data_19845 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 19845 _Entry.PDB_ID 2MM4 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 19845 _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 9 9 THR N N 9 113.692 113.692 115.313 -1.621 19845 2 1 1 . 1 1 9 9 THR HA H 9 4.213 4.213 4.605 -0.392 19845 3 1 1 . 1 1 9 9 THR C C 9 172.757 172.757 175.215 -2.458 19845 4 1 1 . 1 1 9 9 THR CA C 9 62.810 62.810 62.133 0.677 19845 5 1 1 . 1 1 9 9 THR CB C 9 69.878 69.878 69.123 0.755 19845 6 1 1 . 1 1 9 9 THR H H 9 7.930 7.930 8.595 -0.665 19845 7 1 1 . 1 1 10 10 GLY N N 10 110.842 110.842 109.253 1.589 19845 8 1 1 . 1 1 10 10 GLY C C 10 171.923 171.923 173.860 -1.937 19845 9 1 1 . 1 1 10 10 GLY CA C 10 46.099 46.099 44.599 1.500 19845 10 1 1 . 1 1 10 10 GLY H H 10 8.266 8.266 7.976 0.290 19845 11 1 1 . 1 1 11 11 THR N N 11 113.754 113.754 118.177 -4.423 19845 12 1 1 . 1 1 11 11 THR HA H 11 4.220 4.220 4.404 -0.184 19845 13 1 1 . 1 1 11 11 THR C C 11 171.906 171.906 174.558 -2.652 19845 14 1 1 . 1 1 11 11 THR CA C 11 62.721 62.721 63.340 -0.619 19845 15 1 1 . 1 1 11 11 THR CB C 11 69.549 69.549 68.413 1.136 19845 16 1 1 . 1 1 11 11 THR H H 11 7.753 7.753 8.019 -0.266 19845 17 1 1 . 1 1 12 12 LEU N N 12 123.669 123.669 126.450 -2.781 19845 18 1 1 . 1 1 12 12 LEU HA H 12 4.240 4.240 4.637 -0.397 19845 19 1 1 . 1 1 12 12 LEU C C 12 175.221 175.221 177.767 -2.546 19845 20 1 1 . 1 1 12 12 LEU CA C 12 56.799 56.799 54.984 1.815 19845 21 1 1 . 1 1 12 12 LEU CB C 12 42.536 42.536 42.056 0.480 19845 22 1 1 . 1 1 12 12 LEU H H 12 7.980 7.980 8.284 -0.304 19845 23 1 1 . 1 1 13 13 ILE N N 13 120.086 120.086 121.175 -1.089 19845 24 1 1 . 1 1 13 13 ILE HA H 13 3.913 3.913 4.024 -0.111 19845 25 1 1 . 1 1 13 13 ILE C C 13 173.425 173.425 176.966 -3.541 19845 26 1 1 . 1 1 13 13 ILE CA C 13 62.889 62.889 63.687 -0.798 19845 27 1 1 . 1 1 13 13 ILE CB C 13 38.249 38.249 38.088 0.161 19845 28 1 1 . 1 1 13 13 ILE H H 13 7.861 7.861 7.611 0.250 19845 29 1 1 . 1 1 14 14 VAL N N 14 119.785 119.785 119.985 -0.200 19845 30 1 1 . 1 1 14 14 VAL HA H 14 3.790 3.790 3.793 -0.003 19845 31 1 1 . 1 1 14 14 VAL C C 14 173.429 173.429 177.261 -3.832 19845 32 1 1 . 1 1 14 14 VAL CA C 14 64.409 64.409 65.226 -0.817 19845 33 1 1 . 1 1 14 14 VAL CB C 14 32.007 32.007 31.284 0.723 19845 34 1 1 . 1 1 14 14 VAL H H 14 7.549 7.549 8.123 -0.574 19845 35 1 1 . 1 1 15 15 ASN N N 15 119.567 119.567 116.786 2.781 19845 36 1 1 . 1 1 15 15 ASN HA H 15 4.549 4.549 4.655 -0.106 19845 37 1 1 . 1 1 15 15 ASN C C 15 173.619 173.619 177.597 -3.978 19845 38 1 1 . 1 1 15 15 ASN CA C 15 54.805 54.805 55.627 -0.821 19845 39 1 1 . 1 1 15 15 ASN CB C 15 38.824 38.824 38.505 0.319 19845 40 1 1 . 1 1 15 15 ASN H H 15 8.010 8.010 8.507 -0.497 19845 41 1 1 . 1 1 16 16 SER N N 16 116.730 116.730 116.922 -0.192 19845 42 1 1 . 1 1 16 16 SER HA H 16 4.177 4.177 4.398 -0.221 19845 43 1 1 . 1 1 16 16 SER CA C 16 61.705 61.705 61.420 0.285 19845 44 1 1 . 1 1 16 16 SER CB C 16 63.752 63.752 63.581 0.171 19845 45 1 1 . 1 1 16 16 SER H H 16 8.039 8.039 7.456 0.583 19845 46 1 1 . 1 1 17 17 VAL N N 17 122.062 122.062 122.552 -0.490 19845 47 1 1 . 1 1 17 17 VAL HA H 17 3.677 3.677 3.904 -0.227 19845 48 1 1 . 1 1 17 17 VAL C C 17 174.474 174.474 177.310 -2.836 19845 49 1 1 . 1 1 17 17 VAL CA C 17 66.671 66.671 65.136 1.535 19845 50 1 1 . 1 1 17 17 VAL CB C 17 31.531 31.531 31.511 0.020 19845 51 1 1 . 1 1 17 17 VAL H H 17 7.896 7.896 8.261 -0.365 19845 52 1 1 . 1 1 18 18 LEU N N 18 119.103 119.103 120.376 -1.273 19845 53 1 1 . 1 1 18 18 LEU HA H 18 3.998 3.998 4.248 -0.250 19845 54 1 1 . 1 1 18 18 LEU C C 18 175.511 175.511 178.318 -2.807 19845 55 1 1 . 1 1 18 18 LEU CA C 18 58.107 58.107 57.848 0.259 19845 56 1 1 . 1 1 18 18 LEU CB C 18 41.593 41.593 42.014 -0.421 19845 57 1 1 . 1 1 18 18 LEU H H 18 7.857 7.857 7.407 0.450 19845 58 1 1 . 1 1 19 19 LEU N N 19 118.291 118.291 120.564 -2.273 19845 59 1 1 . 1 1 19 19 LEU HA H 19 4.152 4.152 4.186 -0.034 19845 60 1 1 . 1 1 19 19 LEU C C 19 175.156 175.156 178.493 -3.337 19845 61 1 1 . 1 1 19 19 LEU CA C 19 58.011 58.011 57.967 0.044 19845 62 1 1 . 1 1 19 19 LEU CB C 19 42.027 42.027 41.861 0.166 19845 63 1 1 . 1 1 19 19 LEU H H 19 7.745 7.745 7.541 0.204 19845 64 1 1 . 1 1 20 20 PHE N N 20 118.415 118.415 119.366 -0.951 19845 65 1 1 . 1 1 20 20 PHE HA H 20 4.188 4.188 4.136 0.052 19845 66 1 1 . 1 1 20 20 PHE C C 20 174.260 174.260 177.334 -3.074 19845 67 1 1 . 1 1 20 20 PHE CA C 20 61.626 61.626 62.061 -0.435 19845 68 1 1 . 1 1 20 20 PHE CB C 20 38.643 38.643 38.927 -0.284 19845 69 1 1 . 1 1 20 20 PHE H H 20 8.002 8.002 8.603 -0.601 19845 70 1 1 . 1 1 21 21 LEU N N 21 118.571 118.571 119.693 -1.122 19845 71 1 1 . 1 1 21 21 LEU HA H 21 3.797 3.797 4.107 -0.310 19845 72 1 1 . 1 1 21 21 LEU C C 21 175.324 175.324 178.936 -3.612 19845 73 1 1 . 1 1 21 21 LEU CA C 21 58.128 58.128 58.209 -0.081 19845 74 1 1 . 1 1 21 21 LEU CB C 21 41.957 41.957 41.026 0.931 19845 75 1 1 . 1 1 21 21 LEU H H 21 8.456 8.456 7.720 0.736 19845 76 1 1 . 1 1 22 22 ALA N N 22 120.775 120.775 121.032 -0.257 19845 77 1 1 . 1 1 22 22 ALA HA H 22 3.779 3.779 4.086 -0.307 19845 78 1 1 . 1 1 22 22 ALA C C 22 175.697 175.697 180.200 -4.503 19845 79 1 1 . 1 1 22 22 ALA CA C 22 55.721 55.721 54.671 1.050 19845 80 1 1 . 1 1 22 22 ALA CB C 22 17.788 17.788 18.282 -0.494 19845 81 1 1 . 1 1 22 22 ALA H H 22 8.353 8.353 7.573 0.780 19845 82 1 1 . 1 1 23 23 PHE N N 23 117.860 117.860 120.044 -2.184 19845 83 1 1 . 1 1 23 23 PHE HA H 23 4.108 4.108 4.353 -0.245 19845 84 1 1 . 1 1 23 23 PHE C C 23 173.859 173.859 177.077 -3.218 19845 85 1 1 . 1 1 23 23 PHE CA C 23 61.271 61.271 61.898 -0.627 19845 86 1 1 . 1 1 23 23 PHE CB C 23 38.853 38.853 39.714 -0.861 19845 87 1 1 . 1 1 23 23 PHE H H 23 8.121 8.121 8.213 -0.092 19845 88 1 1 . 1 1 24 24 VAL N N 24 119.181 119.181 119.333 -0.152 19845 89 1 1 . 1 1 24 24 VAL HA H 24 3.134 3.134 3.513 -0.379 19845 90 1 1 . 1 1 24 24 VAL C C 24 174.684 174.684 178.034 -3.350 19845 91 1 1 . 1 1 24 24 VAL CA C 24 67.419 67.419 67.291 0.128 19845 92 1 1 . 1 1 24 24 VAL CB C 24 31.106 31.106 31.108 -0.002 19845 93 1 1 . 1 1 24 24 VAL H H 24 8.124 8.124 8.371 -0.247 19845 94 1 1 . 1 1 25 25 VAL N N 25 119.215 119.215 117.269 1.946 19845 95 1 1 . 1 1 25 25 VAL HA H 25 3.324 3.324 3.634 -0.310 19845 96 1 1 . 1 1 25 25 VAL C C 25 174.244 174.244 177.536 -3.292 19845 97 1 1 . 1 1 25 25 VAL CA C 25 67.740 67.740 65.991 1.749 19845 98 1 1 . 1 1 25 25 VAL CB C 25 31.270 31.270 30.536 0.734 19845 99 1 1 . 1 1 25 25 VAL H H 25 8.250 8.250 7.497 0.753 19845 100 1 1 . 1 1 26 26 PHE N N 26 119.875 119.875 118.569 1.306 19845 101 1 1 . 1 1 26 26 PHE HA H 26 3.900 3.900 4.157 -0.257 19845 102 1 1 . 1 1 26 26 PHE C C 26 175.371 175.371 177.654 -2.283 19845 103 1 1 . 1 1 26 26 PHE CA C 26 61.651 61.651 61.301 0.350 19845 104 1 1 . 1 1 26 26 PHE CB C 26 38.760 38.760 38.635 0.125 19845 105 1 1 . 1 1 26 26 PHE H H 26 8.413 8.413 7.130 1.283 19845 106 1 1 . 1 1 27 27 LEU N N 27 122.548 122.548 119.169 3.379 19845 107 1 1 . 1 1 27 27 LEU HA H 27 3.533 3.533 3.883 -0.350 19845 108 1 1 . 1 1 27 27 LEU C C 27 175.256 175.256 179.153 -3.897 19845 109 1 1 . 1 1 27 27 LEU CA C 27 58.211 58.211 57.669 0.542 19845 110 1 1 . 1 1 27 27 LEU CB C 27 41.564 41.564 41.416 0.148 19845 111 1 1 . 1 1 27 27 LEU H H 27 8.453 8.453 8.275 0.178 19845 112 1 1 . 1 1 28 28 LEU N N 28 119.385 119.385 119.791 -0.406 19845 113 1 1 . 1 1 28 28 LEU HA H 28 3.799 3.799 3.895 -0.096 19845 114 1 1 . 1 1 28 28 LEU C C 28 175.881 175.881 179.097 -3.216 19845 115 1 1 . 1 1 28 28 LEU CA C 28 58.492 58.492 57.968 0.524 19845 116 1 1 . 1 1 28 28 LEU CB C 28 41.760 41.760 41.404 0.356 19845 117 1 1 . 1 1 28 28 LEU H H 28 8.248 8.248 8.460 -0.212 19845 118 1 1 . 1 1 29 29 VAL N N 29 118.515 118.515 114.688 3.827 19845 119 1 1 . 1 1 29 29 VAL HA H 29 3.319 3.319 3.840 -0.521 19845 120 1 1 . 1 1 29 29 VAL C C 29 174.734 174.734 178.114 -3.380 19845 121 1 1 . 1 1 29 29 VAL CA C 29 67.192 67.192 65.546 1.646 19845 122 1 1 . 1 1 29 29 VAL CB C 29 31.175 31.175 30.593 0.582 19845 123 1 1 . 1 1 29 29 VAL H H 29 8.446 8.446 7.357 1.089 19845 124 1 1 . 1 1 30 30 THR N N 30 117.313 117.313 117.257 0.056 19845 125 1 1 . 1 1 30 30 THR HA H 30 3.432 3.432 3.922 -0.490 19845 126 1 1 . 1 1 30 30 THR CA C 30 68.606 68.606 66.564 2.042 19845 127 1 1 . 1 1 30 30 THR CB C 30 67.147 67.147 68.224 -1.077 19845 128 1 1 . 1 1 30 30 THR H H 30 7.923 7.923 8.071 -0.148 19845 129 1 1 . 1 1 31 31 LEU N N 31 120.629 120.629 120.860 -0.231 19845 130 1 1 . 1 1 31 31 LEU HA H 31 3.858 3.858 3.922 -0.064 19845 131 1 1 . 1 1 31 31 LEU C C 31 177.164 177.164 178.446 -1.282 19845 132 1 1 . 1 1 31 31 LEU CA C 31 58.145 58.145 57.779 0.366 19845 133 1 1 . 1 1 31 31 LEU CB C 31 41.615 41.615 41.528 0.087 19845 134 1 1 . 1 1 31 31 LEU H H 31 8.382 8.382 7.971 0.411 19845 135 1 1 . 1 1 32 32 ALA N N 32 125.216 125.216 121.686 3.530 19845 136 1 1 . 1 1 32 32 ALA HA H 32 3.836 3.836 3.916 -0.080 19845 137 1 1 . 1 1 32 32 ALA C C 32 175.968 175.968 180.521 -4.553 19845 138 1 1 . 1 1 32 32 ALA CA C 32 55.918 55.918 54.831 1.087 19845 139 1 1 . 1 1 32 32 ALA CB C 32 17.802 17.802 18.136 -0.334 19845 140 1 1 . 1 1 32 32 ALA H H 32 8.517 8.517 7.612 0.905 19845 141 1 1 . 1 1 33 33 ILE N N 33 118.722 118.722 118.964 -0.242 19845 142 1 1 . 1 1 33 33 ILE HA H 33 3.481 3.481 3.578 -0.097 19845 143 1 1 . 1 1 33 33 ILE C C 33 175.004 175.004 178.073 -3.069 19845 144 1 1 . 1 1 33 33 ILE CA C 33 65.554 65.554 64.850 0.704 19845 145 1 1 . 1 1 33 33 ILE CB C 33 37.657 37.657 37.350 0.307 19845 146 1 1 . 1 1 33 33 ILE H H 33 8.288 8.288 7.573 0.715 19845 147 1 1 . 1 1 34 34 LEU N N 34 118.987 118.987 120.146 -1.159 19845 148 1 1 . 1 1 34 34 LEU HA H 34 3.893 3.893 3.989 -0.096 19845 149 1 1 . 1 1 34 34 LEU C C 34 176.439 176.439 178.251 -1.812 19845 150 1 1 . 1 1 34 34 LEU CA C 34 58.436 58.436 57.914 0.522 19845 151 1 1 . 1 1 34 34 LEU CB C 34 42.152 42.152 41.161 0.991 19845 152 1 1 . 1 1 34 34 LEU H H 34 8.493 8.493 8.084 0.409 19845 153 1 1 . 1 1 35 35 THR N N 35 116.630 116.630 116.228 0.402 19845 154 1 1 . 1 1 35 35 THR HA H 35 3.652 3.652 3.846 -0.194 19845 155 1 1 . 1 1 35 35 THR C C 35 173.366 173.366 175.874 -2.508 19845 156 1 1 . 1 1 35 35 THR CA C 35 68.153 68.153 67.448 0.705 19845 157 1 1 . 1 1 35 35 THR CB C 35 68.162 68.162 68.341 -0.179 19845 158 1 1 . 1 1 35 35 THR H H 35 8.215 8.215 8.153 0.062 19845 159 1 1 . 1 1 36 36 ALA N N 36 124.667 124.667 123.032 1.635 19845 160 1 1 . 1 1 36 36 ALA HA H 36 3.864 3.864 3.939 -0.075 19845 161 1 1 . 1 1 36 36 ALA C C 36 176.510 176.510 179.102 -2.592 19845 162 1 1 . 1 1 36 36 ALA CA C 36 55.758 55.758 55.093 0.665 19845 163 1 1 . 1 1 36 36 ALA CB C 36 18.054 18.054 18.284 -0.230 19845 164 1 1 . 1 1 36 36 ALA H H 36 8.358 8.358 7.958 0.400 19845 165 1 1 . 1 1 37 37 LEU N N 37 116.565 116.565 118.123 -1.558 19845 166 1 1 . 1 1 37 37 LEU HA H 37 3.973 3.973 4.110 -0.137 19845 167 1 1 . 1 1 37 37 LEU C C 37 176.538 176.538 179.136 -2.598 19845 168 1 1 . 1 1 37 37 LEU CA C 37 57.853 57.853 57.358 0.495 19845 169 1 1 . 1 1 37 37 LEU CB C 37 42.018 42.018 40.698 1.320 19845 170 1 1 . 1 1 37 37 LEU H H 37 8.360 8.360 7.539 0.821 19845 171 1 1 . 1 1 38 38 ARG N N 38 119.392 119.392 119.742 -0.350 19845 172 1 1 . 1 1 38 38 ARG HA H 38 4.104 4.104 4.078 0.026 19845 173 1 1 . 1 1 38 38 ARG C C 38 176.208 176.208 179.350 -3.142 19845 174 1 1 . 1 1 38 38 ARG CA C 38 58.100 58.100 58.962 -0.862 19845 175 1 1 . 1 1 38 38 ARG CB C 38 29.502 29.502 29.621 -0.119 19845 176 1 1 . 1 1 38 38 ARG H H 38 8.082 8.082 7.400 0.682 19845 177 1 1 . 1 1 39 39 LEU N N 39 120.438 120.438 118.125 2.313 19845 178 1 1 . 1 1 39 39 LEU HA H 39 4.243 4.243 3.823 0.420 19845 179 1 1 . 1 1 39 39 LEU C C 39 175.702 175.702 178.467 -2.765 19845 180 1 1 . 1 1 39 39 LEU CA C 39 56.979 56.979 57.593 -0.614 19845 181 1 1 . 1 1 39 39 LEU CB C 39 41.893 41.893 41.093 0.800 19845 182 1 1 . 1 1 39 39 LEU H H 39 8.446 8.446 7.848 0.598 19845 183 1 1 . 1 1 40 40 ALA N N 40 122.512 122.512 120.641 1.871 19845 184 1 1 . 1 1 40 40 ALA HA H 40 3.975 3.975 4.070 -0.095 19845 185 1 1 . 1 1 40 40 ALA C C 40 175.838 175.838 178.649 -2.811 19845 186 1 1 . 1 1 40 40 ALA CA C 40 54.710 54.710 54.510 0.200 19845 187 1 1 . 1 1 40 40 ALA CB C 40 18.319 18.319 17.961 0.358 19845 188 1 1 . 1 1 40 40 ALA H H 40 8.321 8.321 7.429 0.892 19845 189 1 1 . 1 1 41 41 ALA N N 41 119.754 119.754 120.407 -0.653 19845 190 1 1 . 1 1 41 41 ALA HA H 41 4.024 4.024 4.197 -0.173 19845 191 1 1 . 1 1 41 41 ALA C C 41 176.517 176.517 179.899 -3.382 19845 192 1 1 . 1 1 41 41 ALA CA C 41 54.486 54.486 54.677 -0.191 19845 193 1 1 . 1 1 41 41 ALA CB C 41 18.468 18.468 18.728 -0.260 19845 194 1 1 . 1 1 41 41 ALA H H 41 8.038 8.038 8.041 -0.003 19845 195 1 1 . 1 1 42 42 TYR N N 42 118.272 118.272 118.891 -0.619 19845 196 1 1 . 1 1 42 42 TYR HA H 42 4.326 4.326 4.220 0.106 19845 197 1 1 . 1 1 42 42 TYR C C 42 174.633 174.633 177.773 -3.140 19845 198 1 1 . 1 1 42 42 TYR CA C 42 60.098 60.098 60.054 0.044 19845 199 1 1 . 1 1 42 42 TYR CB C 42 38.936 38.936 37.415 1.521 19845 200 1 1 . 1 1 42 42 TYR H H 42 7.814 7.814 8.005 -0.191 19845 201 1 1 . 1 1 43 43 ALA N N 43 122.908 122.908 121.586 1.322 19845 202 1 1 . 1 1 43 43 ALA HA H 43 4.111 4.111 4.208 -0.097 19845 203 1 1 . 1 1 43 43 ALA C C 43 175.241 175.241 178.346 -3.105 19845 204 1 1 . 1 1 43 43 ALA CA C 43 53.842 53.842 54.166 -0.324 19845 205 1 1 . 1 1 43 43 ALA CB C 43 18.427 18.427 17.594 0.833 19845 206 1 1 . 1 1 43 43 ALA H H 43 8.172 8.172 7.596 0.576 19845 207 1 1 . 1 1 44 44 ALA N N 44 119.906 119.906 119.520 0.386 19845 208 1 1 . 1 1 44 44 ALA HA H 44 4.051 4.051 4.237 -0.186 19845 209 1 1 . 1 1 44 44 ALA C C 44 175.092 175.092 178.089 -2.997 19845 210 1 1 . 1 1 44 44 ALA CA C 44 53.611 53.611 53.556 0.056 19845 211 1 1 . 1 1 44 44 ALA CB C 44 18.689 18.689 19.114 -0.425 19845 212 1 1 . 1 1 44 44 ALA H H 44 7.953 7.953 7.774 0.179 19845 213 1 1 . 1 1 45 45 ASN N N 45 114.984 114.984 116.764 -1.780 19845 214 1 1 . 1 1 45 45 ASN HA H 45 4.541 4.541 4.740 -0.199 19845 215 1 1 . 1 1 45 45 ASN CA C 45 54.506 54.506 54.731 -0.225 19845 216 1 1 . 1 1 45 45 ASN CB C 45 38.602 38.602 39.964 -1.362 19845 217 1 1 . 1 1 45 45 ASN H H 45 7.847 7.847 8.221 -0.374 19845 218 1 1 . 1 1 46 46 ILE N N 46 119.155 119.155 116.954 2.201 19845 219 1 1 . 1 1 46 46 ILE HA H 46 4.033 4.033 4.315 -0.282 19845 220 1 1 . 1 1 46 46 ILE C C 46 173.344 173.344 175.436 -2.092 19845 221 1 1 . 1 1 46 46 ILE CA C 46 62.357 62.357 62.034 0.323 19845 222 1 1 . 1 1 46 46 ILE CB C 46 38.657 38.657 38.682 -0.025 19845 223 1 1 . 1 1 46 46 ILE H H 46 7.790 7.790 7.629 0.161 19845 224 1 1 . 1 1 47 47 VAL N N 47 117.526 117.526 117.618 -0.092 19845 225 1 1 . 1 1 47 47 VAL HA H 47 4.133 4.133 4.331 -0.198 19845 226 1 1 . 1 1 47 47 VAL C C 47 172.672 172.672 175.201 -2.529 19845 227 1 1 . 1 1 47 47 VAL CA C 47 62.149 62.149 60.687 1.462 19845 228 1 1 . 1 1 47 47 VAL CB C 47 32.807 32.807 34.701 -1.894 19845 229 1 1 . 1 1 47 47 VAL H H 47 7.582 7.582 7.533 0.049 19845 230 1 1 . 1 1 48 48 ASN N N 48 120.091 120.091 118.388 1.703 19845 231 1 1 . 1 1 48 48 ASN HA H 48 4.658 4.658 4.838 -0.180 19845 232 1 1 . 1 1 48 48 ASN CA C 48 53.478 53.478 53.443 0.035 19845 233 1 1 . 1 1 48 48 ASN CB C 48 38.573 38.573 37.968 0.605 19845 234 1 1 . 1 1 48 48 ASN H H 48 8.053 8.053 8.580 -0.527 19845 235 1 1 . 1 1 49 49 VAL N N 49 118.854 118.854 118.981 -0.127 19845 236 1 1 . 1 1 49 49 VAL HA H 49 4.133 4.133 4.194 -0.061 19845 237 1 1 . 1 1 49 49 VAL C C 49 172.595 172.595 174.124 -1.529 19845 238 1 1 . 1 1 49 49 VAL CA C 49 62.049 62.049 60.672 1.377 19845 239 1 1 . 1 1 49 49 VAL CB C 49 33.271 33.271 33.724 -0.453 19845 240 1 1 . 1 1 49 49 VAL H H 49 7.685 7.685 7.125 0.560 19845 241 1 1 . 1 1 50 50 SER N N 50 118.689 118.689 121.183 -2.494 19845 242 1 1 . 1 1 50 50 SER HA H 50 4.466 4.466 4.284 0.182 19845 243 1 1 . 1 1 50 50 SER C C 50 171.430 171.430 172.504 -1.074 19845 244 1 1 . 1 1 50 50 SER CA C 50 58.128 58.128 57.056 1.072 19845 245 1 1 . 1 1 50 50 SER CB C 50 63.916 63.916 64.231 -0.315 19845 246 1 1 . 1 1 50 50 SER H H 50 8.075 8.075 8.115 -0.040 19845 247 1 1 . 1 1 51 51 LEU N N 51 123.536 123.536 120.045 3.491 19845 248 1 1 . 1 1 51 51 LEU HA H 51 4.305 4.305 4.701 -0.396 19845 249 1 1 . 1 1 51 51 LEU C C 51 174.110 174.110 175.773 -1.663 19845 250 1 1 . 1 1 51 51 LEU CA C 51 55.145 55.145 54.424 0.721 19845 251 1 1 . 1 1 51 51 LEU CB C 51 42.674 42.674 44.576 -1.902 19845 252 1 1 . 1 1 51 51 LEU H H 51 7.991 7.991 7.800 0.191 19845 253 1 1 . 1 1 52 52 VAL N N 52 119.649 119.649 119.100 0.549 19845 254 1 1 . 1 1 52 52 VAL HA H 52 3.992 3.992 4.309 -0.317 19845 255 1 1 . 1 1 52 52 VAL C C 52 172.476 172.476 175.960 -3.484 19845 256 1 1 . 1 1 52 52 VAL CA C 52 62.772 62.772 62.705 0.067 19845 257 1 1 . 1 1 52 52 VAL CB C 52 33.066 33.066 32.705 0.361 19845 258 1 1 . 1 1 52 52 VAL H H 52 7.536 7.536 8.088 -0.552 19845 259 1 1 . 1 1 53 53 LYS N N 53 122.004 122.004 121.218 0.786 19845 260 1 1 . 1 1 53 53 LYS HA H 53 4.354 4.354 4.216 0.138 19845 261 1 1 . 1 1 53 53 LYS CA C 53 56.567 56.567 59.692 -3.125 19845 262 1 1 . 1 1 53 53 LYS CB C 53 31.689 31.689 30.015 1.674 19845 263 1 1 . 1 1 53 53 LYS H H 53 8.038 8.038 8.234 -0.196 19845 264 1 1 . 1 1 54 54 PRO HA H 54 4.353 4.353 4.484 -0.131 19845 265 1 1 . 1 1 54 54 PRO CA C 54 65.103 65.103 64.928 0.175 19845 266 1 1 . 1 1 54 54 PRO CB C 54 32.193 32.193 30.925 1.268 19845 267 1 1 . 1 1 55 55 THR N N 55 111.485 111.485 109.668 1.817 19845 268 1 1 . 1 1 55 55 THR HA H 55 3.910 3.910 4.724 -0.814 19845 269 1 1 . 1 1 55 55 THR C C 55 172.822 172.822 176.443 -3.621 19845 270 1 1 . 1 1 55 55 THR CA C 55 65.030 65.030 63.334 1.696 19845 271 1 1 . 1 1 55 55 THR CB C 55 68.882 68.882 68.988 -0.106 19845 272 1 1 . 1 1 55 55 THR H H 55 7.722 7.722 7.319 0.403 19845 273 1 1 . 1 1 56 56 VAL N N 56 121.165 121.165 120.528 0.637 19845 274 1 1 . 1 1 56 56 VAL HA H 56 3.772 3.772 3.643 0.129 19845 275 1 1 . 1 1 56 56 VAL C C 56 174.904 174.904 176.877 -1.973 19845 276 1 1 . 1 1 56 56 VAL CA C 56 64.971 64.971 65.759 -0.788 19845 277 1 1 . 1 1 56 56 VAL CB C 56 31.989 31.989 31.244 0.745 19845 278 1 1 . 1 1 56 56 VAL H H 56 7.597 7.597 7.650 -0.053 19845 279 1 1 . 1 1 57 57 TYR N N 57 122.177 122.177 117.795 4.382 19845 280 1 1 . 1 1 57 57 TYR HA H 57 4.227 4.227 4.241 -0.014 19845 281 1 1 . 1 1 57 57 TYR C C 57 174.969 174.969 177.185 -2.216 19845 282 1 1 . 1 1 57 57 TYR CA C 57 60.755 60.755 59.477 1.278 19845 283 1 1 . 1 1 57 57 TYR CB C 57 38.453 38.453 37.057 1.396 19845 284 1 1 . 1 1 57 57 TYR H H 57 7.964 7.964 7.759 0.205 19845 285 1 1 . 1 1 58 58 VAL N N 58 119.069 119.069 118.682 0.387 19845 286 1 1 . 1 1 58 58 VAL HA H 58 3.529 3.529 3.354 0.175 19845 287 1 1 . 1 1 58 58 VAL C C 58 174.250 174.250 176.691 -2.441 19845 288 1 1 . 1 1 58 58 VAL CA C 58 66.223 66.223 63.965 2.258 19845 289 1 1 . 1 1 58 58 VAL CB C 58 31.803 31.803 31.314 0.489 19845 290 1 1 . 1 1 58 58 VAL H H 58 8.018 8.018 7.294 0.724 19845 291 1 1 . 1 1 59 59 TYR N N 59 120.360 120.360 121.180 -0.820 19845 292 1 1 . 1 1 59 59 TYR HA H 59 4.115 4.115 3.983 0.132 19845 293 1 1 . 1 1 59 59 TYR C C 59 173.899 173.899 177.450 -3.551 19845 294 1 1 . 1 1 59 59 TYR CA C 59 60.929 60.929 61.031 -0.102 19845 295 1 1 . 1 1 59 59 TYR CB C 59 38.602 38.602 37.993 0.609 19845 296 1 1 . 1 1 59 59 TYR H H 59 8.142 8.142 7.989 0.153 19845 297 1 1 . 1 1 60 60 SER N N 60 113.480 113.480 113.425 0.055 19845 298 1 1 . 1 1 60 60 SER HA H 60 3.979 3.979 4.031 -0.052 19845 299 1 1 . 1 1 60 60 SER C C 60 172.887 172.887 176.703 -3.816 19845 300 1 1 . 1 1 60 60 SER CA C 60 60.987 60.987 60.937 0.050 19845 301 1 1 . 1 1 60 60 SER CB C 60 63.267 63.267 63.178 0.088 19845 302 1 1 . 1 1 60 60 SER H H 60 8.057 8.057 7.701 0.356 19845 303 1 1 . 1 1 61 61 ARG N N 61 120.962 120.962 122.674 -1.712 19845 304 1 1 . 1 1 61 61 ARG HA H 61 4.103 4.103 3.997 0.106 19845 305 1 1 . 1 1 61 61 ARG C C 61 175.399 175.399 178.548 -3.149 19845 306 1 1 . 1 1 61 61 ARG CA C 61 57.427 57.427 58.881 -1.454 19845 307 1 1 . 1 1 61 61 ARG CB C 61 30.008 30.008 29.797 0.211 19845 308 1 1 . 1 1 61 61 ARG H H 61 7.606 7.606 7.284 0.322 19845 309 1 1 . 1 1 62 62 VAL N N 62 117.852 117.852 116.794 1.058 19845 310 1 1 . 1 1 62 62 VAL HA H 62 3.805 3.805 3.749 0.056 19845 311 1 1 . 1 1 62 62 VAL C C 62 174.155 174.155 177.314 -3.159 19845 312 1 1 . 1 1 62 62 VAL CA C 62 64.458 64.458 65.493 -1.035 19845 313 1 1 . 1 1 62 62 VAL CB C 62 31.969 31.969 30.805 1.164 19845 314 1 1 . 1 1 62 62 VAL H H 62 7.848 7.848 7.990 -0.142 19845 315 1 1 . 1 1 63 63 LYS N N 63 119.254 119.254 120.091 -0.837 19845 316 1 1 . 1 1 63 63 LYS HA H 63 4.051 4.051 3.977 0.074 19845 317 1 1 . 1 1 63 63 LYS C C 63 173.615 173.615 178.452 -4.837 19845 318 1 1 . 1 1 63 63 LYS CA C 63 56.727 56.727 58.321 -1.594 19845 319 1 1 . 1 1 63 63 LYS CB C 63 32.105 32.105 32.571 -0.466 19845 320 1 1 . 1 1 63 63 LYS H H 63 7.759 7.759 7.430 0.329 19845 321 1 1 . 1 1 64 64 ASN N N 64 117.696 117.696 116.306 1.390 19845 322 1 1 . 1 1 64 64 ASN HA H 64 4.642 4.642 4.434 0.208 19845 323 1 1 . 1 1 64 64 ASN C C 64 171.750 171.750 176.058 -4.308 19845 324 1 1 . 1 1 64 64 ASN CA C 64 53.313 53.313 55.010 -1.697 19845 325 1 1 . 1 1 64 64 ASN CB C 64 39.260 39.260 39.182 0.078 19845 326 1 1 . 1 1 64 64 ASN H H 64 7.615 7.615 8.066 -0.451 19845 327 1 2 . 1 1 9 9 THR N N 9 113.692 113.692 115.912 -2.220 19845 328 1 2 . 1 1 9 9 THR HA H 9 4.213 4.213 4.583 -0.370 19845 329 1 2 . 1 1 9 9 THR C C 9 172.757 172.757 175.108 -2.351 19845 330 1 2 . 1 1 9 9 THR CA C 9 62.810 62.810 62.512 0.298 19845 331 1 2 . 1 1 9 9 THR CB C 9 69.878 69.878 69.092 0.786 19845 332 1 2 . 1 1 9 9 THR H H 9 7.930 7.930 8.875 -0.945 19845 333 1 2 . 1 1 10 10 GLY N N 10 110.842 110.842 109.124 1.718 19845 334 1 2 . 1 1 10 10 GLY C C 10 171.923 171.923 173.517 -1.594 19845 335 1 2 . 1 1 10 10 GLY CA C 10 46.099 46.099 44.663 1.436 19845 336 1 2 . 1 1 10 10 GLY H H 10 8.266 8.266 7.978 0.288 19845 337 1 2 . 1 1 11 11 THR N N 11 113.754 113.754 116.935 -3.181 19845 338 1 2 . 1 1 11 11 THR HA H 11 4.220 4.220 4.360 -0.140 19845 339 1 2 . 1 1 11 11 THR C C 11 171.906 171.906 174.433 -2.527 19845 340 1 2 . 1 1 11 11 THR CA C 11 62.721 62.721 62.471 0.250 19845 341 1 2 . 1 1 11 11 THR CB C 11 69.549 69.549 68.859 0.690 19845 342 1 2 . 1 1 11 11 THR H H 11 7.753 7.753 7.904 -0.151 19845 343 1 2 . 1 1 12 12 LEU N N 12 123.669 123.669 126.123 -2.454 19845 344 1 2 . 1 1 12 12 LEU HA H 12 4.240 4.240 4.644 -0.404 19845 345 1 2 . 1 1 12 12 LEU C C 12 175.221 175.221 177.411 -2.190 19845 346 1 2 . 1 1 12 12 LEU CA C 12 56.799 56.799 54.598 2.201 19845 347 1 2 . 1 1 12 12 LEU CB C 12 42.536 42.536 42.024 0.512 19845 348 1 2 . 1 1 12 12 LEU H H 12 7.980 7.980 8.562 -0.582 19845 349 1 2 . 1 1 13 13 ILE N N 13 120.086 120.086 121.375 -1.289 19845 350 1 2 . 1 1 13 13 ILE HA H 13 3.913 3.913 4.138 -0.225 19845 351 1 2 . 1 1 13 13 ILE C C 13 173.425 173.425 177.371 -3.946 19845 352 1 2 . 1 1 13 13 ILE CA C 13 62.889 62.889 63.608 -0.719 19845 353 1 2 . 1 1 13 13 ILE CB C 13 38.249 38.249 37.902 0.347 19845 354 1 2 . 1 1 13 13 ILE H H 13 7.861 7.861 7.724 0.137 19845 355 1 2 . 1 1 14 14 VAL N N 14 119.785 119.785 120.545 -0.760 19845 356 1 2 . 1 1 14 14 VAL HA H 14 3.790 3.790 3.889 -0.099 19845 357 1 2 . 1 1 14 14 VAL C C 14 173.429 173.429 177.369 -3.940 19845 358 1 2 . 1 1 14 14 VAL CA C 14 64.409 64.409 65.318 -0.909 19845 359 1 2 . 1 1 14 14 VAL CB C 14 32.007 32.007 31.182 0.825 19845 360 1 2 . 1 1 14 14 VAL H H 14 7.549 7.549 8.198 -0.649 19845 361 1 2 . 1 1 15 15 ASN N N 15 119.567 119.567 116.595 2.972 19845 362 1 2 . 1 1 15 15 ASN HA H 15 4.549 4.549 4.652 -0.103 19845 363 1 2 . 1 1 15 15 ASN C C 15 173.619 173.619 177.524 -3.905 19845 364 1 2 . 1 1 15 15 ASN CA C 15 54.805 54.805 55.706 -0.901 19845 365 1 2 . 1 1 15 15 ASN CB C 15 38.824 38.824 38.158 0.666 19845 366 1 2 . 1 1 15 15 ASN H H 15 8.010 8.010 8.521 -0.511 19845 367 1 2 . 1 1 16 16 SER N N 16 116.730 116.730 116.681 0.049 19845 368 1 2 . 1 1 16 16 SER HA H 16 4.177 4.177 4.422 -0.245 19845 369 1 2 . 1 1 16 16 SER CA C 16 61.705 61.705 61.095 0.610 19845 370 1 2 . 1 1 16 16 SER CB C 16 63.752 63.752 63.329 0.423 19845 371 1 2 . 1 1 16 16 SER H H 16 8.039 8.039 7.460 0.579 19845 372 1 2 . 1 1 17 17 VAL N N 17 122.062 122.062 123.040 -0.978 19845 373 1 2 . 1 1 17 17 VAL HA H 17 3.677 3.677 3.836 -0.159 19845 374 1 2 . 1 1 17 17 VAL C C 17 174.474 174.474 177.334 -2.860 19845 375 1 2 . 1 1 17 17 VAL CA C 17 66.671 66.671 65.861 0.810 19845 376 1 2 . 