 56.053 54.579 1.474 26022 187 1 1 . 1 1 34 34 HIS CB C 34 30.487 30.487 32.638 -2.151 26022 188 1 1 . 1 1 34 34 HIS H H 34 7.890 7.890 7.681 0.209 26022 189 1 1 . 1 1 35 35 GLU HA H 35 5.400 5.400 5.314 0.086 26022 190 1 1 . 1 1 35 35 GLU C C 35 175.944 175.944 176.315 -0.371 26022 191 1 1 . 1 1 35 35 GLU CA C 35 55.109 55.109 55.673 -0.564 26022 192 1 1 . 1 1 35 35 GLU CB C 35 32.308 32.308 30.140 2.168 26022 193 1 1 . 1 1 36 36 ILE N N 36 119.077 119.077 118.462 0.615 26022 194 1 1 . 1 1 36 36 ILE HA H 36 4.686 4.686 4.621 0.065 26022 195 1 1 . 1 1 36 36 ILE C C 36 173.790 173.790 174.575 -0.785 26022 196 1 1 . 1 1 36 36 ILE CA C 36 59.156 59.156 59.078 0.078 26022 197 1 1 . 1 1 36 36 ILE CB C 36 42.696 42.696 41.712 0.983 26022 198 1 1 . 1 1 37 37 ILE N N 37 122.787 122.787 120.764 2.023 26022 199 1 1 . 1 1 37 37 ILE HA H 37 4.778 4.778 4.236 0.542 26022 200 1 1 . 1 1 37 37 ILE C C 37 177.057 177.057 175.436 1.621 26022 201 1 1 . 1 1 37 37 ILE CA C 37 59.723 59.723 61.301 -1.578 26022 202 1 1 . 1 1 37 37 ILE CB C 37 37.949 37.949 38.983 -1.034 26022 203 1 1 . 1 1 38 38 CYS N N 38 122.357 122.357 123.247 -0.890 26022 204 1 1 . 1 1 38 38 CYS HA H 38 5.708 5.708 5.337 0.371 26022 205 1 1 . 1 1 38 38 CYS C C 38 174.258 174.258 173.365 0.893 26022 206 1 1 . 1 1 38 38 CYS CA C 38 56.930 56.930 56.882 0.048 26022 207 1 1 . 1 1 38 38 CYS CB C 38 33.252 33.252 31.002 2.250 26022 208 1 1 . 1 1 38 38 CYS H H 38 9.512 9.512 8.517 0.995 26022 209 1 1 . 1 1 39 39 HIS N N 39 117.101 117.101 119.296 -2.195 26022 210 1 1 . 1 1 39 39 HIS HA H 39 5.526 5.526 5.043 0.483 26022 211 1 1 . 1 1 39 39 HIS C C 39 174.516 174.516 174.679 -0.163 26022 212 1 1 . 1 1 39 39 HIS CA C 39 54.097 54.097 55.126 -1.029 26022 213 1 1 . 1 1 39 39 HIS CB C 39 31.701 31.701 34.972 -3.271 26022 214 1 1 . 1 1 39 39 HIS H H 39 7.597 7.597 9.381 -1.784 26022 215 1 1 . 1 1 40 40 VAL N N 40 117.923 117.923 119.314 -1.391 26022 216 1 1 . 1 1 40 40 VAL HA H 40 4.614 4.614 4.434 0.180 26022 217 1 1 . 1 1 40 40 VAL C C 40 175.804 175.804 175.846 -0.042 26022 218 1 1 . 1 1 40 40 VAL CA C 40 61.382 61.382 62.801 -1.419 26022 219 1 1 . 1 1 40 40 VAL CB C 40 33.396 33.396 31.760 1.636 26022 220 1 1 . 1 1 41 41 SER N N 41 119.242 119.242 122.396 -3.154 26022 221 1 1 . 1 1 41 41 SER HA H 41 4.550 4.550 4.711 -0.161 26022 222 1 1 . 1 1 41 41 SER C C 41 174.656 174.656 173.526 1.130 26022 223 1 1 . 1 1 41 41 SER CA C 41 58.126 58.126 58.150 -0.024 26022 224 1 1 . 1 1 41 41 SER CB C 41 63.470 63.470 64.156 -0.686 26022 225 1 1 . 1 1 41 41 SER H H 41 8.341 8.341 8.912 -0.571 26022 226 1 1 . 1 1 42 42 GLY N N 42 110.569 110.569 109.061 1.508 26022 227 1 1 . 1 1 42 42 GLY C C 42 173.829 173.829 173.891 -0.062 26022 228 1 1 . 1 1 42 42 GLY CA C 42 45.257 45.257 45.128 0.129 26022 229 1 1 . 1 1 42 42 GLY H H 42 8.380 8.380 7.825 0.555 26022 230 1 1 . 1 1 43 43 LYS HA H 43 3.977 3.977 4.089 -0.112 26022 231 1 1 . 1 1 43 43 LYS C C 43 179.363 179.363 178.296 1.067 26022 232 1 1 . 1 1 43 43 LYS CA C 43 59.628 59.628 58.111 1.517 26022 233 1 1 . 1 1 43 43 LYS CB C 43 32.510 32.510 32.445 0.065 26022 234 1 1 . 1 1 44 44 VAL N N 44 120.404 120.404 118.499 1.905 26022 235 1 1 . 1 1 44 44 VAL HA H 44 3.661 3.661 3.612 0.049 26022 236 1 1 . 1 1 44 44 VAL C C 44 179.785 179.785 177.650 2.135 26022 237 1 1 . 1 1 44 44 VAL CA C 44 65.425 65.425 65.446 -0.021 26022 238 1 1 . 1 1 44 44 VAL CB C 44 31.500 31.500 31.293 0.207 26022 239 1 1 . 1 1 45 45 ARG N N 45 123.687 123.687 118.368 5.319 26022 240 1 1 . 1 1 45 45 ARG HA H 45 4.054 4.054 4.138 -0.084 26022 241 1 1 . 1 1 45 45 ARG C C 45 179.504 179.504 178.327 1.177 26022 242 1 1 . 1 1 45 45 ARG CA C 45 59.669 59.669 58.584 1.085 26022 243 1 1 . 1 1 45 45 ARG CB C 45 30.417 30.417 29.931 0.486 26022 244 1 1 . 1 1 45 45 ARG H H 45 8.608 8.608 7.754 0.854 26022 245 1 1 . 1 1 46 46 ARG N N 46 118.506 118.506 118.568 -0.062 26022 246 1 1 . 1 1 46 46 ARG HA H 46 4.148 4.148 4.291 -0.143 26022 247 1 1 . 1 1 46 46 ARG C C 46 177.396 177.396 178.301 -0.905 26022 248 1 1 . 1 1 46 46 ARG CA C 46 58.481 58.481 57.452 1.029 26022 249 1 1 . 1 1 46 46 ARG CB C 46 30.554 30.554 30.190 0.364 26022 250 1 1 . 1 1 46 46 ARG H H 46 8.474 8.474 7.602 0.872 26022 251 1 1 . 1 1 47 47 SER N N 47 114.263 114.263 113.490 0.773 26022 252 1 1 . 1 1 47 47 SER HA H 47 4.393 4.393 4.394 -0.001 26022 253 1 1 . 1 1 47 47 SER C C 47 174.070 174.070 173.895 0.175 26022 254 1 1 . 1 1 47 47 SER CA C 47 59.696 59.696 59.120 0.577 26022 255 1 1 . 1 1 47 47 SER CB C 47 64.013 64.013 63.847 0.166 26022 256 1 1 . 1 1 47 47 SER H H 47 7.645 7.645 8.178 -0.533 26022 257 1 1 . 1 1 48 48 LYS N N 48 115.405 115.405 119.383 -3.978 26022 258 1 1 . 1 1 48 48 LYS HA H 48 3.990 3.990 4.073 -0.083 26022 259 1 1 . 1 1 48 48 LYS C C 48 175.804 175.804 175.341 0.463 26022 260 1 1 . 1 1 48 48 LYS CA C 48 57.537 57.537 56.970 0.567 26022 261 1 1 . 1 1 48 48 LYS CB C 48 29.947 29.947 30.192 -0.245 26022 262 1 1 . 1 1 48 48 LYS H H 48 7.821 7.821 7.730 0.091 26022 263 1 1 . 1 1 49 49 ILE N N 49 117.265 117.265 121.059 -3.794 26022 264 1 1 . 1 1 49 49 ILE HA H 49 4.041 4.041 4.255 -0.214 26022 265 1 1 . 1 1 49 49 ILE C C 49 175.125 175.125 176.338 -1.213 26022 266 1 1 . 1 1 49 49 ILE CA C 49 61.315 61.315 58.716 2.599 26022 267 1 1 . 1 1 49 49 ILE CB C 49 38.919 38.919 38.953 -0.034 26022 268 1 1 . 1 1 50 50 ARG N N 50 126.687 126.687 126.353 0.334 26022 269 1 1 . 1 1 50 50 ARG HA H 50 4.471 4.471 4.453 0.018 26022 270 1 1 . 1 1 50 50 ARG C C 50 175.007 175.007 175.325 -0.318 26022 271 1 1 . 1 1 50 50 ARG CA C 50 55.176 55.176 55.615 -0.439 26022 272 1 1 . 1 1 50 50 ARG CB C 50 31.026 31.026 30.809 0.217 26022 273 1 1 . 1 1 50 50 ARG H H 50 8.437 8.437 8.425 0.012 26022 274 1 1 . 1 1 51 51 ILE N N 51 127.722 127.722 126.680 1.042 26022 275 1 1 . 1 1 51 51 ILE HA H 51 4.276 4.276 3.974 0.302 26022 276 1 1 . 1 1 51 51 ILE C C 51 174.726 174.726 175.679 -0.953 26022 277 1 1 . 1 1 51 51 ILE CA C 51 60.235 60.235 60.486 -0.251 26022 278 1 1 . 1 1 51 51 ILE CB C 51 37.772 37.772 37.862 -0.090 26022 279 1 1 . 1 1 52 52 ILE N N 52 121.888 121.888 123.477 -1.589 26022 280 1 1 . 1 1 52 52 ILE HA H 52 4.781 4.781 4.508 0.273 26022 281 1 1 . 1 1 52 52 ILE C C 52 175.733 175.733 174.917 0.816 26022 282 1 1 . 1 1 52 52 ILE CA C 52 59.021 59.021 59.329 -0.308 26022 283 1 1 . 1 1 52 52 ILE CB C 52 42.089 42.089 40.730 1.359 26022 284 1 1 . 1 1 53 53 ILE N N 53 119.363 119.363 123.715 -4.352 26022 285 1 1 . 1 1 53 53 ILE HA H 53 3.338 3.338 3.919 -0.581 26022 286 1 1 . 1 1 53 53 ILE C C 53 177.021 177.021 177.058 -0.037 26022 287 1 1 . 1 1 53 53 ILE CA C 53 64.274 64.274 62.448 1.826 26022 288 1 1 . 1 1 53 53 ILE CB C 53 37.256 37.256 37.925 -0.669 26022 289 1 1 . 1 1 54 54 GLY N N 54 116.136 116.136 115.434 0.702 26022 290 1 1 . 1 1 54 54 GLY C C 54 174.844 174.844 173.884 0.960 26022 291 1 1 . 1 1 54 54 GLY CA C 54 45.188 45.188 44.718 0.470 26022 292 1 1 . 1 1 54 54 GLY H H 54 8.853 8.853 8.964 -0.111 26022 293 1 1 . 1 1 55 55 ASP N N 55 121.946 121.946 120.837 1.109 26022 294 1 1 . 1 1 55 55 ASP HA H 55 4.588 4.588 4.856 -0.268 26022 295 1 1 . 1 1 55 55 ASP C C 55 175.804 175.804 175.193 0.611 26022 296 1 1 . 1 1 55 55 ASP CA C 55 55.200 55.200 52.482 2.718 26022 297 1 1 . 1 1 55 55 ASP CB C 55 41.048 41.048 42.049 -1.001 26022 298 1 1 . 1 1 55 55 ASP H H 55 8.054 8.054 7.681 0.373 26022 299 1 1 . 1 1 56 56 ARG N N 56 120.974 120.974 119.684 1.290 26022 300 1 1 . 1 1 56 56 ARG HA H 56 5.200 5.200 4.556 0.644 26022 301 1 1 . 1 1 56 56 ARG C C 56 176.483 176.483 175.815 0.668 26022 302 1 1 . 1 1 56 56 ARG CA C 56 54.097 54.097 55.704 -1.607 26022 303 1 1 . 1 1 56 56 ARG CB C 56 30.689 30.689 30.486 0.203 26022 304 1 1 . 1 1 56 56 ARG H H 56 8.766 8.766 8.374 0.392 26022 305 1 1 . 1 1 57 57 VAL N N 57 114.943 114.943 114.129 0.814 26022 306 1 1 . 1 1 57 57 VAL HA H 57 4.965 4.965 4.386 0.579 26022 307 1 1 . 1 1 57 57 VAL C C 57 172.243 172.243 173.670 -1.427 26022 308 1 1 . 1 1 57 57 VAL CA C 57 58.077 58.077 60.308 -2.231 26022 309 1 1 . 1 1 57 57 VAL CB C 57 36.288 36.288 35.171 1.117 26022 310 1 1 . 1 1 58 58 LEU N N 58 122.410 122.410 124.946 -2.536 26022 311 1 1 . 1 1 58 58 LEU HA H 58 4.731 4.731 5.095 -0.364 26022 312 1 1 . 1 1 58 58 LEU C C 58 174.773 174.773 175.636 -0.863 26022 313 1 1 . 1 1 58 58 LEU CA C 58 53.085 53.085 53.478 -0.393 26022 314 1 1 . 1 1 58 58 LEU CB C 58 45.788 45.788 43.723 2.065 26022 315 1 1 . 1 1 58 58 LEU H H 58 8.382 8.382 7.927 0.455 26022 316 1 1 . 1 1 59 59 VAL N N 59 127.937 127.937 128.978 -1.041 26022 317 1 1 . 1 1 59 59 VAL HA H 59 4.744 4.744 4.418 0.326 26022 318 1 1 . 1 1 59 59 VAL C C 59 174.141 174.141 174.984 -0.843 26022 319 1 1 . 1 1 59 59 VAL CA C 59 60.279 60.279 61.781 -1.502 26022 320 1 1 . 1 1 59 59 VAL CB C 59 34.399 34.399 31.929 2.470 26022 321 1 1 . 1 1 60 60 GLU N N 60 124.832 124.832 130.148 -5.316 26022 322 1 1 . 1 1 60 60 GLU HA H 60 5.304 5.304 5.015 0.289 26022 323 1 1 . 1 1 60 60 GLU C C 60 176.155 176.155 175.669 0.486 26022 324 1 1 . 1 1 60 60 GLU CA C 60 54.164 54.164 55.397 -1.233 26022 325 1 1 . 1 1 60 60 GLU CB C 60 33.803 33.803 30.383 3.420 26022 326 1 1 . 1 1 60 60 GLU H H 60 9.142 9.142 8.731 0.411 26022 327 1 1 . 1 1 61 61 MET N N 61 124.187 124.187 123.028 1.159 26022 328 1 1 . 1 1 61 61 MET HA H 61 4.899 4.899 5.069 -0.170 26022 329 1 1 . 1 1 61 61 MET C C 61 173.953 173.953 173.593 0.360 26022 330 1 1 . 1 1 61 61 MET CA C 61 54.232 54.232 53.333 0.899 26022 331 1 1 . 1 1 61 61 MET CB C 61 37.256 37.256 37.051 0.205 26022 332 1 1 . 1 1 61 61 MET H H 61 8.984 8.984 9.034 -0.050 26022 333 1 1 . 1 1 62 62 SER N N 62 116.623 116.623 115.477 1.146 26022 334 1 1 . 1 1 62 62 SER HA H 62 4.263 4.263 4.715 -0.452 26022 335 1 1 . 1 1 62 62 SER C C 62 176.413 176.413 175.253 1.160 26022 336 1 1 . 1 1 62 62 SER CA C 62 56.893 56.893 55.442 1.451 26022 337 1 1 . 1 1 62 62 SER CB C 62 65.362 65.362 64.801 0.561 26022 338 1 1 . 1 1 62 62 SER H H 62 9.167 9.167 8.752 0.415 26022 339 1 1 . 1 1 63 63 ILE N N 63 121.187 121.187 124.778 -3.591 26022 340 1 1 . 1 1 63 63 ILE HA H 63 3.989 3.989 3.892 0.097 26022 341 1 1 . 1 1 63 63 ILE C C 63 176.623 176.623 176.795 -0.172 26022 342 1 1 . 1 1 63 63 ILE CA C 63 63.878 63.878 60.870 3.008 26022 343 1 1 . 1 1 63 63 ILE CB C 63 38.244 38.244 36.770 1.474 26022 344 1 1 . 1 1 64 64 TYR N N 64 120.214 120.214 119.271 0.943 26022 345 1 1 . 1 1 64 64 TYR HA H 64 4.432 4.432 4.223 0.209 26022 346 1 1 . 1 1 64 64 TYR C C 64 177.092 177.092 176.988 0.104 26022 347 1 1 . 1 1 64 64 TYR CA C 64 59.156 59.156 60.547 -1.391 26022 348 1 1 . 1 1 64 64 TYR CB C 64 38.109 38.109 38.376 -0.267 26022 349 1 1 . 1 1 64 64 TYR H H 64 7.762 7.762 7.283 0.479 26022 350 1 1 . 1 1 65 65 ASP N N 65 121.338 121.338 114.339 6.999 26022 351 1 1 . 1 1 65 65 ASP HA H 65 4.495 4.495 4.594 -0.099 26022 352 1 1 . 1 1 65 65 ASP C C 65 177.349 177.349 178.252 -0.903 26022 353 1 1 . 1 1 65 65 ASP CA C 65 55.243 55.243 54.805 0.438 26022 354 1 1 . 1 1 65 65 ASP CB C 65 40.538 40.538 41.028 -0.490 26022 355 1 1 . 1 1 65 65 ASP H H 65 7.798 7.798 8.716 -0.918 26022 356 1 1 . 1 1 66 66 ARG N N 66 121.118 121.118 122.578 -1.460 26022 357 1 1 . 1 1 66 66 ARG HA H 66 4.069 4.069 4.095 -0.026 26022 358 1 1 . 1 1 66 66 ARG C C 66 178.448 178.448 176.786 1.662 26022 359 1 1 . 1 1 66 66 ARG CA C 66 58.401 58.401 59.060 -0.659 26022 360 1 1 . 1 1 66 66 ARG CB C 66 30.184 30.184 29.035 1.149 26022 361 1 1 . 1 1 66 66 ARG H H 66 8.382 8.382 8.774 -0.392 26022 362 1 1 . 1 1 67 67 ASN N N 67 117.334 117.334 116.337 0.997 26022 363 1 1 . 1 1 67 67 ASN HA H 67 4.601 4.601 4.955 -0.354 26022 364 1 1 . 1 1 67 67 ASN C C 67 175.288 175.288 174.817 0.471 26022 365 1 1 . 1 1 67 67 ASN CA C 67 54.097 54.097 52.611 1.486 26022 366 1 1 . 1 1 67 67 ASN CB C 67 38.514 38.514 37.660 0.855 26022 367 1 1 . 1 1 67 67 ASN H H 67 8.194 8.194 8.098 0.096 26022 368 1 1 . 1 1 68 68 ALA N N 68 122.187 122.187 122.629 -0.442 26022 369 1 1 . 1 1 68 68 ALA HA H 68 4.575 4.575 4.519 0.056 26022 370 1 1 . 1 1 68 68 ALA C C 68 176.272 176.272 178.620 -2.348 26022 371 1 1 . 1 1 68 68 ALA CA C 68 52.478 52.478 53.869 -1.391 26022 372 1 1 . 1 1 68 68 ALA CB C 68 19.086 19.086 19.250 -0.164 26022 373 1 1 . 1 1 68 68 ALA H H 68 7.658 7.658 7.502 0.156 26022 374 1 1 . 1 1 69 69 LYS N N 69 116.931 116.931 116.783 0.148 26022 375 1 1 . 1 1 69 69 LYS HA H 69 4.197 4.197 4.225 -0.028 26022 376 1 1 . 1 1 69 69 LYS C C 69 176.085 176.085 175.486 0.599 26022 377 1 1 . 1 1 69 69 LYS CA C 69 56.728 56.728 58.062 -1.334 26022 378 1 1 . 1 1 69 69 LYS CB C 69 31.566 31.566 33.150 -1.584 26022 379 1 1 . 1 1 69 69 LYS H H 69 8.255 8.255 8.318 -0.063 26022 380 1 1 . 1 1 70 70 LYS N N 70 119.854 119.854 114.901 4.953 26022 381 1 1 . 1 1 70 70 LYS HA H 70 5.526 5.526 5.244 0.282 26022 382 1 1 . 1 1 70 70 LYS C C 70 175.171 175.171 175.476 -0.305 26022 383 1 1 . 1 1 70 70 LYS CA C 70 54.704 54.704 54.316 0.388 26022 384 1 1 . 1 1 70 70 LYS CB C 70 36.850 36.850 35.670 1.180 26022 385 1 1 . 1 1 70 70 LYS H H 70 8.182 8.182 7.458 0.724 26022 386 1 1 . 1 1 71 71 GLY N N 71 103.604 103.604 107.608 -4.004 26022 387 1 1 . 1 1 71 71 GLY C C 71 171.541 171.541 173.014 -1.473 26022 388 1 1 . 1 1 71 71 GLY CA C 71 45.462 45.462 43.137 2.325 26022 389 1 1 . 1 1 71 71 GLY H H 71 7.780 7.780 8.474 -0.694 26022 390 1 1 . 1 1 72 72 ARG N N 72 119.187 119.187 120.245 -1.058 26022 391 1 1 . 1 1 72 72 ARG HA H 72 4.861 4.861 5.126 -0.265 26022 392 1 1 . 1 1 72 72 ARG C C 72 175.570 175.570 175.633 -0.063 26022 393 1 1 . 1 1 72 72 ARG CA C 72 53.624 53.624 55.409 -1.785 26022 394 1 1 . 1 1 72 72 ARG CB C 72 34.129 34.129 31.067 3.062 26022 395 1 1 . 1 1 72 72 ARG H H 72 8.007 8.007 8.635 -0.628 26022 396 1 1 . 1 1 73 73 ILE N N 73 125.721 125.721 125.544 0.177 26022 397 1 1 . 1 1 73 73 ILE HA H 73 4.263 4.263 4.680 -0.417 26022 398 1 1 . 1 1 73 73 ILE C C 73 175.312 175.312 174.136 1.176 26022 399 1 1 . 1 1 73 73 ILE CA C 73 62.259 62.259 60.058 2.201 26022 400 1 1 . 1 1 73 73 ILE CB C 73 39.423 39.423 39.976 -0.553 26022 401 1 1 . 1 1 74 74 ILE N N 74 120.540 120.540 128.143 -7.603 26022 402 1 1 . 1 1 74 74 ILE HA H 74 4.596 4.596 4.282 0.314 26022 403 1 1 . 1 1 74 74 ILE C C 74 176.249 176.249 174.025 2.224 26022 404 1 1 . 1 1 74 74 ILE CA C 74 60.910 60.910 60.707 0.203 26022 405 1 1 . 1 1 74 74 ILE CB C 74 39.863 39.863 40.103 -0.240 26022 406 1 1 . 1 1 75 75 ARG N N 75 118.582 118.582 116.907 1.675 26022 407 1 1 . 1 1 75 75 ARG HA H 75 4.289 4.289 4.296 -0.007 26022 408 1 1 . 1 1 75 75 ARG C C 75 173.883 173.883 174.189 -0.306 26022 409 1 1 . 1 1 75 75 ARG CA C 75 56.390 56.390 55.268 1.122 26022 410 1 1 . 1 1 75 75 ARG CB C 75 34.669 34.669 32.102 2.567 26022 411 1 1 . 1 1 75 75 ARG H H 75 7.397 7.397 7.772 -0.375 26022 412 1 1 . 1 1 76 76 ARG N N 76 125.606 125.606 121.848 3.758 26022 413 1 1 . 1 1 76 76 ARG HA H 76 4.609 4.609 4.286 0.323 26022 414 1 1 . 1 1 76 76 ARG C C 76 175.312 175.312 175.737 -0.425 26022 415 1 1 . 1 1 76 76 ARG CA C 76 55.810 55.810 55.906 -0.096 26022 416 1 1 . 1 1 76 76 ARG CB C 76 31.094 31.094 29.767 1.327 26022 417 1 1 . 1 1 76 76 ARG H H 76 9.094 9.094 8.227 0.867 26022 418 1 1 . 1 1 77 77 LEU N N 77 128.575 128.575 122.692 5.883 26022 419 1 1 . 1 1 77 77 LEU HA H 77 4.372 4.372 4.503 -0.131 26022 420 1 1 . 1 1 77 77 LEU C C 77 176.225 176.225 176.457 -0.232 26022 421 1 1 . 1 1 77 77 LEU CA C 77 54.704 54.704 54.298 0.406 26022 422 1 1 . 1 1 77 77 LEU CB C 77 42.292 42.292 42.655 -0.363 26022 423 1 1 . 1 1 77 77 LEU H H 77 8.742 8.742 8.114 0.628 26022 424 1 1 . 1 1 78 78 LYS N N 78 119.592 119.592 119.956 -0.364 26022 425 1 1 . 1 1 78 78 LYS HA H 78 4.302 4.302 4.296 0.006 26022 426 1 1 . 1 1 78 78 LYS C C 78 176.296 176.296 177.960 -1.664 26022 427 1 1 . 1 1 78 78 LYS CA C 78 56.390 56.390 56.235 0.155 26022 428 1 1 . 1 1 78 78 LYS CB C 78 33.994 33.994 32.203 1.791 26022 429 1 1 . 1 1 78 78 LYS H H 78 8.090 8.090 8.391 -0.301 26022 430 1 1 . 1 1 79 79 GLY N N 79 110.854 110.854 113.808 -2.954 26022 431 1 1 . 1 1 79 79 GLY C C 79 174.328 174.328 174.169 0.159 26022 432 1 1 . 1 1 79 79 GLY CA C 79 44.990 44.990 44.648 0.342 26022 433 1 1 . 1 1 79 79 GLY H H 79 8.520 8.520 8.696 -0.176 26022 434 1 1 . 1 1 80 80 THR N N 80 114.187 114.187 111.457 2.730 26022 435 1 1 . 1 1 80 80 THR HA H 80 4.237 4.237 3.927 0.310 26022 436 1 1 . 1 1 80 80 THR C C 80 175.054 175.054 174.281 0.773 26022 437 1 1 . 1 1 80 80 THR CA C 80 62.242 62.242 62.726 -0.484 26022 438 1 1 . 1 1 80 80 THR CB C 80 69.826 69.826 67.610 2.216 26022 439 1 1 . 1 1 81 81 SER N N 81 117.958 117.958 113.218 4.740 26022 440 1 1 . 1 1 81 81 SER HA H 81 4.449 4.449 4.431 0.018 26022 441 1 1 . 1 1 81 81 SER C C 81 174.703 174.703 174.786 -0.083 26022 442 1 1 . 1 1 81 81 SER CA C 81 58.481 58.481 58.846 -0.365 26022 443 1 1 . 1 1 81 81 SER CB C 81 63.338 63.338 63.526 -0.188 26022 444 1 1 . 1 1 81 81 SER H H 81 8.474 8.474 8.102 0.372 26022 445 1 1 . 1 1 82 82 ASP HA H 82 4.280 4.280 4.585 -0.305 26022 446 1 1 . 1 1 82 82 ASP C C 82 177.115 177.115 176.778 0.337 26022 447 1 1 . 1 1 82 82 ASP CA C 82 55.176 55.176 54.153 1.023 26022 448 1 1 . 1 1 82 82 ASP CB C 82 42.359 42.359 40.496 1.863 26022 449 1 1 . 1 1 83 83 ARG N N 83 121.531 121.531 120.093 1.438 26022 450 1 1 . 1 1 83 83 ARG HA H 83 4.346 4.346 4.160 0.186 26022 451 1 1 . 1 1 83 83 ARG C C 83 176.342 176.342 176.956 -0.614 26022 452 1 1 . 1 1 83 83 ARG CA C 83 56.053 56.053 58.539 -2.486 26022 453 1 1 . 1 1 83 83 ARG CB C 83 30.891 30.891 30.471 0.420 26022 454 1 1 . 1 1 83 83 ARG H H 83 8.259 8.259 8.014 0.245 26022 455 1 1 . 1 1 84 84 THR N N 84 116.462 116.462 108.519 7.943 26022 456 1 1 . 1 1 84 84 THR HA H 84 4.333 4.333 4.349 -0.016 26022 457 1 1 . 1 1 84 84 THR C C 84 174.445 174.445 173.732 0.713 26022 458 1 1 . 1 1 84 84 THR CA C 84 62.254 62.254 61.765 0.489 26022 459 1 1 . 1 1 84 84 THR CB C 84 69.833 69.833 70.796 -0.963 26022 460 1 1 . 1 1 85 85 ILE N N 85 123.762 123.762 118.778 4.984 26022 461 1 1 . 1 1 85 85 ILE HA H 85 4.188 4.188 3.845 0.343 26022 462 1 1 . 1 1 85 85 ILE C C 85 176.155 176.155 175.217 0.938 26022 463 1 1 . 1 1 85 85 ILE CA C 85 61.112 61.112 62.145 -1.032 26022 464 1 1 . 1 1 85 85 ILE CB C 85 38.919 38.919 36.237 2.682 26022 465 1 1 . 1 1 86 86 SER N N 86 120.214 120.214 113.516 6.698 26022 466 1 1 . 1 1 86 86 SER HA H 86 4.451 4.451 4.142 0.309 26022 467 1 1 . 1 1 86 86 SER C C 86 174.586 174.586 174.068 0.518 26022 468 1 1 . 1 1 86 86 SER CA C 86 58.212 58.212 59.569 -1.357 26022 469 1 1 . 1 1 86 86 SER CB C 86 63.271 63.271 62.070 1.201 26022 470 1 1 . 1 1 86 86 SER H H 86 8.377 8.377 8.159 0.218 26022 471 1 2 . 1 1 2 2 VAL N N 2 122.187 122.187 123.031 -0.844 26022 472 1 2 . 1 1 2 2 VAL HA H 2 4.091 4.091 4.251 -0.160 26022 473 1 2 . 1 1 2 2 VAL C C 2 175.921 175.921 174.500 1.421 26022 474 1 2 . 1 1 2 2 VAL CA C 2 62.057 62.057 62.025 0.032 26022 475 1 2 . 1 1 2 2 VAL CB C 2 32.848 32.848 32.266 0.582 26022 476 1 2 . 1 1 3 3 LYS N N 3 125.437 125.437 126.169 -0.732 26022 477 1 2 . 1 1 3 3 LYS HA H 3 4.289 4.289 4.714 -0.425 26022 478 1 2 . 1 1 3 3 LYS C C 3 176.155 176.155 174.891 1.264 26022 479 1 2 . 1 1 3 3 LYS CA C 3 56.323 56.323 55.747 0.576 26022 480 1 2 . 1 1 3 3 LYS CB C 3 33.320 33.320 33.536 -0.216 26022 481 1 2 . 1 1 3 3 LYS H H 3 8.396 8.396 8.298 0.098 26022 482 1 2 . 1 1 4 4 ASP N N 4 121.937 121.937 122.919 -0.982 26022 483 1 2 . 1 1 4 4 ASP HA H 4 4.289 4.289 4.742 -0.453 26022 484 1 2 . 1 1 4 4 ASP C C 4 176.319 176.319 177.190 -0.871 26022 485 1 2 . 1 1 4 4 ASP CA C 4 54.029 54.029 55.112 -1.083 26022 486 1 2 . 1 1 4 4 ASP CB C 4 41.280 41.280 41.950 -0.671 26022 487 1 2 . 1 1 4 4 ASP H H 4 8.325 8.325 8.441 -0.116 26022 488 1 2 . 1 1 5 5 GLU N N 5 122.369 122.369 119.744 2.625 26022 489 1 2 . 1 1 5 5 GLU HA H 5 4.250 4.250 4.092 0.158 26022 490 1 2 . 1 1 5 5 GLU C C 5 177.045 177.045 177.689 -0.644 26022 491 1 2 . 1 1 5 5 GLU CA C 5 56.930 56.930 58.512 -1.582 26022 492 1 2 . 1 1 5 5 GLU CB C 5 30.554 30.554 29.401 1.153 26022 493 1 2 . 1 1 5 5 GLU H H 5 8.464 8.464 8.646 -0.182 26022 494 1 2 . 1 1 6 6 LYS N N 6 121.437 121.437 118.362 3.075 26022 495 1 2 . 1 1 6 6 LYS HA H 6 4.282 4.282 4.398 -0.116 26022 496 1 2 . 1 1 6 6 LYS C C 6 177.185 177.185 175.964 1.221 26022 497 1 2 . 1 1 6 6 LYS CA C 6 56.930 56.930 55.508 1.422 26022 498 1 2 . 1 1 6 6 LYS CB C 6 32.713 32.713 31.714 0.999 26022 499 1 2 . 1 1 6 6 LYS H H 6 8.390 8.390 8.150 0.240 26022 500 1 2 . 1 1 7 7 SER N N 7 115.822 115.822 117.511 -1.689 26022 501 1 2 . 1 1 7 7 SER HA H 7 4.396 4.396 4.406 -0.010 26022 502 1 2 . 1 1 7 7 SER C C 7 174.609 174.609 174.607 0.002 26022 503 1 2 . 1 1 7 7 SER CA C 7 58.684 58.684 59.206 -0.522 26022 504 1 2 . 1 1 7 7 SER CB C 7 63.608 63.608 62.786 0.822 26022 505 1 2 . 1 1 7 7 SER H H 7 8.205 8.205 7.580 0.625 26022 506 1 2 . 1 1 8 8 LYS N N 8 122.643 122.643 125.087 -2.444 26022 507 1 2 . 1 1 8 8 LYS HA H 8 4.407 4.407 4.394 0.013 26022 508 1 2 . 1 1 8 8 LYS C C 8 176.694 176.694 176.853 -0.159 26022 509 1 2 . 1 1 8 8 LYS CA C 8 56.390 56.390 56.568 -0.178 26022 510 1 2 . 1 1 8 8 LYS CB C 8 33.185 33.185 32.853 0.332 26022 511 1 2 . 1 1 8 8 LYS H H 8 8.201 8.201 8.203 -0.002 26022 512 1 2 . 1 1 9 9 THR N N 9 113.900 113.900 118.773 -4.873 26022 513 1 2 . 1 1 9 9 THR HA H 9 4.341 4.341 4.428 -0.087 26022 514 1 2 . 1 1 9 9 THR C C 9 173.438 173.438 173.113 0.325 26022 515 1 2 . 1 1 9 9 THR CA C 9 62.529 62.529 62.221 0.308 26022 516 1 2 . 1 1 9 9 THR CB C 9 69.342 69.342 67.671 1.671 26022 517 1 2 . 1 1 10 10 LEU N N 10 124.082 124.082 121.396 2.686 26022 518 1 2 . 1 1 10 10 LEU HA H 10 4.858 4.858 4.707 0.151 26022 519 1 2 . 1 1 10 10 LEU C C 10 175.804 175.804 174.296 1.508 26022 520 1 2 . 1 1 10 10 LEU CA C 10 53.759 53.759 54.269 -0.510 26022 521 1 2 . 1 1 10 10 LEU CB C 10 44.653 44.653 44.722 -0.069 26022 522 1 2 . 1 1 10 10 LEU H H 10 7.786 7.786 7.529 0.257 26022 523 1 2 . 1 1 11 11 PHE N N 11 120.942 120.942 120.361 0.581 26022 524 1 2 . 1 1 11 11 PHE HA H 11 4.862 4.862 4.873 -0.011 26022 525 1 2 . 1 1 11 11 PHE C C 11 173.578 173.578 174.097 -0.519 26022 526 1 2 . 1 1 11 11 PHE CA C 11 56.120 56.120 57.394 -1.274 26022 527 1 2 . 1 1 11 11 PHE CB C 11 41.212 41.212 42.816 -1.604 26022 528 1 2 . 1 1 11 11 PHE H H 11 8.889 8.889 8.190 0.699 26022 529 1 2 . 1 1 12 12 GLU N N 12 119.958 119.958 126.642 -6.684 26022 530 1 2 . 1 1 12 12 GLU HA H 12 5.539 5.539 4.904 0.635 26022 531 1 2 . 1 1 12 12 GLU C C 12 176.295 176.295 174.716 1.579 26022 532 1 2 . 1 1 12 12 GLU CA C 12 54.501 54.501 55.471 -0.970 26022 533 1 2 . 1 1 12 12 GLU CB C 12 31.768 31.768 30.792 0.976 26022 534 1 2 . 1 1 12 12 GLU H H 12 8.285 8.285 8.150 0.135 26022 535 1 2 . 1 1 13 13 VAL N N 13 120.742 120.742 122.802 -2.060 26022 536 1 2 . 1 1 13 13 VAL HA H 13 4.570 4.570 4.155 0.415 26022 537 1 2 . 1 1 13 13 VAL C C 13 173.415 173.415 174.058 -0.643 26022 538 1 2 . 1 1 13 13 VAL CA C 13 59.696 59.696 59.738 -0.042 26022 539 1 2 . 1 1 13 13 VAL CB C 13 36.018 36.018 36.235 -0.217 26022 540 1 2 . 1 1 14 14 GLU N N 14 122.848 122.848 122.551 0.297 26022 541 1 2 . 1 1 14 14 GLU HA H 14 5.226 5.226 5.103 0.123 26022 542 1 2 . 1 1 14 14 GLU C C 14 176.295 176.295 176.388 -0.093 26022 543 1 2 . 1 1 14 14 GLU CA C 14 55.243 55.243 55.357 -0.114 26022 544 1 2 . 1 1 14 14 GLU CB C 14 32.173 32.173 30.300 1.873 26022 545 1 2 . 1 1 14 14 GLU H H 14 8.492 8.492 8.493 -0.001 26022 546 1 2 . 1 1 15 15 GLY N N 15 105.005 105.005 109.278 -4.273 26022 547 1 2 . 1 1 15 15 GLY C C 15 170.393 170.393 172.021 -1.628 26022 548 1 2 . 1 1 15 15 GLY CA C 15 46.002 46.002 44.028 1.974 26022 549 1 2 . 1 1 15 15 GLY H H 15 8.454 8.454 8.926 -0.472 26022 550 1 2 . 1 1 16 16 ALA N N 16 120.909 120.909 121.928 -1.019 26022 551 1 2 . 1 1 16 16 ALA HA H 16 5.526 5.526 5.025 0.501 26022 552 1 2 . 1 1 16 16 ALA C C 16 176.834 176.834 175.688 1.146 26022 553 1 2 . 1 1 16 16 ALA CA C 16 49.644 49.644 50.624 -0.980 26022 554 1 2 . 1 1 16 16 ALA CB C 16 22.054 22.054 22.265 -0.211 26022 555 1 2 . 1 1 16 16 ALA H H 16 8.206 8.206 8.131 0.075 26022 556 1 2 . 1 1 17 17 VAL N N 17 122.567 122.567 124.289 -1.722 26022 557 1 2 . 1 1 17 17 VAL HA H 17 4.380 4.380 4.119 0.261 26022 558 1 2 . 1 1 17 17 VAL C C 17 178.099 178.099 175.170 2.929 26022 559 1 2 . 1 1 17 17 VAL CA C 17 63.608 63.608 62.641 0.967 26022 560 1 2 . 1 1 17 17 VAL CB C 17 32.105 32.105 32.584 -0.479 26022 561 1 2 . 1 1 18 18 THR N N 18 120.937 120.937 125.509 -4.572 26022 562 1 2 . 1 1 18 18 THR HA H 18 4.601 4.601 4.437 0.164 26022 563 1 2 . 1 1 18 18 THR C C 18 175.312 175.312 173.773 1.539 26022 564 1 2 . 1 1 18 18 THR CA C 18 61.517 61.517 62.418 -0.901 26022 565 1 2 . 1 1 18 18 THR CB C 18 69.814 69.814 69.627 0.187 26022 566 1 2 . 1 1 19 19 ALA N N 19 121.258 121.258 123.093 -1.835 26022 567 1 2 . 1 1 19 19 ALA HA H 19 4.458 4.458 4.611 -0.153 26022 568 1 2 . 1 1 19 19 ALA C C 19 174.703 174.703 174.741 -0.038 26022 569 1 2 . 1 1 19 19 ALA CA C 19 53.017 53.017 51.993 1.024 26022 570 1 2 . 1 1 19 19 ALA CB C 19 22.054 22.054 20.676 1.378 26022 571 1 2 . 1 1 19 19 ALA H H 19 7.716 7.716 7.547 0.169 26022 572 1 2 . 1 1 20 20 LEU N N 20 123.420 123.420 118.072 5.348 26022 573 1 2 . 1 1 20 20 LEU HA H 20 4.393 4.393 5.161 -0.768 26022 574 1 2 . 1 1 20 20 LEU C C 20 175.499 175.499 174.794 0.705 26022 575 1 2 . 1 1 20 20 LEU CA C 20 54.839 54.839 53.342 1.497 26022 576 1 2 . 1 1 20 20 LEU CB C 20 41.212 41.212 45.416 -4.204 26022 577 1 2 . 1 1 20 20 LEU H H 20 8.711 8.711 8.265 0.446 26022 578 1 2 . 1 1 21 21 LEU N N 21 124.718 124.718 121.553 3.165 26022 579 1 2 . 1 1 21 21 LEU HA H 21 4.714 4.714 4.882 -0.168 26022 580 1 2 . 1 1 21 21 LEU C C 21 174.328 174.328 176.147 -1.819 26022 581 1 2 . 1 1 21 21 LEU CA C 21 52.680 52.680 51.855 0.825 26022 582 1 2 . 1 1 21 21 LEU CB C 21 41.684 41.684 43.145 -1.461 26022 583 1 2 . 1 1 21 21 LEU H H 21 7.773 7.773 8.731 -0.958 26022 584 1 2 . 1 1 22 22 PRO HA H 22 4.380 4.380 4.370 0.010 26022 585 1 2 . 1 1 22 22 PRO C C 22 175.616 175.616 175.637 -0.021 26022 586 1 2 . 1 1 22 22 PRO CA C 22 62.529 62.529 63.443 -0.914 26022 587 1 2 . 1 1 22 22 PRO CB C 22 32.240 32.240 30.108 2.132 26022 588 1 2 . 1 1 23 23 ALA N N 23 120.693 120.693 121.044 -0.351 26022 589 1 2 . 1 1 23 23 ALA HA H 23 4.302 4.302 4.376 -0.074 26022 590 1 2 . 1 1 23 23 ALA C C 23 176.178 176.178 176.885 -0.707 26022 591 1 2 . 1 1 23 23 ALA CA C 23 52.882 52.882 51.568 1.314 26022 592 1 2 . 1 1 23 23 ALA CB C 23 17.336 17.336 19.551 -2.215 26022 593 1 2 . 1 1 23 23 ALA H H 23 8.675 8.675 7.835 0.840 26022 594 1 2 . 1 1 24 24 ALA N N 24 115.540 115.540 119.781 -4.241 26022 595 1 2 . 1 1 24 24 ALA HA H 24 3.820 3.820 3.534 0.286 26022 596 1 2 . 1 1 24 24 ALA C C 24 175.546 175.546 175.261 0.285 26022 597 1 2 . 1 1 24 24 ALA CA C 24 52.613 52.613 53.011 -0.398 26022 598 1 2 . 1 1 24 24 ALA CB C 24 16.590 16.590 17.098 -0.508 26022 599 1 2 . 1 1 24 24 ALA H H 24 8.381 8.381 8.233 0.148 26022 600 1 2 . 1 1 25 25 GLU N N 25 114.082 114.082 117.664 -3.582 26022 601 1 2 . 1 1 25 25 GLU HA H 25 5.148 5.148 4.832 0.316 26022 602 1 2 . 1 1 25 25 GLU C C 25 175.757 175.757 174.670 1.087 26022 603 1 2 . 1 1 25 25 GLU CA C 25 54.911 54.911 54.160 0.751 26022 604 1 2 . 1 1 25 25 GLU CB C 25 32.645 32.645 31.790 0.855 26022 605 1 2 . 1 1 25 25 GLU H H 25 6.378 6.378 7.126 -0.748 26022 606 1 2 . 1 1 26 26 PHE N N 26 117.365 117.365 123.938 -6.573 26022 607 1 2 . 1 1 26 26 PHE HA H 26 4.979 4.979 4.832 0.147 26022 608 1 2 . 1 1 26 26 PHE C C 26 174.960 174.960 174.581 0.379 26022 609 1 2 . 1 1 26 26 PHE CA C 26 56.862 56.862 56.883 -0.021 26022 610 1 2 . 1 1 26 26 PHE CB C 26 43.371 43.371 42.328 1.043 26022 611 1 2 . 1 1 26 26 PHE H H 26 8.950 8.950 9.276 -0.326 26022 612 1 2 . 1 1 27 27 ARG N N 27 125.082 125.082 122.541 2.541 26022 613 1 2 . 1 1 27 27 ARG HA H 27 4.992 4.992 5.259 -0.267 26022 614 1 2 . 1 1 27 27 ARG C C 27 175.148 175.148 175.205 -0.057 26022 615 1 2 . 1 1 27 27 ARG CA C 27 56.323 56.323 54.941 1.382 26022 616 1 2 . 1 1 27 27 ARG CB C 27 32.240 32.240 32.192 0.048 26022 617 1 2 . 1 1 27 27 ARG H H 27 8.799 8.799 8.987 -0.188 26022 618 1 2 . 1 1 28 28 VAL N N 28 127.456 127.456 121.289 6.167 26022 619 1 2 . 1 1 28 28 VAL HA H 28 4.757 4.757 4.952 -0.195 26022 620 1 2 . 1 1 28 28 VAL C C 28 173.602 173.602 174.645 -1.043 26022 621 1 2 . 1 1 28 28 VAL CA C 28 60.303 60.303 59.754 0.549 26022 622 1 2 . 1 1 28 28 VAL CB C 28 35.681 35.681 33.721 1.960 26022 623 1 2 . 1 1 29 29 LYS N N 29 128.096 128.096 123.496 4.600 26022 624 1 2 . 1 1 29 29 LYS HA H 29 4.354 4.354 5.112 -0.758 26022 625 1 2 . 1 1 29 29 LYS C C 29 176.740 176.740 175.241 1.499 26022 626 1 2 . 1 1 29 29 LYS CA C 29 55.041 55.041 53.618 1.423 26022 627 1 2 . 1 1 29 29 LYS CB C 29 34.062 34.062 35.275 -1.213 26022 628 1 2 . 1 1 29 29 LYS H H 29 9.268 9.268 8.256 1.012 26022 629 1 2 . 1 1 30 30 LEU N N 30 129.600 129.600 124.842 4.758 26022 630 1 2 . 1 1 30 30 LEU HA H 30 4.653 4.653 4.527 0.126 26022 631 1 2 . 1 1 30 30 LEU C C 30 178.193 178.193 177.507 0.686 26022 632 1 2 . 1 1 30 30 LEU CA C 30 54.771 54.771 54.338 0.433 26022 633 1 2 . 1 1 30 30 LEU CB C 30 42.224 42.224 44.758 -2.534 26022 634 1 2 . 1 1 30 30 LEU H H 30 9.000 9.000 8.947 0.053 26022 635 1 2 . 1 1 31 31 ASP N N 31 120.478 120.478 124.988 -4.510 26022 636 1 2 . 1 1 31 31 ASP HA H 31 4.458 4.458 4.385 0.073 26022 637 1 2 . 1 1 31 31 ASP C C 31 176.155 176.155 176.259 -0.104 26022 638 1 2 . 1 1 31 31 ASP CA C 31 55.918 55.918 56.556 -0.638 26022 639 1 2 . 1 1 31 31 ASP CB C 31 39.593 39.593 40.349 -0.756 26022 640 1 2 . 1 1 31 31 ASP H H 31 8.698 8.698 8.851 -0.153 26022 641 1 2 . 1 1 32 32 ASN N N 32 115.450 115.450 117.820 -2.370 26022 642 1 2 . 1 1 32 32 ASN HA H 32 4.588 4.588 4.664 -0.076 26022 643 1 2 . 1 1 32 32 ASN C C 32 175.335 175.335 174.120 1.215 26022 644 1 2 . 1 1 32 32 ASN CA C 32 53.152 53.152 52.745 0.408 26022 645 1 2 . 1 1 32 32 ASN CB C 32 37.367 37.367 38.191 -0.824 26022 646 1 2 . 1 1 32 32 ASN H H 32 7.680 7.680 7.782 -0.102 26022 647 1 2 . 1 1 33 33 GLU N N 33 111.790 111.790 115.438 -3.648 26022 648 1 2 . 1 1 33 33 GLU HA H 33 3.898 3.898 3.926 -0.028 26022 649 1 2 . 1 1 33 33 GLU C C 33 175.733 175.733 174.909 0.824 26022 650 1 2 . 1 1 33 33 GLU CA C 33 58.144 58.144 57.503 0.641 26022 651 1 2 . 1 1 33 33 GLU CB C 33 28.242 28.242 26.986 1.256 26022 652 1 2 . 1 1 33 33 GLU H H 33 8.097 8.097 7.889 0.208 26022 653 1 2 . 1 1 34 34 HIS N N 34 119.193 119.193 117.304 1.889 26022 654 1 2 . 1 1 34 34 HIS HA H 34 4.201 4.201 4.866 -0.665 26022 655 1 2 . 1 1 34 34 HIS C C 34 173.789 173.789 173.579 0.210 26022 656 1 2 . 1 1 34 34 HIS CA C 34 56.053 56.053 54.883 1.170 26022 657 1 2 . 1 1 34 34 HIS CB C 34 30.487 30.487 33.356 -2.869 26022 658 1 2 . 1 1 34 34 HIS H H 34 7.890 7.890 7.751 0.139 26022 659 1 2 . 1 1 35 35 GLU HA H 35 5.400 5.400 5.206 0.194 26022 660 1 2 . 1 1 35 35 GLU C C 35 175.944 175.944 176.057 -0.113 26022 661 1 2 . 1 1 35 35 GLU CA C 35 55.109 55.109 54.919 0.191 26022 662 1 2 . 1 1 35 35 GLU CB C 35 32.308 32.308 31.259 1.049 26022 663 1 2 . 1 1 36 36 ILE N N 36 119.077 119.077 116.475 2.602 26022 664 1 2 . 1 1 36 36 ILE HA H 36 4.686 4.686 4.634 0.052 26022 665 1 2 . 1 1 36 36 ILE C C 36 173.790 173.790 174.430 -0.640 26022 666 1 2 . 1 1 36 36 ILE CA C 36 59.156 59.156 59.460 -0.304 26022 667 1 2 . 1 1 36 36 ILE CB C 36 42.696 42.696 41.521 1.175 26022 668 1 2 . 1 1 37 37 ILE N N 37 122.787 122.787 122.060 0.727 26022 669 1 2 . 1 1 37 37 ILE HA H 37 4.778 4.778 4.424 0.354 26022 670 1 2 . 1 1 37 37 ILE C C 37 177.057 177.057 175.457 1.600 26022 671 1 2 . 1 1 37 37 ILE CA C 37 59.723 59.723 60.980 -1.257 26022 672 1 2 . 1 1 37 37 ILE CB C 37 37.949 37.949 38.722 -0.773 26022 673 1 2 . 1 1 38 38 CYS N N 38 122.357 122.357 125.936 -3.579 26022 674 1 2 . 1 1 38 38 CYS HA H 38 5.708 5.708 5.387 0.321 26022 675 1 2 . 1 1 38 38 CYS C C 38 174.258 174.258 173.588 0.670 26022 676 1 2 . 1 1 38 38 CYS CA C 38 56.930 56.930 56.621 0.309 26022 677 1 2 . 1 1 38 38 CYS CB C 38 33.252 33.252 30.129 3.123 26022 678 1 2 . 1 1 38 38 CYS H H 38 9.512 9.512 9.357 0.155 26022 679 1 2 . 1 1 39 39 HIS N N 39 117.101 117.101 121.300 -4.199 26022 680 1 2 . 1 1 39 39 HIS HA H 39 5.526 5.526 5.114 0.412 26022 681 1 2 . 1 1 39 39 HIS C C 39 174.516 174.516 174.057 0.459 26022 682 1 2 . 1 1 39 39 HIS CA C 39 54.097 54.097 55.330 -1.233 26022 683 1 2 . 1 1 39 39 HIS CB C 39 31.701 31.701 34.716 -3.015 26022 684 1 2 . 1 1 39 39 HIS H H 39 7.597 7.597 9.266 -1.669 26022 685 1 2 . 1 1 40 40 VAL N N 40 117.923 117.923 122.388 -4.465 26022 686 1 2 . 1 1 40 40 VAL HA H 40 4.614 4.614 4.315 0.299 26022 687 1 2 . 1 1 40 40 VAL C C 40 175.804 175.804 175.774 0.030 26022 688 1 2 . 1 1 40 40 VAL CA C 40 61.382 61.382 63.226 -1.844 26022 689 1 2 . 1 1 40 40 VAL CB C 40 33.396 33.396 31.751 1.645 26022 690 1 2 . 1 1 41 41 SER N N 41 119.242 119.242 122.121 -2.879 26022 691 1 2 . 1 1 41 41 SER HA H 41 4.550 4.550 4.705 -0.155 26022 692 1 2 . 1 1 41 41 SER C C 41 174.656 174.656 173.073 1.583 26022 693 1 2 . 1 1 41 41 SER CA C 41 58.126 58.126 57.899 0.227 26022 694 1 2 . 1 1 41 41 SER CB C 41 63.470 63.470 64.223 -0.753 26022 695 1 2 . 1 1 41 41 SER H H 41 8.341 8.341 8.870 -0.529 26022 696 1 2 . 1 1 42 42 GLY N N 42 110.569 110.569 108.340 2.229 26022 697 1 2 . 1 1 42 42 GLY C C 42 173.829 173.829 174.072 -0.243 26022 698 1 2 . 1 1 42 42 GLY CA C 42 45.257 45.257 44.733 0.524 26022 699 1 2 . 1 1 42 42 GLY H H 42 8.380 8.380 7.683 0.697 26022 700 1 2 . 1 1 43 43 LYS HA H 43 3.977 3.977 4.113 -0.136 26022 701 1 2 . 1 1 43 43 LYS C C 43 179.363 179.363 178.414 0.949 26022 702 1 2 . 1 1 43 43 LYS CA C 43 59.628 59.628 58.043 1.585 26022 703 1 2 . 1 1 43 43 LYS CB C 43 32.510 32.510 32.667 -0.157 26022 704 1 2 . 1 1 44 44 VAL N N 44 120.404 120.404 119.996 0.408 26022 705 1 2 . 1 1 44 44 VAL HA H 44 3.661 3.661 3.642 0.019 26022 706 1 2 . 1 1 44 44 VAL C C 44 179.785 179.785 177.110 2.675 26022 707 1 2 . 1 1 44 44 VAL CA C 44 65.425 65.425 65.096 0.329 26022 708 1 2 . 1 1 44 44 VAL CB C 44 31.500 31.500 31.495 0.005 26022 709 1 2 . 1 1 45 45 ARG N N 45 123.687 123.687 118.142 5.545 26022 710 1 2 . 1 1 45 45 ARG HA H 45 4.054 4.054 4.132 -0.078 26022 711 1 2 . 1 1 45 45 ARG C C 45 179.504 179.504 178.439 1.065 26022 712 1 2 . 1 1 45 45 ARG CA C 45 59.669 59.669 58.742 0.927 26022 713 1 2 . 1 1 45 45 ARG CB C 45 30.417 30.417 29.904 0.513 26022 714 1 2 . 1 1 45 45 ARG H H 45 8.608 8.608 7.807 0.801 26022 715 1 2 . 1 1 46 46 ARG N N 46 118.506 118.506 117.960 0.546 26022 716 1 2 . 1 1 46 46 ARG HA H 46 4.148 4.148 4.293 -0.145 26022 717 1 2 . 1 1 46 46 ARG C C 46 177.396 177.396 178.338 -0.942 26022 718 1 2 . 1 1 46 46 ARG CA C 46 58.481 58.481 57.970 0.511 26022 719 1 2 . 1 1 46 46 ARG CB C 46 30.554 30.554 30.091 0.463 26022 720 1 2 . 1 1 46 46 ARG H H 46 8.474 8.474 7.541 0.933 26022 721 1 2 . 1 1 47 47 SER N N 47 114.263 114.263 113.015 1.248 26022 722 1 2 . 1 1 47 47 SER HA H 47 4.393 4.393 4.481 -0.088 26022 723 1 2 . 1 1 47 47 SER C C 47 174.070 174.070 173.915 0.155 26022 724 1 2 . 1 1 47 47 SER CA C 47 59.696 59.696 58.575 1.121 26022 725 1 2 . 1 1 47 47 SER CB C 47 64.013 64.013 63.553 0.460 26022 726 1 2 . 1 1 47 47 SER H H 47 7.645 7.645 8.072 -0.427 26022 727 1 2 . 1 1 48 48 LYS N N 48 115.405 115.405 117.767 -2.362 26022 728 1 2 . 1 1 48 48 LYS HA H 48 3.990 3.990 3.934 0.056 26022 729 1 2 . 1 1 48 48 LYS C C 48 175.804 175.804 175.646 0.158 26022 730 1 2 . 1 1 48 48 LYS CA C 48 57.537 57.537 56.992 0.545 26022 731 1 2 . 1 1 48 48 LYS CB C 48 29.947 29.947 29.799 0.148 26022 732 1 2 . 1 1 48 48 LYS H H 48 7.821 7.821 7.508 0.313 26022 733 1 2 . 1 1 49 49 ILE N N 49 117.265 117.265 119.130 -1.865 26022 734 1 2 . 1 1 49 49 ILE HA H 49 4.041 4.041 4.011 0.030 26022 735 1 2 . 1 1 49 49 ILE C C 49 175.125 175.125 177.103 -1.978 26022 736 1 2 . 1 1 49 49 ILE CA C 49 61.315 61.315 60.524 0.791 26022 737 1 2 . 1 1 49 49 ILE CB C 49 38.919 38.919 37.755 1.164 26022 738 1 2 . 1 1 50 50 ARG N N 50 126.687 126.687 128.234 -1.547 26022 739 1 2 . 1 1 50 50 ARG HA H 50 4.471 4.471 4.381 0.090 26022 740 1 2 . 1 1 50 50 ARG C C 50 175.007 175.007 175.466 -0.459 26022 741 1 2 . 1 1 50 50 ARG CA C 50 55.176 55.176 55.695 -0.519 26022 742 1 2 . 1 1 50 50 ARG CB C 50 31.026 31.026 30.244 0.782 26022 743 1 2 . 1 1 50 50 ARG H H 50 8.437 8.437 8.361 0.076 26022 744 1 2 . 1 1 51 51 ILE N N 51 127.722 127.722 126.861 0.861 26022 745 1 2 . 1 1 51 51 ILE HA H 51 4.276 4.276 3.967 0.309 26022 746 1 2 . 1 1 51 51 ILE C C 51 174.726 174.726 175.672 -0.946 26022 747 1 2 . 1 1 51 51 ILE CA C 51 60.235 60.235 61.223 -0.988 26022 748 1 2 . 1 1 51 51 ILE CB C 51 37.772 37.772 37.973 -0.201 26022 749 1 2 . 1 1 52 52 ILE N N 52 121.888 121.888 123.399 -1.511 26022 750 1 2 . 1 1 52 52 ILE HA H 52 4.781 4.781 4.509 0.272 26022 751 1 2 . 1 1 52 52 ILE C C 52 175.733 175.733 174.895 0.838 26022 752 1 2 . 1 1 52 52 ILE CA C 52 59.021 59.021 59.089 -0.068 26022 753 1 2 . 1 1 52 52 ILE CB C 52 42.089 42.089 40.492 1.597 26022 754 1 2 . 1 1 53 53 ILE N N 53 119.363 119.363 122.628 -3.265 26022 755 1 2 . 1 1 53 53 ILE HA H 53 3.338 3.338 3.958 -0.620 26022 756 1 2 . 1 1 53 53 ILE C C 53 177.021 177.021 176.943 0.078 26022 757 1 2 . 1 1 53 53 ILE CA C 53 64.274 64.274 62.139 2.135 26022 758 1 2 . 1 1 53 53 ILE CB C 53 37.256 37.256 38.066 -0.810 26022 759 1 2 . 1 1 54 54 GLY N N 54 116.136 116.136 115.213 0.923 26022 760 1 2 . 1 1 54 54 GLY C C 54 174.844 174.844 173.470 1.374 26022 761 1 2 . 1 1 54 54 GLY CA C 54 45.188 45.188 44.833 0.355 26022 762 1 2 . 1 1 54 54 GLY H H 54 8.853 8.853 8.846 0.007 26022 763 1 2 . 1 1 55 55 ASP N N 55 121.946 121.946 120.261 1.685 26022 764 1 2 . 1 1 55 55 ASP HA H 55 4.588 4.588 4.806 -0.218 26022 765 1 2 . 1 1 55 55 ASP C C 55 175.804 175.804 175.276 0.528 26022 766 1 2 . 1 1 55 55 ASP CA C 55 55.200 55.200 52.240 2.959 26022 767 1 2 . 1 1 55 55 ASP CB C 55 41.048 41.048 42.752 -1.704 26022 768 1 2 . 1 1 55 55 ASP H H 55 8.054 8.054 7.726 0.328 26022 769 1 2 . 1 1 56 56 ARG N N 56 120.974 120.974 121.849 -0.875 26022 770 1 2 . 1 1 56 56 ARG HA H 56 5.200 5.200 4.781 0.419 26022 771 1 2 . 1 1 56 56 ARG C C 56 176.483 176.483 175.629 0.854 26022 772 1 2 . 1 1 56 56 ARG CA C 56 54.097 54.097 55.095 -0.998 26022 773 1 2 . 1 1 56 56 ARG CB C 56 30.689 30.689 30.304 0.385 26022 774 1 2 . 1 1 56 56 ARG H H 56 8.766 8.766 8.589 0.177 26022 775 1 2 . 1 1 57 57 VAL N N 57 114.943 114.943 116.018 -1.075 26022 776 1 2 . 1 1 57 57 VAL HA H 57 4.965 4.965 4.476 0.489 26022 777 1 2 . 1 1 57 57 VAL C C 57 172.243 172.243 173.227 -0.984 26022 778 1 2 . 1 1 57 57 VAL CA C 57 58.077 58.077 59.363 -1.286 26022 779 1 2 . 1 1 57 57 VAL CB C 57 36.288 36.288 35.349 0.939 26022 780 1 2 . 1 1 58 58 LEU N N 58 122.410 122.410 125.265 -2.855 26022 781 1 2 . 1 1 58 58 LEU HA H 58 4.731 4.731 5.032 -0.301 26022 782 1 2 . 1 1 58 58 LEU C C 58 174.773 174.773 175.748 -0.975 26022 783 1 2 . 1 1 58 58 LEU CA C 58 53.085 53.085 53.588 -0.503 26022 784 1 2 . 1 1 58 58 LEU CB C 58 45.788 45.788 42.665 3.123 26022 785 1 2 . 1 1 58 58 LEU H H 58 8.382 8.382 7.764 0.618 26022 786 1 2 . 1 1 59 59 VAL N N 59 127.937 127.937 127.867 0.070 26022 787 1 2 . 1 1 59 59 VAL HA H 59 4.744 4.744 4.520 0.224 26022 788 1 2 . 1 1 59 59 VAL C C 59 174.141 174.141 174.101 0.040 26022 789 1 2 . 1 1 59 59 VAL CA C 59 60.279 60.279 60.067 0.212 26022 790 1 2 . 1 1 59 59 VAL CB C 59 34.399 34.399 33.686 0.713 26022 791 1 2 . 1 1 60 60 GLU N N 60 124.832 124.832 130.049 -5.217 26022 792 1 2 . 1 1 60 60 GLU HA H 60 5.304 5.304 4.553 0.751 26022 793 1 2 . 1 1 60 60 GLU C C 60 176.155 176.155 174.833 1.322 26022 794 1 2 . 1 1 60 60 GLU CA C 60 54.164 54.164 54.999 -0.835 26022 795 1 2 . 1 1 60 60 GLU CB C 60 33.803 33.803 30.903 2.900 26022 796 1 2 . 1 1 60 60 GLU H H 60 9.142 9.142 8.558 0.584 26022 797 1 2 . 1 1 61 61 MET N N 61 124.187 124.187 124.397 -0.210 26022 798 1 2 . 1 1 61 61 MET HA H 61 4.899 4.899 4.902 -0.003 26022 799 1 2 . 1 1 61 61 MET C C 61 173.953 173.953 174.329 -0.376 26022 800 1 2 . 1 1 61 61 MET CA C 61 54.232 54.232 53.730 0.502 26022 801 1 2 . 1 1 61 61 MET CB C 61 37.256 37.256 36.506 0.750 26022 802 1 2 . 1 1 61 61 MET H H 61 8.984 8.984 8.068 0.916 26022 803 1 2 . 1 1 62 62 SER N N 62 116.623 116.623 115.315 1.308 26022 804 1 2 . 1 1 62 62 SER HA H 62 4.263 4.263 4.865 -0.602 26022 805 1 2 . 1 1 62 62 SER C C 62 176.413 176.413 175.040 1.373 26022 806 1 2 . 1 1 62 62 SER CA C 62 56.893 56.893 56.940 -0.047 26022 807 1 2 . 1 1 62 62 SER CB C 62 65.362 65.362 64.885 0.477 26022 808 1 2 . 1 1 62 62 SER H H 62 9.167 9.167 8.182 0.985 26022 809 1 2 . 1 1 63 63 ILE N N 63 121.187 121.187 122.152 -0.965 26022 810 1 2 . 1 1 63 63 ILE HA H 63 3.989 3.989 3.902 0.087 26022 811 1 2 . 1 1 63 63 ILE C C 63 176.623 176.623 176.401 0.222 26022 812 1 2 . 1 1 63 63 ILE CA C 63 63.878 63.878 60.366 3.512 26022 813 1 2 . 1 1 63 63 ILE CB C 63 38.244 38.244 36.705 1.539 26022 814 1 2 . 1 1 64 64 TYR N N 64 120.214 120.214 118.790 1.424 26022 815 1 2 . 1 1 64 64 TYR HA H 64 4.432 4.432 4.303 0.129 26022 816 1 2 . 1 1 64 64 TYR C C 64 177.092 177.092 176.024 1.068 26022 817 1 2 . 1 1 64 64 TYR CA C 64 59.156 59.156 60.134 -0.978 26022 818 1 2 . 1 1 64 64 TYR CB C 64 38.109 38.109 38.875 -0.766 26022 819 1 2 . 1 1 64 64 TYR H H 64 7.762 7.762 7.742 0.020 26022 820 1 2 . 1 1 65 65 ASP N N 65 121.338 121.338 116.150 5.188 26022 821 1 2 . 1 1 65 65 ASP HA H 65 4.495 4.495 4.561 -0.067 26022 822 1 2 . 