1 1 17 17 VAL CB C 17 31.531 31.531 32.020 -0.489 19845 377 1 2 . 1 1 17 17 VAL H H 17 7.896 7.896 8.200 -0.304 19845 378 1 2 . 1 1 18 18 LEU N N 18 119.103 119.103 120.120 -1.017 19845 379 1 2 . 1 1 18 18 LEU HA H 18 3.998 3.998 4.235 -0.237 19845 380 1 2 . 1 1 18 18 LEU C C 18 175.511 175.511 178.102 -2.591 19845 381 1 2 . 1 1 18 18 LEU CA C 18 58.107 58.107 58.018 0.089 19845 382 1 2 . 1 1 18 18 LEU CB C 18 41.593 41.593 42.180 -0.587 19845 383 1 2 . 1 1 18 18 LEU H H 18 7.857 7.857 7.428 0.429 19845 384 1 2 . 1 1 19 19 LEU N N 19 118.291 118.291 120.390 -2.099 19845 385 1 2 . 1 1 19 19 LEU HA H 19 4.152 4.152 4.157 -0.005 19845 386 1 2 . 1 1 19 19 LEU C C 19 175.156 175.156 178.921 -3.765 19845 387 1 2 . 1 1 19 19 LEU CA C 19 58.011 58.011 57.709 0.302 19845 388 1 2 . 1 1 19 19 LEU CB C 19 42.027 42.027 41.007 1.020 19845 389 1 2 . 1 1 19 19 LEU H H 19 7.745 7.745 7.583 0.162 19845 390 1 2 . 1 1 20 20 PHE N N 20 118.415 118.415 119.590 -1.175 19845 391 1 2 . 1 1 20 20 PHE HA H 20 4.188 4.188 4.132 0.056 19845 392 1 2 . 1 1 20 20 PHE C C 20 174.260 174.260 177.670 -3.410 19845 393 1 2 . 1 1 20 20 PHE CA C 20 61.626 61.626 62.103 -0.477 19845 394 1 2 . 1 1 20 20 PHE CB C 20 38.643 38.643 38.900 -0.257 19845 395 1 2 . 1 1 20 20 PHE H H 20 8.002 8.002 8.567 -0.565 19845 396 1 2 . 1 1 21 21 LEU N N 21 118.571 118.571 119.806 -1.235 19845 397 1 2 . 1 1 21 21 LEU HA H 21 3.797 3.797 4.102 -0.305 19845 398 1 2 . 1 1 21 21 LEU C C 21 175.324 175.324 178.906 -3.582 19845 399 1 2 . 1 1 21 21 LEU CA C 21 58.128 58.128 58.150 -0.022 19845 400 1 2 . 1 1 21 21 LEU CB C 21 41.957 41.957 41.037 0.920 19845 401 1 2 . 1 1 21 21 LEU H H 21 8.456 8.456 7.713 0.743 19845 402 1 2 . 1 1 22 22 ALA N N 22 120.775 120.775 121.065 -0.290 19845 403 1 2 . 1 1 22 22 ALA HA H 22 3.779 3.779 4.090 -0.311 19845 404 1 2 . 1 1 22 22 ALA C C 22 175.697 175.697 180.201 -4.504 19845 405 1 2 . 1 1 22 22 ALA CA C 22 55.721 55.721 54.702 1.019 19845 406 1 2 . 1 1 22 22 ALA CB C 22 17.788 17.788 18.288 -0.500 19845 407 1 2 . 1 1 22 22 ALA H H 22 8.353 8.353 7.599 0.754 19845 408 1 2 . 1 1 23 23 PHE N N 23 117.860 117.860 119.800 -1.940 19845 409 1 2 . 1 1 23 23 PHE HA H 23 4.108 4.108 4.341 -0.233 19845 410 1 2 . 1 1 23 23 PHE C C 23 173.859 173.859 176.994 -3.135 19845 411 1 2 . 1 1 23 23 PHE CA C 23 61.271 61.271 62.015 -0.744 19845 412 1 2 . 1 1 23 23 PHE CB C 23 38.853 38.853 39.633 -0.780 19845 413 1 2 . 1 1 23 23 PHE H H 23 8.121 8.121 8.255 -0.134 19845 414 1 2 . 1 1 24 24 VAL N N 24 119.181 119.181 119.741 -0.560 19845 415 1 2 . 1 1 24 24 VAL HA H 24 3.134 3.134 3.539 -0.405 19845 416 1 2 . 1 1 24 24 VAL C C 24 174.684 174.684 177.936 -3.252 19845 417 1 2 . 1 1 24 24 VAL CA C 24 67.419 67.419 66.979 0.440 19845 418 1 2 . 1 1 24 24 VAL CB C 24 31.106 31.106 30.953 0.154 19845 419 1 2 . 1 1 24 24 VAL H H 24 8.124 8.124 8.416 -0.292 19845 420 1 2 . 1 1 25 25 VAL N N 25 119.215 119.215 117.508 1.707 19845 421 1 2 . 1 1 25 25 VAL HA H 25 3.324 3.324 3.577 -0.253 19845 422 1 2 . 1 1 25 25 VAL C C 25 174.244 174.244 177.782 -3.538 19845 423 1 2 . 1 1 25 25 VAL CA C 25 67.740 67.740 65.674 2.066 19845 424 1 2 . 1 1 25 25 VAL CB C 25 31.270 31.270 30.281 0.989 19845 425 1 2 . 1 1 25 25 VAL H H 25 8.250 8.250 7.450 0.800 19845 426 1 2 . 1 1 26 26 PHE N N 26 119.875 119.875 119.874 0.001 19845 427 1 2 . 1 1 26 26 PHE HA H 26 3.900 3.900 4.133 -0.233 19845 428 1 2 . 1 1 26 26 PHE C C 26 175.371 175.371 178.025 -2.654 19845 429 1 2 . 1 1 26 26 PHE CA C 26 61.651 61.651 61.881 -0.230 19845 430 1 2 . 1 1 26 26 PHE CB C 26 38.760 38.760 38.350 0.410 19845 431 1 2 . 1 1 26 26 PHE H H 26 8.413 8.413 7.163 1.250 19845 432 1 2 . 1 1 27 27 LEU N N 27 122.548 122.548 119.146 3.402 19845 433 1 2 . 1 1 27 27 LEU HA H 27 3.533 3.533 3.872 -0.339 19845 434 1 2 . 1 1 27 27 LEU C C 27 175.256 175.256 179.079 -3.823 19845 435 1 2 . 1 1 27 27 LEU CA C 27 58.211 58.211 57.706 0.505 19845 436 1 2 . 1 1 27 27 LEU CB C 27 41.564 41.564 41.449 0.115 19845 437 1 2 . 1 1 27 27 LEU H H 27 8.453 8.453 8.195 0.258 19845 438 1 2 . 1 1 28 28 LEU N N 28 119.385 119.385 119.821 -0.436 19845 439 1 2 . 1 1 28 28 LEU HA H 28 3.799 3.799 3.867 -0.068 19845 440 1 2 . 1 1 28 28 LEU C C 28 175.881 175.881 179.120 -3.239 19845 441 1 2 . 1 1 28 28 LEU CA C 28 58.492 58.492 58.274 0.218 19845 442 1 2 . 1 1 28 28 LEU CB C 28 41.760 41.760 41.444 0.316 19845 443 1 2 . 1 1 28 28 LEU H H 28 8.248 8.248 8.318 -0.070 19845 444 1 2 . 1 1 29 29 VAL N N 29 118.515 118.515 117.407 1.108 19845 445 1 2 . 1 1 29 29 VAL HA H 29 3.319 3.319 3.675 -0.356 19845 446 1 2 . 1 1 29 29 VAL C C 29 174.734 174.734 177.707 -2.973 19845 447 1 2 . 1 1 29 29 VAL CA C 29 67.192 67.192 65.805 1.387 19845 448 1 2 . 1 1 29 29 VAL CB C 29 31.175 31.175 31.869 -0.695 19845 449 1 2 . 1 1 29 29 VAL H H 29 8.446 8.446 7.399 1.047 19845 450 1 2 . 1 1 30 30 THR N N 30 117.313 117.313 116.758 0.555 19845 451 1 2 . 1 1 30 30 THR HA H 30 3.432 3.432 3.906 -0.474 19845 452 1 2 . 1 1 30 30 THR CA C 30 68.606 68.606 66.978 1.628 19845 453 1 2 . 1 1 30 30 THR CB C 30 67.147 67.147 68.458 -1.311 19845 454 1 2 . 1 1 30 30 THR H H 30 7.923 7.923 8.062 -0.139 19845 455 1 2 . 1 1 31 31 LEU N N 31 120.629 120.629 121.172 -0.543 19845 456 1 2 . 1 1 31 31 LEU HA H 31 3.858 3.858 3.958 -0.100 19845 457 1 2 . 1 1 31 31 LEU C C 31 177.164 177.164 178.557 -1.393 19845 458 1 2 . 1 1 31 31 LEU CA C 31 58.145 58.145 57.640 0.505 19845 459 1 2 . 1 1 31 31 LEU CB C 31 41.615 41.615 41.648 -0.032 19845 460 1 2 . 1 1 31 31 LEU H H 31 8.382 8.382 8.190 0.192 19845 461 1 2 . 1 1 32 32 ALA N N 32 125.216 125.216 121.703 3.513 19845 462 1 2 . 1 1 32 32 ALA HA H 32 3.836 3.836 3.920 -0.084 19845 463 1 2 . 1 1 32 32 ALA C C 32 175.968 175.968 180.520 -4.552 19845 464 1 2 . 1 1 32 32 ALA CA C 32 55.918 55.918 54.842 1.077 19845 465 1 2 . 1 1 32 32 ALA CB C 32 17.802 17.802 18.136 -0.334 19845 466 1 2 . 1 1 32 32 ALA H H 32 8.517 8.517 7.614 0.903 19845 467 1 2 . 1 1 33 33 ILE N N 33 118.722 118.722 118.936 -0.214 19845 468 1 2 . 1 1 33 33 ILE HA H 33 3.481 3.481 3.583 -0.102 19845 469 1 2 . 1 1 33 33 ILE C C 33 175.004 175.004 178.074 -3.070 19845 470 1 2 . 1 1 33 33 ILE CA C 33 65.554 65.554 64.832 0.722 19845 471 1 2 . 1 1 33 33 ILE CB C 33 37.657 37.657 37.358 0.299 19845 472 1 2 . 1 1 33 33 ILE H H 33 8.288 8.288 7.559 0.729 19845 473 1 2 . 1 1 34 34 LEU N N 34 118.987 118.987 120.016 -1.029 19845 474 1 2 . 1 1 34 34 LEU HA H 34 3.893 3.893 3.994 -0.101 19845 475 1 2 . 1 1 34 34 LEU C C 34 176.439 176.439 178.217 -1.778 19845 476 1 2 . 1 1 34 34 LEU CA C 34 58.436 58.436 57.841 0.595 19845 477 1 2 . 1 1 34 34 LEU CB C 34 42.152 42.152 41.147 1.005 19845 478 1 2 . 1 1 34 34 LEU H H 34 8.493 8.493 8.081 0.412 19845 479 1 2 . 1 1 35 35 THR N N 35 116.630 116.630 115.400 1.230 19845 480 1 2 . 1 1 35 35 THR HA H 35 3.652 3.652 3.857 -0.205 19845 481 1 2 . 1 1 35 35 THR C C 35 173.366 173.366 176.060 -2.694 19845 482 1 2 . 1 1 35 35 THR CA C 35 68.153 68.153 67.129 1.024 19845 483 1 2 . 1 1 35 35 THR CB C 35 68.162 68.162 68.428 -0.266 19845 484 1 2 . 1 1 35 35 THR H H 35 8.215 8.215 8.166 0.049 19845 485 1 2 . 1 1 36 36 ALA N N 36 124.667 124.667 123.482 1.185 19845 486 1 2 . 1 1 36 36 ALA HA H 36 3.864 3.864 4.046 -0.182 19845 487 1 2 . 1 1 36 36 ALA C C 36 176.510 176.510 179.571 -3.061 19845 488 1 2 . 1 1 36 36 ALA CA C 36 55.758 55.758 54.961 0.797 19845 489 1 2 . 1 1 36 36 ALA CB C 36 18.054 18.054 18.199 -0.145 19845 490 1 2 . 1 1 36 36 ALA H H 36 8.358 8.358 7.910 0.448 19845 491 1 2 . 1 1 37 37 LEU N N 37 116.565 116.565 117.671 -1.106 19845 492 1 2 . 1 1 37 37 LEU HA H 37 3.973 3.973 4.097 -0.124 19845 493 1 2 . 1 1 37 37 LEU C C 37 176.538 176.538 179.115 -2.577 19845 494 1 2 . 1 1 37 37 LEU CA C 37 57.853 57.853 57.146 0.707 19845 495 1 2 . 1 1 37 37 LEU CB C 37 42.018 42.018 40.538 1.480 19845 496 1 2 . 1 1 37 37 LEU H H 37 8.360 8.360 7.530 0.830 19845 497 1 2 . 1 1 38 38 ARG N N 38 119.392 119.392 119.909 -0.517 19845 498 1 2 . 1 1 38 38 ARG HA H 38 4.104 4.104 4.033 0.071 19845 499 1 2 . 1 1 38 38 ARG C C 38 176.208 176.208 179.358 -3.150 19845 500 1 2 . 1 1 38 38 ARG CA C 38 58.100 58.100 59.456 -1.355 19845 501 1 2 . 1 1 38 38 ARG CB C 38 29.502 29.502 29.922 -0.420 19845 502 1 2 . 1 1 38 38 ARG H H 38 8.082 8.082 7.459 0.623 19845 503 1 2 . 1 1 39 39 LEU N N 39 120.438 120.438 117.835 2.603 19845 504 1 2 . 1 1 39 39 LEU HA H 39 4.243 4.243 3.903 0.340 19845 505 1 2 . 1 1 39 39 LEU C C 39 175.702 175.702 178.417 -2.715 19845 506 1 2 . 1 1 39 39 LEU CA C 39 56.979 56.979 58.293 -1.314 19845 507 1 2 . 1 1 39 39 LEU CB C 39 41.893 41.893 41.539 0.354 19845 508 1 2 . 1 1 39 39 LEU H H 39 8.446 8.446 7.763 0.683 19845 509 1 2 . 1 1 40 40 ALA N N 40 122.512 122.512 120.861 1.651 19845 510 1 2 . 1 1 40 40 ALA HA H 40 3.975 3.975 4.083 -0.108 19845 511 1 2 . 1 1 40 40 ALA C C 40 175.838 175.838 178.533 -2.695 19845 512 1 2 . 1 1 40 40 ALA CA C 40 54.710 54.710 54.546 0.164 19845 513 1 2 . 1 1 40 40 ALA CB C 40 18.319 18.319 18.038 0.281 19845 514 1 2 . 1 1 40 40 ALA H H 40 8.321 8.321 7.486 0.835 19845 515 1 2 . 1 1 41 41 ALA N N 41 119.754 119.754 120.688 -0.934 19845 516 1 2 . 1 1 41 41 ALA HA H 41 4.024 4.024 4.185 -0.161 19845 517 1 2 . 1 1 41 41 ALA C C 41 176.517 176.517 179.888 -3.371 19845 518 1 2 . 1 1 41 41 ALA CA C 41 54.486 54.486 54.742 -0.256 19845 519 1 2 . 1 1 41 41 ALA CB C 41 18.468 18.468 18.720 -0.252 19845 520 1 2 . 1 1 41 41 ALA H H 41 8.038 8.038 7.999 0.039 19845 521 1 2 . 1 1 42 42 TYR N N 42 118.272 118.272 118.662 -0.390 19845 522 1 2 . 1 1 42 42 TYR HA H 42 4.326 4.326 4.249 0.077 19845 523 1 2 . 1 1 42 42 TYR C C 42 174.633 174.633 177.599 -2.966 19845 524 1 2 . 1 1 42 42 TYR CA C 42 60.098 60.098 59.993 0.105 19845 525 1 2 . 1 1 42 42 TYR CB C 42 38.936 38.936 37.455 1.481 19845 526 1 2 . 1 1 42 42 TYR H H 42 7.814 7.814 8.020 -0.206 19845 527 1 2 . 1 1 43 43 ALA N N 43 122.908 122.908 121.219 1.689 19845 528 1 2 . 1 1 43 43 ALA HA H 43 4.111 4.111 4.227 -0.116 19845 529 1 2 . 1 1 43 43 ALA C C 43 175.241 175.241 178.247 -3.006 19845 530 1 2 . 1 1 43 43 ALA CA C 43 53.842 53.842 54.026 -0.184 19845 531 1 2 . 1 1 43 43 ALA CB C 43 18.427 18.427 17.876 0.551 19845 532 1 2 . 1 1 43 43 ALA H H 43 8.172 8.172 7.577 0.595 19845 533 1 2 . 1 1 44 44 ALA N N 44 119.906 119.906 119.236 0.670 19845 534 1 2 . 1 1 44 44 ALA HA H 44 4.051 4.051 4.235 -0.184 19845 535 1 2 . 1 1 44 44 ALA C C 44 175.092 175.092 178.100 -3.008 19845 536 1 2 . 1 1 44 44 ALA CA C 44 53.611 53.611 53.442 0.169 19845 537 1 2 . 1 1 44 44 ALA CB C 44 18.689 18.689 18.971 -0.282 19845 538 1 2 . 1 1 44 44 ALA H H 44 7.953 7.953 7.616 0.337 19845 539 1 2 . 1 1 45 45 ASN N N 45 114.984 114.984 117.403 -2.419 19845 540 1 2 . 1 1 45 45 ASN HA H 45 4.541 4.541 4.730 -0.189 19845 541 1 2 . 1 1 45 45 ASN CA C 45 54.506 54.506 54.750 -0.244 19845 542 1 2 . 1 1 45 45 ASN CB C 45 38.602 38.602 40.236 -1.634 19845 543 1 2 . 1 1 45 45 ASN H H 45 7.847 7.847 8.156 -0.309 19845 544 1 2 . 1 1 46 46 ILE N N 46 119.155 119.155 117.317 1.838 19845 545 1 2 . 1 1 46 46 ILE HA H 46 4.033 4.033 4.374 -0.341 19845 546 1 2 . 1 1 46 46 ILE C C 46 173.344 173.344 175.752 -2.408 19845 547 1 2 . 1 1 46 46 ILE CA C 46 62.357 62.357 62.014 0.343 19845 548 1 2 . 1 1 46 46 ILE CB C 46 38.657 38.657 38.731 -0.074 19845 549 1 2 . 1 1 46 46 ILE H H 46 7.790 7.790 7.637 0.153 19845 550 1 2 . 1 1 47 47 VAL N N 47 117.526 117.526 114.283 3.243 19845 551 1 2 . 1 1 47 47 VAL HA H 47 4.133 4.133 4.509 -0.376 19845 552 1 2 . 1 1 47 47 VAL C C 47 172.672 172.672 174.560 -1.888 19845 553 1 2 . 1 1 47 47 VAL CA C 47 62.149 62.149 59.892 2.257 19845 554 1 2 . 1 1 47 47 VAL CB C 47 32.807 32.807 34.371 -1.564 19845 555 1 2 . 1 1 47 47 VAL H H 47 7.582 7.582 7.478 0.104 19845 556 1 2 . 1 1 48 48 ASN N N 48 120.091 120.091 121.057 -0.966 19845 557 1 2 . 1 1 48 48 ASN HA H 48 4.658 4.658 4.841 -0.183 19845 558 1 2 . 1 1 48 48 ASN CA C 48 53.478 53.478 53.184 0.294 19845 559 1 2 . 1 1 48 48 ASN CB C 48 38.573 38.573 36.206 2.366 19845 560 1 2 . 1 1 48 48 ASN H H 48 8.053 8.053 8.614 -0.561 19845 561 1 2 . 1 1 49 49 VAL N N 49 118.854 118.854 119.368 -0.514 19845 562 1 2 . 1 1 49 49 VAL HA H 49 4.133 4.133 4.223 -0.090 19845 563 1 2 . 1 1 49 49 VAL C C 49 172.595 172.595 173.899 -1.304 19845 564 1 2 . 1 1 49 49 VAL CA C 49 62.049 62.049 60.785 1.264 19845 565 1 2 . 1 1 49 49 VAL CB C 49 33.271 33.271 33.423 -0.152 19845 566 1 2 . 1 1 49 49 VAL H H 49 7.685 7.685 8.086 -0.401 19845 567 1 2 . 1 1 50 50 SER N N 50 118.689 118.689 122.126 -3.437 19845 568 1 2 . 1 1 50 50 SER HA H 50 4.466 4.466 4.136 0.330 19845 569 1 2 . 1 1 50 50 SER C C 50 171.430 171.430 172.458 -1.028 19845 570 1 2 . 1 1 50 50 SER CA C 50 58.128 58.128 56.970 1.158 19845 571 1 2 . 1 1 50 50 SER CB C 50 63.916 63.916 64.243 -0.327 19845 572 1 2 . 1 1 50 50 SER H H 50 8.075 8.075 8.134 -0.059 19845 573 1 2 . 1 1 51 51 LEU N N 51 123.536 123.536 118.685 4.851 19845 574 1 2 . 1 1 51 51 LEU HA H 51 4.305 4.305 4.753 -0.448 19845 575 1 2 . 1 1 51 51 LEU C C 51 174.110 174.110 175.027 -0.917 19845 576 1 2 . 1 1 51 51 LEU CA C 51 55.145 55.145 54.411 0.734 19845 577 1 2 . 1 1 51 51 LEU CB C 51 42.674 42.674 42.894 -0.220 19845 578 1 2 . 1 1 51 51 LEU H H 51 7.991 7.991 7.580 0.411 19845 579 1 2 . 1 1 52 52 VAL N N 52 119.649 119.649 118.306 1.343 19845 580 1 2 . 1 1 52 52 VAL HA H 52 3.992 3.992 4.347 -0.355 19845 581 1 2 . 1 1 52 52 VAL C C 52 172.476 172.476 177.150 -4.674 19845 582 1 2 . 1 1 52 52 VAL CA C 52 62.772 62.772 62.821 -0.049 19845 583 1 2 . 1 1 52 52 VAL CB C 52 33.066 33.066 32.663 0.403 19845 584 1 2 . 1 1 52 52 VAL H H 52 7.536 7.536 8.351 -0.815 19845 585 1 2 . 1 1 53 53 LYS N N 53 122.004 122.004 122.467 -0.463 19845 586 1 2 . 1 1 53 53 LYS HA H 53 4.354 4.354 4.183 0.171 19845 587 1 2 . 1 1 53 53 LYS CA C 53 56.567 56.567 59.995 -3.428 19845 588 1 2 . 1 1 53 53 LYS CB C 53 31.689 31.689 29.877 1.812 19845 589 1 2 . 1 1 53 53 LYS H H 53 8.038 8.038 8.461 -0.423 19845 590 1 2 . 1 1 54 54 PRO HA H 54 4.353 4.353 4.468 -0.115 19845 591 1 2 . 1 1 54 54 PRO CA C 54 65.103 65.103 65.029 0.074 19845 592 1 2 . 1 1 54 54 PRO CB C 54 32.193 32.193 30.972 1.221 19845 593 1 2 . 1 1 55 55 THR N N 55 111.485 111.485 111.156 0.329 19845 594 1 2 . 1 1 55 55 THR HA H 55 3.910 3.910 4.751 -0.841 19845 595 1 2 . 1 1 55 55 THR C C 55 172.822 172.822 176.714 -3.892 19845 596 1 2 . 1 1 55 55 THR CA C 55 65.030 65.030 63.462 1.567 19845 597 1 2 . 1 1 55 55 THR CB C 55 68.882 68.882 69.374 -0.492 19845 598 1 2 . 1 1 55 55 THR H H 55 7.722 7.722 7.674 0.048 19845 599 1 2 . 1 1 56 56 VAL N N 56 121.165 121.165 120.666 0.499 19845 600 1 2 . 1 1 56 56 VAL HA H 56 3.772 3.772 3.759 0.013 19845 601 1 2 . 1 1 56 56 VAL C C 56 174.904 174.904 176.771 -1.867 19845 602 1 2 . 1 1 56 56 VAL CA C 56 64.971 64.971 66.393 -1.422 19845 603 1 2 . 1 1 56 56 VAL CB C 56 31.989 31.989 30.480 1.508 19845 604 1 2 . 1 1 56 56 VAL H H 56 7.597 7.597 7.714 -0.117 19845 605 1 2 . 1 1 57 57 TYR N N 57 122.177 122.177 117.874 4.303 19845 606 1 2 . 1 1 57 57 TYR HA H 57 4.227 4.227 4.301 -0.074 19845 607 1 2 . 1 1 57 57 TYR C C 57 174.969 174.969 177.174 -2.205 19845 608 1 2 . 1 1 57 57 TYR CA C 57 60.755 60.755 59.527 1.228 19845 609 1 2 . 1 1 57 57 TYR CB C 57 38.453 38.453 36.723 1.730 19845 610 1 2 . 1 1 57 57 TYR H H 57 7.964 7.964 8.098 -0.134 19845 611 1 2 . 1 1 58 58 VAL N N 58 119.069 119.069 119.412 -0.343 19845 612 1 2 . 1 1 58 58 VAL HA H 58 3.529 3.529 3.304 0.225 19845 613 1 2 . 1 1 58 58 VAL C C 58 174.250 174.250 177.388 -3.138 19845 614 1 2 . 1 1 58 58 VAL CA C 58 66.223 66.223 64.509 1.714 19845 615 1 2 . 1 1 58 58 VAL CB C 58 31.803 31.803 30.846 0.957 19845 616 1 2 . 1 1 58 58 VAL H H 58 8.018 8.018 7.242 0.776 19845 617 1 2 . 1 1 59 59 TYR N N 59 120.360 120.360 120.875 -0.515 19845 618 1 2 . 1 1 59 59 TYR HA H 59 4.115 4.115 3.980 0.135 19845 619 1 2 . 1 1 59 59 TYR C C 59 173.899 173.899 177.602 -3.703 19845 620 1 2 . 1 1 59 59 TYR CA C 59 60.929 60.929 61.266 -0.337 19845 621 1 2 . 1 1 59 59 TYR CB C 59 38.602 38.602 37.893 0.709 19845 622 1 2 . 1 1 59 59 TYR H H 59 8.142 8.142 7.900 0.242 19845 623 1 2 . 1 1 60 60 SER N N 60 113.480 113.480 113.320 0.160 19845 624 1 2 . 1 1 60 60 SER HA H 60 3.979 3.979 3.974 0.005 19845 625 1 2 . 1 1 60 60 SER C C 60 172.887 172.887 176.884 -3.997 19845 626 1 2 . 1 1 60 60 SER CA C 60 60.987 60.987 61.176 -0.189 19845 627 1 2 . 1 1 60 60 SER CB C 60 63.267 63.267 63.021 0.246 19845 628 1 2 . 1 1 60 60 SER H H 60 8.057 8.057 7.769 0.288 19845 629 1 2 . 1 1 61 61 ARG N N 61 120.962 120.962 122.783 -1.821 19845 630 1 2 . 1 1 61 61 ARG HA H 61 4.103 4.103 4.031 0.072 19845 631 1 2 . 1 1 61 61 ARG C C 61 175.399 175.399 178.641 -3.242 19845 632 1 2 . 1 1 61 61 ARG CA C 61 57.427 57.427 59.338 -1.911 19845 633 1 2 . 1 1 61 61 ARG CB C 61 30.008 30.008 30.223 -0.215 19845 634 1 2 . 1 1 61 61 ARG H H 61 7.606 7.606 7.279 0.327 19845 635 1 2 . 1 1 62 62 VAL N N 62 117.852 117.852 116.680 1.172 19845 636 1 2 . 1 1 62 62 VAL HA H 62 3.805 3.805 3.769 0.036 19845 637 1 2 . 1 1 62 62 VAL C C 62 174.155 174.155 177.166 -3.011 19845 638 1 2 . 1 1 62 62 VAL CA C 62 64.458 64.458 65.517 -1.059 19845 639 1 2 . 1 1 62 62 VAL CB C 62 31.969 31.969 30.959 1.010 19845 640 1 2 . 1 1 62 62 VAL H H 62 7.848 7.848 8.051 -0.203 19845 641 1 2 . 1 1 63 63 LYS N N 63 119.254 119.254 120.335 -1.081 19845 642 1 2 . 1 1 63 63 LYS HA H 63 4.051 4.051 3.948 0.103 19845 643 1 2 . 1 1 63 63 LYS C C 63 173.615 173.615 178.440 -4.825 19845 644 1 2 . 1 1 63 63 LYS CA C 63 56.727 56.727 58.469 -1.742 19845 645 1 2 . 1 1 63 63 LYS CB C 63 32.105 32.105 32.456 -0.351 19845 646 1 2 . 1 1 63 63 LYS H H 63 7.759 7.759 7.459 0.300 19845 647 1 2 . 1 1 64 64 ASN N N 64 117.696 117.696 116.489 1.207 19845 648 1 2 . 1 1 64 64 ASN HA H 64 4.642 4.642 4.430 0.212 19845 649 1 2 . 1 1 64 64 ASN C C 64 171.750 171.750 175.744 -3.994 19845 650 1 2 . 1 1 64 64 ASN CA C 64 53.313 53.313 54.925 -1.612 19845 651 1 2 . 1 1 64 64 ASN CB C 64 39.260 39.260 39.196 0.064 19845 652 1 2 . 1 1 64 64 ASN H H 64 7.615 7.615 8.049 -0.434 19845 653 1 3 . 1 1 9 9 THR N N 9 113.692 113.692 115.613 -1.921 19845 654 1 3 . 1 1 9 9 THR HA H 9 4.213 4.213 4.580 -0.367 19845 655 1 3 . 1 1 9 9 THR C C 9 172.757 172.757 175.150 -2.393 19845 656 1 3 . 1 1 9 9 THR CA C 9 62.810 62.810 62.250 0.560 19845 657 1 3 . 1 1 9 9 THR CB C 9 69.878 69.878 69.037 0.841 19845 658 1 3 . 1 1 9 9 THR H H 9 7.930 7.930 8.548 -0.618 19845 659 1 3 . 1 1 10 10 GLY N N 10 110.842 110.842 109.423 1.419 19845 660 1 3 . 1 1 10 10 GLY C C 10 171.923 171.923 173.725 -1.802 19845 661 1 3 . 1 1 10 10 GLY CA C 10 46.099 46.099 44.597 1.502 19845 662 1 3 . 1 1 10 10 GLY H H 10 8.266 8.266 7.924 0.342 19845 663 1 3 . 1 1 11 11 THR N N 11 113.754 113.754 118.451 -4.697 19845 664 1 3 . 1 1 11 11 THR HA H 11 4.220 4.220 4.349 -0.129 19845 665 1 3 . 1 1 11 11 THR C C 11 171.906 171.906 174.496 -2.590 19845 666 1 3 . 1 1 11 11 THR CA C 11 62.721 62.721 62.603 0.118 19845 667 1 3 . 1 1 11 11 THR CB C 11 69.549 69.549 68.776 0.773 19845 668 1 3 . 1 1 11 11 THR H H 11 7.753 7.753 7.975 -0.222 19845 669 1 3 . 1 1 12 12 LEU N N 12 123.669 123.669 124.659 -0.990 19845 670 1 3 . 1 1 12 12 LEU HA H 12 4.240 4.240 4.680 -0.440 19845 671 1 3 . 1 1 12 12 LEU C C 12 175.221 175.221 176.719 -1.498 19845 672 1 3 . 1 1 12 12 LEU CA C 12 56.799 56.799 56.007 0.792 19845 673 1 3 . 1 1 12 12 LEU CB C 12 42.536 42.536 42.096 0.440 19845 674 1 3 . 1 1 12 12 LEU H H 12 7.980 7.980 7.923 0.057 19845 675 1 3 . 1 1 13 13 ILE N N 13 120.086 120.086 121.036 -0.950 19845 676 1 3 . 1 1 13 13 ILE HA H 13 3.913 3.913 4.071 -0.158 19845 677 1 3 . 1 1 13 13 ILE C C 13 173.425 173.425 177.309 -3.884 19845 678 1 3 . 1 1 13 13 ILE CA C 13 62.889 62.889 62.101 0.788 19845 679 1 3 . 1 1 13 13 ILE CB C 13 38.249 38.249 37.825 0.424 19845 680 1 3 . 1 1 13 13 ILE H H 13 7.861 7.861 7.525 0.336 19845 681 1 3 . 1 1 14 14 VAL N N 14 119.785 119.785 119.957 -0.172 19845 682 1 3 . 1 1 14 14 VAL HA H 14 3.790 3.790 3.814 -0.024 19845 683 1 3 . 1 1 14 14 VAL C C 14 173.429 173.429 176.989 -3.560 19845 684 1 3 . 1 1 14 14 VAL CA C 14 64.409 64.409 65.941 -1.532 19845 685 1 3 . 1 1 14 14 VAL CB C 14 32.007 32.007 31.831 0.176 19845 686 1 3 . 1 1 14 14 VAL H H 14 7.549 7.549 8.083 -0.534 19845 687 1 3 . 1 1 15 15 ASN N N 15 119.567 119.567 117.083 2.484 19845 688 1 3 . 1 1 15 15 ASN HA H 15 4.549 4.549 4.643 -0.094 19845 689 1 3 . 1 1 15 15 ASN C C 15 173.619 173.619 177.187 -3.568 19845 690 1 3 . 1 1 15 15 ASN CA C 15 54.805 54.805 56.045 -1.240 19845 691 1 3 . 1 1 15 15 ASN CB C 15 38.824 38.824 38.186 0.638 19845 692 1 3 . 1 1 15 15 ASN H H 15 8.010 8.010 8.376 -0.366 19845 693 1 3 . 1 1 16 16 SER N N 16 116.730 116.730 115.869 0.861 19845 694 1 3 . 1 1 16 16 SER HA H 16 4.177 4.177 4.441 -0.264 19845 695 1 3 . 1 1 16 16 SER CA C 16 61.705 61.705 60.730 0.975 19845 696 1 3 . 1 1 16 16 SER CB C 16 63.752 63.752 63.284 0.468 19845 697 1 3 . 1 1 16 16 SER H H 16 8.039 8.039 7.488 0.551 19845 698 1 3 . 1 1 17 17 VAL N N 17 122.062 122.062 122.769 -0.707 19845 699 1 3 . 1 1 17 17 VAL HA H 17 3.677 3.677 3.944 -0.267 19845 700 1 3 . 1 1 17 17 VAL C C 17 174.474 174.474 177.329 -2.855 19845 701 1 3 . 1 1 17 17 VAL CA C 17 66.671 66.671 65.198 1.473 19845 702 1 3 . 1 1 17 17 VAL CB C 17 31.531 31.531 31.477 0.053 19845 703 1 3 . 1 1 17 17 VAL H H 17 7.896 7.896 8.066 -0.170 19845 704 1 3 . 1 1 18 18 LEU N N 18 119.103 119.103 120.189 -1.086 19845 705 1 3 . 1 1 18 18 LEU HA H 18 3.998 3.998 4.263 -0.265 19845 706 1 3 . 1 1 18 18 LEU C C 18 175.511 175.511 178.813 -3.302 19845 707 1 3 . 1 1 18 18 LEU CA C 18 58.107 58.107 57.691 0.416 19845 708 1 3 . 1 1 18 18 LEU CB C 18 41.593 41.593 40.923 0.670 19845 709 1 3 . 1 1 18 18 LEU H H 18 7.857 7.857 7.460 0.397 19845 710 1 3 . 1 1 19 19 LEU N N 19 118.291 118.291 120.998 -2.707 19845 711 1 3 . 1 1 19 19 LEU HA H 19 4.152 4.152 4.153 -0.001 19845 712 1 3 . 1 1 19 19 LEU C C 19 175.156 175.156 178.762 -3.606 19845 713 1 3 . 1 1 19 19 LEU CA C 19 58.011 58.011 58.085 -0.074 19845 714 1 3 . 1 1 19 19 LEU CB C 19 42.027 42.027 41.910 0.117 19845 715 1 3 . 1 1 19 19 LEU H H 19 7.745 7.745 7.590 0.155 19845 716 1 3 . 1 1 20 20 PHE N N 20 118.415 118.415 119.083 -0.668 19845 717 1 3 . 1 1 20 20 PHE HA H 20 4.188 4.188 4.131 0.057 19845 718 1 3 . 1 1 20 20 PHE C C 20 174.260 174.260 177.365 -3.105 19845 719 1 3 . 1 1 20 20 PHE CA C 20 61.626 61.626 62.020 -0.394 19845 720 1 3 . 1 1 20 20 PHE CB C 20 38.643 38.643 38.928 -0.285 19845 721 1 3 . 1 1 20 20 PHE H H 20 8.002 8.002 8.474 -0.472 19845 722 1 3 . 1 1 21 21 LEU N N 21 118.571 118.571 119.810 -1.239 19845 723 1 3 . 1 1 21 21 LEU HA H 21 3.797 3.797 4.099 -0.302 19845 724 1 3 . 1 1 21 21 LEU C C 21 175.324 175.324 178.936 -3.612 19845 725 1 3 . 1 1 21 21 LEU CA C 21 58.128 58.128 58.188 -0.061 19845 726 1 3 . 1 1 21 21 LEU CB C 21 41.957 41.957 41.044 0.913 19845 727 1 3 . 1 1 21 21 LEU H H 21 8.456 8.456 7.709 0.747 19845 728 1 3 . 1 1 22 22 ALA N N 22 120.775 120.775 121.079 -0.304 19845 729 1 3 . 1 1 22 22 ALA HA H 22 3.779 3.779 4.090 -0.311 19845 730 1 3 . 1 1 22 22 ALA C C 22 175.697 175.697 180.201 -4.504 19845 731 1 3 . 1 1 22 22 ALA CA C 22 55.721 55.721 54.723 0.998 19845 732 1 3 . 1 1 22 22 ALA CB C 22 17.788 17.788 18.285 -0.497 19845 733 1 3 . 1 1 22 22 ALA H H 22 8.353 8.353 7.629 0.724 19845 734 1 3 . 1 1 23 23 PHE N N 23 117.860 117.860 119.690 -1.830 19845 735 1 3 . 1 1 23 23 PHE HA H 23 4.108 4.108 4.346 -0.238 19845 736 1 3 . 1 1 23 23 PHE C C 23 173.859 173.859 176.997 -3.138 19845 737 1 3 . 1 1 23 23 PHE CA C 23 61.271 61.271 62.014 -0.743 19845 738 1 3 . 1 1 23 23 PHE CB C 23 38.853 38.853 39.656 -0.803 19845 739 1 3 . 1 1 23 23 PHE H H 23 8.121 8.121 8.226 -0.105 19845 740 1 3 . 1 1 24 24 VAL N N 24 119.181 119.181 119.810 -0.629 19845 741 1 3 . 1 1 24 24 VAL HA H 24 3.134 3.134 3.527 -0.393 19845 742 1 3 . 1 1 24 24 VAL C C 24 174.684 174.684 177.861 -3.177 19845 743 1 3 . 1 1 24 24 VAL CA C 24 67.419 67.419 67.502 -0.083 19845 744 1 3 . 1 1 24 24 VAL CB C 24 31.106 31.106 31.170 -0.064 19845 745 1 3 . 1 1 24 24 VAL H H 24 8.124 8.124 8.426 -0.302 19845 746 1 3 . 1 1 25 25 VAL N N 25 119.215 119.215 117.461 1.754 19845 747 1 3 . 1 1 25 25 VAL HA H 25 3.324 3.324 3.572 -0.248 19845 748 1 3 . 1 1 25 25 VAL C C 25 174.244 174.244 177.743 -3.499 19845 749 1 3 . 1 1 25 25 VAL CA C 25 67.740 67.740 65.705 2.035 19845 750 1 3 . 1 1 25 25 VAL CB C 25 31.270 31.270 30.341 0.929 19845 751 1 3 . 1 1 25 25 VAL H H 25 8.250 8.250 7.444 0.806 19845 752 1 3 . 1 1 26 26 PHE N N 26 119.875 119.875 119.888 -0.013 19845 753 1 3 . 1 1 26 26 PHE HA H 26 3.900 3.900 4.122 -0.222 19845 754 1 3 . 1 1 26 26 PHE C C 26 175.371 175.371 178.014 -2.643 19845 755 1 3 . 1 1 26 26 PHE CA C 26 61.651 61.651 61.979 -0.328 19845 756 1 3 . 1 1 26 26 PHE CB C 26 38.760 38.760 38.337 0.423 19845 757 1 3 . 1 1 26 26 PHE H H 26 8.413 8.413 7.152 1.261 19845 758 1 3 . 1 1 27 27 LEU N N 27 122.548 122.548 119.248 3.300 19845 759 1 3 . 1 1 27 27 LEU HA H 27 3.533 3.533 3.872 -0.339 19845 760 1 3 . 1 1 27 27 LEU C C 27 175.256 175.256 179.016 -3.760 19845 761 1 3 . 1 1 27 27 LEU CA C 27 58.211 58.211 57.803 0.408 19845 762 1 3 . 1 1 27 27 LEU CB C 27 41.564 41.564 41.450 0.114 19845 763 1 3 . 1 1 27 27 LEU H H 27 8.453 8.453 8.182 0.271 19845 764 1 3 . 1 1 28 28 LEU N N 28 119.385 119.385 119.282 0.103 19845 765 1 3 . 1 1 28 28 LEU HA H 28 3.799 3.799 3.874 -0.075 19845 766 1 3 . 1 1 28 28 LEU C C 28 175.881 175.881 179.191 -3.310 19845 767 1 3 . 1 1 28 28 LEU CA C 28 58.492 58.492 58.085 0.407 19845 768 1 3 . 1 1 28 28 LEU CB C 28 41.760 41.760 41.382 0.378 19845 769 1 3 . 1 1 28 28 LEU H H 28 8.248 8.248 8.459 -0.211 19845 770 1 3 . 1 1 29 29 VAL N N 29 118.515 118.515 113.527 4.988 19845 771 1 3 . 1 1 29 29 VAL HA H 29 3.319 3.319 3.766 -0.447 19845 772 1 3 . 1 1 29 29 VAL C C 29 174.734 174.734 177.897 -3.163 19845 773 1 3 . 1 1 29 29 VAL CA C 29 67.192 67.192 65.900 1.292 19845 774 1 3 . 1 1 29 29 VAL CB C 29 31.175 31.175 31.520 -0.345 19845 775 1 3 . 1 1 29 29 VAL H H 29 8.446 8.446 7.382 1.064 19845 776 1 3 . 1 1 30 30 THR N N 30 117.313 117.313 117.435 -0.122 19845 777 1 3 . 1 1 30 30 THR HA H 30 3.432 3.432 3.887 -0.455 19845 778 1 3 . 1 1 30 30 THR CA C 30 68.606 68.606 66.952 1.654 19845 779 1 3 . 1 1 30 30 THR CB C 30 67.147 67.147 68.453 -1.306 19845 780 1 3 . 1 1 30 30 THR H H 30 7.923 7.923 8.189 -0.266 19845 781 1 3 . 1 1 31 31 LEU N N 31 120.629 120.629 120.999 -0.370 19845 782 1 3 . 1 1 31 31 LEU HA H 31 3.858 3.858 3.975 -0.117 19845 783 1 3 . 1 1 31 31 LEU C C 31 177.164 177.164 178.509 -1.345 19845 784 1 3 . 1 1 31 31 LEU CA C 31 58.145 58.145 57.599 0.546 19845 785 1 3 . 1 1 31 31 LEU CB C 31 41.615 41.615 41.701 -0.086 19845 786 1 3 . 1 1 31 31 LEU H H 31 8.382 8.382 8.302 0.080 19845 787 1 3 . 1 1 32 32 ALA N N 32 125.216 125.216 121.733 3.483 19845 788 1 3 . 1 1 32 32 ALA HA H 32 3.836 3.836 3.915 -0.079 19845 789 1 3 . 1 1 32 32 ALA C C 32 175.968 175.968 180.519 -4.551 19845 790 1 3 . 1 1 32 32 ALA CA C 32 55.918 55.918 54.838 1.080 19845 791 1 3 . 1 1 32 32 ALA CB C 32 17.802 17.802 18.142 -0.340 19845 792 1 3 . 1 1 32 32 ALA H H 32 8.517 8.517 7.676 0.841 19845 793 1 3 . 1 1 33 33 ILE N N 33 118.722 118.722 119.089 -0.367 19845 794 1 3 . 1 1 33 33 ILE HA H 33 3.481 3.481 3.593 -0.112 19845 795 1 3 . 1 1 33 33 ILE C C 33 175.004 175.004 178.147 -3.143 19845 796 1 3 . 1 1 33 33 ILE CA C 33 65.554 65.554 64.980 0.574 19845 797 1 3 . 1 1 33 33 ILE CB C 33 37.657 37.657 37.218 0.439 19845 798 1 3 . 1 1 33 33 ILE H H 33 8.288 8.288 7.622 0.666 19845 799 1 3 . 1 1 34 34 LEU N N 34 118.987 118.987 120.135 -1.148 19845 800 1 3 . 1 1 34 34 LEU HA H 34 3.893 3.893 3.999 -0.106 19845 801 1 3 . 1 1 34 34 LEU C C 34 176.439 176.439 178.921 -2.482 19845 802 1 3 . 1 1 34 34 LEU CA C 34 58.436 58.436 58.075 0.361 19845 803 1 3 . 1 1 34 34 LEU CB C 34 42.152 42.152 40.389 1.763 19845 804 1 3 . 1 1 34 34 LEU H H 34 8.493 8.493 8.155 0.338 19845 805 1 3 . 1 1 35 35 THR N N 35 116.630 116.630 114.853 1.777 19845 806 1 3 . 1 1 35 35 THR HA H 35 3.652 3.652 3.962 -0.310 19845 807 1 3 . 1 1 35 35 THR C C 35 173.366 173.366 176.144 -2.778 19845 808 1 3 . 1 1 35 35 THR CA C 35 68.153 68.153 66.100 2.053 19845 809 1 3 . 1 1 35 35 THR CB C 35 68.162 68.162 68.055 0.107 19845 810 1 3 . 1 1 35 35 THR H H 35 8.215 8.215 8.182 0.033 19845 811 1 3 . 1 1 36 36 ALA N N 36 124.667 124.667 123.194 1.473 19845 812 1 3 . 1 1 36 36 ALA HA H 36 3.864 3.864 3.946 -0.082 19845 813 1 3 . 1 1 36 36 ALA C C 36 176.510 176.510 179.299 -2.789 19845 814 1 3 . 1 1 36 36 ALA CA C 36 55.758 55.758 55.033 0.725 19845 815 1 3 . 1 1 36 36 ALA CB C 36 18.054 18.054 18.179 -0.125 19845 816 1 3 . 1 1 36 36 ALA H H 36 8.358 8.358 7.977 0.381 19845 817 1 3 . 1 1 37 37 LEU N N 37 116.565 116.565 117.710 -1.145 19845 818 1 3 . 1 1 37 37 LEU HA H 37 3.973 3.973 4.104 -0.131 19845 819 1 3 . 1 1 37 37 LEU C C 37 176.538 176.538 179.094 -2.556 19845 820 1 3 . 1 1 37 37 LEU CA C 37 57.853 57.853 57.121 0.732 19845 821 1 3 . 1 1 37 37 LEU CB C 37 42.018 42.018 40.527 1.491 19845 822 1 3 . 1 1 37 37 LEU H H 37 8.360 8.360 7.567 0.793 19845 823 1 3 . 1 1 38 38 ARG N N 38 119.392 119.392 119.933 -0.541 19845 824 1 3 . 1 1 38 38 ARG HA H 38 4.104 4.104 4.064 0.040 19845 825 1 3 . 1 1 38 38 ARG C C 38 176.208 176.208 179.379 -3.171 19845 826 1 3 . 1 1 38 38 ARG CA C 38 58.100 58.100 59.397 -1.297 19845 827 1 3 . 1 1 38 38 ARG CB C 38 29.502 29.502 29.929 -0.427 19845 828 1 3 . 1 1 38 38 ARG H H 38 8.082 8.082 7.462 0.620 19845 829 1 3 . 1 1 39 39 LEU N N 39 120.438 120.438 117.694 2.744 19845 830 1 3 . 1 1 39 39 LEU HA H 39 4.243 4.243 3.922 0.321 19845 831 1 3 . 1 1 39 39 LEU C C 39 175.702 175.702 178.574 -2.872 19845 832 1 3 . 1 1 39 39 LEU CA C 39 56.979 56.979 57.461 -0.482 19845 833 1 3 . 1 1 39 39 LEU CB C 39 41.893 41.893 41.187 0.706 19845 834 1 3 . 1 1 39 39 LEU H H 39 8.446 8.446 7.772 0.674 19845 835 1 3 . 1 1 40 40 ALA N N 40 122.512 122.512 120.972 1.540 19845 836 1 3 . 1 1 40 40 ALA HA H 40 3.975 3.975 4.107 -0.132 19845 837 1 3 . 1 1 40 40 ALA C C 40 175.838 175.838 179.159 -3.321 19845 838 1 3 . 1 1 40 40 ALA CA C 40 54.710 54.710 54.520 0.190 19845 839 1 3 . 1 1 40 40 ALA CB C 40 18.319 18.319 17.954 0.364 19845 840 1 3 . 1 1 40 40 ALA H H 40 8.321 8.321 7.560 0.761 19845 841 1 3 . 1 1 41 41 ALA N N 41 119.754 119.754 121.729 -1.975 19845 842 1 3 . 1 1 41 41 ALA HA H 41 4.024 4.024 4.168 -0.144 19845 843 1 3 . 1 1 41 41 ALA C C 41 176.517 176.517 179.611 -3.094 19845 844 1 3 . 1 1 41 41 ALA CA C 41 54.486 54.486 54.700 -0.214 19845 845 1 3 . 1 1 41 41 ALA CB C 41 18.468 18.468 18.639 -0.171 19845 846 1 3 . 1 1 41 41 ALA H H 41 8.038 8.038 8.119 -0.081 19845 847 1 3 . 1 1 42 42 TYR N N 42 118.272 118.272 118.381 -0.109 19845 848 1 3 . 1 1 42 42 TYR HA H 42 4.326 4.326 4.268 0.058 19845 849 1 3 . 1 1 42 42 TYR C C 42 174.633 174.633 177.636 -3.003 19845 850 1 3 . 1 1 42 42 TYR CA C 42 60.098 60.098 59.906 0.192 19845 851 1 3 . 1 1 42 42 TYR CB C 42 38.936 38.936 37.481 1.455 19845 852 1 3 . 1 1 42 42 TYR H H 42 7.814 7.814 7.992 -0.178 19845 853 1 3 . 1 1 43 43 ALA N N 43 122.908 122.908 121.304 1.604 19845 854 1 3 . 1 1 43 43 ALA HA H 43 4.111 4.111 4.146 -0.035 19845 855 1 3 . 1 1 43 43 ALA C C 43 175.241 175.241 177.874 -2.633 19845 856 1 3 . 1 1 43 43 ALA CA C 43 53.842 53.842 53.935 -0.094 19845 857 1 3 . 1 1 43 43 ALA CB C 43 18.427 18.427 17.856 0.571 19845 858 1 3 . 1 1 43 43 ALA H H 43 8.172 8.172 7.476 0.696 19845 859 1 3 . 1 1 44 44 ALA N N 44 119.906 119.906 119.288 0.618 19845 860 1 3 . 1 1 44 44 ALA HA H 44 4.051 4.051 4.243 -0.192 19845 861 1 3 . 1 1 44 44 ALA C C 44 175.092 175.092 178.281 -3.189 19845 862 1 3 . 1 1 44 44 ALA CA C 44 53.611 53.611 53.550 0.061 19845 863 1 3 . 1 1 44 44 ALA CB C 44 18.689 18.689 19.081 -0.392 19845 864 1 3 . 1 1 44 44 ALA H H 44 7.953 7.953 7.705 0.248 19845 865 1 3 . 1 1 45 45 ASN N N 45 114.984 114.984 117.438 -2.454 19845 866 1 3 . 1 1 45 45 ASN HA H 45 4.541 4.541 4.782 -0.241 19845 867 1 3 . 1 1 45 45 ASN CA C 45 54.506 54.506 54.600 -0.094 19845 868 1 3 . 1 1 45 45 ASN CB C 45 38.602 38.602 39.960 -1.358 19845 869 1 3 . 1 1 45 45 ASN H H 45 7.847 7.847 8.202 -0.355 19845 870 1 3 . 1 1 46 46 ILE N N 46 119.155 119.155 117.349 1.806 19845 871 1 3 . 1 1 46 46 ILE HA H 46 4.033 4.033 4.360 -0.327 19845 872 1 3 . 1 1 46 46 ILE C C 46 173.344 173.344 175.614 -2.270 19845 873 1 3 . 1 1 46 46 ILE CA C 46 62.357 62.357 62.005 0.352 19845 874 1 3 . 1 1 46 46 ILE CB C 46 38.657 38.657 38.679 -0.022 19845 875 1 3 . 1 1 46 46 ILE H H 46 7.790 7.790 7.650 0.140 19845 876 1 3 . 1 1 47 47 VAL N N 47 117.526 117.526 115.201 2.325 19845 877 1 3 . 1 1 47 47 VAL HA H 47 4.133 4.133 4.495 -0.362 19845 878 1 3 . 1 1 47 47 VAL C C 47 172.672 172.672 174.667 -1.995 19845 879 1 3 . 1 1 47 47 VAL CA C 47 62.149 62.149 60.083 2.066 19845 880 1 3 . 1 1 47 47 VAL CB C 47 32.807 32.807 34.175 -1.368 19845 881 1 3 . 1 1 47 47 VAL H H 47 7.582 7.582 7.497 0.085 19845 882 1 3 . 1 1 48 48 ASN N N 48 120.091 120.091 121.198 -1.107 19845 883 1 3 . 1 1 48 48 ASN HA H 48 4.658 4.658 4.903 -0.245 19845 884 1 3 . 1 1 48 48 ASN CA C 48 53.478 53.478 53.632 -0.154 19845 885 1 3 . 1 1 48 48 ASN CB C 48 38.573 38.573 36.559 2.014 19845 886 1 3 . 1 1 48 48 ASN H H 48 8.053 8.053 8.652 -0.599 19845 887 1 3 . 1 1 49 49 VAL N N 49 118.854 118.854 118.876 -0.022 19845 888 1 3 . 1 1 49 49 VAL HA H 49 4.133 4.133 4.261 -0.128 19845 889 1 3 . 1 1 49 49 VAL C C 49 172.595 172.595 173.770 -1.175 19845 890 1 3 . 1 1 49 49 VAL CA C 49 62.049 62.049 60.263 1.786 19845 891 1 3 . 1 1 49 49 VAL CB C 49 33.271 33.271 33.337 -0.066 19845 892 1 3 . 1 1 49 49 VAL H H 49 7.685 7.685 7.800 -0.115 19845 893 1 3 . 1 1 50 50 SER N N 50 118.689 118.689 121.126 -2.437 19845 894 1 3 . 1 1 50 50 SER HA H 50 4.466 4.466 4.240 0.226 19845 895 1 3 . 1 1 50 50 SER C C 50 171.430 171.430 172.469 -1.039 19845 896 1 3 . 1 1 50 50 SER CA C 50 58.128 58.128 57.318 0.810 19845 897 1 3 . 1 1 50 50 SER CB C 50 63.916 63.916 64.154 -0.238 19845 898 1 3 . 1 1 50 50 SER H H 50 8.075 8.075 8.170 -0.095 19845 899 1 3 . 1 1 51 51 LEU N N 51 123.536 123.536 122.597 0.939 19845 900 1 3 . 1 1 51 51 LEU HA H 51 4.305 4.305 4.765 -0.460 19845 901 1 3 . 1 1 51 51 LEU C C 51 174.110 174.110 174.966 -0.856 19845 902 1 3 . 1 1 51 51 LEU CA C 51 55.145 55.145 54.514 0.631 19845 903 1 3 . 1 1 51 51 LEU CB C 51 42.674 42.674 44.668 -1.994 19845 904 1 3 . 1 1 51 51 LEU H H 51 7.991 7.991 7.884 0.107 19845 905 1 3 . 1 1 52 52 VAL N N 52 119.649 119.649 119.032 0.617 19845 906 1 3 . 1 1 52 52 VAL HA H 52 3.992 3.992 4.317 -0.325 19845 907 1 3 . 1 1 52 52 VAL C C 52 172.476 172.476 176.459 -3.983 19845 908 1 3 . 1 1 52 52 VAL CA C 52 62.772 62.772 62.709 0.063 19845 909 1 3 . 1 1 52 52 VAL CB C 52 33.066 33.066 32.830 0.236 19845 910 1 3 . 1 1 52 52 VAL H H 52 7.536 7.536 8.263 -0.727 19845 911 1 3 . 1 1 53 53 LYS N N 53 122.004 122.004 121.287 0.717 19845 912 1 3 . 1 1 53 53 LYS HA H 53 4.354 4.354 4.236 0.118 19845 913 1 3 . 1 1 53 53 LYS CA C 53 56.567 56.567 59.522 -2.955 19845 914 1 3 . 1 1 53 53 LYS CB C 53 31.689 31.689 30.187 1.502 19845 915 1 3 . 1 1 53 53 LYS H H 53 8.038 8.038 8.250 -0.212 19845 916 1 3 . 1 1 54 54 PRO HA H 54 4.353 4.353 4.476 -0.123 19845 917 1 3 . 1 1 54 54 PRO CA C 54 65.103 65.103 64.931 0.172 19845 918 1 3 . 1 1 54 54 PRO CB C 54 32.193 32.193 30.927 1.266 19845 919 1 3 . 1 1 55 55 THR N N 55 111.485 111.485 109.719 1.766 19845 920 1 3 . 1 1 55 55 THR HA H 55 3.910 3.910 4.719 -0.809 19845 921 1 3 . 1 1 55 55 THR C C 55 172.822 172.822 176.462 -3.640 19845 922 1 3 . 1 1 55 55 THR CA C 55 65.030 65.030 63.241 1.789 19845 923 1 3 . 1 1 55 55 THR CB C 55 68.882 68.882 68.966 -0.084 19845 924 1 3 . 1 1 55 55 THR H H 55 7.722 7.722 7.328 0.394 19845 925 1 3 . 1 1 56 56 VAL N N 56 121.165 121.165 120.656 0.509 19845 926 1 3 . 1 1 56 56 VAL HA H 56 3.772 3.772 3.656 0.116 19845 927 1 3 . 1 1 56 56 VAL C C 56 174.904 174.904 176.904 -2.000 19845 928 1 3 . 1 1 56 56 VAL CA C 56 64.971 64.971 65.907 -0.936 19845 929 1 3 . 1 1 56 56 VAL CB C 56 31.989 31.989 31.206 0.783 19845 930 1 3 . 1 1 56 56 VAL H H 56 7.597 7.597 7.646 -0.049 19845 931 1 3 . 1 1 57 57 TYR N N 57 122.177 122.177 117.752 4.425 19845 932 1 3 . 1 1 57 57 TYR HA H 57 4.227 4.227 4.232 -0.005 19845 933 1 3 . 1 1 57 57 TYR C C 57 174.969 174.969 177.227 -2.258 19845 934 1 3 . 1 1 57 57 TYR CA C 57 60.755 60.755 59.415 1.340 19845 935 1 3 . 1 1 57 57 TYR CB C 57 38.453 38.453 37.055 1.398 19845 936 1 3 . 1 1 57 57 TYR H H 57 7.964 7.964 7.780 0.184 19845 937 1 3 . 1 1 58 58 VAL N N 58 119.069 119.069 118.841 0.228 19845 938 1 3 . 1 1 58 58 VAL HA H 58 3.529 3.529 3.335 0.194 19845 939 1 3 . 1 1 58 58 VAL C C 58 174.250 174.250 176.790 -2.540 19845 940 1 3 . 1 1 58 58 VAL CA C 58 66.223 66.223 64.214 2.009 19845 941 1 3 . 1 1 58 58 VAL CB C 58 31.803 31.803 31.505 0.298 19845 942 1 3 . 1 1 58 58 VAL H H 58 8.018 8.018 7.265 0.753 19845 943 1 3 . 1 1 59 59 TYR N N 59 120.360 120.360 120.702 -0.342 19845 944 1 3 . 1 1 59 59 TYR HA H 59 4.115 4.115 3.987 0.128 19845 945 1 3 . 1 1 59 59 TYR C C 59 173.899 173.899 177.345 -3.446 19845 946 1 3 . 1 1 59 59 TYR CA C 59 60.929 60.929 61.032 -0.103 19845 947 1 3 . 1 1 59 59 TYR CB C 59 38.602 38.602 37.923 0.679 19845 948 1 3 . 1 1 59 59 TYR H H 59 8.142 8.142 7.901 0.241 19845 949 1 3 . 1 1 60 60 SER N N 60 113.480 113.480 113.246 0.234 19845 950 1 3 . 1 1 60 60 SER HA H 60 3.979 3.979 3.979 -0.000 19845 951 1 3 . 1 1 60 60 SER C C 60 172.887 172.887 176.795 -3.908 19845 952 1 3 . 1 1 60 60 SER CA C 60 60.987 60.987 61.251 -0.264 19845 953 1 3 . 1 1 60 60 SER CB C 60 63.267 63.267 63.168 0.099 19845 954 1 3 . 1 1 60 60 SER H H 60 8.057 8.057 7.698 0.359 19845 955 1 3 . 1 1 61 61 ARG N N 61 120.962 120.962 122.968 -2.006 19845 956 1 3 . 1 1 61 61 ARG HA H 61 4.103 4.103 4.147 -0.044 19845 957 1 3 . 1 1 61 61 ARG C C 61 175.399 175.399 178.663 -3.264 19845 958 1 3 . 1 1 61 61 ARG CA C 61 57.427 57.427 58.892 -1.465 19845 959 1 3 . 1 1 61 61 ARG CB C 61 30.008 30.008 29.786 0.222 19845 960 1 3 . 1 1 61 61 ARG H H 61 7.606 7.606 7.305 0.301 19845 961 1 3 . 1 1 62 62 VAL N N 62 117.852 117.852 116.780 1.072 19845 962 1 3 . 1 1 62 62 VAL HA H 62 3.805 3.805 3.745 0.060 19845 963 1 3 . 1 1 62 62 VAL C C 62 174.155 174.155 177.361 -3.206 19845 964 1 3 . 1 1 62 62 VAL CA C 62 64.458 64.458 65.493 -1.035 19845 965 1 3 . 1 1 62 62 VAL CB C 62 31.969 31.969 30.787 1.183 19845 966 1 3 . 1 1 62 62 VAL H H 62 7.848 7.848 7.973 -0.125 19845 967 1 3 . 1 1 63 63 LYS N N 63 119.254 119.254 120.495 -1.241 19845 968 1 3 . 1 1 63 63 LYS HA H 63 4.051 4.051 3.979 0.072 19845 969 1 3 . 1 1 63 63 LYS C C 63 173.615 173.615 178.343 -4.728 19845 970 1 3 . 1 1 63 63 LYS CA C 63 56.727 56.727 58.345 -1.618 19845 971 1 3 . 1 1 63 63 LYS CB C 63 32.105 32.105 32.638 -0.533 19845 972 1 3 . 1 1 63 63 LYS H H 63 7.759 7.759 7.438 0.321 19845 973 1 3 . 1 1 64 64 ASN N N 64 117.696 117.696 116.194 1.502 19845 974 1 3 . 1 1 64 64 ASN HA H 64 4.642 4.642 4.456 0.186 19845 975 1 3 . 1 1 64 64 ASN C C 64 171.750 171.750 175.623 -3.873 19845 976 1 3 . 1 1 64 64 ASN CA C 64 53.313 53.313 54.758 -1.445 19845 977 1 3 . 1 1 64 64 ASN CB C 64 39.260 39.260 38.871 0.389 19845 978 1 3 . 1 1 64 64 ASN H H 64 7.615 7.615 8.113 -0.498 19845 979 1 4 . 1 1 9 9 THR N N 9 113.692 113.692 117.008 -3.316 19845 980 1 4 . 1 1 9 9 THR HA H 9 4.213 4.213 4.497 -0.284 19845 981 1 4 . 1 1 9 9 THR C C 9 172.757 172.757 174.836 -2.079 19845 982 1 4 . 1 1 9 9 THR CA C 9 62.810 62.810 62.340 0.470 19845 983 1 4 . 1 1 9 9 THR CB C 9 69.878 69.878 68.984 0.894 19845 984 1 4 . 1 1 9 9 THR H H 9 7.930 7.930 8.623 -0.693 19845 985 1 4 . 1 1 10 10 GLY N N 10 110.842 110.842 111.841 -0.999 19845 986 1 4 . 1 1 10 10 GLY C C 10 171.923 171.923 174.102 -2.179 19845 987 1 4 . 1 1 10 10 GLY CA C 10 46.099 46.099 45.159 0.940 19845 988 1 4 . 1 1 10 10 GLY H H 10 8.266 8.266 8.754 -0.488 19845 989 1 4 . 1 1 11 11 THR N N 11 113.754 113.754 120.082 -6.328 19845 990 1 4 . 1 1 11 11 THR HA H 11 4.220 4.220 4.592 -0.372 19845 991 1 4 . 1 1 11 11 THR C C 11 171.906 171.906 175.002 -3.096 19845 992 1 4 . 1 1 11 11 THR CA C 11 62.721 62.721 62.413 0.308 19845 993 1 4 . 1 1 11 11 THR CB C 11 69.549 69.549 68.825 0.724 19845 994 1 4 . 1 1 11 11 THR H H 11 7.753 7.753 8.172 -0.419 19845 995 1 4 . 1 1 12 12 LEU N N 12 123.669 123.669 124.717 -1.048 19845 996 1 4 . 1 1 12 12 LEU HA H 12 4.240 4.240 4.851 -0.611 19845 997 1 4 . 1 1 12 12 LEU C C 12 175.221 175.221 177.397 -2.176 19845 998 1 4 . 1 1 12 12 LEU CA C 12 56.799 56.799 55.180 1.619 19845 999 1 4 . 1 1 12 12 LEU CB C 12 42.536 42.536 41.831 0.705 19845 1000 1 4 . 1 1 12 12 LEU H H 12 7.980 7.980 8.415 -0.435 19845 1001 1 4 . 1 1 13 13 ILE N N 13 120.086 120.086 120.592 -0.506 19845 1002 1 4 . 1 1 13 13 ILE HA H 13 3.913 3.913 4.171 -0.258 19845 1003 1 4 . 1 1 13 13 ILE C C 13 173.425 173.425 176.941 -3.516 19845 1004 1 4 . 1 1 13 13 ILE CA C 13 62.889 62.889 63.053 -0.164 19845 1005 1 4 . 1 1 13 13 ILE CB C 13 38.249 38.249 37.735 0.514 19845 1006 1 4 . 1 1 13 13 ILE H H 13 7.861 7.861 7.811 0.050 19845 1007 1 4 . 1 1 14 14 VAL N N 14 119.785 119.785 120.558 -0.773 19845 1008 1 4 . 1 1 14 14 VAL HA H 14 3.790 3.790 3.863 -0.073 19845 1009 1 4 . 1 1 14 14 VAL C C 14 173.429 173.429 177.869 -4.440 19845 1010 1 4 . 1 1 14 14 VAL CA C 14 64.409 64.409 65.899 -1.490 19845 1011 1 4 . 1 1 14 14 VAL CB C 14 32.007 32.007 31.147 0.860 19845 1012 1 4 . 1 1 14 14 VAL H H 14 7.549 7.549 8.007 -0.458 19845 1013 1 4 . 1 1 15 15 ASN N N 15 119.567 119.567 115.550 4.017 19845 1014 1 4 . 1 1 15 15 ASN HA H 15 4.549 4.549 4.614 -0.065 19845 1015 1 4 . 1 1 15 15 ASN C C 15 173.619 173.619 177.088 -3.469 19845 1016 1 4 . 1 1 15 15 ASN CA C 15 54.805 54.805 55.238 -0.433 19845 1017 1 4 . 1 1 15 15 ASN CB C 15 38.824 38.824 38.384 0.440 19845 1018 1 4 . 1 1 15 15 ASN H H 15 8.010 8.010 8.407 -0.397 19845 1019 1 4 . 1 1 16 16 SER N N 16 116.730 116.730 116.652 0.078 19845 1020 1 4 . 1 1 16 16 SER HA H 16 4.177 4.177 4.398 -0.221 19845 1021 1 4 . 1 1 16 16 SER CA C 16 61.705 61.705 60.941 0.764 19845 1022 1 4 . 1 1 16 16 SER CB C 16 63.752 63.752 63.382 0.370 19845 1023 1 4 . 1 1 16 16 SER H H 16 8.039 8.039 7.468 0.571 19845 1024 1 4 . 1 1 17 17 VAL N N 17 122.062 122.062 122.581 -0.519 19845 1025 1 4 . 1 1 17 17 VAL HA H 17 3.677 3.677 3.884 -0.207 19845 1026 1 4 . 1 1 17 17 VAL C C 17 174.474 174.474 177.159 -2.685 19845 1027 1 4 . 1 1 17 17 VAL CA C 17 66.671 66.671 65.332 1.339 19845 1028 1 4 . 1 1 17 17 VAL CB C 17 31.531 31.531 31.737 -0.206 19845 1029 1 4 . 1 1 17 17 VAL H H 17 7.896 7.896 7.811 0.085 19845 1030 1 4 . 1 1 18 18 LEU N N 18 119.103 119.103 120.166 -1.063 19845 1031 1 4 . 1 1 18 18 LEU HA H 18 3.998 3.998 4.183 -0.185 19845 1032 1 4 . 1 1 18 18 LEU C C 18 175.511 175.511 178.115 -2.604 19845 1033 1 4 . 1 1 18 18 LEU CA C 18 58.107 58.107 57.627 0.480 19845 1034 1 4 . 1 1 18 18 LEU CB C 18 41.593 41.593 42.138 -0.545 19845 1035 1 4 . 1 1 18 18 LEU H H 18 7.857 7.857 7.422 0.435 19845 1036 1 4 . 1 1 19 19 LEU N N 19 118.291 118.291 120.119 -1.828 19845 1037 1 4 . 1 1 19 19 LEU HA H 19 4.152 4.152 4.122 0.030 19845 1038 1 4 . 1 1 19 19 LEU C C 19 175.156 175.156 178.833 -3.677 19845 1039 1 4 . 1 1 19 19 LEU CA C 19 58.011 58.011 57.347 0.664 19845 1040 1 4 . 1 1 19 19 LEU CB C 19 42.027 42.027 41.040 0.987 19845 1041 1 4 . 1 1 19 19 LEU H H 19 7.745 7.745 7.526 0.219 19845 1042 1 4 . 1 1 20 20 PHE N N 20 118.415 118.415 119.714 -1.299 19845 1043 1 4 . 1 1 20 20 PHE HA H 20 4.188 4.188 4.192 -0.004 19845 1044 1 4 . 1 1 20 20 PHE C C 20 174.260 174.260 177.628 -3.368 19845 1045 1 4 . 1 1 20 20 PHE CA C 20 61.626 61.626 62.287 -0.661 19845 1046 1 4 . 1 1 20 20 PHE CB C 20 38.643 38.643 38.834 -0.191 19845 1047 1 4 . 1 1 20 20 PHE H H 20 8.002 8.002 8.410 -0.408 19845 1048 1 4 . 1 1 21 21 LEU N N 21 118.571 118.571 120.163 -1.592 19845 1049 1 4 . 1 1 21 21 LEU HA H 21 3.797 3.797 4.101 -0.304 19845 1050 1 4 . 1 1 21 21 LEU C C 21 175.324 175.324 178.407 -3.083 19845 1051 1 4 . 1 1 21 21 LEU CA C 21 58.128 58.128 58.995 -0.867 19845 1052 1 4 . 1 1 21 21 LEU CB C 21 41.957 41.957 41.900 0.057 19845 1053 1 4 . 1 1 21 21 LEU H H 21 8.456 8.456 7.710 0.746 19845 1054 1 4 . 1 1 22 22 ALA N N 22 120.775 120.775 121.051 -0.276 19845 1055 1 4 . 1 1 22 22 ALA HA H 22 3.779 3.779 4.208 -0.429 19845 1056 1 4 . 1 1 22 22 ALA C C 22 175.697 175.697 180.067 -4.370 19845 1057 1 4 . 1 1 22 22 ALA CA C 22 55.721 55.721 54.779 0.942 19845 1058 1 4 . 1 1 22 22 ALA CB C 22 17.788 17.788 18.233 -0.445 19845 1059 1 4 . 1 1 22 22 ALA H H 22 8.353 8.353 7.580 0.773 19845 1060 1 4 . 1 1 23 23 PHE N N 23 117.860 117.860 120.037 -2.177 19845 1061 1 4 . 1 1 23 23 PHE HA H 23 4.108 4.108 4.283 -0.175 19845 1062 1 4 . 1 1 23 23 PHE C C 23 173.859 173.859 176.962 -3.103 19845 1063 1 4 . 1 1 23 23 PHE CA C 23 61.271 61.271 59.857 1.414 19845 1064 1 4 . 1 1 23 23 PHE CB C 23 38.853 38.853 39.498 -0.645 19845 1065 1 4 . 1 1 23 23 PHE H H 23 8.121 8.121 8.235 -0.114 19845 1066 1 4 . 1 1 24 24 VAL N N 24 119.181 119.181 119.641 -0.460 19845 1067 1 4 . 1 1 24 24 VAL HA H 24 3.134 3.134 3.384 -0.250 19845 1068 1 4 . 1 1 24 24 VAL C C 24 174.684 174.684 178.001 -3.317 19845 1069 1 4 . 1 1 24 24 VAL CA C 24 67.419 67.419 67.275 0.144 19845 1070 1 4 . 1 1 24 24 VAL CB C 24 31.106 31.106 31.169 -0.063 19845 1071 1 4 . 1 1 24 24 VAL H H 24 8.124 8.124 8.243 -0.119 19845 1072 1 4 . 1 1 25 25 VAL N N 25 119.215 119.215 117.396 1.819 19845 1073 1 4 . 1 1 25 25 VAL HA H 25 3.324 3.324 3.629 -0.305 19845 1074 1 4 . 1 1 25 25 VAL C C 25 174.244 174.244 177.831 -3.587 19845 1075 1 4 . 1 1 25 25 VAL CA C 25 67.740 67.740 65.161 2.579 19845 1076 1 4 . 1 1 25 25 VAL CB C 25 31.270 31.270 30.294 0.976 19845 1077 1 4 . 1 1 25 25 VAL H H 25 8.250 8.250 7.645 0.605 19845 1078 1 4 . 1 1 26 26 PHE N N 26 119.875 119.875 119.486 0.389 19845 1079 1 4 . 1 1 26 26 PHE HA H 26 3.900 3.900 4.145 -0.245 19845 1080 1 4 . 1 1 26 26 PHE C C 26 175.371 175.371 177.888 -2.517 19845 1081 1 4 . 1 1 26 26 PHE CA C 26 61.651 61.651 62.667 -1.016 19845 1082 1 4 . 1 1 26 26 PHE CB C 26 38.760 38.760 38.988 -0.228 19845 1083 1 4 . 1 1 26 26 PHE H H 26 8.413 8.413 7.327 1.086 19845 1084 1 4 . 1 1 27 27 LEU N N 27 122.548 122.548 119.625 2.923 19845 1085 1 4 . 1 1 27 27 LEU HA H 27 3.533 3.533 3.721 -0.188 19845 1086 1 4 . 1 1 27 27 LEU C C 27 175.256 175.256 178.895 -3.639 19845 1087 1 4 . 1 1 27 27 LEU CA C 27 58.211 58.211 57.807 0.404 19845 1088 1 4 . 1 1 27 27 LEU CB C 27 41.564 41.564 41.225 0.339 19845 1089 1 4 . 1 1 27 27 LEU H H 27 8.453 8.453 8.365 0.088 19845 1090 1 4 . 1 1 28 28 LEU N N 28 119.385 119.385 119.492 -0.107 19845 1091 1 4 . 1 1 28 28 LEU HA H 28 3.799 3.799 3.814 -0.015 19845 1092 1 4 . 1 1 28 28 LEU C C 28 175.881 175.881 179.038 -3.157 19845 1093 1 4 . 1 1 28 28 LEU CA C 28 58.492 58.492 58.184 0.307 19845 1094 1 4 . 1 1 28 28 LEU CB C 28 41.760 41.760 41.352 0.408 19845 1095 1 4 . 1 1 28 28 LEU H H 28 8.248 8.248 8.387 -0.139 19845 1096 1 4 . 1 1 29 29 VAL N N 29 118.515 118.515 117.543 0.972 19845 1097 1 4 . 1 1 29 29 VAL HA H 29 3.319 3.319 3.595 -0.276 19845 1098 1 4 . 1 1 29 29 VAL C C 29 174.734 174.734 177.650 -2.916 19845 1099 1 4 . 1 1 29 29 VAL CA C 29 67.192 67.192 66.079 1.113 19845 1100 1 4 . 1 1 29 29 VAL CB C 29 31.175 31.175 31.683 -0.508 19845 1101 1 4 . 1 1 29 29 VAL H H 29 8.446 8.446 7.222 1.224 19845 1102 1 4 . 1 1 30 30 THR N N 30 117.313 117.313 116.457 0.856 19845 1103 1 4 . 1 1 30 30 THR HA H 30 3.432 3.432 3.886 -0.454 19845 1104 1 4 . 1 1 30 30 THR CA C 30 68.606 68.606 66.712 1.894 19845 1105 1 4 . 1 1 30 30 THR CB C 30 67.147 67.147 68.364 -1.217 19845 1106 1 4 . 1 1 30 30 THR H H 30 7.923 7.923 8.235 -0.312 19845 1107 1 4 . 1 1 31 31 LEU N N 31 120.629 120.629 121.238 -0.609 19845 1108 1 4 . 1 1 31 31 LEU HA H 31 3.858 3.858 4.004 -0.146 19845 1109 1 4 . 1 1 31 31 LEU C C 31 177.164 177.164 178.439 -1.275 19845 1110 1 4 . 1 1 31 31 LEU CA C 31 58.145 58.145 57.694 0.452 19845 1111 1 4 . 1 1 31 31 LEU CB C 31 41.615 41.615 40.960 0.655 19845 1112 1 4 . 1 1 31 31 LEU H H 31 8.382 8.382 7.974 0.408 19845 1113 1 4 . 1 1 32 32 ALA N N 32 125.216 125.216 121.895 3.321 19845 1114 1 4 . 1 1 32 32 ALA HA H 32 3.836 3.836 3.902 -0.066 19845 1115 1 4 . 1 1 32 32 ALA C C 32 175.968 175.968 180.708 -4.740 19845 1116 1 4 . 1 1 32 32 ALA CA C 32 55.918 55.918 54.841 1.077 19845 1117 1 4 . 1 1 32 32 ALA CB C 32 17.802 17.802 18.157 -0.355 19845 1118 1 4 . 1 1 32 32 ALA H H 32 8.517 8.517 7.538 0.979 19845 1119 1 4 . 1 1 33 33 ILE N N 33 118.722 118.722 118.974 -0.252 19845 1120 1 4 . 1 1 33 33 ILE HA H 33 3.481 3.481 3.565 -0.084 19845 1121 1 4 . 1 1 33 33 ILE C C 33 175.004 175.004 178.059 -3.055 19845 1122 1 4 . 1 1 33 33 ILE CA C 33 65.554 65.554 64.866 0.688 19845 1123 1 4 . 1 1 33 33 ILE CB C 33 37.657 37.657 37.322 0.335 19845 1124 1 4 . 1 1 33 33 ILE H H 33 8.288 8.288 7.645 0.643 19845 1125 1 4 . 1 1 34 34 LEU N N 34 118.987 118.987 120.038 -1.051 19845 1126 1 4 . 