1 1 65 65 ASP C C 65 177.349 177.349 178.253 -0.904 26022 823 1 2 . 1 1 65 65 ASP CA C 65 55.243 55.243 55.356 -0.113 26022 824 1 2 . 1 1 65 65 ASP CB C 65 40.538 40.538 40.952 -0.414 26022 825 1 2 . 1 1 65 65 ASP H H 65 7.798 7.798 8.547 -0.749 26022 826 1 2 . 1 1 66 66 ARG N N 66 121.118 121.118 122.839 -1.721 26022 827 1 2 . 1 1 66 66 ARG HA H 66 4.069 4.069 4.102 -0.033 26022 828 1 2 . 1 1 66 66 ARG C C 66 178.448 178.448 177.075 1.373 26022 829 1 2 . 1 1 66 66 ARG CA C 66 58.401 58.401 58.839 -0.438 26022 830 1 2 . 1 1 66 66 ARG CB C 66 30.184 30.184 29.206 0.978 26022 831 1 2 . 1 1 66 66 ARG H H 66 8.382 8.382 8.759 -0.377 26022 832 1 2 . 1 1 67 67 ASN N N 67 117.334 117.334 117.744 -0.410 26022 833 1 2 . 1 1 67 67 ASN HA H 67 4.601 4.601 5.153 -0.552 26022 834 1 2 . 1 1 67 67 ASN C C 67 175.288 175.288 175.214 0.074 26022 835 1 2 . 1 1 67 67 ASN CA C 67 54.097 54.097 52.770 1.327 26022 836 1 2 . 1 1 67 67 ASN CB C 67 38.514 38.514 38.151 0.363 26022 837 1 2 . 1 1 67 67 ASN H H 67 8.194 8.194 8.476 -0.282 26022 838 1 2 . 1 1 68 68 ALA N N 68 122.187 122.187 121.770 0.417 26022 839 1 2 . 1 1 68 68 ALA HA H 68 4.575 4.575 4.636 -0.061 26022 840 1 2 . 1 1 68 68 ALA C C 68 176.272 176.272 178.458 -2.186 26022 841 1 2 . 1 1 68 68 ALA CA C 68 52.478 52.478 53.772 -1.294 26022 842 1 2 . 1 1 68 68 ALA CB C 68 19.086 19.086 19.549 -0.463 26022 843 1 2 . 1 1 68 68 ALA H H 68 7.658 7.658 8.094 -0.436 26022 844 1 2 . 1 1 69 69 LYS N N 69 116.931 116.931 117.192 -0.261 26022 845 1 2 . 1 1 69 69 LYS HA H 69 4.197 4.197 4.391 -0.194 26022 846 1 2 . 1 1 69 69 LYS C C 69 176.085 176.085 176.005 0.080 26022 847 1 2 . 1 1 69 69 LYS CA C 69 56.728 56.728 57.573 -0.845 26022 848 1 2 . 1 1 69 69 LYS CB C 69 31.566 31.566 34.192 -2.626 26022 849 1 2 . 1 1 69 69 LYS H H 69 8.255 8.255 8.026 0.229 26022 850 1 2 . 1 1 70 70 LYS N N 70 119.854 119.854 119.114 0.740 26022 851 1 2 . 1 1 70 70 LYS HA H 70 5.526 5.526 5.319 0.207 26022 852 1 2 . 1 1 70 70 LYS C C 70 175.171 175.171 176.289 -1.118 26022 853 1 2 . 1 1 70 70 LYS CA C 70 54.704 54.704 54.749 -0.045 26022 854 1 2 . 1 1 70 70 LYS CB C 70 36.850 36.850 34.895 1.955 26022 855 1 2 . 1 1 70 70 LYS H H 70 8.182 8.182 7.345 0.837 26022 856 1 2 . 1 1 71 71 GLY N N 71 103.604 103.604 109.765 -6.161 26022 857 1 2 . 1 1 71 71 GLY C C 71 171.541 171.541 172.875 -1.334 26022 858 1 2 . 1 1 71 71 GLY CA C 71 45.462 45.462 43.203 2.259 26022 859 1 2 . 1 1 71 71 GLY H H 71 7.780 7.780 9.092 -1.312 26022 860 1 2 . 1 1 72 72 ARG N N 72 119.187 119.187 120.422 -1.235 26022 861 1 2 . 1 1 72 72 ARG HA H 72 4.861 4.861 5.086 -0.225 26022 862 1 2 . 1 1 72 72 ARG C C 72 175.570 175.570 175.571 -0.001 26022 863 1 2 . 1 1 72 72 ARG CA C 72 53.624 53.624 55.271 -1.647 26022 864 1 2 . 1 1 72 72 ARG CB C 72 34.129 34.129 30.941 3.188 26022 865 1 2 . 1 1 72 72 ARG H H 72 8.007 8.007 8.790 -0.783 26022 866 1 2 . 1 1 73 73 ILE N N 73 125.721 125.721 124.144 1.577 26022 867 1 2 . 1 1 73 73 ILE HA H 73 4.263 4.263 4.377 -0.114 26022 868 1 2 . 1 1 73 73 ILE C C 73 175.312 175.312 174.546 0.766 26022 869 1 2 . 1 1 73 73 ILE CA C 73 62.259 62.259 60.005 2.254 26022 870 1 2 . 1 1 73 73 ILE CB C 73 39.423 39.423 40.605 -1.182 26022 871 1 2 . 1 1 74 74 ILE N N 74 120.540 120.540 125.823 -5.283 26022 872 1 2 . 1 1 74 74 ILE HA H 74 4.596 4.596 4.278 0.318 26022 873 1 2 . 1 1 74 74 ILE C C 74 176.249 176.249 173.647 2.602 26022 874 1 2 . 1 1 74 74 ILE CA C 74 60.910 60.910 60.784 0.126 26022 875 1 2 . 1 1 74 74 ILE CB C 74 39.863 39.863 39.637 0.226 26022 876 1 2 . 1 1 75 75 ARG N N 75 118.582 118.582 115.661 2.921 26022 877 1 2 . 1 1 75 75 ARG HA H 75 4.289 4.289 4.384 -0.095 26022 878 1 2 . 1 1 75 75 ARG C C 75 173.883 173.883 174.548 -0.665 26022 879 1 2 . 1 1 75 75 ARG CA C 75 56.390 56.390 55.539 0.851 26022 880 1 2 . 1 1 75 75 ARG CB C 75 34.669 34.669 32.453 2.216 26022 881 1 2 . 1 1 75 75 ARG H H 75 7.397 7.397 8.137 -0.740 26022 882 1 2 . 1 1 76 76 ARG N N 76 125.606 125.606 121.590 4.016 26022 883 1 2 . 1 1 76 76 ARG HA H 76 4.609 4.609 4.477 0.132 26022 884 1 2 . 1 1 76 76 ARG C C 76 175.312 175.312 175.183 0.129 26022 885 1 2 . 1 1 76 76 ARG CA C 76 55.810 55.810 54.755 1.055 26022 886 1 2 . 1 1 76 76 ARG CB C 76 31.094 31.094 30.723 0.371 26022 887 1 2 . 1 1 76 76 ARG H H 76 9.094 9.094 8.190 0.904 26022 888 1 2 . 1 1 77 77 LEU N N 77 128.575 128.575 126.286 2.289 26022 889 1 2 . 1 1 77 77 LEU HA H 77 4.372 4.372 4.220 0.152 26022 890 1 2 . 1 1 77 77 LEU C C 77 176.225 176.225 176.395 -0.170 26022 891 1 2 . 1 1 77 77 LEU CA C 77 54.704 54.704 54.923 -0.219 26022 892 1 2 . 1 1 77 77 LEU CB C 77 42.292 42.292 43.037 -0.745 26022 893 1 2 . 1 1 77 77 LEU H H 77 8.742 8.742 8.336 0.406 26022 894 1 2 . 1 1 78 78 LYS N N 78 119.592 119.592 123.527 -3.935 26022 895 1 2 . 1 1 78 78 LYS HA H 78 4.302 4.302 4.176 0.126 26022 896 1 2 . 1 1 78 78 LYS C C 78 176.296 176.296 177.229 -0.933 26022 897 1 2 . 1 1 78 78 LYS CA C 78 56.390 56.390 56.763 -0.373 26022 898 1 2 . 1 1 78 78 LYS CB C 78 33.994 33.994 32.187 1.807 26022 899 1 2 . 1 1 78 78 LYS H H 78 8.090 8.090 8.236 -0.146 26022 900 1 2 . 1 1 79 79 GLY N N 79 110.854 110.854 109.736 1.118 26022 901 1 2 . 1 1 79 79 GLY C C 79 174.328 174.328 174.190 0.138 26022 902 1 2 . 1 1 79 79 GLY CA C 79 44.990 44.990 44.585 0.405 26022 903 1 2 . 1 1 79 79 GLY H H 79 8.520 8.520 8.385 0.135 26022 904 1 2 . 1 1 80 80 THR N N 80 114.187 114.187 113.397 0.790 26022 905 1 2 . 1 1 80 80 THR HA H 80 4.237 4.237 4.479 -0.242 26022 906 1 2 . 1 1 80 80 THR C C 80 175.054 175.054 175.267 -0.213 26022 907 1 2 . 1 1 80 80 THR CA C 80 62.242 62.242 59.952 2.290 26022 908 1 2 . 1 1 80 80 THR CB C 80 69.826 69.826 69.647 0.179 26022 909 1 2 . 1 1 81 81 SER N N 81 117.958 117.958 119.391 -1.433 26022 910 1 2 . 1 1 81 81 SER HA H 81 4.449 4.449 4.723 -0.274 26022 911 1 2 . 1 1 81 81 SER C C 81 174.703 174.703 175.036 -0.333 26022 912 1 2 . 1 1 81 81 SER CA C 81 58.481 58.481 58.530 -0.049 26022 913 1 2 . 1 1 81 81 SER CB C 81 63.338 63.338 63.513 -0.175 26022 914 1 2 . 1 1 81 81 SER H H 81 8.474 8.474 8.790 -0.316 26022 915 1 2 . 1 1 82 82 ASP HA H 82 4.280 4.280 4.527 -0.247 26022 916 1 2 . 1 1 82 82 ASP C C 82 177.115 177.115 176.765 0.350 26022 917 1 2 . 1 1 82 82 ASP CA C 82 55.176 55.176 55.387 -0.211 26022 918 1 2 . 1 1 82 82 ASP CB C 82 42.359 42.359 41.448 0.911 26022 919 1 2 . 1 1 83 83 ARG N N 83 121.531 121.531 118.055 3.476 26022 920 1 2 . 1 1 83 83 ARG HA H 83 4.346 4.346 3.904 0.442 26022 921 1 2 . 1 1 83 83 ARG C C 83 176.342 176.342 177.292 -0.950 26022 922 1 2 . 1 1 83 83 ARG CA C 83 56.053 56.053 58.666 -2.613 26022 923 1 2 . 1 1 83 83 ARG CB C 83 30.891 30.891 28.310 2.581 26022 924 1 2 . 1 1 83 83 ARG H H 83 8.259 8.259 8.538 -0.279 26022 925 1 2 . 1 1 84 84 THR N N 84 116.462 116.462 114.723 1.739 26022 926 1 2 . 1 1 84 84 THR HA H 84 4.333 4.333 4.420 -0.087 26022 927 1 2 . 1 1 84 84 THR C C 84 174.445 174.445 174.984 -0.539 26022 928 1 2 . 1 1 84 84 THR CA C 84 62.254 62.254 64.017 -1.763 26022 929 1 2 . 1 1 84 84 THR CB C 84 69.833 69.833 69.781 0.052 26022 930 1 2 . 1 1 85 85 ILE N N 85 123.762 123.762 119.086 4.676 26022 931 1 2 . 1 1 85 85 ILE HA H 85 4.188 4.188 4.445 -0.257 26022 932 1 2 . 1 1 85 85 ILE C C 85 176.155 176.155 175.665 0.490 26022 933 1 2 . 1 1 85 85 ILE CA C 85 61.112 61.112 59.628 1.484 26022 934 1 2 . 1 1 85 85 ILE CB C 85 38.919 38.919 40.179 -1.260 26022 935 1 2 . 1 1 86 86 SER N N 86 120.214 120.214 116.509 3.705 26022 936 1 2 . 1 1 86 86 SER HA H 86 4.451 4.451 4.310 0.141 26022 937 1 2 . 1 1 86 86 SER C C 86 174.586 174.586 174.818 -0.232 26022 938 1 2 . 1 1 86 86 SER CA C 86 58.212 58.212 60.280 -2.068 26022 939 1 2 . 1 1 86 86 SER CB C 86 63.271 63.271 63.872 -0.601 26022 940 1 2 . 1 1 86 86 SER H H 86 8.377 8.377 8.441 -0.064 26022 941 1 3 . 1 1 2 2 VAL N N 2 122.187 122.187 120.564 1.623 26022 942 1 3 . 1 1 2 2 VAL HA H 2 4.091 4.091 3.775 0.316 26022 943 1 3 . 1 1 2 2 VAL C C 2 175.921 175.921 174.744 1.177 26022 944 1 3 . 1 1 2 2 VAL CA C 2 62.057 62.057 63.430 -1.373 26022 945 1 3 . 1 1 2 2 VAL CB C 2 32.848 32.848 30.132 2.716 26022 946 1 3 . 1 1 3 3 LYS N N 3 125.437 125.437 125.606 -0.169 26022 947 1 3 . 1 1 3 3 LYS HA H 3 4.289 4.289 4.696 -0.407 26022 948 1 3 . 1 1 3 3 LYS C C 3 176.155 176.155 175.530 0.625 26022 949 1 3 . 1 1 3 3 LYS CA C 3 56.323 56.323 55.635 0.688 26022 950 1 3 . 1 1 3 3 LYS CB C 3 33.320 33.320 33.263 0.057 26022 951 1 3 . 1 1 3 3 LYS H H 3 8.396 8.396 8.182 0.214 26022 952 1 3 . 1 1 4 4 ASP N N 4 121.937 121.937 124.942 -3.005 26022 953 1 3 . 1 1 4 4 ASP HA H 4 4.289 4.289 4.623 -0.334 26022 954 1 3 . 1 1 4 4 ASP C C 4 176.319 176.319 177.648 -1.329 26022 955 1 3 . 1 1 4 4 ASP CA C 4 54.029 54.029 55.702 -1.673 26022 956 1 3 . 1 1 4 4 ASP CB C 4 41.280 41.280 41.699 -0.419 26022 957 1 3 . 1 1 4 4 ASP H H 4 8.325 8.325 8.806 -0.481 26022 958 1 3 . 1 1 5 5 GLU N N 5 122.369 122.369 119.067 3.302 26022 959 1 3 . 1 1 5 5 GLU HA H 5 4.250 4.250 4.102 0.148 26022 960 1 3 . 1 1 5 5 GLU C C 5 177.045 177.045 176.937 0.108 26022 961 1 3 . 1 1 5 5 GLU CA C 5 56.930 56.930 58.448 -1.518 26022 962 1 3 . 1 1 5 5 GLU CB C 5 30.554 30.554 29.828 0.726 26022 963 1 3 . 1 1 5 5 GLU H H 5 8.464 8.464 8.583 -0.119 26022 964 1 3 . 1 1 6 6 LYS N N 6 121.437 121.437 119.780 1.657 26022 965 1 3 . 1 1 6 6 LYS HA H 6 4.282 4.282 4.432 -0.150 26022 966 1 3 . 1 1 6 6 LYS C C 6 177.185 177.185 175.678 1.507 26022 967 1 3 . 1 1 6 6 LYS CA C 6 56.930 56.930 55.762 1.168 26022 968 1 3 . 1 1 6 6 LYS CB C 6 32.713 32.713 32.819 -0.106 26022 969 1 3 . 1 1 6 6 LYS H H 6 8.390 8.390 8.125 0.265 26022 970 1 3 . 1 1 7 7 SER N N 7 115.822 115.822 118.751 -2.929 26022 971 1 3 . 1 1 7 7 SER HA H 7 4.396 4.396 4.475 -0.079 26022 972 1 3 . 1 1 7 7 SER C C 7 174.609 174.609 174.480 0.129 26022 973 1 3 . 1 1 7 7 SER CA C 7 58.684 58.684 58.129 0.555 26022 974 1 3 . 1 1 7 7 SER CB C 7 63.608 63.608 63.888 -0.280 26022 975 1 3 . 1 1 7 7 SER H H 7 8.205 8.205 8.793 -0.588 26022 976 1 3 . 1 1 8 8 LYS N N 8 122.643 122.643 117.498 5.145 26022 977 1 3 . 1 1 8 8 LYS HA H 8 4.407 4.407 4.069 0.338 26022 978 1 3 . 1 1 8 8 LYS C C 8 176.694 176.694 176.212 0.482 26022 979 1 3 . 1 1 8 8 LYS CA C 8 56.390 56.390 57.805 -1.415 26022 980 1 3 . 1 1 8 8 LYS CB C 8 33.185 33.185 31.328 1.857 26022 981 1 3 . 1 1 8 8 LYS H H 8 8.201 8.201 7.916 0.285 26022 982 1 3 . 1 1 9 9 THR N N 9 113.900 113.900 118.938 -5.038 26022 983 1 3 . 1 1 9 9 THR HA H 9 4.341 4.341 4.419 -0.078 26022 984 1 3 . 1 1 9 9 THR C C 9 173.438 173.438 173.475 -0.037 26022 985 1 3 . 1 1 9 9 THR CA C 9 62.529 62.529 62.696 -0.167 26022 986 1 3 . 1 1 9 9 THR CB C 9 69.342 69.342 68.368 0.974 26022 987 1 3 . 1 1 10 10 LEU N N 10 124.082 124.082 123.545 0.537 26022 988 1 3 . 1 1 10 10 LEU HA H 10 4.858 4.858 4.783 0.075 26022 989 1 3 . 1 1 10 10 LEU C C 10 175.804 175.804 174.836 0.968 26022 990 1 3 . 1 1 10 10 LEU CA C 10 53.759 53.759 53.378 0.381 26022 991 1 3 . 1 1 10 10 LEU CB C 10 44.653 44.653 45.343 -0.690 26022 992 1 3 . 1 1 10 10 LEU H H 10 7.786 7.786 7.970 -0.184 26022 993 1 3 . 1 1 11 11 PHE N N 11 120.942 120.942 120.525 0.417 26022 994 1 3 . 1 1 11 11 PHE HA H 11 4.862 4.862 4.810 0.052 26022 995 1 3 . 1 1 11 11 PHE C C 11 173.578 173.578 175.055 -1.477 26022 996 1 3 . 1 1 11 11 PHE CA C 11 56.120 56.120 55.766 0.354 26022 997 1 3 . 1 1 11 11 PHE CB C 11 41.212 41.212 40.919 0.293 26022 998 1 3 . 1 1 11 11 PHE H H 11 8.889 8.889 9.333 -0.444 26022 999 1 3 . 1 1 12 12 GLU N N 12 119.958 119.958 125.467 -5.509 26022 1000 1 3 . 1 1 12 12 GLU HA H 12 5.539 5.539 4.541 0.998 26022 1001 1 3 . 1 1 12 12 GLU C C 12 176.295 176.295 175.650 0.645 26022 1002 1 3 . 1 1 12 12 GLU CA C 12 54.501 54.501 56.083 -1.582 26022 1003 1 3 . 1 1 12 12 GLU CB C 12 31.768 31.768 29.505 2.263 26022 1004 1 3 . 1 1 12 12 GLU H H 12 8.285 8.285 8.727 -0.442 26022 1005 1 3 . 1 1 13 13 VAL N N 13 120.742 120.742 120.989 -0.247 26022 1006 1 3 . 1 1 13 13 VAL HA H 13 4.570 4.570 4.611 -0.041 26022 1007 1 3 . 1 1 13 13 VAL C C 13 173.415 173.415 174.653 -1.238 26022 1008 1 3 . 1 1 13 13 VAL CA C 13 59.696 59.696 59.799 -0.103 26022 1009 1 3 . 1 1 13 13 VAL CB C 13 36.018 36.018 34.439 1.579 26022 1010 1 3 . 1 1 14 14 GLU N N 14 122.848 122.848 122.997 -0.149 26022 1011 1 3 . 1 1 14 14 GLU HA H 14 5.226 5.226 5.485 -0.259 26022 1012 1 3 . 1 1 14 14 GLU C C 14 176.295 176.295 176.015 0.280 26022 1013 1 3 . 1 1 14 14 GLU CA C 14 55.243 55.243 54.857 0.386 26022 1014 1 3 . 1 1 14 14 GLU CB C 14 32.173 32.173 33.328 -1.155 26022 1015 1 3 . 1 1 14 14 GLU H H 14 8.492 8.492 8.628 -0.136 26022 1016 1 3 . 1 1 15 15 GLY N N 15 105.005 105.005 109.318 -4.313 26022 1017 1 3 . 1 1 15 15 GLY C C 15 170.393 170.393 172.132 -1.739 26022 1018 1 3 . 1 1 15 15 GLY CA C 15 46.002 46.002 44.969 1.033 26022 1019 1 3 . 1 1 15 15 GLY H H 15 8.454 8.454 8.752 -0.298 26022 1020 1 3 . 1 1 16 16 ALA N N 16 120.909 120.909 123.509 -2.600 26022 1021 1 3 . 1 1 16 16 ALA HA H 16 5.526 5.526 4.952 0.574 26022 1022 1 3 . 1 1 16 16 ALA C C 16 176.834 176.834 176.519 0.315 26022 1023 1 3 . 1 1 16 16 ALA CA C 16 49.644 49.644 50.566 -0.922 26022 1024 1 3 . 1 1 16 16 ALA CB C 16 22.054 22.054 20.347 1.707 26022 1025 1 3 . 1 1 16 16 ALA H H 16 8.206 8.206 8.530 -0.324 26022 1026 1 3 . 1 1 17 17 VAL N N 17 122.567 122.567 124.266 -1.699 26022 1027 1 3 . 1 1 17 17 VAL HA H 17 4.380 4.380 4.200 0.180 26022 1028 1 3 . 1 1 17 17 VAL C C 17 178.099 178.099 175.469 2.630 26022 1029 1 3 . 1 1 17 17 VAL CA C 17 63.608 63.608 62.590 1.018 26022 1030 1 3 . 1 1 17 17 VAL CB C 17 32.105 32.105 32.759 -0.654 26022 1031 1 3 . 1 1 18 18 THR N N 18 120.937 120.937 125.119 -4.182 26022 1032 1 3 . 1 1 18 18 THR HA H 18 4.601 4.601 4.495 0.106 26022 1033 1 3 . 1 1 18 18 THR C C 18 175.312 175.312 173.777 1.535 26022 1034 1 3 . 1 1 18 18 THR CA C 18 61.517 61.517 61.956 -0.439 26022 1035 1 3 . 1 1 18 18 THR CB C 18 69.814 69.814 69.822 -0.008 26022 1036 1 3 . 1 1 19 19 ALA N N 19 121.258 121.258 122.788 -1.530 26022 1037 1 3 . 1 1 19 19 ALA HA H 19 4.458 4.458 4.716 -0.258 26022 1038 1 3 . 1 1 19 19 ALA C C 19 174.703 174.703 174.645 0.058 26022 1039 1 3 . 1 1 19 19 ALA CA C 19 53.017 53.017 51.597 1.420 26022 1040 1 3 . 1 1 19 19 ALA CB C 19 22.054 22.054 21.330 0.724 26022 1041 1 3 . 1 1 19 19 ALA H H 19 7.716 7.716 7.614 0.102 26022 1042 1 3 . 1 1 20 20 LEU N N 20 123.420 123.420 117.258 6.162 26022 1043 1 3 . 1 1 20 20 LEU HA H 20 4.393 4.393 5.278 -0.885 26022 1044 1 3 . 1 1 20 20 LEU C C 20 175.499 175.499 174.520 0.979 26022 1045 1 3 . 1 1 20 20 LEU CA C 20 54.839 54.839 53.389 1.450 26022 1046 1 3 . 1 1 20 20 LEU CB C 20 41.212 41.212 45.887 -4.675 26022 1047 1 3 . 1 1 20 20 LEU H H 20 8.711 8.711 8.331 0.380 26022 1048 1 3 . 1 1 21 21 LEU N N 21 124.718 124.718 122.121 2.597 26022 1049 1 3 . 1 1 21 21 LEU HA H 21 4.714 4.714 4.957 -0.243 26022 1050 1 3 . 1 1 21 21 LEU C C 21 174.328 174.328 175.816 -1.488 26022 1051 1 3 . 1 1 21 21 LEU CA C 21 52.680 52.680 51.042 1.637 26022 1052 1 3 . 1 1 21 21 LEU CB C 21 41.684 41.684 44.495 -2.811 26022 1053 1 3 . 1 1 21 21 LEU H H 21 7.773 7.773 8.687 -0.914 26022 1054 1 3 . 1 1 22 22 PRO HA H 22 4.380 4.380 4.376 0.004 26022 1055 1 3 . 1 1 22 22 PRO C C 22 175.616 175.616 175.658 -0.042 26022 1056 1 3 . 1 1 22 22 PRO CA C 22 62.529 62.529 63.615 -1.086 26022 1057 1 3 . 1 1 22 22 PRO CB C 22 32.240 32.240 30.075 2.165 26022 1058 1 3 . 1 1 23 23 ALA N N 23 120.693 120.693 120.609 0.084 26022 1059 1 3 . 1 1 23 23 ALA HA H 23 4.302 4.302 4.476 -0.174 26022 1060 1 3 . 1 1 23 23 ALA C C 23 176.178 176.178 176.273 -0.095 26022 1061 1 3 . 1 1 23 23 ALA CA C 23 52.882 52.882 51.391 1.491 26022 1062 1 3 . 1 1 23 23 ALA CB C 23 17.336 17.336 19.384 -2.048 26022 1063 1 3 . 1 1 23 23 ALA H H 23 8.675 8.675 7.973 0.702 26022 1064 1 3 . 1 1 24 24 ALA N N 24 115.540 115.540 120.169 -4.629 26022 1065 1 3 . 1 1 24 24 ALA HA H 24 3.820 3.820 3.536 0.284 26022 1066 1 3 . 1 1 24 24 ALA C C 24 175.546 175.546 175.774 -0.228 26022 1067 1 3 . 1 1 24 24 ALA CA C 24 52.613 52.613 52.838 -0.225 26022 1068 1 3 . 1 1 24 24 ALA CB C 24 16.590 16.590 17.177 -0.587 26022 1069 1 3 . 1 1 24 24 ALA H H 24 8.381 8.381 7.966 0.415 26022 1070 1 3 . 1 1 25 25 GLU N N 25 114.082 114.082 117.886 -3.804 26022 1071 1 3 . 1 1 25 25 GLU HA H 25 5.148 5.148 5.068 0.080 26022 1072 1 3 . 1 1 25 25 GLU C C 25 175.757 175.757 174.982 0.775 26022 1073 1 3 . 1 1 25 25 GLU CA C 25 54.911 54.911 54.159 0.752 26022 1074 1 3 . 1 1 25 25 GLU CB C 25 32.645 32.645 31.941 0.704 26022 1075 1 3 . 1 1 25 25 GLU H H 25 6.378 6.378 7.188 -0.810 26022 1076 1 3 . 1 1 26 26 PHE N N 26 117.365 117.365 123.894 -6.529 26022 1077 1 3 . 1 1 26 26 PHE HA H 26 4.979 4.979 4.949 0.030 26022 1078 1 3 . 1 1 26 26 PHE C C 26 174.960 174.960 174.733 0.227 26022 1079 1 3 . 1 1 26 26 PHE CA C 26 56.862 56.862 56.695 0.167 26022 1080 1 3 . 1 1 26 26 PHE CB C 26 43.371 43.371 42.937 0.434 26022 1081 1 3 . 1 1 26 26 PHE H H 26 8.950 8.950 9.339 -0.389 26022 1082 1 3 . 1 1 27 27 ARG N N 27 125.082 125.082 121.120 3.962 26022 1083 1 3 . 1 1 27 27 ARG HA H 27 4.992 4.992 5.339 -0.347 26022 1084 1 3 . 1 1 27 27 ARG C C 27 175.148 175.148 175.084 0.064 26022 1085 1 3 . 1 1 27 27 ARG CA C 27 56.323 56.323 54.936 1.387 26022 1086 1 3 . 1 1 27 27 ARG CB C 27 32.240 32.240 32.529 -0.288 26022 1087 1 3 . 1 1 27 27 ARG H H 27 8.799 8.799 9.235 -0.436 26022 1088 1 3 . 1 1 28 28 VAL N N 28 127.456 127.456 120.802 6.654 26022 1089 1 3 . 1 1 28 28 VAL HA H 28 4.757 4.757 4.932 -0.175 26022 1090 1 3 . 1 1 28 28 VAL C C 28 173.602 173.602 174.647 -1.045 26022 1091 1 3 . 1 1 28 28 VAL CA C 28 60.303 60.303 59.674 0.629 26022 1092 1 3 . 1 1 28 28 VAL CB C 28 35.681 35.681 34.164 1.517 26022 1093 1 3 . 1 1 29 29 LYS N N 29 128.096 128.096 123.044 5.052 26022 1094 1 3 . 1 1 29 29 LYS HA H 29 4.354 4.354 5.103 -0.749 26022 1095 1 3 . 1 1 29 29 LYS C C 29 176.740 176.740 174.795 1.945 26022 1096 1 3 . 1 1 29 29 LYS CA C 29 55.041 55.041 53.910 1.131 26022 1097 1 3 . 1 1 29 29 LYS CB C 29 34.062 34.062 34.559 -0.496 26022 1098 1 3 . 1 1 29 29 LYS H H 29 9.268 9.268 8.195 1.073 26022 1099 1 3 . 1 1 30 30 LEU N N 30 129.600 129.600 124.963 4.637 26022 1100 1 3 . 1 1 30 30 LEU HA H 30 4.653 4.653 4.537 0.116 26022 1101 1 3 . 1 1 30 30 LEU C C 30 178.193 178.193 177.385 0.808 26022 1102 1 3 . 1 1 30 30 LEU CA C 30 54.771 54.771 54.049 0.722 26022 1103 1 3 . 1 1 30 30 LEU CB C 30 42.224 42.224 44.883 -2.659 26022 1104 1 3 . 1 1 30 30 LEU H H 30 9.000 9.000 8.884 0.116 26022 1105 1 3 . 1 1 31 31 ASP N N 31 120.478 120.478 123.326 -2.848 26022 1106 1 3 . 1 1 31 31 ASP HA H 31 4.458 4.458 4.475 -0.017 26022 1107 1 3 . 1 1 31 31 ASP C C 31 176.155 176.155 176.383 -0.228 26022 1108 1 3 . 1 1 31 31 ASP CA C 31 55.918 55.918 56.564 -0.646 26022 1109 1 3 . 1 1 31 31 ASP CB C 31 39.593 39.593 40.706 -1.113 26022 1110 1 3 . 1 1 31 31 ASP H H 31 8.698 8.698 8.718 -0.020 26022 1111 1 3 . 1 1 32 32 ASN N N 32 115.450 115.450 117.167 -1.717 26022 1112 1 3 . 1 1 32 32 ASN HA H 32 4.588 4.588 4.671 -0.083 26022 1113 1 3 . 1 1 32 32 ASN C C 32 175.335 175.335 174.820 0.515 26022 1114 1 3 . 1 1 32 32 ASN CA C 32 53.152 53.152 53.273 -0.121 26022 1115 1 3 . 1 1 32 32 ASN CB C 32 37.367 37.367 38.629 -1.262 26022 1116 1 3 . 1 1 32 32 ASN H H 32 7.680 7.680 7.779 -0.099 26022 1117 1 3 . 1 1 33 33 GLU N N 33 111.790 111.790 116.380 -4.590 26022 1118 1 3 . 1 1 33 33 GLU HA H 33 3.898 3.898 4.009 -0.111 26022 1119 1 3 . 1 1 33 33 GLU C C 33 175.733 175.733 174.719 1.014 26022 1120 1 3 . 1 1 33 33 GLU CA C 33 58.144 58.144 58.064 0.080 26022 1121 1 3 . 1 1 33 33 GLU CB C 33 28.242 28.242 27.696 0.546 26022 1122 1 3 . 1 1 33 33 GLU H H 33 8.097 8.097 7.783 0.314 26022 1123 1 3 . 1 1 34 34 HIS N N 34 119.193 119.193 116.823 2.370 26022 1124 1 3 . 1 1 34 34 HIS HA H 34 4.201 4.201 4.896 -0.695 26022 1125 1 3 . 1 1 34 34 HIS C C 34 173.789 173.789 174.040 -0.251 26022 1126 1 3 . 1 1 34 34 HIS CA C 34 56.053 56.053 54.812 1.241 26022 1127 1 3 . 1 1 34 34 HIS CB C 34 30.487 30.487 33.322 -2.836 26022 1128 1 3 . 1 1 34 34 HIS H H 34 7.890 7.890 7.669 0.221 26022 1129 1 3 . 1 1 35 35 GLU HA H 35 5.400 5.400 5.215 0.185 26022 1130 1 3 . 1 1 35 35 GLU C C 35 175.944 175.944 175.699 0.245 26022 1131 1 3 . 1 1 35 35 GLU CA C 35 55.109 55.109 55.794 -0.685 26022 1132 1 3 . 1 1 35 35 GLU CB C 35 32.308 32.308 31.229 1.079 26022 1133 1 3 . 1 1 36 36 ILE N N 36 119.077 119.077 122.959 -3.882 26022 1134 1 3 . 1 1 36 36 ILE HA H 36 4.686 4.686 4.433 0.253 26022 1135 1 3 . 1 1 36 36 ILE C C 36 173.790 173.790 175.711 -1.921 26022 1136 1 3 . 1 1 36 36 ILE CA C 36 59.156 59.156 60.321 -1.165 26022 1137 1 3 . 1 1 36 36 ILE CB C 36 42.696 42.696 41.213 1.483 26022 1138 1 3 . 1 1 37 37 ILE N N 37 122.787 122.787 128.242 -5.455 26022 1139 1 3 . 1 1 37 37 ILE HA H 37 4.778 4.778 4.215 0.563 26022 1140 1 3 . 1 1 37 37 ILE C C 37 177.057 177.057 175.470 1.587 26022 1141 1 3 . 1 1 37 37 ILE CA C 37 59.723 59.723 61.906 -2.183 26022 1142 1 3 . 1 1 37 37 ILE CB C 37 37.949 37.949 37.362 0.587 26022 1143 1 3 . 1 1 38 38 CYS N N 38 122.357 122.357 127.125 -4.768 26022 1144 1 3 . 1 1 38 38 CYS HA H 38 5.708 5.708 4.922 0.786 26022 1145 1 3 . 1 1 38 38 CYS C C 38 174.258 174.258 173.534 0.724 26022 1146 1 3 . 1 1 38 38 CYS CA C 38 56.930 56.930 57.556 -0.626 26022 1147 1 3 . 1 1 38 38 CYS CB C 38 33.252 33.252 30.287 2.965 26022 1148 1 3 . 1 1 38 38 CYS H H 38 9.512 9.512 9.205 0.307 26022 1149 1 3 . 1 1 39 39 HIS N N 39 117.101 117.101 121.902 -4.801 26022 1150 1 3 . 1 1 39 39 HIS HA H 39 5.526 5.526 5.487 0.039 26022 1151 1 3 . 1 1 39 39 HIS C C 39 174.516 174.516 173.984 0.532 26022 1152 1 3 . 1 1 39 39 HIS CA C 39 54.097 54.097 55.481 -1.384 26022 1153 1 3 . 1 1 39 39 HIS CB C 39 31.701 31.701 34.586 -2.885 26022 1154 1 3 . 1 1 39 39 HIS H H 39 7.597 7.597 8.231 -0.634 26022 1155 1 3 . 1 1 40 40 VAL N N 40 117.923 117.923 120.191 -2.268 26022 1156 1 3 . 1 1 40 40 VAL HA H 40 4.614 4.614 4.257 0.357 26022 1157 1 3 . 1 1 40 40 VAL C C 40 175.804 175.804 174.905 0.899 26022 1158 1 3 . 1 1 40 40 VAL CA C 40 61.382 61.382 62.800 -1.418 26022 1159 1 3 . 1 1 40 40 VAL CB C 40 33.396 33.396 31.933 1.463 26022 1160 1 3 . 1 1 41 41 SER N N 41 119.242 119.242 121.844 -2.602 26022 1161 1 3 . 1 1 41 41 SER HA H 41 4.550 4.550 4.779 -0.229 26022 1162 1 3 . 1 1 41 41 SER C C 41 174.656 174.656 176.166 -1.510 26022 1163 1 3 . 1 1 41 41 SER CA C 41 58.126 58.126 55.639 2.487 26022 1164 1 3 . 1 1 41 41 SER CB C 41 63.470 63.470 65.189 -1.719 26022 1165 1 3 . 1 1 41 41 SER H H 41 8.341 8.341 8.165 0.176 26022 1166 1 3 . 1 1 42 42 GLY N N 42 110.569 110.569 109.155 1.414 26022 1167 1 3 . 1 1 42 42 GLY C C 42 173.829 173.829 175.792 -1.963 26022 1168 1 3 . 1 1 42 42 GLY CA C 42 45.257 45.257 47.099 -1.842 26022 1169 1 3 . 1 1 42 42 GLY H H 42 8.380 8.380 8.701 -0.321 26022 1170 1 3 . 1 1 43 43 LYS HA H 43 3.977 3.977 4.075 -0.098 26022 1171 1 3 . 1 1 43 43 LYS C C 43 179.363 179.363 179.166 0.197 26022 1172 1 3 . 1 1 43 43 LYS CA C 43 59.628 59.628 58.985 0.643 26022 1173 1 3 . 1 1 43 43 LYS CB C 43 32.510 32.510 32.169 0.341 26022 1174 1 3 . 1 1 44 44 VAL N N 44 120.404 120.404 118.976 1.428 26022 1175 1 3 . 1 1 44 44 VAL HA H 44 3.661 3.661 3.723 -0.062 26022 1176 1 3 . 1 1 44 44 VAL C C 44 179.785 179.785 177.998 1.787 26022 1177 1 3 . 1 1 44 44 VAL CA C 44 65.425 65.425 65.839 -0.414 26022 1178 1 3 . 1 1 44 44 VAL CB C 44 31.500 31.500 31.415 0.085 26022 1179 1 3 . 1 1 45 45 ARG N N 45 123.687 123.687 119.365 4.322 26022 1180 1 3 . 1 1 45 45 ARG HA H 45 4.054 4.054 4.091 -0.037 26022 1181 1 3 . 1 1 45 45 ARG C C 45 179.504 179.504 178.809 0.695 26022 1182 1 3 . 1 1 45 45 ARG CA C 45 59.669 59.669 58.982 0.687 26022 1183 1 3 . 1 1 45 45 ARG CB C 45 30.417 30.417 29.881 0.536 26022 1184 1 3 . 1 1 45 45 ARG H H 45 8.608 8.608 7.918 0.690 26022 1185 1 3 . 1 1 46 46 ARG N N 46 118.506 118.506 118.899 -0.393 26022 1186 1 3 . 1 1 46 46 ARG HA H 46 4.148 4.148 4.224 -0.076 26022 1187 1 3 . 1 1 46 46 ARG C C 46 177.396 177.396 178.619 -1.223 26022 1188 1 3 . 1 1 46 46 ARG CA C 46 58.481 58.481 58.294 0.187 26022 1189 1 3 . 1 1 46 46 ARG CB C 46 30.554 30.554 30.086 0.468 26022 1190 1 3 . 1 1 46 46 ARG H H 46 8.474 8.474 7.658 0.816 26022 1191 1 3 . 1 1 47 47 SER N N 47 114.263 114.263 113.337 0.926 26022 1192 1 3 . 1 1 47 47 SER HA H 47 4.393 4.393 4.408 -0.015 26022 1193 1 3 . 1 1 47 47 SER C C 47 174.070 174.070 174.588 -0.518 26022 1194 1 3 . 1 1 47 47 SER CA C 47 59.696 59.696 59.327 0.369 26022 1195 1 3 . 1 1 47 47 SER CB C 47 64.013 64.013 63.856 0.157 26022 1196 1 3 . 1 1 47 47 SER H H 47 7.645 7.645 8.156 -0.511 26022 1197 1 3 . 1 1 48 48 LYS N N 48 115.405 115.405 117.304 -1.899 26022 1198 1 3 . 1 1 48 48 LYS HA H 48 3.990 3.990 3.953 0.037 26022 1199 1 3 . 1 1 48 48 LYS C C 48 175.804 175.804 175.509 0.295 26022 1200 1 3 . 1 1 48 48 LYS CA C 48 57.537 57.537 57.041 0.496 26022 1201 1 3 . 1 1 48 48 LYS CB C 48 29.947 29.947 30.028 -0.081 26022 1202 1 3 . 1 1 48 48 LYS H H 48 7.821 7.821 7.518 0.303 26022 1203 1 3 . 1 1 49 49 ILE N N 49 117.265 117.265 119.082 -1.817 26022 1204 1 3 . 1 1 49 49 ILE HA H 49 4.041 4.041 4.019 0.022 26022 1205 1 3 . 1 1 49 49 ILE C C 49 175.125 175.125 176.610 -1.485 26022 1206 1 3 . 1 1 49 49 ILE CA C 49 61.315 61.315 60.156 1.159 26022 1207 1 3 . 1 1 49 49 ILE CB C 49 38.919 38.919 37.965 0.954 26022 1208 1 3 . 1 1 50 50 ARG N N 50 126.687 126.687 126.237 0.450 26022 1209 1 3 . 1 1 50 50 ARG HA H 50 4.471 4.471 4.459 0.012 26022 1210 1 3 . 1 1 50 50 ARG C C 50 175.007 175.007 174.732 0.275 26022 1211 1 3 . 1 1 50 50 ARG CA C 50 55.176 55.176 55.304 -0.128 26022 1212 1 3 . 1 1 50 50 ARG CB C 50 31.026 31.026 31.756 -0.730 26022 1213 1 3 . 1 1 50 50 ARG H H 50 8.437 8.437 8.279 0.158 26022 1214 1 3 . 1 1 51 51 ILE N N 51 127.722 127.722 125.740 1.982 26022 1215 1 3 . 1 1 51 51 ILE HA H 51 4.276 4.276 3.984 0.292 26022 1216 1 3 . 1 1 51 51 ILE C C 51 174.726 174.726 175.876 -1.150 26022 1217 1 3 . 1 1 51 51 ILE CA C 51 60.235 60.235 60.257 -0.022 26022 1218 1 3 . 1 1 51 51 ILE CB C 51 37.772 37.772 37.772 0.000 26022 1219 1 3 . 1 1 52 52 ILE N N 52 121.888 121.888 124.134 -2.246 26022 1220 1 3 . 1 1 52 52 ILE HA H 52 4.781 4.781 4.447 0.335 26022 1221 1 3 . 1 1 52 52 ILE C C 52 175.733 175.733 175.128 0.605 26022 1222 1 3 . 1 1 52 52 ILE CA C 52 59.021 59.021 59.245 -0.224 26022 1223 1 3 . 1 1 52 52 ILE CB C 52 42.089 42.089 40.084 2.005 26022 1224 1 3 . 1 1 53 53 ILE N N 53 119.363 119.363 124.259 -4.896 26022 1225 1 3 . 1 1 53 53 ILE HA H 53 3.338 3.338 3.897 -0.559 26022 1226 1 3 . 1 1 53 53 ILE C C 53 177.021 177.021 176.793 0.228 26022 1227 1 3 . 1 1 53 53 ILE CA C 53 64.274 64.274 62.454 1.820 26022 1228 1 3 . 1 1 53 53 ILE CB C 53 37.256 37.256 37.666 -0.409 26022 1229 1 3 . 1 1 54 54 GLY N N 54 116.136 116.136 116.623 -0.487 26022 1230 1 3 . 1 1 54 54 GLY C C 54 174.844 174.844 173.815 1.029 26022 1231 1 3 . 1 1 54 54 GLY CA C 54 45.188 45.188 44.634 0.554 26022 1232 1 3 . 1 1 54 54 GLY H H 54 8.853 8.853 8.910 -0.057 26022 1233 1 3 . 1 1 55 55 ASP N N 55 121.946 121.946 121.877 0.069 26022 1234 1 3 . 1 1 55 55 ASP HA H 55 4.588 4.588 4.853 -0.265 26022 1235 1 3 . 1 1 55 55 ASP C C 55 175.804 175.804 174.863 0.941 26022 1236 1 3 . 1 1 55 55 ASP CA C 55 55.200 55.200 52.210 2.990 26022 1237 1 3 . 1 1 55 55 ASP CB C 55 41.048 41.048 42.897 -1.849 26022 1238 1 3 . 1 1 55 55 ASP H H 55 8.054 8.054 7.677 0.377 26022 1239 1 3 . 1 1 56 56 ARG N N 56 120.974 120.974 122.589 -1.615 26022 1240 1 3 . 1 1 56 56 ARG HA H 56 5.200 5.200 4.581 0.619 26022 1241 1 3 . 1 1 56 56 ARG C C 56 176.483 176.483 175.193 1.290 26022 1242 1 3 . 1 1 56 56 ARG CA C 56 54.097 54.097 54.496 -0.399 26022 1243 1 3 . 1 1 56 56 ARG CB C 56 30.689 30.689 28.694 1.995 26022 1244 1 3 . 1 1 56 56 ARG H H 56 8.766 8.766 8.413 0.353 26022 1245 1 3 . 1 1 57 57 VAL N N 57 114.943 114.943 116.493 -1.550 26022 1246 1 3 . 1 1 57 57 VAL HA H 57 4.965 4.965 4.609 0.356 26022 1247 1 3 . 1 1 57 57 VAL C C 57 172.243 172.243 173.546 -1.303 26022 1248 1 3 . 1 1 57 57 VAL CA C 57 58.077 58.077 58.992 -0.915 26022 1249 1 3 . 1 1 57 57 VAL CB C 57 36.288 36.288 35.319 0.969 26022 1250 1 3 . 1 1 58 58 LEU N N 58 122.410 122.410 122.046 0.364 26022 1251 1 3 . 1 1 58 58 LEU HA H 58 4.731 4.731 5.094 -0.363 26022 1252 1 3 . 1 1 58 58 LEU C C 58 174.773 174.773 174.872 -0.099 26022 1253 1 3 . 1 1 58 58 LEU CA C 58 53.085 53.085 53.678 -0.593 26022 1254 1 3 . 1 1 58 58 LEU CB C 58 45.788 45.788 44.135 1.653 26022 1255 1 3 . 1 1 58 58 LEU H H 58 8.382 8.382 7.650 0.732 26022 1256 1 3 . 1 1 59 59 VAL N N 59 127.937 127.937 127.679 0.258 26022 1257 1 3 . 1 1 59 59 VAL HA H 59 4.744 4.744 4.772 -0.028 26022 1258 1 3 . 1 1 59 59 VAL C C 59 174.141 174.141 173.722 0.419 26022 1259 1 3 . 1 1 59 59 VAL CA C 59 60.279 60.279 59.942 0.337 26022 1260 1 3 . 1 1 59 59 VAL CB C 59 34.399 34.399 35.179 -0.780 26022 1261 1 3 . 1 1 60 60 GLU N N 60 124.832 124.832 130.162 -5.330 26022 1262 1 3 . 1 1 60 60 GLU HA H 60 5.304 5.304 4.668 0.636 26022 1263 1 3 . 1 1 60 60 GLU C C 60 176.155 176.155 175.489 0.666 26022 1264 1 3 . 1 1 60 60 GLU CA C 60 54.164 54.164 55.309 -1.145 26022 1265 1 3 . 1 1 60 60 GLU CB C 60 33.803 33.803 30.098 3.705 26022 1266 1 3 . 1 1 60 60 GLU H H 60 9.142 9.142 8.977 0.165 26022 1267 1 3 . 1 1 61 61 MET N N 61 124.187 124.187 122.889 1.298 26022 1268 1 3 . 1 1 61 61 MET HA H 61 4.899 4.899 4.949 -0.050 26022 1269 1 3 . 1 1 61 61 MET C C 61 173.953 173.953 174.180 -0.227 26022 1270 1 3 . 1 1 61 61 MET CA C 61 54.232 54.232 53.490 0.742 26022 1271 1 3 . 1 1 61 61 MET CB C 61 37.256 37.256 35.765 1.491 26022 1272 1 3 . 1 1 61 61 MET H H 61 8.984 8.984 8.437 0.547 26022 1273 1 3 . 1 1 62 62 SER N N 62 116.623 116.623 115.015 1.608 26022 1274 1 3 . 1 1 62 62 SER HA H 62 4.263 4.263 4.798 -0.535 26022 1275 1 3 . 1 1 62 62 SER C C 62 176.413 176.413 175.019 1.394 26022 1276 1 3 . 1 1 62 62 SER CA C 62 56.893 56.893 55.566 1.327 26022 1277 1 3 . 1 1 62 62 SER CB C 62 65.362 65.362 64.850 0.512 26022 1278 1 3 . 1 1 62 62 SER H H 62 9.167 9.167 8.551 0.616 26022 1279 1 3 . 1 1 63 63 ILE N N 63 121.187 121.187 125.119 -3.932 26022 1280 1 3 . 1 1 63 63 ILE HA H 63 3.989 3.989 3.890 0.099 26022 1281 1 3 . 1 1 63 63 ILE C C 63 176.623 176.623 176.367 0.256 26022 1282 1 3 . 1 1 63 63 ILE CA C 63 63.878 63.878 59.761 4.117 26022 1283 1 3 . 1 1 63 63 ILE CB C 63 38.244 38.244 35.788 2.456 26022 1284 1 3 . 1 1 64 64 TYR N N 64 120.214 120.214 120.330 -0.116 26022 1285 1 3 . 1 1 64 64 TYR HA H 64 4.432 4.432 4.293 0.139 26022 1286 1 3 . 1 1 64 64 TYR C C 64 177.092 177.092 176.604 0.488 26022 1287 1 3 . 1 1 64 64 TYR CA C 64 59.156 59.156 58.973 0.183 26022 1288 1 3 . 1 1 64 64 TYR CB C 64 38.109 38.109 38.174 -0.065 26022 1289 1 3 . 1 1 64 64 TYR H H 64 7.762 7.762 7.207 0.555 26022 1290 1 3 . 1 1 65 65 ASP N N 65 121.338 121.338 115.866 5.472 26022 1291 1 3 . 1 1 65 65 ASP HA H 65 4.495 4.495 4.623 -0.128 26022 1292 1 3 . 1 1 65 65 ASP C C 65 177.349 177.349 178.135 -0.786 26022 1293 1 3 . 1 1 65 65 ASP CA C 65 55.243 55.243 54.864 0.379 26022 1294 1 3 . 1 1 65 65 ASP CB C 65 40.538 40.538 41.168 -0.630 26022 1295 1 3 . 1 1 65 65 ASP H H 65 7.798 7.798 8.425 -0.627 26022 1296 1 3 . 1 1 66 66 ARG N N 66 121.118 121.118 122.203 -1.085 26022 1297 1 3 . 1 1 66 66 ARG HA H 66 4.069 4.069 4.154 -0.085 26022 1298 1 3 . 1 1 66 66 ARG C C 66 178.448 178.448 176.304 2.144 26022 1299 1 3 . 1 1 66 66 ARG CA C 66 58.401 58.401 58.677 -0.276 26022 1300 1 3 . 1 1 66 66 ARG CB C 66 30.184 30.184 29.131 1.053 26022 1301 1 3 . 1 1 66 66 ARG H H 66 8.382 8.382 8.625 -0.243 26022 1302 1 3 . 1 1 67 67 ASN N N 67 117.334 117.334 117.277 0.057 26022 1303 1 3 . 1 1 67 67 ASN HA H 67 4.601 4.601 5.106 -0.505 26022 1304 1 3 . 1 1 67 67 ASN C C 67 175.288 175.288 175.331 -0.043 26022 1305 1 3 . 1 1 67 67 ASN CA C 67 54.097 54.097 53.163 0.934 26022 1306 1 3 . 1 1 67 67 ASN CB C 67 38.514 38.514 37.824 0.690 26022 1307 1 3 . 1 1 67 67 ASN H H 67 8.194 8.194 8.469 -0.275 26022 1308 1 3 . 1 1 68 68 ALA N N 68 122.187 122.187 123.934 -1.747 26022 1309 1 3 . 1 1 68 68 ALA HA H 68 4.575 4.575 4.739 -0.164 26022 1310 1 3 . 1 1 68 68 ALA C C 68 176.272 176.272 178.382 -2.110 26022 1311 1 3 . 1 1 68 68 ALA CA C 68 52.478 52.478 53.647 -1.169 26022 1312 1 3 . 1 1 68 68 ALA CB C 68 19.086 19.086 19.388 -0.302 26022 1313 1 3 . 1 1 68 68 ALA H H 68 7.658 7.658 7.562 0.096 26022 1314 1 3 . 1 1 69 69 LYS N N 69 116.931 116.931 116.471 0.460 26022 1315 1 3 . 1 1 69 69 LYS HA H 69 4.197 4.197 4.246 -0.049 26022 1316 1 3 . 1 1 69 69 LYS C C 69 176.085 176.085 176.058 0.027 26022 1317 1 3 . 1 1 69 69 LYS CA C 69 56.728 56.728 58.297 -1.569 26022 1318 1 3 . 1 1 69 69 LYS CB C 69 31.566 31.566 33.259 -1.693 26022 1319 1 3 . 1 1 69 69 LYS H H 69 8.255 8.255 7.986 0.269 26022 1320 1 3 . 1 1 70 70 LYS N N 70 119.854 119.854 115.889 3.965 26022 1321 1 3 . 1 1 70 70 LYS HA H 70 5.526 5.526 5.520 0.006 26022 1322 1 3 . 1 1 70 70 LYS C C 70 175.171 175.171 175.807 -0.636 26022 1323 1 3 . 1 1 70 70 LYS CA C 70 54.704 54.704 54.459 0.245 26022 1324 1 3 . 1 1 70 70 LYS CB C 70 36.850 36.850 35.419 1.431 26022 1325 1 3 . 1 1 70 70 LYS H H 70 8.182 8.182 7.312 0.870 26022 1326 1 3 . 1 1 71 71 GLY N N 71 103.604 103.604 108.689 -5.085 26022 1327 1 3 . 1 1 71 71 GLY C C 71 171.541 171.541 172.678 -1.137 26022 1328 1 3 . 1 1 71 71 GLY CA C 71 45.462 45.462 43.811 1.651 26022 1329 1 3 . 1 1 71 71 GLY H H 71 7.780 7.780 7.963 -0.183 26022 1330 1 3 . 1 1 72 72 ARG N N 72 119.187 119.187 119.441 -0.254 26022 1331 1 3 . 1 1 72 72 ARG HA H 72 4.861 4.861 4.780 0.081 26022 1332 1 3 . 1 1 72 72 ARG C C 72 175.570 175.570 175.473 0.097 26022 1333 1 3 . 1 1 72 72 ARG CA C 72 53.624 53.624 55.094 -1.470 26022 1334 1 3 . 1 1 72 72 ARG CB C 72 34.129 34.129 30.506 3.623 26022 1335 1 3 . 1 1 72 72 ARG H H 72 8.007 8.007 8.548 -0.541 26022 1336 1 3 . 1 1 73 73 ILE N N 73 125.721 125.721 126.003 -0.282 26022 1337 1 3 . 1 1 73 73 ILE HA H 73 4.263 4.263 4.721 -0.458 26022 1338 1 3 . 1 1 73 73 ILE C C 73 175.312 175.312 173.807 1.505 26022 1339 1 3 . 1 1 73 73 ILE CA C 73 62.259 62.259 60.432 1.827 26022 1340 1 3 . 1 1 73 73 ILE CB C 73 39.423 39.423 39.937 -0.514 26022 1341 1 3 . 1 1 74 74 ILE N N 74 120.540 120.540 128.129 -7.589 26022 1342 1 3 . 1 1 74 74 ILE HA H 74 4.596 4.596 4.250 0.346 26022 1343 1 3 . 1 1 74 74 ILE C C 74 176.249 176.249 174.114 2.135 26022 1344 1 3 . 1 1 74 74 ILE CA C 74 60.910 60.910 60.686 0.224 26022 1345 1 3 . 1 1 74 74 ILE CB C 74 39.863 39.863 40.608 -0.745 26022 1346 1 3 . 1 1 75 75 ARG N N 75 118.582 118.582 116.394 2.188 26022 1347 1 3 . 1 1 75 75 ARG HA H 75 4.289 4.289 4.314 -0.025 26022 1348 1 3 . 1 1 75 75 ARG C C 75 173.883 173.883 174.007 -0.124 26022 1349 1 3 . 1 1 75 75 ARG CA C 75 56.390 56.390 55.537 0.853 26022 1350 1 3 . 1 1 75 75 ARG CB C 75 34.669 34.669 32.185 2.484 26022 1351 1 3 . 1 1 75 75 ARG H H 75 7.397 7.397 7.732 -0.335 26022 1352 1 3 . 1 1 76 76 ARG N N 76 125.606 125.606 121.830 3.776 26022 1353 1 3 . 1 1 76 76 ARG HA H 76 4.609 4.609 4.353 0.256 26022 1354 1 3 . 1 1 76 76 ARG C C 76 175.312 175.312 176.459 -1.147 26022 1355 1 3 . 1 1 76 76 ARG CA C 76 55.810 55.810 55.320 0.490 26022 1356 1 3 . 1 1 76 76 ARG CB C 76 31.094 31.094 30.483 0.611 26022 1357 1 3 . 1 1 76 76 ARG H H 76 9.094 9.094 8.321 0.773 26022 1358 1 3 . 1 1 77 77 LEU N N 77 128.575 128.575 124.787 3.788 26022 1359 1 3 . 1 1 77 77 LEU HA H 77 4.372 4.372 4.357 0.015 26022 1360 1 3 . 1 1 77 77 LEU C C 77 176.225 176.225 176.442 -0.217 26022 1361 1 3 . 1 1 77 77 LEU CA C 77 54.704 54.704 55.279 -0.575 26022 1362 1 3 . 1 1 77 77 LEU CB C 77 42.292 42.292 42.306 -0.014 26022 1363 1 3 . 1 1 77 77 LEU H H 77 8.742 8.742 8.522 0.220 26022 1364 1 3 . 1 1 78 78 LYS N N 78 119.592 119.592 124.802 -5.210 26022 1365 1 3 . 1 1 78 78 LYS HA H 78 4.302 4.302 4.268 0.034 26022 1366 1 3 . 1 1 78 78 LYS C C 78 176.296 176.296 178.457 -2.161 26022 1367 1 3 . 1 1 78 78 LYS CA C 78 56.390 56.390 56.715 -0.325 26022 1368 1 3 . 1 1 78 78 LYS CB C 78 33.994 33.994 33.069 0.925 26022 1369 1 3 . 1 1 78 78 LYS H H 78 8.090 8.090 8.254 -0.164 26022 1370 1 3 . 1 1 79 79 GLY N N 79 110.854 110.854 110.825 0.029 26022 1371 1 3 . 1 1 79 79 GLY C C 79 174.328 174.328 174.123 0.205 26022 1372 1 3 . 1 1 79 79 GLY CA C 79 44.990 44.990 45.844 -0.854 26022 1373 1 3 . 1 1 79 79 GLY H H 79 8.520 8.520 8.524 -0.004 26022 1374 1 3 . 1 1 80 80 THR N N 80 114.187 114.187 115.936 -1.749 26022 1375 1 3 . 1 1 80 80 THR HA H 80 4.237 4.237 3.957 0.280 26022 1376 1 3 . 1 1 80 80 THR C C 80 175.054 175.054 174.033 1.021 26022 1377 1 3 . 1 1 80 80 THR CA C 80 62.242 62.242 62.995 -0.753 26022 1378 1 3 . 1 1 80 80 THR CB C 80 69.826 69.826 67.903 1.923 26022 1379 1 3 . 1 1 81 81 SER N N 81 117.958 117.958 120.868 -2.910 26022 1380 1 3 . 1 1 81 81 SER HA H 81 4.449 4.449 4.559 -0.110 26022 1381 1 3 . 1 1 81 81 SER C C 81 174.703 174.703 174.036 0.667 26022 1382 1 3 . 1 1 81 81 SER CA C 81 58.481 58.481 57.531 0.950 26022 1383 1 3 . 1 1 81 81 SER CB C 81 63.338 63.338 62.665 0.673 26022 1384 1 3 . 1 1 81 81 SER H H 81 8.474 8.474 8.599 -0.125 26022 1385 1 3 . 1 1 82 82 ASP HA H 82 4.280 4.280 4.580 -0.300 26022 1386 1 3 . 1 1 82 82 ASP C C 82 177.115 177.115 176.965 0.150 26022 1387 1 3 . 1 1 82 82 ASP CA C 82 55.176 55.176 55.846 -0.671 26022 1388 1 3 . 1 1 82 82 ASP CB C 82 42.359 42.359 41.343 1.016 26022 1389 1 3 . 1 1 83 83 ARG N N 83 121.531 121.531 117.112 4.419 26022 1390 1 3 . 1 1 83 83 ARG HA H 83 4.346 4.346 3.984 0.362 26022 1391 1 3 . 1 1 83 83 ARG C C 83 176.342 176.342 176.615 -0.273 26022 1392 1 3 . 1 1 83 83 ARG CA C 83 56.053 56.053 58.387 -2.334 26022 1393 1 3 . 1 1 83 83 ARG CB C 83 30.891 30.891 28.832 2.059 26022 1394 1 3 . 1 1 83 83 ARG H H 83 8.259 8.259 8.685 -0.426 26022 1395 1 3 . 1 1 84 84 THR N N 84 116.462 116.462 112.379 4.083 26022 1396 1 3 . 1 1 84 84 THR HA H 84 4.333 4.333 4.412 -0.079 26022 1397 1 3 . 1 1 84 84 THR C C 84 174.445 174.445 174.407 0.038 26022 1398 1 3 . 1 1 84 84 THR CA C 84 62.254 62.254 62.455 -0.201 26022 1399 1 3 . 1 1 84 84 THR CB C 84 69.833 69.833 70.566 -0.733 26022 1400 1 3 . 1 1 85 85 ILE N N 85 123.762 123.762 119.391 4.371 26022 1401 1 3 . 1 1 85 85 ILE HA H 85 4.188 4.188 3.851 0.337 26022 1402 1 3 . 1 1 85 85 ILE C C 85 176.155 176.155 174.441 1.714 26022 1403 1 3 . 1 1 85 85 ILE CA C 85 61.112 61.112 62.682 -1.570 26022 1404 1 3 . 1 1 85 85 ILE CB C 85 38.919 38.919 36.163 2.756 26022 1405 1 3 . 1 1 86 86 SER N N 86 120.214 120.214 113.566 6.648 26022 1406 1 3 . 1 1 86 86 SER HA H 86 4.451 4.451 4.947 -0.496 26022 1407 1 3 . 1 1 86 86 SER C C 86 174.586 174.586 173.473 1.113 26022 1408 1 3 . 1 1 86 86 SER CA C 86 58.212 58.212 57.033 1.179 26022 1409 1 3 . 1 1 86 86 SER CB C 86 63.271 63.271 66.327 -3.056 26022 1410 1 3 . 1 1 86 86 SER H H 86 8.377 8.377 7.946 0.431 26022 1411 1 4 . 1 1 2 2 VAL N N 2 122.187 122.187 119.214 2.973 26022 1412 1 4 . 1 1 2 2 VAL HA H 2 4.091 4.091 3.964 0.127 26022 1413 1 4 . 1 1 2 2 VAL C C 2 175.921 175.921 176.602 -0.681 26022 1414 1 4 . 1 1 2 2 VAL CA C 2 62.057 62.057 64.431 -2.374 26022 1415 1 4 . 1 1 2 2 VAL CB C 2 32.848 32.848 31.643 1.205 26022 1416 1 4 . 1 1 3 3 LYS N N 3 125.437 125.437 121.822 3.615 26022 1417 1 4 . 1 1 3 3 LYS HA H 3 4.289 4.289 4.431 -0.142 26022 1418 1 4 . 1 1 3 3 LYS C C 3 176.155 176.155 175.214 0.941 26022 1419 1 4 . 1 1 3 3 LYS CA C 3 56.323 56.323 56.336 -0.013 26022 1420 1 4 . 1 1 3 3 LYS CB C 3 33.320 33.320 30.622 2.698 26022 1421 1 4 . 1 1 3 3 LYS H H 3 8.396 8.396 8.208 0.188 26022 1422 1 4 . 1 1 4 4 ASP N N 4 121.937 121.937 121.185 0.752 26022 1423 1 4 . 1 1 4 4 ASP HA H 4 4.289 4.289 4.593 -0.304 26022 1424 1 4 . 1 1 4 4 ASP C C 4 176.319 176.319 177.668 -1.349 26022 1425 1 4 . 1 1 4 4 ASP CA C 4 54.029 54.029 56.429 -2.400 26022 1426 1 4 . 1 1 4 4 ASP CB C 4 41.280 41.280 42.236 -0.956 26022 1427 1 4 . 1 1 4 4 ASP H H 4 8.325 8.325 7.864 0.461 26022 1428 1 4 . 1 1 5 5 GLU N N 5 122.369 122.369 120.014 2.355 26022 1429 1 4 . 1 1 5 5 GLU HA H 5 4.250 4.250 4.058 0.192 26022 1430 1 4 . 1 1 5 5 GLU C C 5 177.045 177.045 177.007 0.038 26022 1431 1 4 . 1 1 5 5 GLU CA C 5 56.930 56.930 58.764 -1.834 26022 1432 1 4 . 1 1 5 5 GLU CB C 5 30.554 30.554 29.418 1.136 26022 1433 1 4 . 1 1 5 5 GLU H H 5 8.464 8.464 8.674 -0.210 26022 1434 1 4 . 1 1 6 6 LYS N N 6 121.437 121.437 115.275 6.162 26022 1435 1 4 . 1 1 6 6 LYS HA H 6 4.282 4.282 4.375 -0.093 26022 1436 1 4 . 1 1 6 6 LYS C C 6 177.185 177.185 176.031 1.154 26022 1437 1 4 . 1 1 6 6 LYS CA C 6 56.930 56.930 55.471 1.459 26022 1438 1 4 . 1 1 6 6 LYS CB C 6 32.713 32.713 32.201 0.512 26022 1439 1 4 . 1 1 6 6 LYS H H 6 8.390 8.390 8.261 0.129 26022 1440 1 4 . 1 1 7 7 SER N N 7 115.822 115.822 115.079 0.743 26022 1441 1 4 . 1 1 7 7 SER HA H 7 4.396 4.396 4.789 -0.393 26022 1442 1 4 . 1 1 7 7 SER C C 7 174.609 174.609 174.410 0.199 26022 1443 1 4 . 1 1 7 7 SER CA C 7 58.684 58.684 57.873 0.811 26022 1444 1 4 . 1 1 7 7 SER CB C 7 63.608 63.608 62.650 0.958 26022 1445 1 4 . 1 1 7 7 SER H H 7 8.205 8.205 7.597 0.608 26022 1446 1 4 . 1 1 8 8 LYS N N 8 122.643 122.643 124.596 -1.953 26022 1447 1 4 . 1 1 8 8 LYS HA H 8 4.407 4.407 4.520 -0.113 26022 1448 1 4 . 1 1 8 8 LYS C C 8 176.694 176.694 176.720 -0.026 26022 1449 1 4 . 1 1 8 8 LYS CA C 8 56.390 56.390 57.108 -0.718 26022 1450 1 4 . 1 1 8 8 LYS CB C 8 33.185 33.185 34.076 -0.891 26022 1451 1 4 . 1 1 8 8 LYS H H 8 8.201 8.201 8.368 -0.167 26022 1452 1 4 . 