1 1 34 34 LEU HA H 34 3.893 3.893 3.991 -0.098 19845 1127 1 4 . 1 1 34 34 LEU C C 34 176.439 176.439 178.301 -1.862 19845 1128 1 4 . 1 1 34 34 LEU CA C 34 58.436 58.436 58.017 0.420 19845 1129 1 4 . 1 1 34 34 LEU CB C 34 42.152 42.152 41.084 1.068 19845 1130 1 4 . 1 1 34 34 LEU H H 34 8.493 8.493 8.059 0.434 19845 1131 1 4 . 1 1 35 35 THR N N 35 116.630 116.630 115.262 1.368 19845 1132 1 4 . 1 1 35 35 THR HA H 35 3.652 3.652 3.900 -0.248 19845 1133 1 4 . 1 1 35 35 THR C C 35 173.366 173.366 176.208 -2.842 19845 1134 1 4 . 1 1 35 35 THR CA C 35 68.153 68.153 66.261 1.892 19845 1135 1 4 . 1 1 35 35 THR CB C 35 68.162 68.162 67.908 0.254 19845 1136 1 4 . 1 1 35 35 THR H H 35 8.215 8.215 8.161 0.054 19845 1137 1 4 . 1 1 36 36 ALA N N 36 124.667 124.667 123.225 1.442 19845 1138 1 4 . 1 1 36 36 ALA HA H 36 3.864 3.864 3.932 -0.068 19845 1139 1 4 . 1 1 36 36 ALA C C 36 176.510 176.510 179.209 -2.699 19845 1140 1 4 . 1 1 36 36 ALA CA C 36 55.758 55.758 55.059 0.699 19845 1141 1 4 . 1 1 36 36 ALA CB C 36 18.054 18.054 18.171 -0.117 19845 1142 1 4 . 1 1 36 36 ALA H H 36 8.358 8.358 7.993 0.365 19845 1143 1 4 . 1 1 37 37 LEU N N 37 116.565 116.565 117.660 -1.095 19845 1144 1 4 . 1 1 37 37 LEU HA H 37 3.973 3.973 4.123 -0.150 19845 1145 1 4 . 1 1 37 37 LEU C C 37 176.538 176.538 179.037 -2.499 19845 1146 1 4 . 1 1 37 37 LEU CA C 37 57.853 57.853 57.151 0.702 19845 1147 1 4 . 1 1 37 37 LEU CB C 37 42.018 42.018 40.575 1.442 19845 1148 1 4 . 1 1 37 37 LEU H H 37 8.360 8.360 7.538 0.822 19845 1149 1 4 . 1 1 38 38 ARG N N 38 119.392 119.392 119.856 -0.464 19845 1150 1 4 . 1 1 38 38 ARG HA H 38 4.104 4.104 4.060 0.044 19845 1151 1 4 . 1 1 38 38 ARG C C 38 176.208 176.208 179.282 -3.074 19845 1152 1 4 . 1 1 38 38 ARG CA C 38 58.100 58.100 58.844 -0.744 19845 1153 1 4 . 1 1 38 38 ARG CB C 38 29.502 29.502 29.537 -0.035 19845 1154 1 4 . 1 1 38 38 ARG H H 38 8.082 8.082 7.414 0.668 19845 1155 1 4 . 1 1 39 39 LEU N N 39 120.438 120.438 118.091 2.347 19845 1156 1 4 . 1 1 39 39 LEU HA H 39 4.243 4.243 3.936 0.307 19845 1157 1 4 . 1 1 39 39 LEU C C 39 175.702 175.702 178.839 -3.137 19845 1158 1 4 . 1 1 39 39 LEU CA C 39 56.979 56.979 58.375 -1.396 19845 1159 1 4 . 1 1 39 39 LEU CB C 39 41.893 41.893 41.484 0.409 19845 1160 1 4 . 1 1 39 39 LEU H H 39 8.446 8.446 7.800 0.646 19845 1161 1 4 . 1 1 40 40 ALA N N 40 122.512 122.512 120.653 1.859 19845 1162 1 4 . 1 1 40 40 ALA HA H 40 3.975 3.975 4.310 -0.335 19845 1163 1 4 . 1 1 40 40 ALA C C 40 175.838 175.838 179.458 -3.620 19845 1164 1 4 . 1 1 40 40 ALA CA C 40 54.710 54.710 54.475 0.235 19845 1165 1 4 . 1 1 40 40 ALA CB C 40 18.319 18.319 18.011 0.308 19845 1166 1 4 . 1 1 40 40 ALA H H 40 8.321 8.321 7.378 0.943 19845 1167 1 4 . 1 1 41 41 ALA N N 41 119.754 119.754 121.700 -1.946 19845 1168 1 4 . 1 1 41 41 ALA HA H 41 4.024 4.024 4.169 -0.145 19845 1169 1 4 . 1 1 41 41 ALA C C 41 176.517 176.517 179.666 -3.149 19845 1170 1 4 . 1 1 41 41 ALA CA C 41 54.486 54.486 54.710 -0.224 19845 1171 1 4 . 1 1 41 41 ALA CB C 41 18.468 18.468 18.505 -0.037 19845 1172 1 4 . 1 1 41 41 ALA H H 41 8.038 8.038 8.161 -0.123 19845 1173 1 4 . 1 1 42 42 TYR N N 42 118.272 118.272 118.740 -0.468 19845 1174 1 4 . 1 1 42 42 TYR HA H 42 4.326 4.326 4.400 -0.074 19845 1175 1 4 . 1 1 42 42 TYR C C 42 174.633 174.633 178.192 -3.559 19845 1176 1 4 . 1 1 42 42 TYR CA C 42 60.098 60.098 59.566 0.532 19845 1177 1 4 . 1 1 42 42 TYR CB C 42 38.936 38.936 37.461 1.475 19845 1178 1 4 . 1 1 42 42 TYR H H 42 7.814 7.814 7.838 -0.024 19845 1179 1 4 . 1 1 43 43 ALA N N 43 122.908 122.908 121.767 1.141 19845 1180 1 4 . 1 1 43 43 ALA HA H 43 4.111 4.111 4.161 -0.050 19845 1181 1 4 . 1 1 43 43 ALA C C 43 175.241 175.241 178.407 -3.166 19845 1182 1 4 . 1 1 43 43 ALA CA C 43 53.842 53.842 54.299 -0.457 19845 1183 1 4 . 1 1 43 43 ALA CB C 43 18.427 18.427 17.617 0.810 19845 1184 1 4 . 1 1 43 43 ALA H H 43 8.172 8.172 7.512 0.660 19845 1185 1 4 . 1 1 44 44 ALA N N 44 119.906 119.906 119.414 0.492 19845 1186 1 4 . 1 1 44 44 ALA HA H 44 4.051 4.051 4.220 -0.169 19845 1187 1 4 . 1 1 44 44 ALA C C 44 175.092 175.092 178.176 -3.084 19845 1188 1 4 . 1 1 44 44 ALA CA C 44 53.611 53.611 53.702 -0.091 19845 1189 1 4 . 1 1 44 44 ALA CB C 44 18.689 18.689 18.998 -0.309 19845 1190 1 4 . 1 1 44 44 ALA H H 44 7.953 7.953 7.724 0.229 19845 1191 1 4 . 1 1 45 45 ASN N N 45 114.984 114.984 116.981 -1.997 19845 1192 1 4 . 1 1 45 45 ASN HA H 45 4.541 4.541 4.759 -0.218 19845 1193 1 4 . 1 1 45 45 ASN CA C 45 54.506 54.506 54.968 -0.462 19845 1194 1 4 . 1 1 45 45 ASN CB C 45 38.602 38.602 39.586 -0.983 19845 1195 1 4 . 1 1 45 45 ASN H H 45 7.847 7.847 8.388 -0.541 19845 1196 1 4 . 1 1 46 46 ILE N N 46 119.155 119.155 116.317 2.838 19845 1197 1 4 . 1 1 46 46 ILE HA H 46 4.033 4.033 4.302 -0.269 19845 1198 1 4 . 1 1 46 46 ILE C C 46 173.344 173.344 175.474 -2.130 19845 1199 1 4 . 1 1 46 46 ILE CA C 46 62.357 62.357 61.690 0.667 19845 1200 1 4 . 1 1 46 46 ILE CB C 46 38.657 38.657 38.393 0.264 19845 1201 1 4 . 1 1 46 46 ILE H H 46 7.790 7.790 7.612 0.178 19845 1202 1 4 . 1 1 47 47 VAL N N 47 117.526 117.526 119.032 -1.506 19845 1203 1 4 . 1 1 47 47 VAL HA H 47 4.133 4.133 4.356 -0.223 19845 1204 1 4 . 1 1 47 47 VAL C C 47 172.672 172.672 174.796 -2.124 19845 1205 1 4 . 1 1 47 47 VAL CA C 47 62.149 62.149 60.226 1.923 19845 1206 1 4 . 1 1 47 47 VAL CB C 47 32.807 32.807 35.314 -2.507 19845 1207 1 4 . 1 1 47 47 VAL H H 47 7.582 7.582 7.510 0.072 19845 1208 1 4 . 1 1 48 48 ASN N N 48 120.091 120.091 121.707 -1.616 19845 1209 1 4 . 1 1 48 48 ASN HA H 48 4.658 4.658 4.843 -0.185 19845 1210 1 4 . 1 1 48 48 ASN CA C 48 53.478 53.478 53.611 -0.133 19845 1211 1 4 . 1 1 48 48 ASN CB C 48 38.573 38.573 37.296 1.277 19845 1212 1 4 . 1 1 48 48 ASN H H 48 8.053 8.053 8.521 -0.468 19845 1213 1 4 . 1 1 49 49 VAL N N 49 118.854 118.854 119.507 -0.653 19845 1214 1 4 . 1 1 49 49 VAL HA H 49 4.133 4.133 4.311 -0.178 19845 1215 1 4 . 1 1 49 49 VAL C C 49 172.595 172.595 173.359 -0.764 19845 1216 1 4 . 1 1 49 49 VAL CA C 49 62.049 62.049 60.251 1.798 19845 1217 1 4 . 1 1 49 49 VAL CB C 49 33.271 33.271 33.798 -0.527 19845 1218 1 4 . 1 1 49 49 VAL H H 49 7.685 7.685 8.088 -0.403 19845 1219 1 4 . 1 1 50 50 SER N N 50 118.689 118.689 121.021 -2.332 19845 1220 1 4 . 1 1 50 50 SER HA H 50 4.466 4.466 4.210 0.256 19845 1221 1 4 . 1 1 50 50 SER C C 50 171.430 171.430 172.466 -1.036 19845 1222 1 4 . 1 1 50 50 SER CA C 50 58.128 58.128 57.308 0.820 19845 1223 1 4 . 1 1 50 50 SER CB C 50 63.916 63.916 64.211 -0.295 19845 1224 1 4 . 1 1 50 50 SER H H 50 8.075 8.075 8.166 -0.091 19845 1225 1 4 . 1 1 51 51 LEU N N 51 123.536 123.536 120.370 3.166 19845 1226 1 4 . 1 1 51 51 LEU HA H 51 4.305 4.305 4.646 -0.341 19845 1227 1 4 . 1 1 51 51 LEU C C 51 174.110 174.110 175.090 -0.980 19845 1228 1 4 . 1 1 51 51 LEU CA C 51 55.145 55.145 54.126 1.019 19845 1229 1 4 . 1 1 51 51 LEU CB C 51 42.674 42.674 44.834 -2.160 19845 1230 1 4 . 1 1 51 51 LEU H H 51 7.991 7.991 8.101 -0.110 19845 1231 1 4 . 1 1 52 52 VAL N N 52 119.649 119.649 119.460 0.189 19845 1232 1 4 . 1 1 52 52 VAL HA H 52 3.992 3.992 4.353 -0.361 19845 1233 1 4 . 1 1 52 52 VAL C C 52 172.476 172.476 176.934 -4.458 19845 1234 1 4 . 1 1 52 52 VAL CA C 52 62.772 62.772 63.109 -0.337 19845 1235 1 4 . 1 1 52 52 VAL CB C 52 33.066 33.066 32.431 0.635 19845 1236 1 4 . 1 1 52 52 VAL H H 52 7.536 7.536 8.114 -0.578 19845 1237 1 4 . 1 1 53 53 LYS N N 53 122.004 122.004 122.852 -0.848 19845 1238 1 4 . 1 1 53 53 LYS HA H 53 4.354 4.354 4.210 0.144 19845 1239 1 4 . 1 1 53 53 LYS CA C 53 56.567 56.567 59.897 -3.330 19845 1240 1 4 . 1 1 53 53 LYS CB C 53 31.689 31.689 30.065 1.624 19845 1241 1 4 . 1 1 53 53 LYS H H 53 8.038 8.038 8.492 -0.454 19845 1242 1 4 . 1 1 54 54 PRO HA H 54 4.353 4.353 4.452 -0.099 19845 1243 1 4 . 1 1 54 54 PRO CA C 54 65.103 65.103 64.886 0.217 19845 1244 1 4 . 1 1 54 54 PRO CB C 54 32.193 32.193 30.961 1.232 19845 1245 1 4 . 1 1 55 55 THR N N 55 111.485 111.485 109.646 1.839 19845 1246 1 4 . 1 1 55 55 THR HA H 55 3.910 3.910 4.801 -0.891 19845 1247 1 4 . 1 1 55 55 THR C C 55 172.822 172.822 176.797 -3.975 19845 1248 1 4 . 1 1 55 55 THR CA C 55 65.030 65.030 63.113 1.917 19845 1249 1 4 . 1 1 55 55 THR CB C 55 68.882 68.882 69.426 -0.544 19845 1250 1 4 . 1 1 55 55 THR H H 55 7.722 7.722 7.530 0.192 19845 1251 1 4 . 1 1 56 56 VAL N N 56 121.165 121.165 121.261 -0.096 19845 1252 1 4 . 1 1 56 56 VAL HA H 56 3.772 3.772 3.718 0.054 19845 1253 1 4 . 1 1 56 56 VAL C C 56 174.904 174.904 176.901 -1.997 19845 1254 1 4 . 1 1 56 56 VAL CA C 56 64.971 64.971 66.169 -1.198 19845 1255 1 4 . 1 1 56 56 VAL CB C 56 31.989 31.989 30.790 1.199 19845 1256 1 4 . 1 1 56 56 VAL H H 56 7.597 7.597 7.763 -0.166 19845 1257 1 4 . 1 1 57 57 TYR N N 57 122.177 122.177 118.797 3.380 19845 1258 1 4 . 1 1 57 57 TYR HA H 57 4.227 4.227 4.232 -0.005 19845 1259 1 4 . 1 1 57 57 TYR C C 57 174.969 174.969 177.421 -2.452 19845 1260 1 4 . 1 1 57 57 TYR CA C 57 60.755 60.755 59.748 1.007 19845 1261 1 4 . 1 1 57 57 TYR CB C 57 38.453 38.453 36.725 1.728 19845 1262 1 4 . 1 1 57 57 TYR H H 57 7.964 7.964 8.012 -0.048 19845 1263 1 4 . 1 1 58 58 VAL N N 58 119.069 119.069 119.516 -0.447 19845 1264 1 4 . 1 1 58 58 VAL HA H 58 3.529 3.529 3.218 0.311 19845 1265 1 4 . 1 1 58 58 VAL C C 58 174.250 174.250 177.102 -2.852 19845 1266 1 4 . 1 1 58 58 VAL CA C 58 66.223 66.223 65.204 1.019 19845 1267 1 4 . 1 1 58 58 VAL CB C 58 31.803 31.803 31.365 0.438 19845 1268 1 4 . 1 1 58 58 VAL H H 58 8.018 8.018 7.286 0.732 19845 1269 1 4 . 1 1 59 59 TYR N N 59 120.360 120.360 120.592 -0.232 19845 1270 1 4 . 1 1 59 59 TYR HA H 59 4.115 4.115 3.952 0.163 19845 1271 1 4 . 1 1 59 59 TYR C C 59 173.899 173.899 177.672 -3.773 19845 1272 1 4 . 1 1 59 59 TYR CA C 59 60.929 60.929 60.787 0.142 19845 1273 1 4 . 1 1 59 59 TYR CB C 59 38.602 38.602 37.833 0.769 19845 1274 1 4 . 1 1 59 59 TYR H H 59 8.142 8.142 7.864 0.278 19845 1275 1 4 . 1 1 60 60 SER N N 60 113.480 113.480 113.187 0.293 19845 1276 1 4 . 1 1 60 60 SER HA H 60 3.979 3.979 3.991 -0.012 19845 1277 1 4 . 1 1 60 60 SER C C 60 172.887 172.887 176.779 -3.892 19845 1278 1 4 . 1 1 60 60 SER CA C 60 60.987 60.987 61.085 -0.098 19845 1279 1 4 . 1 1 60 60 SER CB C 60 63.267 63.267 62.817 0.450 19845 1280 1 4 . 1 1 60 60 SER H H 60 8.057 8.057 7.648 0.409 19845 1281 1 4 . 1 1 61 61 ARG N N 61 120.962 120.962 121.806 -0.844 19845 1282 1 4 . 1 1 61 61 ARG HA H 61 4.103 4.103 3.984 0.119 19845 1283 1 4 . 1 1 61 61 ARG C C 61 175.399 175.399 178.681 -3.282 19845 1284 1 4 . 1 1 61 61 ARG CA C 61 57.427 57.427 58.957 -1.530 19845 1285 1 4 . 1 1 61 61 ARG CB C 61 30.008 30.008 29.881 0.127 19845 1286 1 4 . 1 1 61 61 ARG H H 61 7.606 7.606 7.378 0.228 19845 1287 1 4 . 1 1 62 62 VAL N N 62 117.852 117.852 115.917 1.935 19845 1288 1 4 . 1 1 62 62 VAL HA H 62 3.805 3.805 3.694 0.111 19845 1289 1 4 . 1 1 62 62 VAL C C 62 174.155 174.155 177.496 -3.341 19845 1290 1 4 . 1 1 62 62 VAL CA C 62 64.458 64.458 65.889 -1.431 19845 1291 1 4 . 1 1 62 62 VAL CB C 62 31.969 31.969 31.091 0.878 19845 1292 1 4 . 1 1 62 62 VAL H H 62 7.848 7.848 7.941 -0.093 19845 1293 1 4 . 1 1 63 63 LYS N N 63 119.254 119.254 120.248 -0.994 19845 1294 1 4 . 1 1 63 63 LYS HA H 63 4.051 4.051 3.992 0.059 19845 1295 1 4 . 1 1 63 63 LYS C C 63 173.615 173.615 178.386 -4.771 19845 1296 1 4 . 1 1 63 63 LYS CA C 63 56.727 56.727 58.563 -1.836 19845 1297 1 4 . 1 1 63 63 LYS CB C 63 32.105 32.105 32.553 -0.448 19845 1298 1 4 . 1 1 63 63 LYS H H 63 7.759 7.759 7.477 0.282 19845 1299 1 4 . 1 1 64 64 ASN N N 64 117.696 117.696 116.219 1.477 19845 1300 1 4 . 1 1 64 64 ASN HA H 64 4.642 4.642 4.474 0.168 19845 1301 1 4 . 1 1 64 64 ASN C C 64 171.750 171.750 175.760 -4.010 19845 1302 1 4 . 1 1 64 64 ASN CA C 64 53.313 53.313 54.742 -1.429 19845 1303 1 4 . 1 1 64 64 ASN CB C 64 39.260 39.260 39.285 -0.025 19845 1304 1 4 . 1 1 64 64 ASN H H 64 7.615 7.615 7.947 -0.332 19845 1305 1 5 . 1 1 9 9 THR N N 9 113.692 113.692 116.072 -2.380 19845 1306 1 5 . 1 1 9 9 THR HA H 9 4.213 4.213 4.133 0.080 19845 1307 1 5 . 1 1 9 9 THR C C 9 172.757 172.757 173.962 -1.205 19845 1308 1 5 . 1 1 9 9 THR CA C 9 62.810 62.810 62.546 0.264 19845 1309 1 5 . 1 1 9 9 THR CB C 9 69.878 69.878 68.281 1.597 19845 1310 1 5 . 1 1 9 9 THR H H 9 7.930 7.930 8.201 -0.271 19845 1311 1 5 . 1 1 10 10 GLY N N 10 110.842 110.842 107.084 3.758 19845 1312 1 5 . 1 1 10 10 GLY C C 10 171.923 171.923 174.308 -2.385 19845 1313 1 5 . 1 1 10 10 GLY CA C 10 46.099 46.099 44.558 1.541 19845 1314 1 5 . 1 1 10 10 GLY H H 10 8.266 8.266 8.332 -0.066 19845 1315 1 5 . 1 1 11 11 THR N N 11 113.754 113.754 117.255 -3.501 19845 1316 1 5 . 1 1 11 11 THR HA H 11 4.220 4.220 4.464 -0.244 19845 1317 1 5 . 1 1 11 11 THR C C 11 171.906 171.906 174.613 -2.707 19845 1318 1 5 . 1 1 11 11 THR CA C 11 62.721 62.721 62.417 0.304 19845 1319 1 5 . 1 1 11 11 THR CB C 11 69.549 69.549 68.770 0.779 19845 1320 1 5 . 1 1 11 11 THR H H 11 7.753 7.753 8.108 -0.355 19845 1321 1 5 . 1 1 12 12 LEU N N 12 123.669 123.669 124.530 -0.861 19845 1322 1 5 . 1 1 12 12 LEU HA H 12 4.240 4.240 4.794 -0.554 19845 1323 1 5 . 1 1 12 12 LEU C C 12 175.221 175.221 177.055 -1.834 19845 1324 1 5 . 1 1 12 12 LEU CA C 12 56.799 56.799 55.389 1.410 19845 1325 1 5 . 1 1 12 12 LEU CB C 12 42.536 42.536 41.758 0.778 19845 1326 1 5 . 1 1 12 12 LEU H H 12 7.980 7.980 8.399 -0.419 19845 1327 1 5 . 1 1 13 13 ILE N N 13 120.086 120.086 120.350 -0.264 19845 1328 1 5 . 1 1 13 13 ILE HA H 13 3.913 3.913 4.147 -0.234 19845 1329 1 5 . 1 1 13 13 ILE C C 13 173.425 173.425 176.957 -3.532 19845 1330 1 5 . 1 1 13 13 ILE CA C 13 62.889 62.889 63.909 -1.020 19845 1331 1 5 . 1 1 13 13 ILE CB C 13 38.249 38.249 37.944 0.305 19845 1332 1 5 . 1 1 13 13 ILE H H 13 7.861 7.861 7.714 0.147 19845 1333 1 5 . 1 1 14 14 VAL N N 14 119.785 119.785 117.537 2.248 19845 1334 1 5 . 1 1 14 14 VAL HA H 14 3.790 3.790 3.884 -0.094 19845 1335 1 5 . 1 1 14 14 VAL C C 14 173.429 173.429 177.311 -3.882 19845 1336 1 5 . 1 1 14 14 VAL CA C 14 64.409 64.409 65.574 -1.165 19845 1337 1 5 . 1 1 14 14 VAL CB C 14 32.007 32.007 31.112 0.895 19845 1338 1 5 . 1 1 14 14 VAL H H 14 7.549 7.549 7.987 -0.438 19845 1339 1 5 . 1 1 15 15 ASN N N 15 119.567 119.567 116.840 2.727 19845 1340 1 5 . 1 1 15 15 ASN HA H 15 4.549 4.549 4.717 -0.168 19845 1341 1 5 . 1 1 15 15 ASN C C 15 173.619 173.619 177.264 -3.645 19845 1342 1 5 . 1 1 15 15 ASN CA C 15 54.805 54.805 55.684 -0.880 19845 1343 1 5 . 1 1 15 15 ASN CB C 15 38.824 38.824 38.570 0.254 19845 1344 1 5 . 1 1 15 15 ASN H H 15 8.010 8.010 8.542 -0.532 19845 1345 1 5 . 1 1 16 16 SER N N 16 116.730 116.730 118.008 -1.278 19845 1346 1 5 . 1 1 16 16 SER HA H 16 4.177 4.177 4.410 -0.233 19845 1347 1 5 . 1 1 16 16 SER CA C 16 61.705 61.705 62.008 -0.303 19845 1348 1 5 . 1 1 16 16 SER CB C 16 63.752 63.752 63.630 0.122 19845 1349 1 5 . 1 1 16 16 SER H H 16 8.039 8.039 7.521 0.518 19845 1350 1 5 . 1 1 17 17 VAL N N 17 122.062 122.062 122.213 -0.151 19845 1351 1 5 . 1 1 17 17 VAL HA H 17 3.677 3.677 3.725 -0.048 19845 1352 1 5 . 1 1 17 17 VAL C C 17 174.474 174.474 177.431 -2.957 19845 1353 1 5 . 1 1 17 17 VAL CA C 17 66.671 66.671 66.657 0.014 19845 1354 1 5 . 1 1 17 17 VAL CB C 17 31.531 31.531 31.887 -0.355 19845 1355 1 5 . 1 1 17 17 VAL H H 17 7.896 7.896 8.409 -0.513 19845 1356 1 5 . 1 1 18 18 LEU N N 18 119.103 119.103 119.255 -0.152 19845 1357 1 5 . 1 1 18 18 LEU HA H 18 3.998 3.998 4.132 -0.134 19845 1358 1 5 . 1 1 18 18 LEU C C 18 175.511 175.511 178.244 -2.733 19845 1359 1 5 . 1 1 18 18 LEU CA C 18 58.107 58.107 57.722 0.385 19845 1360 1 5 . 1 1 18 18 LEU CB C 18 41.593 41.593 42.081 -0.488 19845 1361 1 5 . 1 1 18 18 LEU H H 18 7.857 7.857 7.407 0.450 19845 1362 1 5 . 1 1 19 19 LEU N N 19 118.291 118.291 120.044 -1.753 19845 1363 1 5 . 1 1 19 19 LEU HA H 19 4.152 4.152 4.127 0.025 19845 1364 1 5 . 1 1 19 19 LEU C C 19 175.156 175.156 178.816 -3.660 19845 1365 1 5 . 1 1 19 19 LEU CA C 19 58.011 58.011 57.423 0.588 19845 1366 1 5 . 1 1 19 19 LEU CB C 19 42.027 42.027 41.126 0.901 19845 1367 1 5 . 1 1 19 19 LEU H H 19 7.745 7.745 7.515 0.230 19845 1368 1 5 . 1 1 20 20 PHE N N 20 118.415 118.415 120.041 -1.626 19845 1369 1 5 . 1 1 20 20 PHE HA H 20 4.188 4.188 4.176 0.012 19845 1370 1 5 . 1 1 20 20 PHE C C 20 174.260 174.260 177.792 -3.532 19845 1371 1 5 . 1 1 20 20 PHE CA C 20 61.626 61.626 61.991 -0.365 19845 1372 1 5 . 1 1 20 20 PHE CB C 20 38.643 38.643 38.936 -0.293 19845 1373 1 5 . 1 1 20 20 PHE H H 20 8.002 8.002 8.696 -0.694 19845 1374 1 5 . 1 1 21 21 LEU N N 21 118.571 118.571 119.707 -1.136 19845 1375 1 5 . 1 1 21 21 LEU HA H 21 3.797 3.797 4.260 -0.463 19845 1376 1 5 . 1 1 21 21 LEU C C 21 175.324 175.324 178.852 -3.528 19845 1377 1 5 . 1 1 21 21 LEU CA C 21 58.128 58.128 57.515 0.613 19845 1378 1 5 . 1 1 21 21 LEU CB C 21 41.957 41.957 40.979 0.978 19845 1379 1 5 . 1 1 21 21 LEU H H 21 8.456 8.456 7.635 0.821 19845 1380 1 5 . 1 1 22 22 ALA N N 22 120.775 120.775 121.718 -0.943 19845 1381 1 5 . 1 1 22 22 ALA HA H 22 3.779 3.779 4.273 -0.494 19845 1382 1 5 . 1 1 22 22 ALA C C 22 175.697 175.697 180.019 -4.322 19845 1383 1 5 . 1 1 22 22 ALA CA C 22 55.721 55.721 54.642 1.079 19845 1384 1 5 . 1 1 22 22 ALA CB C 22 17.788 17.788 18.383 -0.595 19845 1385 1 5 . 1 1 22 22 ALA H H 22 8.353 8.353 7.579 0.774 19845 1386 1 5 . 1 1 23 23 PHE N N 23 117.860 117.860 119.726 -1.866 19845 1387 1 5 . 1 1 23 23 PHE HA H 23 4.108 4.108 4.227 -0.119 19845 1388 1 5 . 1 1 23 23 PHE C C 23 173.859 173.859 176.835 -2.976 19845 1389 1 5 . 1 1 23 23 PHE CA C 23 61.271 61.271 61.698 -0.427 19845 1390 1 5 . 1 1 23 23 PHE CB C 23 38.853 38.853 39.943 -1.090 19845 1391 1 5 . 1 1 23 23 PHE H H 23 8.121 8.121 8.390 -0.269 19845 1392 1 5 . 1 1 24 24 VAL N N 24 119.181 119.181 119.945 -0.764 19845 1393 1 5 . 1 1 24 24 VAL HA H 24 3.134 3.134 3.579 -0.445 19845 1394 1 5 . 1 1 24 24 VAL C C 24 174.684 174.684 177.277 -2.593 19845 1395 1 5 . 1 1 24 24 VAL CA C 24 67.419 67.419 66.668 0.751 19845 1396 1 5 . 1 1 24 24 VAL CB C 24 31.106 31.106 31.983 -0.876 19845 1397 1 5 . 1 1 24 24 VAL H H 24 8.124 8.124 7.773 0.351 19845 1398 1 5 . 1 1 25 25 VAL N N 25 119.215 119.215 116.534 2.681 19845 1399 1 5 . 1 1 25 25 VAL HA H 25 3.324 3.324 3.680 -0.356 19845 1400 1 5 . 1 1 25 25 VAL C C 25 174.244 174.244 177.588 -3.344 19845 1401 1 5 . 1 1 25 25 VAL CA C 25 67.740 67.740 66.491 1.249 19845 1402 1 5 . 1 1 25 25 VAL CB C 25 31.270 31.270 31.468 -0.198 19845 1403 1 5 . 1 1 25 25 VAL H H 25 8.250 8.250 7.393 0.857 19845 1404 1 5 . 1 1 26 26 PHE N N 26 119.875 119.875 118.744 1.131 19845 1405 1 5 . 1 1 26 26 PHE HA H 26 3.900 3.900 4.149 -0.249 19845 1406 1 5 . 1 1 26 26 PHE C C 26 175.371 175.371 177.398 -2.027 19845 1407 1 5 . 1 1 26 26 PHE CA C 26 61.651 61.651 61.986 -0.335 19845 1408 1 5 . 1 1 26 26 PHE CB C 26 38.760 38.760 38.836 -0.076 19845 1409 1 5 . 1 1 26 26 PHE H H 26 8.413 8.413 7.332 1.081 19845 1410 1 5 . 1 1 27 27 LEU N N 27 122.548 122.548 119.353 3.195 19845 1411 1 5 . 1 1 27 27 LEU HA H 27 3.533 3.533 3.902 -0.369 19845 1412 1 5 . 1 1 27 27 LEU C C 27 175.256 175.256 179.026 -3.770 19845 1413 1 5 . 1 1 27 27 LEU CA C 27 58.211 58.211 57.770 0.441 19845 1414 1 5 . 1 1 27 27 LEU CB C 27 41.564 41.564 41.435 0.128 19845 1415 1 5 . 1 1 27 27 LEU H H 27 8.453 8.453 8.333 0.120 19845 1416 1 5 . 1 1 28 28 LEU N N 28 119.385 119.385 119.341 0.044 19845 1417 1 5 . 1 1 28 28 LEU HA H 28 3.799 3.799 3.912 -0.113 19845 1418 1 5 . 1 1 28 28 LEU C C 28 175.881 175.881 179.035 -3.154 19845 1419 1 5 . 1 1 28 28 LEU CA C 28 58.492 58.492 58.026 0.466 19845 1420 1 5 . 1 1 28 28 LEU CB C 28 41.760 41.760 41.501 0.259 19845 1421 1 5 . 1 1 28 28 LEU H H 28 8.248 8.248 7.906 0.342 19845 1422 1 5 . 1 1 29 29 VAL N N 29 118.515 118.515 114.237 4.278 19845 1423 1 5 . 1 1 29 29 VAL HA H 29 3.319 3.319 3.764 -0.445 19845 1424 1 5 . 1 1 29 29 VAL C C 29 174.734 174.734 177.870 -3.136 19845 1425 1 5 . 1 1 29 29 VAL CA C 29 67.192 67.192 65.604 1.588 19845 1426 1 5 . 1 1 29 29 VAL CB C 29 31.175 31.175 31.287 -0.112 19845 1427 1 5 . 1 1 29 29 VAL H H 29 8.446 8.446 7.185 1.261 19845 1428 1 5 . 1 1 30 30 THR N N 30 117.313 117.313 116.925 0.388 19845 1429 1 5 . 1 1 30 30 THR HA H 30 3.432 3.432 3.867 -0.435 19845 1430 1 5 . 1 1 30 30 THR CA C 30 68.606 68.606 66.711 1.895 19845 1431 1 5 . 1 1 30 30 THR CB C 30 67.147 67.147 68.284 -1.137 19845 1432 1 5 . 1 1 30 30 THR H H 30 7.923 7.923 8.026 -0.103 19845 1433 1 5 . 1 1 31 31 LEU N N 31 120.629 120.629 120.466 0.163 19845 1434 1 5 . 1 1 31 31 LEU HA H 31 3.858 3.858 3.905 -0.047 19845 1435 1 5 . 1 1 31 31 LEU C C 31 177.164 177.164 178.460 -1.296 19845 1436 1 5 . 1 1 31 31 LEU CA C 31 58.145 58.145 57.777 0.368 19845 1437 1 5 . 1 1 31 31 LEU CB C 31 41.615 41.615 41.534 0.081 19845 1438 1 5 . 1 1 31 31 LEU H H 31 8.382 8.382 7.938 0.444 19845 1439 1 5 . 1 1 32 32 ALA N N 32 125.216 125.216 121.628 3.588 19845 1440 1 5 . 1 1 32 32 ALA HA H 32 3.836 3.836 3.908 -0.072 19845 1441 1 5 . 1 1 32 32 ALA C C 32 175.968 175.968 180.488 -4.520 19845 1442 1 5 . 1 1 32 32 ALA CA C 32 55.918 55.918 54.788 1.130 19845 1443 1 5 . 1 1 32 32 ALA CB C 32 17.802 17.802 18.140 -0.338 19845 1444 1 5 . 1 1 32 32 ALA H H 32 8.517 8.517 7.706 0.811 19845 1445 1 5 . 1 1 33 33 ILE N N 33 118.722 118.722 118.945 -0.223 19845 1446 1 5 . 1 1 33 33 ILE HA H 33 3.481 3.481 3.561 -0.080 19845 1447 1 5 . 1 1 33 33 ILE C C 33 175.004 175.004 178.053 -3.049 19845 1448 1 5 . 1 1 33 33 ILE CA C 33 65.554 65.554 64.836 0.718 19845 1449 1 5 . 1 1 33 33 ILE CB C 33 37.657 37.657 37.311 0.346 19845 1450 1 5 . 1 1 33 33 ILE H H 33 8.288 8.288 7.585 0.703 19845 1451 1 5 . 1 1 34 34 LEU N N 34 118.987 118.987 120.111 -1.124 19845 1452 1 5 . 1 1 34 34 LEU HA H 34 3.893 3.893 3.991 -0.098 19845 1453 1 5 . 1 1 34 34 LEU C C 34 176.439 176.439 178.293 -1.854 19845 1454 1 5 . 1 1 34 34 LEU CA C 34 58.436 58.436 58.007 0.429 19845 1455 1 5 . 1 1 34 34 LEU CB C 34 42.152 42.152 41.093 1.059 19845 1456 1 5 . 1 1 34 34 LEU H H 34 8.493 8.493 8.082 0.411 19845 1457 1 5 . 1 1 35 35 THR N N 35 116.630 116.630 115.343 1.287 19845 1458 1 5 . 1 1 35 35 THR HA H 35 3.652 3.652 3.895 -0.243 19845 1459 1 5 . 1 1 35 35 THR C C 35 173.366 173.366 176.182 -2.816 19845 1460 1 5 . 1 1 35 35 THR CA C 35 68.153 68.153 66.445 1.708 19845 1461 1 5 . 1 1 35 35 THR CB C 35 68.162 68.162 67.958 0.204 19845 1462 1 5 . 1 1 35 35 THR H H 35 8.215 8.215 8.176 0.039 19845 1463 1 5 . 1 1 36 36 ALA N N 36 124.667 124.667 123.163 1.504 19845 1464 1 5 . 1 1 36 36 ALA HA H 36 3.864 3.864 3.930 -0.066 19845 1465 1 5 . 1 1 36 36 ALA C C 36 176.510 176.510 179.188 -2.678 19845 1466 1 5 . 1 1 36 36 ALA CA C 36 55.758 55.758 55.050 0.708 19845 1467 1 5 . 1 1 36 36 ALA CB C 36 18.054 18.054 18.196 -0.142 19845 1468 1 5 . 1 1 36 36 ALA H H 36 8.358 8.358 7.997 0.361 19845 1469 1 5 . 1 1 37 37 LEU N N 37 116.565 116.565 117.780 -1.215 19845 1470 1 5 . 1 1 37 37 LEU HA H 37 3.973 3.973 4.113 -0.140 19845 1471 1 5 . 1 1 37 37 LEU C C 37 176.538 176.538 179.162 -2.624 19845 1472 1 5 . 1 1 37 37 LEU CA C 37 57.853 57.853 57.206 0.647 19845 1473 1 5 . 1 1 37 37 LEU CB C 37 42.018 42.018 40.583 1.435 19845 1474 1 5 . 1 1 37 37 LEU H H 37 8.360 8.360 7.574 0.786 19845 1475 1 5 . 1 1 38 38 ARG N N 38 119.392 119.392 119.917 -0.525 19845 1476 1 5 . 1 1 38 38 ARG HA H 38 4.104 4.104 4.048 0.056 19845 1477 1 5 . 1 1 38 38 ARG C C 38 176.208 176.208 179.260 -3.052 19845 1478 1 5 . 1 1 38 38 ARG CA C 38 58.100 58.100 59.015 -0.915 19845 1479 1 5 . 1 1 38 38 ARG CB C 38 29.502 29.502 29.625 -0.123 19845 1480 1 5 . 1 1 38 38 ARG H H 38 8.082 8.082 7.410 0.672 19845 1481 1 5 . 1 1 39 39 LEU N N 39 120.438 120.438 118.272 2.166 19845 1482 1 5 . 1 1 39 39 LEU HA H 39 4.243 4.243 3.918 0.325 19845 1483 1 5 . 1 1 39 39 LEU C C 39 175.702 175.702 178.920 -3.218 19845 1484 1 5 . 1 1 39 39 LEU CA C 39 56.979 56.979 58.387 -1.408 19845 1485 1 5 . 1 1 39 39 LEU CB C 39 41.893 41.893 41.494 0.399 19845 1486 1 5 . 1 1 39 39 LEU H H 39 8.446 8.446 7.764 0.682 19845 1487 1 5 . 1 1 40 40 ALA N N 40 122.512 122.512 120.929 1.583 19845 1488 1 5 . 1 1 40 40 ALA HA H 40 3.975 3.975 4.064 -0.089 19845 1489 1 5 . 1 1 40 40 ALA C C 40 175.838 175.838 179.665 -3.827 19845 1490 1 5 . 1 1 40 40 ALA CA C 40 54.710 54.710 54.714 -0.004 19845 1491 1 5 . 1 1 40 40 ALA CB C 40 18.319 18.319 17.838 0.481 19845 1492 1 5 . 1 1 40 40 ALA H H 40 8.321 8.321 7.422 0.899 19845 1493 1 5 . 1 1 41 41 ALA N N 41 119.754 119.754 121.761 -2.007 19845 1494 1 5 . 1 1 41 41 ALA HA H 41 4.024 4.024 4.171 -0.147 19845 1495 1 5 . 1 1 41 41 ALA C C 41 176.517 176.517 179.671 -3.154 19845 1496 1 5 . 1 1 41 41 ALA CA C 41 54.486 54.486 54.702 -0.216 19845 1497 1 5 . 