1 1 9 9 THR N N 9 113.900 113.900 118.359 -4.459 26022 1453 1 4 . 1 1 9 9 THR HA H 9 4.341 4.341 4.470 -0.129 26022 1454 1 4 . 1 1 9 9 THR C C 9 173.438 173.438 173.563 -0.125 26022 1455 1 4 . 1 1 9 9 THR CA C 9 62.529 62.529 62.547 -0.018 26022 1456 1 4 . 1 1 9 9 THR CB C 9 69.342 69.342 68.033 1.309 26022 1457 1 4 . 1 1 10 10 LEU N N 10 124.082 124.082 121.781 2.301 26022 1458 1 4 . 1 1 10 10 LEU HA H 10 4.858 4.858 4.744 0.114 26022 1459 1 4 . 1 1 10 10 LEU C C 10 175.804 175.804 173.981 1.823 26022 1460 1 4 . 1 1 10 10 LEU CA C 10 53.759 53.759 53.998 -0.239 26022 1461 1 4 . 1 1 10 10 LEU CB C 10 44.653 44.653 44.589 0.064 26022 1462 1 4 . 1 1 10 10 LEU H H 10 7.786 7.786 7.715 0.071 26022 1463 1 4 . 1 1 11 11 PHE N N 11 120.942 120.942 121.226 -0.284 26022 1464 1 4 . 1 1 11 11 PHE HA H 11 4.862 4.862 4.895 -0.033 26022 1465 1 4 . 1 1 11 11 PHE C C 11 173.578 173.578 173.965 -0.387 26022 1466 1 4 . 1 1 11 11 PHE CA C 11 56.120 56.120 56.721 -0.601 26022 1467 1 4 . 1 1 11 11 PHE CB C 11 41.212 41.212 42.105 -0.893 26022 1468 1 4 . 1 1 11 11 PHE H H 11 8.889 8.889 9.180 -0.291 26022 1469 1 4 . 1 1 12 12 GLU N N 12 119.958 119.958 127.006 -7.048 26022 1470 1 4 . 1 1 12 12 GLU HA H 12 5.539 5.539 5.254 0.285 26022 1471 1 4 . 1 1 12 12 GLU C C 12 176.295 176.295 174.960 1.335 26022 1472 1 4 . 1 1 12 12 GLU CA C 12 54.501 54.501 54.577 -0.076 26022 1473 1 4 . 1 1 12 12 GLU CB C 12 31.768 31.768 32.166 -0.398 26022 1474 1 4 . 1 1 12 12 GLU H H 12 8.285 8.285 8.115 0.170 26022 1475 1 4 . 1 1 13 13 VAL N N 13 120.742 120.742 119.501 1.241 26022 1476 1 4 . 1 1 13 13 VAL HA H 13 4.570 4.570 4.506 0.064 26022 1477 1 4 . 1 1 13 13 VAL C C 13 173.415 173.415 174.621 -1.206 26022 1478 1 4 . 1 1 13 13 VAL CA C 13 59.696 59.696 59.434 0.262 26022 1479 1 4 . 1 1 13 13 VAL CB C 13 36.018 36.018 35.037 0.981 26022 1480 1 4 . 1 1 14 14 GLU N N 14 122.848 122.848 119.203 3.645 26022 1481 1 4 . 1 1 14 14 GLU HA H 14 5.226 5.226 5.359 -0.133 26022 1482 1 4 . 1 1 14 14 GLU C C 14 176.295 176.295 176.514 -0.219 26022 1483 1 4 . 1 1 14 14 GLU CA C 14 55.243 55.243 55.233 0.010 26022 1484 1 4 . 1 1 14 14 GLU CB C 14 32.173 32.173 31.631 0.542 26022 1485 1 4 . 1 1 14 14 GLU H H 14 8.492 8.492 8.455 0.037 26022 1486 1 4 . 1 1 15 15 GLY N N 15 105.005 105.005 104.682 0.323 26022 1487 1 4 . 1 1 15 15 GLY C C 15 170.393 170.393 171.851 -1.458 26022 1488 1 4 . 1 1 15 15 GLY CA C 15 46.002 46.002 45.515 0.487 26022 1489 1 4 . 1 1 15 15 GLY H H 15 8.454 8.454 7.919 0.535 26022 1490 1 4 . 1 1 16 16 ALA N N 16 120.909 120.909 122.344 -1.435 26022 1491 1 4 . 1 1 16 16 ALA HA H 16 5.526 5.526 5.119 0.407 26022 1492 1 4 . 1 1 16 16 ALA C C 16 176.834 176.834 176.383 0.451 26022 1493 1 4 . 1 1 16 16 ALA CA C 16 49.644 49.644 50.283 -0.639 26022 1494 1 4 . 1 1 16 16 ALA CB C 16 22.054 22.054 22.221 -0.168 26022 1495 1 4 . 1 1 16 16 ALA H H 16 8.206 8.206 8.037 0.169 26022 1496 1 4 . 1 1 17 17 VAL N N 17 122.567 122.567 125.289 -2.722 26022 1497 1 4 . 1 1 17 17 VAL HA H 17 4.380 4.380 3.985 0.395 26022 1498 1 4 . 1 1 17 17 VAL C C 17 178.099 178.099 175.585 2.514 26022 1499 1 4 . 1 1 17 17 VAL CA C 17 63.608 63.608 62.424 1.184 26022 1500 1 4 . 1 1 17 17 VAL CB C 17 32.105 32.105 33.140 -1.035 26022 1501 1 4 . 1 1 18 18 THR N N 18 120.937 120.937 124.695 -3.758 26022 1502 1 4 . 1 1 18 18 THR HA H 18 4.601 4.601 4.433 0.168 26022 1503 1 4 . 1 1 18 18 THR C C 18 175.312 175.312 173.990 1.322 26022 1504 1 4 . 1 1 18 18 THR CA C 18 61.517 61.517 63.230 -1.713 26022 1505 1 4 . 1 1 18 18 THR CB C 18 69.814 69.814 69.904 -0.090 26022 1506 1 4 . 1 1 19 19 ALA N N 19 121.258 121.258 122.867 -1.609 26022 1507 1 4 . 1 1 19 19 ALA HA H 19 4.458 4.458 4.770 -0.312 26022 1508 1 4 . 1 1 19 19 ALA C C 19 174.703 174.703 174.931 -0.228 26022 1509 1 4 . 1 1 19 19 ALA CA C 19 53.017 53.017 51.570 1.447 26022 1510 1 4 . 1 1 19 19 ALA CB C 19 22.054 22.054 21.095 0.959 26022 1511 1 4 . 1 1 19 19 ALA H H 19 7.716 7.716 7.634 0.082 26022 1512 1 4 . 1 1 20 20 LEU N N 20 123.420 123.420 117.716 5.704 26022 1513 1 4 . 1 1 20 20 LEU HA H 20 4.393 4.393 5.349 -0.956 26022 1514 1 4 . 1 1 20 20 LEU C C 20 175.499 175.499 174.604 0.895 26022 1515 1 4 . 1 1 20 20 LEU CA C 20 54.839 54.839 53.116 1.723 26022 1516 1 4 . 1 1 20 20 LEU CB C 20 41.212 41.212 45.836 -4.624 26022 1517 1 4 . 1 1 20 20 LEU H H 20 8.711 8.711 8.311 0.400 26022 1518 1 4 . 1 1 21 21 LEU N N 21 124.718 124.718 121.933 2.785 26022 1519 1 4 . 1 1 21 21 LEU HA H 21 4.714 4.714 4.978 -0.264 26022 1520 1 4 . 1 1 21 21 LEU C C 21 174.328 174.328 174.896 -0.568 26022 1521 1 4 . 1 1 21 21 LEU CA C 21 52.680 52.680 51.325 1.355 26022 1522 1 4 . 1 1 21 21 LEU CB C 21 41.684 41.684 44.942 -3.258 26022 1523 1 4 . 1 1 21 21 LEU H H 21 7.773 7.773 8.766 -0.993 26022 1524 1 4 . 1 1 22 22 PRO HA H 22 4.380 4.380 4.275 0.105 26022 1525 1 4 . 1 1 22 22 PRO C C 22 175.616 175.616 175.995 -0.379 26022 1526 1 4 . 1 1 22 22 PRO CA C 22 62.529 62.529 64.622 -2.093 26022 1527 1 4 . 1 1 22 22 PRO CB C 22 32.240 32.240 31.312 0.928 26022 1528 1 4 . 1 1 23 23 ALA N N 23 120.693 120.693 119.493 1.200 26022 1529 1 4 . 1 1 23 23 ALA HA H 23 4.302 4.302 4.370 -0.068 26022 1530 1 4 . 1 1 23 23 ALA C C 23 176.178 176.178 176.839 -0.661 26022 1531 1 4 . 1 1 23 23 ALA CA C 23 52.882 52.882 51.014 1.868 26022 1532 1 4 . 1 1 23 23 ALA CB C 23 17.336 17.336 17.766 -0.430 26022 1533 1 4 . 1 1 23 23 ALA H H 23 8.675 8.675 7.672 1.003 26022 1534 1 4 . 1 1 24 24 ALA N N 24 115.540 115.540 119.300 -3.760 26022 1535 1 4 . 1 1 24 24 ALA HA H 24 3.820 3.820 3.736 0.084 26022 1536 1 4 . 1 1 24 24 ALA C C 24 175.546 175.546 176.232 -0.686 26022 1537 1 4 . 1 1 24 24 ALA CA C 24 52.613 52.613 52.993 -0.380 26022 1538 1 4 . 1 1 24 24 ALA CB C 24 16.590 16.590 17.217 -0.627 26022 1539 1 4 . 1 1 24 24 ALA H H 24 8.381 8.381 7.959 0.422 26022 1540 1 4 . 1 1 25 25 GLU N N 25 114.082 114.082 117.483 -3.401 26022 1541 1 4 . 1 1 25 25 GLU HA H 25 5.148 5.148 5.392 -0.244 26022 1542 1 4 . 1 1 25 25 GLU C C 25 175.757 175.757 174.773 0.984 26022 1543 1 4 . 1 1 25 25 GLU CA C 25 54.911 54.911 53.916 0.995 26022 1544 1 4 . 1 1 25 25 GLU CB C 25 32.645 32.645 32.699 -0.054 26022 1545 1 4 . 1 1 25 25 GLU H H 25 6.378 6.378 7.437 -1.059 26022 1546 1 4 . 1 1 26 26 PHE N N 26 117.365 117.365 122.684 -5.319 26022 1547 1 4 . 1 1 26 26 PHE HA H 26 4.979 4.979 5.042 -0.062 26022 1548 1 4 . 1 1 26 26 PHE C C 26 174.960 174.960 174.808 0.152 26022 1549 1 4 . 1 1 26 26 PHE CA C 26 56.862 56.862 56.600 0.262 26022 1550 1 4 . 1 1 26 26 PHE CB C 26 43.371 43.371 43.626 -0.255 26022 1551 1 4 . 1 1 26 26 PHE H H 26 8.950 8.950 9.270 -0.320 26022 1552 1 4 . 1 1 27 27 ARG N N 27 125.082 125.082 120.446 4.636 26022 1553 1 4 . 1 1 27 27 ARG HA H 27 4.992 4.992 5.203 -0.211 26022 1554 1 4 . 1 1 27 27 ARG C C 27 175.148 175.148 174.723 0.425 26022 1555 1 4 . 1 1 27 27 ARG CA C 27 56.323 56.323 55.394 0.929 26022 1556 1 4 . 1 1 27 27 ARG CB C 27 32.240 32.240 33.080 -0.840 26022 1557 1 4 . 1 1 27 27 ARG H H 27 8.799 8.799 8.827 -0.028 26022 1558 1 4 . 1 1 28 28 VAL N N 28 127.456 127.456 119.493 7.963 26022 1559 1 4 . 1 1 28 28 VAL HA H 28 4.757 4.757 5.048 -0.291 26022 1560 1 4 . 1 1 28 28 VAL C C 28 173.602 173.602 173.964 -0.362 26022 1561 1 4 . 1 1 28 28 VAL CA C 28 60.303 60.303 59.090 1.214 26022 1562 1 4 . 1 1 28 28 VAL CB C 28 35.681 35.681 35.628 0.053 26022 1563 1 4 . 1 1 29 29 LYS N N 29 128.096 128.096 121.508 6.588 26022 1564 1 4 . 1 1 29 29 LYS HA H 29 4.354 4.354 5.092 -0.738 26022 1565 1 4 . 1 1 29 29 LYS C C 29 176.740 176.740 175.546 1.194 26022 1566 1 4 . 1 1 29 29 LYS CA C 29 55.041 55.041 53.303 1.738 26022 1567 1 4 . 1 1 29 29 LYS CB C 29 34.062 34.062 34.384 -0.322 26022 1568 1 4 . 1 1 29 29 LYS H H 29 9.268 9.268 8.048 1.220 26022 1569 1 4 . 1 1 30 30 LEU N N 30 129.600 129.600 125.983 3.617 26022 1570 1 4 . 1 1 30 30 LEU HA H 30 4.653 4.653 4.434 0.219 26022 1571 1 4 . 1 1 30 30 LEU C C 30 178.193 178.193 177.138 1.055 26022 1572 1 4 . 1 1 30 30 LEU CA C 30 54.771 54.771 55.233 -0.462 26022 1573 1 4 . 1 1 30 30 LEU CB C 30 42.224 42.224 43.913 -1.690 26022 1574 1 4 . 1 1 30 30 LEU H H 30 9.000 9.000 8.966 0.034 26022 1575 1 4 . 1 1 31 31 ASP N N 31 120.478 120.478 125.061 -4.583 26022 1576 1 4 . 1 1 31 31 ASP HA H 31 4.458 4.458 4.518 -0.060 26022 1577 1 4 . 1 1 31 31 ASP C C 31 176.155 176.155 175.906 0.249 26022 1578 1 4 . 1 1 31 31 ASP CA C 31 55.918 55.918 56.558 -0.640 26022 1579 1 4 . 1 1 31 31 ASP CB C 31 39.593 39.593 40.743 -1.150 26022 1580 1 4 . 1 1 31 31 ASP H H 31 8.698 8.698 8.693 0.005 26022 1581 1 4 . 1 1 32 32 ASN N N 32 115.450 115.450 117.368 -1.918 26022 1582 1 4 . 1 1 32 32 ASN HA H 32 4.588 4.588 4.767 -0.179 26022 1583 1 4 . 1 1 32 32 ASN C C 32 175.335 175.335 174.254 1.081 26022 1584 1 4 . 1 1 32 32 ASN CA C 32 53.152 53.152 52.969 0.183 26022 1585 1 4 . 1 1 32 32 ASN CB C 32 37.367 37.367 37.937 -0.570 26022 1586 1 4 . 1 1 32 32 ASN H H 32 7.680 7.680 7.816 -0.136 26022 1587 1 4 . 1 1 33 33 GLU N N 33 111.790 111.790 115.886 -4.096 26022 1588 1 4 . 1 1 33 33 GLU HA H 33 3.898 3.898 3.876 0.022 26022 1589 1 4 . 1 1 33 33 GLU C C 33 175.733 175.733 174.354 1.379 26022 1590 1 4 . 1 1 33 33 GLU CA C 33 58.144 58.144 57.785 0.359 26022 1591 1 4 . 1 1 33 33 GLU CB C 33 28.242 28.242 27.283 0.959 26022 1592 1 4 . 1 1 33 33 GLU H H 33 8.097 8.097 7.925 0.172 26022 1593 1 4 . 1 1 34 34 HIS N N 34 119.193 119.193 117.815 1.378 26022 1594 1 4 . 1 1 34 34 HIS HA H 34 4.201 4.201 4.898 -0.697 26022 1595 1 4 . 1 1 34 34 HIS C C 34 173.789 173.789 173.841 -0.052 26022 1596 1 4 . 1 1 34 34 HIS CA C 34 56.053 56.053 55.272 0.781 26022 1597 1 4 . 1 1 34 34 HIS CB C 34 30.487 30.487 31.887 -1.400 26022 1598 1 4 . 1 1 34 34 HIS H H 34 7.890 7.890 7.633 0.257 26022 1599 1 4 . 1 1 35 35 GLU HA H 35 5.400 5.400 5.308 0.092 26022 1600 1 4 . 1 1 35 35 GLU C C 35 175.944 175.944 175.836 0.108 26022 1601 1 4 . 1 1 35 35 GLU CA C 35 55.109 55.109 55.451 -0.342 26022 1602 1 4 . 1 1 35 35 GLU CB C 35 32.308 32.308 31.171 1.137 26022 1603 1 4 . 1 1 36 36 ILE N N 36 119.077 119.077 119.790 -0.713 26022 1604 1 4 . 1 1 36 36 ILE HA H 36 4.686 4.686 4.699 -0.014 26022 1605 1 4 . 1 1 36 36 ILE C C 36 173.790 173.790 175.318 -1.528 26022 1606 1 4 . 1 1 36 36 ILE CA C 36 59.156 59.156 59.590 -0.434 26022 1607 1 4 . 1 1 36 36 ILE CB C 36 42.696 42.696 41.035 1.661 26022 1608 1 4 . 1 1 37 37 ILE N N 37 122.787 122.787 124.533 -1.746 26022 1609 1 4 . 1 1 37 37 ILE HA H 37 4.778 4.778 4.168 0.610 26022 1610 1 4 . 1 1 37 37 ILE C C 37 177.057 177.057 175.727 1.330 26022 1611 1 4 . 1 1 37 37 ILE CA C 37 59.723 59.723 61.917 -2.194 26022 1612 1 4 . 1 1 37 37 ILE CB C 37 37.949 37.949 36.891 1.058 26022 1613 1 4 . 1 1 38 38 CYS N N 38 122.357 122.357 126.445 -4.088 26022 1614 1 4 . 1 1 38 38 CYS HA H 38 5.708 5.708 4.798 0.910 26022 1615 1 4 . 1 1 38 38 CYS C C 38 174.258 174.258 173.712 0.546 26022 1616 1 4 . 1 1 38 38 CYS CA C 38 56.930 56.930 57.528 -0.598 26022 1617 1 4 . 1 1 38 38 CYS CB C 38 33.252 33.252 29.627 3.625 26022 1618 1 4 . 1 1 38 38 CYS H H 38 9.512 9.512 8.979 0.533 26022 1619 1 4 . 1 1 39 39 HIS N N 39 117.101 117.101 123.423 -6.322 26022 1620 1 4 . 1 1 39 39 HIS HA H 39 5.526 5.526 5.381 0.145 26022 1621 1 4 . 1 1 39 39 HIS C C 39 174.516 174.516 174.050 0.466 26022 1622 1 4 . 1 1 39 39 HIS CA C 39 54.097 54.097 55.421 -1.324 26022 1623 1 4 . 1 1 39 39 HIS CB C 39 31.701 31.701 33.767 -2.066 26022 1624 1 4 . 1 1 39 39 HIS H H 39 7.597 7.597 8.416 -0.820 26022 1625 1 4 . 1 1 40 40 VAL N N 40 117.923 117.923 123.880 -5.957 26022 1626 1 4 . 1 1 40 40 VAL HA H 40 4.614 4.614 4.164 0.450 26022 1627 1 4 . 1 1 40 40 VAL C C 40 175.804 175.804 175.317 0.487 26022 1628 1 4 . 1 1 40 40 VAL CA C 40 61.382 61.382 63.053 -1.671 26022 1629 1 4 . 1 1 40 40 VAL CB C 40 33.396 33.396 31.769 1.627 26022 1630 1 4 . 1 1 41 41 SER N N 41 119.242 119.242 121.753 -2.511 26022 1631 1 4 . 1 1 41 41 SER HA H 41 4.550 4.550 4.751 -0.201 26022 1632 1 4 . 1 1 41 41 SER C C 41 174.656 174.656 173.382 1.274 26022 1633 1 4 . 1 1 41 41 SER CA C 41 58.126 58.126 58.091 0.035 26022 1634 1 4 . 1 1 41 41 SER CB C 41 63.470 63.470 64.272 -0.802 26022 1635 1 4 . 1 1 41 41 SER H H 41 8.341 8.341 8.794 -0.453 26022 1636 1 4 . 1 1 42 42 GLY N N 42 110.569 110.569 109.123 1.446 26022 1637 1 4 . 1 1 42 42 GLY C C 42 173.829 173.829 173.939 -0.110 26022 1638 1 4 . 1 1 42 42 GLY CA C 42 45.257 45.257 45.346 -0.089 26022 1639 1 4 . 1 1 42 42 GLY H H 42 8.380 8.380 7.928 0.452 26022 1640 1 4 . 1 1 43 43 LYS HA H 43 3.977 3.977 4.060 -0.083 26022 1641 1 4 . 1 1 43 43 LYS C C 43 179.363 179.363 177.811 1.552 26022 1642 1 4 . 1 1 43 43 LYS CA C 43 59.628 59.628 58.413 1.215 26022 1643 1 4 . 1 1 43 43 LYS CB C 43 32.510 32.510 32.443 0.067 26022 1644 1 4 . 1 1 44 44 VAL N N 44 120.404 120.404 119.923 0.481 26022 1645 1 4 . 1 1 44 44 VAL HA H 44 3.661 3.661 3.618 0.043 26022 1646 1 4 . 1 1 44 44 VAL C C 44 179.785 179.785 177.919 1.866 26022 1647 1 4 . 1 1 44 44 VAL CA C 44 65.425 65.425 65.898 -0.473 26022 1648 1 4 . 1 1 44 44 VAL CB C 44 31.500 31.500 31.203 0.297 26022 1649 1 4 . 1 1 45 45 ARG N N 45 123.687 123.687 119.470 4.217 26022 1650 1 4 . 1 1 45 45 ARG HA H 45 4.054 4.054 4.171 -0.117 26022 1651 1 4 . 1 1 45 45 ARG C C 45 179.504 179.504 177.762 1.742 26022 1652 1 4 . 1 1 45 45 ARG CA C 45 59.669 59.669 58.416 1.253 26022 1653 1 4 . 1 1 45 45 ARG CB C 45 30.417 30.417 30.130 0.287 26022 1654 1 4 . 1 1 45 45 ARG H H 45 8.608 8.608 7.873 0.735 26022 1655 1 4 . 1 1 46 46 ARG N N 46 118.506 118.506 118.535 -0.029 26022 1656 1 4 . 1 1 46 46 ARG HA H 46 4.148 4.148 4.236 -0.088 26022 1657 1 4 . 1 1 46 46 ARG C C 46 177.396 177.396 178.295 -0.899 26022 1658 1 4 . 1 1 46 46 ARG CA C 46 58.481 58.481 58.424 0.057 26022 1659 1 4 . 1 1 46 46 ARG CB C 46 30.554 30.554 30.522 0.032 26022 1660 1 4 . 1 1 46 46 ARG H H 46 8.474 8.474 7.508 0.966 26022 1661 1 4 . 1 1 47 47 SER N N 47 114.263 114.263 112.379 1.884 26022 1662 1 4 . 1 1 47 47 SER HA H 47 4.393 4.393 4.493 -0.100 26022 1663 1 4 . 1 1 47 47 SER C C 47 174.070 174.070 173.860 0.210 26022 1664 1 4 . 1 1 47 47 SER CA C 47 59.696 59.696 58.251 1.445 26022 1665 1 4 . 1 1 47 47 SER CB C 47 64.013 64.013 63.964 0.049 26022 1666 1 4 . 1 1 47 47 SER H H 47 7.645 7.645 7.812 -0.167 26022 1667 1 4 . 1 1 48 48 LYS N N 48 115.405 115.405 119.003 -3.598 26022 1668 1 4 . 1 1 48 48 LYS HA H 48 3.990 3.990 3.958 0.032 26022 1669 1 4 . 1 1 48 48 LYS C C 48 175.804 175.804 175.519 0.285 26022 1670 1 4 . 1 1 48 48 LYS CA C 48 57.537 57.537 57.258 0.279 26022 1671 1 4 . 1 1 48 48 LYS CB C 48 29.947 29.947 29.593 0.354 26022 1672 1 4 . 1 1 48 48 LYS H H 48 7.821 7.821 7.794 0.027 26022 1673 1 4 . 1 1 49 49 ILE N N 49 117.265 117.265 119.031 -1.766 26022 1674 1 4 . 1 1 49 49 ILE HA H 49 4.041 4.041 4.021 0.020 26022 1675 1 4 . 1 1 49 49 ILE C C 49 175.125 175.125 176.146 -1.021 26022 1676 1 4 . 1 1 49 49 ILE CA C 49 61.315 61.315 60.859 0.456 26022 1677 1 4 . 1 1 49 49 ILE CB C 49 38.919 38.919 38.640 0.279 26022 1678 1 4 . 1 1 50 50 ARG N N 50 126.687 126.687 127.027 -0.340 26022 1679 1 4 . 1 1 50 50 ARG HA H 50 4.471 4.471 4.367 0.103 26022 1680 1 4 . 1 1 50 50 ARG C C 50 175.007 175.007 175.401 -0.394 26022 1681 1 4 . 1 1 50 50 ARG CA C 50 55.176 55.176 55.594 -0.418 26022 1682 1 4 . 1 1 50 50 ARG CB C 50 31.026 31.026 30.679 0.347 26022 1683 1 4 . 1 1 50 50 ARG H H 50 8.437 8.437 8.398 0.039 26022 1684 1 4 . 1 1 51 51 ILE N N 51 127.722 127.722 126.077 1.645 26022 1685 1 4 . 1 1 51 51 ILE HA H 51 4.276 4.276 4.053 0.223 26022 1686 1 4 . 1 1 51 51 ILE C C 51 174.726 174.726 175.728 -1.002 26022 1687 1 4 . 1 1 51 51 ILE CA C 51 60.235 60.235 60.553 -0.318 26022 1688 1 4 . 1 1 51 51 ILE CB C 51 37.772 37.772 38.281 -0.509 26022 1689 1 4 . 1 1 52 52 ILE N N 52 121.888 121.888 122.822 -0.934 26022 1690 1 4 . 1 1 52 52 ILE HA H 52 4.781 4.781 4.516 0.265 26022 1691 1 4 . 1 1 52 52 ILE C C 52 175.733 175.733 174.908 0.825 26022 1692 1 4 . 1 1 52 52 ILE CA C 52 59.021 59.021 59.261 -0.240 26022 1693 1 4 . 1 1 52 52 ILE CB C 52 42.089 42.089 40.941 1.148 26022 1694 1 4 . 1 1 53 53 ILE N N 53 119.363 119.363 124.316 -4.953 26022 1695 1 4 . 1 1 53 53 ILE HA H 53 3.338 3.338 3.901 -0.563 26022 1696 1 4 . 1 1 53 53 ILE C C 53 177.021 177.021 176.808 0.213 26022 1697 1 4 . 1 1 53 53 ILE CA C 53 64.274 64.274 62.284 1.990 26022 1698 1 4 . 1 1 53 53 ILE CB C 53 37.256 37.256 37.883 -0.627 26022 1699 1 4 . 1 1 54 54 GLY N N 54 116.136 116.136 115.605 0.531 26022 1700 1 4 . 1 1 54 54 GLY C C 54 174.844 174.844 173.852 0.992 26022 1701 1 4 . 1 1 54 54 GLY CA C 54 45.188 45.188 44.778 0.410 26022 1702 1 4 . 1 1 54 54 GLY H H 54 8.853 8.853 8.403 0.450 26022 1703 1 4 . 1 1 55 55 ASP N N 55 121.946 121.946 121.700 0.246 26022 1704 1 4 . 1 1 55 55 ASP HA H 55 4.588 4.588 5.069 -0.481 26022 1705 1 4 . 1 1 55 55 ASP C C 55 175.804 175.804 174.729 1.075 26022 1706 1 4 . 1 1 55 55 ASP CA C 55 55.200 55.200 52.958 2.242 26022 1707 1 4 . 1 1 55 55 ASP CB C 55 41.048 41.048 42.554 -1.506 26022 1708 1 4 . 1 1 55 55 ASP H H 55 8.054 8.054 7.563 0.491 26022 1709 1 4 . 1 1 56 56 ARG N N 56 120.974 120.974 117.987 2.987 26022 1710 1 4 . 1 1 56 56 ARG HA H 56 5.200 5.200 4.958 0.242 26022 1711 1 4 . 1 1 56 56 ARG C C 56 176.483 176.483 176.310 0.173 26022 1712 1 4 . 1 1 56 56 ARG CA C 56 54.097 54.097 54.198 -0.101 26022 1713 1 4 . 1 1 56 56 ARG CB C 56 30.689 30.689 31.547 -0.858 26022 1714 1 4 . 1 1 56 56 ARG H H 56 8.766 8.766 8.184 0.582 26022 1715 1 4 . 1 1 57 57 VAL N N 57 114.943 114.943 116.384 -1.441 26022 1716 1 4 . 1 1 57 57 VAL HA H 57 4.965 4.965 4.515 0.450 26022 1717 1 4 . 1 1 57 57 VAL C C 57 172.243 172.243 173.687 -1.444 26022 1718 1 4 . 1 1 57 57 VAL CA C 57 58.077 58.077 59.684 -1.607 26022 1719 1 4 . 1 1 57 57 VAL CB C 57 36.288 36.288 35.013 1.275 26022 1720 1 4 . 1 1 58 58 LEU N N 58 122.410 122.410 124.495 -2.085 26022 1721 1 4 . 1 1 58 58 LEU HA H 58 4.731 4.731 4.931 -0.200 26022 1722 1 4 . 1 1 58 58 LEU C C 58 174.773 174.773 175.027 -0.254 26022 1723 1 4 . 1 1 58 58 LEU CA C 58 53.085 53.085 53.800 -0.715 26022 1724 1 4 . 1 1 58 58 LEU CB C 58 45.788 45.788 43.642 2.146 26022 1725 1 4 . 1 1 58 58 LEU H H 58 8.382 8.382 8.438 -0.056 26022 1726 1 4 . 1 1 59 59 VAL N N 59 127.937 127.937 127.326 0.611 26022 1727 1 4 . 1 1 59 59 VAL HA H 59 4.744 4.744 5.145 -0.401 26022 1728 1 4 . 1 1 59 59 VAL C C 59 174.141 174.141 173.687 0.454 26022 1729 1 4 . 1 1 59 59 VAL CA C 59 60.279 60.279 59.065 1.214 26022 1730 1 4 . 1 1 59 59 VAL CB C 59 34.399 34.399 34.666 -0.267 26022 1731 1 4 . 1 1 60 60 GLU N N 60 124.832 124.832 128.332 -3.500 26022 1732 1 4 . 1 1 60 60 GLU HA H 60 5.304 5.304 5.304 0.000 26022 1733 1 4 . 1 1 60 60 GLU C C 60 176.155 176.155 175.637 0.518 26022 1734 1 4 . 1 1 60 60 GLU CA C 60 54.164 54.164 54.055 0.109 26022 1735 1 4 . 1 1 60 60 GLU CB C 60 33.803 33.803 30.539 3.264 26022 1736 1 4 . 1 1 60 60 GLU H H 60 9.142 9.142 8.787 0.355 26022 1737 1 4 . 1 1 61 61 MET N N 61 124.187 124.187 122.908 1.279 26022 1738 1 4 . 1 1 61 61 MET HA H 61 4.899 4.899 4.948 -0.049 26022 1739 1 4 . 1 1 61 61 MET C C 61 173.953 173.953 174.516 -0.563 26022 1740 1 4 . 1 1 61 61 MET CA C 61 54.232 54.232 53.514 0.718 26022 1741 1 4 . 1 1 61 61 MET CB C 61 37.256 37.256 36.598 0.658 26022 1742 1 4 . 1 1 61 61 MET H H 61 8.984 8.984 9.375 -0.391 26022 1743 1 4 . 1 1 62 62 SER N N 62 116.623 116.623 117.195 -0.572 26022 1744 1 4 . 1 1 62 62 SER HA H 62 4.263 4.263 4.881 -0.618 26022 1745 1 4 . 1 1 62 62 SER C C 62 176.413 176.413 175.026 1.387 26022 1746 1 4 . 1 1 62 62 SER CA C 62 56.893 56.893 56.632 0.261 26022 1747 1 4 . 1 1 62 62 SER CB C 62 65.362 65.362 64.469 0.893 26022 1748 1 4 . 1 1 62 62 SER H H 62 9.167 9.167 8.147 1.020 26022 1749 1 4 . 1 1 63 63 ILE N N 63 121.187 121.187 123.960 -2.773 26022 1750 1 4 . 1 1 63 63 ILE HA H 63 3.989 3.989 3.811 0.178 26022 1751 1 4 . 1 1 63 63 ILE C C 63 176.623 176.623 177.219 -0.596 26022 1752 1 4 . 1 1 63 63 ILE CA C 63 63.878 63.878 61.367 2.511 26022 1753 1 4 . 1 1 63 63 ILE CB C 63 38.244 38.244 37.041 1.203 26022 1754 1 4 . 1 1 64 64 TYR N N 64 120.214 120.214 118.656 1.558 26022 1755 1 4 . 1 1 64 64 TYR HA H 64 4.432 4.432 4.245 0.187 26022 1756 1 4 . 1 1 64 64 TYR C C 64 177.092 177.092 176.631 0.461 26022 1757 1 4 . 1 1 64 64 TYR CA C 64 59.156 59.156 60.096 -0.940 26022 1758 1 4 . 1 1 64 64 TYR CB C 64 38.109 38.109 38.328 -0.219 26022 1759 1 4 . 1 1 64 64 TYR H H 64 7.762 7.762 7.691 0.071 26022 1760 1 4 . 1 1 65 65 ASP N N 65 121.338 121.338 115.310 6.028 26022 1761 1 4 . 1 1 65 65 ASP HA H 65 4.495 4.495 4.704 -0.209 26022 1762 1 4 . 1 1 65 65 ASP C C 65 177.349 177.349 178.082 -0.733 26022 1763 1 4 . 1 1 65 65 ASP CA C 65 55.243 55.243 54.562 0.681 26022 1764 1 4 . 1 1 65 65 ASP CB C 65 40.538 40.538 41.004 -0.466 26022 1765 1 4 . 1 1 65 65 ASP H H 65 7.798 7.798 8.042 -0.244 26022 1766 1 4 . 1 1 66 66 ARG N N 66 121.118 121.118 120.819 0.299 26022 1767 1 4 . 1 1 66 66 ARG HA H 66 4.069 4.069 4.114 -0.045 26022 1768 1 4 . 1 1 66 66 ARG C C 66 178.448 178.448 176.910 1.538 26022 1769 1 4 . 1 1 66 66 ARG CA C 66 58.401 58.401 58.629 -0.228 26022 1770 1 4 . 1 1 66 66 ARG CB C 66 30.184 30.184 29.310 0.874 26022 1771 1 4 . 1 1 66 66 ARG H H 66 8.382 8.382 8.697 -0.315 26022 1772 1 4 . 1 1 67 67 ASN N N 67 117.334 117.334 117.672 -0.338 26022 1773 1 4 . 1 1 67 67 ASN HA H 67 4.601 4.601 4.991 -0.390 26022 1774 1 4 . 1 1 67 67 ASN C C 67 175.288 175.288 175.595 -0.307 26022 1775 1 4 . 1 1 67 67 ASN CA C 67 54.097 54.097 52.990 1.107 26022 1776 1 4 . 1 1 67 67 ASN CB C 67 38.514 38.514 37.759 0.755 26022 1777 1 4 . 1 1 67 67 ASN H H 67 8.194 8.194 8.337 -0.143 26022 1778 1 4 . 1 1 68 68 ALA N N 68 122.187 122.187 123.212 -1.025 26022 1779 1 4 . 1 1 68 68 ALA HA H 68 4.575 4.575 4.519 0.056 26022 1780 1 4 . 1 1 68 68 ALA C C 68 176.272 176.272 178.023 -1.751 26022 1781 1 4 . 1 1 68 68 ALA CA C 68 52.478 52.478 54.325 -1.847 26022 1782 1 4 . 1 1 68 68 ALA CB C 68 19.086 19.086 19.226 -0.140 26022 1783 1 4 . 1 1 68 68 ALA H H 68 7.658 7.658 7.564 0.094 26022 1784 1 4 . 1 1 69 69 LYS N N 69 116.931 116.931 115.722 1.209 26022 1785 1 4 . 1 1 69 69 LYS HA H 69 4.197 4.197 4.255 -0.058 26022 1786 1 4 . 1 1 69 69 LYS C C 69 176.085 176.085 175.553 0.532 26022 1787 1 4 . 1 1 69 69 LYS CA C 69 56.728 56.728 57.312 -0.584 26022 1788 1 4 . 1 1 69 69 LYS CB C 69 31.566 31.566 33.065 -1.499 26022 1789 1 4 . 1 1 69 69 LYS H H 69 8.255 8.255 8.332 -0.077 26022 1790 1 4 . 1 1 70 70 LYS N N 70 119.854 119.854 117.550 2.304 26022 1791 1 4 . 1 1 70 70 LYS HA H 70 5.526 5.526 4.865 0.661 26022 1792 1 4 . 1 1 70 70 LYS C C 70 175.171 175.171 175.029 0.142 26022 1793 1 4 . 1 1 70 70 LYS CA C 70 54.704 54.704 55.227 -0.523 26022 1794 1 4 . 1 1 70 70 LYS CB C 70 36.850 36.850 35.564 1.286 26022 1795 1 4 . 1 1 70 70 LYS H H 70 8.182 8.182 7.338 0.844 26022 1796 1 4 . 1 1 71 71 GLY N N 71 103.604 103.604 108.636 -5.032 26022 1797 1 4 . 1 1 71 71 GLY C C 71 171.541 171.541 173.531 -1.990 26022 1798 1 4 . 1 1 71 71 GLY CA C 71 45.462 45.462 43.468 1.994 26022 1799 1 4 . 1 1 71 71 GLY H H 71 7.780 7.780 8.266 -0.486 26022 1800 1 4 . 1 1 72 72 ARG N N 72 119.187 119.187 120.306 -1.119 26022 1801 1 4 . 1 1 72 72 ARG HA H 72 4.861 4.861 4.533 0.328 26022 1802 1 4 . 1 1 72 72 ARG C C 72 175.570 175.570 175.472 0.098 26022 1803 1 4 . 1 1 72 72 ARG CA C 72 53.624 53.624 55.569 -1.946 26022 1804 1 4 . 1 1 72 72 ARG CB C 72 34.129 34.129 30.882 3.247 26022 1805 1 4 . 1 1 72 72 ARG H H 72 8.007 8.007 8.640 -0.633 26022 1806 1 4 . 1 1 73 73 ILE N N 73 125.721 125.721 125.326 0.395 26022 1807 1 4 . 1 1 73 73 ILE HA H 73 4.263 4.263 4.651 -0.388 26022 1808 1 4 . 1 1 73 73 ILE C C 73 175.312 175.312 175.130 0.182 26022 1809 1 4 . 1 1 73 73 ILE CA C 73 62.259 62.259 60.869 1.390 26022 1810 1 4 . 1 1 73 73 ILE CB C 73 39.423 39.423 38.655 0.768 26022 1811 1 4 . 1 1 74 74 ILE N N 74 120.540 120.540 127.089 -6.549 26022 1812 1 4 . 1 1 74 74 ILE HA H 74 4.596 4.596 4.224 0.372 26022 1813 1 4 . 1 1 74 74 ILE C C 74 176.249 176.249 173.909 2.340 26022 1814 1 4 . 1 1 74 74 ILE CA C 74 60.910 60.910 61.223 -0.313 26022 1815 1 4 . 1 1 74 74 ILE CB C 74 39.863 39.863 40.634 -0.771 26022 1816 1 4 . 1 1 75 75 ARG N N 75 118.582 118.582 117.349 1.233 26022 1817 1 4 . 1 1 75 75 ARG HA H 75 4.289 4.289 4.540 -0.251 26022 1818 1 4 . 1 1 75 75 ARG C C 75 173.883 173.883 173.634 0.249 26022 1819 1 4 . 1 1 75 75 ARG CA C 75 56.390 56.390 55.544 0.846 26022 1820 1 4 . 1 1 75 75 ARG CB C 75 34.669 34.669 32.097 2.571 26022 1821 1 4 . 1 1 75 75 ARG H H 75 7.397 7.397 7.970 -0.573 26022 1822 1 4 . 1 1 76 76 ARG N N 76 125.606 125.606 121.518 4.088 26022 1823 1 4 . 1 1 76 76 ARG HA H 76 4.609 4.609 4.597 0.012 26022 1824 1 4 . 1 1 76 76 ARG C C 76 175.312 175.312 173.577 1.735 26022 1825 1 4 . 1 1 76 76 ARG CA C 76 55.810 55.810 54.897 0.913 26022 1826 1 4 . 1 1 76 76 ARG CB C 76 31.094 31.094 34.802 -3.708 26022 1827 1 4 . 1 1 76 76 ARG H H 76 9.094 9.094 8.790 0.304 26022 1828 1 4 . 1 1 77 77 LEU N N 77 128.575 128.575 123.948 4.627 26022 1829 1 4 . 1 1 77 77 LEU HA H 77 4.372 4.372 4.177 0.195 26022 1830 1 4 . 1 1 77 77 LEU C C 77 176.225 176.225 176.241 -0.016 26022 1831 1 4 . 1 1 77 77 LEU CA C 77 54.704 54.704 55.879 -1.175 26022 1832 1 4 . 1 1 77 77 LEU CB C 77 42.292 42.292 43.033 -0.741 26022 1833 1 4 . 1 1 77 77 LEU H H 77 8.742 8.742 8.467 0.275 26022 1834 1 4 . 1 1 78 78 LYS N N 78 119.592 119.592 124.583 -4.991 26022 1835 1 4 . 1 1 78 78 LYS HA H 78 4.302 4.302 4.149 0.153 26022 1836 1 4 . 1 1 78 78 LYS C C 78 176.296 176.296 177.501 -1.205 26022 1837 1 4 . 1 1 78 78 LYS CA C 78 56.390 56.390 57.344 -0.954 26022 1838 1 4 . 1 1 78 78 LYS CB C 78 33.994 33.994 32.667 1.327 26022 1839 1 4 . 1 1 78 78 LYS H H 78 8.090 8.090 8.213 -0.123 26022 1840 1 4 . 1 1 79 79 GLY N N 79 110.854 110.854 106.645 4.209 26022 1841 1 4 . 1 1 79 79 GLY C C 79 174.328 174.328 174.354 -0.026 26022 1842 1 4 . 1 1 79 79 GLY CA C 79 44.990 44.990 44.684 0.306 26022 1843 1 4 . 1 1 79 79 GLY H H 79 8.520 8.520 8.248 0.272 26022 1844 1 4 . 1 1 80 80 THR N N 80 114.187 114.187 113.999 0.188 26022 1845 1 4 . 1 1 80 80 THR HA H 80 4.237 4.237 4.545 -0.308 26022 1846 1 4 . 1 1 80 80 THR C C 80 175.054 175.054 173.877 1.177 26022 1847 1 4 . 1 1 80 80 THR CA C 80 62.242 62.242 61.914 0.328 26022 1848 1 4 . 1 1 80 80 THR CB C 80 69.826 69.826 69.912 -0.086 26022 1849 1 4 . 1 1 81 81 SER N N 81 117.958 117.958 118.960 -1.002 26022 1850 1 4 . 1 1 81 81 SER HA H 81 4.449 4.449 4.237 0.212 26022 1851 1 4 . 1 1 81 81 SER C C 81 174.703 174.703 173.469 1.234 26022 1852 1 4 . 1 1 81 81 SER CA C 81 58.481 58.481 59.030 -0.549 26022 1853 1 4 . 1 1 81 81 SER CB C 81 63.338 63.338 63.255 0.083 26022 1854 1 4 . 1 1 81 81 SER H H 81 8.474 8.474 8.445 0.029 26022 1855 1 4 . 1 1 82 82 ASP HA H 82 4.280 4.280 4.754 -0.474 26022 1856 1 4 . 1 1 82 82 ASP C C 82 177.115 177.115 177.167 -0.052 26022 1857 1 4 . 1 1 82 82 ASP CA C 82 55.176 55.176 54.725 0.451 26022 1858 1 4 . 1 1 82 82 ASP CB C 82 42.359 42.359 41.313 1.046 26022 1859 1 4 . 1 1 83 83 ARG N N 83 121.531 121.531 116.537 4.994 26022 1860 1 4 . 1 1 83 83 ARG HA H 83 4.346 4.346 3.897 0.449 26022 1861 1 4 . 1 1 83 83 ARG C C 83 176.342 176.342 176.614 -0.272 26022 1862 1 4 . 1 1 83 83 ARG CA C 83 56.053 56.053 58.815 -2.762 26022 1863 1 4 . 1 1 83 83 ARG CB C 83 30.891 30.891 28.663 2.228 26022 1864 1 4 . 1 1 83 83 ARG H H 83 8.259 8.259 8.541 -0.282 26022 1865 1 4 . 1 1 84 84 THR N N 84 116.462 116.462 113.410 3.052 26022 1866 1 4 . 1 1 84 84 THR HA H 84 4.333 4.333 4.541 -0.208 26022 1867 1 4 . 1 1 84 84 THR C C 84 174.445 174.445 174.262 0.183 26022 1868 1 4 . 1 1 84 84 THR CA C 84 62.254 62.254 62.764 -0.510 26022 1869 1 4 . 1 1 84 84 THR CB C 84 69.833 69.833 70.775 -0.942 26022 1870 1 4 . 1 1 85 85 ILE N N 85 123.762 123.762 122.385 1.377 26022 1871 1 4 . 1 1 85 85 ILE HA H 85 4.188 4.188 4.222 -0.034 26022 1872 1 4 . 1 1 85 85 ILE C C 85 176.155 176.155 175.564 0.591 26022 1873 1 4 . 1 1 85 85 ILE CA C 85 61.112 61.112 61.828 -0.716 26022 1874 1 4 . 1 1 85 85 ILE CB C 85 38.919 38.919 36.030 2.889 26022 1875 1 4 . 1 1 86 86 SER N N 86 120.214 120.214 119.918 0.296 26022 1876 1 4 . 1 1 86 86 SER HA H 86 4.451 4.451 4.394 0.057 26022 1877 1 4 . 1 1 86 86 SER C C 86 174.586 174.586 173.438 1.148 26022 1878 1 4 . 1 1 86 86 SER CA C 86 58.212 58.212 59.012 -0.800 26022 1879 1 4 . 1 1 86 86 SER CB C 86 63.271 63.271 63.529 -0.258 26022 1880 1 4 . 1 1 86 86 SER H H 86 8.377 8.377 8.338 0.039 26022 1881 1 5 . 1 1 2 2 VAL N N 2 122.187 122.187 117.292 4.895 26022 1882 1 5 . 1 1 2 2 VAL HA H 2 4.091 4.091 4.379 -0.288 26022 1883 1 5 . 1 1 2 2 VAL C C 2 175.921 175.921 174.990 0.931 26022 1884 1 5 . 1 1 2 2 VAL CA C 2 62.057 62.057 63.334 -1.276 26022 1885 1 5 . 1 1 2 2 VAL CB C 2 32.848 32.848 32.539 0.309 26022 1886 1 5 . 1 1 3 3 LYS N N 3 125.437 125.437 121.640 3.797 26022 1887 1 5 . 1 1 3 3 LYS HA H 3 4.289 4.289 4.439 -0.150 26022 1888 1 5 . 1 1 3 3 LYS C C 3 176.155 176.155 175.330 0.825 26022 1889 1 5 . 1 1 3 3 LYS CA C 3 56.323 56.323 56.320 0.003 26022 1890 1 5 . 1 1 3 3 LYS CB C 3 33.320 33.320 31.690 1.630 26022 1891 1 5 . 1 1 3 3 LYS H H 3 8.396 8.396 8.086 0.310 26022 1892 1 5 . 1 1 4 4 ASP N N 4 121.937 121.937 123.077 -1.140 26022 1893 1 5 . 1 1 4 4 ASP HA H 4 4.289 4.289 4.719 -0.430 26022 1894 1 5 . 1 1 4 4 ASP C C 4 176.319 176.319 177.166 -0.847 26022 1895 1 5 . 1 1 4 4 ASP CA C 4 54.029 54.029 55.690 -1.661 26022 1896 1 5 . 1 1 4 4 ASP CB C 4 41.280 41.280 41.745 -0.465 26022 1897 1 5 . 1 1 4 4 ASP H H 4 8.325 8.325 8.228 0.097 26022 1898 1 5 . 1 1 5 5 GLU N N 5 122.369 122.369 120.467 1.902 26022 1899 1 5 . 1 1 5 5 GLU HA H 5 4.250 4.250 4.237 0.013 26022 1900 1 5 . 1 1 5 5 GLU C C 5 177.045 177.045 177.543 -0.498 26022 1901 1 5 . 1 1 5 5 GLU CA C 5 56.930 56.930 58.343 -1.413 26022 1902 1 5 . 1 1 5 5 GLU CB C 5 30.554 30.554 29.653 0.901 26022 1903 1 5 . 1 1 5 5 GLU H H 5 8.464 8.464 8.851 -0.387 26022 1904 1 5 . 1 1 6 6 LYS N N 6 121.437 121.437 119.018 2.419 26022 1905 1 5 . 1 1 6 6 LYS HA H 6 4.282 4.282 4.548 -0.266 26022 1906 1 5 . 1 1 6 6 LYS C C 6 177.185 177.185 176.453 0.732 26022 1907 1 5 . 1 1 6 6 LYS CA C 6 56.930 56.930 55.513 1.417 26022 1908 1 5 . 1 1 6 6 LYS CB C 6 32.713 32.713 31.058 1.655 26022 1909 1 5 . 1 1 6 6 LYS H H 6 8.390 8.390 8.414 -0.024 26022 1910 1 5 . 1 1 7 7 SER N N 7 115.822 115.822 114.915 0.907 26022 1911 1 5 . 1 1 7 7 SER HA H 7 4.396 4.396 4.238 0.158 26022 1912 1 5 . 1 1 7 7 SER C C 7 174.609 174.609 174.774 -0.165 26022 1913 1 5 . 1 1 7 7 SER CA C 7 58.684 58.684 59.547 -0.863 26022 1914 1 5 . 1 1 7 7 SER CB C 7 63.608 63.608 63.575 0.033 26022 1915 1 5 . 1 1 7 7 SER H H 7 8.205 8.205 8.189 0.016 26022 1916 1 5 . 1 1 8 8 LYS N N 8 122.643 122.643 119.295 3.348 26022 1917 1 5 . 1 1 8 8 LYS HA H 8 4.407 4.407 4.140 0.267 26022 1918 1 5 . 1 1 8 8 LYS C C 8 176.694 176.694 175.658 1.036 26022 1919 1 5 . 1 1 8 8 LYS CA C 8 56.390 56.390 56.933 -0.543 26022 1920 1 5 . 1 1 8 8 LYS CB C 8 33.185 33.185 31.916 1.269 26022 1921 1 5 . 1 1 8 8 LYS H H 8 8.201 8.201 8.371 -0.170 26022 1922 1 5 . 1 1 9 9 THR N N 9 113.900 113.900 116.627 -2.727 26022 1923 1 5 . 1 1 9 9 THR HA H 9 4.341 4.341 4.489 -0.148 26022 1924 1 5 . 1 1 9 9 THR C C 9 173.438 173.438 174.580 -1.142 26022 1925 1 5 . 1 1 9 9 THR CA C 9 62.529 62.529 62.797 -0.268 26022 1926 1 5 . 1 1 9 9 THR CB C 9 69.342 69.342 69.505 -0.163 26022 1927 1 5 . 1 1 10 10 LEU N N 10 124.082 124.082 124.228 -0.146 26022 1928 1 5 . 1 1 10 10 LEU HA H 10 4.858 4.858 4.932 -0.074 26022 1929 1 5 . 1 1 10 10 LEU C C 10 175.804 175.804 175.620 0.184 26022 1930 1 5 . 1 1 10 10 LEU CA C 10 53.759 53.759 54.023 -0.264 26022 1931 1 5 . 1 1 10 10 LEU CB C 10 44.653 44.653 44.847 -0.194 26022 1932 1 5 . 1 1 10 10 LEU H H 10 7.786 7.786 8.411 -0.625 26022 1933 1 5 . 1 1 11 11 PHE N N 11 120.942 120.942 123.497 -2.555 26022 1934 1 5 . 1 1 11 11 PHE HA H 11 4.862 4.862 4.757 0.105 26022 1935 1 5 . 1 1 11 11 PHE C C 11 173.578 173.578 174.358 -0.780 26022 1936 1 5 . 1 1 11 11 PHE CA C 11 56.120 56.120 57.017 -0.897 26022 1937 1 5 . 1 1 11 11 PHE CB C 11 41.212 41.212 41.754 -0.542 26022 1938 1 5 . 1 1 11 11 PHE H H 11 8.889 8.889 9.255 -0.366 26022 1939 1 5 . 1 1 12 12 GLU N N 12 119.958 119.958 127.304 -7.346 26022 1940 1 5 . 1 1 12 12 GLU HA H 12 5.539 5.539 5.058 0.481 26022 1941 1 5 . 1 1 12 12 GLU C C 12 176.295 176.295 175.069 1.226 26022 1942 1 5 . 1 1 12 12 GLU CA C 12 54.501 54.501 55.088 -0.587 26022 1943 1 5 . 1 1 12 12 GLU CB C 12 31.768 31.768 31.022 0.746 26022 1944 1 5 . 1 1 12 12 GLU H H 12 8.285 8.285 8.231 0.054 26022 1945 1 5 . 1 1 13 13 VAL N N 13 120.742 120.742 124.700 -3.958 26022 1946 1 5 . 1 1 13 13 VAL HA H 13 4.570 4.570 4.461 0.109 26022 1947 1 5 . 1 1 13 13 VAL C C 13 173.415 173.415 174.125 -0.710 26022 1948 1 5 . 1 1 13 13 VAL CA C 13 59.696 59.696 59.816 -0.120 26022 1949 1 5 . 1 1 13 13 VAL CB C 13 36.018 36.018 35.935 0.083 26022 1950 1 5 . 1 1 14 14 GLU N N 14 122.848 122.848 122.720 0.128 26022 1951 1 5 . 1 1 14 14 GLU HA H 14 5.226 5.226 5.206 0.020 26022 1952 1 5 . 1 1 14 14 GLU C C 14 176.295 176.295 175.753 0.542 26022 1953 1 5 . 1 1 14 14 GLU CA C 14 55.243 55.243 55.656 -0.413 26022 1954 1 5 . 1 1 14 14 GLU CB C 14 32.173 32.173 31.427 0.746 26022 1955 1 5 . 1 1 14 14 GLU H H 14 8.492 8.492 8.571 -0.079 26022 1956 1 5 . 1 1 15 15 GLY N N 15 105.005 105.005 108.460 -3.455 26022 1957 1 5 . 1 1 15 15 GLY C C 15 170.393 170.393 172.043 -1.650 26022 1958 1 5 . 1 1 15 15 GLY CA C 15 46.002 46.002 44.787 1.215 26022 1959 1 5 . 1 1 15 15 GLY H H 15 8.454 8.454 8.878 -0.424 26022 1960 1 5 . 1 1 16 16 ALA N N 16 120.909 120.909 120.914 -0.005 26022 1961 1 5 . 1 1 16 16 ALA HA H 16 5.526 5.526 4.989 0.537 26022 1962 1 5 . 1 1 16 16 ALA C C 16 176.834 176.834 175.309 1.525 26022 1963 1 5 . 1 1 16 16 ALA CA C 16 49.644 49.644 50.394 -0.750 26022 1964 1 5 . 1 1 16 16 ALA CB C 16 22.054 22.054 22.663 -0.609 26022 1965 1 5 . 1 1 16 16 ALA H H 16 8.206 8.206 8.627 -0.421 26022 1966 1 5 . 1 1 17 17 VAL N N 17 122.567 122.567 123.589 -1.022 26022 1967 1 5 . 1 1 17 17 VAL HA H 17 4.380 4.380 4.060 0.320 26022 1968 1 5 . 1 1 17 17 VAL C C 17 178.099 178.099 175.728 2.371 26022 1969 1 5 . 1 1 17 17 VAL CA C 17 63.608 63.608 62.424 1.184 26022 1970 1 5 . 1 1 17 17 VAL CB C 17 32.105 32.105 33.489 -1.384 26022 1971 1 5 . 1 1 18 18 THR N N 18 120.937 120.937 125.462 -4.525 26022 1972 1 5 . 1 1 18 18 THR HA H 18 4.601 4.601 4.491 0.110 26022 1973 1 5 . 1 1 18 18 THR C C 18 175.312 175.312 173.804 1.508 26022 1974 1 5 . 1 1 18 18 THR CA C 18 61.517 61.517 64.432 -2.915 26022 1975 1 5 . 1 1 18 18 THR CB C 18 69.814 69.814 69.746 0.068 26022 1976 1 5 . 1 1 19 19 ALA N N 19 121.258 121.258 121.736 -0.478 26022 1977 1 5 . 1 1 19 19 ALA HA H 19 4.458 4.458 4.648 -0.190 26022 1978 1 5 . 1 1 19 19 ALA C C 19 174.703 174.703 174.637 0.066 26022 1979 1 5 . 1 1 19 19 ALA CA C 19 53.017 53.017 51.941 1.076 26022 1980 1 5 . 1 1 19 19 ALA CB C 19 22.054 22.054 20.676 1.378 26022 1981 1 5 . 1 1 19 19 ALA H H 19 7.716 7.716 7.661 0.055 26022 1982 1 5 . 1 1 20 20 LEU N N 20 123.420 123.420 117.587 5.833 26022 1983 1 5 . 1 1 20 20 LEU HA H 20 4.393 4.393 5.379 -0.986 26022 1984 1 5 . 1 1 20 20 LEU C C 20 175.499 175.499 174.893 0.606 26022 1985 1 5 . 1 1 20 20 LEU CA C 20 54.839 54.839 53.036 1.803 26022 1986 1 5 . 1 1 20 20 LEU CB C 20 41.212 41.212 45.388 -4.176 26022 1987 1 5 . 1 1 20 20 LEU H H 20 8.711 8.711 8.242 0.470 26022 1988 1 5 . 1 1 21 21 LEU N N 21 124.718 124.718 121.774 2.944 26022 1989 1 5 . 1 1 21 21 LEU HA H 21 4.714 4.714 4.894 -0.180 26022 1990 1 5 . 1 1 21 21 LEU C C 21 174.328 174.328 176.066 -1.738 26022 1991 1 5 . 1 1 21 21 LEU CA C 21 52.680 52.680 51.860 0.820 26022 1992 1 5 . 1 1 21 21 LEU CB C 21 41.684 41.684 42.897 -1.213 26022 1993 1 5 . 1 1 21 21 LEU H H 21 7.773 7.773 8.777 -1.004 26022 1994 1 5 . 1 1 22 22 PRO HA H 22 4.380 4.380 4.200 0.180 26022 1995 1 5 . 1 1 22 22 PRO C C 22 175.616 175.616 176.438 -0.822 26022 1996 1 5 . 1 1 22 22 PRO CA C 22 62.529 62.529 64.738 -2.209 26022 1997 1 5 . 1 1 22 22 PRO CB C 22 32.240 32.240 31.383 0.857 26022 1998 1 5 . 1 1 23 23 ALA N N 23 120.693 120.693 119.650 1.043 26022 1999 1 5 . 1 1 23 23 ALA HA H 23 4.302 4.302 4.317 -0.016 26022 2000 1 5 . 1 1 23 23 ALA C C 23 176.178 176.178 176.795 -0.617 26022 2001 1 5 . 1 1 23 23 ALA CA C 23 52.882 52.882 51.264 1.618 26022 2002 1 5 . 1 1 23 23 ALA CB C 23 17.336 17.336 18.476 -1.140 26022 2003 1 5 . 1 1 23 23 ALA H H 23 8.675 8.675 7.594 1.081 26022 2004 1 5 . 1 1 24 24 ALA N N 24 115.540 115.540 118.432 -2.892 26022 2005 1 5 . 1 1 24 24 ALA HA H 24 3.820 3.820 3.664 0.156 26022 2006 1 5 . 1 1 24 24 ALA C C 24 175.546 175.546 175.705 -0.159 26022 2007 1 5 . 1 1 24 24 ALA CA C 24 52.613 52.613 52.718 -0.105 26022 2008 1 5 . 1 1 24 24 ALA CB C 24 16.590 16.590 17.191 -0.601 26022 2009 1 5 . 1 1 24 24 ALA H H 24 8.381 8.381 7.672 0.709 26022 2010 1 5 . 1 1 25 25 GLU N N 25 114.082 114.082 117.834 -3.752 26022 2011 1 5 . 1 1 25 25 GLU HA H 25 5.148 5.148 4.693 0.455 26022 2012 1 5 . 1 1 25 25 GLU C C 25 175.757 175.757 174.933 0.824 26022 2013 1 5 . 1 1 25 25 GLU CA C 25 54.911 54.911 55.262 -0.351 26022 2014 1 5 . 1 1 25 25 GLU CB C 25 32.645 32.645 31.108 1.537 26022 2015 1 5 . 1 1 25 25 GLU H H 25 6.378 6.378 7.339 -0.961 26022 2016 1 5 . 1 1 26 26 PHE N N 26 117.365 117.365 123.519 -6.154 26022 2017 1 5 . 1 1 26 26 PHE HA H 26 4.979 4.979 5.229 -0.250 26022 2018 1 5 . 1 1 26 26 PHE C C 26 174.960 174.960 175.276 -0.316 26022 2019 1 5 . 1 1 26 26 PHE CA C 26 56.862 56.862 56.757 0.105 26022 2020 1 5 . 1 1 26 26 PHE CB C 26 43.371 43.371 43.439 -0.068 26022 2021 1 5 . 1 1 26 26 PHE H H 26 8.950 8.950 9.525 -0.575 26022 2022 1 5 . 1 1 27 27 ARG N N 27 125.082 125.082 120.256 4.826 26022 2023 1 5 . 1 1 27 27 ARG HA H 27 4.992 4.992 5.164 -0.172 26022 2024 1 5 . 1 1 27 27 ARG C C 27 175.148 175.148 174.598 0.550 26022 2025 1 5 . 1 1 27 27 ARG CA C 27 56.323 56.323 55.426 0.897 26022 2026 1 5 . 1 1 27 27 ARG CB C 27 32.240 32.240 33.301 -1.062 26022 2027 1 5 . 1 1 27 27 ARG H H 27 8.799 8.799 9.160 -0.361 26022 2028 1 5 . 1 1 28 28 VAL N N 28 127.456 127.456 119.474 7.982 26022 2029 1 5 . 1 1 28 28 VAL HA H 28 4.757 4.757 5.110 -0.353 26022 2030 1 5 . 1 1 28 28 VAL C C 28 173.602 173.602 173.753 -0.151 26022 2031 1 5 . 1 1 28 28 VAL CA C 28 60.303 60.303 59.416 0.887 26022 2032 1 5 . 1 1 28 28 VAL CB C 28 35.681 35.681 36.169 -0.488 26022 2033 1 5 . 1 1 29 29 LYS N N 29 128.096 128.096 120.970 7.126 26022 2034 1 5 . 1 1 29 29 LYS HA H 29 4.354 4.354 4.866 -0.512 26022 2035 1 5 . 1 1 29 29 LYS C C 29 176.740 176.740 175.010 1.730 26022 2036 1 5 . 1 1 29 29 LYS CA C 29 55.041 55.041 53.699 1.342 26022 2037 1 5 . 1 1 29 29 LYS CB C 29 34.062 34.062 34.533 -0.471 26022 2038 1 5 . 1 1 29 29 LYS H H 29 9.268 9.268 8.869 0.399 26022 2039 1 5 . 1 1 30 30 LEU N N 30 129.600 129.600 124.298 5.302 26022 2040 1 5 . 1 1 30 30 LEU HA H 30 4.653 4.653 4.296 0.357 26022 2041 1 5 . 1 1 30 30 LEU C C 30 178.193 178.193 177.310 0.883 26022 2042 1 5 . 1 1 30 30 LEU CA C 30 54.771 54.771 55.437 -0.666 26022 2043 1 5 . 1 1 30 30 LEU CB C 30 42.224 42.224 43.421 -1.197 26022 2044 1 5 . 1 1 30 30 LEU H H 30 9.000 9.000 8.862 0.138 26022 2045 1 5 . 1 1 31 31 ASP N N 31 120.478 120.478 124.351 -3.873 26022 2046 1 5 . 1 1 31 31 ASP HA H 31 4.458 4.458 4.441 0.017 26022 2047 1 5 . 1 1 31 31 ASP C C 31 176.155 176.155 176.039 0.116 26022 2048 1 5 . 1 1 31 31 ASP CA C 31 55.918 55.918 56.269 -0.351 26022 2049 1 5 . 1 1 31 31 ASP CB C 31 39.593 39.593 40.959 -1.366 26022 2050 1 5 . 1 1 31 31 ASP H H 31 8.698 8.698 9.102 -0.404 26022 2051 1 5 . 1 1 32 32 ASN N N 32 115.450 115.450 117.055 -1.605 26022 2052 1 5 . 1 1 32 32 ASN HA H 32 4.588 4.588 4.769 -0.181 26022 2053 1 5 . 1 1 32 32 ASN C C 32 175.335 175.335 174.341 0.994 26022 2054 1 5 . 1 1 32 32 ASN CA C 32 53.152 53.152 53.153 -0.001 26022 2055 1 5 . 1 1 32 32 ASN CB C 32 37.367 37.367 37.417 -0.050 26022 2056 1 5 . 1 1 32 32 ASN H H 32 7.680 7.680 8.143 -0.463 26022 2057 1 5 . 1 1 33 33 GLU N N 33 111.790 111.790 114.316 -2.526 26022 2058 1 5 . 1 1 33 33 GLU HA H 33 3.898 3.898 3.936 -0.038 26022 2059 1 5 . 1 1 33 33 GLU C C 33 175.733 175.733 174.564 1.169 26022 2060 1 5 . 1 1 33 33 GLU CA C 33 58.144 58.144 57.959 0.185 26022 2061 1 5 . 1 1 33 33 GLU CB C 33 28.242 28.242 27.425 0.817 26022 2062 1 5 . 1 1 33 33 GLU H H 33 8.097 8.097 7.935 0.162 26022 2063 1 5 . 1 1 34 34 HIS N N 34 119.193 119.193 118.786 0.407 26022 2064 1 5 . 1 1 34 34 HIS HA H 34 4.201 4.201 4.843 -0.642 26022 2065 1 5 . 1 1 34 34 HIS C C 34 173.789 173.789 173.699 0.090 26022 2066 1 5 . 1 1 34 34 HIS CA C 34 56.053 56.053 54.703 1.350 26022 2067 1 5 . 1 1 34 34 HIS CB C 34 30.487 30.487 31.763 -1.276 26022 2068 1 5 . 1 1 34 34 HIS H H 34 7.890 7.890 7.593 0.297 26022 2069 1 5 . 1 1 35 35 GLU HA H 35 5.400 5.400 4.637 0.763 26022 2070 1 5 . 1 1 35 35 GLU C C 35 175.944 175.944 175.644 0.300 26022 2071 1 5 . 1 1 35 35 GLU CA C 35 55.109 55.109 55.855 -0.746 26022 2072 1 5 . 1 1 35 35 GLU CB C 35 32.308 32.308 31.004 1.304 26022 2073 1 5 . 1 1 36 36 ILE N N 36 119.077 119.077 116.851 2.226 26022 2074 1 5 . 1 1 36 36 ILE HA H 36 4.686 4.686 4.506 0.180 26022 2075 1 5 . 1 1 36 36 ILE C C 36 173.790 173.790 174.301 -0.511 26022 2076 1 5 . 1 1 36 36 ILE CA C 36 59.156 59.156 59.626 -0.470 26022 2077 1 5 . 1 1 36 36 ILE CB C 36 42.696 42.696 41.333 1.363 26022 2078 1 5 . 1 1 37 37 ILE N N 37 122.787 122.787 122.382 0.405 26022 2079 1 5 . 1 1 37 37 ILE HA H 37 4.778 4.778 4.623 0.155 26022 2080 1 5 . 1 1 37 37 ILE C C 37 177.057 177.057 175.863 1.194 26022 2081 1 5 . 1 1 37 37 ILE CA C 37 59.723 59.723 61.144 -1.421 26022 2082 1 5 . 1 1 37 37 ILE CB C 37 37.949 37.949 38.282 -0.333 26022 2083 1 5 . 1 1 38 38 CYS N N 38 122.357 122.357 124.467 -2.110 26022 2084 1 5 . 1 1 38 38 CYS HA H 38 5.708 5.708 5.346 0.362 26022 2085 1 5 . 1 1 38 38 CYS C C 38 174.258 174.258 173.238 1.020 26022 2086 1 5 . 1 1 38 38 CYS CA C 38 56.930 56.930 56.912 0.018 26022 2087 1 5 . 1 1 38 38 CYS CB C 38 33.252 33.252 31.579 1.673 26022 2088 1 5 . 1 1 38 38 CYS H H 38 9.512 9.512 9.304 0.208 26022 2089 1 5 . 1 1 39 39 HIS N N 39 117.101 117.101 115.390 1.711 26022 2090 1 5 . 1 1 39 39 HIS HA H 39 5.526 5.526 5.399 0.127 26022 2091 1 5 . 1 1 39 39 HIS C C 39 174.516 174.516 173.852 0.664 26022 2092 1 5 . 1 1 39 39 HIS CA C 39 54.097 54.097 54.934 -0.837 26022 2093 1 5 . 1 1 39 39 HIS CB C 39 31.701 31.701 31.808 -0.107 26022 2094 1 5 . 1 1 39 39 HIS H H 39 7.597 7.597 9.180 -1.583 26022 2095 1 5 . 1 1 40 40 VAL N N 40 117.923 117.923 115.955 1.968 26022 2096 1 5 . 1 1 40 40 VAL HA H 40 4.614 4.614 4.370 0.244 26022 2097 1 5 . 1 1 40 40 VAL C C 40 175.804 175.804 175.564 0.240 26022 2098 1 5 . 1 1 40 40 VAL CA C 40 61.382 61.382 62.396 -1.014 26022 2099 1 5 . 1 1 40 40 VAL CB C 40 33.396 33.396 32.386 1.010 26022 2100 1 5 . 1 1 41 41 SER N N 41 119.242 119.242 120.320 -1.078 26022 2101 1 5 . 1 1 41 41 SER HA H 41 4.550 4.550 4.932 -0.382 26022 2102 1 5 . 1 1 41 41 SER C C 41 174.656 174.656 176.157 -1.501 26022 2103 1 5 . 1 1 41 41 SER CA C 41 58.126 58.126 56.161 1.964 26022 2104 1 5 . 1 1 41 41 SER CB C 41 63.470 63.470 65.038 -1.568 26022 2105 1 5 . 1 1 41 41 SER H H 41 8.341 8.341 8.319 0.022 26022 2106 1 5 . 1 1 42 42 GLY N N 42 110.569 110.569 109.302 1.267 26022 2107 1 5 . 1 1 42 42 GLY C C 42 173.829 173.829 175.890 -2.061 26022 2108 1 5 . 1 1 42 42 GLY CA C 42 45.257 45.257 47.271 -2.014 26022 2109 1 5 . 1 1 42 42 GLY H H 42 8.380 8.380 8.734 -0.354 26022 2110 1 5 . 1 1 43 43 LYS HA H 43 3.977 3.977 4.037 -0.060 26022 2111 1 5 . 1 1 43 43 LYS C C 43 179.363 179.363 178.711 0.652 26022 2112 1 5 . 1 1 43 43 LYS CA C 43 59.628 59.628 59.192 0.436 26022 2113 1 5 . 1 1 43 43 LYS CB C 43 32.510 32.510 32.162 0.348 26022 2114 1 5 . 1 1 44 44 VAL N N 44 120.404 120.404 118.656 1.748 26022 2115 1 5 . 1 1 44 44 VAL HA H 44 3.661 3.661 3.671 -0.010 26022 2116 1 5 . 1 1 44 44 VAL C C 44 179.785 179.785 178.465 1.320 26022 2117 1 5 . 1 1 44 44 VAL CA C 44 65.425 65.425 65.776 -0.351 26022 2118 1 5 . 1 1 44 44 VAL CB C 44 31.500 31.500 30.865 0.635 26022 2119 1 5 . 1 1 45 45 ARG N N 45 123.687 123.687 119.345 4.342 26022 2120 1 5 . 1 1 45 45 ARG HA H 45 4.054 4.054 4.071 -0.017 26022 2121 1 5 . 1 1 45 45 ARG C C 45 179.504 179.504 178.586 0.918 26022 2122 1 5 . 1 1 45 45 ARG CA C 45 59.669 59.669 58.880 0.789 26022 2123 1 5 . 1 1 45 45 ARG CB C 45 30.417 30.417 30.355 0.062 26022 2124 1 5 . 1 1 45 45 ARG H H 45 8.608 8.608 7.974 0.634 26022 2125 1 5 . 1 1 46 46 ARG N N 46 118.506 118.506 115.860 2.646 26022 2126 1 5 . 1 1 46 46 ARG HA H 46 4.148 4.148 4.345 -0.197 26022 2127 1 5 . 1 1 46 46 ARG C C 46 177.396 177.396 177.397 -0.001 26022 2128 1 5 . 1 1 46 46 ARG CA C 46 58.481 58.481 57.590 0.891 26022 2129 1 5 . 1 1 46 46 ARG CB C 46 30.554 30.554 29.583 0.971 26022 2130 1 5 . 1 1 46 46 ARG H H 46 8.474 8.474 7.621 0.853 26022 2131 1 5 . 1 1 47 47 SER N N 47 114.263 114.263 114.761 -0.498 26022 2132 1 5 . 1 1 47 47 SER HA H 47 4.393 4.393 4.522 -0.129 26022 2133 1 5 . 1 1 47 47 SER C C 47 174.070 174.070 174.095 -0.025 26022 2134 1 5 . 1 1 47 47 SER CA C 47 59.696 59.696 58.522 1.174 26022 2135 1 5 . 1 1 47 47 SER CB C 47 64.013 64.013 64.079 -0.066 26022 2136 1 5 . 1 1 47 47 SER H H 47 7.645 7.645 7.825 -0.180 26022 2137 1 5 . 1 1 48 48 LYS N N 48 115.405 115.405 120.133 -4.728 26022 2138 1 5 . 1 1 48 48 LYS HA H 48 3.990 3.990 3.947 0.043 26022 2139 1 5 . 1 1 48 48 LYS C C 48 175.804 175.804 175.266 0.538 26022 2140 1 5 . 1 1 48 48 LYS CA C 48 57.537 57.537 57.014 0.523 26022 2141 1 5 . 1 1 48 48 LYS CB C 48 29.947 29.947 30.009 -0.062 26022 2142 1 5 . 1 1 48 48 LYS H H 48 7.821 7.821 7.442 0.379 26022 2143 1 5 . 1 1 49 49 ILE N N 49 117.265 117.265 120.911 -3.646 26022 2144 1 5 . 1 1 49 49 ILE HA H 49 4.041 4.041 4.284 -0.243 26022 2145 1 5 . 1 1 49 49 ILE C C 49 175.125 175.125 176.037 -0.912 26022 2146 1 5 . 1 1 49 49 ILE CA C 49 61.315 61.315 58.716 2.599 26022 2147 1 5 . 1 1 49 49 ILE CB C 49 38.919 38.919 37.524 1.395 26022 2148 1 5 . 1 1 50 50 ARG N N 50 126.687 126.687 128.644 -1.957 26022 2149 1 5 . 1 1 50 50 ARG HA H 50 4.471 4.471 4.403 0.068 26022 2150 1 5 . 1 1 50 50 ARG C C 50 175.007 175.007 175.604 -0.597 26022 2151 1 5 . 1 1 50 50 ARG CA C 50 55.176 55.176 55.920 -0.744 26022 2152 1 5 . 1 1 50 50 ARG CB C 50 31.026 31.026 30.071 0.955 26022 2153 1 5 . 1 1 50 50 ARG H H 50 8.437 8.437 8.534 -0.097 26022 2154 1 5 . 1 1 51 51 ILE N N 51 127.722 127.722 126.530 1.192 26022 2155 1 5 . 1 1 51 51 ILE HA H 51 4.276 4.276 4.064 0.212 26022 2156 1 5 . 1 1 51 51 ILE C C 51 174.726 174.726 175.824 -1.098 26022 2157 1 5 . 1 1 51 51 ILE CA C 51 60.235 60.235 61.214 -0.979 26022 2158 1 5 . 1 1 51 51 ILE CB C 51 37.772 37.772 38.272 -0.499 26022 2159 1 5 . 1 1 52 52 ILE N N 52 121.888 121.888 122.842 -0.954 26022 2160 1 5 . 1 1 52 52 ILE HA H 52 4.781 4.781 4.514 0.267 26022 2161 1 5 . 1 1 52 52 ILE C C 52 175.733 175.733 174.714 1.019 26022 2162 1 5 . 1 1 52 52 ILE CA C 52 59.021 59.021 59.223 -0.202 26022 2163 1 5 . 1 1 52 52 ILE CB C 52 42.089 42.089 40.724 1.365 26022 2164 1 5 . 1 1 53 53 ILE N N 53 119.363 119.363 122.407 -3.044 26022 2165 1 5 . 1 1 53 53 ILE HA H 53 3.338 3.338 3.995 -0.657 26022 2166 1 5 . 1 1 53 53 ILE C C 53 177.021 177.021 176.954 0.067 26022 2167 1 5 . 1 1 53 53 ILE CA C 53 64.274 64.274 62.058 2.216 26022 2168 1 5 . 1 1 53 53 ILE CB C 53 37.256 37.256 38.128 -0.872 26022 2169 1 5 . 1 1 54 54 GLY N N 54 116.136 116.136 116.071 0.065 26022 2170 1 5 . 1 1 54 54 GLY C C 54 174.844 174.844 173.472 1.372 26022 2171 1 5 . 1 1 54 54 GLY CA C 54 45.188 45.188 44.983 0.205 26022 2172 1 5 . 1 1 54 54 GLY H H 54 8.853 8.853 9.146 -0.293 26022 2173 1 5 . 1 1 55 55 ASP N N 55 121.946 121.946 117.956 3.990 26022 2174 1 5 . 1 1 55 55 ASP HA H 55 4.588 4.588 4.822 -0.234 26022 2175 1 5 . 1 1 55 55 ASP C C 55 175.804 175.804 174.787 1.017 26022 2176 1 5 . 1 1 55 55 ASP CA C 55 55.200 55.200 52.122 3.078 26022 2177 1 5 . 1 1 55 55 ASP CB C 55 41.048 41.048 43.217 -2.169 26022 2178 1 5 . 1 1 55 55 ASP H H 55 8.054 8.054 7.965 0.089 26022 2179 1 5 . 1 1 56 56 ARG N N 56 120.974 120.974 119.865 1.109 26022 2180 1 5 . 1 1 56 56 ARG HA H 56 5.200 5.200 4.742 0.458 26022 2181 1 5 . 1 1 56 56 ARG C C 56 176.483 176.483 176.104 0.379 26022 2182 1 5 . 1 1 56 56 ARG CA C 56 54.097 54.097 55.627 -1.530 26022 2183 1 5 . 1 1 56 56 ARG CB C 56 30.689 30.689 30.550 0.139 26022 2184 1 5 . 1 1 56 56 ARG H H 56 8.766 8.766 8.426 0.340 26022 2185 1 5 . 1 1 57 57 VAL N N 57 114.943 114.943 114.012 0.931 26022 2186 1 5 . 1 1 57 57 VAL HA H 57 4.965 4.965 4.501 0.464 26022 2187 1 5 . 1 1 57 57 VAL C C 57 172.243 172.243 173.086 -0.843 26022 2188 1 5 . 1 1 57 57 VAL CA C 57 58.077 58.077 60.035 -1.958 26022 2189 1 5 . 1 1 57 57 VAL CB C 57 36.288 36.288 35.319 0.969 26022 2190 1 5 . 1 1 58 58 LEU N N 58 122.410 122.410 124.988 -2.578 26022 2191 1 5 . 1 1 58 58 LEU HA H 58 4.731 4.731 5.037 -0.306 26022 2192 1 5 . 1 1 58 58 LEU C C 58 174.773 174.773 174.722 0.051 26022 2193 1 5 . 1 1 58 58 LEU CA C 58 53.085 53.085 53.524 -0.439 26022 2194 1 5 . 1 1 58 58 LEU CB C 58 45.788 45.788 44.299 1.489 26022 2195 1 5 . 1 1 58 58 LEU H H 58 8.382 8.382 7.973 0.409 26022 2196 1 5 . 1 1 59 59 VAL N N 59 127.937 127.937 126.959 0.978 26022 2197 1 5 . 1 1 59 59 VAL HA H 59 4.744 4.744 4.894 -0.150 26022 2198 1 5 . 1 1 59 59 VAL C C 59 174.141 174.141 173.349 0.792 26022 2199 1 5 . 1 1 59 59 VAL CA C 59 60.279 60.279 59.660 0.619 26022 2200 1 5 . 1 1 59 59 VAL CB C 59 34.399 34.399 35.453 -1.054 26022 2201 1 5 . 1 1 60 60 GLU N N 60 124.832 124.832 130.627 -5.795 26022 2202 1 5 . 1 1 60 60 GLU HA H 60 5.304 5.304 5.190 0.114 26022 2203 1 5 . 1 1 60 60 GLU C C 60 176.155 176.155 174.822 1.333 26022 2204 1 5 . 1 1 60 60 GLU CA C 60 54.164 54.164 54.653 -0.489 26022 2205 1 5 . 1 1 60 60 GLU CB C 60 33.803 33.803 31.573 2.230 26022 2206 1 5 . 1 1 60 60 GLU H H 60 9.142 9.142 8.912 0.230 26022 2207 1 5 . 1 1 61 61 MET N N 61 124.187 124.187 124.609 -0.422 26022 2208 1 5 . 1 1 61 61 MET HA H 61 4.899 4.899 5.078 -0.179 26022 2209 1 5 . 1 1 61 61 MET C C 61 173.953 173.953 173.773 0.180 26022 2210 1 5 . 1 1 61 61 MET CA C 61 54.232 54.232 53.479 0.753 26022 2211 1 5 . 1 1 61 61 MET CB C 61 37.256 37.256 37.027 0.229 26022 2212 1 5 . 1 1 61 61 MET H H 61 8.984 8.984 9.208 -0.224 26022 2213 1 5 . 1 1 62 62 SER N N 62 116.623 116.623 117.522 -0.899 26022 2214 1 5 . 1 1 62 62 SER HA H 62 4.263 4.263 4.727 -0.464 26022 2215 1 5 . 1 1 62 62 SER C C 62 176.413 176.413 174.993 1.420 26022 2216 1 5 . 1 1 62 62 SER CA C 62 56.893 56.893 58.309 -1.416 26022 2217 1 5 . 1 1 62 62 SER CB C 62 65.362 65.362 64.335 1.027 26022 2218 1 5 . 1 1 62 62 SER H H 62 9.167 9.167 8.687 0.480 26022 2219 1 5 . 1 1 63 63 ILE N N 63 121.187 121.187 121.724 -0.537 26022 2220 1 5 . 1 1 63 63 ILE HA H 63 3.989 3.989 3.927 0.062 26022 2221 1 5 . 1 1 63 63 ILE C C 63 176.623 176.623 176.514 0.109 26022 2222 1 5 . 1 1 63 63 ILE CA C 63 63.878 63.878 61.767 2.111 26022 2223 1 5 . 1 1 63 63 ILE CB C 63 38.244 38.244 36.967 1.277 26022 2224 1 5 . 1 1 64 64 TYR N N 64 120.214 120.214 119.649 0.565 26022 2225 1 5 . 1 1 64 64 TYR HA H 64 4.432 4.432 4.293 0.139 26022 2226 1 5 . 1 1 64 64 TYR C C 64 177.092 177.092 176.078 1.014 26022 2227 1 5 . 1 1 64 64 TYR CA C 64 59.156 59.156 59.742 -0.586 26022 2228 1 5 . 1 1 64 64 TYR CB C 64 38.109 38.109 38.740 -0.631 26022 2229 1 5 . 1 1 64 64 TYR H H 64 7.762 7.762 7.887 -0.125 26022 2230 1 5 . 1 1 65 65 ASP N N 65 121.338 121.338 114.959 6.379 26022 2231 1 5 . 1 1 65 65 ASP HA H 65 4.495 4.495 4.743 -0.248 26022 2232 1 5 . 1 1 65 65 ASP C C 65 177.349 177.349 178.157 -0.808 26022 2233 1 5 . 1 1 65 65 ASP CA C 65 55.243 55.243 55.008 0.235 26022 2234 1 5 . 1 1 65 65 ASP CB C 65 40.538 40.538 41.085 -0.547 26022 2235 1 5 . 1 1 65 65 ASP H H 65 7.798 7.798 8.163 -0.365 26022 2236 1 5 . 1 1 66 66 ARG N N 66 121.118 121.118 121.062 0.056 26022 2237 1 5 . 1 1 66 66 ARG HA H 66 4.069 4.069 4.157 -0.088 26022 2238 1 5 . 1 1 66 66 ARG C C 66 178.448 178.448 176.847 1.601 26022 2239 1 5 . 1 1 66 66 ARG CA C 66 58.401 58.401 58.723 -0.322 26022 2240 1 5 . 1 1 66 66 ARG CB C 66 30.184 30.184 29.539 0.645 26022 2241 1 5 . 1 1 66 66 ARG H H 66 8.382 8.382 8.695 -0.313 26022 2242 1 5 . 1 1 67 67 ASN N N 67 117.334 117.334 115.963 1.371 26022 2243 1 5 . 1 1 67 67 ASN HA H 67 4.601 4.601 5.171 -0.570 26022 2244 1 5 . 1 1 67 67 ASN C C 67 175.288 175.288 174.530 0.758 26022 2245 1 5 . 1 1 67 67 ASN CA C 67 54.097 54.097 52.922 1.175 26022 2246 1 5 . 1 1 67 67 ASN CB C 67 38.514 38.514 37.968 0.546 26022 2247 1 5 . 1 1 67 67 ASN H H 67 8.194 8.194 8.184 0.010 26022 2248 1 5 . 1 1 68 68 ALA N N 68 122.187 122.187 120.768 1.419 26022 2249 1 5 . 1 1 68 68 ALA HA H 68 4.575 4.575 4.295 0.280 26022 2250 1 5 . 1 1 68 68 ALA C C 68 176.272 176.272 178.713 -2.441 26022 2251 1 5 . 1 1 68 68 ALA CA C 68 52.478 52.478 54.031 -1.553 26022 2252 1 5 . 1 1 68 68 ALA CB C 68 19.086 19.086 19.613 -0.527 26022 2253 1 5 . 1 1 68 68 ALA H H 68 7.658 7.658 8.009 -0.351 26022 2254 1 5 . 1 1 69 69 LYS N N 69 116.931 116.931 116.476 0.455 26022 2255 1 5 . 1 1 69 69 LYS HA H 69 4.197 4.197 4.422 -0.225 26022 2256 1 5 . 1 1 69 69 LYS C C 69 176.085 176.085 175.679 0.406 26022 2257 1 5 . 1 1 69 69 LYS CA C 69 56.728 56.728 57.064 -0.336 26022 2258 1 5 . 1 1 69 69 LYS CB C 69 31.566 31.566 33.519 -1.953 26022 2259 1 5 . 1 1 69 69 LYS H H 69 8.255 8.255 8.132 0.123 26022 2260 1 5 . 1 1 70 70 LYS N N 70 119.854 119.854 119.148 0.706 26022 2261 1 5 . 1 1 70 70 LYS HA H 70 5.526 5.526 5.344 0.182 26022 2262 1 5 . 1 1 70 70 LYS C C 70 175.171 175.171 175.800 -0.629 26022 2263 1 5 . 1 1 70 70 LYS CA C 70 54.704 54.704 54.960 -0.256 26022 2264 1 5 . 1 1 70 70 LYS CB C 70 36.850 36.850 35.456 1.394 26022 2265 1 5 . 1 1 70 70 LYS H H 70 8.182 8.182 7.681 0.501 26022 2266 1 5 . 1 1 71 71 GLY N N 71 103.604 103.604 109.553 -5.949 26022 2267 1 5 . 1 1 71 71 GLY C C 71 171.541 171.541 172.447 -0.906 26022 2268 1 5 . 1 1 71 71 GLY CA C 71 45.462 45.462 43.140 2.322 26022 2269 1 5 . 1 1 71 71 GLY H H 71 7.780 7.780 8.072 -0.292 26022 2270 1 5 . 1 1 72 72 ARG N N 72 119.187 119.187 119.626 -0.439 26022 2271 1 5 . 1 1 72 72 ARG HA H 72 4.861 4.861 5.391 -0.530 26022 2272 1 5 . 1 1 72 72 ARG C C 72 175.570 175.570 175.201 0.369 26022 2273 1 5 . 1 1 72 72 ARG CA C 72 53.624 53.624 54.425 -0.801 26022 2274 1 5 . 1 1 72 72 ARG CB C 72 34.129 34.129 31.834 2.295 26022 2275 1 5 . 1 1 72 72 ARG H H 72 8.007 8.007 8.328 -0.321 26022 2276 1 5 . 1 1 73 73 ILE N N 73 125.721 125.721 124.701 1.020 26022 2277 1 5 . 1 1 73 73 ILE HA H 73 4.263 4.263 4.659 -0.396 26022 2278 1 5 . 1 1 73 73 ILE C C 73 175.312 175.312 173.804 1.508 26022 2279 1 5 . 1 1 73 73 ILE CA C 73 62.259 62.259 59.694 2.566 26022 2280 1 5 . 1 1 73 73 ILE CB C 73 39.423 39.423 40.693 -1.270 26022 2281 1 5 . 1 1 74 74 ILE N N 74 120.540 120.540 127.419 -6.879 26022 2282 1 5 . 1 1 74 74 ILE HA H 74 4.596 4.596 4.277 0.319 26022 2283 1 5 . 1 1 74 74 ILE C C 74 176.249 176.249 174.023 2.226 26022 2284 1 5 . 1 1 74 74 ILE CA C 74 60.910 60.910 60.531 0.379 26022 2285 1 5 . 1 1 74 74 ILE CB C 74 39.863 39.863 40.669 -0.806 26022 2286 1 5 . 1 1 75 75 ARG N N 75 118.582 118.582 116.062 2.520 26022 2287 1 5 . 1 1 75 75 ARG HA H 75 4.289 4.289 4.342 -0.053 26022 2288 1 5 . 1 1 75 75 ARG C C 75 173.883 173.883 174.604 -0.721 26022 2289 1 5 . 1 1 75 75 ARG CA C 75 56.390 56.390 55.318 1.072 26022 2290 1 5 . 1 1 75 75 ARG CB C 75 34.669 34.669 32.157 2.512 26022 2291 1 5 . 1 1 75 75 ARG H H 75 7.397 7.397 7.735 -0.338 26022 2292 1 5 . 1 1 76 76 ARG N N 76 125.606 125.606 120.751 4.855 26022 2293 1 5 . 1 1 76 76 ARG HA H 76 4.609 4.609 4.352 0.257 26022 2294 1 5 . 1 1 76 76 ARG C C 76 175.312 175.312 174.564 0.748 26022 2295 1 5 . 1 1 76 76 ARG CA C 76 55.810 55.810 56.831 -1.021 26022 2296 1 5 . 1 1 76 76 ARG CB C 76 31.094 31.094 30.753 0.341 26022 2297 1 5 . 1 1 76 76 ARG H H 76 9.094 9.094 8.320 0.774 26022 2298 1 5 . 1 1 77 77 LEU N N 77 128.575 128.575 122.149 6.426 26022 2299 1 5 . 1 1 77 77 LEU HA H 77 4.372 4.372 4.619 -0.247 26022 2300 1 5 . 1 1 77 77 LEU C C 77 176.225 176.225 176.045 0.180 26022 2301 1 5 . 1 1 77 77 LEU CA C 77 54.704 54.704 53.469 1.235 26022 2302 1 5 . 1 1 77 77 LEU CB C 77 42.292 42.292 45.167 -2.876 26022 2303 1 5 . 1 1 77 77 LEU H H 77 8.742 8.742 8.091 0.651 26022 2304 1 5 . 1 1 78 78 LYS N N 78 119.592 119.592 121.821 -2.229 26022 2305 1 5 . 1 1 78 78 LYS HA H 78 4.302 4.302 4.320 -0.018 26022 2306 1 5 . 1 1 78 78 LYS C C 78 176.296 176.296 177.241 -0.945 26022 2307 1 5 . 1 1 78 78 LYS CA C 78 56.390 56.390 56.077 0.313 26022 2308 1 5 . 1 1 78 78 LYS CB C 78 33.994 33.994 31.934 2.060 26022 2309 1 5 . 1 1 78 78 LYS H H 78 8.090 8.090 8.457 -0.367 26022 2310 1 5 . 1 1 79 79 GLY N N 79 110.854 110.854 114.815 -3.961 26022 2311 1 5 . 1 1 79 79 GLY C C 79 174.328 174.328 174.005 0.323 26022 2312 1 5 . 1 1 79 79 GLY CA C 79 44.990 44.990 44.708 0.282 26022 2313 1 5 . 1 1 79 79 GLY H H 79 8.520 8.520 8.680 -0.160 26022 2314 1 5 . 1 1 80 80 THR N N 80 114.187 114.187 117.517 -3.330 26022 2315 1 5 . 1 1 80 80 THR HA H 80 4.237 4.237 4.390 -0.153 26022 2316 1 5 . 1 1 80 80 THR C C 80 175.054 175.054 173.688 1.366 26022 2317 1 5 . 1 1 80 80 THR CA C 80 62.242 62.242 62.474 -0.232 26022 2318 1 5 . 1 1 80 80 THR CB C 80 69.826 69.826 68.258 1.568 26022 2319 1 5 . 1 1 81 81 SER N N 81 117.958 117.958 122.524 -4.566 26022 2320 1 5 . 1 1 81 81 SER HA H 81 4.449 4.449 4.769 -0.320 26022 2321 1 5 . 1 1 81 81 SER C C 81 174.703 174.703 174.154 0.549 26022 2322 1 5 . 1 1 81 81 SER CA C 81 58.481 58.481 56.600 1.881 26022 2323 1 5 . 1 1 81 81 SER CB C 81 63.338 63.338 65.557 -2.219 26022 2324 1 5 . 1 1 81 81 SER H H 81 8.474 8.474 7.910 0.564 26022 2325 1 5 . 1 1 82 82 ASP HA H 82 4.280 4.280 4.418 -0.138 26022 2326 1 5 . 1 1 82 82 ASP C C 82 177.115 177.115 176.660 0.455 26022 2327 1 5 . 1 1 82 82 ASP CA C 82 55.176 55.176 55.559 -0.383 26022 2328 1 5 . 1 1 82 82 ASP CB C 82 42.359 42.359 40.855 1.504 26022 2329 1 5 . 1 1 83 83 ARG N N 83 121.531 121.531 118.302 3.229 26022 2330 1 5 . 1 1 83 83 ARG HA H 83 4.346 4.346 4.161 0.185 26022 2331 1 5 . 1 1 83 83 ARG C C 83 176.342 176.342 176.756 -0.414 26022 2332 1 5 . 1 1 83 83 ARG CA C 83 56.053 56.053 57.863 -1.810 26022 2333 1 5 . 1 1 83 83 ARG CB C 83 30.891 30.891 30.354 0.537 26022 2334 1 5 . 1 1 83 83 ARG H H 83 8.259 8.259 7.723 0.536 26022 2335 1 5 . 1 1 84 84 THR N N 84 116.462 116.462 111.793 4.669 26022 2336 1 5 . 1 1 84 84 THR HA H 84 4.333 4.333 4.619 -0.286 26022 2337 1 5 . 1 1 84 84 THR C C 84 174.445 174.445 174.115 0.330 26022 2338 1 5 . 1 1 84 84 THR CA C 84 62.254 62.254 61.882 0.372 26022 2339 1 5 . 1 1 84 84 THR CB C 84 69.833 69.833 71.093 -1.260 26022 2340 1 5 . 1 1 85 85 ILE N N 85 123.762 123.762 117.720 6.042 26022 2341 1 5 . 1 1 85 85 ILE HA H 85 4.188 4.188 4.422 -0.234 26022 2342 1 5 . 1 1 85 85 ILE C C 85 176.155 176.155 175.599 0.556 26022 2343 1 5 . 1 1 85 85 ILE CA C 85 61.112 61.112 62.167 -1.055 26022 2344 1 5 . 1 1 85 85 ILE CB C 85 38.919 38.919 37.256 1.663 26022 2345 1 5 . 1 1 86 86 SER N N 86 120.214 120.214 116.154 4.060 26022 2346 1 5 . 1 1 86 86 SER HA H 86 4.451 4.451 4.651 -0.200 26022 2347 1 5 . 1 1 86 86 SER C C 86 174.586 174.586 173.555 1.031 26022 2348 1 5 . 1 1 86 86 SER CA C 86 58.212 58.212 58.350 -0.138 26022 2349 1 5 . 1 1 86 86 SER CB C 86 63.271 63.271 63.589 -0.318 26022 2350 1 5 . 1 1 86 86 SER H H 86 8.377 8.377 8.136 0.241 26022 2351 1 6 . 1 1 2 2 VAL N N 2 122.187 122.187 117.711 4.476 26022 2352 1 6 . 1 1 2 2 VAL HA H 2 4.091 4.091 3.984 0.107 26022 2353 1 6 . 1 1 2 2 VAL C C 2 175.921 175.921 176.876 -0.955 26022 2354 1 6 . 1 1 2 2 VAL CA C 2 62.057 62.057 64.430 -2.373 26022 2355 1 6 . 1 1 2 2 VAL CB C 2 32.848 32.848 31.628 1.220 26022 2356 1 6 . 1 1 3 3 LYS N N 3 125.437 125.437 122.118 3.319 26022 2357 1 6 . 1 1 3 3 LYS HA H 3 4.289 4.289 4.484 -0.195 26022 2358 1 6 . 1 1 3 3 LYS C C 3 176.155 176.155 175.484 0.671 26022 2359 1 6 . 1 1 3 3 LYS CA C 3 56.323 56.323 56.378 -0.055 26022 2360 1 6 . 1 1 3 3 LYS CB C 3 33.320 33.320 30.726 2.594 26022 2361 1 6 . 1 1 3 3 LYS H H 3 8.396 8.396 8.240 0.156 26022 2362 1 6 . 1 1 4 4 ASP N N 4 121.937 121.937 122.747 -0.810 26022 2363 1 6 . 1 1 4 4 ASP HA H 4 4.289 4.289 4.777 -0.488 26022 2364 1 6 . 1 1 4 4 ASP C C 4 176.319 176.319 177.178 -0.859 26022 2365 1 6 . 1 1 4 4 ASP CA C 4 54.029 54.029 55.521 -1.492 26022 2366 1 6 . 1 1 4 4 ASP CB C 4 41.280 41.280 42.669 -1.389 26022 2367 1 6 . 1 1 4 4 ASP H H 4 8.325 8.325 8.412 -0.087 26022 2368 1 6 . 1 1 5 5 GLU N N 5 122.369 122.369 121.112 1.257 26022 2369 1 6 . 1 1 5 5 GLU HA H 5 4.250 4.250 4.158 0.092 26022 2370 1 6 . 1 1 5 5 GLU C C 5 177.045 177.045 177.892 -0.847 26022 2371 1 6 . 1 1 5 5 GLU CA C 5 56.930 56.930 59.108 -2.178 26022 2372 1 6 . 1 1 5 5 GLU CB C 5 30.554 30.554 29.388 1.166 26022 2373 1 6 . 1 1 5 5 GLU H H 5 8.464 8.464 8.809 -0.345 26022 2374 1 6 . 1 1 6 6 LYS N N 6 121.437 121.437 116.784 4.653 26022 2375 1 6 . 1 1 6 6 LYS HA H 6 4.282 4.282 4.317 -0.035 26022 2376 1 6 . 1 1 6 6 LYS C C 6 177.185 177.185 176.383 0.802 26022 2377 1 6 . 1 1 6 6 LYS CA C 6 56.930 56.930 56.559 0.371 26022 2378 1 6 . 1 1 6 6 LYS CB C 6 32.713 32.713 31.464 1.249 26022 2379 1 6 . 1 1 6 6 LYS H H 6 8.390 8.390 8.459 -0.069 26022 2380 1 6 . 1 1 7 7 SER N N 7 115.822 115.822 114.579 1.243 26022 2381 1 6 . 1 1 7 7 SER HA H 7 4.396 4.396 4.670 -0.274 26022 2382 1 6 . 1 1 7 7 SER C C 7 174.609 174.609 174.791 -0.182 26022 2383 1 6 . 1 1 7 7 SER CA C 7 58.684 58.684 58.735 -0.051 26022 2384 1 6 . 1 1 7 7 SER CB C 7 63.608 63.608 63.246 0.362 26022 2385 1 6 . 1 1 7 7 SER H H 7 8.205 8.205 8.217 -0.012 26022 2386 1 6 . 1 1 8 8 LYS N N 8 122.643 122.643 121.276 1.367 26022 2387 1 6 . 1 1 8 8 LYS HA H 8 4.407 4.407 4.111 0.296 26022 2388 1 6 . 1 1 8 8 LYS C C 8 176.694 176.694 176.918 -0.224 26022 2389 1 6 . 1 1 8 8 LYS CA C 8 56.390 56.390 59.148 -2.758 26022 2390 1 6 . 1 1 8 8 LYS CB C 8 33.185 33.185 32.732 0.453 26022 2391 1 6 . 1 1 8 8 LYS H H 8 8.201 8.201 7.601 0.600 26022 2392 1 6 . 1 1 9 9 THR N N 9 113.900 113.900 116.567 -2.667 26022 2393 1 6 . 1 1 9 9 THR HA H 9 4.341 4.341 4.438 -0.097 26022 2394 1 6 . 1 1 9 9 THR C C 9 173.438 173.438 173.485 -0.047 26022 2395 1 6 . 1 1 9 9 THR CA C 9 62.529 62.529 62.585 -0.056 26022 2396 1 6 . 1 1 9 9 THR CB C 9 69.342 69.342 67.238 2.104 26022 2397 1 6 . 1 1 10 10 LEU N N 10 124.082 124.082 121.068 3.014 26022 2398 1 6 . 1 1 10 10 LEU HA H 10 4.858 4.858 4.813 0.045 26022 2399 1 6 . 1 1 10 10 LEU C C 10 175.804 175.804 174.700 1.104 26022 2400 1 6 . 1 1 10 10 LEU CA C 10 53.759 53.759 53.070 0.689 26022 2401 1 6 . 1 1 10 10 LEU CB C 10 44.653 44.653 45.051 -0.398 26022 2402 1 6 . 1 1 10 10 LEU H H 10 7.786 7.786 7.597 0.189 26022 2403 1 6 . 1 1 11 11 PHE N N 11 120.942 120.942 121.050 -0.108 26022 2404 1 6 . 1 1 11 11 PHE HA H 11 4.862 4.862 4.876 -0.014 26022 2405 1 6 . 1 1 11 11 PHE C C 11 173.578 173.578 174.223 -0.645 26022 2406 1 6 . 1 1 11 11 PHE CA C 11 56.120 56.120 56.713 -0.593 26022 2407 1 6 . 1 1 11 11 PHE CB C 11 41.212 41.212 42.026 -0.814 26022 2408 1 6 . 1 1 11 11 PHE H H 11 8.889 8.889 9.000 -0.111 26022 2409 1 6 . 1 1 12 12 GLU N N 12 119.958 119.958 127.668 -7.710 26022 2410 1 6 . 1 1 12 12 GLU HA H 12 5.539 5.539 4.954 0.585 26022 2411 1 6 . 1 1 12 12 GLU C C 12 176.295 176.295 174.747 1.548 26022 2412 1 6 . 1 1 12 12 GLU CA C 12 54.501 54.501 55.373 -0.873 26022 2413 1 6 . 1 1 12 12 GLU CB C 12 31.768 31.768 30.708 1.060 26022 2414 1 6 . 1 1 12 12 GLU H H 12 8.285 8.285 8.306 -0.021 26022 2415 1 6 . 1 1 13 13 VAL N N 13 120.742 120.742 124.947 -4.205 26022 2416 1 6 . 1 1 13 13 VAL HA H 13 4.570 4.570 4.288 0.282 26022 2417 1 6 . 1 1 13 13 VAL C C 13 173.415 173.415 174.102 -0.687 26022 2418 1 6 . 1 1 13 13 VAL CA C 13 59.696 59.696 59.443 0.253 26022 2419 1 6 . 1 1 13 13 VAL CB C 13 36.018 36.018 36.385 -0.367 26022 2420 1 6 . 1 1 14 14 GLU N N 14 122.848 122.848 123.591 -0.743 26022 2421 1 6 . 1 1 14 14 GLU HA H 14 5.226 5.226 5.338 -0.112 26022 2422 1 6 . 1 1 14 14 GLU C C 14 176.295 176.295 175.711 0.584 26022 2423 1 6 . 1 1 14 14 GLU CA C 14 55.243 55.243 55.431 -0.188 26022 2424 1 6 . 1 1 14 14 GLU CB C 14 32.173 32.173 30.746 1.427 26022 2425 1 6 . 1 1 14 14 GLU H H 14 8.492 8.492 8.514 -0.022 26022 2426 1 6 . 1 1 15 15 GLY N N 15 105.005 105.005 109.812 -4.807 26022 2427 1 6 . 1 1 15 15 GLY C C 15 170.393 170.393 172.378 -1.985 26022 2428 1 6 . 1 1 15 15 GLY CA C 15 46.002 46.002 43.698 2.304 26022 2429 1 6 . 1 1 15 15 GLY H H 15 8.454 8.454 8.753 -0.299 26022 2430 1 6 . 1 1 16 16 ALA N N 16 120.909 120.909 123.847 -2.938 26022 2431 1 6 . 1 1 16 16 ALA HA H 16 5.526 5.526 5.161 0.365 26022 2432 1 6 . 1 1 16 16 ALA C C 16 176.834 176.834 176.086 0.748 26022 2433 1 6 . 1 1 16 16 ALA CA C 16 49.644 49.644 49.922 -0.278 26022 2434 1 6 . 1 1 16 16 ALA CB C 16 22.054 22.054 21.334 0.720 26022 2435 1 6 . 1 1 16 16 ALA H H 16 8.206 8.206 8.631 -0.425 26022 2436 1 6 . 1 1 17 17 VAL N N 17 122.567 122.567 125.119 -2.552 26022 2437 1 6 . 1 1 17 17 VAL HA H 17 4.380 4.380 4.098 0.282 26022 2438 1 6 . 1 1 17 17 VAL C C 17 178.099 178.099 175.218 2.881 26022 2439 1 6 . 1 1 17 17 VAL CA C 17 63.608 63.608 62.615 0.993 26022 2440 1 6 . 1 1 17 17 VAL CB C 17 32.105 32.105 33.312 -1.207 26022 2441 1 6 . 1 1 18 18 THR N N 18 120.937 120.937 124.246 -3.309 26022 2442 1 6 . 1 1 18 18 THR HA H 18 4.601 4.601 4.603 -0.002 26022 2443 1 6 . 1 1 18 18 THR C C 18 175.312 175.312 173.805 1.507 26022 2444 1 6 . 1 1 18 18 THR CA C 18 61.517 61.517 60.872 0.645 26022 2445 1 6 . 1 1 18 18 THR CB C 18 69.814 69.814 69.663 0.151 26022 2446 1 6 . 1 1 19 19 ALA N N 19 121.258 121.258 123.636 -2.378 26022 2447 1 6 . 1 1 19 19 ALA HA H 19 4.458 4.458 4.679 -0.221 26022 2448 1 6 . 1 1 19 19 ALA C C 19 174.703 174.703 174.812 -0.109 26022 2449 1 6 . 1 1 19 19 ALA CA C 19 53.017 53.017 51.984 1.033 26022 2450 1 6 . 1 1 19 19 ALA CB C 19 22.054 22.054 21.063 0.991 26022 2451 1 6 . 1 1 19 19 ALA H H 19 7.716 7.716 7.704 0.012 26022 2452 1 6 . 1 1 20 20 LEU N N 20 123.420 123.420 117.365 6.055 26022 2453 1 6 . 1 1 20 20 LEU HA H 20 4.393 4.393 5.173 -0.780 26022 2454 1 6 . 1 1 20 20 LEU C C 20 175.499 175.499 174.808 0.691 26022 2455 1 6 . 1 1 20 20 LEU CA C 20 54.839 54.839 53.699 1.140 26022 2456 1 6 . 1 1 20 20 LEU CB C 20 41.212 41.212 45.204 -3.992 26022 2457 1 6 . 1 1 20 20 LEU H H 20 8.711 8.711 8.271 0.440 26022 2458 1 6 . 1 1 21 21 LEU N N 21 124.718 124.718 122.194 2.524 26022 2459 1 6 . 1 1 21 21 LEU HA H 21 4.714 4.714 4.948 -0.234 26022 2460 1 6 . 1 1 21 21 LEU C C 21 174.328 174.328 176.209 -1.881 26022 2461 1 6 . 1 1 21 21 LEU CA C 21 52.680 52.680 51.875 0.805 26022 2462 1 6 . 1 1 21 21 LEU CB C 21 41.684 41.684 43.002 -1.318 26022 2463 1 6 . 1 1 21 21 LEU H H 21 7.773 7.773 8.712 -0.939 26022 2464 1 6 . 1 1 22 22 PRO HA H 22 4.380 4.380 4.187 0.193 26022 2465 1 6 . 1 1 22 22 PRO C C 22 175.616 175.616 176.693 -1.077 26022 2466 1 6 . 1 1 22 22 PRO CA C 22 62.529 62.529 64.916 -2.387 26022 2467 1 6 . 1 1 22 22 PRO CB C 22 32.240 32.240 31.339 0.901 26022 2468 1 6 . 1 1 23 23 ALA N N 23 120.693 120.693 119.176 1.517 26022 2469 1 6 . 1 1 23 23 ALA HA H 23 4.302 4.302 4.299 0.003 26022 2470 1 6 . 1 1 23 23 ALA C C 23 176.178 176.178 177.071 -0.893 26022 2471 1 6 . 1 1 23 23 ALA CA C 23 52.882 52.882 51.357 1.525 26022 2472 1 6 . 1 1 23 23 ALA CB C 23 17.336 17.336 17.955 -0.619 26022 2473 1 6 . 1 1 23 23 ALA H H 23 8.675 8.675 7.849 0.826 26022 2474 1 6 . 1 1 24 24 ALA N N 24 115.540 115.540 118.119 -2.579 26022 2475 1 6 . 1 1 24 24 ALA HA H 24 3.820 3.820 3.766 0.054 26022 2476 1 6 . 1 1 24 24 ALA C C 24 175.546 175.546 175.734 -0.188 26022 2477 1 6 . 1 1 24 24 ALA CA C 24 52.613 52.613 52.952 -0.339 26022 2478 1 6 . 1 1 24 24 ALA CB C 24 16.590 16.590 17.269 -0.679 26022 2479 1 6 . 1 1 24 24 ALA H H 24 8.381 8.381 7.558 0.823 26022 2480 1 6 . 1 1 25 25 GLU N N 25 114.082 114.082 116.986 -2.904 26022 2481 1 6 . 1 1 25 25 GLU HA H 25 5.148 5.148 5.073 0.075 26022 2482 1 6 . 1 1 25 25 GLU C C 25 175.757 175.757 175.661 0.096 26022 2483 1 6 . 1 1 25 25 GLU CA C 25 54.911 54.911 54.374 0.537 26022 2484 1 6 . 1 1 25 25 GLU CB C 25 32.645 32.645 31.776 0.869 26022 2485 1 6 . 1 1 25 25 GLU H H 25 6.378 6.378 7.480 -1.102 26022 2486 1 6 . 1 1 26 26 PHE N N 26 117.365 117.365 122.315 -4.950 26022 2487 1 6 . 1 1 26 26 PHE HA H 26 4.979 4.979 4.702 0.277 26022 2488 1 6 . 1 1 26 26 PHE C C 26 174.960 174.960 175.215 -0.255 26022 2489 1 6 . 1 1 26 26 PHE CA C 26 56.862 56.862 57.865 -1.004 26022 2490 1 6 . 1 1 26 26 PHE CB C 26 43.371 43.371 41.294 2.077 26022 2491 1 6 . 1 1 26 26 PHE H H 26 8.950 8.950 9.400 -0.450 26022 2492 1 6 . 1 1 27 27 ARG N N 27 125.082 125.082 120.534 4.548 26022 2493 1 6 . 1 1 27 27 ARG HA H 27 4.992 4.992 5.149 -0.157 26022 2494 1 6 . 1 1 27 27 ARG C C 27 175.148 175.148 174.808 0.340 26022 2495 1 6 . 1 1 27 27 ARG CA C 27 56.323 56.323 55.262 1.061 26022 2496 1 6 . 1 1 27 27 ARG CB C 27 32.240 32.240 32.805 -0.565 26022 2497 1 6 . 1 1 27 27 ARG H H 27 8.799 8.799 9.127 -0.328 26022 2498 1 6 . 1 1 28 28 VAL N N 28 127.456 127.456 119.977 7.479 26022 2499 1 6 . 1 1 28 28 VAL HA H 28 4.757 4.757 5.187 -0.430 26022 2500 1 6 . 1 1 28 28 VAL C C 28 173.602 173.602 173.859 -0.257 26022 2501 1 6 . 1 1 28 28 VAL CA C 28 60.303 60.303 59.025 1.278 26022 2502 1 6 . 1 1 28 28 VAL CB C 28 35.681 35.681 35.369 0.312 26022 2503 1 6 . 1 1 29 29 LYS N N 29 128.096 128.096 123.250 4.846 26022 2504 1 6 . 1 1 29 29 LYS HA H 29 4.354 4.354 5.080 -0.726 26022 2505 1 6 . 1 1 29 29 LYS C C 29 176.740 176.740 174.716 2.024 26022 2506 1 6 . 1 1 29 29 LYS CA C 29 55.041 55.041 53.526 1.515 26022 2507 1 6 . 1 1 29 29 LYS CB C 29 34.062 34.062 36.301 -2.239 26022 2508 1 6 . 1 1 29 29 LYS H H 29 9.268 9.268 8.987 0.281 26022 2509 1 6 . 1 1 30 30 LEU N N 30 129.600 129.600 126.238 3.362 26022 2510 1 6 . 1 1 30 30 LEU HA H 30 4.653 4.653 4.533 0.120 26022 2511 1 6 . 1 1 30 30 LEU C C 30 178.193 178.193 176.916 1.277 26022 2512 1 6 . 1 1 30 30 LEU CA C 30 54.771 54.771 54.787 -0.016 26022 2513 1 6 . 1 1 30 30 LEU CB C 30 42.224 42.224 44.256 -2.032 26022 2514 1 6 . 1 1 30 30 LEU H H 30 9.000 9.000 9.079 -0.079 26022 2515 1 6 . 1 1 31 31 ASP N N 31 120.478 120.478 126.674 -6.196 26022 2516 1 6 . 1 1 31 31 ASP HA H 31 4.458 4.458 4.408 0.050 26022 2517 1 6 . 1 1 31 31 ASP C C 31 176.155 176.155 176.664 -0.509 26022 2518 1 6 . 1 1 31 31 ASP CA C 31 55.918 55.918 56.909 -0.991 26022 2519 1 6 . 1 1 31 31 ASP CB C 31 39.593 39.593 40.600 -1.007 26022 2520 1 6 . 1 1 31 31 ASP H H 31 8.698 8.698 8.829 -0.131 26022 2521 1 6 . 1 1 32 32 ASN N N 32 115.450 115.450 117.999 -2.549 26022 2522 1 6 . 1 1 32 32 ASN HA H 32 4.588 4.588 4.738 -0.150 26022 2523 1 6 . 1 1 32 32 ASN C C 32 175.335 175.335 175.132 0.203 26022 2524 1 6 . 1 1 32 32 ASN CA C 32 53.152 53.152 52.864 0.288 26022 2525 1 6 . 1 1 32 32 ASN CB C 32 37.367 37.367 37.567 -0.200 26022 2526 1 6 . 1 1 32 32 ASN H H 32 7.680 7.680 8.397 -0.717 26022 2527 1 6 . 1 1 33 33 GLU N N 33 111.790 111.790 115.505 -3.715 26022 2528 1 6 . 1 1 33 33 GLU HA H 33 3.898 3.898 3.883 0.015 26022 2529 1 6 . 1 1 33 33 GLU C C 33 175.733 175.733 175.247 0.486 26022 2530 1 6 . 1 1 33 33 GLU CA C 33 58.144 58.144 57.768 0.376 26022 2531 1 6 . 1 1 33 33 GLU CB C 33 28.242 28.242 26.829 1.413 26022 2532 1 6 . 1 1 33 33 GLU H H 33 8.097 8.097 8.118 -0.021 26022 2533 1 6 . 1 1 34 34 HIS N N 34 119.193 119.193 118.003 1.190 26022 2534 1 6 . 1 1 34 34 HIS HA H 34 4.201 4.201 4.851 -0.650 26022 2535 1 6 . 1 1 34 34 HIS C C 34 173.789 173.789 173.702 0.087 26022 2536 1 6 . 1 1 34 34 HIS CA C 34 56.053 56.053 55.228 0.825 26022 2537 1 6 . 1 1 34 34 HIS CB C 34 30.487 30.487 32.070 -1.583 26022 2538 1 6 . 1 1 34 34 HIS H H 34 7.890 7.890 8.027 -0.137 26022 2539 1 6 . 1 1 35 35 GLU HA H 35 5.400 5.400 4.904 0.496 26022 2540 1 6 . 1 1 35 35 GLU C C 35 175.944 175.944 175.614 0.330 26022 2541 1 6 . 1 1 35 35 GLU CA C 35 55.109 55.109 55.769 -0.660 26022 2542 1 6 . 1 1 35 35 GLU CB C 35 32.308 32.308 31.167 1.141 26022 2543 1 6 . 1 1 36 36 ILE N N 36 119.077 119.077 118.208 0.869 26022 2544 1 6 . 1 1 36 36 ILE HA H 36 4.686 4.686 4.641 0.045 26022 2545 1 6 . 1 1 36 36 ILE C C 36 173.790 173.790 174.091 -0.301 26022 2546 1 6 . 1 1 36 36 ILE CA C 36 59.156 59.156 59.816 -0.660 26022 2547 1 6 . 1 1 36 36 ILE CB C 36 42.696 42.696 41.361 1.335 26022 2548 1 6 . 1 1 37 37 ILE N N 37 122.787 122.787 122.680 0.107 26022 2549 1 6 . 1 1 37 37 ILE HA H 37 4.778 4.778 4.698 0.080 26022 2550 1 6 . 1 1 37 37 ILE C C 37 177.057 177.057 175.971 1.086 26022 2551 1 6 . 1 1 37 37 ILE CA C 37 59.723 59.723 60.882 -1.159 26022 2552 1 6 . 1 1 37 37 ILE CB C 37 37.949 37.949 39.219 -1.270 26022 2553 1 6 . 1 1 38 38 CYS N N 38 122.357 122.357 123.890 -1.533 26022 2554 1 6 . 1 1 38 38 CYS HA H 38 5.708 5.708 5.220 0.488 26022 2555 1 6 . 1 1 38 38 CYS C C 38 174.258 174.258 173.074 1.184 26022 2556 1 6 . 1 1 38 38 CYS CA C 38 56.930 56.930 57.297 -0.367 26022 2557 1 6 . 1 1 38 38 CYS CB C 38 33.252 33.252 31.060 2.192 26022 2558 1 6 . 1 1 38 38 CYS H H 38 9.512 9.512 9.398 0.114 26022 2559 1 6 . 1 1 39 39 HIS N N 39 117.101 117.101 121.927 -4.826 26022 2560 1 6 . 1 1 39 39 HIS HA H 39 5.526 5.526 5.060 0.466 26022 2561 1 6 . 1 1 39 39 HIS C C 39 174.516 174.516 174.443 0.073 26022 2562 1 6 . 1 1 39 39 HIS CA C 39 54.097 54.097 54.994 -0.897 26022 2563 1 6 . 1 1 39 39 HIS CB C 39 31.701 31.701 34.081 -2.380 26022 2564 1 6 . 1 1 39 39 HIS H H 39 7.597 7.597 9.101 -1.504 26022 2565 1 6 . 1 1 40 40 VAL N N 40 117.923 117.923 122.417 -4.494 26022 2566 1 6 . 1 1 40 40 VAL HA H 40 4.614 4.614 4.115 0.499 26022 2567 1 6 . 1 1 40 40 VAL C C 40 175.804 175.804 175.908 -0.104 26022 2568 1 6 . 1 1 40 40 VAL CA C 40 61.382 61.382 63.087 -1.705 26022 2569 1 6 . 1 1 40 40 VAL CB C 40 33.396 33.396 31.651 1.745 26022 2570 1 6 . 1 1 41 41 SER N N 41 119.242 119.242 121.731 -2.489 26022 2571 1 6 . 1 1 41 41 SER HA H 41 4.550 4.550 4.615 -0.065 26022 2572 1 6 . 1 1 41 41 SER C C 41 174.656 174.656 172.816 1.840 26022 2573 1 6 . 1 1 41 41 SER CA C 41 58.126 58.126 58.313 -0.187 26022 2574 1 6 . 1 1 41 41 SER CB C 41 63.470 63.470 63.639 -0.169 26022 2575 1 6 . 1 1 41 41 SER H H 41 8.341 8.341 8.742 -0.401 26022 2576 1 6 . 1 1 42 42 GLY N N 42 110.569 110.569 108.292 2.277 26022 2577 1 6 . 1 1 42 42 GLY C C 42 173.829 173.829 173.537 0.292 26022 2578 1 6 . 1 1 42 42 GLY CA C 42 45.257 45.257 45.098 0.159 26022 2579 1 6 . 1 1 42 42 GLY H H 42 8.380 8.380 7.617 0.763 26022 2580 1 6 . 1 1 43 43 LYS HA H 43 3.977 3.977 4.067 -0.090 26022 2581 1 6 . 1 1 43 43 LYS C C 43 179.363 179.363 178.290 1.073 26022 2582 1 6 . 1 1 43 43 LYS CA C 43 59.628 59.628 58.524 1.104 26022 2583 1 6 . 1 1 43 43 LYS CB C 43 32.510 32.510 32.657 -0.147 26022 2584 1 6 . 1 1 44 44 VAL N N 44 120.404 120.404 119.041 1.363 26022 2585 1 6 . 1 1 44 44 VAL HA H 44 3.661 3.661 3.671 -0.010 26022 2586 1 6 . 1 1 44 44 VAL C C 44 179.785 179.785 176.885 2.900 26022 2587 1 6 . 1 1 44 44 VAL CA C 44 65.425 65.425 65.601 -0.176 26022 2588 1 6 . 1 1 44 44 VAL CB C 44 31.500 31.500 31.650 -0.150 26022 2589 1 6 . 1 1 45 45 ARG N N 45 123.687 123.687 118.525 5.162 26022 2590 1 6 . 1 1 45 45 ARG HA H 45 4.054 4.054 4.161 -0.107 26022 2591 1 6 . 1 1 45 45 ARG C C 45 179.504 179.504 178.166 1.338 26022 2592 1 6 . 1 1 45 45 ARG CA C 45 59.669 59.669 58.441 1.228 26022 2593 1 6 . 1 1 45 45 ARG CB C 45 30.417 30.417 29.952 0.465 26022 2594 1 6 . 1 1 45 45 ARG H H 45 8.608 8.608 7.664 0.944 26022 2595 1 6 . 1 1 46 46 ARG N N 46 118.506 118.506 118.909 -0.403 26022 2596 1 6 . 1 1 46 46 ARG HA H 46 4.148 4.148 4.224 -0.076 26022 2597 1 6 . 1 1 46 46 ARG C C 46 177.396 177.396 178.260 -0.864 26022 2598 1 6 . 1 1 46 46 ARG CA C 46 58.481 58.481 58.137 0.344 26022 2599 1 6 . 1 1 46 46 ARG CB C 46 30.554 30.554 30.168 0.386 26022 2600 1 6 . 1 1 46 46 ARG H H 46 8.474 8.474 7.556 0.918 26022 2601 1 6 . 1 1 47 47 SER N N 47 114.263 114.263 112.071 2.192 26022 2602 1 6 . 1 1 47 47 SER HA H 47 4.393 4.393 4.446 -0.053 26022 2603 1 6 . 1 1 47 47 SER C C 47 174.070 174.070 173.590 0.480 26022 2604 1 6 . 1 1 47 47 SER CA C 47 59.696 59.696 58.085 1.611 26022 2605 1 6 . 1 1 47 47 SER CB C 47 64.013 64.013 63.802 0.211 26022 2606 1 6 . 1 1 47 47 SER H H 47 7.645 7.645 8.117 -0.472 26022 2607 1 6 . 1 1 48 48 LYS N N 48 115.405 115.405 118.787 -3.382 26022 2608 1 6 . 1 1 48 48 LYS HA H 48 3.990 3.990 3.977 0.013 26022 2609 1 6 . 1 1 48 48 LYS C C 48 175.804 175.804 175.204 0.600 26022 2610 1 6 . 1 1 48 48 LYS CA C 48 57.537 57.537 57.078 0.459 26022 2611 1 6 . 1 1 48 48 LYS CB C 48 29.947 29.947 29.762 0.185 26022 2612 1 6 . 1 1 48 48 LYS H H 48 7.821 7.821 7.933 -0.112 26022 2613 1 6 . 1 1 49 49 ILE N N 49 117.265 117.265 119.477 -2.212 26022 2614 1 6 . 1 1 49 49 ILE HA H 49 4.041 4.041 4.158 -0.117 26022 2615 1 6 . 1 1 49 49 ILE C C 49 175.125 175.125 176.282 -1.157 26022 2616 1 6 . 1 1 49 49 ILE CA C 49 61.315 61.315 58.720 2.595 26022 2617 1 6 . 1 1 49 49 ILE CB C 49 38.919 38.919 38.242 0.677 26022 2618 1 6 . 1 1 50 50 ARG N N 50 126.687 126.687 127.281 -0.594 26022 2619 1 6 . 1 1 50 50 ARG HA H 50 4.471 4.471 4.432 0.039 26022 2620 1 6 . 1 1 50 50 ARG C C 50 175.007 175.007 175.455 -0.448 26022 2621 1 6 . 1 1 50 50 ARG CA C 50 55.176 55.176 55.272 -0.096 26022 2622 1 6 . 1 1 50 50 ARG CB C 50 31.026 31.026 30.407 0.619 26022 2623 1 6 . 1 1 50 50 ARG H H 50 8.437 8.437 8.420 0.017 26022 2624 1 6 . 1 1 51 51 ILE N N 51 127.722 127.722 126.609 1.113 26022 2625 1 6 . 1 1 51 51 ILE HA H 51 4.276 4.276 4.007 0.269 26022 2626 1 6 . 1 1 51 51 ILE C C 51 174.726 174.726 175.874 -1.148 26022 2627 1 6 . 1 1 51 51 ILE CA C 51 60.235 60.235 60.629 -0.394 26022 2628 1 6 . 1 1 51 51 ILE CB C 51 37.772 37.772 38.083 -0.311 26022 2629 1 6 . 1 1 52 52 ILE N N 52 121.888 121.888 123.327 -1.439 26022 2630 1 6 . 1 1 52 52 ILE HA H 52 4.781 4.781 4.492 0.289 26022 2631 1 6 . 1 1 52 52 ILE C C 52 175.733 175.733 174.840 0.893 26022 2632 1 6 . 1 1 52 52 ILE CA C 52 59.021 59.021 59.327 -0.306 26022 2633 1 6 . 1 1 52 52 ILE CB C 52 42.089 42.089 40.414 1.675 26022 2634 1 6 . 1 1 53 53 ILE N N 53 119.363 119.363 122.375 -3.012 26022 2635 1 6 . 1 1 53 53 ILE HA H 53 3.338 3.338 4.040 -0.702 26022 2636 1 6 . 1 1 53 53 ILE C C 53 177.021 177.021 176.887 0.134 26022 2637 1 6 . 1 1 53 53 ILE CA C 53 64.274 64.274 61.781 2.493 26022 2638 1 6 . 1 1 53 53 ILE CB C 53 37.256 37.256 38.195 -0.939 26022 2639 1 6 . 1 1 54 54 GLY N N 54 116.136 116.136 115.041 1.095 26022 2640 1 6 . 1 1 54 54 GLY C C 54 174.844 174.844 173.258 1.586 26022 2641 1 6 . 1 1 54 54 GLY CA C 54 45.188 45.188 45.006 0.182 26022 2642 1 6 . 1 1 54 54 GLY H H 54 8.853 8.853 8.759 0.094 26022 2643 1 6 . 1 1 55 55 ASP N N 55 121.946 121.946 118.323 3.623 26022 2644 1 6 . 1 1 55 55 ASP HA H 55 4.588 4.588 4.845 -0.257 26022 2645 1 6 . 1 1 55 55 ASP C C 55 175.804 175.804 174.227 1.577 26022 2646 1 6 . 1 1 55 55 ASP CA C 55 55.200 55.200 52.985 2.215 26022 2647 1 6 . 1 1 55 55 ASP CB C 55 41.048 41.048 43.157 -2.110 26022 2648 1 6 . 1 1 55 55 ASP H H 55 8.054 8.054 8.026 0.028 26022 2649 1 6 . 1 1 56 56 ARG N N 56 120.974 120.974 118.549 2.425 26022 2650 1 6 . 1 1 56 56 ARG HA H 56 5.200 5.200 5.094 0.106 26022 2651 1 6 . 1 1 56 56 ARG C C 56 176.483 176.483 175.642 0.841 26022 2652 1 6 . 1 1 56 56 ARG CA C 56 54.097 54.097 54.865 -0.768 26022 2653 1 6 . 1 1 56 56 ARG CB C 56 30.689 30.689 31.775 -1.086 26022 2654 1 6 . 1 1 56 56 ARG H H 56 8.766 8.766 8.392 0.374 26022 2655 1 6 . 1 1 57 57 VAL N N 57 114.943 114.943 116.246 -1.303 26022 2656 1 6 . 1 1 57 57 VAL HA H 57 4.965 4.965 4.471 0.494 26022 2657 1 6 . 1 1 57 57 VAL C C 57 172.243 172.243 173.255 -1.012 26022 2658 1 6 . 1 1 57 57 VAL CA C 57 58.077 58.077 59.949 -1.872 26022 2659 1 6 . 1 1 57 57 VAL CB C 57 36.288 36.288 35.157 1.131 26022 2660 1 6 . 1 1 58 58 LEU N N 58 122.410 122.410 124.185 -1.775 26022 2661 1 6 . 1 1 58 58 LEU HA H 58 4.731 4.731 5.029 -0.298 26022 2662 1 6 . 1 1 58 58 LEU C C 58 174.773 174.773 175.277 -0.504 26022 2663 1 6 . 1 1 58 58 LEU CA C 58 53.085 53.085 53.642 -0.557 26022 2664 1 6 . 1 1 58 58 LEU CB C 58 45.788 45.788 43.688 2.100 26022 2665 1 6 . 1 1 58 58 LEU H H 58 8.382 8.382 7.838 0.544 26022 2666 1 6 . 1 1 59 59 VAL N N 59 127.937 127.937 128.051 -0.114 26022 2667 1 6 . 1 1 59 59 VAL HA H 59 4.744 4.744 5.160 -0.416 26022 2668 1 6 . 1 1 59 59 VAL C C 59 174.141 174.141 174.172 -0.031 26022 2669 1 6 . 1 1 59 59 VAL CA C 59 60.279 60.279 59.082 1.197 26022 2670 1 6 . 1 1 59 59 VAL CB C 59 34.399 34.399 34.325 0.074 26022 2671 1 6 . 1 1 60 60 GLU N N 60 124.832 124.832 129.915 -5.083 26022 2672 1 6 . 1 1 60 60 GLU HA H 60 5.304 5.304 4.597 0.707 26022 2673 1 6 . 1 1 60 60 GLU C C 60 176.155 176.155 175.477 0.678 26022 2674 1 6 . 1 1 60 60 GLU CA C 60 54.164 54.164 55.072 -0.908 26022 2675 1 6 . 1 1 60 60 GLU CB C 60 33.803 33.803 30.267 3.536 26022 2676 1 6 . 1 1 60 60 GLU H H 60 9.142 9.142 8.452 0.690 26022 2677 1 6 . 1 1 61 61 MET N N 61 124.187 124.187 123.289 0.898 26022 2678 1 6 . 1 1 61 61 MET HA H 61 4.899 4.899 5.077 -0.178 26022 2679 1 6 . 1 1 61 61 MET C C 61 173.953 173.953 173.622 0.331 26022 2680 1 6 . 1 1 61 61 MET CA C 61 54.232 54.232 53.709 0.523 26022 2681 1 6 . 1 1 61 61 MET CB C 61 37.256 37.256 37.027 0.229 26022 2682 1 6 . 1 1 61 61 MET H H 61 8.984 8.984 8.359 0.625 26022 2683 1 6 . 1 1 62 62 SER N N 62 116.623 116.623 117.242 -0.619 26022 2684 1 6 . 1 1 62 62 SER HA H 62 4.263 4.263 4.771 -0.508 26022 2685 1 6 . 1 1 62 62 SER C C 62 176.413 176.413 174.911 1.502 26022 2686 1 6 . 1 1 62 62 SER CA C 62 56.893 56.893 57.172 -0.279 26022 2687 1 6 . 1 1 62 62 SER CB C 62 65.362 65.362 65.270 0.092 26022 2688 1 6 . 1 1 62 62 SER H H 62 9.167 9.167 8.614 0.553 26022 2689 1 6 . 1 1 63 63 ILE N N 63 121.187 121.187 121.862 -0.675 26022 2690 1 6 . 1 1 63 63 ILE HA H 63 3.989 3.989 3.955 0.034 26022 2691 1 6 . 1 1 63 63 ILE C C 63 176.623 176.623 176.668 -0.045 26022 2692 1 6 . 1 1 63 63 ILE CA C 63 63.878 63.878 61.905 1.973 26022 2693 1 6 . 1 1 63 63 ILE CB C 63 38.244 38.244 36.952 1.292 26022 2694 1 6 . 1 1 64 64 TYR N N 64 120.214 120.214 118.490 1.724 26022 2695 1 6 . 1 1 64 64 TYR HA H 64 4.432 4.432 4.167 0.265 26022 2696 1 6 . 1 1 64 64 TYR C C 64 177.092 177.092 176.305 0.787 26022 2697 1 6 . 1 1 64 64 TYR CA C 64 59.156 59.156 60.631 -1.475 26022 2698 1 6 . 1 1 64 64 TYR CB C 64 38.109 38.109 38.619 -0.510 26022 2699 1 6 . 1 1 64 64 TYR H H 64 7.762 7.762 7.784 -0.022 26022 2700 1 6 . 1 1 65 65 ASP N N 65 121.338 121.338 115.620 5.718 26022 2701 1 6 . 1 1 65 65 ASP HA H 65 4.495 4.495 4.586 -0.091 26022 2702 1 6 . 1 1 65 65 ASP C C 65 177.349 177.349 178.261 -0.912 26022 2703 1 6 . 1 1 65 65 ASP CA C 65 55.243 55.243 54.890 0.353 26022 2704 1 6 . 