1 1 41 41 ALA CB C 41 18.468 18.468 18.442 0.026 19845 1498 1 5 . 1 1 41 41 ALA H H 41 8.038 8.038 8.240 -0.202 19845 1499 1 5 . 1 1 42 42 TYR N N 42 118.272 118.272 118.268 0.004 19845 1500 1 5 . 1 1 42 42 TYR HA H 42 4.326 4.326 4.285 0.041 19845 1501 1 5 . 1 1 42 42 TYR C C 42 174.633 174.633 177.693 -3.060 19845 1502 1 5 . 1 1 42 42 TYR CA C 42 60.098 60.098 59.517 0.581 19845 1503 1 5 . 1 1 42 42 TYR CB C 42 38.936 38.936 37.435 1.501 19845 1504 1 5 . 1 1 42 42 TYR H H 42 7.814 7.814 7.954 -0.140 19845 1505 1 5 . 1 1 43 43 ALA N N 43 122.908 122.908 121.764 1.144 19845 1506 1 5 . 1 1 43 43 ALA HA H 43 4.111 4.111 4.162 -0.051 19845 1507 1 5 . 1 1 43 43 ALA C C 43 175.241 175.241 178.339 -3.098 19845 1508 1 5 . 1 1 43 43 ALA CA C 43 53.842 53.842 54.192 -0.350 19845 1509 1 5 . 1 1 43 43 ALA CB C 43 18.427 18.427 17.766 0.661 19845 1510 1 5 . 1 1 43 43 ALA H H 43 8.172 8.172 7.539 0.633 19845 1511 1 5 . 1 1 44 44 ALA N N 44 119.906 119.906 119.148 0.758 19845 1512 1 5 . 1 1 44 44 ALA HA H 44 4.051 4.051 4.221 -0.170 19845 1513 1 5 . 1 1 44 44 ALA C C 44 175.092 175.092 178.370 -3.278 19845 1514 1 5 . 1 1 44 44 ALA CA C 44 53.611 53.611 53.764 -0.153 19845 1515 1 5 . 1 1 44 44 ALA CB C 44 18.689 18.689 19.042 -0.353 19845 1516 1 5 . 1 1 44 44 ALA H H 44 7.953 7.953 7.754 0.199 19845 1517 1 5 . 1 1 45 45 ASN N N 45 114.984 114.984 117.098 -2.114 19845 1518 1 5 . 1 1 45 45 ASN HA H 45 4.541 4.541 4.826 -0.285 19845 1519 1 5 . 1 1 45 45 ASN CA C 45 54.506 54.506 54.577 -0.071 19845 1520 1 5 . 1 1 45 45 ASN CB C 45 38.602 38.602 39.666 -1.064 19845 1521 1 5 . 1 1 45 45 ASN H H 45 7.847 7.847 8.337 -0.490 19845 1522 1 5 . 1 1 46 46 ILE N N 46 119.155 119.155 117.200 1.955 19845 1523 1 5 . 1 1 46 46 ILE HA H 46 4.033 4.033 4.337 -0.304 19845 1524 1 5 . 1 1 46 46 ILE C C 46 173.344 173.344 175.403 -2.059 19845 1525 1 5 . 1 1 46 46 ILE CA C 46 62.357 62.357 61.853 0.504 19845 1526 1 5 . 1 1 46 46 ILE CB C 46 38.657 38.657 38.602 0.055 19845 1527 1 5 . 1 1 46 46 ILE H H 46 7.790 7.790 7.675 0.115 19845 1528 1 5 . 1 1 47 47 VAL N N 47 117.526 117.526 114.692 2.834 19845 1529 1 5 . 1 1 47 47 VAL HA H 47 4.133 4.133 4.463 -0.330 19845 1530 1 5 . 1 1 47 47 VAL C C 47 172.672 172.672 174.605 -1.933 19845 1531 1 5 . 1 1 47 47 VAL CA C 47 62.149 62.149 59.669 2.479 19845 1532 1 5 . 1 1 47 47 VAL CB C 47 32.807 32.807 34.073 -1.266 19845 1533 1 5 . 1 1 47 47 VAL H H 47 7.582 7.582 7.513 0.069 19845 1534 1 5 . 1 1 48 48 ASN N N 48 120.091 120.091 119.639 0.452 19845 1535 1 5 . 1 1 48 48 ASN HA H 48 4.658 4.658 4.818 -0.160 19845 1536 1 5 . 1 1 48 48 ASN CA C 48 53.478 53.478 53.217 0.261 19845 1537 1 5 . 1 1 48 48 ASN CB C 48 38.573 38.573 36.309 2.264 19845 1538 1 5 . 1 1 48 48 ASN H H 48 8.053 8.053 8.581 -0.528 19845 1539 1 5 . 1 1 49 49 VAL N N 49 118.854 118.854 119.958 -1.104 19845 1540 1 5 . 1 1 49 49 VAL HA H 49 4.133 4.133 4.279 -0.146 19845 1541 1 5 . 1 1 49 49 VAL C C 49 172.595 172.595 173.737 -1.142 19845 1542 1 5 . 1 1 49 49 VAL CA C 49 62.049 62.049 60.835 1.214 19845 1543 1 5 . 1 1 49 49 VAL CB C 49 33.271 33.271 34.475 -1.204 19845 1544 1 5 . 1 1 49 49 VAL H H 49 7.685 7.685 7.968 -0.283 19845 1545 1 5 . 1 1 50 50 SER N N 50 118.689 118.689 121.475 -2.786 19845 1546 1 5 . 1 1 50 50 SER HA H 50 4.466 4.466 4.262 0.204 19845 1547 1 5 . 1 1 50 50 SER C C 50 171.430 171.430 172.557 -1.127 19845 1548 1 5 . 1 1 50 50 SER CA C 50 58.128 58.128 57.274 0.854 19845 1549 1 5 . 1 1 50 50 SER CB C 50 63.916 63.916 64.182 -0.266 19845 1550 1 5 . 1 1 50 50 SER H H 50 8.075 8.075 8.151 -0.076 19845 1551 1 5 . 1 1 51 51 LEU N N 51 123.536 123.536 119.364 4.172 19845 1552 1 5 . 1 1 51 51 LEU HA H 51 4.305 4.305 4.610 -0.305 19845 1553 1 5 . 1 1 51 51 LEU C C 51 174.110 174.110 175.449 -1.339 19845 1554 1 5 . 1 1 51 51 LEU CA C 51 55.145 55.145 54.464 0.681 19845 1555 1 5 . 1 1 51 51 LEU CB C 51 42.674 42.674 44.912 -2.238 19845 1556 1 5 . 1 1 51 51 LEU H H 51 7.991 7.991 7.753 0.238 19845 1557 1 5 . 1 1 52 52 VAL N N 52 119.649 119.649 119.964 -0.315 19845 1558 1 5 . 1 1 52 52 VAL HA H 52 3.992 3.992 4.346 -0.354 19845 1559 1 5 . 1 1 52 52 VAL C C 52 172.476 172.476 176.301 -3.825 19845 1560 1 5 . 1 1 52 52 VAL CA C 52 62.772 62.772 63.295 -0.524 19845 1561 1 5 . 1 1 52 52 VAL CB C 52 33.066 33.066 32.442 0.624 19845 1562 1 5 . 1 1 52 52 VAL H H 52 7.536 7.536 8.441 -0.905 19845 1563 1 5 . 1 1 53 53 LYS N N 53 122.004 122.004 122.317 -0.313 19845 1564 1 5 . 1 1 53 53 LYS HA H 53 4.354 4.354 4.206 0.148 19845 1565 1 5 . 1 1 53 53 LYS CA C 53 56.567 56.567 60.167 -3.600 19845 1566 1 5 . 1 1 53 53 LYS CB C 53 31.689 31.689 29.936 1.752 19845 1567 1 5 . 1 1 53 53 LYS H H 53 8.038 8.038 8.527 -0.489 19845 1568 1 5 . 1 1 54 54 PRO HA H 54 4.353 4.353 4.461 -0.108 19845 1569 1 5 . 1 1 54 54 PRO CA C 54 65.103 65.103 64.900 0.203 19845 1570 1 5 . 1 1 54 54 PRO CB C 54 32.193 32.193 30.959 1.234 19845 1571 1 5 . 1 1 55 55 THR N N 55 111.485 111.485 109.390 2.095 19845 1572 1 5 . 1 1 55 55 THR HA H 55 3.910 3.910 4.795 -0.885 19845 1573 1 5 . 1 1 55 55 THR C C 55 172.822 172.822 176.660 -3.838 19845 1574 1 5 . 1 1 55 55 THR CA C 55 65.030 65.030 63.154 1.876 19845 1575 1 5 . 1 1 55 55 THR CB C 55 68.882 68.882 69.157 -0.275 19845 1576 1 5 . 1 1 55 55 THR H H 55 7.722 7.722 7.394 0.328 19845 1577 1 5 . 1 1 56 56 VAL N N 56 121.165 121.165 120.790 0.375 19845 1578 1 5 . 1 1 56 56 VAL HA H 56 3.772 3.772 3.687 0.085 19845 1579 1 5 . 1 1 56 56 VAL C C 56 174.904 174.904 176.938 -2.034 19845 1580 1 5 . 1 1 56 56 VAL CA C 56 64.971 64.971 66.033 -1.062 19845 1581 1 5 . 1 1 56 56 VAL CB C 56 31.989 31.989 31.258 0.731 19845 1582 1 5 . 1 1 56 56 VAL H H 56 7.597 7.597 7.640 -0.043 19845 1583 1 5 . 1 1 57 57 TYR N N 57 122.177 122.177 117.826 4.351 19845 1584 1 5 . 1 1 57 57 TYR HA H 57 4.227 4.227 4.212 0.015 19845 1585 1 5 . 1 1 57 57 TYR C C 57 174.969 174.969 177.158 -2.189 19845 1586 1 5 . 1 1 57 57 TYR CA C 57 60.755 60.755 59.521 1.234 19845 1587 1 5 . 1 1 57 57 TYR CB C 57 38.453 38.453 36.960 1.493 19845 1588 1 5 . 1 1 57 57 TYR H H 57 7.964 7.964 8.005 -0.041 19845 1589 1 5 . 1 1 58 58 VAL N N 58 119.069 119.069 119.130 -0.061 19845 1590 1 5 . 1 1 58 58 VAL HA H 58 3.529 3.529 3.346 0.183 19845 1591 1 5 . 1 1 58 58 VAL C C 58 174.250 174.250 177.118 -2.868 19845 1592 1 5 . 1 1 58 58 VAL CA C 58 66.223 66.223 64.394 1.829 19845 1593 1 5 . 1 1 58 58 VAL CB C 58 31.803 31.803 30.660 1.143 19845 1594 1 5 . 1 1 58 58 VAL H H 58 8.018 8.018 7.323 0.695 19845 1595 1 5 . 1 1 59 59 TYR N N 59 120.360 120.360 121.149 -0.789 19845 1596 1 5 . 1 1 59 59 TYR HA H 59 4.115 4.115 3.933 0.182 19845 1597 1 5 . 1 1 59 59 TYR C C 59 173.899 173.899 177.747 -3.848 19845 1598 1 5 . 1 1 59 59 TYR CA C 59 60.929 60.929 61.365 -0.436 19845 1599 1 5 . 1 1 59 59 TYR CB C 59 38.602 38.602 37.791 0.811 19845 1600 1 5 . 1 1 59 59 TYR H H 59 8.142 8.142 7.815 0.327 19845 1601 1 5 . 1 1 60 60 SER N N 60 113.480 113.480 113.901 -0.421 19845 1602 1 5 . 1 1 60 60 SER HA H 60 3.979 3.979 3.963 0.016 19845 1603 1 5 . 1 1 60 60 SER C C 60 172.887 172.887 176.561 -3.674 19845 1604 1 5 . 1 1 60 60 SER CA C 60 60.987 60.987 60.988 -0.001 19845 1605 1 5 . 1 1 60 60 SER CB C 60 63.267 63.267 62.925 0.342 19845 1606 1 5 . 1 1 60 60 SER H H 60 8.057 8.057 7.708 0.349 19845 1607 1 5 . 1 1 61 61 ARG N N 61 120.962 120.962 122.372 -1.410 19845 1608 1 5 . 1 1 61 61 ARG HA H 61 4.103 4.103 3.960 0.143 19845 1609 1 5 . 1 1 61 61 ARG C C 61 175.399 175.399 178.594 -3.195 19845 1610 1 5 . 1 1 61 61 ARG CA C 61 57.427 57.427 59.530 -2.103 19845 1611 1 5 . 1 1 61 61 ARG CB C 61 30.008 30.008 30.140 -0.132 19845 1612 1 5 . 1 1 61 61 ARG H H 61 7.606 7.606 7.322 0.284 19845 1613 1 5 . 1 1 62 62 VAL N N 62 117.852 117.852 116.116 1.736 19845 1614 1 5 . 1 1 62 62 VAL HA H 62 3.805 3.805 3.675 0.130 19845 1615 1 5 . 1 1 62 62 VAL C C 62 174.155 174.155 177.236 -3.081 19845 1616 1 5 . 1 1 62 62 VAL CA C 62 64.458 64.458 65.991 -1.533 19845 1617 1 5 . 1 1 62 62 VAL CB C 62 31.969 31.969 31.202 0.767 19845 1618 1 5 . 1 1 62 62 VAL H H 62 7.848 7.848 8.056 -0.208 19845 1619 1 5 . 1 1 63 63 LYS N N 63 119.254 119.254 120.210 -0.956 19845 1620 1 5 . 1 1 63 63 LYS HA H 63 4.051 4.051 4.004 0.047 19845 1621 1 5 . 1 1 63 63 LYS C C 63 173.615 173.615 178.331 -4.716 19845 1622 1 5 . 1 1 63 63 LYS CA C 63 56.727 56.727 58.402 -1.675 19845 1623 1 5 . 1 1 63 63 LYS CB C 63 32.105 32.105 32.567 -0.462 19845 1624 1 5 . 1 1 63 63 LYS H H 63 7.759 7.759 7.463 0.296 19845 1625 1 5 . 1 1 64 64 ASN N N 64 117.696 117.696 116.416 1.280 19845 1626 1 5 . 1 1 64 64 ASN HA H 64 4.642 4.642 4.472 0.170 19845 1627 1 5 . 1 1 64 64 ASN C C 64 171.750 171.750 176.259 -4.509 19845 1628 1 5 . 1 1 64 64 ASN CA C 64 53.313 53.313 54.950 -1.637 19845 1629 1 5 . 1 1 64 64 ASN CB C 64 39.260 39.260 39.148 0.112 19845 1630 1 5 . 1 1 64 64 ASN H H 64 7.615 7.615 7.980 -0.365 19845 1631 1 6 . 1 1 9 9 THR N N 9 113.692 113.692 114.794 -1.102 19845 1632 1 6 . 1 1 9 9 THR HA H 9 4.213 4.213 4.599 -0.386 19845 1633 1 6 . 1 1 9 9 THR C C 9 172.757 172.757 175.123 -2.366 19845 1634 1 6 . 1 1 9 9 THR CA C 9 62.810 62.810 62.382 0.428 19845 1635 1 6 . 1 1 9 9 THR CB C 9 69.878 69.878 69.198 0.680 19845 1636 1 6 . 1 1 9 9 THR H H 9 7.930 7.930 8.563 -0.633 19845 1637 1 6 . 1 1 10 10 GLY N N 10 110.842 110.842 109.106 1.736 19845 1638 1 6 . 1 1 10 10 GLY C C 10 171.923 171.923 173.789 -1.866 19845 1639 1 6 . 1 1 10 10 GLY CA C 10 46.099 46.099 44.581 1.518 19845 1640 1 6 . 1 1 10 10 GLY H H 10 8.266 8.266 7.989 0.277 19845 1641 1 6 . 1 1 11 11 THR N N 11 113.754 113.754 118.389 -4.635 19845 1642 1 6 . 1 1 11 11 THR HA H 11 4.220 4.220 4.352 -0.132 19845 1643 1 6 . 1 1 11 11 THR C C 11 171.906 171.906 174.464 -2.558 19845 1644 1 6 . 1 1 11 11 THR CA C 11 62.721 62.721 63.328 -0.606 19845 1645 1 6 . 1 1 11 11 THR CB C 11 69.549 69.549 68.274 1.275 19845 1646 1 6 . 1 1 11 11 THR H H 11 7.753 7.753 8.028 -0.275 19845 1647 1 6 . 1 1 12 12 LEU N N 12 123.669 123.669 125.729 -2.060 19845 1648 1 6 . 1 1 12 12 LEU HA H 12 4.240 4.240 4.534 -0.294 19845 1649 1 6 . 1 1 12 12 LEU C C 12 175.221 175.221 177.501 -2.280 19845 1650 1 6 . 1 1 12 12 LEU CA C 12 56.799 56.799 55.271 1.528 19845 1651 1 6 . 1 1 12 12 LEU CB C 12 42.536 42.536 41.935 0.601 19845 1652 1 6 . 1 1 12 12 LEU H H 12 7.980 7.980 8.045 -0.065 19845 1653 1 6 . 1 1 13 13 ILE N N 13 120.086 120.086 120.875 -0.789 19845 1654 1 6 . 1 1 13 13 ILE HA H 13 3.913 3.913 4.041 -0.128 19845 1655 1 6 . 1 1 13 13 ILE C C 13 173.425 173.425 176.995 -3.570 19845 1656 1 6 . 1 1 13 13 ILE CA C 13 62.889 62.889 63.119 -0.230 19845 1657 1 6 . 1 1 13 13 ILE CB C 13 38.249 38.249 38.022 0.227 19845 1658 1 6 . 1 1 13 13 ILE H H 13 7.861 7.861 7.432 0.429 19845 1659 1 6 . 1 1 14 14 VAL N N 14 119.785 119.785 119.591 0.194 19845 1660 1 6 . 1 1 14 14 VAL HA H 14 3.790 3.790 3.777 0.013 19845 1661 1 6 . 1 1 14 14 VAL C C 14 173.429 173.429 177.149 -3.720 19845 1662 1 6 . 1 1 14 14 VAL CA C 14 64.409 64.409 65.016 -0.607 19845 1663 1 6 . 1 1 14 14 VAL CB C 14 32.007 32.007 31.472 0.535 19845 1664 1 6 . 1 1 14 14 VAL H H 14 7.549 7.549 8.370 -0.821 19845 1665 1 6 . 1 1 15 15 ASN N N 15 119.567 119.567 116.987 2.580 19845 1666 1 6 . 1 1 15 15 ASN HA H 15 4.549 4.549 4.626 -0.077 19845 1667 1 6 . 1 1 15 15 ASN C C 15 173.619 173.619 177.267 -3.648 19845 1668 1 6 . 1 1 15 15 ASN CA C 15 54.805 54.805 56.068 -1.263 19845 1669 1 6 . 1 1 15 15 ASN CB C 15 38.824 38.824 38.420 0.404 19845 1670 1 6 . 1 1 15 15 ASN H H 15 8.010 8.010 8.357 -0.347 19845 1671 1 6 . 1 1 16 16 SER N N 16 116.730 116.730 115.884 0.846 19845 1672 1 6 . 1 1 16 16 SER HA H 16 4.177 4.177 4.390 -0.213 19845 1673 1 6 . 1 1 16 16 SER CA C 16 61.705 61.705 60.763 0.942 19845 1674 1 6 . 1 1 16 16 SER CB C 16 63.752 63.752 63.427 0.325 19845 1675 1 6 . 1 1 16 16 SER H H 16 8.039 8.039 7.438 0.601 19845 1676 1 6 . 1 1 17 17 VAL N N 17 122.062 122.062 122.899 -0.837 19845 1677 1 6 . 1 1 17 17 VAL HA H 17 3.677 3.677 3.900 -0.223 19845 1678 1 6 . 1 1 17 17 VAL C C 17 174.474 174.474 177.374 -2.900 19845 1679 1 6 . 1 1 17 17 VAL CA C 17 66.671 66.671 65.067 1.604 19845 1680 1 6 . 1 1 17 17 VAL CB C 17 31.531 31.531 31.442 0.089 19845 1681 1 6 . 1 1 17 17 VAL H H 17 7.896 7.896 8.237 -0.341 19845 1682 1 6 . 1 1 18 18 LEU N N 18 119.103 119.103 120.282 -1.179 19845 1683 1 6 . 1 1 18 18 LEU HA H 18 3.998 3.998 4.198 -0.200 19845 1684 1 6 . 1 1 18 18 LEU C C 18 175.511 175.511 178.477 -2.966 19845 1685 1 6 . 1 1 18 18 LEU CA C 18 58.107 58.107 57.934 0.173 19845 1686 1 6 . 1 1 18 18 LEU CB C 18 41.593 41.593 41.980 -0.387 19845 1687 1 6 . 1 1 18 18 LEU H H 18 7.857 7.857 7.397 0.460 19845 1688 1 6 . 1 1 19 19 LEU N N 19 118.291 118.291 119.870 -1.579 19845 1689 1 6 . 1 1 19 19 LEU HA H 19 4.152 4.152 4.067 0.085 19845 1690 1 6 . 1 1 19 19 LEU C C 19 175.156 175.156 178.900 -3.744 19845 1691 1 6 . 1 1 19 19 LEU CA C 19 58.011 58.011 57.885 0.126 19845 1692 1 6 . 1 1 19 19 LEU CB C 19 42.027 42.027 41.537 0.490 19845 1693 1 6 . 1 1 19 19 LEU H H 19 7.745 7.745 7.504 0.241 19845 1694 1 6 . 1 1 20 20 PHE N N 20 118.415 118.415 119.562 -1.147 19845 1695 1 6 . 1 1 20 20 PHE HA H 20 4.188 4.188 4.173 0.015 19845 1696 1 6 . 1 1 20 20 PHE C C 20 174.260 174.260 177.505 -3.245 19845 1697 1 6 . 1 1 20 20 PHE CA C 20 61.626 61.626 62.209 -0.583 19845 1698 1 6 . 1 1 20 20 PHE CB C 20 38.643 38.643 38.924 -0.281 19845 1699 1 6 . 1 1 20 20 PHE H H 20 8.002 8.002 8.677 -0.675 19845 1700 1 6 . 1 1 21 21 LEU N N 21 118.571 118.571 120.155 -1.584 19845 1701 1 6 . 1 1 21 21 LEU HA H 21 3.797 3.797 4.074 -0.277 19845 1702 1 6 . 1 1 21 21 LEU C C 21 175.324 175.324 178.438 -3.114 19845 1703 1 6 . 1 1 21 21 LEU CA C 21 58.128 58.128 59.055 -0.927 19845 1704 1 6 . 1 1 21 21 LEU CB C 21 41.957 41.957 41.886 0.071 19845 1705 1 6 . 1 1 21 21 LEU H H 21 8.456 8.456 7.704 0.752 19845 1706 1 6 . 1 1 22 22 ALA N N 22 120.775 120.775 120.910 -0.135 19845 1707 1 6 . 1 1 22 22 ALA HA H 22 3.779 3.779 4.202 -0.423 19845 1708 1 6 . 1 1 22 22 ALA C C 22 175.697 175.697 180.065 -4.368 19845 1709 1 6 . 1 1 22 22 ALA CA C 22 55.721 55.721 54.764 0.957 19845 1710 1 6 . 1 1 22 22 ALA CB C 22 17.788 17.788 18.244 -0.456 19845 1711 1 6 . 1 1 22 22 ALA H H 22 8.353 8.353 7.572 0.781 19845 1712 1 6 . 1 1 23 23 PHE N N 23 117.860 117.860 119.880 -2.020 19845 1713 1 6 . 1 1 23 23 PHE HA H 23 4.108 4.108 4.244 -0.136 19845 1714 1 6 . 1 1 23 23 PHE C C 23 173.859 173.859 176.940 -3.081 19845 1715 1 6 . 1 1 23 23 PHE CA C 23 61.271 61.271 60.137 1.134 19845 1716 1 6 . 1 1 23 23 PHE CB C 23 38.853 38.853 39.320 -0.467 19845 1717 1 6 . 1 1 23 23 PHE H H 23 8.121 8.121 8.206 -0.085 19845 1718 1 6 . 1 1 24 24 VAL N N 24 119.181 119.181 119.934 -0.753 19845 1719 1 6 . 1 1 24 24 VAL HA H 24 3.134 3.134 3.371 -0.237 19845 1720 1 6 . 1 1 24 24 VAL C C 24 174.684 174.684 177.778 -3.094 19845 1721 1 6 . 1 1 24 24 VAL CA C 24 67.419 67.419 67.161 0.258 19845 1722 1 6 . 1 1 24 24 VAL CB C 24 31.106 31.106 31.143 -0.037 19845 1723 1 6 . 1 1 24 24 VAL H H 24 8.124 8.124 8.295 -0.171 19845 1724 1 6 . 1 1 25 25 VAL N N 25 119.215 119.215 117.082 2.133 19845 1725 1 6 . 1 1 25 25 VAL HA H 25 3.324 3.324 3.582 -0.258 19845 1726 1 6 . 1 1 25 25 VAL C C 25 174.244 174.244 177.484 -3.240 19845 1727 1 6 . 1 1 25 25 VAL CA C 25 67.740 67.740 66.449 1.291 19845 1728 1 6 . 1 1 25 25 VAL CB C 25 31.270 31.270 31.296 -0.026 19845 1729 1 6 . 1 1 25 25 VAL H H 25 8.250 8.250 7.518 0.732 19845 1730 1 6 . 1 1 26 26 PHE N N 26 119.875 119.875 119.076 0.799 19845 1731 1 6 . 1 1 26 26 PHE HA H 26 3.900 3.900 4.157 -0.257 19845 1732 1 6 . 1 1 26 26 PHE C C 26 175.371 175.371 177.695 -2.324 19845 1733 1 6 . 1 1 26 26 PHE CA C 26 61.651 61.651 62.444 -0.793 19845 1734 1 6 . 1 1 26 26 PHE CB C 26 38.760 38.760 39.163 -0.403 19845 1735 1 6 . 1 1 26 26 PHE H H 26 8.413 8.413 7.337 1.076 19845 1736 1 6 . 1 1 27 27 LEU N N 27 122.548 122.548 119.499 3.049 19845 1737 1 6 . 1 1 27 27 LEU HA H 27 3.533 3.533 3.741 -0.208 19845 1738 1 6 . 1 1 27 27 LEU C C 27 175.256 175.256 178.976 -3.720 19845 1739 1 6 . 1 1 27 27 LEU CA C 27 58.211 58.211 57.703 0.508 19845 1740 1 6 . 1 1 27 27 LEU CB C 27 41.564 41.564 41.201 0.363 19845 1741 1 6 . 1 1 27 27 LEU H H 27 8.453 8.453 8.355 0.098 19845 1742 1 6 . 1 1 28 28 LEU N N 28 119.385 119.385 119.778 -0.393 19845 1743 1 6 . 1 1 28 28 LEU HA H 28 3.799 3.799 3.844 -0.045 19845 1744 1 6 . 1 1 28 28 LEU C C 28 175.881 175.881 179.174 -3.293 19845 1745 1 6 . 1 1 28 28 LEU CA C 28 58.492 58.492 57.974 0.518 19845 1746 1 6 . 1 1 28 28 LEU CB C 28 41.760 41.760 41.349 0.411 19845 1747 1 6 . 1 1 28 28 LEU H H 28 8.248 8.248 8.314 -0.066 19845 1748 1 6 . 1 1 29 29 VAL N N 29 118.515 118.515 117.761 0.754 19845 1749 1 6 . 1 1 29 29 VAL HA H 29 3.319 3.319 3.723 -0.404 19845 1750 1 6 . 1 1 29 29 VAL C C 29 174.734 174.734 177.877 -3.143 19845 1751 1 6 . 1 1 29 29 VAL CA C 29 67.192 67.192 65.500 1.692 19845 1752 1 6 . 1 1 29 29 VAL CB C 29 31.175 31.175 31.267 -0.092 19845 1753 1 6 . 1 1 29 29 VAL H H 29 8.446 8.446 7.248 1.198 19845 1754 1 6 . 1 1 30 30 THR N N 30 117.313 117.313 116.801 0.512 19845 1755 1 6 . 1 1 30 30 THR HA H 30 3.432 3.432 3.886 -0.454 19845 1756 1 6 . 1 1 30 30 THR CA C 30 68.606 68.606 66.878 1.728 19845 1757 1 6 . 1 1 30 30 THR CB C 30 67.147 67.147 68.443 -1.296 19845 1758 1 6 . 1 1 30 30 THR H H 30 7.923 7.923 8.057 -0.134 19845 1759 1 6 . 1 1 31 31 LEU N N 31 120.629 120.629 120.757 -0.128 19845 1760 1 6 . 1 1 31 31 LEU HA H 31 3.858 3.858 3.877 -0.019 19845 1761 1 6 . 1 1 31 31 LEU C C 31 177.164 177.164 178.414 -1.250 19845 1762 1 6 . 1 1 31 31 LEU CA C 31 58.145 58.145 57.770 0.375 19845 1763 1 6 . 1 1 31 31 LEU CB C 31 41.615 41.615 41.523 0.092 19845 1764 1 6 . 1 1 31 31 LEU H H 31 8.382 8.382 8.006 0.376 19845 1765 1 6 . 1 1 32 32 ALA N N 32 125.216 125.216 121.597 3.619 19845 1766 1 6 . 1 1 32 32 ALA HA H 32 3.836 3.836 3.897 -0.061 19845 1767 1 6 . 1 1 32 32 ALA C C 32 175.968 175.968 180.505 -4.537 19845 1768 1 6 . 1 1 32 32 ALA CA C 32 55.918 55.918 54.812 1.107 19845 1769 1 6 . 1 1 32 32 ALA CB C 32 17.802 17.802 18.116 -0.314 19845 1770 1 6 . 1 1 32 32 ALA H H 32 8.517 8.517 7.565 0.952 19845 1771 1 6 . 1 1 33 33 ILE N N 33 118.722 118.722 118.948 -0.226 19845 1772 1 6 . 1 1 33 33 ILE HA H 33 3.481 3.481 3.538 -0.057 19845 1773 1 6 . 1 1 33 33 ILE C C 33 175.004 175.004 178.040 -3.036 19845 1774 1 6 . 1 1 33 33 ILE CA C 33 65.554 65.554 65.076 0.478 19845 1775 1 6 . 1 1 33 33 ILE CB C 33 37.657 37.657 37.377 0.280 19845 1776 1 6 . 1 1 33 33 ILE H H 33 8.288 8.288 7.555 0.733 19845 1777 1 6 . 1 1 34 34 LEU N N 34 118.987 118.987 119.771 -0.784 19845 1778 1 6 . 1 1 34 34 LEU HA H 34 3.893 3.893 3.915 -0.022 19845 1779 1 6 . 1 1 34 34 LEU C C 34 176.439 176.439 178.467 -2.028 19845 1780 1 6 . 1 1 34 34 LEU CA C 34 58.436 58.436 57.836 0.600 19845 1781 1 6 . 1 1 34 34 LEU CB C 34 42.152 42.152 41.545 0.607 19845 1782 1 6 . 1 1 34 34 LEU H H 34 8.493 8.493 8.075 0.418 19845 1783 1 6 . 1 1 35 35 THR N N 35 116.630 116.630 114.955 1.675 19845 1784 1 6 . 1 1 35 35 THR HA H 35 3.652 3.652 3.873 -0.221 19845 1785 1 6 . 1 1 35 35 THR C C 35 173.366 173.366 175.984 -2.618 19845 1786 1 6 . 1 1 35 35 THR CA C 35 68.153 68.153 66.659 1.494 19845 1787 1 6 . 1 1 35 35 THR CB C 35 68.162 68.162 68.540 -0.378 19845 1788 1 6 . 1 1 35 35 THR H H 35 8.215 8.215 8.171 0.044 19845 1789 1 6 . 1 1 36 36 ALA N N 36 124.667 124.667 123.392 1.275 19845 1790 1 6 . 1 1 36 36 ALA HA H 36 3.864 3.864 3.933 -0.069 19845 1791 1 6 . 1 1 36 36 ALA C C 36 176.510 176.510 179.366 -2.856 19845 1792 1 6 . 1 1 36 36 ALA CA C 36 55.758 55.758 55.144 0.614 19845 1793 1 6 . 1 1 36 36 ALA CB C 36 18.054 18.054 18.193 -0.139 19845 1794 1 6 . 1 1 36 36 ALA H H 36 8.358 8.358 8.058 0.300 19845 1795 1 6 . 1 1 37 37 LEU N N 37 116.565 116.565 117.855 -1.290 19845 1796 1 6 . 1 1 37 37 LEU HA H 37 3.973 3.973 4.104 -0.131 19845 1797 1 6 . 1 1 37 37 LEU C C 37 176.538 176.538 179.181 -2.643 19845 1798 1 6 . 1 1 37 37 LEU CA C 37 57.853 57.853 57.271 0.582 19845 1799 1 6 . 1 1 37 37 LEU CB C 37 42.018 42.018 40.591 1.427 19845 1800 1 6 . 1 1 37 37 LEU H H 37 8.360 8.360 7.543 0.817 19845 1801 1 6 . 1 1 38 38 ARG N N 38 119.392 119.392 119.843 -0.451 19845 1802 1 6 . 1 1 38 38 ARG HA H 38 4.104 4.104 4.047 0.057 19845 1803 1 6 . 1 1 38 38 ARG C C 38 176.208 176.208 179.282 -3.074 19845 1804 1 6 . 1 1 38 38 ARG CA C 38 58.100 58.100 59.026 -0.926 19845 1805 1 6 . 1 1 38 38 ARG CB C 38 29.502 29.502 29.627 -0.125 19845 1806 1 6 . 1 1 38 38 ARG H H 38 8.082 8.082 7.398 0.684 19845 1807 1 6 . 1 1 39 39 LEU N N 39 120.438 120.438 118.153 2.285 19845 1808 1 6 . 1 1 39 39 LEU HA H 39 4.243 4.243 3.931 0.312 19845 1809 1 6 . 1 1 39 39 LEU C C 39 175.702 175.702 178.886 -3.184 19845 1810 1 6 . 1 1 39 39 LEU CA C 39 56.979 56.979 58.353 -1.374 19845 1811 1 6 . 1 1 39 39 LEU CB C 39 41.893 41.893 41.537 0.356 19845 1812 1 6 . 1 1 39 39 LEU H H 39 8.446 8.446 7.783 0.663 19845 1813 1 6 . 1 1 40 40 ALA N N 40 122.512 122.512 120.644 1.868 19845 1814 1 6 . 1 1 40 40 ALA HA H 40 3.975 3.975 4.085 -0.110 19845 1815 1 6 . 1 1 40 40 ALA C C 40 175.838 175.838 179.675 -3.837 19845 1816 1 6 . 1 1 40 40 ALA CA C 40 54.710 54.710 54.501 0.209 19845 1817 1 6 . 1 1 40 40 ALA CB C 40 18.319 18.319 18.095 0.224 19845 1818 1 6 . 1 1 40 40 ALA H H 40 8.321 8.321 7.376 0.945 19845 1819 1 6 . 1 1 41 41 ALA N N 41 119.754 119.754 121.827 -2.073 19845 1820 1 6 . 1 1 41 41 ALA HA H 41 4.024 4.024 4.167 -0.143 19845 1821 1 6 . 1 1 41 41 ALA C C 41 176.517 176.517 179.670 -3.153 19845 1822 1 6 . 1 1 41 41 ALA CA C 41 54.486 54.486 54.724 -0.238 19845 1823 1 6 . 1 1 41 41 ALA CB C 41 18.468 18.468 18.451 0.017 19845 1824 1 6 . 1 1 41 41 ALA H H 41 8.038 8.038 8.198 -0.160 19845 1825 1 6 . 1 1 42 42 TYR N N 42 118.272 118.272 118.270 0.002 19845 1826 1 6 . 1 1 42 42 TYR HA H 42 4.326 4.326 4.277 0.049 19845 1827 1 6 . 1 1 42 42 TYR C C 42 174.633 174.633 177.710 -3.077 19845 1828 1 6 . 1 1 42 42 TYR CA C 42 60.098 60.098 59.586 0.512 19845 1829 1 6 . 1 1 42 42 TYR CB C 42 38.936 38.936 37.403 1.533 19845 1830 1 6 . 1 1 42 42 TYR H H 42 7.814 7.814 7.924 -0.110 19845 1831 1 6 . 1 1 43 43 ALA N N 43 122.908 122.908 121.729 1.179 19845 1832 1 6 . 1 1 43 43 ALA HA H 43 4.111 4.111 4.172 -0.061 19845 1833 1 6 . 1 1 43 43 ALA C C 43 175.241 175.241 178.316 -3.075 19845 1834 1 6 . 1 1 43 43 ALA CA C 43 53.842 53.842 54.172 -0.330 19845 1835 1 6 . 1 1 43 43 ALA CB C 43 18.427 18.427 17.779 0.648 19845 1836 1 6 . 1 1 43 43 ALA H H 43 8.172 8.172 7.512 0.660 19845 1837 1 6 . 1 1 44 44 ALA N N 44 119.906 119.906 119.235 0.671 19845 1838 1 6 . 1 1 44 44 ALA HA H 44 4.051 4.051 4.229 -0.178 19845 1839 1 6 . 1 1 44 44 ALA C C 44 175.092 175.092 178.246 -3.154 19845 1840 1 6 . 1 1 44 44 ALA CA C 44 53.611 53.611 53.594 0.017 19845 1841 1 6 . 1 1 44 44 ALA CB C 44 18.689 18.689 19.018 -0.330 19845 1842 1 6 . 1 1 44 44 ALA H H 44 7.953 7.953 7.616 0.337 19845 1843 1 6 . 1 1 45 45 ASN N N 45 114.984 114.984 117.417 -2.433 19845 1844 1 6 . 1 1 45 45 ASN HA H 45 4.541 4.541 4.782 -0.241 19845 1845 1 6 . 1 1 45 45 ASN CA C 45 54.506 54.506 54.554 -0.048 19845 1846 1 6 . 1 1 45 45 ASN CB C 45 38.602 38.602 40.060 -1.458 19845 1847 1 6 . 1 1 45 45 ASN H H 45 7.847 7.847 8.205 -0.358 19845 1848 1 6 . 1 1 46 46 ILE N N 46 119.155 119.155 117.710 1.445 19845 1849 1 6 . 1 1 46 46 ILE HA H 46 4.033 4.033 4.351 -0.318 19845 1850 1 6 . 1 1 46 46 ILE C C 46 173.344 173.344 175.494 -2.150 19845 1851 1 6 . 1 1 46 46 ILE CA C 46 62.357 62.357 61.929 0.427 19845 1852 1 6 . 1 1 46 46 ILE CB C 46 38.657 38.657 38.642 0.015 19845 1853 1 6 . 1 1 46 46 ILE H H 46 7.790 7.790 7.667 0.123 19845 1854 1 6 . 1 1 47 47 VAL N N 47 117.526 117.526 114.371 3.155 19845 1855 1 6 . 1 1 47 47 VAL HA H 47 4.133 4.133 4.390 -0.257 19845 1856 1 6 . 1 1 47 47 VAL C C 47 172.672 172.672 174.847 -2.175 19845 1857 1 6 . 1 1 47 47 VAL CA C 47 62.149 62.149 59.619 2.530 19845 1858 1 6 . 1 1 47 47 VAL CB C 47 32.807 32.807 33.727 -0.921 19845 1859 1 6 . 1 1 47 47 VAL H H 47 7.582 7.582 7.579 0.003 19845 1860 1 6 . 1 1 48 48 ASN N N 48 120.091 120.091 121.081 -0.990 19845 1861 1 6 . 1 1 48 48 ASN HA H 48 4.658 4.658 4.862 -0.204 19845 1862 1 6 . 1 1 48 48 ASN CA C 48 53.478 53.478 53.822 -0.344 19845 1863 1 6 . 1 1 48 48 ASN CB C 48 38.573 38.573 36.420 2.152 19845 1864 1 6 . 1 1 48 48 ASN H H 48 8.053 8.053 8.541 -0.488 19845 1865 1 6 . 1 1 49 49 VAL N N 49 118.854 118.854 119.691 -0.837 19845 1866 1 6 . 1 1 49 49 VAL HA H 49 4.133 4.133 4.282 -0.149 19845 1867 1 6 . 