1 1 65 65 ASP CB C 65 40.538 40.538 40.972 -0.434 26022 2705 1 6 . 1 1 65 65 ASP H H 65 7.798 7.798 8.669 -0.871 26022 2706 1 6 . 1 1 66 66 ARG N N 66 121.118 121.118 122.396 -1.278 26022 2707 1 6 . 1 1 66 66 ARG HA H 66 4.069 4.069 4.198 -0.129 26022 2708 1 6 . 1 1 66 66 ARG C C 66 178.448 178.448 177.024 1.424 26022 2709 1 6 . 1 1 66 66 ARG CA C 66 58.401 58.401 58.405 -0.004 26022 2710 1 6 . 1 1 66 66 ARG CB C 66 30.184 30.184 29.397 0.787 26022 2711 1 6 . 1 1 66 66 ARG H H 66 8.382 8.382 8.883 -0.501 26022 2712 1 6 . 1 1 67 67 ASN N N 67 117.334 117.334 116.405 0.929 26022 2713 1 6 . 1 1 67 67 ASN HA H 67 4.601 4.601 5.172 -0.571 26022 2714 1 6 . 1 1 67 67 ASN C C 67 175.288 175.288 175.092 0.196 26022 2715 1 6 . 1 1 67 67 ASN CA C 67 54.097 54.097 53.531 0.566 26022 2716 1 6 . 1 1 67 67 ASN CB C 67 38.514 38.514 38.727 -0.213 26022 2717 1 6 . 1 1 67 67 ASN H H 67 8.194 8.194 8.417 -0.223 26022 2718 1 6 . 1 1 68 68 ALA N N 68 122.187 122.187 121.046 1.141 26022 2719 1 6 . 1 1 68 68 ALA HA H 68 4.575 4.575 4.402 0.173 26022 2720 1 6 . 1 1 68 68 ALA C C 68 176.272 176.272 177.578 -1.306 26022 2721 1 6 . 1 1 68 68 ALA CA C 68 52.478 52.478 53.675 -1.197 26022 2722 1 6 . 1 1 68 68 ALA CB C 68 19.086 19.086 19.493 -0.407 26022 2723 1 6 . 1 1 68 68 ALA H H 68 7.658 7.658 7.505 0.153 26022 2724 1 6 . 1 1 69 69 LYS N N 69 116.931 116.931 113.800 3.131 26022 2725 1 6 . 1 1 69 69 LYS HA H 69 4.197 4.197 4.412 -0.215 26022 2726 1 6 . 1 1 69 69 LYS C C 69 176.085 176.085 175.170 0.915 26022 2727 1 6 . 1 1 69 69 LYS CA C 69 56.728 56.728 56.575 0.153 26022 2728 1 6 . 1 1 69 69 LYS CB C 69 31.566 31.566 34.161 -2.595 26022 2729 1 6 . 1 1 69 69 LYS H H 69 8.255 8.255 8.173 0.082 26022 2730 1 6 . 1 1 70 70 LYS N N 70 119.854 119.854 117.948 1.906 26022 2731 1 6 . 1 1 70 70 LYS HA H 70 5.526 5.526 5.491 0.035 26022 2732 1 6 . 1 1 70 70 LYS C C 70 175.171 175.171 175.403 -0.232 26022 2733 1 6 . 1 1 70 70 LYS CA C 70 54.704 54.704 54.742 -0.038 26022 2734 1 6 . 1 1 70 70 LYS CB C 70 36.850 36.850 35.921 0.929 26022 2735 1 6 . 1 1 70 70 LYS H H 70 8.182 8.182 7.343 0.839 26022 2736 1 6 . 1 1 71 71 GLY N N 71 103.604 103.604 109.253 -5.649 26022 2737 1 6 . 1 1 71 71 GLY C C 71 171.541 171.541 172.944 -1.403 26022 2738 1 6 . 1 1 71 71 GLY CA C 71 45.462 45.462 43.099 2.363 26022 2739 1 6 . 1 1 71 71 GLY H H 71 7.780 7.780 8.345 -0.565 26022 2740 1 6 . 1 1 72 72 ARG N N 72 119.187 119.187 119.695 -0.508 26022 2741 1 6 . 1 1 72 72 ARG HA H 72 4.861 4.861 4.932 -0.071 26022 2742 1 6 . 1 1 72 72 ARG C C 72 175.570 175.570 175.316 0.254 26022 2743 1 6 . 1 1 72 72 ARG CA C 72 53.624 53.624 55.255 -1.631 26022 2744 1 6 . 1 1 72 72 ARG CB C 72 34.129 34.129 31.323 2.805 26022 2745 1 6 . 1 1 72 72 ARG H H 72 8.007 8.007 8.613 -0.606 26022 2746 1 6 . 1 1 73 73 ILE N N 73 125.721 125.721 125.449 0.272 26022 2747 1 6 . 1 1 73 73 ILE HA H 73 4.263 4.263 4.348 -0.085 26022 2748 1 6 . 1 1 73 73 ILE C C 73 175.312 175.312 174.066 1.246 26022 2749 1 6 . 1 1 73 73 ILE CA C 73 62.259 62.259 59.384 2.875 26022 2750 1 6 . 1 1 73 73 ILE CB C 73 39.423 39.423 40.020 -0.597 26022 2751 1 6 . 1 1 74 74 ILE N N 74 120.540 120.540 126.606 -6.066 26022 2752 1 6 . 1 1 74 74 ILE HA H 74 4.596 4.596 4.263 0.333 26022 2753 1 6 . 1 1 74 74 ILE C C 74 176.249 176.249 173.881 2.368 26022 2754 1 6 . 1 1 74 74 ILE CA C 74 60.910 60.910 60.630 0.280 26022 2755 1 6 . 1 1 74 74 ILE CB C 74 39.863 39.863 40.320 -0.457 26022 2756 1 6 . 1 1 75 75 ARG N N 75 118.582 118.582 115.853 2.729 26022 2757 1 6 . 1 1 75 75 ARG HA H 75 4.289 4.289 4.348 -0.059 26022 2758 1 6 . 1 1 75 75 ARG C C 75 173.883 173.883 174.331 -0.448 26022 2759 1 6 . 1 1 75 75 ARG CA C 75 56.390 56.390 55.503 0.887 26022 2760 1 6 . 1 1 75 75 ARG CB C 75 34.669 34.669 32.487 2.182 26022 2761 1 6 . 1 1 75 75 ARG H H 75 7.397 7.397 7.963 -0.566 26022 2762 1 6 . 1 1 76 76 ARG N N 76 125.606 125.606 120.145 5.461 26022 2763 1 6 . 1 1 76 76 ARG HA H 76 4.609 4.609 4.485 0.124 26022 2764 1 6 . 1 1 76 76 ARG C C 76 175.312 175.312 174.884 0.428 26022 2765 1 6 . 1 1 76 76 ARG CA C 76 55.810 55.810 55.972 -0.162 26022 2766 1 6 . 1 1 76 76 ARG CB C 76 31.094 31.094 30.698 0.396 26022 2767 1 6 . 1 1 76 76 ARG H H 76 9.094 9.094 8.244 0.850 26022 2768 1 6 . 1 1 77 77 LEU N N 77 128.575 128.575 122.170 6.405 26022 2769 1 6 . 1 1 77 77 LEU HA H 77 4.372 4.372 4.381 -0.009 26022 2770 1 6 . 1 1 77 77 LEU C C 77 176.225 176.225 176.471 -0.246 26022 2771 1 6 . 1 1 77 77 LEU CA C 77 54.704 54.704 54.006 0.698 26022 2772 1 6 . 1 1 77 77 LEU CB C 77 42.292 42.292 44.209 -1.917 26022 2773 1 6 . 1 1 77 77 LEU H H 77 8.742 8.742 8.324 0.418 26022 2774 1 6 . 1 1 78 78 LYS N N 78 119.592 119.592 126.138 -6.546 26022 2775 1 6 . 1 1 78 78 LYS HA H 78 4.302 4.302 4.204 0.098 26022 2776 1 6 . 1 1 78 78 LYS C C 78 176.296 176.296 176.526 -0.230 26022 2777 1 6 . 1 1 78 78 LYS CA C 78 56.390 56.390 57.532 -1.142 26022 2778 1 6 . 1 1 78 78 LYS CB C 78 33.994 33.994 32.568 1.426 26022 2779 1 6 . 1 1 78 78 LYS H H 78 8.090 8.090 8.401 -0.311 26022 2780 1 6 . 1 1 79 79 GLY N N 79 110.854 110.854 112.581 -1.727 26022 2781 1 6 . 1 1 79 79 GLY C C 79 174.328 174.328 173.403 0.925 26022 2782 1 6 . 1 1 79 79 GLY CA C 79 44.990 44.990 44.703 0.287 26022 2783 1 6 . 1 1 79 79 GLY H H 79 8.520 8.520 8.528 -0.008 26022 2784 1 6 . 1 1 80 80 THR N N 80 114.187 114.187 113.942 0.245 26022 2785 1 6 . 1 1 80 80 THR HA H 80 4.237 4.237 4.567 -0.330 26022 2786 1 6 . 1 1 80 80 THR C C 80 175.054 175.054 173.294 1.760 26022 2787 1 6 . 1 1 80 80 THR CA C 80 62.242 62.242 60.646 1.596 26022 2788 1 6 . 1 1 80 80 THR CB C 80 69.826 69.826 70.386 -0.560 26022 2789 1 6 . 1 1 81 81 SER N N 81 117.958 117.958 115.275 2.683 26022 2790 1 6 . 1 1 81 81 SER HA H 81 4.449 4.449 4.298 0.151 26022 2791 1 6 . 1 1 81 81 SER C C 81 174.703 174.703 173.924 0.779 26022 2792 1 6 . 1 1 81 81 SER CA C 81 58.481 58.481 58.689 -0.208 26022 2793 1 6 . 1 1 81 81 SER CB C 81 63.338 63.338 62.608 0.730 26022 2794 1 6 . 1 1 81 81 SER H H 81 8.474 8.474 8.610 -0.136 26022 2795 1 6 . 1 1 82 82 ASP HA H 82 4.280 4.280 4.501 -0.221 26022 2796 1 6 . 1 1 82 82 ASP C C 82 177.115 177.115 175.914 1.201 26022 2797 1 6 . 1 1 82 82 ASP CA C 82 55.176 55.176 54.488 0.688 26022 2798 1 6 . 1 1 82 82 ASP CB C 82 42.359 42.359 41.175 1.184 26022 2799 1 6 . 1 1 83 83 ARG N N 83 121.531 121.531 115.010 6.521 26022 2800 1 6 . 1 1 83 83 ARG HA H 83 4.346 4.346 4.029 0.317 26022 2801 1 6 . 1 1 83 83 ARG C C 83 176.342 176.342 176.168 0.174 26022 2802 1 6 . 1 1 83 83 ARG CA C 83 56.053 56.053 56.495 -0.442 26022 2803 1 6 . 1 1 83 83 ARG CB C 83 30.891 30.891 29.564 1.327 26022 2804 1 6 . 1 1 83 83 ARG H H 83 8.259 8.259 7.565 0.694 26022 2805 1 6 . 1 1 84 84 THR N N 84 116.462 116.462 114.908 1.554 26022 2806 1 6 . 1 1 84 84 THR HA H 84 4.333 4.333 4.195 0.138 26022 2807 1 6 . 1 1 84 84 THR C C 84 174.445 174.445 175.508 -1.063 26022 2808 1 6 . 1 1 84 84 THR CA C 84 62.254 62.254 63.697 -1.443 26022 2809 1 6 . 1 1 84 84 THR CB C 84 69.833 69.833 68.535 1.298 26022 2810 1 6 . 1 1 85 85 ILE N N 85 123.762 123.762 113.734 10.028 26022 2811 1 6 . 1 1 85 85 ILE HA H 85 4.188 4.188 3.835 0.353 26022 2812 1 6 . 1 1 85 85 ILE C C 85 176.155 176.155 174.488 1.667 26022 2813 1 6 . 1 1 85 85 ILE CA C 85 61.112 61.112 62.696 -1.584 26022 2814 1 6 . 1 1 85 85 ILE CB C 85 38.919 38.919 36.032 2.887 26022 2815 1 6 . 1 1 86 86 SER N N 86 120.214 120.214 111.938 8.276 26022 2816 1 6 . 1 1 86 86 SER HA H 86 4.451 4.451 4.578 -0.127 26022 2817 1 6 . 1 1 86 86 SER C C 86 174.586 174.586 174.449 0.137 26022 2818 1 6 . 1 1 86 86 SER CA C 86 58.212 58.212 57.626 0.587 26022 2819 1 6 . 1 1 86 86 SER CB C 86 63.271 63.271 64.309 -1.038 26022 2820 1 6 . 1 1 86 86 SER H H 86 8.377 8.377 8.089 0.288 26022 2821 1 7 . 1 1 2 2 VAL N N 2 122.187 122.187 118.521 3.666 26022 2822 1 7 . 1 1 2 2 VAL HA H 2 4.091 4.091 4.271 -0.180 26022 2823 1 7 . 1 1 2 2 VAL C C 2 175.921 175.921 175.887 0.034 26022 2824 1 7 . 1 1 2 2 VAL CA C 2 62.057 62.057 63.429 -1.372 26022 2825 1 7 . 1 1 2 2 VAL CB C 2 32.848 32.848 31.968 0.880 26022 2826 1 7 . 1 1 3 3 LYS N N 3 125.437 125.437 122.226 3.211 26022 2827 1 7 . 1 1 3 3 LYS HA H 3 4.289 4.289 4.692 -0.403 26022 2828 1 7 . 1 1 3 3 LYS C C 3 176.155 176.155 175.478 0.677 26022 2829 1 7 . 1 1 3 3 LYS CA C 3 56.323 56.323 55.584 0.739 26022 2830 1 7 . 1 1 3 3 LYS CB C 3 33.320 33.320 31.414 1.906 26022 2831 1 7 . 1 1 3 3 LYS H H 3 8.396 8.396 8.000 0.396 26022 2832 1 7 . 1 1 4 4 ASP N N 4 121.937 121.937 122.758 -0.821 26022 2833 1 7 . 1 1 4 4 ASP HA H 4 4.289 4.289 4.683 -0.394 26022 2834 1 7 . 1 1 4 4 ASP C C 4 176.319 176.319 177.139 -0.820 26022 2835 1 7 . 1 1 4 4 ASP CA C 4 54.029 54.029 55.547 -1.518 26022 2836 1 7 . 1 1 4 4 ASP CB C 4 41.280 41.280 41.854 -0.574 26022 2837 1 7 . 1 1 4 4 ASP H H 4 8.325 8.325 8.753 -0.428 26022 2838 1 7 . 1 1 5 5 GLU N N 5 122.369 122.369 121.060 1.309 26022 2839 1 7 . 1 1 5 5 GLU HA H 5 4.250 4.250 4.102 0.148 26022 2840 1 7 . 1 1 5 5 GLU C C 5 177.045 177.045 177.405 -0.360 26022 2841 1 7 . 1 1 5 5 GLU CA C 5 56.930 56.930 58.779 -1.849 26022 2842 1 7 . 1 1 5 5 GLU CB C 5 30.554 30.554 29.494 1.060 26022 2843 1 7 . 1 1 5 5 GLU H H 5 8.464 8.464 8.750 -0.286 26022 2844 1 7 . 1 1 6 6 LYS N N 6 121.437 121.437 118.422 3.015 26022 2845 1 7 . 1 1 6 6 LYS HA H 6 4.282 4.282 4.500 -0.218 26022 2846 1 7 . 1 1 6 6 LYS C C 6 177.185 177.185 175.785 1.400 26022 2847 1 7 . 1 1 6 6 LYS CA C 6 56.930 56.930 55.522 1.409 26022 2848 1 7 . 1 1 6 6 LYS CB C 6 32.713 32.713 31.186 1.527 26022 2849 1 7 . 1 1 6 6 LYS H H 6 8.390 8.390 8.282 0.108 26022 2850 1 7 . 1 1 7 7 SER N N 7 115.822 115.822 117.383 -1.561 26022 2851 1 7 . 1 1 7 7 SER HA H 7 4.396 4.396 4.418 -0.022 26022 2852 1 7 . 1 1 7 7 SER C C 7 174.609 174.609 174.625 -0.016 26022 2853 1 7 . 1 1 7 7 SER CA C 7 58.684 58.684 60.562 -1.878 26022 2854 1 7 . 1 1 7 7 SER CB C 7 63.608 63.608 63.819 -0.211 26022 2855 1 7 . 1 1 7 7 SER H H 7 8.205 8.205 8.532 -0.327 26022 2856 1 7 . 1 1 8 8 LYS N N 8 122.643 122.643 120.323 2.320 26022 2857 1 7 . 1 1 8 8 LYS HA H 8 4.407 4.407 4.549 -0.142 26022 2858 1 7 . 1 1 8 8 LYS C C 8 176.694 176.694 175.199 1.495 26022 2859 1 7 . 1 1 8 8 LYS CA C 8 56.390 56.390 55.440 0.950 26022 2860 1 7 . 1 1 8 8 LYS CB C 8 33.185 33.185 33.044 0.141 26022 2861 1 7 . 1 1 8 8 LYS H H 8 8.201 8.201 8.040 0.161 26022 2862 1 7 . 1 1 9 9 THR N N 9 113.900 113.900 122.751 -8.851 26022 2863 1 7 . 1 1 9 9 THR HA H 9 4.341 4.341 4.482 -0.141 26022 2864 1 7 . 1 1 9 9 THR C C 9 173.438 173.438 173.439 -0.001 26022 2865 1 7 . 1 1 9 9 THR CA C 9 62.529 62.529 62.763 -0.234 26022 2866 1 7 . 1 1 9 9 THR CB C 9 69.342 69.342 68.474 0.868 26022 2867 1 7 . 1 1 10 10 LEU N N 10 124.082 124.082 122.956 1.126 26022 2868 1 7 . 1 1 10 10 LEU HA H 10 4.858 4.858 4.762 0.096 26022 2869 1 7 . 1 1 10 10 LEU C C 10 175.804 175.804 174.568 1.236 26022 2870 1 7 . 1 1 10 10 LEU CA C 10 53.759 53.759 53.485 0.274 26022 2871 1 7 . 1 1 10 10 LEU CB C 10 44.653 44.653 45.107 -0.454 26022 2872 1 7 . 1 1 10 10 LEU H H 10 7.786 7.786 7.773 0.013 26022 2873 1 7 . 1 1 11 11 PHE N N 11 120.942 120.942 120.922 0.020 26022 2874 1 7 . 1 1 11 11 PHE HA H 11 4.862 4.862 4.920 -0.058 26022 2875 1 7 . 1 1 11 11 PHE C C 11 173.578 173.578 174.023 -0.445 26022 2876 1 7 . 1 1 11 11 PHE CA C 11 56.120 56.120 57.131 -1.011 26022 2877 1 7 . 1 1 11 11 PHE CB C 11 41.212 41.212 42.827 -1.615 26022 2878 1 7 . 1 1 11 11 PHE H H 11 8.889 8.889 9.172 -0.283 26022 2879 1 7 . 1 1 12 12 GLU N N 12 119.958 119.958 127.210 -7.252 26022 2880 1 7 . 1 1 12 12 GLU HA H 12 5.539 5.539 4.684 0.855 26022 2881 1 7 . 1 1 12 12 GLU C C 12 176.295 176.295 174.589 1.706 26022 2882 1 7 . 1 1 12 12 GLU CA C 12 54.501 54.501 55.429 -0.928 26022 2883 1 7 . 1 1 12 12 GLU CB C 12 31.768 31.768 30.880 0.888 26022 2884 1 7 . 1 1 12 12 GLU H H 12 8.285 8.285 8.147 0.138 26022 2885 1 7 . 1 1 13 13 VAL N N 13 120.742 120.742 125.284 -4.542 26022 2886 1 7 . 1 1 13 13 VAL HA H 13 4.570 4.570 4.389 0.181 26022 2887 1 7 . 1 1 13 13 VAL C C 13 173.415 173.415 174.003 -0.588 26022 2888 1 7 . 1 1 13 13 VAL CA C 13 59.696 59.696 59.784 -0.088 26022 2889 1 7 . 1 1 13 13 VAL CB C 13 36.018 36.018 36.214 -0.196 26022 2890 1 7 . 1 1 14 14 GLU N N 14 122.848 122.848 123.816 -0.968 26022 2891 1 7 . 1 1 14 14 GLU HA H 14 5.226 5.226 5.058 0.168 26022 2892 1 7 . 1 1 14 14 GLU C C 14 176.295 176.295 175.846 0.449 26022 2893 1 7 . 1 1 14 14 GLU CA C 14 55.243 55.243 55.346 -0.103 26022 2894 1 7 . 1 1 14 14 GLU CB C 14 32.173 32.173 31.690 0.483 26022 2895 1 7 . 1 1 14 14 GLU H H 14 8.492 8.492 8.579 -0.087 26022 2896 1 7 . 1 1 15 15 GLY N N 15 105.005 105.005 107.246 -2.241 26022 2897 1 7 . 1 1 15 15 GLY C C 15 170.393 170.393 171.841 -1.448 26022 2898 1 7 . 1 1 15 15 GLY CA C 15 46.002 46.002 45.075 0.927 26022 2899 1 7 . 1 1 15 15 GLY H H 15 8.454 8.454 8.859 -0.405 26022 2900 1 7 . 1 1 16 16 ALA N N 16 120.909 120.909 121.314 -0.405 26022 2901 1 7 . 1 1 16 16 ALA HA H 16 5.526 5.526 4.959 0.567 26022 2902 1 7 . 1 1 16 16 ALA C C 16 176.834 176.834 175.529 1.305 26022 2903 1 7 . 1 1 16 16 ALA CA C 16 49.644 49.644 50.228 -0.584 26022 2904 1 7 . 1 1 16 16 ALA CB C 16 22.054 22.054 22.109 -0.055 26022 2905 1 7 . 1 1 16 16 ALA H H 16 8.206 8.206 8.074 0.132 26022 2906 1 7 . 1 1 17 17 VAL N N 17 122.567 122.567 124.917 -2.350 26022 2907 1 7 . 1 1 17 17 VAL HA H 17 4.380 4.380 4.250 0.130 26022 2908 1 7 . 1 1 17 17 VAL C C 17 178.099 178.099 175.143 2.956 26022 2909 1 7 . 1 1 17 17 VAL CA C 17 63.608 63.608 62.495 1.113 26022 2910 1 7 . 1 1 17 17 VAL CB C 17 32.105 32.105 33.110 -1.005 26022 2911 1 7 . 1 1 18 18 THR N N 18 120.937 120.937 124.899 -3.962 26022 2912 1 7 . 1 1 18 18 THR HA H 18 4.601 4.601 4.584 0.017 26022 2913 1 7 . 1 1 18 18 THR C C 18 175.312 175.312 173.844 1.468 26022 2914 1 7 . 1 1 18 18 THR CA C 18 61.517 61.517 61.064 0.453 26022 2915 1 7 . 1 1 18 18 THR CB C 18 69.814 69.814 69.414 0.400 26022 2916 1 7 . 1 1 19 19 ALA N N 19 121.258 121.258 123.525 -2.267 26022 2917 1 7 . 1 1 19 19 ALA HA H 19 4.458 4.458 4.683 -0.225 26022 2918 1 7 . 1 1 19 19 ALA C C 19 174.703 174.703 174.885 -0.182 26022 2919 1 7 . 1 1 19 19 ALA CA C 19 53.017 53.017 51.824 1.193 26022 2920 1 7 . 1 1 19 19 ALA CB C 19 22.054 22.054 21.284 0.770 26022 2921 1 7 . 1 1 19 19 ALA H H 19 7.716 7.716 7.665 0.051 26022 2922 1 7 . 1 1 20 20 LEU N N 20 123.420 123.420 118.536 4.884 26022 2923 1 7 . 1 1 20 20 LEU HA H 20 4.393 4.393 4.927 -0.534 26022 2924 1 7 . 1 1 20 20 LEU C C 20 175.499 175.499 175.094 0.405 26022 2925 1 7 . 1 1 20 20 LEU CA C 20 54.839 54.839 53.411 1.428 26022 2926 1 7 . 1 1 20 20 LEU CB C 20 41.212 41.212 44.933 -3.721 26022 2927 1 7 . 1 1 20 20 LEU H H 20 8.711 8.711 8.305 0.406 26022 2928 1 7 . 1 1 21 21 LEU N N 21 124.718 124.718 123.474 1.244 26022 2929 1 7 . 1 1 21 21 LEU HA H 21 4.714 4.714 4.852 -0.138 26022 2930 1 7 . 1 1 21 21 LEU C C 21 174.328 174.328 176.006 -1.678 26022 2931 1 7 . 1 1 21 21 LEU CA C 21 52.680 52.680 51.981 0.699 26022 2932 1 7 . 1 1 21 21 LEU CB C 21 41.684 41.684 42.801 -1.117 26022 2933 1 7 . 1 1 21 21 LEU H H 21 7.773 7.773 8.809 -1.036 26022 2934 1 7 . 1 1 22 22 PRO HA H 22 4.380 4.380 4.308 0.072 26022 2935 1 7 . 1 1 22 22 PRO C C 22 175.616 175.616 175.947 -0.331 26022 2936 1 7 . 1 1 22 22 PRO CA C 22 62.529 62.529 63.854 -1.325 26022 2937 1 7 . 1 1 22 22 PRO CB C 22 32.240 32.240 30.868 1.372 26022 2938 1 7 . 1 1 23 23 ALA N N 23 120.693 120.693 120.342 0.351 26022 2939 1 7 . 1 1 23 23 ALA HA H 23 4.302 4.302 4.360 -0.058 26022 2940 1 7 . 1 1 23 23 ALA C C 23 176.178 176.178 176.780 -0.602 26022 2941 1 7 . 1 1 23 23 ALA CA C 23 52.882 52.882 51.196 1.686 26022 2942 1 7 . 1 1 23 23 ALA CB C 23 17.336 17.336 18.822 -1.486 26022 2943 1 7 . 1 1 23 23 ALA H H 23 8.675 8.675 7.678 0.997 26022 2944 1 7 . 1 1 24 24 ALA N N 24 115.540 115.540 120.056 -4.516 26022 2945 1 7 . 1 1 24 24 ALA HA H 24 3.820 3.820 3.786 0.034 26022 2946 1 7 . 1 1 24 24 ALA C C 24 175.546 175.546 175.590 -0.044 26022 2947 1 7 . 1 1 24 24 ALA CA C 24 52.613 52.613 53.139 -0.526 26022 2948 1 7 . 1 1 24 24 ALA CB C 24 16.590 16.590 16.980 -0.390 26022 2949 1 7 . 1 1 24 24 ALA H H 24 8.381 8.381 7.817 0.564 26022 2950 1 7 . 1 1 25 25 GLU N N 25 114.082 114.082 114.639 -0.557 26022 2951 1 7 . 1 1 25 25 GLU HA H 25 5.148 5.148 5.097 0.051 26022 2952 1 7 . 1 1 25 25 GLU C C 25 175.757 175.757 174.590 1.167 26022 2953 1 7 . 1 1 25 25 GLU CA C 25 54.911 54.911 53.661 1.250 26022 2954 1 7 . 1 1 25 25 GLU CB C 25 32.645 32.645 32.799 -0.154 26022 2955 1 7 . 1 1 25 25 GLU H H 25 6.378 6.378 7.370 -0.992 26022 2956 1 7 . 1 1 26 26 PHE N N 26 117.365 117.365 119.297 -1.932 26022 2957 1 7 . 1 1 26 26 PHE HA H 26 4.979 4.979 4.830 0.149 26022 2958 1 7 . 1 1 26 26 PHE C C 26 174.960 174.960 174.979 -0.019 26022 2959 1 7 . 1 1 26 26 PHE CA C 26 56.862 56.862 56.922 -0.060 26022 2960 1 7 . 1 1 26 26 PHE CB C 26 43.371 43.371 42.708 0.663 26022 2961 1 7 . 1 1 26 26 PHE H H 26 8.950 8.950 8.899 0.051 26022 2962 1 7 . 1 1 27 27 ARG N N 27 125.082 125.082 120.592 4.490 26022 2963 1 7 . 1 1 27 27 ARG HA H 27 4.992 4.992 5.033 -0.041 26022 2964 1 7 . 1 1 27 27 ARG C C 27 175.148 175.148 174.289 0.859 26022 2965 1 7 . 1 1 27 27 ARG CA C 27 56.323 56.323 55.180 1.143 26022 2966 1 7 . 1 1 27 27 ARG CB C 27 32.240 32.240 33.963 -1.723 26022 2967 1 7 . 1 1 27 27 ARG H H 27 8.799 8.799 9.236 -0.437 26022 2968 1 7 . 1 1 28 28 VAL N N 28 127.456 127.456 120.798 6.658 26022 2969 1 7 . 1 1 28 28 VAL HA H 28 4.757 4.757 5.264 -0.507 26022 2970 1 7 . 1 1 28 28 VAL C C 28 173.602 173.602 173.688 -0.086 26022 2971 1 7 . 1 1 28 28 VAL CA C 28 60.303 60.303 59.093 1.210 26022 2972 1 7 . 1 1 28 28 VAL CB C 28 35.681 35.681 35.639 0.042 26022 2973 1 7 . 1 1 29 29 LYS N N 29 128.096 128.096 123.440 4.656 26022 2974 1 7 . 1 1 29 29 LYS HA H 29 4.354 4.354 5.068 -0.714 26022 2975 1 7 . 1 1 29 29 LYS C C 29 176.740 176.740 174.694 2.046 26022 2976 1 7 . 1 1 29 29 LYS CA C 29 55.041 55.041 53.749 1.292 26022 2977 1 7 . 1 1 29 29 LYS CB C 29 34.062 34.062 36.268 -2.206 26022 2978 1 7 . 1 1 29 29 LYS H H 29 9.268 9.268 8.862 0.406 26022 2979 1 7 . 1 1 30 30 LEU N N 30 129.600 129.600 123.553 6.047 26022 2980 1 7 . 1 1 30 30 LEU HA H 30 4.653 4.653 4.545 0.108 26022 2981 1 7 . 1 1 30 30 LEU C C 30 178.193 178.193 177.077 1.116 26022 2982 1 7 . 1 1 30 30 LEU CA C 30 54.771 54.771 54.184 0.587 26022 2983 1 7 . 1 1 30 30 LEU CB C 30 42.224 42.224 43.880 -1.656 26022 2984 1 7 . 1 1 30 30 LEU H H 30 9.000 9.000 8.542 0.458 26022 2985 1 7 . 1 1 31 31 ASP N N 31 120.478 120.478 122.706 -2.228 26022 2986 1 7 . 1 1 31 31 ASP HA H 31 4.458 4.458 4.472 -0.014 26022 2987 1 7 . 1 1 31 31 ASP C C 31 176.155 176.155 176.610 -0.455 26022 2988 1 7 . 1 1 31 31 ASP CA C 31 55.918 55.918 56.628 -0.710 26022 2989 1 7 . 1 1 31 31 ASP CB C 31 39.593 39.593 40.499 -0.906 26022 2990 1 7 . 1 1 31 31 ASP H H 31 8.698 8.698 8.639 0.059 26022 2991 1 7 . 1 1 32 32 ASN N N 32 115.450 115.450 117.188 -1.738 26022 2992 1 7 . 1 1 32 32 ASN HA H 32 4.588 4.588 4.645 -0.057 26022 2993 1 7 . 1 1 32 32 ASN C C 32 175.335 175.335 174.689 0.646 26022 2994 1 7 . 1 1 32 32 ASN CA C 32 53.152 53.152 53.564 -0.412 26022 2995 1 7 . 1 1 32 32 ASN CB C 32 37.367 37.367 38.553 -1.186 26022 2996 1 7 . 1 1 32 32 ASN H H 32 7.680 7.680 8.116 -0.436 26022 2997 1 7 . 1 1 33 33 GLU N N 33 111.790 111.790 114.533 -2.743 26022 2998 1 7 . 1 1 33 33 GLU HA H 33 3.898 3.898 3.916 -0.018 26022 2999 1 7 . 1 1 33 33 GLU C C 33 175.733 175.733 174.474 1.259 26022 3000 1 7 . 1 1 33 33 GLU CA C 33 58.144 58.144 57.653 0.491 26022 3001 1 7 . 1 1 33 33 GLU CB C 33 28.242 28.242 26.740 1.502 26022 3002 1 7 . 1 1 33 33 GLU H H 33 8.097 8.097 7.867 0.230 26022 3003 1 7 . 1 1 34 34 HIS N N 34 119.193 119.193 118.194 0.999 26022 3004 1 7 . 1 1 34 34 HIS HA H 34 4.201 4.201 4.778 -0.577 26022 3005 1 7 . 1 1 34 34 HIS C C 34 173.789 173.789 173.606 0.183 26022 3006 1 7 . 1 1 34 34 HIS CA C 34 56.053 56.053 55.249 0.804 26022 3007 1 7 . 1 1 34 34 HIS CB C 34 30.487 30.487 32.006 -1.519 26022 3008 1 7 . 1 1 34 34 HIS H H 34 7.890 7.890 7.603 0.287 26022 3009 1 7 . 1 1 35 35 GLU HA H 35 5.400 5.400 5.170 0.230 26022 3010 1 7 . 1 1 35 35 GLU C C 35 175.944 175.944 175.392 0.552 26022 3011 1 7 . 1 1 35 35 GLU CA C 35 55.109 55.109 54.860 0.249 26022 3012 1 7 . 1 1 35 35 GLU CB C 35 32.308 32.308 31.267 1.041 26022 3013 1 7 . 1 1 36 36 ILE N N 36 119.077 119.077 115.408 3.669 26022 3014 1 7 . 1 1 36 36 ILE HA H 36 4.686 4.686 4.893 -0.207 26022 3015 1 7 . 1 1 36 36 ILE C C 36 173.790 173.790 174.824 -1.034 26022 3016 1 7 . 1 1 36 36 ILE CA C 36 59.156 59.156 59.416 -0.260 26022 3017 1 7 . 1 1 36 36 ILE CB C 36 42.696 42.696 42.047 0.649 26022 3018 1 7 . 1 1 37 37 ILE N N 37 122.787 122.787 118.596 4.191 26022 3019 1 7 . 1 1 37 37 ILE HA H 37 4.778 4.778 4.560 0.218 26022 3020 1 7 . 1 1 37 37 ILE C C 37 177.057 177.057 175.735 1.322 26022 3021 1 7 . 1 1 37 37 ILE CA C 37 59.723 59.723 60.531 -0.808 26022 3022 1 7 . 1 1 37 37 ILE CB C 37 37.949 37.949 39.937 -1.988 26022 3023 1 7 . 1 1 38 38 CYS N N 38 122.357 122.357 123.061 -0.704 26022 3024 1 7 . 1 1 38 38 CYS HA H 38 5.708 5.708 5.520 0.188 26022 3025 1 7 . 1 1 38 38 CYS C C 38 174.258 174.258 173.650 0.608 26022 3026 1 7 . 1 1 38 38 CYS CA C 38 56.930 56.930 57.095 -0.165 26022 3027 1 7 . 1 1 38 38 CYS CB C 38 33.252 33.252 31.570 1.681 26022 3028 1 7 . 1 1 38 38 CYS H H 38 9.512 9.512 9.278 0.234 26022 3029 1 7 . 1 1 39 39 HIS N N 39 117.101 117.101 116.217 0.884 26022 3030 1 7 . 1 1 39 39 HIS HA H 39 5.526 5.526 5.106 0.420 26022 3031 1 7 . 1 1 39 39 HIS C C 39 174.516 174.516 173.222 1.294 26022 3032 1 7 . 1 1 39 39 HIS CA C 39 54.097 54.097 54.513 -0.416 26022 3033 1 7 . 1 1 39 39 HIS CB C 39 31.701 31.701 32.039 -0.338 26022 3034 1 7 . 1 1 39 39 HIS H H 39 7.597 7.597 9.411 -1.814 26022 3035 1 7 . 1 1 40 40 VAL N N 40 117.923 117.923 115.874 2.049 26022 3036 1 7 . 1 1 40 40 VAL HA H 40 4.614 4.614 4.234 0.380 26022 3037 1 7 . 1 1 40 40 VAL C C 40 175.804 175.804 174.768 1.036 26022 3038 1 7 . 1 1 40 40 VAL CA C 40 61.382 61.382 62.250 -0.868 26022 3039 1 7 . 1 1 40 40 VAL CB C 40 33.396 33.396 32.596 0.800 26022 3040 1 7 . 1 1 41 41 SER N N 41 119.242 119.242 118.808 0.434 26022 3041 1 7 . 1 1 41 41 SER HA H 41 4.550 4.550 4.735 -0.185 26022 3042 1 7 . 1 1 41 41 SER C C 41 174.656 174.656 175.621 -0.965 26022 3043 1 7 . 1 1 41 41 SER CA C 41 58.126 58.126 56.613 1.513 26022 3044 1 7 . 1 1 41 41 SER CB C 41 63.470 63.470 65.357 -1.887 26022 3045 1 7 . 1 1 41 41 SER H H 41 8.341 8.341 7.917 0.424 26022 3046 1 7 . 1 1 42 42 GLY N N 42 110.569 110.569 110.596 -0.027 26022 3047 1 7 . 1 1 42 42 GLY C C 42 173.829 173.829 175.506 -1.677 26022 3048 1 7 . 1 1 42 42 GLY CA C 42 45.257 45.257 47.203 -1.946 26022 3049 1 7 . 1 1 42 42 GLY H H 42 8.380 8.380 8.707 -0.327 26022 3050 1 7 . 1 1 43 43 LYS HA H 43 3.977 3.977 4.055 -0.078 26022 3051 1 7 . 1 1 43 43 LYS C C 43 179.363 179.363 178.608 0.755 26022 3052 1 7 . 1 1 43 43 LYS CA C 43 59.628 59.628 59.028 0.600 26022 3053 1 7 . 1 1 43 43 LYS CB C 43 32.510 32.510 32.384 0.126 26022 3054 1 7 . 1 1 44 44 VAL N N 44 120.404 120.404 118.730 1.674 26022 3055 1 7 . 1 1 44 44 VAL HA H 44 3.661 3.661 3.706 -0.045 26022 3056 1 7 . 1 1 44 44 VAL C C 44 179.785 179.785 178.955 0.830 26022 3057 1 7 . 1 1 44 44 VAL CA C 44 65.425 65.425 65.911 -0.486 26022 3058 1 7 . 1 1 44 44 VAL CB C 44 31.500 31.500 30.908 0.592 26022 3059 1 7 . 1 1 45 45 ARG N N 45 123.687 123.687 119.826 3.861 26022 3060 1 7 . 1 1 45 45 ARG HA H 45 4.054 4.054 4.076 -0.022 26022 3061 1 7 . 1 1 45 45 ARG C C 45 179.504 179.504 177.811 1.693 26022 3062 1 7 . 1 1 45 45 ARG CA C 45 59.669 59.669 58.942 0.727 26022 3063 1 7 . 1 1 45 45 ARG CB C 45 30.417 30.417 30.287 0.130 26022 3064 1 7 . 1 1 45 45 ARG H H 45 8.608 8.608 8.078 0.530 26022 3065 1 7 . 1 1 46 46 ARG N N 46 118.506 118.506 115.579 2.927 26022 3066 1 7 . 1 1 46 46 ARG HA H 46 4.148 4.148 4.306 -0.158 26022 3067 1 7 . 1 1 46 46 ARG C C 46 177.396 177.396 177.217 0.179 26022 3068 1 7 . 1 1 46 46 ARG CA C 46 58.481 58.481 57.410 1.071 26022 3069 1 7 . 1 1 46 46 ARG CB C 46 30.554 30.554 30.013 0.541 26022 3070 1 7 . 1 1 46 46 ARG H H 46 8.474 8.474 7.457 1.017 26022 3071 1 7 . 1 1 47 47 SER N N 47 114.263 114.263 113.587 0.676 26022 3072 1 7 . 1 1 47 47 SER HA H 47 4.393 4.393 4.377 0.016 26022 3073 1 7 . 1 1 47 47 SER C C 47 174.070 174.070 174.837 -0.767 26022 3074 1 7 . 1 1 47 47 SER CA C 47 59.696 59.696 59.411 0.285 26022 3075 1 7 . 1 1 47 47 SER CB C 47 64.013 64.013 63.467 0.546 26022 3076 1 7 . 1 1 47 47 SER H H 47 7.645 7.645 7.737 -0.092 26022 3077 1 7 . 1 1 48 48 LYS N N 48 115.405 115.405 118.154 -2.749 26022 3078 1 7 . 1 1 48 48 LYS HA H 48 3.990 3.990 4.016 -0.026 26022 3079 1 7 . 1 1 48 48 LYS C C 48 175.804 175.804 175.931 -0.127 26022 3080 1 7 . 1 1 48 48 LYS CA C 48 57.537 57.537 57.037 0.500 26022 3081 1 7 . 1 1 48 48 LYS CB C 48 29.947 29.947 30.370 -0.423 26022 3082 1 7 . 1 1 48 48 LYS H H 48 7.821 7.821 7.979 -0.158 26022 3083 1 7 . 1 1 49 49 ILE N N 49 117.265 117.265 115.944 1.321 26022 3084 1 7 . 1 1 49 49 ILE HA H 49 4.041 4.041 4.159 -0.118 26022 3085 1 7 . 1 1 49 49 ILE C C 49 175.125 175.125 176.101 -0.976 26022 3086 1 7 . 1 1 49 49 ILE CA C 49 61.315 61.315 60.439 0.876 26022 3087 1 7 . 1 1 49 49 ILE CB C 49 38.919 38.919 38.650 0.269 26022 3088 1 7 . 1 1 50 50 ARG N N 50 126.687 126.687 123.048 3.639 26022 3089 1 7 . 1 1 50 50 ARG HA H 50 4.471 4.471 4.592 -0.121 26022 3090 1 7 . 1 1 50 50 ARG C C 50 175.007 175.007 175.130 -0.123 26022 3091 1 7 . 1 1 50 50 ARG CA C 50 55.176 55.176 55.357 -0.181 26022 3092 1 7 . 1 1 50 50 ARG CB C 50 31.026 31.026 30.527 0.498 26022 3093 1 7 . 1 1 50 50 ARG H H 50 8.437 8.437 8.444 -0.007 26022 3094 1 7 . 1 1 51 51 ILE N N 51 127.722 127.722 127.403 0.319 26022 3095 1 7 . 1 1 51 51 ILE HA H 51 4.276 4.276 4.034 0.242 26022 3096 1 7 . 1 1 51 51 ILE C C 51 174.726 174.726 175.422 -0.696 26022 3097 1 7 . 1 1 51 51 ILE CA C 51 60.235 60.235 60.982 -0.747 26022 3098 1 7 . 1 1 51 51 ILE CB C 51 37.772 37.772 37.664 0.108 26022 3099 1 7 . 1 1 52 52 ILE N N 52 121.888 121.888 123.586 -1.698 26022 3100 1 7 . 1 1 52 52 ILE HA H 52 4.781 4.781 4.536 0.245 26022 3101 1 7 . 1 1 52 52 ILE C C 52 175.733 175.733 175.050 0.683 26022 3102 1 7 . 1 1 52 52 ILE CA C 52 59.021 59.021 59.039 -0.018 26022 3103 1 7 . 1 1 52 52 ILE CB C 52 42.089 42.089 40.319 1.770 26022 3104 1 7 . 1 1 53 53 ILE N N 53 119.363 119.363 123.458 -4.095 26022 3105 1 7 . 1 1 53 53 ILE HA H 53 3.338 3.338 3.802 -0.464 26022 3106 1 7 . 1 1 53 53 ILE C C 53 177.021 177.021 176.930 0.091 26022 3107 1 7 . 1 1 53 53 ILE CA C 53 64.274 64.274 62.481 1.793 26022 3108 1 7 . 1 1 53 53 ILE CB C 53 37.256 37.256 37.893 -0.637 26022 3109 1 7 . 1 1 54 54 GLY N N 54 116.136 116.136 115.623 0.513 26022 3110 1 7 . 1 1 54 54 GLY C C 54 174.844 174.844 173.456 1.388 26022 3111 1 7 . 1 1 54 54 GLY CA C 54 45.188 45.188 44.827 0.361 26022 3112 1 7 . 1 1 54 54 GLY H H 54 8.853 8.853 8.867 -0.014 26022 3113 1 7 . 1 1 55 55 ASP N N 55 121.946 121.946 120.837 1.109 26022 3114 1 7 . 1 1 55 55 ASP HA H 55 4.588 4.588 4.732 -0.144 26022 3115 1 7 . 1 1 55 55 ASP C C 55 175.804 175.804 175.483 0.321 26022 3116 1 7 . 1 1 55 55 ASP CA C 55 55.200 55.200 52.739 2.461 26022 3117 1 7 . 1 1 55 55 ASP CB C 55 41.048 41.048 42.482 -1.434 26022 3118 1 7 . 1 1 55 55 ASP H H 55 8.054 8.054 7.568 0.486 26022 3119 1 7 . 1 1 56 56 ARG N N 56 120.974 120.974 120.722 0.252 26022 3120 1 7 . 1 1 56 56 ARG HA H 56 5.200 5.200 4.668 0.532 26022 3121 1 7 . 1 1 56 56 ARG C C 56 176.483 176.483 176.358 0.125 26022 3122 1 7 . 1 1 56 56 ARG CA C 56 54.097 54.097 55.487 -1.390 26022 3123 1 7 . 1 1 56 56 ARG CB C 56 30.689 30.689 29.960 0.729 26022 3124 1 7 . 1 1 56 56 ARG H H 56 8.766 8.766 8.505 0.261 26022 3125 1 7 . 1 1 57 57 VAL N N 57 114.943 114.943 117.142 -2.199 26022 3126 1 7 . 1 1 57 57 VAL HA H 57 4.965 4.965 4.496 0.469 26022 3127 1 7 . 1 1 57 57 VAL C C 57 172.243 172.243 173.415 -1.172 26022 3128 1 7 . 1 1 57 57 VAL CA C 57 58.077 58.077 59.987 -1.911 26022 3129 1 7 . 1 1 57 57 VAL CB C 57 36.288 36.288 35.733 0.555 26022 3130 1 7 . 1 1 58 58 LEU N N 58 122.410 122.410 123.208 -0.798 26022 3131 1 7 . 1 1 58 58 LEU HA H 58 4.731 4.731 4.756 -0.025 26022 3132 1 7 . 1 1 58 58 LEU C C 58 174.773 174.773 174.364 0.409 26022 3133 1 7 . 1 1 58 58 LEU CA C 58 53.085 53.085 53.776 -0.691 26022 3134 1 7 . 1 1 58 58 LEU CB C 58 45.788 45.788 44.353 1.435 26022 3135 1 7 . 1 1 58 58 LEU H H 58 8.382 8.382 8.388 -0.006 26022 3136 1 7 . 1 1 59 59 VAL N N 59 127.937 127.937 126.951 0.986 26022 3137 1 7 . 1 1 59 59 VAL HA H 59 4.744 4.744 4.868 -0.124 26022 3138 1 7 . 1 1 59 59 VAL C C 59 174.141 174.141 173.417 0.724 26022 3139 1 7 . 1 1 59 59 VAL CA C 59 60.279 60.279 60.032 0.246 26022 3140 1 7 . 1 1 59 59 VAL CB C 59 34.399 34.399 35.158 -0.759 26022 3141 1 7 . 1 1 60 60 GLU N N 60 124.832 124.832 130.490 -5.658 26022 3142 1 7 . 1 1 60 60 GLU HA H 60 5.304 5.304 4.770 0.534 26022 3143 1 7 . 1 1 60 60 GLU C C 60 176.155 176.155 174.730 1.425 26022 3144 1 7 . 1 1 60 60 GLU CA C 60 54.164 54.164 54.861 -0.697 26022 3145 1 7 . 1 1 60 60 GLU CB C 60 33.803 33.803 31.615 2.188 26022 3146 1 7 . 1 1 60 60 GLU H H 60 9.142 9.142 9.099 0.043 26022 3147 1 7 . 1 1 61 61 MET N N 61 124.187 124.187 123.843 0.344 26022 3148 1 7 . 1 1 61 61 MET HA H 61 4.899 4.899 5.082 -0.183 26022 3149 1 7 . 1 1 61 61 MET C C 61 173.953 173.953 173.521 0.432 26022 3150 1 7 . 1 1 61 61 MET CA C 61 54.232 54.232 53.663 0.569 26022 3151 1 7 . 1 1 61 61 MET CB C 61 37.256 37.256 37.046 0.210 26022 3152 1 7 . 1 1 61 61 MET H H 61 8.984 8.984 8.344 0.640 26022 3153 1 7 . 1 1 62 62 SER N N 62 116.623 116.623 116.709 -0.086 26022 3154 1 7 . 1 1 62 62 SER HA H 62 4.263 4.263 4.727 -0.464 26022 3155 1 7 . 1 1 62 62 SER C C 62 176.413 176.413 174.451 1.962 26022 3156 1 7 . 1 1 62 62 SER CA C 62 56.893 56.893 58.187 -1.294 26022 3157 1 7 . 1 1 62 62 SER CB C 62 65.362 65.362 64.396 0.966 26022 3158 1 7 . 1 1 62 62 SER H H 62 9.167 9.167 8.690 0.477 26022 3159 1 7 . 1 1 63 63 ILE N N 63 121.187 121.187 122.533 -1.346 26022 3160 1 7 . 1 1 63 63 ILE HA H 63 3.989 3.989 3.985 0.004 26022 3161 1 7 . 1 1 63 63 ILE C C 63 176.623 176.623 177.150 -0.527 26022 3162 1 7 . 1 1 63 63 ILE CA C 63 63.878 63.878 59.566 4.312 26022 3163 1 7 . 1 1 63 63 ILE CB C 63 38.244 38.244 36.619 1.625 26022 3164 1 7 . 1 1 64 64 TYR N N 64 120.214 120.214 119.370 0.844 26022 3165 1 7 . 1 1 64 64 TYR HA H 64 4.432 4.432 4.151 0.281 26022 3166 1 7 . 1 1 64 64 TYR C C 64 177.092 177.092 176.760 0.332 26022 3167 1 7 . 1 1 64 64 TYR CA C 64 59.156 59.156 60.834 -1.678 26022 3168 1 7 . 1 1 64 64 TYR CB C 64 38.109 38.109 38.462 -0.353 26022 3169 1 7 . 1 1 64 64 TYR H H 64 7.762 7.762 8.101 -0.339 26022 3170 1 7 . 1 1 65 65 ASP N N 65 121.338 121.338 114.565 6.773 26022 3171 1 7 . 1 1 65 65 ASP HA H 65 4.495 4.495 4.683 -0.188 26022 3172 1 7 . 1 1 65 65 ASP C C 65 177.349 177.349 178.232 -0.883 26022 3173 1 7 . 1 1 65 65 ASP CA C 65 55.243 55.243 54.423 0.820 26022 3174 1 7 . 1 1 65 65 ASP CB C 65 40.538 40.538 41.337 -0.799 26022 3175 1 7 . 1 1 65 65 ASP H H 65 7.798 7.798 8.226 -0.428 26022 3176 1 7 . 1 1 66 66 ARG N N 66 121.118 121.118 120.650 0.468 26022 3177 1 7 . 1 1 66 66 ARG HA H 66 4.069 4.069 4.224 -0.155 26022 3178 1 7 . 1 1 66 66 ARG C C 66 178.448 178.448 177.374 1.074 26022 3179 1 7 . 1 1 66 66 ARG CA C 66 58.401 58.401 58.750 -0.349 26022 3180 1 7 . 1 1 66 66 ARG CB C 66 30.184 30.184 29.512 0.672 26022 3181 1 7 . 1 1 66 66 ARG H H 66 8.382 8.382 8.576 -0.194 26022 3182 1 7 . 1 1 67 67 ASN N N 67 117.334 117.334 118.093 -0.759 26022 3183 1 7 . 1 1 67 67 ASN HA H 67 4.601 4.601 5.214 -0.613 26022 3184 1 7 . 1 1 67 67 ASN C C 67 175.288 175.288 175.116 0.172 26022 3185 1 7 . 1 1 67 67 ASN CA C 67 54.097 54.097 55.073 -0.976 26022 3186 1 7 . 1 1 67 67 ASN CB C 67 38.514 38.514 38.216 0.298 26022 3187 1 7 . 1 1 67 67 ASN H H 67 8.194 8.194 8.559 -0.365 26022 3188 1 7 . 1 1 68 68 ALA N N 68 122.187 122.187 119.593 2.594 26022 3189 1 7 . 1 1 68 68 ALA HA H 68 4.575 4.575 4.320 0.255 26022 3190 1 7 . 1 1 68 68 ALA C C 68 176.272 176.272 177.879 -1.607 26022 3191 1 7 . 1 1 68 68 ALA CA C 68 52.478 52.478 53.516 -1.038 26022 3192 1 7 . 1 1 68 68 ALA CB C 68 19.086 19.086 18.761 0.325 26022 3193 1 7 . 1 1 68 68 ALA H H 68 7.658 7.658 7.503 0.155 26022 3194 1 7 . 1 1 69 69 LYS N N 69 116.931 116.931 116.198 0.733 26022 3195 1 7 . 1 1 69 69 LYS HA H 69 4.197 4.197 4.382 -0.185 26022 3196 1 7 . 1 1 69 69 LYS C C 69 176.085 176.085 176.097 -0.012 26022 3197 1 7 . 1 1 69 69 LYS CA C 69 56.728 56.728 57.478 -0.750 26022 3198 1 7 . 1 1 69 69 LYS CB C 69 31.566 31.566 34.345 -2.779 26022 3199 1 7 . 1 1 69 69 LYS H H 69 8.255 8.255 7.614 0.641 26022 3200 1 7 . 1 1 70 70 LYS N N 70 119.854 119.854 119.278 0.576 26022 3201 1 7 . 1 1 70 70 LYS HA H 70 5.526 5.526 5.539 -0.013 26022 3202 1 7 . 1 1 70 70 LYS C C 70 175.171 175.171 176.181 -1.010 26022 3203 1 7 . 1 1 70 70 LYS CA C 70 54.704 54.704 54.739 -0.035 26022 3204 1 7 . 1 1 70 70 LYS CB C 70 36.850 36.850 35.577 1.273 26022 3205 1 7 . 1 1 70 70 LYS H H 70 8.182 8.182 7.938 0.244 26022 3206 1 7 . 1 1 71 71 GLY N N 71 103.604 103.604 110.202 -6.598 26022 3207 1 7 . 1 1 71 71 GLY C C 71 171.541 171.541 172.493 -0.952 26022 3208 1 7 . 1 1 71 71 GLY CA C 71 45.462 45.462 43.187 2.275 26022 3209 1 7 . 1 1 71 71 GLY H H 71 7.780 7.780 8.255 -0.475 26022 3210 1 7 . 1 1 72 72 ARG N N 72 119.187 119.187 119.064 0.123 26022 3211 1 7 . 1 1 72 72 ARG HA H 72 4.861 4.861 5.474 -0.613 26022 3212 1 7 . 1 1 72 72 ARG C C 72 175.570 175.570 175.253 0.317 26022 3213 1 7 . 1 1 72 72 ARG CA C 72 53.624 53.624 54.562 -0.938 26022 3214 1 7 . 1 1 72 72 ARG CB C 72 34.129 34.129 31.979 2.150 26022 3215 1 7 . 1 1 72 72 ARG H H 72 8.007 8.007 8.522 -0.515 26022 3216 1 7 . 1 1 73 73 ILE N N 73 125.721 125.721 125.124 0.597 26022 3217 1 7 . 1 1 73 73 ILE HA H 73 4.263 4.263 5.073 -0.810 26022 3218 1 7 . 1 1 73 73 ILE C C 73 175.312 175.312 173.827 1.485 26022 3219 1 7 . 1 1 73 73 ILE CA C 73 62.259 62.259 58.768 3.491 26022 3220 1 7 . 1 1 73 73 ILE CB C 73 39.423 39.423 41.350 -1.927 26022 3221 1 7 . 1 1 74 74 ILE N N 74 120.540 120.540 127.085 -6.545 26022 3222 1 7 . 1 1 74 74 ILE HA H 74 4.596 4.596 4.237 0.359 26022 3223 1 7 . 1 1 74 74 ILE C C 74 176.249 176.249 173.854 2.395 26022 3224 1 7 . 1 1 74 74 ILE CA C 74 60.910 60.910 60.775 0.135 26022 3225 1 7 . 1 1 74 74 ILE CB C 74 39.863 39.863 40.475 -0.612 26022 3226 1 7 . 1 1 75 75 ARG N N 75 118.582 118.582 116.703 1.879 26022 3227 1 7 . 1 1 75 75 ARG HA H 75 4.289 4.289 4.248 0.041 26022 3228 1 7 . 1 1 75 75 ARG C C 75 173.883 173.883 174.090 -0.207 26022 3229 1 7 . 1 1 75 75 ARG CA C 75 56.390 56.390 55.438 0.952 26022 3230 1 7 . 1 1 75 75 ARG CB C 75 34.669 34.669 32.115 2.554 26022 3231 1 7 . 1 1 75 75 ARG H H 75 7.397 7.397 7.739 -0.342 26022 3232 1 7 . 1 1 76 76 ARG N N 76 125.606 125.606 121.522 4.084 26022 3233 1 7 . 1 1 76 76 ARG HA H 76 4.609 4.609 4.283 0.326 26022 3234 1 7 . 1 1 76 76 ARG C C 76 175.312 175.312 176.067 -0.755 26022 3235 1 7 . 1 1 76 76 ARG CA C 76 55.810 55.810 55.782 0.028 26022 3236 1 7 . 1 1 76 76 ARG CB C 76 31.094 31.094 30.780 0.314 26022 3237 1 7 . 1 1 76 76 ARG H H 76 9.094 9.094 8.240 0.854 26022 3238 1 7 . 1 1 77 77 LEU N N 77 128.575 128.575 123.585 4.990 26022 3239 1 7 . 1 1 77 77 LEU HA H 77 4.372 4.372 4.262 0.110 26022 3240 1 7 . 1 1 77 77 LEU C C 77 176.225 176.225 176.893 -0.668 26022 3241 1 7 . 1 1 77 77 LEU CA C 77 54.704 54.704 54.868 -0.164 26022 3242 1 7 . 1 1 77 77 LEU CB C 77 42.292 42.292 42.686 -0.394 26022 3243 1 7 . 1 1 77 77 LEU H H 77 8.742 8.742 8.296 0.446 26022 3244 1 7 . 1 1 78 78 LYS N N 78 119.592 119.592 121.821 -2.229 26022 3245 1 7 . 1 1 78 78 LYS HA H 78 4.302 4.302 4.167 0.135 26022 3246 1 7 . 1 1 78 78 LYS C C 78 176.296 176.296 177.197 -0.901 26022 3247 1 7 . 1 1 78 78 LYS CA C 78 56.390 56.390 56.477 -0.087 26022 3248 1 7 . 1 1 78 78 LYS CB C 78 33.994 33.994 31.478 2.516 26022 3249 1 7 . 1 1 78 78 LYS H H 78 8.090 8.090 8.401 -0.311 26022 3250 1 7 . 1 1 79 79 GLY N N 79 110.854 110.854 113.265 -2.411 26022 3251 1 7 . 1 1 79 79 GLY C C 79 174.328 174.328 174.032 0.296 26022 3252 1 7 . 1 1 79 79 GLY CA C 79 44.990 44.990 44.760 0.230 26022 3253 1 7 . 1 1 79 79 GLY H H 79 8.520 8.520 8.121 0.399 26022 3254 1 7 . 1 1 80 80 THR N N 80 114.187 114.187 108.850 5.337 26022 3255 1 7 . 1 1 80 80 THR HA H 80 4.237 4.237 4.009 0.228 26022 3256 1 7 . 1 1 80 80 THR C C 80 175.054 175.054 174.955 0.099 26022 3257 1 7 . 1 1 80 80 THR CA C 80 62.242 62.242 63.095 -0.853 26022 3258 1 7 . 1 1 80 80 THR CB C 80 69.826 69.826 67.529 2.297 26022 3259 1 7 . 1 1 81 81 SER N N 81 117.958 117.958 113.563 4.395 26022 3260 1 7 . 1 1 81 81 SER HA H 81 4.449 4.449 4.174 0.275 26022 3261 1 7 . 1 1 81 81 SER C C 81 174.703 174.703 175.355 -0.652 26022 3262 1 7 . 1 1 81 81 SER CA C 81 58.481 58.481 60.107 -1.626 26022 3263 1 7 . 1 1 81 81 SER CB C 81 63.338 63.338 63.045 0.293 26022 3264 1 7 . 1 1 81 81 SER H H 81 8.474 8.474 8.098 0.376 26022 3265 1 7 . 1 1 82 82 ASP HA H 82 4.280 4.280 4.445 -0.165 26022 3266 1 7 . 1 1 82 82 ASP C C 82 177.115 177.115 176.475 0.640 26022 3267 1 7 . 1 1 82 82 ASP CA C 82 55.176 55.176 55.622 -0.446 26022 3268 1 7 . 1 1 82 82 ASP CB C 82 42.359 42.359 41.159 1.200 26022 3269 1 7 . 1 1 83 83 ARG N N 83 121.531 121.531 114.956 6.575 26022 3270 1 7 . 1 1 83 83 ARG HA H 83 4.346 4.346 4.265 0.081 26022 3271 1 7 . 1 1 83 83 ARG C C 83 176.342 176.342 175.223 1.119 26022 3272 1 7 . 1 1 83 83 ARG CA C 83 56.053 56.053 56.792 -0.739 26022 3273 1 7 . 1 1 83 83 ARG CB C 83 30.891 30.891 30.655 0.236 26022 3274 1 7 . 1 1 83 83 ARG H H 83 8.259 8.259 8.050 0.209 26022 3275 1 7 . 1 1 84 84 THR N N 84 116.462 116.462 113.972 2.490 26022 3276 1 7 . 1 1 84 84 THR HA H 84 4.333 4.333 4.396 -0.063 26022 3277 1 7 . 1 1 84 84 THR C C 84 174.445 174.445 174.798 -0.353 26022 3278 1 7 . 1 1 84 84 THR CA C 84 62.254 62.254 61.845 0.409 26022 3279 1 7 . 1 1 84 84 THR CB C 84 69.833 69.833 70.348 -0.515 26022 3280 1 7 . 1 1 85 85 ILE N N 85 123.762 123.762 117.700 6.062 26022 3281 1 7 . 1 1 85 85 ILE HA H 85 4.188 4.188 3.904 0.284 26022 3282 1 7 . 1 1 85 85 ILE C C 85 176.155 176.155 175.558 0.597 26022 3283 1 7 . 1 1 85 85 ILE CA C 85 61.112 61.112 62.357 -1.245 26022 3284 1 7 . 1 1 85 85 ILE CB C 85 38.919 38.919 35.768 3.151 26022 3285 1 7 . 1 1 86 86 SER N N 86 120.214 120.214 113.478 6.736 26022 3286 1 7 . 1 1 86 86 SER HA H 86 4.451 4.451 4.378 0.073 26022 3287 1 7 . 1 1 86 86 SER C C 86 174.586 174.586 174.800 -0.214 26022 3288 1 7 . 1 1 86 86 SER CA C 86 58.212 58.212 58.416 -0.204 26022 3289 1 7 . 1 1 86 86 SER CB C 86 63.271 63.271 63.943 -0.672 26022 3290 1 7 . 1 1 86 86 SER H H 86 8.377 8.377 7.946 0.431 26022 3291 1 8 . 1 1 2 2 VAL N N 2 122.187 122.187 124.850 -2.663 26022 3292 1 8 . 1 1 2 2 VAL HA H 2 4.091 4.091 4.105 -0.014 26022 3293 1 8 . 1 1 2 2 VAL C C 2 175.921 175.921 175.935 -0.014 26022 3294 1 8 . 1 1 2 2 VAL CA C 2 62.057 62.057 62.444 -0.387 26022 3295 1 8 . 1 1 2 2 VAL CB C 2 32.848 32.848 31.904 0.944 26022 3296 1 8 . 1 1 3 3 LYS N N 3 125.437 125.437 130.199 -4.762 26022 3297 1 8 . 1 1 3 3 LYS HA H 3 4.289 4.289 4.681 -0.392 26022 3298 1 8 . 1 1 3 3 LYS C C 3 176.155 176.155 175.260 0.895 26022 3299 1 8 . 1 1 3 3 LYS CA C 3 56.323 56.323 56.154 0.169 26022 3300 1 8 . 1 1 3 3 LYS CB C 3 33.320 33.320 32.767 0.553 26022 3301 1 8 . 1 1 3 3 LYS H H 3 8.396 8.396 8.624 -0.228 26022 3302 1 8 . 1 1 4 4 ASP N N 4 121.937 121.937 120.456 1.481 26022 3303 1 8 . 1 1 4 4 ASP HA H 4 4.289 4.289 4.894 -0.605 26022 3304 1 8 . 1 1 4 4 ASP C C 4 176.319 176.319 177.485 -1.166 26022 3305 1 8 . 1 1 4 4 ASP CA C 4 54.029 54.029 55.044 -1.015 26022 3306 1 8 . 1 1 4 4 ASP CB C 4 41.280 41.280 41.683 -0.403 26022 3307 1 8 . 1 1 4 4 ASP H H 4 8.325 8.325 8.488 -0.163 26022 3308 1 8 . 1 1 5 5 GLU N N 5 122.369 122.369 122.178 0.191 26022 3309 1 8 . 1 1 5 5 GLU HA H 5 4.250 4.250 4.117 0.133 26022 3310 1 8 . 1 1 5 5 GLU C C 5 177.045 177.045 177.199 -0.154 26022 3311 1 8 . 1 1 5 5 GLU CA C 5 56.930 56.930 58.713 -1.783 26022 3312 1 8 . 1 1 5 5 GLU CB C 5 30.554 30.554 29.374 1.180 26022 3313 1 8 . 1 1 5 5 GLU H H 5 8.464 8.464 8.708 -0.244 26022 3314 1 8 . 1 1 6 6 LYS N N 6 121.437 121.437 116.901 4.536 26022 3315 1 8 . 1 1 6 6 LYS HA H 6 4.282 4.282 4.448 -0.166 26022 3316 1 8 . 1 1 6 6 LYS C C 6 177.185 177.185 175.323 1.862 26022 3317 1 8 . 1 1 6 6 LYS CA C 6 56.930 56.930 55.476 1.454 26022 3318 1 8 . 1 1 6 6 LYS CB C 6 32.713 32.713 32.381 0.332 26022 3319 1 8 . 1 1 6 6 LYS H H 6 8.390 8.390 8.108 0.282 26022 3320 1 8 . 1 1 7 7 SER N N 7 115.822 115.822 112.052 3.770 26022 3321 1 8 . 1 1 7 7 SER HA H 7 4.396 4.396 4.790 -0.394 26022 3322 1 8 . 1 1 7 7 SER C C 7 174.609 174.609 174.738 -0.129 26022 3323 1 8 . 1 1 7 7 SER CA C 7 58.684 58.684 57.594 1.090 26022 3324 1 8 . 1 1 7 7 SER CB C 7 63.608 63.608 63.487 0.121 26022 3325 1 8 . 1 1 7 7 SER H H 7 8.205 8.205 7.738 0.467 26022 3326 1 8 . 1 1 8 8 LYS N N 8 122.643 122.643 120.472 2.171 26022 3327 1 8 . 1 1 8 8 LYS HA H 8 4.407 4.407 4.301 0.106 26022 3328 1 8 . 1 1 8 8 LYS C C 8 176.694 176.694 176.410 0.284 26022 3329 1 8 . 1 1 8 8 LYS CA C 8 56.390 56.390 57.032 -0.642 26022 3330 1 8 . 1 1 8 8 LYS CB C 8 33.185 33.185 32.275 0.910 26022 3331 1 8 . 1 1 8 8 LYS H H 8 8.201 8.201 8.488 -0.287 26022 3332 1 8 . 