1 1 49 49 VAL C C 49 172.595 172.595 173.499 -0.904 19845 1868 1 6 . 1 1 49 49 VAL CA C 49 62.049 62.049 60.561 1.488 19845 1869 1 6 . 1 1 49 49 VAL CB C 49 33.271 33.271 33.448 -0.177 19845 1870 1 6 . 1 1 49 49 VAL H H 49 7.685 7.685 8.044 -0.359 19845 1871 1 6 . 1 1 50 50 SER N N 50 118.689 118.689 121.989 -3.300 19845 1872 1 6 . 1 1 50 50 SER HA H 50 4.466 4.466 4.264 0.202 19845 1873 1 6 . 1 1 50 50 SER C C 50 171.430 171.430 172.443 -1.013 19845 1874 1 6 . 1 1 50 50 SER CA C 50 58.128 58.128 57.455 0.673 19845 1875 1 6 . 1 1 50 50 SER CB C 50 63.916 63.916 64.415 -0.499 19845 1876 1 6 . 1 1 50 50 SER H H 50 8.075 8.075 8.153 -0.078 19845 1877 1 6 . 1 1 51 51 LEU N N 51 123.536 123.536 120.787 2.749 19845 1878 1 6 . 1 1 51 51 LEU HA H 51 4.305 4.305 4.667 -0.362 19845 1879 1 6 . 1 1 51 51 LEU C C 51 174.110 174.110 175.031 -0.921 19845 1880 1 6 . 1 1 51 51 LEU CA C 51 55.145 55.145 53.875 1.270 19845 1881 1 6 . 1 1 51 51 LEU CB C 51 42.674 42.674 45.587 -2.913 19845 1882 1 6 . 1 1 51 51 LEU H H 51 7.991 7.991 8.201 -0.210 19845 1883 1 6 . 1 1 52 52 VAL N N 52 119.649 119.649 119.698 -0.049 19845 1884 1 6 . 1 1 52 52 VAL HA H 52 3.992 3.992 4.274 -0.282 19845 1885 1 6 . 1 1 52 52 VAL C C 52 172.476 172.476 176.671 -4.195 19845 1886 1 6 . 1 1 52 52 VAL CA C 52 62.772 62.772 62.627 0.145 19845 1887 1 6 . 1 1 52 52 VAL CB C 52 33.066 33.066 32.428 0.638 19845 1888 1 6 . 1 1 52 52 VAL H H 52 7.536 7.536 8.212 -0.676 19845 1889 1 6 . 1 1 53 53 LYS N N 53 122.004 122.004 122.412 -0.408 19845 1890 1 6 . 1 1 53 53 LYS HA H 53 4.354 4.354 4.210 0.144 19845 1891 1 6 . 1 1 53 53 LYS CA C 53 56.567 56.567 59.720 -3.153 19845 1892 1 6 . 1 1 53 53 LYS CB C 53 31.689 31.689 30.282 1.407 19845 1893 1 6 . 1 1 53 53 LYS H H 53 8.038 8.038 8.412 -0.374 19845 1894 1 6 . 1 1 54 54 PRO HA H 54 4.353 4.353 4.473 -0.120 19845 1895 1 6 . 1 1 54 54 PRO CA C 54 65.103 65.103 64.952 0.151 19845 1896 1 6 . 1 1 54 54 PRO CB C 54 32.193 32.193 30.922 1.271 19845 1897 1 6 . 1 1 55 55 THR N N 55 111.485 111.485 110.812 0.673 19845 1898 1 6 . 1 1 55 55 THR HA H 55 3.910 3.910 4.735 -0.825 19845 1899 1 6 . 1 1 55 55 THR C C 55 172.822 172.822 176.567 -3.745 19845 1900 1 6 . 1 1 55 55 THR CA C 55 65.030 65.030 63.440 1.590 19845 1901 1 6 . 1 1 55 55 THR CB C 55 68.882 68.882 69.222 -0.340 19845 1902 1 6 . 1 1 55 55 THR H H 55 7.722 7.722 7.550 0.172 19845 1903 1 6 . 1 1 56 56 VAL N N 56 121.165 121.165 120.087 1.078 19845 1904 1 6 . 1 1 56 56 VAL HA H 56 3.772 3.772 3.713 0.059 19845 1905 1 6 . 1 1 56 56 VAL C C 56 174.904 174.904 176.785 -1.881 19845 1906 1 6 . 1 1 56 56 VAL CA C 56 64.971 64.971 65.989 -1.018 19845 1907 1 6 . 1 1 56 56 VAL CB C 56 31.989 31.989 30.975 1.014 19845 1908 1 6 . 1 1 56 56 VAL H H 56 7.597 7.597 7.589 0.008 19845 1909 1 6 . 1 1 57 57 TYR N N 57 122.177 122.177 117.915 4.262 19845 1910 1 6 . 1 1 57 57 TYR HA H 57 4.227 4.227 4.215 0.012 19845 1911 1 6 . 1 1 57 57 TYR C C 57 174.969 174.969 177.103 -2.134 19845 1912 1 6 . 1 1 57 57 TYR CA C 57 60.755 60.755 59.466 1.289 19845 1913 1 6 . 1 1 57 57 TYR CB C 57 38.453 38.453 36.802 1.651 19845 1914 1 6 . 1 1 57 57 TYR H H 57 7.964 7.964 8.094 -0.130 19845 1915 1 6 . 1 1 58 58 VAL N N 58 119.069 119.069 119.384 -0.315 19845 1916 1 6 . 1 1 58 58 VAL HA H 58 3.529 3.529 3.271 0.258 19845 1917 1 6 . 1 1 58 58 VAL C C 58 174.250 174.250 177.213 -2.963 19845 1918 1 6 . 1 1 58 58 VAL CA C 58 66.223 66.223 65.030 1.193 19845 1919 1 6 . 1 1 58 58 VAL CB C 58 31.803 31.803 30.730 1.073 19845 1920 1 6 . 1 1 58 58 VAL H H 58 8.018 8.018 7.283 0.735 19845 1921 1 6 . 1 1 59 59 TYR N N 59 120.360 120.360 120.994 -0.634 19845 1922 1 6 . 1 1 59 59 TYR HA H 59 4.115 4.115 3.954 0.161 19845 1923 1 6 . 1 1 59 59 TYR C C 59 173.899 173.899 177.726 -3.827 19845 1924 1 6 . 1 1 59 59 TYR CA C 59 60.929 60.929 61.277 -0.348 19845 1925 1 6 . 1 1 59 59 TYR CB C 59 38.602 38.602 37.769 0.833 19845 1926 1 6 . 1 1 59 59 TYR H H 59 8.142 8.142 7.838 0.304 19845 1927 1 6 . 1 1 60 60 SER N N 60 113.480 113.480 113.517 -0.037 19845 1928 1 6 . 1 1 60 60 SER HA H 60 3.979 3.979 3.942 0.037 19845 1929 1 6 . 1 1 60 60 SER C C 60 172.887 172.887 176.916 -4.029 19845 1930 1 6 . 1 1 60 60 SER CA C 60 60.987 60.987 61.722 -0.735 19845 1931 1 6 . 1 1 60 60 SER CB C 60 63.267 63.267 62.732 0.535 19845 1932 1 6 . 1 1 60 60 SER H H 60 8.057 8.057 7.691 0.366 19845 1933 1 6 . 1 1 61 61 ARG N N 61 120.962 120.962 121.437 -0.475 19845 1934 1 6 . 1 1 61 61 ARG HA H 61 4.103 4.103 3.934 0.169 19845 1935 1 6 . 1 1 61 61 ARG C C 61 175.399 175.399 178.805 -3.406 19845 1936 1 6 . 1 1 61 61 ARG CA C 61 57.427 57.427 59.427 -2.000 19845 1937 1 6 . 1 1 61 61 ARG CB C 61 30.008 30.008 30.096 -0.088 19845 1938 1 6 . 1 1 61 61 ARG H H 61 7.606 7.606 7.244 0.362 19845 1939 1 6 . 1 1 62 62 VAL N N 62 117.852 117.852 119.987 -2.135 19845 1940 1 6 . 1 1 62 62 VAL HA H 62 3.805 3.805 3.651 0.154 19845 1941 1 6 . 1 1 62 62 VAL C C 62 174.155 174.155 177.753 -3.598 19845 1942 1 6 . 1 1 62 62 VAL CA C 62 64.458 64.458 66.249 -1.791 19845 1943 1 6 . 1 1 62 62 VAL CB C 62 31.969 31.969 31.518 0.451 19845 1944 1 6 . 1 1 62 62 VAL H H 62 7.848 7.848 8.247 -0.399 19845 1945 1 6 . 1 1 63 63 LYS N N 63 119.254 119.254 119.146 0.108 19845 1946 1 6 . 1 1 63 63 LYS HA H 63 4.051 4.051 3.989 0.062 19845 1947 1 6 . 1 1 63 63 LYS C C 63 173.615 173.615 178.414 -4.799 19845 1948 1 6 . 1 1 63 63 LYS CA C 63 56.727 56.727 58.545 -1.818 19845 1949 1 6 . 1 1 63 63 LYS CB C 63 32.105 32.105 32.534 -0.429 19845 1950 1 6 . 1 1 63 63 LYS H H 63 7.759 7.759 7.593 0.166 19845 1951 1 6 . 1 1 64 64 ASN N N 64 117.696 117.696 116.746 0.950 19845 1952 1 6 . 1 1 64 64 ASN HA H 64 4.642 4.642 4.443 0.199 19845 1953 1 6 . 1 1 64 64 ASN C C 64 171.750 171.750 175.904 -4.154 19845 1954 1 6 . 1 1 64 64 ASN CA C 64 53.313 53.313 55.148 -1.835 19845 1955 1 6 . 1 1 64 64 ASN CB C 64 39.260 39.260 39.185 0.075 19845 1956 1 6 . 1 1 64 64 ASN H H 64 7.615 7.615 8.099 -0.484 19845 1957 1 7 . 1 1 9 9 THR N N 9 113.692 113.692 114.986 -1.294 19845 1958 1 7 . 1 1 9 9 THR HA H 9 4.213 4.213 4.577 -0.364 19845 1959 1 7 . 1 1 9 9 THR C C 9 172.757 172.757 175.154 -2.397 19845 1960 1 7 . 1 1 9 9 THR CA C 9 62.810 62.810 62.400 0.410 19845 1961 1 7 . 1 1 9 9 THR CB C 9 69.878 69.878 69.201 0.677 19845 1962 1 7 . 1 1 9 9 THR H H 9 7.930 7.930 8.545 -0.615 19845 1963 1 7 . 1 1 10 10 GLY N N 10 110.842 110.842 108.932 1.910 19845 1964 1 7 . 1 1 10 10 GLY C C 10 171.923 171.923 173.825 -1.902 19845 1965 1 7 . 1 1 10 10 GLY CA C 10 46.099 46.099 44.571 1.528 19845 1966 1 7 . 1 1 10 10 GLY H H 10 8.266 8.266 7.967 0.299 19845 1967 1 7 . 1 1 11 11 THR N N 11 113.754 113.754 118.192 -4.438 19845 1968 1 7 . 1 1 11 11 THR HA H 11 4.220 4.220 4.442 -0.222 19845 1969 1 7 . 1 1 11 11 THR C C 11 171.906 171.906 174.743 -2.837 19845 1970 1 7 . 1 1 11 11 THR CA C 11 62.721 62.721 62.841 -0.120 19845 1971 1 7 . 1 1 11 11 THR CB C 11 69.549 69.549 68.840 0.709 19845 1972 1 7 . 1 1 11 11 THR H H 11 7.753 7.753 7.961 -0.208 19845 1973 1 7 . 1 1 12 12 LEU N N 12 123.669 123.669 124.351 -0.682 19845 1974 1 7 . 1 1 12 12 LEU HA H 12 4.240 4.240 4.825 -0.585 19845 1975 1 7 . 1 1 12 12 LEU C C 12 175.221 175.221 177.340 -2.119 19845 1976 1 7 . 1 1 12 12 LEU CA C 12 56.799 56.799 55.294 1.505 19845 1977 1 7 . 1 1 12 12 LEU CB C 12 42.536 42.536 41.804 0.732 19845 1978 1 7 . 1 1 12 12 LEU H H 12 7.980 7.980 8.396 -0.416 19845 1979 1 7 . 1 1 13 13 ILE N N 13 120.086 120.086 120.468 -0.382 19845 1980 1 7 . 1 1 13 13 ILE HA H 13 3.913 3.913 4.078 -0.165 19845 1981 1 7 . 1 1 13 13 ILE C C 13 173.425 173.425 177.480 -4.055 19845 1982 1 7 . 1 1 13 13 ILE CA C 13 62.889 62.889 63.391 -0.502 19845 1983 1 7 . 1 1 13 13 ILE CB C 13 38.249 38.249 38.445 -0.196 19845 1984 1 7 . 1 1 13 13 ILE H H 13 7.861 7.861 7.768 0.093 19845 1985 1 7 . 1 1 14 14 VAL N N 14 119.785 119.785 120.426 -0.641 19845 1986 1 7 . 1 1 14 14 VAL HA H 14 3.790 3.790 3.785 0.005 19845 1987 1 7 . 1 1 14 14 VAL C C 14 173.429 173.429 177.028 -3.599 19845 1988 1 7 . 1 1 14 14 VAL CA C 14 64.409 64.409 65.330 -0.921 19845 1989 1 7 . 1 1 14 14 VAL CB C 14 32.007 32.007 31.355 0.652 19845 1990 1 7 . 1 1 14 14 VAL H H 14 7.549 7.549 8.029 -0.480 19845 1991 1 7 . 1 1 15 15 ASN N N 15 119.567 119.567 115.910 3.657 19845 1992 1 7 . 1 1 15 15 ASN HA H 15 4.549 4.549 4.632 -0.083 19845 1993 1 7 . 1 1 15 15 ASN C C 15 173.619 173.619 177.062 -3.443 19845 1994 1 7 . 1 1 15 15 ASN CA C 15 54.805 54.805 55.350 -0.545 19845 1995 1 7 . 1 1 15 15 ASN CB C 15 38.824 38.824 38.344 0.480 19845 1996 1 7 . 1 1 15 15 ASN H H 15 8.010 8.010 8.400 -0.390 19845 1997 1 7 . 1 1 16 16 SER N N 16 116.730 116.730 116.832 -0.102 19845 1998 1 7 . 1 1 16 16 SER HA H 16 4.177 4.177 4.401 -0.224 19845 1999 1 7 . 1 1 16 16 SER CA C 16 61.705 61.705 61.295 0.410 19845 2000 1 7 . 1 1 16 16 SER CB C 16 63.752 63.752 63.252 0.500 19845 2001 1 7 . 1 1 16 16 SER H H 16 8.039 8.039 7.474 0.565 19845 2002 1 7 . 1 1 17 17 VAL N N 17 122.062 122.062 122.083 -0.021 19845 2003 1 7 . 1 1 17 17 VAL HA H 17 3.677 3.677 3.802 -0.125 19845 2004 1 7 . 1 1 17 17 VAL C C 17 174.474 174.474 177.575 -3.101 19845 2005 1 7 . 1 1 17 17 VAL CA C 17 66.671 66.671 66.231 0.440 19845 2006 1 7 . 1 1 17 17 VAL CB C 17 31.531 31.531 31.640 -0.109 19845 2007 1 7 . 1 1 17 17 VAL H H 17 7.896 7.896 8.429 -0.533 19845 2008 1 7 . 1 1 18 18 LEU N N 18 119.103 119.103 119.551 -0.448 19845 2009 1 7 . 1 1 18 18 LEU HA H 18 3.998 3.998 4.139 -0.141 19845 2010 1 7 . 1 1 18 18 LEU C C 18 175.511 175.511 178.229 -2.718 19845 2011 1 7 . 1 1 18 18 LEU CA C 18 58.107 58.107 58.084 0.023 19845 2012 1 7 . 1 1 18 18 LEU CB C 18 41.593 41.593 42.042 -0.449 19845 2013 1 7 . 1 1 18 18 LEU H H 18 7.857 7.857 7.432 0.425 19845 2014 1 7 . 1 1 19 19 LEU N N 19 118.291 118.291 119.246 -0.955 19845 2015 1 7 . 1 1 19 19 LEU HA H 19 4.152 4.152 4.017 0.135 19845 2016 1 7 . 1 1 19 19 LEU C C 19 175.156 175.156 178.921 -3.765 19845 2017 1 7 . 1 1 19 19 LEU CA C 19 58.011 58.011 57.612 0.399 19845 2018 1 7 . 1 1 19 19 LEU CB C 19 42.027 42.027 41.827 0.200 19845 2019 1 7 . 1 1 19 19 LEU H H 19 7.745 7.745 7.418 0.327 19845 2020 1 7 . 1 1 20 20 PHE N N 20 118.415 118.415 119.857 -1.442 19845 2021 1 7 . 1 1 20 20 PHE HA H 20 4.188 4.188 4.087 0.101 19845 2022 1 7 . 1 1 20 20 PHE C C 20 174.260 174.260 177.487 -3.227 19845 2023 1 7 . 1 1 20 20 PHE CA C 20 61.626 61.626 62.051 -0.425 19845 2024 1 7 . 1 1 20 20 PHE CB C 20 38.643 38.643 38.942 -0.299 19845 2025 1 7 . 1 1 20 20 PHE H H 20 8.002 8.002 8.595 -0.593 19845 2026 1 7 . 1 1 21 21 LEU N N 21 118.571 118.571 120.121 -1.550 19845 2027 1 7 . 1 1 21 21 LEU HA H 21 3.797 3.797 4.102 -0.305 19845 2028 1 7 . 1 1 21 21 LEU C C 21 175.324 175.324 178.451 -3.127 19845 2029 1 7 . 1 1 21 21 LEU CA C 21 58.128 58.128 58.965 -0.837 19845 2030 1 7 . 1 1 21 21 LEU CB C 21 41.957 41.957 41.855 0.102 19845 2031 1 7 . 1 1 21 21 LEU H H 21 8.456 8.456 7.757 0.699 19845 2032 1 7 . 1 1 22 22 ALA N N 22 120.775 120.775 121.133 -0.358 19845 2033 1 7 . 1 1 22 22 ALA HA H 22 3.779 3.779 4.188 -0.409 19845 2034 1 7 . 1 1 22 22 ALA C C 22 175.697 175.697 180.021 -4.324 19845 2035 1 7 . 1 1 22 22 ALA CA C 22 55.721 55.721 54.692 1.029 19845 2036 1 7 . 1 1 22 22 ALA CB C 22 17.788 17.788 18.226 -0.438 19845 2037 1 7 . 1 1 22 22 ALA H H 22 8.353 8.353 7.550 0.803 19845 2038 1 7 . 1 1 23 23 PHE N N 23 117.860 117.860 119.615 -1.755 19845 2039 1 7 . 1 1 23 23 PHE HA H 23 4.108 4.108 4.186 -0.078 19845 2040 1 7 . 1 1 23 23 PHE C C 23 173.859 173.859 176.969 -3.110 19845 2041 1 7 . 1 1 23 23 PHE CA C 23 61.271 61.271 61.855 -0.584 19845 2042 1 7 . 1 1 23 23 PHE CB C 23 38.853 38.853 39.691 -0.838 19845 2043 1 7 . 1 1 23 23 PHE H H 23 8.121 8.121 8.338 -0.217 19845 2044 1 7 . 1 1 24 24 VAL N N 24 119.181 119.181 119.665 -0.484 19845 2045 1 7 . 1 1 24 24 VAL HA H 24 3.134 3.134 3.439 -0.305 19845 2046 1 7 . 1 1 24 24 VAL C C 24 174.684 174.684 177.774 -3.090 19845 2047 1 7 . 1 1 24 24 VAL CA C 24 67.419 67.419 67.420 -0.001 19845 2048 1 7 . 1 1 24 24 VAL CB C 24 31.106 31.106 31.755 -0.649 19845 2049 1 7 . 1 1 24 24 VAL H H 24 8.124 8.124 8.072 0.052 19845 2050 1 7 . 1 1 25 25 VAL N N 25 119.215 119.215 116.527 2.688 19845 2051 1 7 . 1 1 25 25 VAL HA H 25 3.324 3.324 3.543 -0.219 19845 2052 1 7 . 1 1 25 25 VAL C C 25 174.244 174.244 177.684 -3.440 19845 2053 1 7 . 1 1 25 25 VAL CA C 25 67.740 67.740 66.012 1.728 19845 2054 1 7 . 1 1 25 25 VAL CB C 25 31.270 31.270 31.310 -0.040 19845 2055 1 7 . 1 1 25 25 VAL H H 25 8.250 8.250 7.455 0.795 19845 2056 1 7 . 1 1 26 26 PHE N N 26 119.875 119.875 119.421 0.454 19845 2057 1 7 . 1 1 26 26 PHE HA H 26 3.900 3.900 4.153 -0.253 19845 2058 1 7 . 1 1 26 26 PHE C C 26 175.371 175.371 177.833 -2.462 19845 2059 1 7 . 1 1 26 26 PHE CA C 26 61.651 61.651 62.331 -0.680 19845 2060 1 7 . 1 1 26 26 PHE CB C 26 38.760 38.760 38.966 -0.206 19845 2061 1 7 . 1 1 26 26 PHE H H 26 8.413 8.413 7.332 1.081 19845 2062 1 7 . 1 1 27 27 LEU N N 27 122.548 122.548 119.579 2.969 19845 2063 1 7 . 1 1 27 27 LEU HA H 27 3.533 3.533 3.861 -0.328 19845 2064 1 7 . 1 1 27 27 LEU C C 27 175.256 175.256 179.074 -3.818 19845 2065 1 7 . 1 1 27 27 LEU CA C 27 58.211 58.211 57.831 0.380 19845 2066 1 7 . 1 1 27 27 LEU CB C 27 41.564 41.564 41.472 0.092 19845 2067 1 7 . 1 1 27 27 LEU H H 27 8.453 8.453 8.474 -0.021 19845 2068 1 7 . 1 1 28 28 LEU N N 28 119.385 119.385 119.758 -0.373 19845 2069 1 7 . 1 1 28 28 LEU HA H 28 3.799 3.799 3.907 -0.108 19845 2070 1 7 . 1 1 28 28 LEU C C 28 175.881 175.881 179.288 -3.407 19845 2071 1 7 . 1 1 28 28 LEU CA C 28 58.492 58.492 58.020 0.472 19845 2072 1 7 . 1 1 28 28 LEU CB C 28 41.760 41.760 41.415 0.345 19845 2073 1 7 . 1 1 28 28 LEU H H 28 8.248 8.248 8.408 -0.160 19845 2074 1 7 . 1 1 29 29 VAL N N 29 118.515 118.515 117.702 0.813 19845 2075 1 7 . 1 1 29 29 VAL HA H 29 3.319 3.319 3.803 -0.484 19845 2076 1 7 . 1 1 29 29 VAL C C 29 174.734 174.734 177.771 -3.037 19845 2077 1 7 . 1 1 29 29 VAL CA C 29 67.192 67.192 65.189 2.003 19845 2078 1 7 . 1 1 29 29 VAL CB C 29 31.175 31.175 31.492 -0.318 19845 2079 1 7 . 1 1 29 29 VAL H H 29 8.446 8.446 7.272 1.174 19845 2080 1 7 . 1 1 30 30 THR N N 30 117.313 117.313 117.081 0.232 19845 2081 1 7 . 1 1 30 30 THR HA H 30 3.432 3.432 3.861 -0.429 19845 2082 1 7 . 1 1 30 30 THR CA C 30 68.606 68.606 66.982 1.624 19845 2083 1 7 . 1 1 30 30 THR CB C 30 67.147 67.147 68.460 -1.313 19845 2084 1 7 . 1 1 30 30 THR H H 30 7.923 7.923 8.191 -0.268 19845 2085 1 7 . 1 1 31 31 LEU N N 31 120.629 120.629 120.785 -0.156 19845 2086 1 7 . 1 1 31 31 LEU HA H 31 3.858 3.858 3.945 -0.087 19845 2087 1 7 . 1 1 31 31 LEU C C 31 177.164 177.164 178.564 -1.400 19845 2088 1 7 . 1 1 31 31 LEU CA C 31 58.145 58.145 57.589 0.556 19845 2089 1 7 . 1 1 31 31 LEU CB C 31 41.615 41.615 41.581 0.034 19845 2090 1 7 . 1 1 31 31 LEU H H 31 8.382 8.382 8.088 0.294 19845 2091 1 7 . 1 1 32 32 ALA N N 32 125.216 125.216 121.704 3.512 19845 2092 1 7 . 1 1 32 32 ALA HA H 32 3.836 3.836 3.907 -0.071 19845 2093 1 7 . 1 1 32 32 ALA C C 32 175.968 175.968 180.514 -4.546 19845 2094 1 7 . 1 1 32 32 ALA CA C 32 55.918 55.918 54.794 1.124 19845 2095 1 7 . 1 1 32 32 ALA CB C 32 17.802 17.802 18.127 -0.325 19845 2096 1 7 . 1 1 32 32 ALA H H 32 8.517 8.517 7.657 0.860 19845 2097 1 7 . 1 1 33 33 ILE N N 33 118.722 118.722 118.989 -0.267 19845 2098 1 7 . 1 1 33 33 ILE HA H 33 3.481 3.481 3.541 -0.060 19845 2099 1 7 . 1 1 33 33 ILE C C 33 175.004 175.004 178.047 -3.043 19845 2100 1 7 . 1 1 33 33 ILE CA C 33 65.554 65.554 65.117 0.437 19845 2101 1 7 . 1 1 33 33 ILE CB C 33 37.657 37.657 37.369 0.288 19845 2102 1 7 . 1 1 33 33 ILE H H 33 8.288 8.288 7.602 0.686 19845 2103 1 7 . 1 1 34 34 LEU N N 34 118.987 118.987 119.948 -0.961 19845 2104 1 7 . 1 1 34 34 LEU HA H 34 3.893 3.893 3.923 -0.030 19845 2105 1 7 . 1 1 34 34 LEU C C 34 176.439 176.439 178.436 -1.997 19845 2106 1 7 . 1 1 34 34 LEU CA C 34 58.436 58.436 57.943 0.493 19845 2107 1 7 . 1 1 34 34 LEU CB C 34 42.152 42.152 41.589 0.563 19845 2108 1 7 . 1 1 34 34 LEU H H 34 8.493 8.493 8.128 0.365 19845 2109 1 7 . 1 1 35 35 THR N N 35 116.630 116.630 115.609 1.021 19845 2110 1 7 . 1 1 35 35 THR HA H 35 3.652 3.652 3.889 -0.237 19845 2111 1 7 . 1 1 35 35 THR C C 35 173.366 173.366 175.796 -2.430 19845 2112 1 7 . 1 1 35 35 THR CA C 35 68.153 68.153 66.265 1.888 19845 2113 1 7 . 1 1 35 35 THR CB C 35 68.162 68.162 68.054 0.108 19845 2114 1 7 . 1 1 35 35 THR H H 35 8.215 8.215 8.170 0.045 19845 2115 1 7 . 1 1 36 36 ALA N N 36 124.667 124.667 123.225 1.442 19845 2116 1 7 . 1 1 36 36 ALA HA H 36 3.864 3.864 3.939 -0.075 19845 2117 1 7 . 1 1 36 36 ALA C C 36 176.510 176.510 179.166 -2.656 19845 2118 1 7 . 1 1 36 36 ALA CA C 36 55.758 55.758 55.067 0.691 19845 2119 1 7 . 1 1 36 36 ALA CB C 36 18.054 18.054 18.207 -0.153 19845 2120 1 7 . 1 1 36 36 ALA H H 36 8.358 8.358 8.009 0.349 19845 2121 1 7 . 1 1 37 37 LEU N N 37 116.565 116.565 117.975 -1.410 19845 2122 1 7 . 1 1 37 37 LEU HA H 37 3.973 3.973 4.104 -0.131 19845 2123 1 7 . 1 1 37 37 LEU C C 37 176.538 176.538 179.171 -2.633 19845 2124 1 7 . 1 1 37 37 LEU CA C 37 57.853 57.853 57.281 0.572 19845 2125 1 7 . 1 1 37 37 LEU CB C 37 42.018 42.018 40.596 1.423 19845 2126 1 7 . 1 1 37 37 LEU H H 37 8.360 8.360 7.543 0.817 19845 2127 1 7 . 1 1 38 38 ARG N N 38 119.392 119.392 119.779 -0.387 19845 2128 1 7 . 1 1 38 38 ARG HA H 38 4.104 4.104 4.077 0.027 19845 2129 1 7 . 1 1 38 38 ARG C C 38 176.208 176.208 179.350 -3.142 19845 2130 1 7 . 1 1 38 38 ARG CA C 38 58.100 58.100 58.942 -0.842 19845 2131 1 7 . 1 1 38 38 ARG CB C 38 29.502 29.502 29.629 -0.127 19845 2132 1 7 . 1 1 38 38 ARG H H 38 8.082 8.082 7.405 0.677 19845 2133 1 7 . 1 1 39 39 LEU N N 39 120.438 120.438 117.807 2.631 19845 2134 1 7 . 1 1 39 39 LEU HA H 39 4.243 4.243 3.925 0.318 19845 2135 1 7 . 1 1 39 39 LEU C C 39 175.702 175.702 178.777 -3.075 19845 2136 1 7 . 1 1 39 39 LEU CA C 39 56.979 56.979 57.552 -0.573 19845 2137 1 7 . 1 1 39 39 LEU CB C 39 41.893 41.893 41.155 0.738 19845 2138 1 7 . 1 1 39 39 LEU H H 39 8.446 8.446 7.824 0.622 19845 2139 1 7 . 1 1 40 40 ALA N N 40 122.512 122.512 121.056 1.456 19845 2140 1 7 . 1 1 40 40 ALA HA H 40 3.975 3.975 4.049 -0.074 19845 2141 1 7 . 1 1 40 40 ALA C C 40 175.838 175.838 179.500 -3.662 19845 2142 1 7 . 1 1 40 40 ALA CA C 40 54.710 54.710 54.498 0.212 19845 2143 1 7 . 1 1 40 40 ALA CB C 40 18.319 18.319 18.030 0.289 19845 2144 1 7 . 1 1 40 40 ALA H H 40 8.321 8.321 7.517 0.804 19845 2145 1 7 . 1 1 41 41 ALA N N 41 119.754 119.754 121.623 -1.869 19845 2146 1 7 . 1 1 41 41 ALA HA H 41 4.024 4.024 4.175 -0.151 19845 2147 1 7 . 1 1 41 41 ALA C C 41 176.517 176.517 179.656 -3.139 19845 2148 1 7 . 1 1 41 41 ALA CA C 41 54.486 54.486 54.665 -0.179 19845 2149 1 7 . 1 1 41 41 ALA CB C 41 18.468 18.468 18.535 -0.067 19845 2150 1 7 . 1 1 41 41 ALA H H 41 8.038 8.038 8.181 -0.143 19845 2151 1 7 . 1 1 42 42 TYR N N 42 118.272 118.272 118.293 -0.021 19845 2152 1 7 . 1 1 42 42 TYR HA H 42 4.326 4.326 4.282 0.044 19845 2153 1 7 . 1 1 42 42 TYR C C 42 174.633 174.633 177.704 -3.071 19845 2154 1 7 . 1 1 42 42 TYR CA C 42 60.098 60.098 59.559 0.540 19845 2155 1 7 . 1 1 42 42 TYR CB C 42 38.936 38.936 37.443 1.493 19845 2156 1 7 . 1 1 42 42 TYR H H 42 7.814 7.814 7.971 -0.157 19845 2157 1 7 . 1 1 43 43 ALA N N 43 122.908 122.908 121.845 1.063 19845 2158 1 7 . 1 1 43 43 ALA HA H 43 4.111 4.111 4.208 -0.097 19845 2159 1 7 . 1 1 43 43 ALA C C 43 175.241 175.241 178.347 -3.106 19845 2160 1 7 . 1 1 43 43 ALA CA C 43 53.842 53.842 54.289 -0.447 19845 2161 1 7 . 1 1 43 43 ALA CB C 43 18.427 18.427 17.628 0.799 19845 2162 1 7 . 1 1 43 43 ALA H H 43 8.172 8.172 7.506 0.666 19845 2163 1 7 . 1 1 44 44 ALA N N 44 119.906 119.906 119.074 0.832 19845 2164 1 7 . 1 1 44 44 ALA HA H 44 4.051 4.051 4.227 -0.176 19845 2165 1 7 . 1 1 44 44 ALA C C 44 175.092 175.092 178.246 -3.154 19845 2166 1 7 . 1 1 44 44 ALA CA C 44 53.611 53.611 53.604 0.007 19845 2167 1 7 . 1 1 44 44 ALA CB C 44 18.689 18.689 19.071 -0.382 19845 2168 1 7 . 1 1 44 44 ALA H H 44 7.953 7.953 7.719 0.234 19845 2169 1 7 . 1 1 45 45 ASN N N 45 114.984 114.984 117.068 -2.084 19845 2170 1 7 . 1 1 45 45 ASN HA H 45 4.541 4.541 4.785 -0.244 19845 2171 1 7 . 1 1 45 45 ASN CA C 45 54.506 54.506 54.715 -0.209 19845 2172 1 7 . 1 1 45 45 ASN CB C 45 38.602 38.602 40.040 -1.438 19845 2173 1 7 . 1 1 45 45 ASN H H 45 7.847 7.847 8.331 -0.484 19845 2174 1 7 . 1 1 46 46 ILE N N 46 119.155 119.155 116.749 2.406 19845 2175 1 7 . 1 1 46 46 ILE HA H 46 4.033 4.033 4.325 -0.292 19845 2176 1 7 . 1 1 46 46 ILE C C 46 173.344 173.344 175.290 -1.946 19845 2177 1 7 . 1 1 46 46 ILE CA C 46 62.357 62.357 61.644 0.713 19845 2178 1 7 . 1 1 46 46 ILE CB C 46 38.657 38.657 38.397 0.260 19845 2179 1 7 . 1 1 46 46 ILE H H 46 7.790 7.790 7.601 0.189 19845 2180 1 7 . 1 1 47 47 VAL N N 47 117.526 117.526 119.009 -1.483 19845 2181 1 7 . 1 1 47 47 VAL HA H 47 4.133 4.133 4.322 -0.189 19845 2182 1 7 . 1 1 47 47 VAL C C 47 172.672 172.672 174.901 -2.229 19845 2183 1 7 . 1 1 47 47 VAL CA C 47 62.149 62.149 59.862 2.287 19845 2184 1 7 . 1 1 47 47 VAL CB C 47 32.807 32.807 34.991 -2.184 19845 2185 1 7 . 1 1 47 47 VAL H H 47 7.582 7.582 7.689 -0.107 19845 2186 1 7 . 1 1 48 48 ASN N N 48 120.091 120.091 122.038 -1.947 19845 2187 1 7 . 1 1 48 48 ASN HA H 48 4.658 4.658 4.855 -0.197 19845 2188 1 7 . 1 1 48 48 ASN CA C 48 53.478 53.478 53.237 0.241 19845 2189 1 7 . 1 1 48 48 ASN CB C 48 38.573 38.573 37.412 1.161 19845 2190 1 7 . 1 1 48 48 ASN H H 48 8.053 8.053 8.527 -0.474 19845 2191 1 7 . 1 1 49 49 VAL N N 49 118.854 118.854 121.251 -2.397 19845 2192 1 7 . 1 1 49 49 VAL HA H 49 4.133 4.133 4.214 -0.081 19845 2193 1 7 . 1 1 49 49 VAL C C 49 172.595 172.595 174.090 -1.495 19845 2194 1 7 . 1 1 49 49 VAL CA C 49 62.049 62.049 60.992 1.057 19845 2195 1 7 . 1 1 49 49 VAL CB C 49 33.271 33.271 34.707 -1.436 19845 2196 1 7 . 1 1 49 49 VAL H H 49 7.685 7.685 7.847 -0.162 19845 2197 1 7 . 1 1 50 50 SER N N 50 118.689 118.689 120.550 -1.861 19845 2198 1 7 . 1 1 50 50 SER HA H 50 4.466 4.466 4.257 0.209 19845 2199 1 7 . 1 1 50 50 SER C C 50 171.430 171.430 172.566 -1.136 19845 2200 1 7 . 1 1 50 50 SER CA C 50 58.128 58.128 57.382 0.746 19845 2201 1 7 . 1 1 50 50 SER CB C 50 63.916 63.916 64.487 -0.571 19845 2202 1 7 . 1 1 50 50 SER H H 50 8.075 8.075 8.013 0.062 19845 2203 1 7 . 1 1 51 51 LEU N N 51 123.536 123.536 119.494 4.042 19845 2204 1 7 . 1 1 51 51 LEU HA H 51 4.305 4.305 4.625 -0.320 19845 2205 1 7 . 1 1 51 51 LEU C C 51 174.110 174.110 175.166 -1.056 19845 2206 1 7 . 1 1 51 51 LEU CA C 51 55.145 55.145 54.493 0.652 19845 2207 1 7 . 1 1 51 51 LEU CB C 51 42.674 42.674 43.953 -1.279 19845 2208 1 7 . 1 1 51 51 LEU H H 51 7.991 7.991 7.664 0.327 19845 2209 1 7 . 1 1 52 52 VAL N N 52 119.649 119.649 118.361 1.288 19845 2210 1 7 . 1 1 52 52 VAL HA H 52 3.992 3.992 4.328 -0.336 19845 2211 1 7 . 1 1 52 52 VAL C C 52 172.476 172.476 176.768 -4.292 19845 2212 1 7 . 1 1 52 52 VAL CA C 52 62.772 62.772 62.964 -0.192 19845 2213 1 7 . 1 1 52 52 VAL CB C 52 33.066 33.066 32.706 0.360 19845 2214 1 7 . 1 1 52 52 VAL H H 52 7.536 7.536 8.208 -0.672 19845 2215 1 7 . 1 1 53 53 LYS N N 53 122.004 122.004 122.306 -0.302 19845 2216 1 7 . 1 1 53 53 LYS HA H 53 4.354 4.354 4.199 0.155 19845 2217 1 7 . 1 1 53 53 LYS CA C 53 56.567 56.567 60.166 -3.599 19845 2218 1 7 . 1 1 53 53 LYS CB C 53 31.689 31.689 29.943 1.746 19845 2219 1 7 . 1 1 53 53 LYS H H 53 8.038 8.038 8.524 -0.486 19845 2220 1 7 . 1 1 54 54 PRO HA H 54 4.353 4.353 4.513 -0.160 19845 2221 1 7 . 1 1 54 54 PRO CA C 54 65.103 65.103 64.942 0.161 19845 2222 1 7 . 1 1 54 54 PRO CB C 54 32.193 32.193 30.962 1.231 19845 2223 1 7 . 1 1 55 55 THR N N 55 111.485 111.485 111.285 0.200 19845 2224 1 7 . 1 1 55 55 THR HA H 55 3.910 3.910 4.735 -0.825 19845 2225 1 7 . 1 1 55 55 THR C C 55 172.822 172.822 176.312 -3.490 19845 2226 1 7 . 1 1 55 55 THR CA C 55 65.030 65.030 63.212 1.818 19845 2227 1 7 . 1 1 55 55 THR CB C 55 68.882 68.882 68.995 -0.113 19845 2228 1 7 . 1 1 55 55 THR H H 55 7.722 7.722 7.509 0.213 19845 2229 1 7 . 1 1 56 56 VAL N N 56 121.165 121.165 120.461 0.704 19845 2230 1 7 . 1 1 56 56 VAL HA H 56 3.772 3.772 3.718 0.054 19845 2231 1 7 . 1 1 56 56 VAL C C 56 174.904 174.904 176.762 -1.858 19845 2232 1 7 . 1 1 56 56 VAL CA C 56 64.971 64.971 66.086 -1.115 19845 2233 1 7 . 1 1 56 56 VAL CB C 56 31.989 31.989 31.209 0.780 19845 2234 1 7 . 1 1 56 56 VAL H H 56 7.597 7.597 7.606 -0.009 19845 2235 1 7 . 1 1 57 57 TYR N N 57 122.177 122.177 117.692 4.485 19845 2236 1 7 . 1 1 57 57 TYR HA H 57 4.227 4.227 4.212 0.015 19845 2237 1 7 . 1 1 57 57 TYR C C 57 174.969 174.969 177.205 -2.236 19845 2238 1 7 . 1 1 57 57 TYR CA C 57 60.755 60.755 59.776 0.979 19845 2239 1 7 . 1 1 57 57 TYR CB C 57 38.453 38.453 37.069 1.384 19845 2240 1 7 . 1 1 57 57 TYR H H 57 7.964 7.964 7.935 0.029 19845 2241 1 7 . 1 1 58 58 VAL N N 58 119.069 119.069 118.892 0.177 19845 2242 1 7 . 1 1 58 58 VAL HA H 58 3.529 3.529 3.359 0.170 19845 2243 1 7 . 1 1 58 58 VAL C C 58 174.250 174.250 177.358 -3.108 19845 2244 1 7 . 1 1 58 58 VAL CA C 58 66.223 66.223 65.292 0.931 19845 2245 1 7 . 1 1 58 58 VAL CB C 58 31.803 31.803 30.746 1.057 19845 2246 1 7 . 1 1 58 58 VAL H H 58 8.018 8.018 7.247 0.771 19845 2247 1 7 . 1 1 59 59 TYR N N 59 120.360 120.360 121.276 -0.916 19845 2248 1 7 . 1 1 59 59 TYR HA H 59 4.115 4.115 3.994 0.121 19845 2249 1 7 . 1 1 59 59 TYR C C 59 173.899 173.899 178.070 -4.171 19845 2250 1 7 . 1 1 59 59 TYR CA C 59 60.929 60.929 61.054 -0.125 19845 2251 1 7 . 1 1 59 59 TYR CB C 59 38.602 38.602 37.783 0.819 19845 2252 1 7 . 1 1 59 59 TYR H H 59 8.142 8.142 7.821 0.321 19845 2253 1 7 . 1 1 60 60 SER N N 60 113.480 113.480 113.164 0.316 19845 2254 1 7 . 1 1 60 60 SER HA H 60 3.979 3.979 4.009 -0.030 19845 2255 1 7 . 1 1 60 60 SER C C 60 172.887 172.887 176.783 -3.896 19845 2256 1 7 . 1 1 60 60 SER CA C 60 60.987 60.987 60.399 0.588 19845 2257 1 7 . 1 1 60 60 SER CB C 60 63.267 63.267 62.767 0.500 19845 2258 1 7 . 1 1 60 60 SER H H 60 8.057 8.057 7.695 0.362 19845 2259 1 7 . 1 1 61 61 ARG N N 61 120.962 120.962 122.129 -1.167 19845 2260 1 7 . 1 1 61 61 ARG HA H 61 4.103 4.103 3.958 0.145 19845 2261 1 7 . 1 1 61 61 ARG C C 61 175.399 175.399 178.634 -3.235 19845 2262 1 7 . 1 1 61 61 ARG CA C 61 57.427 57.427 59.484 -2.057 19845 2263 1 7 . 1 1 61 61 ARG CB C 61 30.008 30.008 30.301 -0.293 19845 2264 1 7 . 1 1 61 61 ARG H H 61 7.606 7.606 7.351 0.255 19845 2265 1 7 . 1 1 62 62 VAL N N 62 117.852 117.852 115.785 2.067 19845 2266 1 7 . 1 1 62 62 VAL HA H 62 3.805 3.805 3.690 0.115 19845 2267 1 7 . 1 1 62 62 VAL C C 62 174.155 174.155 177.262 -3.107 19845 2268 1 7 . 1 1 62 62 VAL CA C 62 64.458 64.458 66.085 -1.627 19845 2269 1 7 . 1 1 62 62 VAL CB C 62 31.969 31.969 31.460 0.509 19845 2270 1 7 . 1 1 62 62 VAL H H 62 7.848 7.848 8.138 -0.290 19845 2271 1 7 . 1 1 63 63 LYS N N 63 119.254 119.254 120.037 -0.783 19845 2272 1 7 . 1 1 63 63 LYS HA H 63 4.051 4.051 3.975 0.076 19845 2273 1 7 . 1 1 63 63 LYS C C 63 173.615 173.615 178.195 -4.580 19845 2274 1 7 . 1 1 63 63 LYS CA C 63 56.727 56.727 58.503 -1.776 19845 2275 1 7 . 1 1 63 63 LYS CB C 63 32.105 32.105 32.468 -0.363 19845 2276 1 7 . 1 1 63 63 LYS H H 63 7.759 7.759 7.471 0.288 19845 2277 1 7 . 1 1 64 64 ASN N N 64 117.696 117.696 116.471 1.225 19845 2278 1 7 . 1 1 64 64 ASN HA H 64 4.642 4.642 4.486 0.156 19845 2279 1 7 . 1 1 64 64 ASN C C 64 171.750 171.750 175.763 -4.013 19845 2280 1 7 . 1 1 64 64 ASN CA C 64 53.313 53.313 54.790 -1.477 19845 2281 1 7 . 1 1 64 64 ASN CB C 64 39.260 39.260 39.352 -0.092 19845 2282 1 7 . 1 1 64 64 ASN H H 64 7.615 7.615 7.973 -0.358 19845 2283 1 8 . 1 1 9 9 THR N N 9 113.692 113.692 115.560 -1.868 19845 2284 1 8 . 1 1 9 9 THR HA H 9 4.213 4.213 4.569 -0.356 19845 2285 1 8 . 1 1 9 9 THR C C 9 172.757 172.757 175.119 -2.362 19845 2286 1 8 . 1 1 9 9 THR CA C 9 62.810 62.810 62.486 0.324 19845 2287 1 8 . 1 1 9 9 THR CB C 9 69.878 69.878 69.281 0.597 19845 2288 1 8 . 1 1 9 9 THR H H 9 7.930 7.930 8.625 -0.695 19845 2289 1 8 . 1 1 10 10 GLY N N 10 110.842 110.842 110.040 0.802 19845 2290 1 8 . 1 1 10 10 GLY C C 10 171.923 171.923 173.740 -1.817 19845 2291 1 8 . 1 1 10 10 GLY CA C 10 46.099 46.099 44.590 1.510 19845 2292 1 8 . 1 1 10 10 GLY H H 10 8.266 8.266 7.941 0.325 19845 2293 1 8 . 1 1 11 11 THR N N 11 113.754 113.754 117.823 -4.069 19845 2294 1 8 . 1 1 11 11 THR HA H 11 4.220 4.220 4.458 -0.238 19845 2295 1 8 . 1 1 11 11 THR C C 11 171.906 171.906 174.842 -2.936 19845 2296 1 8 . 1 1 11 11 THR CA C 11 62.721 62.721 63.059 -0.338 19845 2297 1 8 . 1 1 11 11 THR CB C 11 69.549 69.549 68.592 0.957 19845 2298 1 8 . 1 1 11 11 THR H H 11 7.753 7.753 7.995 -0.242 19845 2299 1 8 . 1 1 12 12 LEU N N 12 123.669 123.669 123.842 -0.173 19845 2300 1 8 . 1 1 12 12 LEU HA H 12 4.240 4.240 4.877 -0.637 19845 2301 1 8 . 1 1 12 12 LEU C C 12 175.221 175.221 177.470 -2.249 19845 2302 1 8 . 1 1 12 12 LEU CA C 12 56.799 56.799 55.213 1.586 19845 2303 1 8 . 1 1 12 12 LEU CB C 12 42.536 42.536 42.203 0.333 19845 2304 1 8 . 1 1 12 12 LEU H H 12 7.980 7.980 8.271 -0.291 19845 2305 1 8 . 1 1 13 13 ILE N N 13 120.086 120.086 121.527 -1.441 19845 2306 1 8 . 1 1 13 13 ILE HA H 13 3.913 3.913 4.027 -0.114 19845 2307 1 8 . 1 1 13 13 ILE C C 13 173.425 173.425 176.536 -3.111 19845 2308 1 8 . 1 1 13 13 ILE CA C 13 62.889 62.889 63.238 -0.349 19845 2309 1 8 . 1 1 13 13 ILE CB C 13 38.249 38.249 38.172 0.077 19845 2310 1 8 . 1 1 13 13 ILE H H 13 7.861 7.861 7.643 0.218 19845 2311 1 8 . 1 1 14 14 VAL N N 14 119.785 119.785 117.954 1.831 19845 2312 1 8 . 1 1 14 14 VAL HA H 14 3.790 3.790 3.802 -0.012 19845 2313 1 8 . 1 1 14 14 VAL C C 14 173.429 173.429 177.599 -4.170 19845 2314 1 8 . 1 1 14 14 VAL CA C 14 64.409 64.409 65.224 -0.815 19845 2315 1 8 . 1 1 14 14 VAL CB C 14 32.007 32.007 31.174 0.833 19845 2316 1 8 . 1 1 14 14 VAL H H 14 7.549 7.549 8.060 -0.511 19845 2317 1 8 . 1 1 15 15 ASN N N 15 119.567 119.567 116.950 2.617 19845 2318 1 8 . 1 1 15 15 ASN HA H 15 4.549 4.549 4.594 -0.045 19845 2319 1 8 . 1 1 15 15 ASN C C 15 173.619 173.619 177.098 -3.479 19845 2320 1 8 . 1 1 15 15 ASN CA C 15 54.805 54.805 55.697 -0.891 19845 2321 1 8 . 1 1 15 15 ASN CB C 15 38.824 38.824 38.205 0.619 19845 2322 1 8 . 1 1 15 15 ASN H H 15 8.010 8.010 8.534 -0.524 19845 2323 1 8 . 1 1 16 16 SER N N 16 116.730 116.730 116.483 0.247 19845 2324 1 8 . 1 1 16 16 SER HA H 16 4.177 4.177 4.417 -0.240 19845 2325 1 8 . 1 1 16 16 SER CA C 16 61.705 61.705 61.108 0.597 19845 2326 1 8 . 1 1 16 16 SER CB C 16 63.752 63.752 63.369 0.383 19845 2327 1 8 . 1 1 16 16 SER H H 16 8.039 8.039 7.450 0.589 19845 2328 1 8 . 1 1 17 17 VAL N N 17 122.062 122.062 122.500 -0.438 19845 2329 1 8 . 1 1 17 17 VAL HA H 17 3.677 3.677 3.841 -0.164 19845 2330 1 8 . 1 1 17 17 VAL C C 17 174.474 174.474 176.949 -2.475 19845 2331 1 8 . 1 1 17 17 VAL CA C 17 66.671 66.671 65.844 0.827 19845 2332 1 8 . 1 1 17 17 VAL CB C 17 31.531 31.531 32.043 -0.512 19845 2333 1 8 . 1 1 17 17 VAL H H 17 7.896 7.896 8.140 -0.244 19845 2334 1 8 . 1 1 18 18 LEU N N 18 119.103 119.103 120.115 -1.012 19845 2335 1 8 . 1 1 18 18 LEU HA H 18 3.998 3.998 4.261 -0.263 19845 2336 1 8 . 1 1 18 18 LEU C C 18 175.511 175.511 178.017 -2.506 19845 2337 1 8 . 1 1 18 18 LEU CA C 18 58.107 58.107 57.971 0.136 19845 2338 1 8 . 1 1 18 18 LEU CB C 18 41.593 41.593 42.160 -0.567 19845 2339 1 8 . 1 1 18 18 LEU H H 18 7.857 7.857 7.428 0.429 19845 2340 1 8 . 1 1 19 19 LEU N N 19 118.291 118.291 120.368 -2.077 19845 2341 1 8 . 1 1 19 19 LEU HA H 19 4.152 4.152 4.183 -0.031 19845 2342 1 8 . 1 1 19 19 LEU C C 19 175.156 175.156 178.889 -3.733 19845 2343 1 8 . 1 1 19 19 LEU CA C 19 58.011 58.011 57.561 0.450 19845 2344 1 8 . 1 1 19 19 LEU CB C 19 42.027 42.027 40.937 1.091 19845 2345 1 8 . 1 1 19 19 LEU H H 19 7.745 7.745 7.550 0.195 19845 2346 1 8 . 1 1 20 20 PHE N N 20 118.415 118.415 119.585 -1.170 19845 2347 1 8 . 1 1 20 20 PHE HA H 20 4.188 4.188 4.108 0.080 19845 2348 1 8 . 1 1 20 20 PHE C C 20 174.260 174.260 177.600 -3.340 19845 2349 1 8 . 1 1 20 20 PHE CA C 20 61.626 61.626 62.301 -0.675 19845 2350 1 8 . 1 1 20 20 PHE CB C 20 38.643 38.643 38.758 -0.115 19845 2351 1 8 . 1 1 20 20 PHE H H 20 8.002 8.002 8.560 -0.558 19845 2352 1 8 . 1 1 21 21 LEU N N 21 118.571 118.571 119.998 -1.427 19845 2353 1 8 . 1 1 21 21 LEU HA H 21 3.797 3.797 4.045 -0.248 19845 2354 1 8 . 1 1 21 21 LEU C C 21 175.324 175.324 178.461 -3.137 19845 2355 1 8 . 1 1 21 21 LEU CA C 21 58.128 58.128 59.111 -0.983 19845 2356 1 8 . 1 1 21 21 LEU CB C 21 41.957 41.957 41.868 0.089 19845 2357 1 8 . 1 1 21 21 LEU H H 21 8.456 8.456 7.711 0.745 19845 2358 1 8 . 1 1 22 22 ALA N N 22 120.775 120.775 120.783 -0.008 19845 2359 1 8 . 1 1 22 22 ALA HA H 22 3.779 3.779 4.082 -0.303 19845 2360 1 8 . 1 1 22 22 ALA C C 22 175.697 175.697 180.029 -4.332 19845 2361 1 8 . 1 1 22 22 ALA CA C 22 55.721 55.721 54.656 1.065 19845 2362 1 8 . 1 1 22 22 ALA CB C 22 17.788 17.788 18.250 -0.462 19845 2363 1 8 . 1 1 22 22 ALA H H 22 8.353 8.353 7.557 0.796 19845 2364 1 8 . 1 1 23 23 PHE N N 23 117.860 117.860 119.911 -2.051 19845 2365 1 8 . 1 1 23 23 PHE HA H 23 4.108 4.108 4.353 -0.245 19845 2366 1 8 . 1 1 23 23 PHE C C 23 173.859 173.859 177.005 -3.146 19845 2367 1 8 . 1 1 23 23 PHE CA C 23 61.271 61.271 61.865 -0.594 19845 2368 1 8 . 1 1 23 23 PHE CB C 23 38.853 38.853 39.682 -0.829 19845 2369 1 8 . 1 1 23 23 PHE H H 23 8.121 8.121 8.230 -0.109 19845 2370 1 8 . 1 1 24 24 VAL N N 24 119.181 119.181 119.688 -0.507 19845 2371 1 8 . 1 1 24 24 VAL HA H 24 3.134 3.134 3.495 -0.361 19845 2372 1 8 . 1 1 24 24 VAL C C 24 174.684 174.684 177.828 -3.144 19845 2373 1 8 . 1 1 24 24 VAL CA C 24 67.419 67.419 67.233 0.186 19845 2374 1 8 . 1 1 24 24 VAL CB C 24 31.106 31.106 31.656 -0.550 19845 2375 1 8 . 1 1 24 24 VAL H H 24 8.124 8.124 8.479 -0.355 19845 2376 1 8 . 1 1 25 25 VAL N N 25 119.215 119.215 117.010 2.205 19845 2377 1 8 . 1 1 25 25 VAL HA H 25 3.324 3.324 3.584 -0.260 19845 2378 1 8 . 1 1 25 25 VAL C C 25 174.244 174.244 177.493 -3.249 19845 2379 1 8 . 1 1 25 25 VAL CA C 25 67.740 67.740 64.983 2.757 19845 2380 1 8 . 1 1 25 25 VAL CB C 25 31.270 31.270 30.371 0.899 19845 2381 1 8 . 1 1 25 25 VAL H H 25 8.250 8.250 7.504 0.746 19845 2382 1 8 . 1 1 26 26 PHE N N 26 119.875 119.875 119.541 0.334 19845 2383 1 8 . 1 1 26 26 PHE HA H 26 3.900 3.900 4.139 -0.239 19845 2384 1 8 . 1 1 26 26 PHE C C 26 175.371 175.371 178.220 -2.849 19845 2385 1 8 . 1 1 26 26 PHE CA C 26 61.651 61.651 61.561 0.090 19845 2386 1 8 . 1 1 26 26 PHE CB C 26 38.760 38.760 38.545 0.215 19845 2387 1 8 . 1 1 26 26 PHE H H 26 8.413 8.413 7.204 1.209 19845 2388 1 8 . 1 1 27 27 LEU N N 27 122.548 122.548 119.470 3.078 19845 2389 1 8 . 1 1 27 27 LEU HA H 27 3.533 3.533 3.849 -0.316 19845 2390 1 8 . 1 1 27 27 LEU C C 27 175.256 175.256 178.945 -3.689 19845 2391 1 8 . 1 1 27 27 LEU CA C 27 58.211 58.211 57.700 0.511 19845 2392 1 8 . 1 1 27 27 LEU CB C 27 41.564 41.564 41.379 0.185 19845 2393 1 8 . 1 1 27 27 LEU H H 27 8.453 8.453 8.297 0.156 19845 2394 1 8 . 1 1 28 28 LEU N N 28 119.385 119.385 119.795 -0.410 19845 2395 1 8 . 1 1 28 28 LEU HA H 28 3.799 3.799 3.862 -0.063 19845 2396 1 8 . 1 1 28 28 LEU C C 28 175.881 175.881 179.219 -3.338 19845 2397 1 8 . 1 1 28 28 LEU CA C 28 58.492 58.492 58.078 0.414 19845 2398 1 8 . 1 1 28 28 LEU CB C 28 41.760 41.760 41.418 0.342 19845 2399 1 8 . 1 1 28 28 LEU H H 28 8.248 8.248 8.393 -0.145 19845 2400 1 8 . 1 1 29 29 VAL N N 29 118.515 118.515 117.404 1.111 19845 2401 1 8 . 1 1 29 29 VAL HA H 29 3.319 3.319 3.671 -0.352 19845 2402 1 8 . 1 1 29 29 VAL C C 29 174.734 174.734 177.636 -2.902 19845 2403 1 8 . 1 1 29 29 VAL CA C 29 67.192 67.192 66.236 0.956 19845 2404 1 8 . 1 1 29 29 VAL CB C 29 31.175 31.175 32.013 -0.838 19845 2405 1 8 . 1 1 29 29 VAL H H 29 8.446 8.446 7.407 1.039 19845 2406 1 8 . 1 1 30 30 THR N N 30 117.313 117.313 116.569 0.744 19845 2407 1 8 . 1 1 30 30 THR HA H 30 3.432 3.432 3.912 -0.480 19845 2408 1 8 . 1 1 30 30 THR CA C 30 68.606 68.606 66.615 1.990 19845 2409 1 8 . 1 1 30 30 THR CB C 30 67.147 67.147 68.326 -1.179 19845 2410 1 8 . 1 1 30 30 THR H H 30 7.923 7.923 8.062 -0.139 19845 2411 1 8 . 1 1 31 31 LEU N N 31 120.629 120.629 120.964 -0.335 19845 2412 1 8 . 1 1 31 31 LEU HA H 31 3.858 3.858 3.910 -0.052 19845 2413 1 8 . 1 1 31 31 LEU C C 31 177.164 177.164 178.449 -1.285 19845 2414 1 8 . 1 1 31 31 LEU CA C 31 58.145 58.145 57.815 0.330 19845 2415 1 8 . 1 1 31 31 LEU CB C 31 41.615 41.615 41.543 0.072 19845 2416 1 8 . 1 1 31 31 LEU H H 31 8.382 8.382 7.945 0.437 19845 2417 1 8 . 1 1 32 32 ALA N N 32 125.216 125.216 121.613 3.603 19845 2418 1 8 . 1 1 32 32 ALA HA H 32 3.836 3.836 3.915 -0.079 19845 2419 1 8 . 1 1 32 32 ALA C C 32 175.968 175.968 180.522 -4.554 19845 2420 1 8 . 1 1 32 32 ALA CA C 32 55.918 55.918 54.842 1.076 19845 2421 1 8 . 1 1 32 32 ALA CB C 32 17.802 17.802 18.134 -0.332 19845 2422 1 8 . 1 1 32 32 ALA H H 32 8.517 8.517 7.568 0.949 19845 2423 1 8 . 1 1 33 33 ILE N N 33 118.722 118.722 118.951 -0.229 19845 2424 1 8 . 1 1 33 33 ILE HA H 33 3.481 3.481 3.554 -0.073 19845 2425 1 8 . 1 1 33 33 ILE C C 33 175.004 175.004 178.045 -3.041 19845 2426 1 8 . 1 1 33 33 ILE CA C 33 65.554 65.554 65.084 0.470 19845 2427 1 8 . 1 1 33 33 ILE CB C 33 37.657 37.657 37.395 0.262 19845 2428 1 8 . 1 1 33 33 ILE H H 33 8.288 8.288 7.559 0.729 19845 2429 1 8 . 1 1 34 34 LEU N N 34 118.987 118.987 119.682 -0.695 19845 2430 1 8 . 1 1 34 34 LEU HA H 34 3.893 3.893 3.917 -0.024 19845 2431 1 8 . 1 1 34 34 LEU C C 34 176.439 176.439 178.543 -2.104 19845 2432 1 8 . 1 1 34 34 LEU CA C 34 58.436 58.436 57.848 0.588 19845 2433 1 8 . 1 1 34 34 LEU CB C 34 42.152 42.152 41.555 0.597 19845 2434 1 8 . 1 1 34 34 LEU H H 34 8.493 8.493 8.078 0.415 19845 2435 1 8 . 1 1 35 35 THR N N 35 116.630 116.630 114.864 1.766 19845 2436 1 8 . 1 1 35 35 THR HA H 35 3.652 3.652 3.896 -0.244 19845 2437 1 8 . 1 1 35 35 THR C C 35 173.366 173.366 176.033 -2.667 19845 2438 1 8 . 1 1 35 35 THR CA C 35 68.153 68.153 66.755 1.398 19845 2439 1 8 . 1 1 35 35 THR CB C 35 68.162 68.162 68.524 -0.362 19845 2440 1 8 . 1 1 35 35 THR H H 35 8.215 8.215 8.180 0.035 19845 2441 1 8 . 1 1 36 36 ALA N N 36 124.667 124.667 123.425 1.242 19845 2442 1 8 . 1 1 36 36 ALA HA H 36 3.864 3.864 3.940 -0.076 19845 2443 1 8 . 1 1 36 36 ALA C C 36 176.510 176.510 179.444 -2.934 19845 2444 1 8 . 1 1 36 36 ALA CA C 36 55.758 55.758 55.128 0.630 19845 2445 1 8 . 1 1 36 36 ALA CB C 36 18.054 18.054 18.137 -0.083 19845 2446 1 8 . 1 1 36 36 ALA H H 36 8.358 8.358 8.069 0.289 19845 2447 1 8 . 1 1 37 37 LEU N N 37 116.565 116.565 117.829 -1.264 19845 2448 1 8 . 1 1 37 37 LEU HA H 37 3.973 3.973 4.112 -0.139 19845 2449 1 8 . 1 1 37 37 LEU C C 37 176.538 176.538 179.171 -2.633 19845 2450 1 8 . 1 1 37 37 LEU CA C 37 57.853 57.853 57.250 0.603 19845 2451 1 8 . 1 1 37 37 LEU CB C 37 42.018 42.018 40.608 1.410 19845 2452 1 8 . 1 1 37 37 LEU H H 37 8.360 8.360 7.551 0.809 19845 2453 1 8 . 1 1 38 38 ARG N N 38 119.392 119.392 119.905 -0.513 19845 2454 1 8 . 1 1 38 38 ARG HA H 38 4.104 4.104 4.056 0.048 19845 2455 1 8 . 1 1 38 38 ARG C C 38 176.208 176.208 179.267 -3.059 19845 2456 1 8 . 1 1 38 38 ARG CA C 38 58.100 58.100 58.985 -0.885 19845 2457 1 8 . 1 1 38 38 ARG CB C 38 29.502 29.502 29.613 -0.111 19845 2458 1 8 . 1 1 38 38 ARG H H 38 8.082 8.082 7.401 0.681 19845 2459 1 8 . 1 1 39 39 LEU N N 39 120.438 120.438 118.288 2.150 19845 2460 1 8 . 1 1 39 39 LEU HA H 39 4.243 4.243 3.904 0.339 19845 2461 1 8 . 1 1 39 39 LEU C C 39 175.702 175.702 178.740 -3.038 19845 2462 1 8 . 1 1 39 39 LEU CA C 39 56.979 56.979 58.387 -1.408 19845 2463 1 8 . 1 1 39 39 LEU CB C 39 41.893 41.893 41.474 0.419 19845 2464 1 8 . 1 1 39 39 LEU H H 39 8.446 8.446 7.778 0.668 19845 2465 1 8 . 1 1 40 40 ALA N N 40 122.512 122.512 120.744 1.768 19845 2466 1 8 . 1 1 40 40 ALA HA H 40 3.975 3.975 4.082 -0.107 19845 2467 1 8 . 1 1 40 40 ALA C C 40 175.838 175.838 179.134 -3.296 19845 2468 1 8 . 1 1 40 40 ALA CA C 40 54.710 54.710 54.605 0.105 19845 2469 1 8 . 1 1 40 40 ALA CB C 40 18.319 18.319 17.857 0.462 19845 2470 1 8 . 1 1 40 40 ALA H H 40 8.321 8.321 7.391 0.930 19845 2471 1 8 . 1 1 41 41 ALA N N 41 119.754 119.754 121.459 -1.705 19845 2472 1 8 . 1 1 41 41 ALA HA H 41 4.024 4.024 4.188 -0.164 19845 2473 1 8 . 1 1 41 41 ALA C C 41 176.517 176.517 179.661 -3.144 19845 2474 1 8 . 1 1 41 41 ALA CA C 41 54.486 54.486 54.652 -0.166 19845 2475 1 8 . 1 1 41 41 ALA CB C 41 18.468 18.468 18.670 -0.202 19845 2476 1 8 . 1 1 41 41 ALA H H 41 8.038 8.038 8.148 -0.110 19845 2477 1 8 . 1 1 42 42 TYR N N 42 118.272 118.272 118.502 -0.230 19845 2478 1 8 . 1 1 42 42 TYR HA H 42 4.326 4.326 4.285 0.041 19845 2479 1 8 . 1 1 42 42 TYR C C 42 174.633 174.633 177.993 -3.360 19845 2480 1 8 . 1 1 42 42 TYR CA C 42 60.098 60.098 59.520 0.578 19845 2481 1 8 . 1 1 42 42 TYR CB C 42 38.936 38.936 37.363 1.573 19845 2482 1 8 . 1 1 42 42 TYR H H 42 7.814 7.814 7.903 -0.089 19845 2483 1 8 . 1 1 43 43 ALA N N 43 122.908 122.908 121.173 1.735 19845 2484 1 8 . 1 1 43 43 ALA HA H 43 4.111 4.111 4.205 -0.094 19845 2485 1 8 . 1 1 43 43 ALA C C 43 175.241 175.241 177.881 -2.640 19845 2486 1 8 . 1 1 43 43 ALA CA C 43 53.842 53.842 53.923 -0.081 19845 2487 1 8 . 1 1 43 43 ALA CB C 43 18.427 18.427 17.875 0.552 19845 2488 1 8 . 1 1 43 43 ALA H H 43 8.172 8.172 7.506 0.666 19845 2489 1 8 . 1 1 44 44 ALA N N 44 119.906 119.906 119.180 0.726 19845 2490 1 8 . 1 1 44 44 ALA HA H 44 4.051 4.051 4.247 -0.196 19845 2491 1 8 . 1 1 44 44 ALA C C 44 175.092 175.092 178.243 -3.151 19845 2492 1 8 . 1 1 44 44 ALA CA C 44 53.611 53.611 53.614 -0.003 19845 2493 1 8 . 1 1 44 44 ALA CB C 44 18.689 18.689 19.084 -0.395 19845 2494 1 8 . 1 1 44 44 ALA H H 44 7.953 7.953 7.718 0.235 19845 2495 1 8 . 1 1 45 45 ASN N N 45 114.984 114.984 117.105 -2.121 19845 2496 1 8 . 1 1 45 45 ASN HA H 45 4.541 4.541 4.801 -0.260 19845 2497 1 8 . 1 1 45 45 ASN CA C 45 54.506 54.506 54.928 -0.422 19845 2498 1 8 . 1 1 45 45 ASN CB C 45 38.602 38.602 39.682 -1.080 19845 2499 1 8 . 1 1 45 45 ASN H H 45 7.847 7.847 8.346 -0.499 19845 2500 1 8 . 1 1 46 46 ILE N N 46 119.155 119.155 116.890 2.265 19845 2501 1 8 . 1 1 46 46 ILE HA H 46 4.033 4.033 4.306 -0.273 19845 2502 1 8 . 1 1 46 46 ILE C C 46 173.344 173.344 175.404 -2.060 19845 2503 1 8 . 1 1 46 46 ILE CA C 46 62.357 62.357 61.866 0.491 19845 2504 1 8 . 1 1 46 46 ILE CB C 46 38.657 38.657 38.316 0.341 19845 2505 1 8 . 1 1 46 46 ILE H H 46 7.790 7.790 7.647 0.143 19845 2506 1 8 . 1 1 47 47 VAL N N 47 117.526 117.526 117.470 0.056 19845 2507 1 8 . 1 1 47 47 VAL HA H 47 4.133 4.133 4.391 -0.258 19845 2508 1 8 . 1 1 47 47 VAL C C 47 172.672 172.672 175.221 -2.549 19845 2509 1 8 . 1 1 47 47 VAL CA C 47 62.149 62.149 59.839 2.310 19845 2510 1 8 . 1 1 47 47 VAL CB C 47 32.807 32.807 34.114 -1.307 19845 2511 1 8 . 1 1 47 47 VAL H H 47 7.582 7.582 7.523 0.059 19845 2512 1 8 . 1 1 48 48 ASN N N 48 120.091 120.091 121.507 -1.416 19845 2513 1 8 . 1 1 48 48 ASN HA H 48 4.658 4.658 4.863 -0.205 19845 2514 1 8 . 1 1 48 48 ASN CA C 48 53.478 53.478 53.581 -0.103 19845 2515 1 8 . 1 1 48 48 ASN CB C 48 38.573 38.573 37.145 1.428 19845 2516 1 8 . 1 1 48 48 ASN H H 48 8.053 8.053 8.656 -0.603 19845 2517 1 8 . 1 1 49 49 VAL N N 49 118.854 118.854 119.722 -0.868 19845 2518 1 8 . 1 1 49 49 VAL HA H 49 4.133 4.133 4.239 -0.106 19845 2519 1 8 . 1 1 49 49 VAL C C 49 172.595 172.595 174.036 -1.441 19845 2520 1 8 . 1 1 49 49 VAL CA C 49 62.049 62.049 61.355 0.694 19845 2521 1 8 . 1 1 49 49 VAL CB C 49 33.271 33.271 34.425 -1.154 19845 2522 1 8 . 1 1 49 49 VAL H H 49 7.685 7.685 7.918 -0.233 19845 2523 1 8 . 1 1 50 50 SER N N 50 118.689 118.689 120.070 -1.381 19845 2524 1 8 . 1 1 50 50 SER HA H 50 4.466 4.466 4.175 0.291 19845 2525 1 8 . 1 1 50 50 SER C C 50 171.430 171.430 172.526 -1.096 19845 2526 1 8 . 1 1 50 50 SER CA C 50 58.128 58.128 57.446 0.682 19845 2527 1 8 . 1 1 50 50 SER CB C 50 63.916 63.916 64.300 -0.384 19845 2528 1 8 . 1 1 50 50 SER H H 50 8.075 8.075 8.112 -0.037 19845 2529 1 8 . 1 1 51 51 LEU N N 51 123.536 123.536 119.366 4.170 19845 2530 1 8 . 1 1 51 51 LEU HA H 51 4.305 4.305 4.618 -0.313 19845 2531 1 8 . 1 1 51 51 LEU C C 51 174.110 174.110 175.518 -1.408 19845 2532 1 8 . 1 1 51 51 LEU CA C 51 55.145 55.145 54.458 0.687 19845 2533 1 8 . 1 1 51 51 LEU CB C 51 42.674 42.674 44.886 -2.212 19845 2534 1 8 . 1 1 51 51 LEU H H 51 7.991 7.991 7.738 0.253 19845 2535 1 8 . 1 1 52 52 VAL N N 52 119.649 119.649 119.331 0.318 19845 2536 1 8 . 1 1 52 52 VAL HA H 52 3.992 3.992 4.318 -0.326 19845 2537 1 8 . 1 1 52 52 VAL C C 52 172.476 172.476 176.815 -4.339 19845 2538 1 8 . 1 1 52 52 VAL CA C 52 62.772 62.772 63.337 -0.565 19845 2539 1 8 . 1 1 52 52 VAL CB C 52 33.066 33.066 32.309 0.757 19845 2540 1 8 . 1 1 52 52 VAL H H 52 7.536 7.536 8.424 -0.888 19845 2541 1 8 . 1 1 53 53 LYS N N 53 122.004 122.004 122.487 -0.483 19845 2542 1 8 . 1 1 53 53 LYS HA H 53 4.354 4.354 4.184 0.170 19845 2543 1 8 . 1 1 53 53 LYS CA C 53 56.567 56.567 60.014 -3.447 19845 2544 1 8 . 1 1 53 53 LYS CB C 53 31.689 31.689 29.902 1.787 19845 2545 1 8 . 1 1 53 53 LYS H H 53 8.038 8.038 8.483 -0.445 19845 2546 1 8 . 1 1 54 54 PRO HA H 54 4.353 4.353 4.456 -0.103 19845 2547 1 8 . 1 1 54 54 PRO CA C 54 65.103 65.103 64.868 0.235 19845 2548 1 8 . 1 1 54 54 PRO CB C 54 32.193 32.193 30.974 1.219 19845 2549 1 8 . 1 1 55 55 THR N N 55 111.485 111.485 109.731 1.754 19845 2550 1 8 . 1 1 55 55 THR HA H 55 3.910 3.910 4.807 -0.897 19845 2551 1 8 . 1 1 55 55 THR C C 55 172.822 172.822 176.802 -3.980 19845 2552 1 8 . 1 1 55 55 THR CA C 55 65.030 65.030 63.062 1.968 19845 2553 1 8 . 1 1 55 55 THR CB C 55 68.882 68.882 69.459 -0.577 19845 2554 1 8 . 1 1 55 55 THR H H 55 7.722 7.722 7.622 0.100 19845 2555 1 8 . 1 1 56 56 VAL N N 56 121.165 121.165 121.111 0.054 19845 2556 1 8 . 1 1 56 56 VAL HA H 56 3.772 3.772 3.712 0.060 19845 2557 1 8 . 1 1 56 56 VAL C C 56 174.904 174.904 176.898 -1.994 19845 2558 1 8 . 1 1 56 56 VAL CA C 56 64.971 64.971 66.190 -1.219 19845 2559 1 8 . 1 1 56 56 VAL CB C 56 31.989 31.989 30.931 1.058 19845 2560 1 8 . 1 1 56 56 VAL H H 56 7.597 7.597 7.755 -0.158 19845 2561 1 8 . 1 1 57 57 TYR N N 57 122.177 122.177 118.653 3.524 19845 2562 1 8 . 1 1 57 57 TYR HA H 57 4.227 4.227 4.228 -0.001 19845 2563 1 8 . 1 1 57 57 TYR C C 57 174.969 174.969 177.404 -2.435 19845 2564 1 8 . 1 1 57 57 TYR CA C 57 60.755 60.755 59.747 1.008 19845 2565 1 8 . 1 1 57 57 TYR CB C 57 38.453 38.453 36.753 1.700 19845 2566 1 8 . 1 1 57 57 TYR H H 57 7.964 7.964 8.032 -0.068 19845 2567 1 8 . 1 1 58 58 VAL N N 58 119.069 119.069 119.281 -0.212 19845 2568 1 8 . 1 1 58 58 VAL HA H 58 3.529 3.529 3.346 0.183 19845 2569 1 8 . 1 1 58 58 VAL C C 58 174.250 174.250 177.128 -2.878 19845 2570 1 8 . 1 1 58 58 VAL CA C 58 66.223 66.223 64.706 1.517 19845 2571 1 8 . 1 1 58 58 VAL CB C 58 31.803 31.803 30.724 1.079 19845 2572 1 8 . 1 1 58 58 VAL H H 58 8.018 8.018 7.315 0.703 19845 2573 1 8 . 1 1 59 59 TYR N N 59 120.360 120.360 120.768 -0.408 19845 2574 1 8 . 1 1 59 59 TYR HA H 59 4.115 4.115 4.006 0.109 19845 2575 1 8 . 1 1 59 59 TYR C C 59 173.899 173.899 177.760 -3.861 19845 2576 1 8 . 1 1 59 59 TYR CA C 59 60.929 60.929 61.101 -0.172 19845 2577 1 8 . 1 1 59 59 TYR CB C 59 38.602 38.602 37.819 0.783 19845 2578 1 8 . 1 1 59 59 TYR H H 59 8.142 8.142 7.844 0.298 19845 2579 1 8 . 1 1 60 60 SER N N 60 113.480 113.480 112.983 0.497 19845 2580 1 8 . 1 1 60 60 SER HA H 60 3.979 3.979 4.090 -0.111 19845 2581 1 8 . 1 1 60 60 SER C C 60 172.887 172.887 176.746 -3.859 19845 2582 1 8 . 1 1 60 60 SER CA C 60 60.987 60.987 60.812 0.175 19845 2583 1 8 . 1 1 60 60 SER CB C 60 63.267 63.267 62.761 0.506 19845 2584 1 8 . 1 1 60 60 SER H H 60 8.057 8.057 7.657 0.400 19845 2585 1 8 . 1 1 61 61 ARG N N 61 120.962 120.962 121.651 -0.689 19845 2586 1 8 . 1 1 61 61 ARG HA H 61 4.103 4.103 4.039 0.064 19845 2587 1 8 . 1 1 61 61 ARG C C 61 175.399 175.399 178.767 -3.368 19845 2588 1 8 . 1 1 61 61 ARG CA C 61 57.427 57.427 59.006 -1.579 19845 2589 1 8 . 1 1 61 61 ARG CB C 61 30.008 30.008 30.015 -0.007 19845 2590 1 8 . 1 1 61 61 ARG H H 61 7.606 7.606 7.390 0.216 19845 2591 1 8 . 1 1 62 62 VAL N N 62 117.852 117.852 116.838 1.014 19845 2592 1 8 . 1 1 62 62 VAL HA H 62 3.805 3.805 3.835 -0.030 19845 2593 1 8 . 1 1 62 62 VAL C C 62 174.155 174.155 177.024 -2.869 19845 2594 1 8 . 1 1 62 62 VAL CA C 62 64.458 64.458 65.416 -0.958 19845 2595 1 8 . 1 1 62 62 VAL CB C 62 31.969 31.969 30.949 1.020 19845 2596 1 8 . 1 1 62 62 VAL H H 62 7.848 7.848 8.228 -0.380 19845 2597 1 8 . 1 1 63 63 LYS N N 63 119.254 119.254 119.917 -0.663 19845 2598 1 8 . 1 1 63 63 LYS HA H 63 4.051 4.051 4.054 -0.003 19845 2599 1 8 . 1 1 63 63 LYS C C 63 173.615 173.615 178.084 -4.469 19845 2600 1 8 . 1 1 63 63 LYS CA C 63 56.727 56.727 58.374 -1.647 19845 2601 1 8 . 1 1 63 63 LYS CB C 63 32.105 32.105 32.339 -0.234 19845 2602 1 8 . 1 1 63 63 LYS H H 63 7.759 7.759 7.490 0.269 19845 2603 1 8 . 1 1 64 64 ASN N N 64 117.696 117.696 116.729 0.967 19845 2604 1 8 . 1 1 64 64 ASN HA H 64 4.642 4.642 4.575 0.067 19845 2605 1 8 . 1 1 64 64 ASN C C 64 171.750 171.750 175.855 -4.105 19845 2606 1 8 . 1 1 64 64 ASN CA C 64 53.313 53.313 54.578 -1.265 19845 2607 1 8 . 1 1 64 64 ASN CB C 64 39.260 39.260 39.043 0.217 19845 2608 1 8 . 