1 1 9 9 THR N N 9 113.900 113.900 114.372 -0.472 26022 3333 1 8 . 1 1 9 9 THR HA H 9 4.341 4.341 4.443 -0.102 26022 3334 1 8 . 1 1 9 9 THR C C 9 173.438 173.438 172.894 0.544 26022 3335 1 8 . 1 1 9 9 THR CA C 9 62.529 62.529 61.706 0.823 26022 3336 1 8 . 1 1 9 9 THR CB C 9 69.342 69.342 67.399 1.943 26022 3337 1 8 . 1 1 10 10 LEU N N 10 124.082 124.082 121.796 2.286 26022 3338 1 8 . 1 1 10 10 LEU HA H 10 4.858 4.858 4.787 0.071 26022 3339 1 8 . 1 1 10 10 LEU C C 10 175.804 175.804 174.413 1.391 26022 3340 1 8 . 1 1 10 10 LEU CA C 10 53.759 53.759 53.398 0.361 26022 3341 1 8 . 1 1 10 10 LEU CB C 10 44.653 44.653 45.046 -0.393 26022 3342 1 8 . 1 1 10 10 LEU H H 10 7.786 7.786 7.572 0.214 26022 3343 1 8 . 1 1 11 11 PHE N N 11 120.942 120.942 120.084 0.858 26022 3344 1 8 . 1 1 11 11 PHE HA H 11 4.862 4.862 4.888 -0.026 26022 3345 1 8 . 1 1 11 11 PHE C C 11 173.578 173.578 173.847 -0.269 26022 3346 1 8 . 1 1 11 11 PHE CA C 11 56.120 56.120 56.889 -0.769 26022 3347 1 8 . 1 1 11 11 PHE CB C 11 41.212 41.212 43.280 -2.068 26022 3348 1 8 . 1 1 11 11 PHE H H 11 8.889 8.889 8.889 -0.000 26022 3349 1 8 . 1 1 12 12 GLU N N 12 119.958 119.958 124.771 -4.813 26022 3350 1 8 . 1 1 12 12 GLU HA H 12 5.539 5.539 4.913 0.626 26022 3351 1 8 . 1 1 12 12 GLU C C 12 176.295 176.295 175.148 1.147 26022 3352 1 8 . 1 1 12 12 GLU CA C 12 54.501 54.501 55.085 -0.584 26022 3353 1 8 . 1 1 12 12 GLU CB C 12 31.768 31.768 31.001 0.767 26022 3354 1 8 . 1 1 12 12 GLU H H 12 8.285 8.285 7.792 0.493 26022 3355 1 8 . 1 1 13 13 VAL N N 13 120.742 120.742 125.632 -4.890 26022 3356 1 8 . 1 1 13 13 VAL HA H 13 4.570 4.570 4.457 0.113 26022 3357 1 8 . 1 1 13 13 VAL C C 13 173.415 173.415 174.921 -1.506 26022 3358 1 8 . 1 1 13 13 VAL CA C 13 59.696 59.696 60.816 -1.120 26022 3359 1 8 . 1 1 13 13 VAL CB C 13 36.018 36.018 34.749 1.268 26022 3360 1 8 . 1 1 14 14 GLU N N 14 122.848 122.848 125.328 -2.480 26022 3361 1 8 . 1 1 14 14 GLU HA H 14 5.226 5.226 4.862 0.364 26022 3362 1 8 . 1 1 14 14 GLU C C 14 176.295 176.295 176.022 0.273 26022 3363 1 8 . 1 1 14 14 GLU CA C 14 55.243 55.243 55.934 -0.691 26022 3364 1 8 . 1 1 14 14 GLU CB C 14 32.173 32.173 30.899 1.274 26022 3365 1 8 . 1 1 14 14 GLU H H 14 8.492 8.492 8.870 -0.378 26022 3366 1 8 . 1 1 15 15 GLY N N 15 105.005 105.005 111.152 -6.147 26022 3367 1 8 . 1 1 15 15 GLY C C 15 170.393 170.393 172.404 -2.011 26022 3368 1 8 . 1 1 15 15 GLY CA C 15 46.002 46.002 45.347 0.655 26022 3369 1 8 . 1 1 15 15 GLY H H 15 8.454 8.454 8.858 -0.404 26022 3370 1 8 . 1 1 16 16 ALA N N 16 120.909 120.909 126.399 -5.490 26022 3371 1 8 . 1 1 16 16 ALA HA H 16 5.526 5.526 4.995 0.531 26022 3372 1 8 . 1 1 16 16 ALA C C 16 176.834 176.834 176.370 0.464 26022 3373 1 8 . 1 1 16 16 ALA CA C 16 49.644 49.644 50.524 -0.880 26022 3374 1 8 . 1 1 16 16 ALA CB C 16 22.054 22.054 21.042 1.012 26022 3375 1 8 . 1 1 16 16 ALA H H 16 8.206 8.206 8.613 -0.407 26022 3376 1 8 . 1 1 17 17 VAL N N 17 122.567 122.567 119.496 3.071 26022 3377 1 8 . 1 1 17 17 VAL HA H 17 4.380 4.380 4.090 0.290 26022 3378 1 8 . 1 1 17 17 VAL C C 17 178.099 178.099 175.930 2.169 26022 3379 1 8 . 1 1 17 17 VAL CA C 17 63.608 63.608 63.200 0.408 26022 3380 1 8 . 1 1 17 17 VAL CB C 17 32.105 32.105 32.826 -0.721 26022 3381 1 8 . 1 1 18 18 THR N N 18 120.937 120.937 124.650 -3.713 26022 3382 1 8 . 1 1 18 18 THR HA H 18 4.601 4.601 4.495 0.106 26022 3383 1 8 . 1 1 18 18 THR C C 18 175.312 175.312 173.557 1.755 26022 3384 1 8 . 1 1 18 18 THR CA C 18 61.517 61.517 61.876 -0.359 26022 3385 1 8 . 1 1 18 18 THR CB C 18 69.814 69.814 70.246 -0.432 26022 3386 1 8 . 1 1 19 19 ALA N N 19 121.258 121.258 122.759 -1.501 26022 3387 1 8 . 1 1 19 19 ALA HA H 19 4.458 4.458 4.681 -0.223 26022 3388 1 8 . 1 1 19 19 ALA C C 19 174.703 174.703 174.612 0.091 26022 3389 1 8 . 1 1 19 19 ALA CA C 19 53.017 53.017 51.789 1.228 26022 3390 1 8 . 1 1 19 19 ALA CB C 19 22.054 22.054 21.310 0.744 26022 3391 1 8 . 1 1 19 19 ALA H H 19 7.716 7.716 7.997 -0.281 26022 3392 1 8 . 1 1 20 20 LEU N N 20 123.420 123.420 116.665 6.755 26022 3393 1 8 . 1 1 20 20 LEU HA H 20 4.393 4.393 4.921 -0.528 26022 3394 1 8 . 1 1 20 20 LEU C C 20 175.499 175.499 174.539 0.960 26022 3395 1 8 . 1 1 20 20 LEU CA C 20 54.839 54.839 53.478 1.361 26022 3396 1 8 . 1 1 20 20 LEU CB C 20 41.212 41.212 45.849 -4.637 26022 3397 1 8 . 1 1 20 20 LEU H H 20 8.711 8.711 8.293 0.418 26022 3398 1 8 . 1 1 21 21 LEU N N 21 124.718 124.718 122.062 2.656 26022 3399 1 8 . 1 1 21 21 LEU HA H 21 4.714 4.714 4.982 -0.268 26022 3400 1 8 . 1 1 21 21 LEU C C 21 174.328 174.328 174.692 -0.364 26022 3401 1 8 . 1 1 21 21 LEU CA C 21 52.680 52.680 51.223 1.457 26022 3402 1 8 . 1 1 21 21 LEU CB C 21 41.684 41.684 44.856 -3.172 26022 3403 1 8 . 1 1 21 21 LEU H H 21 7.773 7.773 8.506 -0.733 26022 3404 1 8 . 1 1 22 22 PRO HA H 22 4.380 4.380 4.321 0.059 26022 3405 1 8 . 1 1 22 22 PRO C C 22 175.616 175.616 175.777 -0.161 26022 3406 1 8 . 1 1 22 22 PRO CA C 22 62.529 62.529 64.274 -1.745 26022 3407 1 8 . 1 1 22 22 PRO CB C 22 32.240 32.240 30.938 1.302 26022 3408 1 8 . 1 1 23 23 ALA N N 23 120.693 120.693 120.118 0.575 26022 3409 1 8 . 1 1 23 23 ALA HA H 23 4.302 4.302 4.351 -0.049 26022 3410 1 8 . 1 1 23 23 ALA C C 23 176.178 176.178 176.703 -0.525 26022 3411 1 8 . 1 1 23 23 ALA CA C 23 52.882 52.882 51.291 1.591 26022 3412 1 8 . 1 1 23 23 ALA CB C 23 17.336 17.336 18.317 -0.981 26022 3413 1 8 . 1 1 23 23 ALA H H 23 8.675 8.675 7.578 1.097 26022 3414 1 8 . 1 1 24 24 ALA N N 24 115.540 115.540 120.373 -4.833 26022 3415 1 8 . 1 1 24 24 ALA HA H 24 3.820 3.820 3.741 0.079 26022 3416 1 8 . 1 1 24 24 ALA C C 24 175.546 175.546 176.160 -0.614 26022 3417 1 8 . 1 1 24 24 ALA CA C 24 52.613 52.613 52.782 -0.169 26022 3418 1 8 . 1 1 24 24 ALA CB C 24 16.590 16.590 17.389 -0.799 26022 3419 1 8 . 1 1 24 24 ALA H H 24 8.381 8.381 8.052 0.329 26022 3420 1 8 . 1 1 25 25 GLU N N 25 114.082 114.082 117.822 -3.740 26022 3421 1 8 . 1 1 25 25 GLU HA H 25 5.148 5.148 4.971 0.177 26022 3422 1 8 . 1 1 25 25 GLU C C 25 175.757 175.757 174.449 1.308 26022 3423 1 8 . 1 1 25 25 GLU CA C 25 54.911 54.911 54.103 0.808 26022 3424 1 8 . 1 1 25 25 GLU CB C 25 32.645 32.645 32.263 0.382 26022 3425 1 8 . 1 1 25 25 GLU H H 25 6.378 6.378 7.444 -1.066 26022 3426 1 8 . 1 1 26 26 PHE N N 26 117.365 117.365 124.185 -6.820 26022 3427 1 8 . 1 1 26 26 PHE HA H 26 4.979 4.979 4.863 0.116 26022 3428 1 8 . 1 1 26 26 PHE C C 26 174.960 174.960 174.452 0.508 26022 3429 1 8 . 1 1 26 26 PHE CA C 26 56.862 56.862 57.012 -0.150 26022 3430 1 8 . 1 1 26 26 PHE CB C 26 43.371 43.371 42.285 1.087 26022 3431 1 8 . 1 1 26 26 PHE H H 26 8.950 8.950 9.296 -0.346 26022 3432 1 8 . 1 1 27 27 ARG N N 27 125.082 125.082 123.538 1.544 26022 3433 1 8 . 1 1 27 27 ARG HA H 27 4.992 4.992 5.343 -0.351 26022 3434 1 8 . 1 1 27 27 ARG C C 27 175.148 175.148 175.477 -0.329 26022 3435 1 8 . 1 1 27 27 ARG CA C 27 56.323 56.323 54.934 1.389 26022 3436 1 8 . 1 1 27 27 ARG CB C 27 32.240 32.240 31.805 0.435 26022 3437 1 8 . 1 1 27 27 ARG H H 27 8.799 8.799 9.262 -0.463 26022 3438 1 8 . 1 1 28 28 VAL N N 28 127.456 127.456 120.623 6.833 26022 3439 1 8 . 1 1 28 28 VAL HA H 28 4.757 4.757 4.862 -0.105 26022 3440 1 8 . 1 1 28 28 VAL C C 28 173.602 173.602 174.342 -0.740 26022 3441 1 8 . 1 1 28 28 VAL CA C 28 60.303 60.303 59.901 0.402 26022 3442 1 8 . 1 1 28 28 VAL CB C 28 35.681 35.681 34.484 1.197 26022 3443 1 8 . 1 1 29 29 LYS N N 29 128.096 128.096 121.869 6.227 26022 3444 1 8 . 1 1 29 29 LYS HA H 29 4.354 4.354 5.081 -0.727 26022 3445 1 8 . 1 1 29 29 LYS C C 29 176.740 176.740 174.689 2.051 26022 3446 1 8 . 1 1 29 29 LYS CA C 29 55.041 55.041 53.705 1.336 26022 3447 1 8 . 1 1 29 29 LYS CB C 29 34.062 34.062 34.970 -0.908 26022 3448 1 8 . 1 1 29 29 LYS H H 29 9.268 9.268 8.722 0.546 26022 3449 1 8 . 1 1 30 30 LEU N N 30 129.600 129.600 125.121 4.479 26022 3450 1 8 . 1 1 30 30 LEU HA H 30 4.653 4.653 4.489 0.164 26022 3451 1 8 . 1 1 30 30 LEU C C 30 178.193 178.193 177.685 0.508 26022 3452 1 8 . 1 1 30 30 LEU CA C 30 54.771 54.771 55.068 -0.297 26022 3453 1 8 . 1 1 30 30 LEU CB C 30 42.224 42.224 43.915 -1.691 26022 3454 1 8 . 1 1 30 30 LEU H H 30 9.000 9.000 8.893 0.107 26022 3455 1 8 . 1 1 31 31 ASP N N 31 120.478 120.478 123.799 -3.321 26022 3456 1 8 . 1 1 31 31 ASP HA H 31 4.458 4.458 4.429 0.029 26022 3457 1 8 . 1 1 31 31 ASP C C 31 176.155 176.155 176.206 -0.051 26022 3458 1 8 . 1 1 31 31 ASP CA C 31 55.918 55.918 56.431 -0.513 26022 3459 1 8 . 1 1 31 31 ASP CB C 31 39.593 39.593 40.938 -1.345 26022 3460 1 8 . 1 1 31 31 ASP H H 31 8.698 8.698 8.822 -0.124 26022 3461 1 8 . 1 1 32 32 ASN N N 32 115.450 115.450 117.609 -2.159 26022 3462 1 8 . 1 1 32 32 ASN HA H 32 4.588 4.588 4.698 -0.110 26022 3463 1 8 . 1 1 32 32 ASN C C 32 175.335 175.335 174.961 0.374 26022 3464 1 8 . 1 1 32 32 ASN CA C 32 53.152 53.152 52.946 0.206 26022 3465 1 8 . 1 1 32 32 ASN CB C 32 37.367 37.367 38.220 -0.853 26022 3466 1 8 . 1 1 32 32 ASN H H 32 7.680 7.680 7.980 -0.300 26022 3467 1 8 . 1 1 33 33 GLU N N 33 111.790 111.790 116.658 -4.868 26022 3468 1 8 . 1 1 33 33 GLU HA H 33 3.898 3.898 3.937 -0.039 26022 3469 1 8 . 1 1 33 33 GLU C C 33 175.733 175.733 174.434 1.299 26022 3470 1 8 . 1 1 33 33 GLU CA C 33 58.144 58.144 57.654 0.490 26022 3471 1 8 . 1 1 33 33 GLU CB C 33 28.242 28.242 28.226 0.016 26022 3472 1 8 . 1 1 33 33 GLU H H 33 8.097 8.097 7.714 0.383 26022 3473 1 8 . 1 1 34 34 HIS N N 34 119.193 119.193 118.726 0.467 26022 3474 1 8 . 1 1 34 34 HIS HA H 34 4.201 4.201 4.848 -0.647 26022 3475 1 8 . 1 1 34 34 HIS C C 34 173.789 173.789 173.330 0.459 26022 3476 1 8 . 1 1 34 34 HIS CA C 34 56.053 56.053 55.497 0.556 26022 3477 1 8 . 1 1 34 34 HIS CB C 34 30.487 30.487 32.296 -1.809 26022 3478 1 8 . 1 1 34 34 HIS H H 34 7.890 7.890 7.722 0.168 26022 3479 1 8 . 1 1 35 35 GLU HA H 35 5.400 5.400 5.188 0.212 26022 3480 1 8 . 1 1 35 35 GLU C C 35 175.944 175.944 175.344 0.600 26022 3481 1 8 . 1 1 35 35 GLU CA C 35 55.109 55.109 55.325 -0.216 26022 3482 1 8 . 1 1 35 35 GLU CB C 35 32.308 32.308 31.425 0.883 26022 3483 1 8 . 1 1 36 36 ILE N N 36 119.077 119.077 123.888 -4.811 26022 3484 1 8 . 1 1 36 36 ILE HA H 36 4.686 4.686 4.483 0.203 26022 3485 1 8 . 1 1 36 36 ILE C C 36 173.790 173.790 175.605 -1.815 26022 3486 1 8 . 1 1 36 36 ILE CA C 36 59.156 59.156 60.026 -0.871 26022 3487 1 8 . 1 1 36 36 ILE CB C 36 42.696 42.696 41.751 0.945 26022 3488 1 8 . 1 1 37 37 ILE N N 37 122.787 122.787 128.393 -5.606 26022 3489 1 8 . 1 1 37 37 ILE HA H 37 4.778 4.778 4.153 0.625 26022 3490 1 8 . 1 1 37 37 ILE C C 37 177.057 177.057 175.359 1.698 26022 3491 1 8 . 1 1 37 37 ILE CA C 37 59.723 59.723 62.043 -2.320 26022 3492 1 8 . 1 1 37 37 ILE CB C 37 37.949 37.949 36.848 1.101 26022 3493 1 8 . 1 1 38 38 CYS N N 38 122.357 122.357 126.599 -4.242 26022 3494 1 8 . 1 1 38 38 CYS HA H 38 5.708 5.708 5.273 0.435 26022 3495 1 8 . 1 1 38 38 CYS C C 38 174.258 174.258 173.575 0.683 26022 3496 1 8 . 1 1 38 38 CYS CA C 38 56.930 56.930 57.068 -0.138 26022 3497 1 8 . 1 1 38 38 CYS CB C 38 33.252 33.252 31.302 1.950 26022 3498 1 8 . 1 1 38 38 CYS H H 38 9.512 9.512 9.122 0.390 26022 3499 1 8 . 1 1 39 39 HIS N N 39 117.101 117.101 115.533 1.568 26022 3500 1 8 . 1 1 39 39 HIS HA H 39 5.526 5.526 5.227 0.299 26022 3501 1 8 . 1 1 39 39 HIS C C 39 174.516 174.516 173.573 0.943 26022 3502 1 8 . 1 1 39 39 HIS CA C 39 54.097 54.097 54.889 -0.792 26022 3503 1 8 . 1 1 39 39 HIS CB C 39 31.701 31.701 32.251 -0.550 26022 3504 1 8 . 1 1 39 39 HIS H H 39 7.597 7.597 9.108 -1.511 26022 3505 1 8 . 1 1 40 40 VAL N N 40 117.923 117.923 118.439 -0.516 26022 3506 1 8 . 1 1 40 40 VAL HA H 40 4.614 4.614 4.441 0.173 26022 3507 1 8 . 1 1 40 40 VAL C C 40 175.804 175.804 175.997 -0.193 26022 3508 1 8 . 1 1 40 40 VAL CA C 40 61.382 61.382 62.186 -0.804 26022 3509 1 8 . 1 1 40 40 VAL CB C 40 33.396 33.396 31.780 1.615 26022 3510 1 8 . 1 1 41 41 SER N N 41 119.242 119.242 120.222 -0.980 26022 3511 1 8 . 1 1 41 41 SER HA H 41 4.550 4.550 4.696 -0.146 26022 3512 1 8 . 1 1 41 41 SER C C 41 174.656 174.656 173.441 1.215 26022 3513 1 8 . 1 1 41 41 SER CA C 41 58.126 58.126 58.115 0.011 26022 3514 1 8 . 1 1 41 41 SER CB C 41 63.470 63.470 64.071 -0.601 26022 3515 1 8 . 1 1 41 41 SER H H 41 8.341 8.341 8.708 -0.367 26022 3516 1 8 . 1 1 42 42 GLY N N 42 110.569 110.569 111.161 -0.592 26022 3517 1 8 . 1 1 42 42 GLY C C 42 173.829 173.829 174.137 -0.308 26022 3518 1 8 . 1 1 42 42 GLY CA C 42 45.257 45.257 45.849 -0.592 26022 3519 1 8 . 1 1 42 42 GLY H H 42 8.380 8.380 7.773 0.607 26022 3520 1 8 . 1 1 43 43 LYS HA H 43 3.977 3.977 4.173 -0.196 26022 3521 1 8 . 1 1 43 43 LYS C C 43 179.363 179.363 178.284 1.079 26022 3522 1 8 . 1 1 43 43 LYS CA C 43 59.628 59.628 58.356 1.272 26022 3523 1 8 . 1 1 43 43 LYS CB C 43 32.510 32.510 32.566 -0.056 26022 3524 1 8 . 1 1 44 44 VAL N N 44 120.404 120.404 119.599 0.805 26022 3525 1 8 . 1 1 44 44 VAL HA H 44 3.661 3.661 3.727 -0.066 26022 3526 1 8 . 1 1 44 44 VAL C C 44 179.785 179.785 177.165 2.620 26022 3527 1 8 . 1 1 44 44 VAL CA C 44 65.425 65.425 65.039 0.386 26022 3528 1 8 . 1 1 44 44 VAL CB C 44 31.500 31.500 31.537 -0.037 26022 3529 1 8 . 1 1 45 45 ARG N N 45 123.687 123.687 119.527 4.160 26022 3530 1 8 . 1 1 45 45 ARG HA H 45 4.054 4.054 4.119 -0.065 26022 3531 1 8 . 1 1 45 45 ARG C C 45 179.504 179.504 177.661 1.843 26022 3532 1 8 . 1 1 45 45 ARG CA C 45 59.669 59.669 58.897 0.772 26022 3533 1 8 . 1 1 45 45 ARG CB C 45 30.417 30.417 30.255 0.162 26022 3534 1 8 . 1 1 45 45 ARG H H 45 8.608 8.608 7.708 0.900 26022 3535 1 8 . 1 1 46 46 ARG N N 46 118.506 118.506 115.977 2.529 26022 3536 1 8 . 1 1 46 46 ARG HA H 46 4.148 4.148 4.402 -0.254 26022 3537 1 8 . 1 1 46 46 ARG C C 46 177.396 177.396 177.778 -0.382 26022 3538 1 8 . 1 1 46 46 ARG CA C 46 58.481 58.481 57.709 0.772 26022 3539 1 8 . 1 1 46 46 ARG CB C 46 30.554 30.554 30.226 0.328 26022 3540 1 8 . 1 1 46 46 ARG H H 46 8.474 8.474 7.589 0.885 26022 3541 1 8 . 1 1 47 47 SER N N 47 114.263 114.263 115.109 -0.846 26022 3542 1 8 . 1 1 47 47 SER HA H 47 4.393 4.393 4.464 -0.071 26022 3543 1 8 . 1 1 47 47 SER C C 47 174.070 174.070 173.569 0.501 26022 3544 1 8 . 1 1 47 47 SER CA C 47 59.696 59.696 58.735 0.961 26022 3545 1 8 . 1 1 47 47 SER CB C 47 64.013 64.013 64.147 -0.134 26022 3546 1 8 . 1 1 47 47 SER H H 47 7.645 7.645 8.134 -0.489 26022 3547 1 8 . 1 1 48 48 LYS N N 48 115.405 115.405 119.740 -4.335 26022 3548 1 8 . 1 1 48 48 LYS HA H 48 3.990 3.990 4.006 -0.016 26022 3549 1 8 . 1 1 48 48 LYS C C 48 175.804 175.804 175.148 0.656 26022 3550 1 8 . 1 1 48 48 LYS CA C 48 57.537 57.537 57.032 0.505 26022 3551 1 8 . 1 1 48 48 LYS CB C 48 29.947 29.947 30.023 -0.076 26022 3552 1 8 . 1 1 48 48 LYS H H 48 7.821 7.821 7.780 0.041 26022 3553 1 8 . 1 1 49 49 ILE N N 49 117.265 117.265 120.531 -3.266 26022 3554 1 8 . 1 1 49 49 ILE HA H 49 4.041 4.041 4.281 -0.240 26022 3555 1 8 . 1 1 49 49 ILE C C 49 175.125 175.125 176.085 -0.960 26022 3556 1 8 . 1 1 49 49 ILE CA C 49 61.315 61.315 58.458 2.857 26022 3557 1 8 . 1 1 49 49 ILE CB C 49 38.919 38.919 39.432 -0.513 26022 3558 1 8 . 1 1 50 50 ARG N N 50 126.687 126.687 126.356 0.331 26022 3559 1 8 . 1 1 50 50 ARG HA H 50 4.471 4.471 4.413 0.058 26022 3560 1 8 . 1 1 50 50 ARG C C 50 175.007 175.007 175.589 -0.582 26022 3561 1 8 . 1 1 50 50 ARG CA C 50 55.176 55.176 55.666 -0.490 26022 3562 1 8 . 1 1 50 50 ARG CB C 50 31.026 31.026 30.810 0.216 26022 3563 1 8 . 1 1 50 50 ARG H H 50 8.437 8.437 8.435 0.002 26022 3564 1 8 . 1 1 51 51 ILE N N 51 127.722 127.722 126.466 1.256 26022 3565 1 8 . 1 1 51 51 ILE HA H 51 4.276 4.276 3.918 0.358 26022 3566 1 8 . 1 1 51 51 ILE C C 51 174.726 174.726 176.011 -1.285 26022 3567 1 8 . 1 1 51 51 ILE CA C 51 60.235 60.235 60.779 -0.544 26022 3568 1 8 . 1 1 51 51 ILE CB C 51 37.772 37.772 37.803 -0.031 26022 3569 1 8 . 1 1 52 52 ILE N N 52 121.888 121.888 123.984 -2.096 26022 3570 1 8 . 1 1 52 52 ILE HA H 52 4.781 4.781 4.475 0.306 26022 3571 1 8 . 1 1 52 52 ILE C C 52 175.733 175.733 175.131 0.602 26022 3572 1 8 . 1 1 52 52 ILE CA C 52 59.021 59.021 59.358 -0.336 26022 3573 1 8 . 1 1 52 52 ILE CB C 52 42.089 42.089 40.104 1.985 26022 3574 1 8 . 1 1 53 53 ILE N N 53 119.363 119.363 124.068 -4.705 26022 3575 1 8 . 1 1 53 53 ILE HA H 53 3.338 3.338 4.135 -0.797 26022 3576 1 8 . 1 1 53 53 ILE C C 53 177.021 177.021 177.039 -0.018 26022 3577 1 8 . 1 1 53 53 ILE CA C 53 64.274 64.274 61.548 2.726 26022 3578 1 8 . 1 1 53 53 ILE CB C 53 37.256 37.256 36.969 0.287 26022 3579 1 8 . 1 1 54 54 GLY N N 54 116.136 116.136 116.277 -0.141 26022 3580 1 8 . 1 1 54 54 GLY C C 54 174.844 174.844 173.343 1.501 26022 3581 1 8 . 1 1 54 54 GLY CA C 54 45.188 45.188 44.644 0.544 26022 3582 1 8 . 1 1 54 54 GLY H H 54 8.853 8.853 8.870 -0.017 26022 3583 1 8 . 1 1 55 55 ASP N N 55 121.946 121.946 120.803 1.143 26022 3584 1 8 . 1 1 55 55 ASP HA H 55 4.588 4.588 4.835 -0.247 26022 3585 1 8 . 1 1 55 55 ASP C C 55 175.804 175.804 174.953 0.851 26022 3586 1 8 . 1 1 55 55 ASP CA C 55 55.200 55.200 52.373 2.827 26022 3587 1 8 . 1 1 55 55 ASP CB C 55 41.048 41.048 42.963 -1.915 26022 3588 1 8 . 1 1 55 55 ASP H H 55 8.054 8.054 7.812 0.242 26022 3589 1 8 . 1 1 56 56 ARG N N 56 120.974 120.974 124.026 -3.052 26022 3590 1 8 . 1 1 56 56 ARG HA H 56 5.200 5.200 4.323 0.877 26022 3591 1 8 . 1 1 56 56 ARG C C 56 176.483 176.483 175.718 0.765 26022 3592 1 8 . 1 1 56 56 ARG CA C 56 54.097 54.097 56.122 -2.025 26022 3593 1 8 . 1 1 56 56 ARG CB C 56 30.689 30.689 29.896 0.793 26022 3594 1 8 . 1 1 56 56 ARG H H 56 8.766 8.766 8.554 0.212 26022 3595 1 8 . 1 1 57 57 VAL N N 57 114.943 114.943 118.443 -3.500 26022 3596 1 8 . 1 1 57 57 VAL HA H 57 4.965 4.965 4.489 0.476 26022 3597 1 8 . 1 1 57 57 VAL C C 57 172.243 172.243 173.612 -1.369 26022 3598 1 8 . 1 1 57 57 VAL CA C 57 58.077 58.077 58.959 -0.882 26022 3599 1 8 . 1 1 57 57 VAL CB C 57 36.288 36.288 34.906 1.382 26022 3600 1 8 . 1 1 58 58 LEU N N 58 122.410 122.410 121.641 0.769 26022 3601 1 8 . 1 1 58 58 LEU HA H 58 4.731 4.731 5.040 -0.309 26022 3602 1 8 . 1 1 58 58 LEU C C 58 174.773 174.773 175.195 -0.422 26022 3603 1 8 . 1 1 58 58 LEU CA C 58 53.085 53.085 53.696 -0.611 26022 3604 1 8 . 1 1 58 58 LEU CB C 58 45.788 45.788 43.811 1.977 26022 3605 1 8 . 1 1 58 58 LEU H H 58 8.382 8.382 8.379 0.003 26022 3606 1 8 . 1 1 59 59 VAL N N 59 127.937 127.937 126.686 1.251 26022 3607 1 8 . 1 1 59 59 VAL HA H 59 4.744 4.744 4.487 0.257 26022 3608 1 8 . 1 1 59 59 VAL C C 59 174.141 174.141 173.706 0.435 26022 3609 1 8 . 1 1 59 59 VAL CA C 59 60.279 60.279 59.771 0.508 26022 3610 1 8 . 1 1 59 59 VAL CB C 59 34.399 34.399 34.066 0.333 26022 3611 1 8 . 1 1 60 60 GLU N N 60 124.832 124.832 130.370 -5.538 26022 3612 1 8 . 1 1 60 60 GLU HA H 60 5.304 5.304 4.983 0.321 26022 3613 1 8 . 1 1 60 60 GLU C C 60 176.155 176.155 175.059 1.096 26022 3614 1 8 . 1 1 60 60 GLU CA C 60 54.164 54.164 55.043 -0.879 26022 3615 1 8 . 1 1 60 60 GLU CB C 60 33.803 33.803 31.301 2.502 26022 3616 1 8 . 1 1 60 60 GLU H H 60 9.142 9.142 8.182 0.960 26022 3617 1 8 . 1 1 61 61 MET N N 61 124.187 124.187 123.944 0.243 26022 3618 1 8 . 1 1 61 61 MET HA H 61 4.899 4.899 5.045 -0.146 26022 3619 1 8 . 1 1 61 61 MET C C 61 173.953 173.953 173.547 0.406 26022 3620 1 8 . 1 1 61 61 MET CA C 61 54.232 54.232 53.357 0.875 26022 3621 1 8 . 1 1 61 61 MET CB C 61 37.256 37.256 36.765 0.491 26022 3622 1 8 . 1 1 61 61 MET H H 61 8.984 8.984 8.501 0.483 26022 3623 1 8 . 1 1 62 62 SER N N 62 116.623 116.623 114.798 1.825 26022 3624 1 8 . 1 1 62 62 SER HA H 62 4.263 4.263 4.763 -0.500 26022 3625 1 8 . 1 1 62 62 SER C C 62 176.413 176.413 175.454 0.959 26022 3626 1 8 . 1 1 62 62 SER CA C 62 56.893 56.893 55.395 1.498 26022 3627 1 8 . 1 1 62 62 SER CB C 62 65.362 65.362 64.966 0.396 26022 3628 1 8 . 1 1 62 62 SER H H 62 9.167 9.167 8.863 0.304 26022 3629 1 8 . 1 1 63 63 ILE N N 63 121.187 121.187 123.027 -1.840 26022 3630 1 8 . 1 1 63 63 ILE HA H 63 3.989 3.989 3.980 0.009 26022 3631 1 8 . 1 1 63 63 ILE C C 63 176.623 176.623 176.680 -0.057 26022 3632 1 8 . 1 1 63 63 ILE CA C 63 63.878 63.878 60.983 2.895 26022 3633 1 8 . 1 1 63 63 ILE CB C 63 38.244 38.244 36.304 1.940 26022 3634 1 8 . 1 1 64 64 TYR N N 64 120.214 120.214 120.661 -0.447 26022 3635 1 8 . 1 1 64 64 TYR HA H 64 4.432 4.432 4.299 0.133 26022 3636 1 8 . 1 1 64 64 TYR C C 64 177.092 177.092 177.059 0.033 26022 3637 1 8 . 1 1 64 64 TYR CA C 64 59.156 59.156 60.095 -0.939 26022 3638 1 8 . 1 1 64 64 TYR CB C 64 38.109 38.109 37.989 0.120 26022 3639 1 8 . 1 1 64 64 TYR H H 64 7.762 7.762 7.301 0.461 26022 3640 1 8 . 1 1 65 65 ASP N N 65 121.338 121.338 115.133 6.205 26022 3641 1 8 . 1 1 65 65 ASP HA H 65 4.495 4.495 4.776 -0.281 26022 3642 1 8 . 1 1 65 65 ASP C C 65 177.349 177.349 177.515 -0.166 26022 3643 1 8 . 1 1 65 65 ASP CA C 65 55.243 55.243 54.915 0.328 26022 3644 1 8 . 1 1 65 65 ASP CB C 65 40.538 40.538 40.993 -0.456 26022 3645 1 8 . 1 1 65 65 ASP H H 65 7.798 7.798 8.154 -0.356 26022 3646 1 8 . 1 1 66 66 ARG N N 66 121.118 121.118 119.326 1.792 26022 3647 1 8 . 1 1 66 66 ARG HA H 66 4.069 4.069 4.265 -0.196 26022 3648 1 8 . 1 1 66 66 ARG C C 66 178.448 178.448 176.540 1.908 26022 3649 1 8 . 1 1 66 66 ARG CA C 66 58.401 58.401 58.188 0.214 26022 3650 1 8 . 1 1 66 66 ARG CB C 66 30.184 30.184 30.071 0.113 26022 3651 1 8 . 1 1 66 66 ARG H H 66 8.382 8.382 8.452 -0.070 26022 3652 1 8 . 1 1 67 67 ASN N N 67 117.334 117.334 117.398 -0.064 26022 3653 1 8 . 1 1 67 67 ASN HA H 67 4.601 4.601 4.833 -0.232 26022 3654 1 8 . 1 1 67 67 ASN C C 67 175.288 175.288 174.762 0.526 26022 3655 1 8 . 1 1 67 67 ASN CA C 67 54.097 54.097 52.565 1.532 26022 3656 1 8 . 1 1 67 67 ASN CB C 67 38.514 38.514 38.958 -0.444 26022 3657 1 8 . 1 1 67 67 ASN H H 67 8.194 8.194 8.323 -0.129 26022 3658 1 8 . 1 1 68 68 ALA N N 68 122.187 122.187 122.888 -0.701 26022 3659 1 8 . 1 1 68 68 ALA HA H 68 4.575 4.575 5.089 -0.514 26022 3660 1 8 . 1 1 68 68 ALA C C 68 176.272 176.272 178.231 -1.959 26022 3661 1 8 . 1 1 68 68 ALA CA C 68 52.478 52.478 53.380 -0.902 26022 3662 1 8 . 1 1 68 68 ALA CB C 68 19.086 19.086 19.875 -0.789 26022 3663 1 8 . 1 1 68 68 ALA H H 68 7.658 7.658 7.326 0.332 26022 3664 1 8 . 1 1 69 69 LYS N N 69 116.931 116.931 117.546 -0.615 26022 3665 1 8 . 1 1 69 69 LYS HA H 69 4.197 4.197 4.375 -0.178 26022 3666 1 8 . 1 1 69 69 LYS C C 69 176.085 176.085 175.371 0.714 26022 3667 1 8 . 1 1 69 69 LYS CA C 69 56.728 56.728 56.151 0.577 26022 3668 1 8 . 1 1 69 69 LYS CB C 69 31.566 31.566 32.184 -0.618 26022 3669 1 8 . 1 1 69 69 LYS H H 69 8.255 8.255 7.629 0.626 26022 3670 1 8 . 1 1 70 70 LYS N N 70 119.854 119.854 117.381 2.473 26022 3671 1 8 . 1 1 70 70 LYS HA H 70 5.526 5.526 5.430 0.096 26022 3672 1 8 . 1 1 70 70 LYS C C 70 175.171 175.171 174.684 0.487 26022 3673 1 8 . 1 1 70 70 LYS CA C 70 54.704 54.704 54.832 -0.128 26022 3674 1 8 . 1 1 70 70 LYS CB C 70 36.850 36.850 35.834 1.016 26022 3675 1 8 . 1 1 70 70 LYS H H 70 8.182 8.182 7.363 0.819 26022 3676 1 8 . 1 1 71 71 GLY N N 71 103.604 103.604 108.627 -5.023 26022 3677 1 8 . 1 1 71 71 GLY C C 71 171.541 171.541 172.434 -0.893 26022 3678 1 8 . 1 1 71 71 GLY CA C 71 45.462 45.462 44.060 1.402 26022 3679 1 8 . 1 1 71 71 GLY H H 71 7.780 7.780 7.906 -0.126 26022 3680 1 8 . 1 1 72 72 ARG N N 72 119.187 119.187 120.349 -1.162 26022 3681 1 8 . 1 1 72 72 ARG HA H 72 4.861 4.861 5.252 -0.391 26022 3682 1 8 . 1 1 72 72 ARG C C 72 175.570 175.570 175.138 0.432 26022 3683 1 8 . 1 1 72 72 ARG CA C 72 53.624 53.624 54.752 -1.128 26022 3684 1 8 . 1 1 72 72 ARG CB C 72 34.129 34.129 31.701 2.429 26022 3685 1 8 . 1 1 72 72 ARG H H 72 8.007 8.007 8.070 -0.063 26022 3686 1 8 . 1 1 73 73 ILE N N 73 125.721 125.721 124.990 0.731 26022 3687 1 8 . 1 1 73 73 ILE HA H 73 4.263 4.263 4.505 -0.242 26022 3688 1 8 . 1 1 73 73 ILE C C 73 175.312 175.312 173.892 1.420 26022 3689 1 8 . 1 1 73 73 ILE CA C 73 62.259 62.259 58.628 3.631 26022 3690 1 8 . 1 1 73 73 ILE CB C 73 39.423 39.423 41.506 -2.083 26022 3691 1 8 . 1 1 74 74 ILE N N 74 120.540 120.540 126.147 -5.607 26022 3692 1 8 . 1 1 74 74 ILE HA H 74 4.596 4.596 4.207 0.389 26022 3693 1 8 . 1 1 74 74 ILE C C 74 176.249 176.249 173.797 2.452 26022 3694 1 8 . 1 1 74 74 ILE CA C 74 60.910 60.910 61.050 -0.140 26022 3695 1 8 . 1 1 74 74 ILE CB C 74 39.863 39.863 40.063 -0.200 26022 3696 1 8 . 1 1 75 75 ARG N N 75 118.582 118.582 116.689 1.893 26022 3697 1 8 . 1 1 75 75 ARG HA H 75 4.289 4.289 4.339 -0.050 26022 3698 1 8 . 1 1 75 75 ARG C C 75 173.883 173.883 174.274 -0.391 26022 3699 1 8 . 1 1 75 75 ARG CA C 75 56.390 56.390 55.321 1.069 26022 3700 1 8 . 1 1 75 75 ARG CB C 75 34.669 34.669 31.864 2.805 26022 3701 1 8 . 1 1 75 75 ARG H H 75 7.397 7.397 7.769 -0.372 26022 3702 1 8 . 1 1 76 76 ARG N N 76 125.606 125.606 121.924 3.682 26022 3703 1 8 . 1 1 76 76 ARG HA H 76 4.609 4.609 4.252 0.357 26022 3704 1 8 . 1 1 76 76 ARG C C 76 175.312 175.312 175.438 -0.126 26022 3705 1 8 . 1 1 76 76 ARG CA C 76 55.810 55.810 56.354 -0.544 26022 3706 1 8 . 1 1 76 76 ARG CB C 76 31.094 31.094 30.948 0.146 26022 3707 1 8 . 1 1 76 76 ARG H H 76 9.094 9.094 8.337 0.757 26022 3708 1 8 . 1 1 77 77 LEU N N 77 128.575 128.575 122.317 6.258 26022 3709 1 8 . 1 1 77 77 LEU HA H 77 4.372 4.372 4.413 -0.041 26022 3710 1 8 . 1 1 77 77 LEU C C 77 176.225 176.225 176.610 -0.385 26022 3711 1 8 . 1 1 77 77 LEU CA C 77 54.704 54.704 55.147 -0.443 26022 3712 1 8 . 1 1 77 77 LEU CB C 77 42.292 42.292 42.623 -0.331 26022 3713 1 8 . 1 1 77 77 LEU H H 77 8.742 8.742 8.247 0.495 26022 3714 1 8 . 1 1 78 78 LYS N N 78 119.592 119.592 122.804 -3.212 26022 3715 1 8 . 1 1 78 78 LYS HA H 78 4.302 4.302 4.360 -0.058 26022 3716 1 8 . 1 1 78 78 LYS C C 78 176.296 176.296 176.881 -0.585 26022 3717 1 8 . 1 1 78 78 LYS CA C 78 56.390 56.390 56.239 0.151 26022 3718 1 8 . 1 1 78 78 LYS CB C 78 33.994 33.994 32.272 1.722 26022 3719 1 8 . 1 1 78 78 LYS H H 78 8.090 8.090 8.523 -0.433 26022 3720 1 8 . 1 1 79 79 GLY N N 79 110.854 110.854 113.069 -2.215 26022 3721 1 8 . 1 1 79 79 GLY C C 79 174.328 174.328 173.281 1.047 26022 3722 1 8 . 1 1 79 79 GLY CA C 79 44.990 44.990 44.278 0.712 26022 3723 1 8 . 1 1 79 79 GLY H H 79 8.520 8.520 8.493 0.027 26022 3724 1 8 . 1 1 80 80 THR N N 80 114.187 114.187 117.215 -3.028 26022 3725 1 8 . 1 1 80 80 THR HA H 80 4.237 4.237 4.558 -0.321 26022 3726 1 8 . 1 1 80 80 THR C C 80 175.054 175.054 174.604 0.450 26022 3727 1 8 . 1 1 80 80 THR CA C 80 62.242 62.242 61.019 1.223 26022 3728 1 8 . 1 1 80 80 THR CB C 80 69.826 69.826 69.204 0.622 26022 3729 1 8 . 1 1 81 81 SER N N 81 117.958 117.958 122.828 -4.870 26022 3730 1 8 . 1 1 81 81 SER HA H 81 4.449 4.449 4.836 -0.387 26022 3731 1 8 . 1 1 81 81 SER C C 81 174.703 174.703 173.956 0.747 26022 3732 1 8 . 1 1 81 81 SER CA C 81 58.481 58.481 57.953 0.528 26022 3733 1 8 . 1 1 81 81 SER CB C 81 63.338 63.338 64.581 -1.243 26022 3734 1 8 . 1 1 81 81 SER H H 81 8.474 8.474 8.657 -0.183 26022 3735 1 8 . 1 1 82 82 ASP HA H 82 4.280 4.280 4.348 -0.068 26022 3736 1 8 . 1 1 82 82 ASP C C 82 177.115 177.115 176.640 0.475 26022 3737 1 8 . 1 1 82 82 ASP CA C 82 55.176 55.176 56.654 -1.478 26022 3738 1 8 . 1 1 82 82 ASP CB C 82 42.359 42.359 41.485 0.874 26022 3739 1 8 . 1 1 83 83 ARG N N 83 121.531 121.531 117.181 4.350 26022 3740 1 8 . 1 1 83 83 ARG HA H 83 4.346 4.346 4.481 -0.135 26022 3741 1 8 . 1 1 83 83 ARG C C 83 176.342 176.342 175.477 0.865 26022 3742 1 8 . 1 1 83 83 ARG CA C 83 56.053 56.053 56.265 -0.212 26022 3743 1 8 . 1 1 83 83 ARG CB C 83 30.891 30.891 32.513 -1.622 26022 3744 1 8 . 1 1 83 83 ARG H H 83 8.259 8.259 8.257 0.002 26022 3745 1 8 . 1 1 84 84 THR N N 84 116.462 116.462 114.908 1.554 26022 3746 1 8 . 1 1 84 84 THR HA H 84 4.333 4.333 4.527 -0.194 26022 3747 1 8 . 1 1 84 84 THR C C 84 174.445 174.445 173.038 1.407 26022 3748 1 8 . 1 1 84 84 THR CA C 84 62.254 62.254 62.724 -0.470 26022 3749 1 8 . 1 1 84 84 THR CB C 84 69.833 69.833 68.855 0.979 26022 3750 1 8 . 1 1 85 85 ILE N N 85 123.762 123.762 122.876 0.886 26022 3751 1 8 . 1 1 85 85 ILE HA H 85 4.188 4.188 4.526 -0.338 26022 3752 1 8 . 1 1 85 85 ILE C C 85 176.155 176.155 175.300 0.855 26022 3753 1 8 . 1 1 85 85 ILE CA C 85 61.112 61.112 60.968 0.144 26022 3754 1 8 . 1 1 85 85 ILE CB C 85 38.919 38.919 39.763 -0.844 26022 3755 1 8 . 1 1 86 86 SER N N 86 120.214 120.214 119.292 0.922 26022 3756 1 8 . 1 1 86 86 SER HA H 86 4.451 4.451 4.544 -0.093 26022 3757 1 8 . 1 1 86 86 SER C C 86 174.586 174.586 174.484 0.102 26022 3758 1 8 . 1 1 86 86 SER CA C 86 58.212 58.212 58.814 -0.602 26022 3759 1 8 . 1 1 86 86 SER CB C 86 63.271 63.271 63.914 -0.643 26022 3760 1 8 . 1 1 86 86 SER H H 86 8.377 8.377 8.627 -0.250 26022 3761 1 9 . 1 1 2 2 VAL N N 2 122.187 122.187 117.593 4.594 26022 3762 1 9 . 1 1 2 2 VAL HA H 2 4.091 4.091 4.219 -0.128 26022 3763 1 9 . 1 1 2 2 VAL C C 2 175.921 175.921 176.063 -0.142 26022 3764 1 9 . 1 1 2 2 VAL CA C 2 62.057 62.057 63.230 -1.173 26022 3765 1 9 . 1 1 2 2 VAL CB C 2 32.848 32.848 32.080 0.768 26022 3766 1 9 . 1 1 3 3 LYS N N 3 125.437 125.437 122.051 3.386 26022 3767 1 9 . 1 1 3 3 LYS HA H 3 4.289 4.289 4.671 -0.382 26022 3768 1 9 . 1 1 3 3 LYS C C 3 176.155 176.155 175.415 0.740 26022 3769 1 9 . 1 1 3 3 LYS CA C 3 56.323 56.323 55.805 0.518 26022 3770 1 9 . 1 1 3 3 LYS CB C 3 33.320 33.320 32.460 0.860 26022 3771 1 9 . 1 1 3 3 LYS H H 3 8.396 8.396 8.063 0.333 26022 3772 1 9 . 1 1 4 4 ASP N N 4 121.937 121.937 122.206 -0.269 26022 3773 1 9 . 1 1 4 4 ASP HA H 4 4.289 4.289 4.735 -0.446 26022 3774 1 9 . 1 1 4 4 ASP C C 4 176.319 176.319 177.732 -1.413 26022 3775 1 9 . 1 1 4 4 ASP CA C 4 54.029 54.029 56.480 -2.451 26022 3776 1 9 . 1 1 4 4 ASP CB C 4 41.280 41.280 41.952 -0.672 26022 3777 1 9 . 1 1 4 4 ASP H H 4 8.325 8.325 8.730 -0.405 26022 3778 1 9 . 1 1 5 5 GLU N N 5 122.369 122.369 120.293 2.076 26022 3779 1 9 . 1 1 5 5 GLU HA H 5 4.250 4.250 3.980 0.270 26022 3780 1 9 . 1 1 5 5 GLU C C 5 177.045 177.045 176.909 0.136 26022 3781 1 9 . 1 1 5 5 GLU CA C 5 56.930 56.930 58.635 -1.705 26022 3782 1 9 . 1 1 5 5 GLU CB C 5 30.554 30.554 29.759 0.795 26022 3783 1 9 . 1 1 5 5 GLU H H 5 8.464 8.464 8.691 -0.227 26022 3784 1 9 . 1 1 6 6 LYS N N 6 121.437 121.437 121.160 0.277 26022 3785 1 9 . 1 1 6 6 LYS HA H 6 4.282 4.282 4.419 -0.137 26022 3786 1 9 . 1 1 6 6 LYS C C 6 177.185 177.185 175.436 1.749 26022 3787 1 9 . 1 1 6 6 LYS CA C 6 56.930 56.930 55.638 1.292 26022 3788 1 9 . 1 1 6 6 LYS CB C 6 32.713 32.713 31.785 0.928 26022 3789 1 9 . 1 1 6 6 LYS H H 6 8.390 8.390 8.141 0.249 26022 3790 1 9 . 1 1 7 7 SER N N 7 115.822 115.822 121.065 -5.243 26022 3791 1 9 . 1 1 7 7 SER HA H 7 4.396 4.396 4.452 -0.056 26022 3792 1 9 . 1 1 7 7 SER C C 7 174.609 174.609 174.706 -0.097 26022 3793 1 9 . 1 1 7 7 SER CA C 7 58.684 58.684 58.888 -0.204 26022 3794 1 9 . 1 1 7 7 SER CB C 7 63.608 63.608 62.625 0.983 26022 3795 1 9 . 1 1 7 7 SER H H 7 8.205 8.205 8.537 -0.332 26022 3796 1 9 . 1 1 8 8 LYS N N 8 122.643 122.643 124.702 -2.059 26022 3797 1 9 . 1 1 8 8 LYS HA H 8 4.407 4.407 4.489 -0.082 26022 3798 1 9 . 1 1 8 8 LYS C C 8 176.694 176.694 177.525 -0.831 26022 3799 1 9 . 1 1 8 8 LYS CA C 8 56.390 56.390 57.527 -1.137 26022 3800 1 9 . 1 1 8 8 LYS CB C 8 33.185 33.185 33.174 0.011 26022 3801 1 9 . 1 1 8 8 LYS H H 8 8.201 8.201 8.020 0.181 26022 3802 1 9 . 1 1 9 9 THR N N 9 113.900 113.900 114.446 -0.546 26022 3803 1 9 . 1 1 9 9 THR HA H 9 4.341 4.341 4.383 -0.042 26022 3804 1 9 . 1 1 9 9 THR C C 9 173.438 173.438 173.326 0.112 26022 3805 1 9 . 1 1 9 9 THR CA C 9 62.529 62.529 61.903 0.626 26022 3806 1 9 . 1 1 9 9 THR CB C 9 69.342 69.342 66.612 2.730 26022 3807 1 9 . 1 1 10 10 LEU N N 10 124.082 124.082 119.942 4.140 26022 3808 1 9 . 1 1 10 10 LEU HA H 10 4.858 4.858 4.716 0.142 26022 3809 1 9 . 1 1 10 10 LEU C C 10 175.804 175.804 174.666 1.138 26022 3810 1 9 . 1 1 10 10 LEU CA C 10 53.759 53.759 53.310 0.449 26022 3811 1 9 . 1 1 10 10 LEU CB C 10 44.653 44.653 45.187 -0.534 26022 3812 1 9 . 1 1 10 10 LEU H H 10 7.786 7.786 7.656 0.130 26022 3813 1 9 . 1 1 11 11 PHE N N 11 120.942 120.942 121.325 -0.383 26022 3814 1 9 . 1 1 11 11 PHE HA H 11 4.862 4.862 4.715 0.147 26022 3815 1 9 . 1 1 11 11 PHE C C 11 173.578 173.578 174.178 -0.600 26022 3816 1 9 . 1 1 11 11 PHE CA C 11 56.120 56.120 57.072 -0.952 26022 3817 1 9 . 1 1 11 11 PHE CB C 11 41.212 41.212 40.861 0.351 26022 3818 1 9 . 1 1 11 11 PHE H H 11 8.889 8.889 8.886 0.003 26022 3819 1 9 . 1 1 12 12 GLU N N 12 119.958 119.958 127.912 -7.954 26022 3820 1 9 . 1 1 12 12 GLU HA H 12 5.539 5.539 5.275 0.264 26022 3821 1 9 . 1 1 12 12 GLU C C 12 176.295 176.295 174.955 1.340 26022 3822 1 9 . 1 1 12 12 GLU CA C 12 54.501 54.501 54.750 -0.249 26022 3823 1 9 . 1 1 12 12 GLU CB C 12 31.768 31.768 31.474 0.294 26022 3824 1 9 . 1 1 12 12 GLU H H 12 8.285 8.285 8.308 -0.023 26022 3825 1 9 . 1 1 13 13 VAL N N 13 120.742 120.742 119.223 1.519 26022 3826 1 9 . 1 1 13 13 VAL HA H 13 4.570 4.570 4.447 0.123 26022 3827 1 9 . 1 1 13 13 VAL C C 13 173.415 173.415 174.267 -0.852 26022 3828 1 9 . 1 1 13 13 VAL CA C 13 59.696 59.696 59.096 0.600 26022 3829 1 9 . 1 1 13 13 VAL CB C 13 36.018 36.018 35.471 0.548 26022 3830 1 9 . 1 1 14 14 GLU N N 14 122.848 122.848 120.289 2.559 26022 3831 1 9 . 1 1 14 14 GLU HA H 14 5.226 5.226 5.121 0.105 26022 3832 1 9 . 1 1 14 14 GLU C C 14 176.295 176.295 176.514 -0.219 26022 3833 1 9 . 1 1 14 14 GLU CA C 14 55.243 55.243 55.565 -0.322 26022 3834 1 9 . 1 1 14 14 GLU CB C 14 32.173 32.173 31.146 1.027 26022 3835 1 9 . 1 1 14 14 GLU H H 14 8.492 8.492 8.471 0.021 26022 3836 1 9 . 1 1 15 15 GLY N N 15 105.005 105.005 108.787 -3.782 26022 3837 1 9 . 1 1 15 15 GLY C C 15 170.393 170.393 172.008 -1.615 26022 3838 1 9 . 1 1 15 15 GLY CA C 15 46.002 46.002 44.394 1.608 26022 3839 1 9 . 1 1 15 15 GLY H H 15 8.454 8.454 8.986 -0.532 26022 3840 1 9 . 1 1 16 16 ALA N N 16 120.909 120.909 121.648 -0.739 26022 3841 1 9 . 1 1 16 16 ALA HA H 16 5.526 5.526 4.975 0.551 26022 3842 1 9 . 1 1 16 16 ALA C C 16 176.834 176.834 175.939 0.895 26022 3843 1 9 . 1 1 16 16 ALA CA C 16 49.644 49.644 49.931 -0.287 26022 3844 1 9 . 1 1 16 16 ALA CB C 16 22.054 22.054 22.222 -0.168 26022 3845 1 9 . 1 1 16 16 ALA H H 16 8.206 8.206 8.935 -0.729 26022 3846 1 9 . 1 1 17 17 VAL N N 17 122.567 122.567 125.542 -2.975 26022 3847 1 9 . 1 1 17 17 VAL HA H 17 4.380 4.380 4.095 0.285 26022 3848 1 9 . 1 1 17 17 VAL C C 17 178.099 178.099 175.197 2.902 26022 3849 1 9 . 1 1 17 17 VAL CA C 17 63.608 63.608 62.605 1.003 26022 3850 1 9 . 1 1 17 17 VAL CB C 17 32.105 32.105 32.691 -0.586 26022 3851 1 9 . 1 1 18 18 THR N N 18 120.937 120.937 124.475 -3.538 26022 3852 1 9 . 1 1 18 18 THR HA H 18 4.601 4.601 4.433 0.168 26022 3853 1 9 . 1 1 18 18 THR C C 18 175.312 175.312 173.933 1.379 26022 3854 1 9 . 1 1 18 18 THR CA C 18 61.517 61.517 61.990 -0.473 26022 3855 1 9 . 1 1 18 18 THR CB C 18 69.814 69.814 69.582 0.232 26022 3856 1 9 . 1 1 19 19 ALA N N 19 121.258 121.258 122.604 -1.346 26022 3857 1 9 . 1 1 19 19 ALA HA H 19 4.458 4.458 4.637 -0.179 26022 3858 1 9 . 1 1 19 19 ALA C C 19 174.703 174.703 174.835 -0.132 26022 3859 1 9 . 1 1 19 19 ALA CA C 19 53.017 53.017 52.059 0.958 26022 3860 1 9 . 1 1 19 19 ALA CB C 19 22.054 22.054 20.940 1.114 26022 3861 1 9 . 1 1 19 19 ALA H H 19 7.716 7.716 7.634 0.082 26022 3862 1 9 . 1 1 20 20 LEU N N 20 123.420 123.420 117.500 5.920 26022 3863 1 9 . 1 1 20 20 LEU HA H 20 4.393 4.393 4.934 -0.541 26022 3864 1 9 . 1 1 20 20 LEU C C 20 175.499 175.499 174.999 0.500 26022 3865 1 9 . 1 1 20 20 LEU CA C 20 54.839 54.839 53.830 1.009 26022 3866 1 9 . 1 1 20 20 LEU CB C 20 41.212 41.212 45.178 -3.966 26022 3867 1 9 . 1 1 20 20 LEU H H 20 8.711 8.711 8.286 0.425 26022 3868 1 9 . 1 1 21 21 LEU N N 21 124.718 124.718 120.479 4.239 26022 3869 1 9 . 1 1 21 21 LEU HA H 21 4.714 4.714 4.891 -0.177 26022 3870 1 9 . 1 1 21 21 LEU C C 21 174.328 174.328 175.446 -1.118 26022 3871 1 9 . 1 1 21 21 LEU CA C 21 52.680 52.680 51.731 0.949 26022 3872 1 9 . 1 1 21 21 LEU CB C 21 41.684 41.684 44.819 -3.135 26022 3873 1 9 . 1 1 21 21 LEU H H 21 7.773 7.773 8.833 -1.060 26022 3874 1 9 . 1 1 22 22 PRO HA H 22 4.380 4.380 4.350 0.030 26022 3875 1 9 . 1 1 22 22 PRO C C 22 175.616 175.616 175.629 -0.013 26022 3876 1 9 . 1 1 22 22 PRO CA C 22 62.529 62.529 63.564 -1.035 26022 3877 1 9 . 1 1 22 22 PRO CB C 22 32.240 32.240 29.730 2.510 26022 3878 1 9 . 1 1 23 23 ALA N N 23 120.693 120.693 122.853 -2.160 26022 3879 1 9 . 1 1 23 23 ALA HA H 23 4.302 4.302 4.377 -0.075 26022 3880 1 9 . 1 1 23 23 ALA C C 23 176.178 176.178 176.584 -0.406 26022 3881 1 9 . 1 1 23 23 ALA CA C 23 52.882 52.882 52.257 0.625 26022 3882 1 9 . 1 1 23 23 ALA CB C 23 17.336 17.336 19.437 -2.101 26022 3883 1 9 . 1 1 23 23 ALA H H 23 8.675 8.675 8.094 0.581 26022 3884 1 9 . 1 1 24 24 ALA N N 24 115.540 115.540 120.280 -4.740 26022 3885 1 9 . 1 1 24 24 ALA HA H 24 3.820 3.820 3.792 0.028 26022 3886 1 9 . 1 1 24 24 ALA C C 24 175.546 175.546 176.195 -0.649 26022 3887 1 9 . 1 1 24 24 ALA CA C 24 52.613 52.613 53.159 -0.546 26022 3888 1 9 . 1 1 24 24 ALA CB C 24 16.590 16.590 17.571 -0.981 26022 3889 1 9 . 1 1 24 24 ALA H H 24 8.381 8.381 8.326 0.055 26022 3890 1 9 . 1 1 25 25 GLU N N 25 114.082 114.082 117.606 -3.524 26022 3891 1 9 . 1 1 25 25 GLU HA H 25 5.148 5.148 4.364 0.784 26022 3892 1 9 . 1 1 25 25 GLU C C 25 175.757 175.757 174.334 1.423 26022 3893 1 9 . 1 1 25 25 GLU CA C 25 54.911 54.911 54.002 0.909 26022 3894 1 9 . 1 1 25 25 GLU CB C 25 32.645 32.645 32.358 0.287 26022 3895 1 9 . 1 1 25 25 GLU H H 25 6.378 6.378 7.150 -0.772 26022 3896 1 9 . 1 1 26 26 PHE N N 26 117.365 117.365 122.639 -5.274 26022 3897 1 9 . 1 1 26 26 PHE HA H 26 4.979 4.979 4.811 0.168 26022 3898 1 9 . 1 1 26 26 PHE C C 26 174.960 174.960 174.463 0.497 26022 3899 1 9 . 1 1 26 26 PHE CA C 26 56.862 56.862 56.742 0.120 26022 3900 1 9 . 1 1 26 26 PHE CB C 26 43.371 43.371 43.218 0.153 26022 3901 1 9 . 1 1 26 26 PHE H H 26 8.950 8.950 8.893 0.057 26022 3902 1 9 . 1 1 27 27 ARG N N 27 125.082 125.082 120.843 4.239 26022 3903 1 9 . 1 1 27 27 ARG HA H 27 4.992 4.992 5.300 -0.308 26022 3904 1 9 . 1 1 27 27 ARG C C 27 175.148 175.148 174.822 0.326 26022 3905 1 9 . 1 1 27 27 ARG CA C 27 56.323 56.323 55.254 1.069 26022 3906 1 9 . 1 1 27 27 ARG CB C 27 32.240 32.240 33.246 -1.006 26022 3907 1 9 . 1 1 27 27 ARG H H 27 8.799 8.799 8.930 -0.131 26022 3908 1 9 . 1 1 28 28 VAL N N 28 127.456 127.456 119.146 8.310 26022 3909 1 9 . 1 1 28 28 VAL HA H 28 4.757 4.757 5.042 -0.285 26022 3910 1 9 . 1 1 28 28 VAL C C 28 173.602 173.602 173.992 -0.390 26022 3911 1 9 . 1 1 28 28 VAL CA C 28 60.303 60.303 59.234 1.069 26022 3912 1 9 . 1 1 28 28 VAL CB C 28 35.681 35.681 35.374 0.307 26022 3913 1 9 . 1 1 29 29 LYS N N 29 128.096 128.096 120.526 7.570 26022 3914 1 9 . 1 1 29 29 LYS HA H 29 4.354 4.354 5.344 -0.990 26022 3915 1 9 . 1 1 29 29 LYS C C 29 176.740 176.740 175.132 1.608 26022 3916 1 9 . 1 1 29 29 LYS CA C 29 55.041 55.041 53.651 1.391 26022 3917 1 9 . 1 1 29 29 LYS CB C 29 34.062 34.062 36.252 -2.190 26022 3918 1 9 . 1 1 29 29 LYS H H 29 9.268 9.268 8.989 0.279 26022 3919 1 9 . 1 1 30 30 LEU N N 30 129.600 129.600 124.723 4.877 26022 3920 1 9 . 1 1 30 30 LEU HA H 30 4.653 4.653 4.336 0.317 26022 3921 1 9 . 1 1 30 30 LEU C C 30 178.193 178.193 177.180 1.013 26022 3922 1 9 . 1 1 30 30 LEU CA C 30 54.771 54.771 55.405 -0.634 26022 3923 1 9 . 1 1 30 30 LEU CB C 30 42.224 42.224 43.497 -1.273 26022 3924 1 9 . 1 1 30 30 LEU H H 30 9.000 9.000 8.830 0.170 26022 3925 1 9 . 1 1 31 31 ASP N N 31 120.478 120.478 125.872 -5.394 26022 3926 1 9 . 1 1 31 31 ASP HA H 31 4.458 4.458 4.376 0.082 26022 3927 1 9 . 1 1 31 31 ASP C C 31 176.155 176.155 176.507 -0.352 26022 3928 1 9 . 1 1 31 31 ASP CA C 31 55.918 55.918 56.708 -0.790 26022 3929 1 9 . 1 1 31 31 ASP CB C 31 39.593 39.593 40.940 -1.347 26022 3930 1 9 . 1 1 31 31 ASP H H 31 8.698 8.698 9.131 -0.433 26022 3931 1 9 . 1 1 32 32 ASN N N 32 115.450 115.450 116.919 -1.469 26022 3932 1 9 . 1 1 32 32 ASN HA H 32 4.588 4.588 4.676 -0.088 26022 3933 1 9 . 1 1 32 32 ASN C C 32 175.335 175.335 174.171 1.164 26022 3934 1 9 . 1 1 32 32 ASN CA C 32 53.152 53.152 53.086 0.066 26022 3935 1 9 . 1 1 32 32 ASN CB C 32 37.367 37.367 38.144 -0.777 26022 3936 1 9 . 1 1 32 32 ASN H H 32 7.680 7.680 8.122 -0.442 26022 3937 1 9 . 1 1 33 33 GLU N N 33 111.790 111.790 114.992 -3.202 26022 3938 1 9 . 1 1 33 33 GLU HA H 33 3.898 3.898 3.877 0.021 26022 3939 1 9 . 1 1 33 33 GLU C C 33 175.733 175.733 174.417 1.316 26022 3940 1 9 . 1 1 33 33 GLU CA C 33 58.144 58.144 57.651 0.493 26022 3941 1 9 . 1 1 33 33 GLU CB C 33 28.242 28.242 26.817 1.425 26022 3942 1 9 . 1 1 33 33 GLU H H 33 8.097 8.097 7.866 0.231 26022 3943 1 9 . 1 1 34 34 HIS N N 34 119.193 119.193 117.865 1.328 26022 3944 1 9 . 1 1 34 34 HIS HA H 34 4.201 4.201 4.900 -0.699 26022 3945 1 9 . 1 1 34 34 HIS C C 34 173.789 173.789 173.993 -0.204 26022 3946 1 9 . 1 1 34 34 HIS CA C 34 56.053 56.053 55.243 0.810 26022 3947 1 9 . 1 1 34 34 HIS CB C 34 30.487 30.487 31.910 -1.423 26022 3948 1 9 . 1 1 34 34 HIS H H 34 7.890 7.890 7.686 0.204 26022 3949 1 9 . 1 1 35 35 GLU HA H 35 5.400 5.400 5.090 0.310 26022 3950 1 9 . 1 1 35 35 GLU C C 35 175.944 175.944 176.235 -0.291 26022 3951 1 9 . 1 1 35 35 GLU CA C 35 55.109 55.109 55.627 -0.518 26022 3952 1 9 . 1 1 35 35 GLU CB C 35 32.308 32.308 31.135 1.173 26022 3953 1 9 . 1 1 36 36 ILE N N 36 119.077 119.077 118.231 0.846 26022 3954 1 9 . 1 1 36 36 ILE HA H 36 4.686 4.686 4.687 -0.001 26022 3955 1 9 . 1 1 36 36 ILE C C 36 173.790 173.790 174.253 -0.463 26022 3956 1 9 . 1 1 36 36 ILE CA C 36 59.156 59.156 58.825 0.331 26022 3957 1 9 . 1 1 36 36 ILE CB C 36 42.696 42.696 41.747 0.949 26022 3958 1 9 . 1 1 37 37 ILE N N 37 122.787 122.787 119.003 3.784 26022 3959 1 9 . 1 1 37 37 ILE HA H 37 4.778 4.778 4.580 0.198 26022 3960 1 9 . 1 1 37 37 ILE C C 37 177.057 177.057 175.391 1.666 26022 3961 1 9 . 1 1 37 37 ILE CA C 37 59.723 59.723 60.854 -1.131 26022 3962 1 9 . 1 1 37 37 ILE CB C 37 37.949 37.949 39.374 -1.425 26022 3963 1 9 . 1 1 38 38 CYS N N 38 122.357 122.357 125.731 -3.374 26022 3964 1 9 . 1 1 38 38 CYS HA H 38 5.708 5.708 5.752 -0.044 26022 3965 1 9 . 1 1 38 38 CYS C C 38 174.258 174.258 173.510 0.748 26022 3966 1 9 . 1 1 38 38 CYS CA C 38 56.930 56.930 56.020 0.910 26022 3967 1 9 . 1 1 38 38 CYS CB C 38 33.252 33.252 30.158 3.094 26022 3968 1 9 . 1 1 38 38 CYS H H 38 9.512 9.512 8.995 0.517 26022 3969 1 9 . 1 1 39 39 HIS N N 39 117.101 117.101 123.630 -6.529 26022 3970 1 9 . 1 1 39 39 HIS HA H 39 5.526 5.526 5.285 0.241 26022 3971 1 9 . 1 1 39 39 HIS C C 39 174.516 174.516 174.906 -0.390 26022 3972 1 9 . 1 1 39 39 HIS CA C 39 54.097 54.097 55.831 -1.734 26022 3973 1 9 . 1 1 39 39 HIS CB C 39 31.701 31.701 35.179 -3.478 26022 3974 1 9 . 1 1 39 39 HIS H H 39 7.597 7.597 8.878 -1.281 26022 3975 1 9 . 1 1 40 40 VAL N N 40 117.923 117.923 118.825 -0.902 26022 3976 1 9 . 1 1 40 40 VAL HA H 40 4.614 4.614 4.184 0.430 26022 3977 1 9 . 1 1 40 40 VAL C C 40 175.804 175.804 175.068 0.736 26022 3978 1 9 . 1 1 40 40 VAL CA C 40 61.382 61.382 62.963 -1.581 26022 3979 1 9 . 1 1 40 40 VAL CB C 40 33.396 33.396 32.154 1.242 26022 3980 1 9 . 1 1 41 41 SER N N 41 119.242 119.242 121.668 -2.426 26022 3981 1 9 . 1 1 41 41 SER HA H 41 4.550 4.550 4.769 -0.219 26022 3982 1 9 . 1 1 41 41 SER C C 41 174.656 174.656 175.720 -1.064 26022 3983 1 9 . 1 1 41 41 SER CA C 41 58.126 58.126 56.616 1.510 26022 3984 1 9 . 1 1 41 41 SER CB C 41 63.470 63.470 66.169 -2.699 26022 3985 1 9 . 1 1 41 41 SER H H 41 8.341 8.341 8.125 0.216 26022 3986 1 9 . 1 1 42 42 GLY N N 42 110.569 110.569 109.690 0.879 26022 3987 1 9 . 1 1 42 42 GLY C C 42 173.829 173.829 175.902 -2.073 26022 3988 1 9 . 1 1 42 42 GLY CA C 42 45.257 45.257 47.566 -2.309 26022 3989 1 9 . 1 1 42 42 GLY H H 42 8.380 8.380 8.750 -0.370 26022 3990 1 9 . 1 1 43 43 LYS HA H 43 3.977 3.977 4.053 -0.076 26022 3991 1 9 . 1 1 43 43 LYS C C 43 179.363 179.363 178.871 0.492 26022 3992 1 9 . 1 1 43 43 LYS CA C 43 59.628 59.628 58.947 0.681 26022 3993 1 9 . 1 1 43 43 LYS CB C 43 32.510 32.510 32.180 0.330 26022 3994 1 9 . 1 1 44 44 VAL N N 44 120.404 120.404 118.960 1.444 26022 3995 1 9 . 1 1 44 44 VAL HA H 44 3.661 3.661 3.611 0.050 26022 3996 1 9 . 1 1 44 44 VAL C C 44 179.785 179.785 178.335 1.450 26022 3997 1 9 . 1 1 44 44 VAL CA C 44 65.425 65.425 65.706 -0.281 26022 3998 1 9 . 1 1 44 44 VAL CB C 44 31.500 31.500 31.338 0.162 26022 3999 1 9 . 1 1 45 45 ARG N N 45 123.687 123.687 119.757 3.930 26022 4000 1 9 . 1 1 45 45 ARG HA H 45 4.054 4.054 4.103 -0.049 26022 4001 1 9 . 1 1 45 45 ARG C C 45 179.504 179.504 178.256 1.248 26022 4002 1 9 . 1 1 45 45 ARG CA C 45 59.669 59.669 58.943 0.726 26022 4003 1 9 . 1 1 45 45 ARG CB C 45 30.417 30.417 29.994 0.423 26022 4004 1 9 . 1 1 45 45 ARG H H 45 8.608 8.608 8.451 0.157 26022 4005 1 9 . 1 1 46 46 ARG N N 46 118.506 118.506 116.225 2.281 26022 4006 1 9 . 1 1 46 46 ARG HA H 46 4.148 4.148 4.395 -0.247 26022 4007 1 9 . 1 1 46 46 ARG C C 46 177.396 177.396 177.932 -0.536 26022 4008 1 9 . 1 1 46 46 ARG CA C 46 58.481 58.481 57.713 0.768 26022 4009 1 9 . 1 1 46 46 ARG CB C 46 30.554 30.554 29.954 0.600 26022 4010 1 9 . 1 1 46 46 ARG H H 46 8.474 8.474 7.579 0.895 26022 4011 1 9 . 1 1 47 47 SER N N 47 114.263 114.263 115.949 -1.686 26022 4012 1 9 . 1 1 47 47 SER HA H 47 4.393 4.393 4.396 -0.003 26022 4013 1 9 . 1 1 47 47 SER C C 47 174.070 174.070 173.900 0.170 26022 4014 1 9 . 1 1 47 47 SER CA C 47 59.696 59.696 59.091 0.605 26022 4015 1 9 . 1 1 47 47 SER CB C 47 64.013 64.013 64.072 -0.059 26022 4016 1 9 . 1 1 47 47 SER H H 47 7.645 7.645 7.808 -0.163 26022 4017 1 9 . 1 1 48 48 LYS N N 48 115.405 115.405 119.920 -4.515 26022 4018 1 9 . 1 1 48 48 LYS HA H 48 3.990 3.990 3.967 0.023 26022 4019 1 9 . 1 1 48 48 LYS C C 48 175.804 175.804 175.268 0.536 26022 4020 1 9 . 1 1 48 48 LYS CA C 48 57.537 57.537 57.114 0.423 26022 4021 1 9 . 1 1 48 48 LYS CB C 48 29.947 29.947 30.089 -0.142 26022 4022 1 9 . 1 1 48 48 LYS H H 48 7.821 7.821 7.835 -0.014 26022 4023 1 9 . 1 1 49 49 ILE N N 49 117.265 117.265 121.087 -3.822 26022 4024 1 9 . 1 1 49 49 ILE HA H 49 4.041 4.041 4.287 -0.246 26022 4025 1 9 . 1 1 49 49 ILE C C 49 175.125 175.125 176.460 -1.335 26022 4026 1 9 . 1 1 49 49 ILE CA C 49 61.315 61.315 58.765 2.550 26022 4027 1 9 . 1 1 49 49 ILE CB C 49 38.919 38.919 38.879 0.040 26022 4028 1 9 . 1 1 50 50 ARG N N 50 126.687 126.687 127.246 -0.559 26022 4029 1 9 . 1 1 50 50 ARG HA H 50 4.471 4.471 4.469 0.002 26022 4030 1 9 . 1 1 50 50 ARG C C 50 175.007 175.007 175.406 -0.399 26022 4031 1 9 . 1 1 50 50 ARG CA C 50 55.176 55.176 55.804 -0.628 26022 4032 1 9 . 1 1 50 50 ARG CB C 50 31.026 31.026 30.233 0.793 26022 4033 1 9 . 1 1 50 50 ARG H H 50 8.437 8.437 8.510 -0.073 26022 4034 1 9 . 1 1 51 51 ILE N N 51 127.722 127.722 127.066 0.656 26022 4035 1 9 . 1 1 51 51 ILE HA H 51 4.276 4.276 4.099 0.177 26022 4036 1 9 . 1 1 51 51 ILE C C 51 174.726 174.726 175.673 -0.947 26022 4037 1 9 . 1 1 51 51 ILE CA C 51 60.235 60.235 60.782 -0.547 26022 4038 1 9 . 1 1 51 51 ILE CB C 51 37.772 37.772 37.855 -0.083 26022 4039 1 9 . 1 1 52 52 ILE N N 52 121.888 121.888 122.918 -1.030 26022 4040 1 9 . 1 1 52 52 ILE HA H 52 4.781 4.781 4.565 0.216 26022 4041 1 9 . 1 1 52 52 ILE C C 52 175.733 175.733 175.233 0.500 26022 4042 1 9 . 1 1 52 52 ILE CA C 52 59.021 59.021 59.524 -0.503 26022 4043 1 9 . 1 1 52 52 ILE CB C 52 42.089 42.089 40.601 1.488 26022 4044 1 9 . 1 1 53 53 ILE N N 53 119.363 119.363 123.046 -3.683 26022 4045 1 9 . 1 1 53 53 ILE HA H 53 3.338 3.338 3.932 -0.594 26022 4046 1 9 . 1 1 53 53 ILE C C 53 177.021 177.021 177.034 -0.013 26022 4047 1 9 . 1 1 53 53 ILE CA C 53 64.274 64.274 62.062 2.212 26022 4048 1 9 . 1 1 53 53 ILE CB C 53 37.256 37.256 37.935 -0.680 26022 4049 1 9 . 1 1 54 54 GLY N N 54 116.136 116.136 115.342 0.794 26022 4050 1 9 . 1 1 54 54 GLY C C 54 174.844 174.844 173.556 1.288 26022 4051 1 9 . 1 1 54 54 GLY CA C 54 45.188 45.188 44.985 0.203 26022 4052 1 9 . 1 1 54 54 GLY H H 54 8.853 8.853 8.649 0.204 26022 4053 1 9 . 1 1 55 55 ASP N N 55 121.946 121.946 119.201 2.745 26022 4054 1 9 . 1 1 55 55 ASP HA H 55 4.588 4.588 4.857 -0.269 26022 4055 1 9 . 1 1 55 55 ASP C C 55 175.804 175.804 174.850 0.954 26022 4056 1 9 . 1 1 55 55 ASP CA C 55 55.200 55.200 52.072 3.128 26022 4057 1 9 . 1 1 55 55 ASP CB C 55 41.048 41.048 42.489 -1.441 26022 4058 1 9 . 1 1 55 55 ASP H H 55 8.054 8.054 7.762 0.292 26022 4059 1 9 . 1 1 56 56 ARG N N 56 120.974 120.974 121.021 -0.047 26022 4060 1 9 . 1 1 56 56 ARG HA H 56 5.200 5.200 4.751 0.449 26022 4061 1 9 . 1 1 56 56 ARG C C 56 176.483 176.483 176.501 -0.018 26022 4062 1 9 . 1 1 56 56 ARG CA C 56 54.097 54.097 55.607 -1.510 26022 4063 1 9 . 1 1 56 56 ARG CB C 56 30.689 30.689 29.433 1.256 26022 4064 1 9 . 1 1 56 56 ARG H H 56 8.766 8.766 8.486 0.280 26022 4065 1 9 . 1 1 57 57 VAL N N 57 114.943 114.943 117.501 -2.558 26022 4066 1 9 . 1 1 57 57 VAL HA H 57 4.965 4.965 4.566 0.399 26022 4067 1 9 . 1 1 57 57 VAL C C 57 172.243 172.243 173.403 -1.160 26022 4068 1 9 . 1 1 57 57 VAL CA C 57 58.077 58.077 59.843 -1.766 26022 4069 1 9 . 1 1 57 57 VAL CB C 57 36.288 36.288 35.579 0.709 26022 4070 1 9 . 1 1 58 58 LEU N N 58 122.410 122.410 124.876 -2.466 26022 4071 1 9 . 1 1 58 58 LEU HA H 58 4.731 4.731 5.053 -0.322 26022 4072 1 9 . 1 1 58 58 LEU C C 58 174.773 174.773 175.081 -0.308 26022 4073 1 9 . 1 1 58 58 LEU CA C 58 53.085 53.085 53.818 -0.733 26022 4074 1 9 . 1 1 58 58 LEU CB C 58 45.788 45.788 43.593 2.195 26022 4075 1 9 . 1 1 58 58 LEU H H 58 8.382 8.382 8.419 -0.037 26022 4076 1 9 . 1 1 59 59 VAL N N 59 127.937 127.937 127.610 0.327 26022 4077 1 9 . 1 1 59 59 VAL HA H 59 4.744 4.744 5.009 -0.265 26022 4078 1 9 . 1 1 59 59 VAL C C 59 174.141 174.141 174.088 0.053 26022 4079 1 9 . 1 1 59 59 VAL CA C 59 60.279 60.279 59.437 0.842 26022 4080 1 9 . 1 1 59 59 VAL CB C 59 34.399 34.399 34.448 -0.049 26022 4081 1 9 . 1 1 60 60 GLU N N 60 124.832 124.832 129.461 -4.629 26022 4082 1 9 . 1 1 60 60 GLU HA H 60 5.304 5.304 5.262 0.042 26022 4083 1 9 . 1 1 60 60 GLU C C 60 176.155 176.155 175.755 0.400 26022 4084 1 9 . 1 1 60 60 GLU CA C 60 54.164 54.164 54.785 -0.621 26022 4085 1 9 . 1 1 60 60 GLU CB C 60 33.803 33.803 31.119 2.684 26022 4086 1 9 . 1 1 60 60 GLU H H 60 9.142 9.142 8.869 0.273 26022 4087 1 9 . 1 1 61 61 MET N N 61 124.187 124.187 122.965 1.222 26022 4088 1 9 . 1 1 61 61 MET HA H 61 4.899 4.899 4.975 -0.076 26022 4089 1 9 . 1 1 61 61 MET C C 61 173.953 173.953 174.354 -0.401 26022 4090 1 9 . 1 1 61 61 MET CA C 61 54.232 54.232 53.549 0.683 26022 4091 1 9 . 1 1 61 61 MET CB C 61 37.256 37.256 36.395 0.861 26022 4092 1 9 . 1 1 61 61 MET H H 61 8.984 8.984 9.068 -0.084 26022 4093 1 9 . 1 1 62 62 SER N N 62 116.623 116.623 115.814 0.809 26022 4094 1 9 . 1 1 62 62 SER HA H 62 4.263 4.263 4.738 -0.475 26022 4095 1 9 . 1 1 62 62 SER C C 62 176.413 176.413 174.960 1.453 26022 4096 1 9 . 1 1 62 62 SER CA C 62 56.893 56.893 56.926 -0.033 26022 4097 1 9 . 1 1 62 62 SER CB C 62 65.362 65.362 64.449 0.913 26022 4098 1 9 . 1 1 62 62 SER H H 62 9.167 9.167 8.238 0.929 26022 4099 1 9 . 1 1 63 63 ILE N N 63 121.187 121.187 123.369 -2.182 26022 4100 1 9 . 1 1 63 63 ILE HA H 63 3.989 3.989 3.870 0.119 26022 4101 1 9 . 1 1 63 63 ILE C C 63 176.623 176.623 175.985 0.638 26022 4102 1 9 . 1 1 63 63 ILE CA C 63 63.878 63.878 60.379 3.499 26022 4103 1 9 . 1 1 63 63 ILE CB C 63 38.244 38.244 36.380 1.864 26022 4104 1 9 . 1 1 64 64 TYR N N 64 120.214 120.214 120.435 -0.221 26022 4105 1 9 . 1 1 64 64 TYR HA H 64 4.432 4.432 4.408 0.024 26022 4106 1 9 . 1 1 64 64 TYR C C 64 177.092 177.092 177.089 0.003 26022 4107 1 9 . 1 1 64 64 TYR CA C 64 59.156 59.156 60.057 -0.901 26022 4108 1 9 . 1 1 64 64 TYR CB C 64 38.109 38.109 38.362 -0.253 26022 4109 1 9 . 1 1 64 64 TYR H H 64 7.762 7.762 7.573 0.189 26022 4110 1 9 . 1 1 65 65 ASP N N 65 121.338 121.338 116.256 5.082 26022 4111 1 9 . 1 1 65 65 ASP HA H 65 4.495 4.495 4.754 -0.259 26022 4112 1 9 . 1 1 65 65 ASP C C 65 177.349 177.349 178.298 -0.949 26022 4113 1 9 . 1 1 65 65 ASP CA C 65 55.243 55.243 54.816 0.427 26022 4114 1 9 . 1 1 65 65 ASP CB C 65 40.538 40.538 41.309 -0.771 26022 4115 1 9 . 1 1 65 65 ASP H H 65 7.798 7.798 8.254 -0.456 26022 4116 1 9 . 1 1 66 66 ARG N N 66 121.118 121.118 120.689 0.429 26022 4117 1 9 . 1 1 66 66 ARG HA H 66 4.069 4.069 4.239 -0.170 26022 4118 1 9 . 1 1 66 66 ARG C C 66 178.448 178.448 177.285 1.163 26022 4119 1 9 . 1 1 66 66 ARG CA C 66 58.401 58.401 58.334 0.067 26022 4120 1 9 . 1 1 66 66 ARG CB C 66 30.184 30.184 29.498 0.686 26022 4121 1 9 . 1 1 66 66 ARG H H 66 8.382 8.382 8.613 -0.231 26022 4122 1 9 . 1 1 67 67 ASN N N 67 117.334 117.334 118.159 -0.825 26022 4123 1 9 . 1 1 67 67 ASN HA H 67 4.601 4.601 4.907 -0.306 26022 4124 1 9 . 1 1 67 67 ASN C C 67 175.288 175.288 175.276 0.012 26022 4125 1 9 . 1 1 67 67 ASN CA C 67 54.097 54.097 53.535 0.562 26022 4126 1 9 . 1 1 67 67 ASN CB C 67 38.514 38.514 37.471 1.043 26022 4127 1 9 . 1 1 67 67 ASN H H 67 8.194 8.194 8.569 -0.375 26022 4128 1 9 . 1 1 68 68 ALA N N 68 122.187 122.187 122.203 -0.016 26022 4129 1 9 . 1 1 68 68 ALA HA H 68 4.575 4.575 4.561 0.014 26022 4130 1 9 . 1 1 68 68 ALA C C 68 176.272 176.272 177.939 -1.667 26022 4131 1 9 . 1 1 68 68 ALA CA C 68 52.478 52.478 53.558 -1.080 26022 4132 1 9 . 1 1 68 68 ALA CB C 68 19.086 19.086 19.393 -0.307 26022 4133 1 9 . 1 1 68 68 ALA H H 68 7.658 7.658 7.253 0.405 26022 4134 1 9 . 1 1 69 69 LYS N N 69 116.931 116.931 115.900 1.031 26022 4135 1 9 . 1 1 69 69 LYS HA H 69 4.197 4.197 4.506 -0.309 26022 4136 1 9 . 1 1 69 69 LYS C C 69 176.085 176.085 174.732 1.353 26022 4137 1 9 . 1 1 69 69 LYS CA C 69 56.728 56.728 55.642 1.086 26022 4138 1 9 . 1 1 69 69 LYS CB C 69 31.566 31.566 33.119 -1.553 26022 4139 1 9 . 1 1 69 69 LYS H H 69 8.255 8.255 7.615 0.640 26022 4140 1 9 . 1 1 70 70 LYS N N 70 119.854 119.854 120.357 -0.503 26022 4141 1 9 . 1 1 70 70 LYS HA H 70 5.526 5.526 5.442 0.084 26022 4142 1 9 . 1 1 70 70 LYS C C 70 175.171 175.171 174.718 0.453 26022 4143 1 9 . 1 1 70 70 LYS CA C 70 54.704 54.704 55.166 -0.462 26022 4144 1 9 . 1 1 70 70 LYS CB C 70 36.850 36.850 35.617 1.234 26022 4145 1 9 . 1 1 70 70 LYS H H 70 8.182 8.182 7.397 0.785 26022 4146 1 9 . 1 1 71 71 GLY N N 71 103.604 103.604 110.937 -7.333 26022 4147 1 9 . 1 1 71 71 GLY C C 71 171.541 171.541 172.213 -0.672 26022 4148 1 9 . 1 1 71 71 GLY CA C 71 45.462 45.462 43.925 1.537 26022 4149 1 9 . 1 1 71 71 GLY H H 71 7.780 7.780 9.180 -1.400 26022 4150 1 9 . 1 1 72 72 ARG N N 72 119.187 119.187 118.139 1.048 26022 4151 1 9 . 1 1 72 72 ARG HA H 72 4.861 4.861 5.512 -0.651 26022 4152 1 9 . 1 1 72 72 ARG C C 72 175.570 175.570 174.994 0.576 26022 4153 1 9 . 1 1 72 72 ARG CA C 72 53.624 53.624 54.361 -0.737 26022 4154 1 9 . 1 1 72 72 ARG CB C 72 34.129 34.129 33.439 0.690 26022 4155 1 9 . 1 1 72 72 ARG H H 72 8.007 8.007 8.635 -0.628 26022 4156 1 9 . 1 1 73 73 ILE N N 73 125.721 125.721 122.990 2.731 26022 4157 1 9 . 1 1 73 73 ILE HA H 73 4.263 4.263 4.939 -0.676 26022 4158 1 9 . 1 1 73 73 ILE C C 73 175.312 175.312 174.955 0.357 26022 4159 1 9 . 1 1 73 73 ILE CA C 73 62.259 62.259 59.173 3.086 26022 4160 1 9 . 1 1 73 73 ILE CB C 73 39.423 39.423 39.765 -0.342 26022 4161 1 9 . 1 1 74 74 ILE N N 74 120.540 120.540 126.085 -5.545 26022 4162 1 9 . 1 1 74 74 ILE HA H 74 4.596 4.596 4.321 0.275 26022 4163 1 9 . 1 1 74 74 ILE C C 74 176.249 176.249 174.397 1.852 26022 4164 1 9 . 1 1 74 74 ILE CA C 74 60.910 60.910 61.206 -0.296 26022 4165 1 9 . 1 1 74 74 ILE CB C 74 39.863 39.863 40.175 -0.312 26022 4166 1 9 . 1 1 75 75 ARG N N 75 118.582 118.582 116.067 2.515 26022 4167 1 9 . 1 1 75 75 ARG HA H 75 4.289 4.289 4.246 0.043 26022 4168 1 9 . 1 1 75 75 ARG C C 75 173.883 173.883 174.119 -0.236 26022 4169 1 9 . 1 1 75 75 ARG CA C 75 56.390 56.390 55.320 1.070 26022 4170 1 9 . 1 1 75 75 ARG CB C 75 34.669 34.669 32.103 2.566 26022 4171 1 9 . 1 1 75 75 ARG H H 75 7.397 7.397 7.764 -0.367 26022 4172 1 9 . 1 1 76 76 ARG N N 76 125.606 125.606 122.472 3.134 26022 4173 1 9 . 1 1 76 76 ARG HA H 76 4.609 4.609 4.361 0.248 26022 4174 1 9 . 1 1 76 76 ARG C C 76 175.312 175.312 176.711 -1.399 26022 4175 1 9 . 1 1 76 76 ARG CA C 76 55.810 55.810 55.682 0.128 26022 4176 1 9 . 1 1 76 76 ARG CB C 76 31.094 31.094 29.929 1.165 26022 4177 1 9 . 1 1 76 76 ARG H H 76 9.094 9.094 8.162 0.932 26022 4178 1 9 . 1 1 77 77 LEU N N 77 128.575 128.575 124.650 3.925 26022 4179 1 9 . 1 1 77 77 LEU HA H 77 4.372 4.372 4.453 -0.081 26022 4180 1 9 . 1 1 77 77 LEU C C 77 176.225 176.225 176.652 -0.427 26022 4181 1 9 . 1 1 77 77 LEU CA C 77 54.704 54.704 54.818 -0.114 26022 4182 1 9 . 1 1 77 77 LEU CB C 77 42.292 42.292 42.349 -0.056 26022 4183 1 9 . 1 1 77 77 LEU H H 77 8.742 8.742 8.178 0.564 26022 4184 1 9 . 1 1 78 78 LYS N N 78 119.592 119.592 123.010 -3.418 26022 4185 1 9 . 1 1 78 78 LYS HA H 78 4.302 4.302 4.340 -0.038 26022 4186 1 9 . 1 1 78 78 LYS C C 78 176.296 176.296 177.394 -1.098 26022 4187 1 9 . 1 1 78 78 LYS CA C 78 56.390 56.390 56.084 0.306 26022 4188 1 9 . 1 1 78 78 LYS CB C 78 33.994 33.994 31.560 2.434 26022 4189 1 9 . 1 1 78 78 LYS H H 78 8.090 8.090 8.473 -0.383 26022 4190 1 9 . 1 1 79 79 GLY N N 79 110.854 110.854 113.076 -2.222 26022 4191 1 9 . 1 1 79 79 GLY C C 79 174.328 174.328 174.389 -0.061 26022 4192 1 9 . 1 1 79 79 GLY CA C 79 44.990 44.990 44.295 0.695 26022 4193 1 9 . 1 1 79 79 GLY H H 79 8.520 8.520 8.287 0.233 26022 4194 1 9 . 1 1 80 80 THR N N 80 114.187 114.187 119.040 -4.853 26022 4195 1 9 . 1 1 80 80 THR HA H 80 4.237 4.237 4.286 -0.049 26022 4196 1 9 . 1 1 80 80 THR C C 80 175.054 175.054 174.334 0.720 26022 4197 1 9 . 1 1 80 80 THR CA C 80 62.242 62.242 62.348 -0.106 26022 4198 1 9 . 1 1 80 80 THR CB C 80 69.826 69.826 68.202 1.624 26022 4199 1 9 . 1 1 81 81 SER N N 81 117.958 117.958 124.315 -6.357 26022 4200 1 9 . 1 1 81 81 SER HA H 81 4.449 4.449 4.592 -0.143 26022 4201 1 9 . 1 1 81 81 SER C C 81 174.703 174.703 173.679 1.024 26022 4202 1 9 . 1 1 81 81 SER CA C 81 58.481 58.481 58.255 0.226 26022 4203 1 9 . 1 1 81 81 SER CB C 81 63.338 63.338 63.660 -0.322 26022 4204 1 9 . 1 1 81 81 SER H H 81 8.474 8.474 8.186 0.288 26022 4205 1 9 . 1 1 82 82 ASP HA H 82 4.280 4.280 4.493 -0.213 26022 4206 1 9 . 1 1 82 82 ASP C C 82 177.115 177.115 176.411 0.704 26022 4207 1 9 . 1 1 82 82 ASP CA C 82 55.176 55.176 55.343 -0.167 26022 4208 1 9 . 1 1 82 82 ASP CB C 82 42.359 42.359 41.546 0.813 26022 4209 1 9 . 1 1 83 83 ARG N N 83 121.531 121.531 117.090 4.441 26022 4210 1 9 . 1 1 83 83 ARG HA H 83 4.346 4.346 4.394 -0.048 26022 4211 1 9 . 1 1 83 83 ARG C C 83 176.342 176.342 175.658 0.684 26022 4212 1 9 . 1 1 83 83 ARG CA C 83 56.053 56.053 56.888 -0.835 26022 4213 1 9 . 1 1 83 83 ARG CB C 83 30.891 30.891 30.763 0.128 26022 4214 1 9 . 1 1 83 83 ARG H H 83 8.259 8.259 8.406 -0.147 26022 4215 1 9 . 1 1 84 84 THR N N 84 116.462 116.462 115.436 1.026 26022 4216 1 9 . 1 1 84 84 THR HA H 84 4.333 4.333 4.533 -0.200 26022 4217 1 9 . 1 1 84 84 THR C C 84 174.445 174.445 174.581 -0.136 26022 4218 1 9 . 1 1 84 84 THR CA C 84 62.254 62.254 62.542 -0.288 26022 4219 1 9 . 1 1 84 84 THR CB C 84 69.833 69.833 71.882 -2.049 26022 4220 1 9 . 1 1 85 85 ILE N N 85 123.762 123.762 124.451 -0.689 26022 4221 1 9 . 1 1 85 85 ILE HA H 85 4.188 4.188 3.810 0.378 26022 4222 1 9 . 1 1 85 85 ILE C C 85 176.155 176.155 175.427 0.728 26022 4223 1 9 . 1 1 85 85 ILE CA C 85 61.112 61.112 63.056 -1.944 26022 4224 1 9 . 1 1 85 85 ILE CB C 85 38.919 38.919 37.251 1.668 26022 4225 1 9 . 1 1 86 86 SER N N 86 120.214 120.214 119.371 0.843 26022 4226 1 9 . 1 1 86 86 SER HA H 86 4.451 4.451 4.552 -0.101 26022 4227 1 9 . 1 1 86 86 SER C C 86 174.586 174.586 173.658 0.928 26022 4228 1 9 . 1 1 86 86 SER CA C 86 58.212 58.212 58.431 -0.219 26022 4229 1 9 . 1 1 86 86 SER CB C 86 63.271 63.271 64.411 -1.140 26022 4230 1 9 . 1 1 86 86 SER H H 86 8.377 8.377 8.418 -0.041 26022 4231 1 10 . 1 1 2 2 VAL N N 2 122.187 122.187 121.826 0.361 26022 4232 1 10 . 1 1 2 2 VAL HA H 2 4.091 4.091 3.849 0.241 26022 4233 1 10 . 1 1 2 2 VAL C C 2 175.921 175.921 176.543 -0.622 26022 4234 1 10 . 1 1 2 2 VAL CA C 2 62.057 62.057 65.285 -3.228 26022 4235 1 10 . 1 1 2 2 VAL CB C 2 32.848 32.848 31.595 1.253 26022 4236 1 10 . 1 1 3 3 LYS N N 3 125.437 125.437 119.611 5.826 26022 4237 1 10 . 1 1 3 3 LYS HA H 3 4.289 4.289 4.378 -0.089 26022 4238 1 10 . 1 1 3 3 LYS C C 3 176.155 176.155 175.147 1.008 26022 4239 1 10 . 1 1 3 3 LYS CA C 3 56.323 56.323 56.329 -0.006 26022 4240 1 10 . 1 1 3 3 LYS CB C 3 33.320 33.320 29.741 3.579 26022 4241 1 10 . 1 1 3 3 LYS H H 3 8.396 8.396 8.331 0.065 26022 4242 1 10 . 1 1 4 4 ASP N N 4 121.937 121.937 120.104 1.833 26022 4243 1 10 . 1 1 4 4 ASP HA H 4 4.289 4.289 4.697 -0.408 26022 4244 1 10 . 1 1 4 4 ASP C C 4 176.319 176.319 177.509 -1.190 26022 4245 1 10 . 1 1 4 4 ASP CA C 4 54.029 54.029 55.656 -1.627 26022 4246 1 10 . 1 1 4 4 ASP CB C 4 41.280 41.280 42.830 -1.550 26022 4247 1 10 . 1 1 4 4 ASP H H 4 8.325 8.325 8.598 -0.273 26022 4248 1 10 . 1 1 5 5 GLU N N 5 122.369 122.369 122.300 0.069 26022 4249 1 10 . 1 1 5 5 GLU HA H 5 4.250 4.250 4.091 0.159 26022 4250 1 10 . 1 1 5 5 GLU C C 5 177.045 177.045 178.366 -1.321 26022 4251 1 10 . 1 1 5 5 GLU CA C 5 56.930 56.930 59.454 -2.524 26022 4252 1 10 . 1 1 5 5 GLU CB C 5 30.554 30.554 30.105 0.449 26022 4253 1 10 . 1 1 5 5 GLU H H 5 8.464 8.464 7.904 0.560 26022 4254 1 10 . 1 1 6 6 LYS N N 6 121.437 121.437 117.793 3.644 26022 4255 1 10 . 1 1 6 6 LYS HA H 6 4.282 4.282 4.404 -0.122 26022 4256 1 10 . 1 1 6 6 LYS C C 6 177.185 177.185 175.852 1.333 26022 4257 1 10 . 1 1 6 6 LYS CA C 6 56.930 56.930 55.676 1.254 26022 4258 1 10 . 1 1 6 6 LYS CB C 6 32.713 32.713 31.774 0.939 26022 4259 1 10 . 1 1 6 6 LYS H H 6 8.390 8.390 7.655 0.735 26022 4260 1 10 . 1 1 7 7 SER N N 7 115.822 115.822 112.407 3.415 26022 4261 1 10 . 1 1 7 7 SER HA H 7 4.396 4.396 4.778 -0.382 26022 4262 1 10 . 1 1 7 7 SER C C 7 174.609 174.609 174.409 0.200 26022 4263 1 10 . 1 1 7 7 SER CA C 7 58.684 58.684 57.581 1.103 26022 4264 1 10 . 1 1 7 7 SER CB C 7 63.608 63.608 63.956 -0.348 26022 4265 1 10 . 1 1 7 7 SER H H 7 8.205 8.205 7.592 0.613 26022 4266 1 10 . 1 1 8 8 LYS N N 8 122.643 122.643 122.016 0.627 26022 4267 1 10 . 1 1 8 8 LYS HA H 8 4.407 4.407 4.236 0.171 26022 4268 1 10 . 1 1 8 8 LYS C C 8 176.694 176.694 176.949 -0.255 26022 4269 1 10 . 1 1 8 8 LYS CA C 8 56.390 56.390 58.891 -2.501 26022 4270 1 10 . 1 1 8 8 LYS CB C 8 33.185 33.185 33.057 0.128 26022 4271 1 10 . 1 1 8 8 LYS H H 8 8.201 8.201 7.568 0.633 26022 4272 1 10 . 1 1 9 9 THR N N 9 113.900 113.900 115.796 -1.896 26022 4273 1 10 . 1 1 9 9 THR HA H 9 4.341 4.341 4.506 -0.165 26022 4274 1 10 . 1 1 9 9 THR C C 9 173.438 173.438 173.894 -0.456 26022 4275 1 10 . 1 1 9 9 THR CA C 9 62.529 62.529 62.337 0.193 26022 4276 1 10 . 1 1 9 9 THR CB C 9 69.342 69.342 68.416 0.926 26022 4277 1 10 . 1 1 10 10 LEU N N 10 124.082 124.082 122.059 2.023 26022 4278 1 10 . 1 1 10 10 LEU HA H 10 4.858 4.858 5.179 -0.321 26022 4279 1 10 . 1 1 10 10 LEU C C 10 175.804 175.804 174.971 0.833 26022 4280 1 10 . 1 1 10 10 LEU CA C 10 53.759 53.759 52.959 0.800 26022 4281 1 10 . 1 1 10 10 LEU CB C 10 44.653 44.653 44.376 0.277 26022 4282 1 10 . 1 1 10 10 LEU H H 10 7.786 7.786 7.976 -0.190 26022 4283 1 10 . 1 1 11 11 PHE N N 11 120.942 120.942 121.181 -0.239 26022 4284 1 10 . 1 1 11 11 PHE HA H 11 4.862 4.862 4.799 0.063 26022 4285 1 10 . 1 1 11 11 PHE C C 11 173.578 173.578 174.033 -0.455 26022 4286 1 10 . 1 1 11 11 PHE CA C 11 56.120 56.120 56.388 -0.268 26022 4287 1 10 . 1 1 11 11 PHE CB C 11 41.212 41.212 40.899 0.313 26022 4288 1 10 . 1 1 11 11 PHE H H 11 8.889 8.889 8.372 0.517 26022 4289 1 10 . 1 1 12 12 GLU N N 12 119.958 119.958 127.599 -7.641 26022 4290 1 10 . 1 1 12 12 GLU HA H 12 5.539 5.539 4.737 0.802 26022 4291 1 10 . 1 1 12 12 GLU C C 12 176.295 176.295 175.057 1.238 26022 4292 1 10 . 1 1 12 12 GLU CA C 12 54.501 54.501 54.938 -0.437 26022 4293 1 10 . 1 1 12 12 GLU CB C 12 31.768 31.768 30.982 0.786 26022 4294 1 10 . 1 1 12 12 GLU H H 12 8.285 8.285 8.444 -0.159 26022 4295 1 10 . 1 1 13 13 VAL N N 13 120.742 120.742 120.174 0.568 26022 4296 1 10 . 1 1 13 13 VAL HA H 13 4.570 4.570 4.388 0.182 26022 4297 1 10 . 1 1 13 13 VAL C C 13 173.415 173.415 174.464 -1.049 26022 4298 1 10 . 1 1 13 13 VAL CA C 13 59.696 59.696 59.075 0.621 26022 4299 1 10 . 1 1 13 13 VAL CB C 13 36.018 36.018 34.705 1.313 26022 4300 1 10 . 1 1 14 14 GLU N N 14 122.848 122.848 122.141 0.707 26022 4301 1 10 . 1 1 14 14 GLU HA H 14 5.226 5.226 5.165 0.061 26022 4302 1 10 . 1 1 14 14 GLU C C 14 176.295 176.295 176.105 0.190 26022 4303 1 10 . 1 1 14 14 GLU CA C 14 55.243 55.243 55.069 0.174 26022 4304 1 10 . 1 1 14 14 GLU CB C 14 32.173 32.173 31.690 0.483 26022 4305 1 10 . 1 1 14 14 GLU H H 14 8.492 8.492 8.579 -0.087 26022 4306 1 10 . 1 1 15 15 GLY N N 15 105.005 105.005 110.662 -5.657 26022 4307 1 10 . 1 1 15 15 GLY C C 15 170.393 170.393 171.939 -1.546 26022 4308 1 10 . 1 1 15 15 GLY CA C 15 46.002 46.002 43.852 2.151 26022 4309 1 10 . 1 1 15 15 GLY H H 15 8.454 8.454 8.496 -0.042 26022 4310 1 10 . 1 1 16 16 ALA N N 16 120.909 120.909 120.599 0.310 26022 4311 1 10 . 1 1 16 16 ALA HA H 16 5.526 5.526 5.033 0.493 26022 4312 1 10 . 1 1 16 16 ALA C C 16 176.834 176.834 175.553 1.281 26022 4313 1 10 . 1 1 16 16 ALA CA C 16 49.644 49.644 49.426 0.218 26022 4314 1 10 . 1 1 16 16 ALA CB C 16 22.054 22.054 22.563 -0.509 26022 4315 1 10 . 1 1 16 16 ALA H H 16 8.206 8.206 8.857 -0.651 26022 4316 1 10 . 1 1 17 17 VAL N N 17 122.567 122.567 121.362 1.205 26022 4317 1 10 . 1 1 17 17 VAL HA H 17 4.380 4.380 3.941 0.439 26022 4318 1 10 . 1 1 17 17 VAL C C 17 178.099 178.099 176.393 1.706 26022 4319 1 10 . 1 1 17 17 VAL CA C 17 63.608 63.608 62.618 0.990 26022 4320 1 10 . 1 1 17 17 VAL CB C 17 32.105 32.105 32.958 -0.853 26022 4321 1 10 . 1 1 18 18 THR N N 18 120.937 120.937 124.569 -3.632 26022 4322 1 10 . 1 1 18 18 THR HA H 18 4.601 4.601 4.384 0.217 26022 4323 1 10 . 1 1 18 18 THR C C 18 175.312 175.312 174.023 1.289 26022 4324 1 10 . 1 1 18 18 THR CA C 18 61.517 61.517 63.366 -1.849 26022 4325 1 10 . 1 1 18 18 THR CB C 18 69.814 69.814 69.894 -0.080 26022 4326 1 10 . 1 1 19 19 ALA N N 19 121.258 121.258 122.871 -1.613 26022 4327 1 10 . 1 1 19 19 ALA HA H 19 4.458 4.458 4.695 -0.237 26022 4328 1 10 . 1 1 19 19 ALA C C 19 174.703 174.703 174.861 -0.158 26022 4329 1 10 . 1 1 19 19 ALA CA C 19 53.017 53.017 51.740 1.277 26022 4330 1 10 . 1 1 19 19 ALA CB C 19 22.054 22.054 20.828 1.226 26022 4331 1 10 . 1 1 19 19 ALA H H 19 7.716 7.716 7.688 0.028 26022 4332 1 10 . 1 1 20 20 LEU N N 20 123.420 123.420 117.628 5.792 26022 4333 1 10 . 1 1 20 20 LEU HA H 20 4.393 4.393 5.008 -0.615 26022 4334 1 10 . 1 1 20 20 LEU C C 20 175.499 175.499 174.980 0.519 26022 4335 1 10 . 1 1 20 20 LEU CA C 20 54.839 54.839 53.211 1.628 26022 4336 1 10 . 1 1 20 20 LEU CB C 20 41.212 41.212 45.016 -3.804 26022 4337 1 10 . 1 1 20 20 LEU H H 20 8.711 8.711 8.234 0.477 26022 4338 1 10 . 1 1 21 21 LEU N N 21 124.718 124.718 120.863 3.855 26022 4339 1 10 . 1 1 21 21 LEU HA H 21 4.714 4.714 4.871 -0.157 26022 4340 1 10 . 1 1 21 21 LEU C C 21 174.328 174.328 175.574 -1.246 26022 4341 1 10 . 1 1 21 21 LEU CA C 21 52.680 52.680 52.081 0.599 26022 4342 1 10 . 1 1 21 21 LEU CB C 21 41.684 41.684 43.031 -1.347 26022 4343 1 10 . 1 1 21 21 LEU H H 21 7.773 7.773 8.760 -0.987 26022 4344 1 10 . 1 1 22 22 PRO HA H 22 4.380 4.380 4.309 0.071 26022 4345 1 10 . 1 1 22 22 PRO C C 22 175.616 175.616 175.973 -0.357 26022 4346 1 10 . 1 1 22 22 PRO CA C 22 62.529 62.529 64.192 -1.663 26022 4347 1 10 . 1 1 22 22 PRO CB C 22 32.240 32.240 31.074 1.166 26022 4348 1 10 . 1 1 23 23 ALA N N 23 120.693 120.693 119.653 1.040 26022 4349 1 10 . 1 1 23 23 ALA HA H 23 4.302 4.302 4.469 -0.167 26022 4350 1 10 . 1 1 23 23 ALA C C 23 176.178 176.178 176.409 -0.231 26022 4351 1 10 . 1 1 23 23 ALA CA C 23 52.882 52.882 50.810 2.072 26022 4352 1 10 . 1 1 23 23 ALA CB C 23 17.336 17.336 18.193 -0.857 26022 4353 1 10 . 1 1 23 23 ALA H H 23 8.675 8.675 7.729 0.946 26022 4354 1 10 . 1 1 24 24 ALA N N 24 115.540 115.540 119.486 -3.946 26022 4355 1 10 . 1 1 24 24 ALA HA H 24 3.820 3.820 3.713 0.107 26022 4356 1 10 . 1 1 24 24 ALA C C 24 175.546 175.546 175.275 0.271 26022 4357 1 10 . 1 1 24 24 ALA CA C 24 52.613 52.613 52.930 -0.317 26022 4358 1 10 . 1 1 24 24 ALA CB C 24 16.590 16.590 17.016 -0.426 26022 4359 1 10 . 1 1 24 24 ALA H H 24 8.381 8.381 7.798 0.583 26022 4360 1 10 . 1 1 25 25 GLU N N 25 114.082 114.082 116.913 -2.831 26022 4361 1 10 . 1 1 25 25 GLU HA H 25 5.148 5.148 4.562 0.586 26022 4362 1 10 . 1 1 25 25 GLU C C 25 175.757 175.757 174.449 1.308 26022 4363 1 10 . 1 1 25 25 GLU CA C 25 54.911 54.911 53.688 1.223 26022 4364 1 10 . 1 1 25 25 GLU CB C 25 32.645 32.645 32.465 0.180 26022 4365 1 10 . 1 1 25 25 GLU H H 25 6.378 6.378 7.090 -0.712 26022 4366 1 10 . 1 1 26 26 PHE N N 26 117.365 117.365 121.496 -4.131 26022 4367 1 10 . 1 1 26 26 PHE HA H 26 4.979 4.979 4.793 0.186 26022 4368 1 10 . 1 1 26 26 PHE C C 26 174.960 174.960 174.687 0.273 26022 4369 1 10 . 1 1 26 26 PHE CA C 26 56.862 56.862 56.947 -0.085 26022 4370 1 10 . 1 1 26 26 PHE CB C 26 43.371 43.371 42.938 0.433 26022 4371 1 10 . 1 1 26 26 PHE H H 26 8.950 8.950 8.920 0.030 26022 4372 1 10 . 1 1 27 27 ARG N N 27 125.082 125.082 120.618 4.464 26022 4373 1 10 . 1 1 27 27 ARG HA H 27 4.992 4.992 5.272 -0.280 26022 4374 1 10 . 1 1 27 27 ARG C C 27 175.148 175.148 174.644 0.504 26022 4375 1 10 . 1 1 27 27 ARG CA C 27 56.323 56.323 54.809 1.514 26022 4376 1 10 . 1 1 27 27 ARG CB C 27 32.240 32.240 32.958 -0.718 26022 4377 1 10 . 1 1 27 27 ARG H H 27 8.799 8.799 8.963 -0.164 26022 4378 1 10 . 1 1 28 28 VAL N N 28 127.456 127.456 120.330 7.126 26022 4379 1 10 . 1 1 28 28 VAL HA H 28 4.757 4.757 4.995 -0.238 26022 4380 1 10 . 1 1 28 28 VAL C C 28 173.602 173.602 173.698 -0.096 26022 4381 1 10 . 1 1 28 28 VAL CA C 28 60.303 60.303 59.429 0.874 26022 4382 1 10 . 1 1 28 28 VAL CB C 28 35.681 35.681 35.806 -0.125 26022 4383 1 10 . 1 1 29 29 LYS N N 29 128.096 128.096 120.959 7.137 26022 4384 1 10 . 1 1 29 29 LYS HA H 29 4.354 4.354 5.243 -0.889 26022 4385 1 10 . 1 1 29 29 LYS C C 29 176.740 176.740 174.824 1.916 26022 4386 1 10 . 1 1 29 29 LYS CA C 29 55.041 55.041 53.272 1.769 26022 4387 1 10 . 1 1 29 29 LYS CB C 29 34.062 34.062 35.797 -1.735 26022 4388 1 10 . 1 1 29 29 LYS H H 29 9.268 9.268 9.034 0.234 26022 4389 1 10 . 1 1 30 30 LEU N N 30 129.600 129.600 123.522 6.078 26022 4390 1 10 . 1 1 30 30 LEU HA H 30 4.653 4.653 4.235 0.418 26022 4391 1 10 . 1 1 30 30 LEU C C 30 178.193 178.193 177.382 0.811 26022 4392 1 10 . 1 1 30 30 LEU CA C 30 54.771 54.771 55.454 -0.683 26022 4393 1 10 . 1 1 30 30 LEU CB C 30 42.224 42.224 43.432 -1.208 26022 4394 1 10 . 1 1 30 30 LEU H H 30 9.000 9.000 8.378 0.622 26022 4395 1 10 . 1 1 31 31 ASP N N 31 120.478 120.478 124.118 -3.640 26022 4396 1 10 . 1 1 31 31 ASP HA H 31 4.458 4.458 4.423 0.035 26022 4397 1 10 . 1 1 31 31 ASP C C 31 176.155 176.155 176.427 -0.272 26022 4398 1 10 . 1 1 31 31 ASP CA C 31 55.918 55.918 56.898 -0.980 26022 4399 1 10 . 1 1 31 31 ASP CB C 31 39.593 39.593 40.495 -0.902 26022 4400 1 10 . 1 1 31 31 ASP H H 31 8.698 8.698 8.964 -0.266 26022 4401 1 10 . 1 1 32 32 ASN N N 32 115.450 115.450 116.851 -1.401 26022 4402 1 10 . 1 1 32 32 ASN HA H 32 4.588 4.588 4.682 -0.094 26022 4403 1 10 . 1 1 32 32 ASN C C 32 175.335 175.335 174.161 1.174 26022 4404 1 10 . 1 1 32 32 ASN CA C 32 53.152 53.152 53.376 -0.224 26022 4405 1 10 . 1 1 32 32 ASN CB C 32 37.367 37.367 38.856 -1.489 26022 4406 1 10 . 1 1 32 32 ASN H H 32 7.680 7.680 7.994 -0.314 26022 4407 1 10 . 1 1 33 33 GLU N N 33 111.790 111.790 117.230 -5.440 26022 4408 1 10 . 1 1 33 33 GLU HA H 33 3.898 3.898 3.950 -0.052 26022 4409 1 10 . 1 1 33 33 GLU C C 33 175.733 175.733 174.486 1.247 26022 4410 1 10 . 1 1 33 33 GLU CA C 33 58.144 58.144 57.482 0.662 26022 4411 1 10 . 1 1 33 33 GLU CB C 33 28.242 28.242 27.077 1.165 26022 4412 1 10 . 1 1 33 33 GLU H H 33 8.097 8.097 8.216 -0.119 26022 4413 1 10 . 1 1 34 34 HIS N N 34 119.193 119.193 118.859 0.334 26022 4414 1 10 . 1 1 34 34 HIS HA H 34 4.201 4.201 4.788 -0.587 26022 4415 1 10 . 1 1 34 34 HIS C C 34 173.789 173.789 173.942 -0.153 26022 4416 1 10 . 1 1 34 34 HIS CA C 34 56.053 56.053 55.246 0.807 26022 4417 1 10 . 1 1 34 34 HIS CB C 34 30.487 30.487 32.255 -1.768 26022 4418 1 10 . 1 1 34 34 HIS H H 34 7.890 7.890 8.140 -0.250 26022 4419 1 10 . 1 1 35 35 GLU HA H 35 5.400 5.400 5.516 -0.116 26022 4420 1 10 . 1 1 35 35 GLU C C 35 175.944 175.944 176.520 -0.576 26022 4421 1 10 . 1 1 35 35 GLU CA C 35 55.109 55.109 55.554 -0.445 26022 4422 1 10 . 1 1 35 35 GLU CB C 35 32.308 32.308 31.413 0.895 26022 4423 1 10 . 1 1 36 36 ILE N N 36 119.077 119.077 117.924 1.153 26022 4424 1 10 . 1 1 36 36 ILE HA H 36 4.686 4.686 4.662 0.024 26022 4425 1 10 . 1 1 36 36 ILE C C 36 173.790 173.790 174.314 -0.524 26022 4426 1 10 . 1 1 36 36 ILE CA C 36 59.156 59.156 59.624 -0.468 26022 4427 1 10 . 1 1 36 36 ILE CB C 36 42.696 42.696 41.751 0.945 26022 4428 1 10 . 1 1 37 37 ILE N N 37 122.787 122.787 118.795 3.992 26022 4429 1 10 . 1 1 37 37 ILE HA H 37 4.778 4.778 4.563 0.215 26022 4430 1 10 . 1 1 37 37 ILE C C 37 177.057 177.057 175.481 1.576 26022 4431 1 10 . 1 1 37 37 ILE CA C 37 59.723 59.723 60.920 -1.197 26022 4432 1 10 . 1 1 37 37 ILE CB C 37 37.949 37.949 39.221 -1.272 26022 4433 1 10 . 1 1 38 38 CYS N N 38 122.357 122.357 124.066 -1.709 26022 4434 1 10 . 1 1 38 38 CYS HA H 38 5.708 5.708 5.273 0.435 26022 4435 1 10 . 1 1 38 38 CYS C C 38 174.258 174.258 173.392 0.866 26022 4436 1 10 . 1 1 38 38 CYS CA C 38 56.930 56.930 56.175 0.755 26022 4437 1 10 . 1 1 38 38 CYS CB C 38 33.252 33.252 29.767 3.485 26022 4438 1 10 . 1 1 38 38 CYS H H 38 9.512 9.512 8.884 0.628 26022 4439 1 10 . 1 1 39 39 HIS N N 39 117.101 117.101 124.881 -7.780 26022 4440 1 10 . 1 1 39 39 HIS HA H 39 5.526 5.526 5.042 0.484 26022 4441 1 10 . 1 1 39 39 HIS C C 39 174.516 174.516 174.171 0.345 26022 4442 1 10 . 1 1 39 39 HIS CA C 39 54.097 54.097 55.177 -1.080 26022 4443 1 10 . 1 1 39 39 HIS CB C 39 31.701 31.701 34.579 -2.878 26022 4444 1 10 . 1 1 39 39 HIS H H 39 7.597 7.597 8.245 -0.648 26022 4445 1 10 . 1 1 40 40 VAL N N 40 117.923 117.923 120.093 -2.170 26022 4446 1 10 . 1 1 40 40 VAL HA H 40 4.614 4.614 4.276 0.338 26022 4447 1 10 . 1 1 40 40 VAL C C 40 175.804 175.804 174.893 0.911 26022 4448 1 10 . 1 1 40 40 VAL CA C 40 61.382 61.382 63.089 -1.707 26022 4449 1 10 . 1 1 40 40 VAL CB C 40 33.396 33.396 31.575 1.821 26022 4450 1 10 . 1 1 41 41 SER N N 41 119.242 119.242 122.221 -2.979 26022 4451 1 10 . 1 1 41 41 SER HA H 41 4.550 4.550 4.705 -0.155 26022 4452 1 10 . 1 1 41 41 SER C C 41 174.656 174.656 175.000 -0.344 26022 4453 1 10 . 1 1 41 41 SER CA C 41 58.126 58.126 56.741 1.385 26022 4454 1 10 . 1 1 41 41 SER CB C 41 63.470 63.470 65.568 -2.098 26022 4455 1 10 . 1 1 41 41 SER H H 41 8.341 8.341 7.929 0.412 26022 4456 1 10 . 1 1 42 42 GLY N N 42 110.569 110.569 110.677 -0.108 26022 4457 1 10 . 1 1 42 42 GLY C C 42 173.829 173.829 176.083 -2.254 26022 4458 1 10 . 1 1 42 42 GLY CA C 42 45.257 45.257 47.222 -1.965 26022 4459 1 10 . 1 1 42 42 GLY H H 42 8.380 8.380 8.703 -0.323 26022 4460 1 10 . 1 1 43 43 LYS HA H 43 3.977 3.977 3.974 0.003 26022 4461 1 10 . 1 1 43 43 LYS C C 43 179.363 179.363 179.028 0.335 26022 4462 1 10 . 1 1 43 43 LYS CA C 43 59.628 59.628 59.163 0.465 26022 4463 1 10 . 1 1 43 43 LYS CB C 43 32.510 32.510 32.435 0.075 26022 4464 1 10 . 1 1 44 44 VAL N N 44 120.404 120.404 117.831 2.573 26022 4465 1 10 . 1 1 44 44 VAL HA H 44 3.661 3.661 3.777 -0.116 26022 4466 1 10 . 1 1 44 44 VAL C C 44 179.785 179.785 178.160 1.625 26022 4467 1 10 . 1 1 44 44 VAL CA C 44 65.425 65.425 65.545 -0.120 26022 4468 1 10 . 1 1 44 44 VAL CB C 44 31.500 31.500 30.954 0.546 26022 4469 1 10 . 1 1 45 45 ARG N N 45 123.687 123.687 119.909 3.778 26022 4470 1 10 . 1 1 45 45 ARG HA H 45 4.054 4.054 4.030 0.024 26022 4471 1 10 . 1 1 45 45 ARG C C 45 179.504 179.504 178.975 0.529 26022 4472 1 10 . 1 1 45 45 ARG CA C 45 59.669 59.669 59.004 0.665 26022 4473 1 10 . 1 1 45 45 ARG CB C 45 30.417 30.417 30.033 0.384 26022 4474 1 10 . 1 1 45 45 ARG H H 45 8.608 8.608 8.305 0.303 26022 4475 1 10 . 1 1 46 46 ARG N N 46 118.506 118.506 117.303 1.203 26022 4476 1 10 . 1 1 46 46 ARG HA H 46 4.148 4.148 4.330 -0.182 26022 4477 1 10 . 1 1 46 46 ARG C C 46 177.396 177.396 176.745 0.651 26022 4478 1 10 . 1 1 46 46 ARG CA C 46 58.481 58.481 57.456 1.025 26022 4479 1 10 . 1 1 46 46 ARG CB C 46 30.554 30.554 29.102 1.452 26022 4480 1 10 . 1 1 46 46 ARG H H 46 8.474 8.474 7.676 0.798 26022 4481 1 10 . 1 1 47 47 SER N N 47 114.263 114.263 114.683 -0.420 26022 4482 1 10 . 1 1 47 47 SER HA H 47 4.393 4.393 4.460 -0.067 26022 4483 1 10 . 1 1 47 47 SER C C 47 174.070 174.070 174.383 -0.313 26022 4484 1 10 . 1 1 47 47 SER CA C 47 59.696 59.696 58.669 1.027 26022 4485 1 10 . 1 1 47 47 SER CB C 47 64.013 64.013 64.123 -0.110 26022 4486 1 10 . 1 1 47 47 SER H H 47 7.645 7.645 7.538 0.107 26022 4487 1 10 . 1 1 48 48 LYS N N 48 115.405 115.405 120.292 -4.887 26022 4488 1 10 . 1 1 48 48 LYS HA H 48 3.990 3.990 3.951 0.039 26022 4489 1 10 . 1 1 48 48 LYS C C 48 175.804 175.804 175.164 0.640 26022 4490 1 10 . 1 1 48 48 LYS CA C 48 57.537 57.537 56.967 0.570 26022 4491 1 10 . 1 1 48 48 LYS CB C 48 29.947 29.947 30.109 -0.162 26022 4492 1 10 . 1 1 48 48 LYS H H 48 7.821 7.821 7.569 0.252 26022 4493 1 10 . 1 1 49 49 ILE N N 49 117.265 117.265 120.444 -3.179 26022 4494 1 10 . 1 1 49 49 ILE HA H 49 4.041 4.041 4.261 -0.220 26022 4495 1 10 . 1 1 49 49 ILE C C 49 175.125 175.125 176.410 -1.285 26022 4496 1 10 . 1 1 49 49 ILE CA C 49 61.315 61.315 59.176 2.139 26022 4497 1 10 . 1 1 49 49 ILE CB C 49 38.919 38.919 38.669 0.250 26022 4498 1 10 . 1 1 50 50 ARG N N 50 126.687 126.687 127.743 -1.056 26022 4499 1 10 . 1 1 50 50 ARG HA H 50 4.471 4.471 4.557 -0.086 26022 4500 1 10 . 1 1 50 50 ARG C C 50 175.007 175.007 175.186 -0.179 26022 4501 1 10 . 1 1 50 50 ARG CA C 50 55.176 55.176 55.475 -0.299 26022 4502 1 10 . 1 1 50 50 ARG CB C 50 31.026 31.026 30.772 0.254 26022 4503 1 10 . 1 1 50 50 ARG H H 50 8.437 8.437 8.508 -0.071 26022 4504 1 10 . 1 1 51 51 ILE N N 51 127.722 127.722 126.693 1.029 26022 4505 1 10 . 1 1 51 51 ILE HA H 51 4.276 4.276 3.971 0.305 26022 4506 1 10 . 1 1 51 51 ILE C C 51 174.726 174.726 175.546 -0.820 26022 4507 1 10 . 1 1 51 51 ILE CA C 51 60.235 60.235 60.917 -0.682 26022 4508 1 10 . 1 1 51 51 ILE CB C 51 37.772 37.772 37.516 0.256 26022 4509 1 10 . 1 1 52 52 ILE N N 52 121.888 121.888 123.790 -1.902 26022 4510 1 10 . 1 1 52 52 ILE HA H 52 4.781 4.781 4.434 0.347 26022 4511 1 10 . 1 1 52 52 ILE C C 52 175.733 175.733 175.418 0.315 26022 4512 1 10 . 1 1 52 52 ILE CA C 52 59.021 59.021 59.193 -0.172 26022 4513 1 10 . 1 1 52 52 ILE CB C 52 42.089 42.089 39.628 2.461 26022 4514 1 10 . 1 1 53 53 ILE N N 53 119.363 119.363 123.713 -4.350 26022 4515 1 10 . 1 1 53 53 ILE HA H 53 3.338 3.338 4.001 -0.663 26022 4516 1 10 . 1 1 53 53 ILE C C 53 177.021 177.021 176.680 0.341 26022 4517 1 10 . 1 1 53 53 ILE CA C 53 64.274 64.274 62.497 1.777 26022 4518 1 10 . 1 1 53 53 ILE CB C 53 37.256 37.256 37.661 -0.405 26022 4519 1 10 . 1 1 54 54 GLY N N 54 116.136 116.136 116.253 -0.117 26022 4520 1 10 . 1 1 54 54 GLY C C 54 174.844 174.844 173.657 1.187 26022 4521 1 10 . 1 1 54 54 GLY CA C 54 45.188 45.188 44.700 0.488 26022 4522 1 10 . 1 1 54 54 GLY H H 54 8.853 8.853 8.916 -0.063 26022 4523 1 10 . 1 1 55 55 ASP N N 55 121.946 121.946 121.639 0.307 26022 4524 1 10 . 1 1 55 55 ASP HA H 55 4.588 4.588 4.673 -0.085 26022 4525 1 10 . 1 1 55 55 ASP C C 55 175.804 175.804 175.663 0.141 26022 4526 1 10 . 1 1 55 55 ASP CA C 55 55.200 55.200 53.002 2.198 26022 4527 1 10 . 1 1 55 55 ASP CB C 55 41.048 41.048 42.217 -1.169 26022 4528 1 10 . 1 1 55 55 ASP H H 55 8.054 8.054 7.776 0.278 26022 4529 1 10 . 1 1 56 56 ARG N N 56 120.974 120.974 121.611 -0.637 26022 4530 1 10 . 1 1 56 56 ARG HA H 56 5.200 5.200 4.709 0.491 26022 4531 1 10 . 1 1 56 56 ARG C C 56 176.483 176.483 176.113 0.370 26022 4532 1 10 . 1 1 56 56 ARG CA C 56 54.097 54.097 55.515 -1.418 26022 4533 1 10 . 1 1 56 56 ARG CB C 56 30.689 30.689 30.009 0.680 26022 4534 1 10 . 1 1 56 56 ARG H H 56 8.766 8.766 8.486 0.280 26022 4535 1 10 . 1 1 57 57 VAL N N 57 114.943 114.943 118.557 -3.614 26022 4536 1 10 . 1 1 57 57 VAL HA H 57 4.965 4.965 4.496 0.469 26022 4537 1 10 . 1 1 57 57 VAL C C 57 172.243 172.243 173.590 -1.347 26022 4538 1 10 . 1 1 57 57 VAL CA C 57 58.077 58.077 59.424 -1.347 26022 4539 1 10 . 1 1 57 57 VAL CB C 57 36.288 36.288 35.072 1.216 26022 4540 1 10 . 1 1 58 58 LEU N N 58 122.410 122.410 123.301 -0.891 26022 4541 1 10 . 1 1 58 58 LEU HA H 58 4.731 4.731 4.871 -0.140 26022 4542 1 10 . 1 1 58 58 LEU C C 58 174.773 174.773 174.647 0.126 26022 4543 1 10 . 1 1 58 58 LEU CA C 58 53.085 53.085 53.653 -0.568 26022 4544 1 10 . 1 1 58 58 LEU CB C 58 45.788 45.788 43.273 2.515 26022 4545 1 10 . 1 1 58 58 LEU H H 58 8.382 8.382 8.261 0.121 26022 4546 1 10 . 1 1 59 59 VAL N N 59 127.937 127.937 127.503 0.434 26022 4547 1 10 . 1 1 59 59 VAL HA H 59 4.744 4.744 4.506 0.238 26022 4548 1 10 . 1 1 59 59 VAL C C 59 174.141 174.141 173.330 0.811 26022 4549 1 10 . 1 1 59 59 VAL CA C 59 60.279 60.279 59.802 0.477 26022 4550 1 10 . 1 1 59 59 VAL CB C 59 34.399 34.399 34.800 -0.401 26022 4551 1 10 . 1 1 60 60 GLU N N 60 124.832 124.832 128.688 -3.856 26022 4552 1 10 . 1 1 60 60 GLU HA H 60 5.304 5.304 5.212 0.092 26022 4553 1 10 . 1 1 60 60 GLU C C 60 176.155 176.155 175.357 0.798 26022 4554 1 10 . 1 1 60 60 GLU CA C 60 54.164 54.164 54.211 -0.047 26022 4555 1 10 . 1 1 60 60 GLU CB C 60 33.803 33.803 30.932 2.871 26022 4556 1 10 . 1 1 60 60 GLU H H 60 9.142 9.142 8.047 1.095 26022 4557 1 10 . 1 1 61 61 MET N N 61 124.187 124.187 121.817 2.370 26022 4558 1 10 . 1 1 61 61 MET HA H 61 4.899 4.899 4.972 -0.073 26022 4559 1 10 . 1 1 61 61 MET C C 61 173.953 173.953 173.897 0.056 26022 4560 1 10 . 1 1 61 61 MET CA C 61 54.232 54.232 53.394 0.838 26022 4561 1 10 . 1 1 61 61 MET CB C 61 37.256 37.256 37.175 0.081 26022 4562 1 10 . 1 1 61 61 MET H H 61 8.984 8.984 8.984 -0.000 26022 4563 1 10 . 1 1 62 62 SER N N 62 116.623 116.623 117.111 -0.488 26022 4564 1 10 . 1 1 62 62 SER HA H 62 4.263 4.263 4.740 -0.477 26022 4565 1 10 . 1 1 62 62 SER C C 62 176.413 176.413 174.990 1.423 26022 4566 1 10 . 1 1 62 62 SER CA C 62 56.893 56.893 57.488 -0.595 26022 4567 1 10 . 1 1 62 62 SER CB C 62 65.362 65.362 63.559 1.803 26022 4568 1 10 . 1 1 62 62 SER H H 62 9.167 9.167 8.512 0.654 26022 4569 1 10 . 1 1 63 63 ILE N N 63 121.187 121.187 124.538 -3.351 26022 4570 1 10 . 1 1 63 63 ILE HA H 63 3.989 3.989 3.792 0.197 26022 4571 1 10 . 1 1 63 63 ILE C C 63 176.623 176.623 175.754 0.869 26022 4572 1 10 . 1 1 63 63 ILE CA C 63 63.878 63.878 61.997 1.881 26022 4573 1 10 . 1 1 63 63 ILE CB C 63 38.244 38.244 37.127 1.117 26022 4574 1 10 . 1 1 64 64 TYR N N 64 120.214 120.214 119.700 0.514 26022 4575 1 10 . 1 1 64 64 TYR HA H 64 4.432 4.432 4.275 0.157 26022 4576 1 10 . 1 1 64 64 TYR C C 64 177.092 177.092 176.899 0.193 26022 4577 1 10 . 1 1 64 64 TYR CA C 64 59.156 59.156 60.205 -1.049 26022 4578 1 10 . 1 1 64 64 TYR CB C 64 38.109 38.109 38.442 -0.333 26022 4579 1 10 . 1 1 64 64 TYR H H 64 7.762 7.762 7.541 0.221 26022 4580 1 10 . 1 1 65 65 ASP N N 65 121.338 121.338 114.704 6.634 26022 4581 1 10 . 1 1 65 65 ASP HA H 65 4.495 4.495 4.708 -0.213 26022 4582 1 10 . 1 1 65 65 ASP C C 65 177.349 177.349 178.130 -0.781 26022 4583 1 10 . 1 1 65 65 ASP CA C 65 55.243 55.243 54.763 0.480 26022 4584 1 10 . 1 1 65 65 ASP CB C 65 40.538 40.538 41.168 -0.630 26022 4585 1 10 . 1 1 65 65 ASP H H 65 7.798 7.798 8.291 -0.493 26022 4586 1 10 . 1 1 66 66 ARG N N 66 121.118 121.118 120.854 0.264 26022 4587 1 10 . 1 1 66 66 ARG HA H 66 4.069 4.069 4.289 -0.220 26022 4588 1 10 . 1 1 66 66 ARG C C 66 178.448 178.448 177.476 0.972 26022 4589 1 10 . 1 1 66 66 ARG CA C 66 58.401 58.401 58.656 -0.255 26022 4590 1 10 . 1 1 66 66 ARG CB C 66 30.184 30.184 29.461 0.723 26022 4591 1 10 . 1 1 66 66 ARG H H 66 8.382 8.382 8.578 -0.196 26022 4592 1 10 . 1 1 67 67 ASN N N 67 117.334 117.334 117.616 -0.282 26022 4593 1 10 . 1 1 67 67 ASN HA H 67 4.601 4.601 4.742 -0.141 26022 4594 1 10 . 1 1 67 67 ASN C C 67 175.288 175.288 174.878 0.410 26022 4595 1 10 . 1 1 67 67 ASN CA C 67 54.097 54.097 52.473 1.624 26022 4596 1 10 . 1 1 67 67 ASN CB C 67 38.514 38.514 37.407 1.107 26022 4597 1 10 . 1 1 67 67 ASN H H 67 8.194 8.194 8.386 -0.192 26022 4598 1 10 . 1 1 68 68 ALA N N 68 122.187 122.187 122.387 -0.200 26022 4599 1 10 . 1 1 68 68 ALA HA H 68 4.575 4.575 4.616 -0.041 26022 4600 1 10 . 1 1 68 68 ALA C C 68 176.272 176.272 178.240 -1.968 26022 4601 1 10 . 1 1 68 68 ALA CA C 68 52.478 52.478 53.682 -1.204 26022 4602 1 10 . 1 1 68 68 ALA CB C 68 19.086 19.086 19.158 -0.072 26022 4603 1 10 . 1 1 68 68 ALA H H 68 7.658 7.658 7.338 0.320 26022 4604 1 10 . 1 1 69 69 LYS N N 69 116.931 116.931 117.047 -0.116 26022 4605 1 10 . 1 1 69 69 LYS HA H 69 4.197 4.197 4.160 0.037 26022 4606 1 10 . 1 1 69 69 LYS C C 69 176.085 176.085 176.568 -0.483 26022 4607 1 10 . 1 1 69 69 LYS CA C 69 56.728 56.728 59.042 -2.314 26022 4608 1 10 . 1 1 69 69 LYS CB C 69 31.566 31.566 32.983 -1.417 26022 4609 1 10 . 1 1 69 69 LYS H H 69 8.255 8.255 8.053 0.202 26022 4610 1 10 . 1 1 70 70 LYS N N 70 119.854 119.854 115.701 4.153 26022 4611 1 10 . 1 1 70 70 LYS HA H 70 5.526 5.526 5.234 0.292 26022 4612 1 10 . 1 1 70 70 LYS C C 70 175.171 175.171 175.952 -0.781 26022 4613 1 10 . 1 1 70 70 LYS CA C 70 54.704 54.704 54.413 0.291 26022 4614 1 10 . 1 1 70 70 LYS CB C 70 36.850 36.850 35.518 1.332 26022 4615 1 10 . 1 1 70 70 LYS H H 70 8.182 8.182 7.469 0.713 26022 4616 1 10 . 1 1 71 71 GLY N N 71 103.604 103.604 107.562 -3.958 26022 4617 1 10 . 1 1 71 71 GLY C C 71 171.541 171.541 172.881 -1.340 26022 4618 1 10 . 1 1 71 71 GLY CA C 71 45.462 45.462 43.502 1.960 26022 4619 1 10 . 1 1 71 71 GLY H H 71 7.780 7.780 8.745 -0.965 26022 4620 1 10 . 1 1 72 72 ARG N N 72 119.187 119.187 120.747 -1.560 26022 4621 1 10 . 1 1 72 72 ARG HA H 72 4.861 4.861 5.073 -0.212 26022 4622 1 10 . 1 1 72 72 ARG C C 72 175.570 175.570 175.428 0.142 26022 4623 1 10 . 1 1 72 72 ARG CA C 72 53.624 53.624 54.774 -1.150 26022 4624 1 10 . 1 1 72 72 ARG CB C 72 34.129 34.129 30.588 3.541 26022 4625 1 10 . 1 1 72 72 ARG H H 72 8.007 8.007 7.967 0.040 26022 4626 1 10 . 1 1 73 73 ILE N N 73 125.721 125.721 125.385 0.336 26022 4627 1 10 . 1 1 73 73 ILE HA H 73 4.263 4.263 4.816 -0.553 26022 4628 1 10 . 1 1 73 73 ILE C C 73 175.312 175.312 175.261 0.051 26022 4629 1 10 . 1 1 73 73 ILE CA C 73 62.259 62.259 60.591 1.668 26022 4630 1 10 . 1 1 73 73 ILE CB C 73 39.423 39.423 39.769 -0.346 26022 4631 1 10 . 1 1 74 74 ILE N N 74 120.540 120.540 126.288 -5.748 26022 4632 1 10 . 1 1 74 74 ILE HA H 74 4.596 4.596 4.282 0.314 26022 4633 1 10 . 1 1 74 74 ILE C C 74 176.249 176.249 174.326 1.923 26022 4634 1 10 . 1 1 74 74 ILE CA C 74 60.910 60.910 61.403 -0.493 26022 4635 1 10 . 1 1 74 74 ILE CB C 74 39.863 39.863 40.027 -0.164 26022 4636 1 10 . 1 1 75 75 ARG N N 75 118.582 118.582 117.545 1.037 26022 4637 1 10 . 1 1 75 75 ARG HA H 75 4.289 4.289 4.328 -0.039 26022 4638 1 10 . 1 1 75 75 ARG C C 75 173.883 173.883 174.091 -0.208 26022 4639 1 10 . 1 1 75 75 ARG CA C 75 56.390 56.390 55.250 1.140 26022 4640 1 10 . 1 1 75 75 ARG CB C 75 34.669 34.669 32.340 2.329 26022 4641 1 10 . 1 1 75 75 ARG H H 75 7.397 7.397 7.772 -0.375 26022 4642 1 10 . 1 1 76 76 ARG N N 76 125.606 125.606 122.113 3.493 26022 4643 1 10 . 1 1 76 76 ARG HA H 76 4.609 4.609 4.246 0.363 26022 4644 1 10 . 1 1 76 76 ARG C C 76 175.312 175.312 176.096 -0.784 26022 4645 1 10 . 1 1 76 76 ARG CA C 76 55.810 55.810 55.826 -0.016 26022 4646 1 10 . 1 1 76 76 ARG CB C 76 31.094 31.094 30.396 0.698 26022 4647 1 10 . 1 1 76 76 ARG H H 76 9.094 9.094 8.181 0.913 26022 4648 1 10 . 1 1 77 77 LEU N N 77 128.575 128.575 123.799 4.776 26022 4649 1 10 . 1 1 77 77 LEU HA H 77 4.372 4.372 4.233 0.139 26022 4650 1 10 . 1 1 77 77 LEU C C 77 176.225 176.225 176.695 -0.470 26022 4651 1 10 . 1 1 77 77 LEU CA C 77 54.704 54.704 55.067 -0.363 26022 4652 1 10 . 1 1 77 77 LEU CB C 77 42.292 42.292 42.212 0.080 26022 4653 1 10 . 1 1 77 77 LEU H H 77 8.742 8.742 8.198 0.544 26022 4654 1 10 . 1 1 78 78 LYS N N 78 119.592 119.592 121.636 -2.044 26022 4655 1 10 . 1 1 78 78 LYS HA H 78 4.302 4.302 4.127 0.175 26022 4656 1 10 . 1 1 78 78 LYS C C 78 176.296 176.296 178.144 -1.848 26022 4657 1 10 . 1 1 78 78 LYS CA C 78 56.390 56.390 56.808 -0.418 26022 4658 1 10 . 1 1 78 78 LYS CB C 78 33.994 33.994 32.585 1.409 26022 4659 1 10 . 1 1 78 78 LYS H H 78 8.090 8.090 8.228 -0.138 26022 4660 1 10 . 1 1 79 79 GLY N N 79 110.854 110.854 111.302 -0.448 26022 4661 1 10 . 1 1 79 79 GLY C C 79 174.328 174.328 174.911 -0.583 26022 4662 1 10 . 1 1 79 79 GLY CA C 79 44.990 44.990 45.205 -0.215 26022 4663 1 10 . 1 1 79 79 GLY H H 79 8.520 8.520 8.516 0.004 26022 4664 1 10 . 1 1 80 80 THR N N 80 114.187 114.187 115.549 -1.362 26022 4665 1 10 . 1 1 80 80 THR HA H 80 4.237 4.237 4.218 0.019 26022 4666 1 10 . 1 1 80 80 THR C C 80 175.054 175.054 174.287 0.767 26022 4667 1 10 . 1 1 80 80 THR CA C 80 62.242 62.242 63.188 -0.946 26022 4668 1 10 . 1 1 80 80 THR CB C 80 69.826 69.826 69.358 0.468 26022 4669 1 10 . 1 1 81 81 SER N N 81 117.958 117.958 115.830 2.128 26022 4670 1 10 . 1 1 81 81 SER HA H 81 4.449 4.449 4.658 -0.209 26022 4671 1 10 . 1 1 81 81 SER C C 81 174.703 174.703 172.857 1.846 26022 4672 1 10 . 1 1 81 81 SER CA C 81 58.481 58.481 57.758 0.723 26022 4673 1 10 . 1 1 81 81 SER CB C 81 63.338 63.338 65.072 -1.734 26022 4674 1 10 . 1 1 81 81 SER H H 81 8.474 8.474 7.698 0.776 26022 4675 1 10 . 1 1 82 82 ASP HA H 82 4.280 4.280 4.668 -0.388 26022 4676 1 10 . 1 1 82 82 ASP C C 82 177.115 177.115 177.100 0.015 26022 4677 1 10 . 1 1 82 82 ASP CA C 82 55.176 55.176 54.830 0.346 26022 4678 1 10 . 1 1 82 82 ASP CB C 82 42.359 42.359 41.438 0.921 26022 4679 1 10 . 1 1 83 83 ARG N N 83 121.531 121.531 116.836 4.695 26022 4680 1 10 . 1 1 83 83 ARG HA H 83 4.346 4.346 4.001 0.345 26022 4681 1 10 . 1 1 83 83 ARG C C 83 176.342 176.342 176.795 -0.453 26022 4682 1 10 . 1 1 83 83 ARG CA C 83 56.053 56.053 58.580 -2.527 26022 4683 1 10 . 1 1 83 83 ARG CB C 83 30.891 30.891 29.387 1.504 26022 4684 1 10 . 1 1 83 83 ARG H H 83 8.259 8.259 8.513 -0.254 26022 4685 1 10 . 1 1 84 84 THR N N 84 116.462 116.462 112.004 4.458 26022 4686 1 10 . 1 1 84 84 THR HA H 84 4.333 4.333 4.341 -0.008 26022 4687 1 10 . 1 1 84 84 THR C C 84 174.445 174.445 174.304 0.141 26022 4688 1 10 . 1 1 84 84 THR CA C 84 62.254 62.254 63.183 -0.929 26022 4689 1 10 . 1 1 84 84 THR CB C 84 69.833 69.833 70.159 -0.326 26022 4690 1 10 . 1 1 85 85 ILE N N 85 123.762 123.762 119.128 4.634 26022 4691 1 10 . 1 1 85 85 ILE HA H 85 4.188 4.188 3.887 0.301 26022 4692 1 10 . 1 1 85 85 ILE C C 85 176.155 176.155 174.325 1.830 26022 4693 1 10 . 1 1 85 85 ILE CA C 85 61.112 61.112 62.584 -1.472 26022 4694 1 10 . 1 1 85 85 ILE CB C 85 38.919 38.919 35.823 3.096 26022 4695 1 10 . 1 1 86 86 SER N N 86 120.214 120.214 114.791 5.423 26022 4696 1 10 . 1 1 86 86 SER HA H 86 4.451 4.451 4.627 -0.176 26022 4697 1 10 . 1 1 86 86 SER C C 86 174.586 174.586 174.245 0.341 26022 4698 1 10 . 1 1 86 86 SER CA C 86 58.212 58.212 57.995 0.217 26022 4699 1 10 . 1 1 86 86 SER CB C 86 63.271 63.271 63.776 -0.505 26022 4700 1 10 . 1 1 86 86 SER H H 86 8.377 8.377 8.308 0.069 26022 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 81 3.579 -0.159 3.598 26022 2 1 1 "Average Difference" HA 90 0.393 -0.022 0.394 26022 3 1 1 "Average Difference" C 85 0.979 -0.220 0.960 26022 4 1 1 "Average Difference" CA 85 1.203 -0.066 1.209 26022 5 1 1 "Average Difference" CB 80 1.482 -0.354 1.448 26022 6 1 1 "Average Difference" HN 59 0.533 -0.078 0.532 26022 7 1 2 "Average Difference" N 81 3.090 0.325 3.092 26022 8 1 2 "Average Difference" HA 90 0.354 0.005 0.356 26022 9 1 2 "Average Difference" C 85 1.037 -0.203 1.023 26022 10 1 2 "Average Difference" CA 85 1.168 -0.151 1.165 26022 11 1 2 "Average Difference" CB 80 1.457 -0.242 1.446 26022 12 1 2 "Average Difference" HN 59 0.565 -0.049 0.568 26022 13 1 3 "Average Difference" N 81 3.439 0.394 3.438 26022 14 1 3 "Average Difference" HA 90 0.389 -0.006 0.391 26022 15 1 3 "Average Difference" C 85 1.065 -0.152 1.060 26022 16 1 3 "Average Difference" CA 85 1.182 -0.098 1.185 26022 17 1 3 "Average Difference" CB 80 1.612 -0.302 1.593 26022 18 1 3 "Average Difference" HN 59 0.455 -0.041 0.457 26022 19 1 4 "Average Difference" N 81 3.353 0.007 3.374 26022 20 1 4 "Average Difference" HA 90 0.348 0.024 0.349 26022 21 1 4 "Average Difference" C 85 0.987 -0.256 0.959 26022 22 1 4 "Average Difference" CA 85 1.153 -0.008 1.159 26022 23 1 4 "Average Difference" CB 80 1.444 -0.196 1.440 26022 24 1 4 "Average Difference" HN 59 0.478 -0.095 0.473 26022 25 1 5 "Average Difference" N 81 3.462 -0.215 3.477 26022 26 1 5 "Average Difference" HA 90 0.375 0.041 0.375 26022 27 1 5 "Average Difference" C 85 0.991 -0.258 0.963 26022 28 1 5 "Average Difference" CA 85 1.205 -0.051 1.211 26022 29 1 5 "Average Difference" CB 80 1.259 -0.124 1.261 26022 30 1 5 "Average Difference" HN 59 0.480 0.013 0.484 26022 31 1 6 "Average Difference" N 81 3.692 -0.245 3.706 26022 32 1 6 "Average Difference" HA 90 0.351 0.006 0.353 26022 33 1 6 "Average Difference" C 85 1.053 -0.294 1.017 26022 34 1 6 "Average Difference" CA 85 1.191 -0.084 1.195 26022 35 1 6 "Average Difference" CB 80 1.398 -0.230 1.388 26022 36 1 6 "Average Difference" HN 59 0.527 -0.012 0.532 26022 37 1 7 "Average Difference" N 81 3.411 -0.509 3.393 26022 38 1 7 "Average Difference" HA 90 0.378 0.002 0.380 26022 39 1 7 "Average Difference" C 85 1.000 -0.252 0.973 26022 40 1 7 "Average Difference" CA 85 1.167 -0.070 1.171 26022 41 1 7 "Average Difference" CB 80 1.292 -0.132 1.293 26022 42 1 7 "Average Difference" HN 59 0.493 -0.038 0.496 26022 43 1 8 "Average Difference" N 81 3.452 0.508 3.436 26022 44 1 8 "Average Difference" HA 90 0.357 0.031 0.358 26022 45 1 8 "Average Difference" C 85 1.038 -0.362 0.978 26022 46 1 8 "Average Difference" CA 85 1.146 -0.201 1.135 26022 47 1 8 "Average Difference" CB 80 1.282 -0.152 1.281 26022 48 1 8 "Average Difference" HN 59 0.493 -0.055 0.494 26022 49 1 9 "Average Difference" N 81 3.488 0.321 3.494 26022 50 1 9 "Average Difference" HA 90 0.377 0.036 0.377 26022 51 1 9 "Average Difference" C 85 0.963 -0.189 0.950 26022 52 1 9 "Average Difference" CA 85 1.156 -0.127 1.156 26022 53 1 9 "Average Difference" CB 80 1.410 -0.160 1.410 26022 54 1 9 "Average Difference" HN 59 0.486 0.006 0.490 26022 55 1 10 "Average Difference" N 81 3.420 -0.179 3.437 26022 56 1 10 "Average Difference" HA 90 0.371 -0.002 0.373 26022 57 1 10 "Average Difference" C 85 0.962 -0.152 0.955 26022 58 1 10 "Average Difference" CA 85 1.239 -0.026 1.246 26022 59 1 10 "Average Difference" CB 80 1.420 -0.290 1.399 26022 60 1 10 "Average Difference" HN 59 0.483 -0.116 0.473 26022 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 26022 _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 VAL N N 2 122.187 122.187 120.122 2.065 26022 2 1 . 1 1 2 2 VAL HA H 2 4.091 4.091 4.082 0.009 26022 3 1 . 1 1 2 2 VAL C C 2 175.921 175.921 175.841 0.080 26022 4 1 . 1 1 2 2 VAL CA C 2 62.057 62.057 63.615 -1.558 26022 5 1 . 1 1 2 2 VAL CB C 2 32.848 32.848 31.774 1.074 26022 6 1 . 1 1 3 3 LYS N N 3 125.437 125.437 123.157 2.280 26022 7 1 . 1 1 3 3 LYS HA H 3 4.289 4.289 4.577 -0.288 26022 8 1 . 1 1 3 3 LYS C C 3 176.155 176.155 175.302 0.854 26022 9 1 . 1 1 3 3 LYS CA C 3 56.323 56.323 56.041 0.282 26022 10 1 . 1 1 3 3 LYS CB C 3 33.320 33.320 31.611 1.709 26022 11 1 . 1 1 3 3 LYS H H 3 8.396 8.396 8.219 0.177 26022 12 1 . 1 1 4 4 ASP N N 4 121.937 121.937 122.112 -0.175 26022 13 1 . 1 1 4 4 ASP HA H 4 4.289 4.289 4.719 -0.430 26022 14 1 . 1 1 4 4 ASP C C 4 176.319 176.319 177.294 -0.975 26022 15 1 . 1 1 4 4 ASP CA C 4 54.029 54.029 55.645 -1.616 26022 16 1 . 1 1 4 4 ASP CB C 4 41.280 41.280 42.085 -0.805 26022 17 1 . 1 1 4 4 ASP H H 4 8.325 8.325 8.405 -0.080 26022 18 1 . 1 1 5 5 GLU N N 5 122.369 122.369 120.696 1.673 26022 19 1 . 1 1 5 5 GLU HA H 5 4.250 4.250 4.119 0.131 26022 20 1 . 1 1 5 5 GLU C C 5 177.045 177.045 177.318 -0.273 26022 21 1 . 1 1 5 5 GLU CA C 5 56.930 56.930 58.653 -1.723 26022 22 1 . 1 1 5 5 GLU CB C 5 30.554 30.554 29.719 0.835 26022 23 1 . 1 1 5 5 GLU H H 5 8.464 8.464 8.605 -0.141 26022 24 1 . 1 1 6 6 LYS N N 6 121.437 121.437 118.248 3.189 26022 25 1 . 1 1 6 6 LYS HA H 6 4.282 4.282 4.436 -0.154 26022 26 1 . 1 1 6 6 LYS C C 6 177.185 177.185 175.886 1.300 26022 27 1 . 1 1 6 6 LYS CA C 6 56.930 56.930 55.702 1.228 26022 28 1 . 1 1 6 6 LYS CB C 6 32.713 32.713 32.005 0.708 26022 29 1 . 1 1 6 6 LYS H H 6 8.390 8.390 8.138 0.252 26022 30 1 . 1 1 7 7 SER N N 7 115.822 115.822 115.478 0.344 26022 31 1 . 1 1 7 7 SER HA H 7 4.396 4.396 4.526 -0.130 26022 32 1 . 1 1 7 7 SER C C 7 174.609 174.609 174.621 -0.012 26022 33 1 . 1 1 7 7 SER CA C 7 58.684 58.684 58.764 -0.080 26022 34 1 . 1 1 7 7 SER CB C 7 63.608 63.608 63.209 0.399 26022 35 1 . 1 1 7 7 SER H H 7 8.205 8.205 8.168 0.037 26022 36 1 . 1 1 8 8 LYS N N 8 122.643 122.643 121.432 1.211 26022 37 1 . 1 1 8 8 LYS HA H 8 4.407 4.407 4.301 0.106 26022 38 1 . 1 1 8 8 LYS C C 8 176.694 176.694 176.516 0.178 26022 39 1 . 1 1 8 8 LYS CA C 8 56.390 56.390 57.384 -0.994 26022 40 1 . 1 1 8 8 LYS CB C 8 33.185 33.185 32.723 0.462 26022 41 1 . 1 1 8 8 LYS H H 8 8.201 8.201 8.108 0.093 26022 42 1 . 1 1 9 9 THR N N 9 113.900 113.900 117.069 -3.169 26022 43 1 . 1 1 9 9 THR HA H 9 4.341 4.341 4.433 -0.092 26022 44 1 . 1 1 9 9 THR C C 9 173.438 173.438 173.475 -0.037 26022 45 1 . 1 1 9 9 THR CA C 9 62.529 62.529 62.388 0.141 26022 46 1 . 1 1 9 9 THR CB C 9 69.342 69.342 68.004 1.339 26022 47 1 . 1 1 10 10 LEU N N 10 124.082 124.082 122.547 1.535 26022 48 1 . 1 1 10 10 LEU HA H 10 4.858 4.858 4.799 0.059 26022 49 1 . 1 1 10 10 LEU C C 10 175.804 175.804 174.673 1.131 26022 50 1 . 1 1 10 10 LEU CA C 10 53.759 53.759 53.622 0.137 26022 51 1 . 1 1 10 10 LEU CB C 10 44.653 44.653 44.996 -0.343 26022 52 1 . 1 1 10 10 LEU H H 10 7.786 7.786 7.813 -0.027 26022 53 1 . 1 1 11 11 PHE N N 11 120.942 120.942 121.592 -0.650 26022 54 1 . 1 1 11 11 PHE HA H 11 4.862 4.862 4.843 0.019 26022 55 1 . 1 1 11 11 PHE C C 11 173.578 173.578 174.152 -0.574 26022 56 1 . 1 1 11 11 PHE CA C 11 56.120 56.120 56.751 -0.631 26022 57 1 . 1 1 11 11 PHE CB C 11 41.212 41.212 42.039 -0.827 26022 58 1 . 1 1 11 11 PHE H H 11 8.889 8.889 8.960 -0.071 26022 59 1 . 1 1 12 12 GLU N N 12 119.958 119.958 126.685 -6.727 26022 60 1 . 1 1 12 12 GLU HA H 12 5.539 5.539 4.947 0.592 26022 61 1 . 1 1 12 12 GLU C C 12 176.295 176.295 174.982 1.313 26022 62 1 . 1 1 12 12 GLU CA C 12 54.501 54.501 55.120 -0.619 26022 63 1 . 1 1 12 12 GLU CB C 12 31.768 31.768 31.077 0.690 26022 64 1 . 1 1 12 12 GLU H H 12 8.285 8.285 8.196 0.089 26022 65 1 . 1 1 13 13 VAL N N 13 120.742 120.742 122.863 -2.121 26022 66 1 . 1 1 13 13 VAL HA H 13 4.570 4.570 4.399 0.171 26022 67 1 . 1 1 13 13 VAL C C 13 173.415 173.415 174.412 -0.997 26022 68 1 . 1 1 13 13 VAL CA C 13 59.696 59.696 59.753 -0.057 26022 69 1 . 1 1 13 13 VAL CB C 13 36.018 36.018 35.332 0.686 26022 70 1 . 1 1 14 14 GLU N N 14 122.848 122.848 122.938 -0.090 26022 71 1 . 1 1 14 14 GLU HA H 14 5.226 5.226 5.167 0.059 26022 72 1 . 1 1 14 14 GLU C C 14 176.295 176.295 176.087 0.208 26022 73 1 . 1 1 14 14 GLU CA C 14 55.243 55.243 55.426 -0.183 26022 74 1 . 1 1 14 14 GLU CB C 14 32.173 32.173 31.374 0.799 26022 75 1 . 1 1 14 14 GLU H H 14 8.492 8.492 8.608 -0.116 26022 76 1 . 1 1 15 15 GLY N N 15 105.005 105.005 109.060 -4.055 26022 77 1 . 1 1 15 15 GLY C C 15 170.393 170.393 172.059 -1.666 26022 78 1 . 1 1 15 15 GLY CA C 15 46.002 46.002 44.634 1.368 26022 79 1 . 1 1 15 15 GLY H H 15 8.454 8.454 8.697 -0.243 26022 80 1 . 1 1 16 16 ALA N N 16 120.909 120.909 122.291 -1.382 26022 81 1 . 1 1 16 16 ALA HA H 16 5.526 5.526 5.007 0.519 26022 82 1 . 1 1 16 16 ALA C C 16 176.834 176.834 175.861 0.973 26022 83 1 . 1 1 16 16 ALA CA C 16 49.644 49.644 50.293 -0.649 26022 84 1 . 1 1 16 16 ALA CB C 16 22.054 22.054 21.938 0.116 26022 85 1 . 1 1 16 16 ALA H H 16 8.206 8.206 8.432 -0.226 26022 86 1 . 1 1 17 17 VAL N N 17 122.567 122.567 123.574 -1.007 26022 87 1 . 1 1 17 17 VAL HA H 17 4.380 4.380 4.089 0.291 26022 88 1 . 1 1 17 17 VAL C C 17 178.099 178.099 175.525 2.574 26022 89 1 . 1 1 17 17 VAL CA C 17 63.608 63.608 62.665 0.943 26022 90 1 . 1 1 17 17 VAL CB C 17 32.105 32.105 33.020 -0.915 26022 91 1 . 1 1 18 18 THR N N 18 120.937 120.937 124.754 -3.817 26022 92 1 . 1 1 18 18 THR HA H 18 4.601 4.601 4.490 0.111 26022 93 1 . 1 1 18 18 THR C C 18 175.312 175.312 173.850 1.462 26022 94 1 . 1 1 18 18 THR CA C 18 61.517 61.517 62.328 -0.811 26022 95 1 . 1 1 18 18 THR CB C 18 69.814 69.814 69.729 0.085 26022 96 1 . 1 1 19 19 ALA N N 19 121.258 121.258 122.903 -1.645 26022 97 1 . 1 1 19 19 ALA HA H 19 4.458 4.458 4.677 -0.219 26022 98 1 . 1 1 19 19 ALA C C 19 174.703 174.703 174.753 -0.050 26022 99 1 . 1 1 19 19 ALA CA C 19 53.017 53.017 51.849 1.168 26022 100 1 . 1 1 19 19 ALA CB C 19 22.054 22.054 21.029 1.025 26022 101 1 . 1 1 19 19 ALA H H 19 7.716 7.716 7.682 0.034 26022 102 1 . 1 1 20 20 LEU N N 20 123.420 123.420 117.724 5.696 26022 103 1 . 1 1 20 20 LEU HA H 20 4.393 4.393 5.167 -0.774 26022 104 1 . 1 1 20 20 LEU C C 20 175.499 175.499 174.825 0.674 26022 105 1 . 1 1 20 20 LEU CA C 20 54.839 54.839 53.330 1.509 26022 106 1 . 1 1 20 20 LEU CB C 20 41.212 41.212 45.376 -4.164 26022 107 1 . 1 1 20 20 LEU H H 20 8.711 8.711 8.284 0.427 26022 108 1 . 1 1 21 21 LEU N N 21 124.718 124.718 121.790 2.928 26022 109 1 . 1 1 21 21 LEU HA H 21 4.714 4.714 4.916 -0.202 26022 110 1 . 1 1 21 21 LEU C C 21 174.328 174.328 175.637 -1.309 26022 111 1 . 1 1 21 21 LEU CA C 21 52.680 52.680 51.698 0.982 26022 112 1 . 1 1 21 21 LEU CB C 21 41.684 41.684 43.755 -2.072 26022 113 1 . 1 1 21 21 LEU H H 21 7.773 7.773 8.701 -0.928 26022 114 1 . 1 1 22 22 PRO HA H 22 4.380 4.380 4.301 0.079 26022 115 1 . 1 1 22 22 PRO C C 22 175.616 175.616 175.976 -0.360 26022 116 1 . 1 1 22 22 PRO CA C 22 62.529 62.529 64.166 -1.637 26022 117 1 . 1 1 22 22 PRO CB C 22 32.240 32.240 30.815 1.425 26022 118 1 . 1 1 23 23 ALA N N 23 120.693 120.693 120.242 0.451 26022 119 1 . 1 1 23 23 ALA HA H 23 4.302 4.302 4.389 -0.087 26022 120 1 . 1 1 23 23 ALA C C 23 176.178 176.178 176.700 -0.522 26022 121 1 . 1 1 23 23 ALA CA C 23 52.882 52.882 51.299 1.583 26022 122 1 . 1 1 23 23 ALA CB C 23 17.336 17.336 18.609 -1.273 26022 123 1 . 1 1 23 23 ALA H H 23 8.675 8.675 7.767 0.908 26022 124 1 . 1 1 24 24 ALA N N 24 115.540 115.540 119.589 -4.049 26022 125 1 . 1 1 24 24 ALA HA H 24 3.820 3.820 3.696 0.124 26022 126 1 . 1 1 24 24 ALA C C 24 175.546 175.546 175.735 -0.189 26022 127 1 . 1 1 24 24 ALA CA C 24 52.613 52.613 52.945 -0.332 26022 128 1 . 1 1 24 24 ALA CB C 24 16.590 16.590 17.194 -0.604 26022 129 1 . 1 1 24 24 ALA H H 24 8.381 8.381 7.917 0.464 26022 130 1 . 1 1 25 25 GLU N N 25 114.082 114.082 117.227 -3.145 26022 131 1 . 1 1 25 25 GLU HA H 25 5.148 5.148 4.777 0.371 26022 132 1 . 1 1 25 25 GLU C C 25 175.757 175.757 174.723 1.034 26022 133 1 . 1 1 25 25 GLU CA C 25 54.911 54.911 54.164 0.747 26022 134 1 . 1 1 25 25 GLU CB C 25 32.645 32.645 32.050 0.594 26022 135 1 . 1 1 25 25 GLU H H 25 6.378 6.378 7.274 -0.896 26022 136 1 . 1 1 26 26 PHE N N 26 117.365 117.365 122.854 -5.489 26022 137 1 . 1 1 26 26 PHE HA H 26 4.979 4.979 4.893 0.086 26022 138 1 . 1 1 26 26 PHE C C 26 174.960 174.960 174.821 0.139 26022 139 1 . 1 1 26 26 PHE CA C 26 56.862 56.862 56.912 -0.050 26022 140 1 . 1 1 26 26 PHE CB C 26 43.371 43.371 42.513 0.858 26022 141 1 . 1 1 26 26 PHE H H 26 8.950 8.950 9.148 -0.198 26022 142 1 . 1 1 27 27 ARG N N 27 125.082 125.082 121.443 3.639 26022 143 1 . 1 1 27 27 ARG HA H 27 4.992 4.992 5.216 -0.224 26022 144 1 . 1 1 27 27 ARG C C 27 175.148 175.148 174.922 0.226 26022 145 1 . 1 1 27 27 ARG CA C 27 56.323 56.323 55.137 1.186 26022 146 1 . 1 1 27 27 ARG CB C 27 32.240 32.240 32.761 -0.521 26022 147 1 . 1 1 27 27 ARG H H 27 8.799 8.799 9.048 -0.249 26022 148 1 . 1 1 28 28 VAL N N 28 127.456 127.456 120.215 7.241 26022 149 1 . 1 1 28 28 VAL HA H 28 4.757 4.757 5.021 -0.264 26022 150 1 . 1 1 28 28 VAL C C 28 173.602 173.602 174.082 -0.480 26022 151 1 . 1 1 28 28 VAL CA C 28 60.303 60.303 59.440 0.863 26022 152 1 . 1 1 28 28 VAL CB C 28 35.681 35.681 35.122 0.559 26022 153 1 . 1 1 29 29 LYS N N 29 128.096 128.096 122.094 6.001 26022 154 1 . 1 1 29 29 LYS HA H 29 4.354 4.354 5.104 -0.750 26022 155 1 . 1 1 29 29 LYS C C 29 176.740 176.740 174.975 1.765 26022 156 1 . 1 1 29 29 LYS CA C 29 55.041 55.041 53.610 1.431 26022 157 1 . 1 1 29 29 LYS CB C 29 34.062 34.062 35.241 -1.179 26022 158 1 . 1 1 29 29 LYS H H 29 9.268 9.268 8.694 0.574 26022 159 1 . 1 1 30 30 LEU N N 30 129.600 129.600 124.939 4.661 26022 160 1 . 1 1 30 30 LEU HA H 30 4.653 4.653 4.438 0.215 26022 161 1 . 1 1 30 30 LEU C C 30 178.193 178.193 177.279 0.914 26022 162 1 . 1 1 30 30 LEU CA C 30 54.771 54.771 54.832 -0.061 26022 163 1 . 1 1 30 30 LEU CB C 30 42.224 42.224 44.036 -1.812 26022 164 1 . 1 1 30 30 LEU H H 30 9.000 9.000 8.834 0.166 26022 165 1 . 1 1 31 31 ASP N N 31 120.478 120.478 124.569 -4.091 26022 166 1 . 1 1 31 31 ASP HA H 31 4.458 4.458 4.434 0.024 26022 167 1 . 1 1 31 31 ASP C C 31 176.155 176.155 176.333 -0.178 26022 168 1 . 1 1 31 31 ASP CA C 31 55.918 55.918 56.644 -0.727 26022 169 1 . 1 1 31 31 ASP CB C 31 39.593 39.593 40.678 -1.085 26022 170 1 . 1 1 31 31 ASP H H 31 8.698 8.698 8.855 -0.157 26022 171 1 . 1 1 32 32 ASN N N 32 115.450 115.450 117.301 -1.851 26022 172 1 . 1 1 32 32 ASN HA H 32 4.588 4.588 4.702 -0.114 26022 173 1 . 1 1 32 32 ASN C C 32 175.335 175.335 174.508 0.827 26022 174 1 . 1 1 32 32 ASN CA C 32 53.152 53.152 53.100 0.052 26022 175 1 . 1 1 32 32 ASN CB C 32 37.367 37.367 38.212 -0.845 26022 176 1 . 1 1 32 32 ASN H H 32 7.680 7.680 7.985 -0.305 26022 177 1 . 1 1 33 33 GLU N N 33 111.790 111.790 115.826 -4.035 26022 178 1 . 1 1 33 33 GLU HA H 33 3.898 3.898 3.917 -0.019 26022 179 1 . 1 1 33 33 GLU C C 33 175.733 175.733 174.599 1.134 26022 180 1 . 1 1 33 33 GLU CA C 33 58.144 58.144 57.721 0.423 26022 181 1 . 1 1 33 33 GLU CB C 33 28.242 28.242 27.261 0.981 26022 182 1 . 1 1 33 33 GLU H H 33 8.097 8.097 7.907 0.190 26022 183 1 . 1 1 34 34 HIS N N 34 119.193 119.193 118.065 1.128 26022 184 1 . 1 1 34 34 HIS HA H 34 4.201 4.201 4.849 -0.648 26022 185 1 . 1 1 34 34 HIS C C 34 173.789 173.789 173.750 0.039 26022 186 1 . 1 1 34 34 HIS CA C 34 56.053 56.053 55.071 0.982 26022 187 1 . 1 1 34 34 HIS CB C 34 30.487 30.487 32.350 -1.863 26022 188 1 . 1 1 34 34 HIS H H 34 7.890 7.890 7.751 0.139 26022 189 1 . 1 1 35 35 GLU HA H 35 5.400 5.400 5.155 0.245 26022 190 1 . 1 1 35 35 GLU C C 35 175.944 175.944 175.866 0.078 26022 191 1 . 1 1 35 35 GLU CA C 35 55.109 55.109 55.483 -0.374 26022 192 1 . 1 1 35 35 GLU CB C 35 32.308 32.308 31.121 1.187 26022 193 1 . 1 1 36 36 ILE N N 36 119.077 119.077 118.820 0.257 26022 194 1 . 1 1 36 36 ILE HA H 36 4.686 4.686 4.626 0.060 26022 195 1 . 1 1 36 36 ILE C C 36 173.790 173.790 174.742 -0.952 26022 196 1 . 1 1 36 36 ILE CA C 36 59.156 59.156 59.578 -0.422 26022 197 1 . 1 1 36 36 ILE CB C 36 42.696 42.696 41.547 1.149 26022 198 1 . 1 1 37 37 ILE N N 37 122.787 122.787 122.545 0.242 26022 199 1 . 1 1 37 37 ILE HA H 37 4.778 4.778 4.422 0.356 26022 200 1 . 1 1 37 37 ILE C C 37 177.057 177.057 175.589 1.468 26022 201 1 . 1 1 37 37 ILE CA C 37 59.723 59.723 61.248 -1.525 26022 202 1 . 1 1 37 37 ILE CB C 37 37.949 37.949 38.484 -0.535 26022 203 1 . 1 1 38 38 CYS N N 38 122.357 122.357 125.057 -2.700 26022 204 1 . 1 1 38 38 CYS HA H 38 5.708 5.708 5.283 0.425 26022 205 1 . 1 1 38 38 CYS C C 38 174.258 174.258 173.464 0.794 26022 206 1 . 1 1 38 38 CYS CA C 38 56.930 56.930 56.915 0.015 26022 207 1 . 1 1 38 38 CYS CB C 38 33.252 33.252 30.648 2.604 26022 208 1 . 1 1 38 38 CYS H H 38 9.512 9.512 9.104 0.408 26022 209 1 . 1 1 39 39 HIS N N 39 117.101 117.101 120.350 -3.249 26022 210 1 . 1 1 39 39 HIS HA H 39 5.526 5.526 5.214 0.312 26022 211 1 . 1 1 39 39 HIS C C 39 174.516 174.516 174.094 0.422 26022 212 1 . 1 1 39 39 HIS CA C 39 54.097 54.097 55.170 -1.073 26022 213 1 . 1 1 39 39 HIS CB C 39 31.701 31.701 33.798 -2.097 26022 214 1 . 1 1 39 39 HIS H H 39 7.597 7.597 8.922 -1.325 26022 215 1 . 1 1 40 40 VAL N N 40 117.923 117.923 119.738 -1.815 26022 216 1 . 1 1 40 40 VAL HA H 40 4.614 4.614 4.279 0.335 26022 217 1 . 1 1 40 40 VAL C C 40 175.804 175.804 175.404 0.400 26022 218 1 . 1 1 40 40 VAL CA C 40 61.382 61.382 62.785 -1.403 26022 219 1 . 1 1 40 40 VAL CB C 40 33.396 33.396 31.936 1.460 26022 220 1 . 1 1 41 41 SER N N 41 119.242 119.242 121.308 -2.066 26022 221 1 . 1 1 41 41 SER HA H 41 4.550 4.550 4.740 -0.190 26022 222 1 . 1 1 41 41 SER C C 41 174.656 174.656 174.490 0.166 26022 223 1 . 1 1 41 41 SER CA C 41 58.126 58.126 57.234 0.892 26022 224 1 . 1 1 41 41 SER CB C 41 63.470 63.470 64.768 -1.298 26022 225 1 . 1 1 41 41 SER H H 41 8.341 8.341 8.448 -0.107 26022 226 1 . 1 1 42 42 GLY N N 42 110.569 110.569 109.540 1.029 26022 227 1 . 1 1 42 42 GLY C C 42 173.829 173.829 174.875 -1.046 26022 228 1 . 1 1 42 42 GLY CA C 42 45.257 45.257 46.252 -0.995 26022 229 1 . 1 1 42 42 GLY H H 42 8.380 8.380 8.242 0.138 26022 230 1 . 1 1 43 43 LYS HA H 43 3.977 3.977 4.070 -0.093 26022 231 1 . 1 1 43 43 LYS C C 43 179.363 179.363 178.548 0.815 26022 232 1 . 1 1 43 43 LYS CA C 43 59.628 59.628 58.676 0.952 26022 233 1 . 1 1 43 43 LYS CB C 43 32.510 32.510 32.411 0.099 26022 234 1 . 1 1 44 44 VAL N N 44 120.404 120.404 119.021 1.383 26022 235 1 . 1 1 44 44 VAL HA H 44 3.661 3.661 3.676 -0.015 26022 236 1 . 1 1 44 44 VAL C C 44 179.785 179.785 177.864 1.921 26022 237 1 . 1 1 44 44 VAL CA C 44 65.425 65.425 65.586 -0.161 26022 238 1 . 1 1 44 44 VAL CB C 44 31.500 31.500 31.266 0.234 26022 239 1 . 1 1 45 45 ARG N N 45 123.687 123.687 119.223 4.464 26022 240 1 . 1 1 45 45 ARG HA H 45 4.054 4.054 4.109 -0.055 26022 241 1 . 1 1 45 45 ARG C C 45 179.504 179.504 178.279 1.225 26022 242 1 . 1 1 45 45 ARG CA C 45 59.669 59.669 58.783 0.886 26022 243 1 . 1 1 45 45 ARG CB C 45 30.417 30.417 30.072 0.345 26022 244 1 . 1 1 45 45 ARG H H 45 8.608 8.608 7.953 0.655 26022 245 1 . 1 1 46 46 ARG N N 46 118.506 118.506 117.382 1.124 26022 246 1 . 1 1 46 46 ARG HA H 46 4.148 4.148 4.305 -0.157 26022 247 1 . 1 1 46 46 ARG C C 46 177.396 177.396 177.888 -0.492 26022 248 1 . 1 1 46 46 ARG CA C 46 58.481 58.481 57.816 0.665 26022 249 1 . 1 1 46 46 ARG CB C 46 30.554 30.554 29.994 0.560 26022 250 1 . 1 1 46 46 ARG H H 46 8.474 8.474 7.579 0.895 26022 251 1 . 1 1 47 47 SER N N 47 114.263 114.263 113.838 0.425 26022 252 1 . 1 1 47 47 SER HA H 47 4.393 4.393 4.444 -0.051 26022 253 1 . 1 1 47 47 SER C C 47 174.070 174.070 174.063 0.007 26022 254 1 . 1 1 47 47 SER CA C 47 59.696 59.696 58.779 0.917 26022 255 1 . 1 1 47 47 SER CB C 47 64.013 64.013 63.891 0.122 26022 256 1 . 1 1 47 47 SER H H 47 7.645 7.645 7.938 -0.293 26022 257 1 . 1 1 48 48 LYS N N 48 115.405 115.405 119.048 -3.643 26022 258 1 . 1 1 48 48 LYS HA H 48 3.990 3.990 3.978 0.012 26022 259 1 . 1 1 48 48 LYS C C 48 175.804 175.804 175.400 0.404 26022 260 1 . 1 1 48 48 LYS CA C 48 57.537 57.537 57.050 0.487 26022 261 1 . 1 1 48 48 LYS CB C 48 29.947 29.947 29.997 -0.050 26022 262 1 . 1 1 48 48 LYS H H 48 7.821 7.821 7.709 0.112 26022 263 1 . 1 1 49 49 ILE N N 49 117.265 117.265 119.670 -2.405 26022 264 1 . 1 1 49 49 ILE HA H 49 4.041 4.041 4.174 -0.133 26022 265 1 . 1 1 49 49 ILE C C 49 175.125 175.125 176.357 -1.232 26022 266 1 . 1 1 49 49 ILE CA C 49 61.315 61.315 59.453 1.862 26022 267 1 . 1 1 49 49 ILE CB C 49 38.919 38.919 38.471 0.448 26022 268 1 . 1 1 50 50 ARG N N 50 126.687 126.687 126.817 -0.130 26022 269 1 . 1 1 50 50 ARG HA H 50 4.471 4.471 4.453 0.018 26022 270 1 . 1 1 50 50 ARG C C 50 175.007 175.007 175.329 -0.322 26022 271 1 . 1 1 50 50 ARG CA C 50 55.176 55.176 55.570 -0.394 26022 272 1 . 1 1 50 50 ARG CB C 50 31.026 31.026 30.631 0.395 26022 273 1 . 1 1 50 50 ARG H H 50 8.437 8.437 8.431 0.006 26022 274 1 . 1 1 51 51 ILE N N 51 127.722 127.722 126.612 1.110 26022 275 1 . 1 1 51 51 ILE HA H 51 4.276 4.276 4.007 0.269 26022 276 1 . 1 1 51 51 ILE C C 51 174.726 174.726 175.731 -1.004 26022 277 1 . 1 1 51 51 ILE CA C 51 60.235 60.235 60.782 -0.547 26022 278 1 . 1 1 51 51 ILE CB C 51 37.772 37.772 37.908 -0.136 26022 279 1 . 1 1 52 52 ILE N N 52 121.888 121.888 123.428 -1.540 26022 280 1 . 1 1 52 52 ILE HA H 52 4.781 4.781 4.500 0.281 26022 281 1 . 1 1 52 52 ILE C C 52 175.733 175.733 175.023 0.710 26022 282 1 . 1 1 52 52 ILE CA C 52 59.021 59.021 59.259 -0.238 26022 283 1 . 1 1 52 52 ILE CB C 52 42.089 42.089 40.404 1.685 26022 284 1 . 1 1 53 53 ILE N N 53 119.363 119.363 123.398 -4.036 26022 285 1 . 1 1 53 53 ILE HA H 53 3.338 3.338 3.958 -0.620 26022 286 1 . 1 1 53 53 ILE C C 53 177.021 177.021 176.913 0.108 26022 287 1 . 1 1 53 53 ILE CA C 53 64.274 64.274 62.175 2.099 26022 288 1 . 1 1 53 53 ILE CB C 53 37.256 37.256 37.832 -0.576 26022 289 1 . 1 1 54 54 GLY N N 54 116.136 116.136 115.748 0.388 26022 290 1 . 1 1 54 54 GLY C C 54 174.844 174.844 173.576 1.268 26022 291 1 . 1 1 54 54 GLY CA C 54 45.188 45.188 44.811 0.377 26022 292 1 . 1 1 54 54 GLY H H 54 8.853 8.853 8.833 0.020 26022 293 1 . 1 1 55 55 ASP N N 55 121.946 121.946 120.343 1.603 26022 294 1 . 1 1 55 55 ASP HA H 55 4.588 4.588 4.835 -0.247 26022 295 1 . 1 1 55 55 ASP C C 55 175.804 175.804 175.002 0.802 26022 296 1 . 1 1 55 55 ASP CA C 55 55.200 55.200 52.518 2.682 26022 297 1 . 1 1 55 55 ASP CB C 55 41.048 41.048 42.678 -1.630 26022 298 1 . 1 1 55 55 ASP H H 55 8.054 8.054 7.756 0.298 26022 299 1 . 1 1 56 56 ARG N N 56 120.974 120.974 120.790 0.184 26022 300 1 . 1 1 56 56 ARG HA H 56 5.200 5.200 4.716 0.484 26022 301 1 . 1 1 56 56 ARG C C 56 176.483 176.483 175.938 0.545 26022 302 1 . 1 1 56 56 ARG CA C 56 54.097 54.097 55.272 -1.175 26022 303 1 . 1 1 56 56 ARG CB C 56 30.689 30.689 30.265 0.424 26022 304 1 . 1 1 56 56 ARG H H 56 8.766 8.766 8.441 0.325 26022 305 1 . 1 1 57 57 VAL N N 57 114.943 114.943 116.492 -1.550 26022 306 1 . 1 1 57 57 VAL HA H 57 4.965 4.965 4.501 0.465 26022 307 1 . 1 1 57 57 VAL C C 57 172.243 172.243 173.449 -1.206 26022 308 1 . 1 1 57 57 VAL CA C 57 58.077 58.077 59.654 -1.577 26022 309 1 . 1 1 57 57 VAL CB C 57 36.288 36.288 35.262 1.026 26022 310 1 . 1 1 58 58 LEU N N 58 122.410 122.410 123.895 -1.485 26022 311 1 . 1 1 58 58 LEU HA H 58 4.731 4.731 4.994 -0.263 26022 312 1 . 1 1 58 58 LEU C C 58 174.773 174.773 175.057 -0.284 26022 313 1 . 1 1 58 58 LEU CA C 58 53.085 53.085 53.665 -0.580 26022 314 1 . 1 1 58 58 LEU CB C 58 45.788 45.788 43.718 2.070 26022 315 1 . 1 1 58 58 LEU H H 58 8.382 8.382 8.104 0.278 26022 316 1 . 1 1 59 59 VAL N N 59 127.937 127.937 127.561 0.376 26022 317 1 . 1 1 59 59 VAL HA H 59 4.744 4.744 4.778 -0.034 26022 318 1 . 1 1 59 59 VAL C C 59 174.141 174.141 173.856 0.285 26022 319 1 . 1 1 59 59 VAL CA C 59 60.279 60.279 59.864 0.415 26022 320 1 . 1 1 59 59 VAL CB C 59 34.399 34.399 34.371 0.028 26022 321 1 . 1 1 60 60 GLU N N 60 124.832 124.832 129.824 -4.992 26022 322 1 . 1 1 60 60 GLU HA H 60 5.304 5.304 4.955 0.349 26022 323 1 . 1 1 60 60 GLU C C 60 176.155 176.155 175.283 0.872 26022 324 1 . 1 1 60 60 GLU CA C 60 54.164 54.164 54.838 -0.674 26022 325 1 . 1 1 60 60 GLU CB C 60 33.803 33.803 30.873 2.930 26022 326 1 . 1 1 60 60 GLU H H 60 9.142 9.142 8.661 0.481 26022 327 1 . 1 1 61 61 MET N N 61 124.187 124.187 123.369 0.818 26022 328 1 . 1 1 61 61 MET HA H 61 4.899 4.899 5.010 -0.111 26022 329 1 . 1 1 61 61 MET C C 61 173.953 173.953 173.933 0.020 26022 330 1 . 1 1 61 61 MET CA C 61 54.232 54.232 53.522 0.710 26022 331 1 . 1 1 61 61 MET CB C 61 37.256 37.256 36.735 0.520 26022 332 1 . 1 1 61 61 MET H H 61 8.984 8.984 8.738 0.246 26022 333 1 . 1 1 62 62 SER N N 62 116.623 116.623 116.220 0.403 26022 334 1 . 1 1 62 62 SER HA H 62 4.263 4.263 4.772 -0.509 26022 335 1 . 1 1 62 62 SER C C 62 176.413 176.413 175.010 1.403 26022 336 1 . 1 1 62 62 SER CA C 62 56.893 56.893 56.806 0.087 26022 337 1 . 1 1 62 62 SER CB C 62 65.362 65.362 64.598 0.764 26022 338 1 . 1 1 62 62 SER H H 62 9.167 9.167 8.524 0.643 26022 339 1 . 1 1 63 63 ILE N N 63 121.187 121.187 123.306 -2.119 26022 340 1 . 1 1 63 63 ILE HA H 63 3.989 3.989 3.900 0.089 26022 341 1 . 1 1 63 63 ILE C C 63 176.623 176.623 176.553 0.070 26022 342 1 . 1 1 63 63 ILE CA C 63 63.878 63.878 60.896 2.982 26022 343 1 . 1 1 63 63 ILE CB C 63 38.244 38.244 36.665 1.579 26022 344 1 . 1 1 64 64 TYR N N 64 120.214 120.214 119.535 0.679 26022 345 1 . 1 1 64 64 TYR HA H 64 4.432 4.432 4.266 0.166 26022 346 1 . 1 1 64 64 TYR C C 64 177.092 177.092 176.644 0.448 26022 347 1 . 1 1 64 64 TYR CA C 64 59.156 59.156 60.131 -0.975 26022 348 1 . 1 1 64 64 TYR CB C 64 38.109 38.109 38.437 -0.328 26022 349 1 . 1 1 64 64 TYR H H 64 7.762 7.762 7.611 0.151 26022 350 1 . 1 1 65 65 ASP N N 65 121.338 121.338 115.290 6.048 26022 351 1 . 1 1 65 65 ASP HA H 65 4.495 4.495 4.673 -0.178 26022 352 1 . 1 1 65 65 ASP C C 65 177.349 177.349 178.132 -0.782 26022 353 1 . 1 1 65 65 ASP CA C 65 55.243 55.243 54.840 0.403 26022 354 1 . 1 1 65 65 ASP CB C 65 40.538 40.538 41.102 -0.564 26022 355 1 . 1 1 65 65 ASP H H 65 7.798 7.798 8.349 -0.551 26022 356 1 . 1 1 66 66 ARG N N 66 121.118 121.118 121.342 -0.224 26022 357 1 . 1 1 66 66 ARG HA H 66 4.069 4.069 4.184 -0.115 26022 358 1 . 1 1 66 66 ARG C C 66 178.448 178.448 176.962 1.486 26022 359 1 . 1 1 66 66 ARG CA C 66 58.401 58.401 58.626 -0.225 26022 360 1 . 1 1 66 66 ARG CB C 66 30.184 30.184 29.416 0.768 26022 361 1 . 1 1 66 66 ARG H H 66 8.382 8.382 8.665 -0.283 26022 362 1 . 1 1 67 67 ASN N N 67 117.334 117.334 117.266 0.068 26022 363 1 . 1 1 67 67 ASN HA H 67 4.601 4.601 5.024 -0.423 26022 364 1 . 1 1 67 67 ASN C C 67 175.288 175.288 175.061 0.227 26022 365 1 . 1 1 67 67 ASN CA C 67 54.097 54.097 53.163 0.934 26022 366 1 . 1 1 67 67 ASN CB C 67 38.514 38.514 38.014 0.500 26022 367 1 . 1 1 67 67 ASN H H 67 8.194 8.194 8.382 -0.188 26022 368 1 . 1 1 68 68 ALA N N 68 122.187 122.187 122.043 0.144 26022 369 1 . 1 1 68 68 ALA HA H 68 4.575 4.575 4.570 0.005 26022 370 1 . 1 1 68 68 ALA C C 68 176.272 176.272 178.206 -1.934 26022 371 1 . 1 1 68 68 ALA CA C 68 52.478 52.478 53.746 -1.268 26022 372 1 . 1 1 68 68 ALA CB C 68 19.086 19.086 19.371 -0.285 26022 373 1 . 1 1 68 68 ALA H H 68 7.658 7.658 7.566 0.092 26022 374 1 . 1 1 69 69 LYS N N 69 116.931 116.931 116.314 0.617 26022 375 1 . 1 1 69 69 LYS HA H 69 4.197 4.197 4.337 -0.140 26022 376 1 . 1 1 69 69 LYS C C 69 176.085 176.085 175.672 0.413 26022 377 1 . 1 1 69 69 LYS CA C 69 56.728 56.728 57.320 -0.592 26022 378 1 . 1 1 69 69 LYS CB C 69 31.566 31.566 33.398 -1.832 26022 379 1 . 1 1 69 69 LYS H H 69 8.255 8.255 7.988 0.267 26022 380 1 . 1 1 70 70 LYS N N 70 119.854 119.854 117.727 2.127 26022 381 1 . 1 1 70 70 LYS HA H 70 5.526 5.526 5.343 0.183 26022 382 1 . 1 1 70 70 LYS C C 70 175.171 175.171 175.534 -0.363 26022 383 1 . 1 1 70 70 LYS CA C 70 54.704 54.704 54.760 -0.056 26022 384 1 . 1 1 70 70 LYS CB C 70 36.850 36.850 35.547 1.303 26022 385 1 . 1 1 70 70 LYS H H 70 8.182 8.182 7.464 0.718 26022 386 1 . 1 1 71 71 GLY N N 71 103.604 103.604 109.083 -5.479 26022 387 1 . 1 1 71 71 GLY C C 71 171.541 171.541 172.751 -1.210 26022 388 1 . 1 1 71 71 GLY CA C 71 45.462 45.462 43.453 2.009 26022 389 1 . 1 1 71 71 GLY H H 71 7.780 7.780 8.430 -0.650 26022 390 1 . 1 1 72 72 ARG N N 72 119.187 119.187 119.803 -0.616 26022 391 1 . 1 1 72 72 ARG HA H 72 4.861 4.861 5.116 -0.255 26022 392 1 . 1 1 72 72 ARG C C 72 175.570 175.570 175.348 0.222 26022 393 1 . 1 1 72 72 ARG CA C 72 53.624 53.624 54.947 -1.323 26022 394 1 . 1 1 72 72 ARG CB C 72 34.129 34.129 31.426 2.703 26022 395 1 . 1 1 72 72 ARG H H 72 8.007 8.007 8.475 -0.468 26022 396 1 . 1 1 73 73 ILE N N 73 125.721 125.721 124.966 0.755 26022 397 1 . 1 1 73 73 ILE HA H 73 4.263 4.263 4.677 -0.414 26022 398 1 . 1 1 73 73 ILE C C 73 175.312 175.312 174.342 0.970 26022 399 1 . 1 1 73 73 ILE CA C 73 62.259 62.259 59.760 2.499 26022 400 1 . 1 1 73 73 ILE CB C 73 39.423 39.423 40.228 -0.805 26022 401 1 . 1 1 74 74 ILE N N 74 120.540 120.540 126.881 -6.341 26022 402 1 . 1 1 74 74 ILE HA H 74 4.596 4.596 4.262 0.334 26022 403 1 . 1 1 74 74 ILE C C 74 176.249 176.249 173.997 2.252 26022 404 1 . 1 1 74 74 ILE CA C 74 60.910 60.910 60.900 0.011 26022 405 1 . 1 1 74 74 ILE CB C 74 39.863 39.863 40.271 -0.408 26022 406 1 . 1 1 75 75 ARG N N 75 118.582 118.582 116.523 2.059 26022 407 1 . 1 1 75 75 ARG HA H 75 4.289 4.289 4.339 -0.050 26022 408 1 . 1 1 75 75 ARG C C 75 173.883 173.883 174.189 -0.306 26022 409 1 . 1 1 75 75 ARG CA C 75 56.390 56.390 55.404 0.986 26022 410 1 . 1 1 75 75 ARG CB C 75 34.669 34.669 32.190 2.479 26022 411 1 . 1 1 75 75 ARG H H 75 7.397 7.397 7.835 -0.438 26022 412 1 . 1 1 76 76 ARG N N 76 125.606 125.606 121.571 4.035 26022 413 1 . 1 1 76 76 ARG HA H 76 4.609 4.609 4.369 0.240 26022 414 1 . 1 1 76 76 ARG C C 76 175.312 175.312 175.472 -0.160 26022 415 1 . 1 1 76 76 ARG CA C 76 55.810 55.810 55.732 0.078 26022 416 1 . 1 1 76 76 ARG CB C 76 31.094 31.094 30.928 0.166 26022 417 1 . 1 1 76 76 ARG H H 76 9.094 9.094 8.301 0.793 26022 418 1 . 1 1 77 77 LEU N N 77 128.575 128.575 123.638 4.937 26022 419 1 . 1 1 77 77 LEU HA H 77 4.372 4.372 4.362 0.010 26022 420 1 . 1 1 77 77 LEU C C 77 176.225 176.225 176.490 -0.265 26022 421 1 . 1 1 77 77 LEU CA C 77 54.704 54.704 54.775 -0.071 26022 422 1 . 1 1 77 77 LEU CB C 77 42.292 42.292 43.028 -0.736 26022 423 1 . 1 1 77 77 LEU H H 77 8.742 8.742 8.277 0.465 26022 424 1 . 1 1 78 78 LYS N N 78 119.592 119.592 123.010 -3.418 26022 425 1 . 1 1 78 78 LYS HA H 78 4.302 4.302 4.241 0.061 26022 426 1 . 1 1 78 78 LYS C C 78 176.296 176.296 177.453 -1.157 26022 427 1 . 1 1 78 78 LYS CA C 78 56.390 56.390 56.627 -0.237 26022 428 1 . 1 1 78 78 LYS CB C 78 33.994 33.994 32.252 1.742 26022 429 1 . 1 1 78 78 LYS H H 78 8.090 8.090 8.358 -0.268 26022 430 1 . 1 1 79 79 GLY N N 79 110.854 110.854 111.912 -1.058 26022 431 1 . 1 1 79 79 GLY C C 79 174.328 174.328 174.086 0.242 26022 432 1 . 1 1 79 79 GLY CA C 79 44.990 44.990 44.771 0.219 26022 433 1 . 1 1 79 79 GLY H H 79 8.520 8.520 8.448 0.072 26022 434 1 . 1 1 80 80 THR N N 80 114.187 114.187 114.690 -0.503 26022 435 1 . 1 1 80 80 THR HA H 80 4.237 4.237 4.294 -0.057 26022 436 1 . 1 1 80 80 THR C C 80 175.054 175.054 174.262 0.792 26022 437 1 . 1 1 80 80 THR CA C 80 62.242 62.242 62.036 0.206 26022 438 1 . 1 1 80 80 THR CB C 80 69.826 69.826 68.801 1.025 26022 439 1 . 1 1 81 81 SER N N 81 117.958 117.958 118.677 -0.719 26022 440 1 . 1 1 81 81 SER HA H 81 4.449 4.449 4.528 -0.079 26022 441 1 . 1 1 81 81 SER C C 81 174.703 174.703 174.125 0.578 26022 442 1 . 1 1 81 81 SER CA C 81 58.481 58.481 58.330 0.151 26022 443 1 . 1 1 81 81 SER CB C 81 63.338 63.338 63.748 -0.410 26022 444 1 . 1 1 81 81 SER H H 81 8.474 8.474 8.309 0.165 26022 445 1 . 1 1 82 82 ASP HA H 82 4.280 4.280 4.532 -0.252 26022 446 1 . 1 1 82 82 ASP C C 82 177.115 177.115 176.688 0.427 26022 447 1 . 1 1 82 82 ASP CA C 82 55.176 55.176 55.261 -0.085 26022 448 1 . 1 1 82 82 ASP CB C 82 42.359 42.359 41.226 1.133 26022 449 1 . 1 1 83 83 ARG N N 83 121.531 121.531 117.117 4.414 26022 450 1 . 1 1 83 83 ARG HA H 83 4.346 4.346 4.128 0.218 26022 451 1 . 1 1 83 83 ARG C C 83 176.342 176.342 176.355 -0.013 26022 452 1 . 1 1 83 83 ARG CA C 83 56.053 56.053 57.729 -1.676 26022 453 1 . 1 1 83 83 ARG CB C 83 30.891 30.891 29.951 0.940 26022 454 1 . 1 1 83 83 ARG H H 83 8.259 8.259 8.229 0.030 26022 455 1 . 1 1 84 84 THR N N 84 116.462 116.462 113.205 3.257 26022 456 1 . 1 1 84 84 THR HA H 84 4.333 4.333 4.433 -0.100 26022 457 1 . 1 1 84 84 THR C C 84 174.445 174.445 174.373 0.072 26022 458 1 . 1 1 84 84 THR CA C 84 62.254 62.254 62.687 -0.433 26022 459 1 . 1 1 84 84 THR CB C 84 69.833 69.833 70.279 -0.446 26022 460 1 . 1 1 85 85 ILE N N 85 123.762 123.762 119.525 4.237 26022 461 1 . 1 1 85 85 ILE HA H 85 4.188 4.188 4.075 0.113 26022 462 1 . 1 1 85 85 ILE C C 85 176.155 176.155 175.158 0.997 26022 463 1 . 1 1 85 85 ILE CA C 85 61.112 61.112 62.011 -0.899 26022 464 1 . 1 1 85 85 ILE CB C 85 38.919 38.919 37.050 1.869 26022 465 1 . 1 1 86 86 SER N N 86 120.214 120.214 115.853 4.361 26022 466 1 . 1 1 86 86 SER HA H 86 4.451 4.451 4.512 -0.061 26022 467 1 . 1 1 86 86 SER C C 86 174.586 174.586 174.099 0.487 26022 468 1 . 1 1 86 86 SER CA C 86 58.212 58.212 58.553 -0.340 26022 469 1 . 1 1 86 86 SER CB C 86 63.271 63.271 63.974 -0.703 26022 470 1 . 1 1 86 86 SER H H 86 8.377 8.377 8.241 0.136 26022 stop_ save_