1 1 64 64 ASN H H 64 7.615 7.615 8.084 -0.469 19845 2609 1 9 . 1 1 9 9 THR N N 9 113.692 113.692 116.628 -2.936 19845 2610 1 9 . 1 1 9 9 THR HA H 9 4.213 4.213 4.069 0.144 19845 2611 1 9 . 1 1 9 9 THR C C 9 172.757 172.757 174.264 -1.507 19845 2612 1 9 . 1 1 9 9 THR CA C 9 62.810 62.810 63.423 -0.613 19845 2613 1 9 . 1 1 9 9 THR CB C 9 69.878 69.878 67.466 2.412 19845 2614 1 9 . 1 1 9 9 THR H H 9 7.930 7.930 8.289 -0.358 19845 2615 1 9 . 1 1 10 10 GLY N N 10 110.842 110.842 106.632 4.210 19845 2616 1 9 . 1 1 10 10 GLY C C 10 171.923 171.923 173.746 -1.823 19845 2617 1 9 . 1 1 10 10 GLY CA C 10 46.099 46.099 44.524 1.575 19845 2618 1 9 . 1 1 10 10 GLY H H 10 8.266 8.266 8.075 0.191 19845 2619 1 9 . 1 1 11 11 THR N N 11 113.754 113.754 116.617 -2.863 19845 2620 1 9 . 1 1 11 11 THR HA H 11 4.220 4.220 4.501 -0.281 19845 2621 1 9 . 1 1 11 11 THR C C 11 171.906 171.906 174.349 -2.443 19845 2622 1 9 . 1 1 11 11 THR CA C 11 62.721 62.721 62.132 0.589 19845 2623 1 9 . 1 1 11 11 THR CB C 11 69.549 69.549 69.053 0.496 19845 2624 1 9 . 1 1 11 11 THR H H 11 7.753 7.753 7.909 -0.156 19845 2625 1 9 . 1 1 12 12 LEU N N 12 123.669 123.669 126.456 -2.787 19845 2626 1 9 . 1 1 12 12 LEU HA H 12 4.240 4.240 4.674 -0.434 19845 2627 1 9 . 1 1 12 12 LEU C C 12 175.221 175.221 177.222 -2.001 19845 2628 1 9 . 1 1 12 12 LEU CA C 12 56.799 56.799 54.750 2.049 19845 2629 1 9 . 1 1 12 12 LEU CB C 12 42.536 42.536 42.169 0.367 19845 2630 1 9 . 1 1 12 12 LEU H H 12 7.980 7.980 8.732 -0.752 19845 2631 1 9 . 1 1 13 13 ILE N N 13 120.086 120.086 121.292 -1.206 19845 2632 1 9 . 1 1 13 13 ILE HA H 13 3.913 3.913 4.080 -0.167 19845 2633 1 9 . 1 1 13 13 ILE C C 13 173.425 173.425 177.675 -4.250 19845 2634 1 9 . 1 1 13 13 ILE CA C 13 62.889 62.889 63.413 -0.525 19845 2635 1 9 . 1 1 13 13 ILE CB C 13 38.249 38.249 38.064 0.185 19845 2636 1 9 . 1 1 13 13 ILE H H 13 7.861 7.861 7.775 0.086 19845 2637 1 9 . 1 1 14 14 VAL N N 14 119.785 119.785 119.956 -0.171 19845 2638 1 9 . 1 1 14 14 VAL HA H 14 3.790 3.790 3.795 -0.005 19845 2639 1 9 . 1 1 14 14 VAL C C 14 173.429 173.429 177.121 -3.692 19845 2640 1 9 . 1 1 14 14 VAL CA C 14 64.409 64.409 65.609 -1.200 19845 2641 1 9 . 1 1 14 14 VAL CB C 14 32.007 32.007 31.323 0.684 19845 2642 1 9 . 1 1 14 14 VAL H H 14 7.549 7.549 8.041 -0.492 19845 2643 1 9 . 1 1 15 15 ASN N N 15 119.567 119.567 116.804 2.763 19845 2644 1 9 . 1 1 15 15 ASN HA H 15 4.549 4.549 4.637 -0.088 19845 2645 1 9 . 1 1 15 15 ASN C C 15 173.619 173.619 177.272 -3.653 19845 2646 1 9 . 1 1 15 15 ASN CA C 15 54.805 54.805 55.428 -0.623 19845 2647 1 9 . 1 1 15 15 ASN CB C 15 38.824 38.824 38.378 0.446 19845 2648 1 9 . 1 1 15 15 ASN H H 15 8.010 8.010 8.651 -0.641 19845 2649 1 9 . 1 1 16 16 SER N N 16 116.730 116.730 116.956 -0.226 19845 2650 1 9 . 1 1 16 16 SER HA H 16 4.177 4.177 4.433 -0.256 19845 2651 1 9 . 1 1 16 16 SER CA C 16 61.705 61.705 61.602 0.103 19845 2652 1 9 . 1 1 16 16 SER CB C 16 63.752 63.752 63.427 0.325 19845 2653 1 9 . 1 1 16 16 SER H H 16 8.039 8.039 7.545 0.494 19845 2654 1 9 . 1 1 17 17 VAL N N 17 122.062 122.062 122.551 -0.489 19845 2655 1 9 . 1 1 17 17 VAL HA H 17 3.677 3.677 3.858 -0.181 19845 2656 1 9 . 1 1 17 17 VAL C C 17 174.474 174.474 177.033 -2.559 19845 2657 1 9 . 1 1 17 17 VAL CA C 17 66.671 66.671 65.867 0.804 19845 2658 1 9 . 1 1 17 17 VAL CB C 17 31.531 31.531 31.763 -0.232 19845 2659 1 9 . 1 1 17 17 VAL H H 17 7.896 7.896 8.191 -0.295 19845 2660 1 9 . 1 1 18 18 LEU N N 18 119.103 119.103 120.222 -1.119 19845 2661 1 9 . 1 1 18 18 LEU HA H 18 3.998 3.998 4.264 -0.266 19845 2662 1 9 . 1 1 18 18 LEU C C 18 175.511 175.511 178.719 -3.208 19845 2663 1 9 . 1 1 18 18 LEU CA C 18 58.107 58.107 57.569 0.537 19845 2664 1 9 . 1 1 18 18 LEU CB C 18 41.593 41.593 41.057 0.536 19845 2665 1 9 . 1 1 18 18 LEU H H 18 7.857 7.857 7.483 0.374 19845 2666 1 9 . 1 1 19 19 LEU N N 19 118.291 118.291 121.139 -2.848 19845 2667 1 9 . 1 1 19 19 LEU HA H 19 4.152 4.152 4.207 -0.055 19845 2668 1 9 . 1 1 19 19 LEU C C 19 175.156 175.156 178.691 -3.535 19845 2669 1 9 . 1 1 19 19 LEU CA C 19 58.011 58.011 57.881 0.130 19845 2670 1 9 . 1 1 19 19 LEU CB C 19 42.027 42.027 41.868 0.159 19845 2671 1 9 . 1 1 19 19 LEU H H 19 7.745 7.745 7.554 0.191 19845 2672 1 9 . 1 1 20 20 PHE N N 20 118.415 118.415 119.335 -0.920 19845 2673 1 9 . 1 1 20 20 PHE HA H 20 4.188 4.188 4.134 0.054 19845 2674 1 9 . 1 1 20 20 PHE C C 20 174.260 174.260 177.352 -3.092 19845 2675 1 9 . 1 1 20 20 PHE CA C 20 61.626 61.626 62.031 -0.405 19845 2676 1 9 . 1 1 20 20 PHE CB C 20 38.643 38.643 38.905 -0.262 19845 2677 1 9 . 1 1 20 20 PHE H H 20 8.002 8.002 8.575 -0.573 19845 2678 1 9 . 1 1 21 21 LEU N N 21 118.571 118.571 119.627 -1.056 19845 2679 1 9 . 1 1 21 21 LEU HA H 21 3.797 3.797 4.113 -0.316 19845 2680 1 9 . 1 1 21 21 LEU C C 21 175.324 175.324 178.944 -3.620 19845 2681 1 9 . 1 1 21 21 LEU CA C 21 58.128 58.128 58.264 -0.136 19845 2682 1 9 . 1 1 21 21 LEU CB C 21 41.957 41.957 41.052 0.905 19845 2683 1 9 . 1 1 21 21 LEU H H 21 8.456 8.456 7.716 0.740 19845 2684 1 9 . 1 1 22 22 ALA N N 22 120.775 120.775 121.058 -0.283 19845 2685 1 9 . 1 1 22 22 ALA HA H 22 3.779 3.779 4.081 -0.302 19845 2686 1 9 . 1 1 22 22 ALA C C 22 175.697 175.697 180.192 -4.495 19845 2687 1 9 . 1 1 22 22 ALA CA C 22 55.721 55.721 54.671 1.050 19845 2688 1 9 . 1 1 22 22 ALA CB C 22 17.788 17.788 18.264 -0.475 19845 2689 1 9 . 1 1 22 22 ALA H H 22 8.353 8.353 7.588 0.765 19845 2690 1 9 . 1 1 23 23 PHE N N 23 117.860 117.860 119.808 -1.948 19845 2691 1 9 . 1 1 23 23 PHE HA H 23 4.108 4.108 4.342 -0.234 19845 2692 1 9 . 1 1 23 23 PHE C C 23 173.859 173.859 177.010 -3.151 19845 2693 1 9 . 1 1 23 23 PHE CA C 23 61.271 61.271 62.000 -0.729 19845 2694 1 9 . 1 1 23 23 PHE CB C 23 38.853 38.853 39.714 -0.861 19845 2695 1 9 . 1 1 23 23 PHE H H 23 8.121 8.121 8.222 -0.101 19845 2696 1 9 . 1 1 24 24 VAL N N 24 119.181 119.181 119.514 -0.333 19845 2697 1 9 . 1 1 24 24 VAL HA H 24 3.134 3.134 3.463 -0.329 19845 2698 1 9 . 1 1 24 24 VAL C C 24 174.684 174.684 177.851 -3.167 19845 2699 1 9 . 1 1 24 24 VAL CA C 24 67.419 67.419 67.575 -0.156 19845 2700 1 9 . 1 1 24 24 VAL CB C 24 31.106 31.106 31.718 -0.612 19845 2701 1 9 . 1 1 24 24 VAL H H 24 8.124 8.124 8.321 -0.197 19845 2702 1 9 . 1 1 25 25 VAL N N 25 119.215 119.215 116.750 2.465 19845 2703 1 9 . 1 1 25 25 VAL HA H 25 3.324 3.324 3.595 -0.271 19845 2704 1 9 . 1 1 25 25 VAL C C 25 174.244 174.244 177.636 -3.392 19845 2705 1 9 . 1 1 25 25 VAL CA C 25 67.740 67.740 66.424 1.317 19845 2706 1 9 . 1 1 25 25 VAL CB C 25 31.270 31.270 30.919 0.351 19845 2707 1 9 . 1 1 25 25 VAL H H 25 8.250 8.250 7.436 0.814 19845 2708 1 9 . 1 1 26 26 PHE N N 26 119.875 119.875 119.258 0.617 19845 2709 1 9 . 1 1 26 26 PHE HA H 26 3.900 3.900 4.167 -0.267 19845 2710 1 9 . 1 1 26 26 PHE C C 26 175.371 175.371 177.857 -2.486 19845 2711 1 9 . 1 1 26 26 PHE CA C 26 61.651 61.651 61.229 0.422 19845 2712 1 9 . 1 1 26 26 PHE CB C 26 38.760 38.760 38.516 0.244 19845 2713 1 9 . 1 1 26 26 PHE H H 26 8.413 8.413 7.152 1.261 19845 2714 1 9 . 1 1 27 27 LEU N N 27 122.548 122.548 118.954 3.594 19845 2715 1 9 . 1 1 27 27 LEU HA H 27 3.533 3.533 3.924 -0.391 19845 2716 1 9 . 1 1 27 27 LEU C C 27 175.256 175.256 179.109 -3.853 19845 2717 1 9 . 1 1 27 27 LEU CA C 27 58.211 58.211 57.553 0.658 19845 2718 1 9 . 1 1 27 27 LEU CB C 27 41.564 41.564 41.454 0.110 19845 2719 1 9 . 1 1 27 27 LEU H H 27 8.453 8.453 8.114 0.339 19845 2720 1 9 . 1 1 28 28 LEU N N 28 119.385 119.385 119.767 -0.382 19845 2721 1 9 . 1 1 28 28 LEU HA H 28 3.799 3.799 3.903 -0.104 19845 2722 1 9 . 1 1 28 28 LEU C C 28 175.881 175.881 179.078 -3.197 19845 2723 1 9 . 1 1 28 28 LEU CA C 28 58.492 58.492 58.082 0.410 19845 2724 1 9 . 1 1 28 28 LEU CB C 28 41.760 41.760 41.559 0.201 19845 2725 1 9 . 1 1 28 28 LEU H H 28 8.248 8.248 8.367 -0.119 19845 2726 1 9 . 1 1 29 29 VAL N N 29 118.515 118.515 114.085 4.430 19845 2727 1 9 . 1 1 29 29 VAL HA H 29 3.319 3.319 3.855 -0.536 19845 2728 1 9 . 1 1 29 29 VAL C C 29 174.734 174.734 177.548 -2.814 19845 2729 1 9 . 1 1 29 29 VAL CA C 29 67.192 67.192 66.121 1.071 19845 2730 1 9 . 1 1 29 29 VAL CB C 29 31.175 31.175 31.648 -0.474 19845 2731 1 9 . 1 1 29 29 VAL H H 29 8.446 8.446 7.389 1.057 19845 2732 1 9 . 1 1 30 30 THR N N 30 117.313 117.313 117.533 -0.220 19845 2733 1 9 . 1 1 30 30 THR HA H 30 3.432 3.432 3.863 -0.431 19845 2734 1 9 . 1 1 30 30 THR CA C 30 68.606 68.606 66.792 1.814 19845 2735 1 9 . 1 1 30 30 THR CB C 30 67.147 67.147 68.560 -1.413 19845 2736 1 9 . 1 1 30 30 THR H H 30 7.923 7.923 7.964 -0.041 19845 2737 1 9 . 1 1 31 31 LEU N N 31 120.629 120.629 120.854 -0.225 19845 2738 1 9 . 1 1 31 31 LEU HA H 31 3.858 3.858 3.929 -0.071 19845 2739 1 9 . 1 1 31 31 LEU C C 31 177.164 177.164 178.493 -1.329 19845 2740 1 9 . 1 1 31 31 LEU CA C 31 58.145 58.145 57.699 0.446 19845 2741 1 9 . 1 1 31 31 LEU CB C 31 41.615 41.615 41.723 -0.108 19845 2742 1 9 . 1 1 31 31 LEU H H 31 8.382 8.382 7.970 0.412 19845 2743 1 9 . 1 1 32 32 ALA N N 32 125.216 125.216 121.695 3.521 19845 2744 1 9 . 1 1 32 32 ALA HA H 32 3.836 3.836 3.925 -0.089 19845 2745 1 9 . 1 1 32 32 ALA C C 32 175.968 175.968 180.523 -4.555 19845 2746 1 9 . 1 1 32 32 ALA CA C 32 55.918 55.918 54.817 1.101 19845 2747 1 9 . 1 1 32 32 ALA CB C 32 17.802 17.802 18.140 -0.338 19845 2748 1 9 . 1 1 32 32 ALA H H 32 8.517 8.517 7.727 0.790 19845 2749 1 9 . 1 1 33 33 ILE N N 33 118.722 118.722 118.973 -0.251 19845 2750 1 9 . 1 1 33 33 ILE HA H 33 3.481 3.481 3.585 -0.104 19845 2751 1 9 . 1 1 33 33 ILE C C 33 175.004 175.004 178.088 -3.084 19845 2752 1 9 . 1 1 33 33 ILE CA C 33 65.554 65.554 64.863 0.691 19845 2753 1 9 . 1 1 33 33 ILE CB C 33 37.657 37.657 37.348 0.309 19845 2754 1 9 . 1 1 33 33 ILE H H 33 8.288 8.288 7.570 0.718 19845 2755 1 9 . 1 1 34 34 LEU N N 34 118.987 118.987 120.111 -1.124 19845 2756 1 9 . 1 1 34 34 LEU HA H 34 3.893 3.893 4.001 -0.108 19845 2757 1 9 . 1 1 34 34 LEU C C 34 176.439 176.439 178.312 -1.873 19845 2758 1 9 . 1 1 34 34 LEU CA C 34 58.436 58.436 57.977 0.459 19845 2759 1 9 . 1 1 34 34 LEU CB C 34 42.152 42.152 41.121 1.030 19845 2760 1 9 . 1 1 34 34 LEU H H 34 8.493 8.493 8.129 0.364 19845 2761 1 9 . 1 1 35 35 THR N N 35 116.630 116.630 115.343 1.287 19845 2762 1 9 . 1 1 35 35 THR HA H 35 3.652 3.652 3.916 -0.264 19845 2763 1 9 . 1 1 35 35 THR C C 35 173.366 173.366 176.166 -2.800 19845 2764 1 9 . 1 1 35 35 THR CA C 35 68.153 68.153 66.543 1.610 19845 2765 1 9 . 1 1 35 35 THR CB C 35 68.162 68.162 67.994 0.168 19845 2766 1 9 . 1 1 35 35 THR H H 35 8.215 8.215 8.186 0.029 19845 2767 1 9 . 1 1 36 36 ALA N N 36 124.667 124.667 122.993 1.674 19845 2768 1 9 . 1 1 36 36 ALA HA H 36 3.864 3.864 3.948 -0.084 19845 2769 1 9 . 1 1 36 36 ALA C C 36 176.510 176.510 179.190 -2.680 19845 2770 1 9 . 1 1 36 36 ALA CA C 36 55.758 55.758 55.049 0.709 19845 2771 1 9 . 1 1 36 36 ALA CB C 36 18.054 18.054 18.227 -0.173 19845 2772 1 9 . 1 1 36 36 ALA H H 36 8.358 8.358 7.959 0.399 19845 2773 1 9 . 1 1 37 37 LEU N N 37 116.565 116.565 117.836 -1.271 19845 2774 1 9 . 1 1 37 37 LEU HA H 37 3.973 3.973 4.127 -0.154 19845 2775 1 9 . 1 1 37 37 LEU C C 37 176.538 176.538 179.171 -2.633 19845 2776 1 9 . 1 1 37 37 LEU CA C 37 57.853 57.853 57.184 0.669 19845 2777 1 9 . 1 1 37 37 LEU CB C 37 42.018 42.018 40.607 1.411 19845 2778 1 9 . 1 1 37 37 LEU H H 37 8.360 8.360 7.565 0.795 19845 2779 1 9 . 1 1 38 38 ARG N N 38 119.392 119.392 119.888 -0.496 19845 2780 1 9 . 1 1 38 38 ARG HA H 38 4.104 4.104 4.088 0.016 19845 2781 1 9 . 1 1 38 38 ARG C C 38 176.208 176.208 179.393 -3.185 19845 2782 1 9 . 1 1 38 38 ARG CA C 38 58.100 58.100 58.970 -0.870 19845 2783 1 9 . 1 1 38 38 ARG CB C 38 29.502 29.502 29.616 -0.114 19845 2784 1 9 . 1 1 38 38 ARG H H 38 8.082 8.082 7.429 0.653 19845 2785 1 9 . 1 1 39 39 LEU N N 39 120.438 120.438 118.385 2.053 19845 2786 1 9 . 1 1 39 39 LEU HA H 39 4.243 4.243 3.851 0.392 19845 2787 1 9 . 1 1 39 39 LEU C C 39 175.702 175.702 178.431 -2.729 19845 2788 1 9 . 1 1 39 39 LEU CA C 39 56.979 56.979 57.660 -0.681 19845 2789 1 9 . 1 1 39 39 LEU CB C 39 41.893 41.893 41.129 0.764 19845 2790 1 9 . 1 1 39 39 LEU H H 39 8.446 8.446 7.784 0.662 19845 2791 1 9 . 1 1 40 40 ALA N N 40 122.512 122.512 120.277 2.235 19845 2792 1 9 . 1 1 40 40 ALA HA H 40 3.975 3.975 4.090 -0.115 19845 2793 1 9 . 1 1 40 40 ALA C C 40 175.838 175.838 178.632 -2.794 19845 2794 1 9 . 1 1 40 40 ALA CA C 40 54.710 54.710 54.411 0.299 19845 2795 1 9 . 1 1 40 40 ALA CB C 40 18.319 18.319 17.926 0.393 19845 2796 1 9 . 1 1 40 40 ALA H H 40 8.321 8.321 7.404 0.917 19845 2797 1 9 . 1 1 41 41 ALA N N 41 119.754 119.754 120.583 -0.829 19845 2798 1 9 . 1 1 41 41 ALA HA H 41 4.024 4.024 4.190 -0.166 19845 2799 1 9 . 1 1 41 41 ALA C C 41 176.517 176.517 179.864 -3.347 19845 2800 1 9 . 1 1 41 41 ALA CA C 41 54.486 54.486 54.698 -0.212 19845 2801 1 9 . 1 1 41 41 ALA CB C 41 18.468 18.468 18.716 -0.248 19845 2802 1 9 . 1 1 41 41 ALA H H 41 8.038 8.038 8.041 -0.003 19845 2803 1 9 . 1 1 42 42 TYR N N 42 118.272 118.272 119.460 -1.188 19845 2804 1 9 . 1 1 42 42 TYR HA H 42 4.326 4.326 4.218 0.108 19845 2805 1 9 . 1 1 42 42 TYR C C 42 174.633 174.633 177.904 -3.271 19845 2806 1 9 . 1 1 42 42 TYR CA C 42 60.098 60.098 60.300 -0.202 19845 2807 1 9 . 1 1 42 42 TYR CB C 42 38.936 38.936 37.541 1.395 19845 2808 1 9 . 1 1 42 42 TYR H H 42 7.814 7.814 7.927 -0.113 19845 2809 1 9 . 1 1 43 43 ALA N N 43 122.908 122.908 121.023 1.885 19845 2810 1 9 . 1 1 43 43 ALA HA H 43 4.111 4.111 4.134 -0.023 19845 2811 1 9 . 1 1 43 43 ALA C C 43 175.241 175.241 177.929 -2.688 19845 2812 1 9 . 1 1 43 43 ALA CA C 43 53.842 53.842 53.837 0.005 19845 2813 1 9 . 1 1 43 43 ALA CB C 43 18.427 18.427 17.959 0.468 19845 2814 1 9 . 1 1 43 43 ALA H H 43 8.172 8.172 7.742 0.430 19845 2815 1 9 . 1 1 44 44 ALA N N 44 119.906 119.906 119.473 0.433 19845 2816 1 9 . 1 1 44 44 ALA HA H 44 4.051 4.051 4.231 -0.180 19845 2817 1 9 . 1 1 44 44 ALA C C 44 175.092 175.092 178.289 -3.197 19845 2818 1 9 . 1 1 44 44 ALA CA C 44 53.611 53.611 53.727 -0.116 19845 2819 1 9 . 1 1 44 44 ALA CB C 44 18.689 18.689 19.210 -0.522 19845 2820 1 9 . 1 1 44 44 ALA H H 44 7.953 7.953 7.770 0.183 19845 2821 1 9 . 1 1 45 45 ASN N N 45 114.984 114.984 117.068 -2.084 19845 2822 1 9 . 1 1 45 45 ASN HA H 45 4.541 4.541 4.844 -0.303 19845 2823 1 9 . 1 1 45 45 ASN CA C 45 54.506 54.506 54.486 0.020 19845 2824 1 9 . 1 1 45 45 ASN CB C 45 38.602 38.602 39.555 -0.953 19845 2825 1 9 . 1 1 45 45 ASN H H 45 7.847 7.847 8.360 -0.513 19845 2826 1 9 . 1 1 46 46 ILE N N 46 119.155 119.155 116.904 2.251 19845 2827 1 9 . 1 1 46 46 ILE HA H 46 4.033 4.033 4.344 -0.311 19845 2828 1 9 . 1 1 46 46 ILE C C 46 173.344 173.344 175.811 -2.467 19845 2829 1 9 . 1 1 46 46 ILE CA C 46 62.357 62.357 61.906 0.451 19845 2830 1 9 . 1 1 46 46 ILE CB C 46 38.657 38.657 38.298 0.359 19845 2831 1 9 . 1 1 46 46 ILE H H 46 7.790 7.790 7.674 0.116 19845 2832 1 9 . 1 1 47 47 VAL N N 47 117.526 117.526 117.297 0.229 19845 2833 1 9 . 1 1 47 47 VAL HA H 47 4.133 4.133 4.348 -0.215 19845 2834 1 9 . 1 1 47 47 VAL C C 47 172.672 172.672 174.949 -2.277 19845 2835 1 9 . 1 1 47 47 VAL CA C 47 62.149 62.149 60.309 1.840 19845 2836 1 9 . 1 1 47 47 VAL CB C 47 32.807 32.807 34.737 -1.930 19845 2837 1 9 . 1 1 47 47 VAL H H 47 7.582 7.582 7.626 -0.044 19845 2838 1 9 . 1 1 48 48 ASN N N 48 120.091 120.091 119.116 0.975 19845 2839 1 9 . 1 1 48 48 ASN HA H 48 4.658 4.658 4.838 -0.180 19845 2840 1 9 . 1 1 48 48 ASN CA C 48 53.478 53.478 53.259 0.219 19845 2841 1 9 . 1 1 48 48 ASN CB C 48 38.573 38.573 37.948 0.625 19845 2842 1 9 . 1 1 48 48 ASN H H 48 8.053 8.053 8.479 -0.426 19845 2843 1 9 . 1 1 49 49 VAL N N 49 118.854 118.854 119.001 -0.147 19845 2844 1 9 . 1 1 49 49 VAL HA H 49 4.133 4.133 4.167 -0.034 19845 2845 1 9 . 1 1 49 49 VAL C C 49 172.595 172.595 174.866 -2.271 19845 2846 1 9 . 1 1 49 49 VAL CA C 49 62.049 62.049 60.815 1.234 19845 2847 1 9 . 1 1 49 49 VAL CB C 49 33.271 33.271 33.808 -0.537 19845 2848 1 9 . 1 1 49 49 VAL H H 49 7.685 7.685 7.382 0.303 19845 2849 1 9 . 1 1 50 50 SER N N 50 118.689 118.689 118.856 -0.167 19845 2850 1 9 . 1 1 50 50 SER HA H 50 4.466 4.466 4.165 0.301 19845 2851 1 9 . 1 1 50 50 SER C C 50 171.430 171.430 172.433 -1.003 19845 2852 1 9 . 1 1 50 50 SER CA C 50 58.128 58.128 57.513 0.615 19845 2853 1 9 . 1 1 50 50 SER CB C 50 63.916 63.916 63.927 -0.011 19845 2854 1 9 . 1 1 50 50 SER H H 50 8.075 8.075 8.077 -0.002 19845 2855 1 9 . 1 1 51 51 LEU N N 51 123.536 123.536 121.928 1.608 19845 2856 1 9 . 1 1 51 51 LEU HA H 51 4.305 4.305 4.747 -0.442 19845 2857 1 9 . 1 1 51 51 LEU C C 51 174.110 174.110 175.640 -1.530 19845 2858 1 9 . 1 1 51 51 LEU CA C 51 55.145 55.145 54.426 0.719 19845 2859 1 9 . 1 1 51 51 LEU CB C 51 42.674 42.674 44.411 -1.737 19845 2860 1 9 . 1 1 51 51 LEU H H 51 7.991 7.991 7.887 0.104 19845 2861 1 9 . 1 1 52 52 VAL N N 52 119.649 119.649 119.015 0.634 19845 2862 1 9 . 1 1 52 52 VAL HA H 52 3.992 3.992 4.281 -0.289 19845 2863 1 9 . 1 1 52 52 VAL C C 52 172.476 172.476 177.300 -4.824 19845 2864 1 9 . 1 1 52 52 VAL CA C 52 62.772 62.772 62.899 -0.127 19845 2865 1 9 . 1 1 52 52 VAL CB C 52 33.066 33.066 32.246 0.820 19845 2866 1 9 . 1 1 52 52 VAL H H 52 7.536 7.536 8.382 -0.846 19845 2867 1 9 . 1 1 53 53 LYS N N 53 122.004 122.004 122.588 -0.584 19845 2868 1 9 . 1 1 53 53 LYS HA H 53 4.354 4.354 4.210 0.144 19845 2869 1 9 . 1 1 53 53 LYS CA C 53 56.567 56.567 59.706 -3.139 19845 2870 1 9 . 1 1 53 53 LYS CB C 53 31.689 31.689 30.080 1.609 19845 2871 1 9 . 1 1 53 53 LYS H H 53 8.038 8.038 8.443 -0.405 19845 2872 1 9 . 1 1 54 54 PRO HA H 54 4.353 4.353 4.461 -0.108 19845 2873 1 9 . 1 1 54 54 PRO CA C 54 65.103 65.103 64.805 0.298 19845 2874 1 9 . 1 1 54 54 PRO CB C 54 32.193 32.193 30.957 1.236 19845 2875 1 9 . 1 1 55 55 THR N N 55 111.485 111.485 110.137 1.348 19845 2876 1 9 . 1 1 55 55 THR HA H 55 3.910 3.910 4.778 -0.868 19845 2877 1 9 . 1 1 55 55 THR C C 55 172.822 172.822 176.685 -3.863 19845 2878 1 9 . 1 1 55 55 THR CA C 55 65.030 65.030 63.224 1.806 19845 2879 1 9 . 1 1 55 55 THR CB C 55 68.882 68.882 69.379 -0.497 19845 2880 1 9 . 1 1 55 55 THR H H 55 7.722 7.722 7.539 0.183 19845 2881 1 9 . 1 1 56 56 VAL N N 56 121.165 121.165 121.903 -0.738 19845 2882 1 9 . 1 1 56 56 VAL HA H 56 3.772 3.772 3.725 0.047 19845 2883 1 9 . 1 1 56 56 VAL C C 56 174.904 174.904 176.980 -2.076 19845 2884 1 9 . 1 1 56 56 VAL CA C 56 64.971 64.971 65.113 -0.142 19845 2885 1 9 . 1 1 56 56 VAL CB C 56 31.989 31.989 30.111 1.877 19845 2886 1 9 . 1 1 56 56 VAL H H 56 7.597 7.597 7.755 -0.158 19845 2887 1 9 . 1 1 57 57 TYR N N 57 122.177 122.177 117.633 4.544 19845 2888 1 9 . 1 1 57 57 TYR HA H 57 4.227 4.227 4.268 -0.041 19845 2889 1 9 . 1 1 57 57 TYR C C 57 174.969 174.969 177.406 -2.437 19845 2890 1 9 . 1 1 57 57 TYR CA C 57 60.755 60.755 59.613 1.142 19845 2891 1 9 . 1 1 57 57 TYR CB C 57 38.453 38.453 36.810 1.643 19845 2892 1 9 . 1 1 57 57 TYR H H 57 7.964 7.964 7.948 0.016 19845 2893 1 9 . 1 1 58 58 VAL N N 58 119.069 119.069 119.375 -0.306 19845 2894 1 9 . 1 1 58 58 VAL HA H 58 3.529 3.529 3.216 0.313 19845 2895 1 9 . 1 1 58 58 VAL C C 58 174.250 174.250 177.627 -3.377 19845 2896 1 9 . 1 1 58 58 VAL CA C 58 66.223 66.223 65.546 0.677 19845 2897 1 9 . 1 1 58 58 VAL CB C 58 31.803 31.803 30.683 1.121 19845 2898 1 9 . 1 1 58 58 VAL H H 58 8.018 8.018 7.310 0.708 19845 2899 1 9 . 1 1 59 59 TYR N N 59 120.360 120.360 120.859 -0.499 19845 2900 1 9 . 1 1 59 59 TYR HA H 59 4.115 4.115 3.948 0.167 19845 2901 1 9 . 1 1 59 59 TYR C C 59 173.899 173.899 177.841 -3.942 19845 2902 1 9 . 1 1 59 59 TYR CA C 59 60.929 60.929 61.735 -0.806 19845 2903 1 9 . 1 1 59 59 TYR CB C 59 38.602 38.602 37.914 0.688 19845 2904 1 9 . 1 1 59 59 TYR H H 59 8.142 8.142 8.010 0.132 19845 2905 1 9 . 1 1 60 60 SER N N 60 113.480 113.480 113.466 0.014 19845 2906 1 9 . 1 1 60 60 SER HA H 60 3.979 3.979 4.017 -0.038 19845 2907 1 9 . 1 1 60 60 SER C C 60 172.887 172.887 176.954 -4.067 19845 2908 1 9 . 1 1 60 60 SER CA C 60 60.987 60.987 61.177 -0.190 19845 2909 1 9 . 1 1 60 60 SER CB C 60 63.267 63.267 63.112 0.155 19845 2910 1 9 . 1 1 60 60 SER H H 60 8.057 8.057 7.766 0.291 19845 2911 1 9 . 1 1 61 61 ARG N N 61 120.962 120.962 121.946 -0.984 19845 2912 1 9 . 1 1 61 61 ARG HA H 61 4.103 4.103 3.968 0.135 19845 2913 1 9 . 1 1 61 61 ARG C C 61 175.399 175.399 177.996 -2.597 19845 2914 1 9 . 1 1 61 61 ARG CA C 61 57.427 57.427 58.539 -1.112 19845 2915 1 9 . 1 1 61 61 ARG CB C 61 30.008 30.008 29.886 0.122 19845 2916 1 9 . 1 1 61 61 ARG H H 61 7.606 7.606 7.176 0.430 19845 2917 1 9 . 1 1 62 62 VAL N N 62 117.852 117.852 117.033 0.819 19845 2918 1 9 . 1 1 62 62 VAL HA H 62 3.805 3.805 3.696 0.109 19845 2919 1 9 . 1 1 62 62 VAL C C 62 174.155 174.155 178.295 -4.140 19845 2920 1 9 . 1 1 62 62 VAL CA C 62 64.458 64.458 66.154 -1.696 19845 2921 1 9 . 1 1 62 62 VAL CB C 62 31.969 31.969 31.528 0.441 19845 2922 1 9 . 1 1 62 62 VAL H H 62 7.848 7.848 8.267 -0.419 19845 2923 1 9 . 1 1 63 63 LYS N N 63 119.254 119.254 118.590 0.664 19845 2924 1 9 . 1 1 63 63 LYS HA H 63 4.051 4.051 4.093 -0.042 19845 2925 1 9 . 1 1 63 63 LYS C C 63 173.615 173.615 177.380 -3.765 19845 2926 1 9 . 1 1 63 63 LYS CA C 63 56.727 56.727 58.403 -1.676 19845 2927 1 9 . 1 1 63 63 LYS CB C 63 32.105 32.105 32.523 -0.418 19845 2928 1 9 . 1 1 63 63 LYS H H 63 7.759 7.759 7.312 0.447 19845 2929 1 9 . 1 1 64 64 ASN N N 64 117.696 117.696 117.869 -0.173 19845 2930 1 9 . 1 1 64 64 ASN HA H 64 4.642 4.642 4.689 -0.047 19845 2931 1 9 . 1 1 64 64 ASN C C 64 171.750 171.750 174.068 -2.318 19845 2932 1 9 . 1 1 64 64 ASN CA C 64 53.313 53.313 53.431 -0.118 19845 2933 1 9 . 1 1 64 64 ASN CB C 64 39.260 39.260 39.233 0.027 19845 2934 1 9 . 1 1 64 64 ASN H H 64 7.615 7.615 7.898 -0.283 19845 2935 1 10 . 1 1 9 9 THR N N 9 113.692 113.692 115.238 -1.546 19845 2936 1 10 . 1 1 9 9 THR HA H 9 4.213 4.213 4.610 -0.397 19845 2937 1 10 . 1 1 9 9 THR C C 9 172.757 172.757 174.461 -1.704 19845 2938 1 10 . 1 1 9 9 THR CA C 9 62.810 62.810 63.632 -0.822 19845 2939 1 10 . 1 1 9 9 THR CB C 9 69.878 69.878 69.192 0.686 19845 2940 1 10 . 1 1 9 9 THR H H 9 7.930 7.930 8.628 -0.698 19845 2941 1 10 . 1 1 10 10 GLY N N 10 110.842 110.842 108.459 2.383 19845 2942 1 10 . 1 1 10 10 GLY C C 10 171.923 171.923 174.317 -2.394 19845 2943 1 10 . 1 1 10 10 GLY CA C 10 46.099 46.099 44.664 1.435 19845 2944 1 10 . 1 1 10 10 GLY H H 10 8.266 8.266 7.901 0.365 19845 2945 1 10 . 1 1 11 11 THR N N 11 113.754 113.754 116.526 -2.772 19845 2946 1 10 . 1 1 11 11 THR HA H 11 4.220 4.220 4.202 0.018 19845 2947 1 10 . 1 1 11 11 THR C C 11 171.906 171.906 175.254 -3.348 19845 2948 1 10 . 1 1 11 11 THR CA C 11 62.721 62.721 62.582 0.139 19845 2949 1 10 . 1 1 11 11 THR CB C 11 69.549 69.549 69.107 0.442 19845 2950 1 10 . 1 1 11 11 THR H H 11 7.753 7.753 7.789 -0.036 19845 2951 1 10 . 1 1 12 12 LEU N N 12 123.669 123.669 129.392 -5.723 19845 2952 1 10 . 1 1 12 12 LEU HA H 12 4.240 4.240 4.422 -0.182 19845 2953 1 10 . 1 1 12 12 LEU C C 12 175.221 175.221 177.226 -2.005 19845 2954 1 10 . 1 1 12 12 LEU CA C 12 56.799 56.799 55.211 1.588 19845 2955 1 10 . 1 1 12 12 LEU CB C 12 42.536 42.536 41.592 0.944 19845 2956 1 10 . 1 1 12 12 LEU H H 12 7.980 7.980 8.708 -0.728 19845 2957 1 10 . 1 1 13 13 ILE N N 13 120.086 120.086 121.012 -0.926 19845 2958 1 10 . 1 1 13 13 ILE HA H 13 3.913 3.913 4.007 -0.094 19845 2959 1 10 . 1 1 13 13 ILE C C 13 173.425 173.425 176.903 -3.478 19845 2960 1 10 . 1 1 13 13 ILE CA C 13 62.889 62.889 63.125 -0.236 19845 2961 1 10 . 1 1 13 13 ILE CB C 13 38.249 38.249 38.787 -0.538 19845 2962 1 10 . 1 1 13 13 ILE H H 13 7.861 7.861 7.380 0.481 19845 2963 1 10 . 1 1 14 14 VAL N N 14 119.785 119.785 120.270 -0.485 19845 2964 1 10 . 1 1 14 14 VAL HA H 14 3.790 3.790 3.824 -0.034 19845 2965 1 10 . 1 1 14 14 VAL C C 14 173.429 173.429 177.248 -3.819 19845 2966 1 10 . 1 1 14 14 VAL CA C 14 64.409 64.409 65.325 -0.916 19845 2967 1 10 . 1 1 14 14 VAL CB C 14 32.007 32.007 31.398 0.609 19845 2968 1 10 . 1 1 14 14 VAL H H 14 7.549 7.549 7.768 -0.219 19845 2969 1 10 . 1 1 15 15 ASN N N 15 119.567 119.567 117.309 2.258 19845 2970 1 10 . 1 1 15 15 ASN HA H 15 4.549 4.549 4.683 -0.134 19845 2971 1 10 . 1 1 15 15 ASN C C 15 173.619 173.619 177.485 -3.866 19845 2972 1 10 . 1 1 15 15 ASN CA C 15 54.805 54.805 55.736 -0.931 19845 2973 1 10 . 1 1 15 15 ASN CB C 15 38.824 38.824 38.611 0.213 19845 2974 1 10 . 1 1 15 15 ASN H H 15 8.010 8.010 8.165 -0.155 19845 2975 1 10 . 1 1 16 16 SER N N 16 116.730 116.730 116.711 0.019 19845 2976 1 10 . 1 1 16 16 SER HA H 16 4.177 4.177 4.442 -0.265 19845 2977 1 10 . 1 1 16 16 SER CA C 16 61.705 61.705 60.935 0.770 19845 2978 1 10 . 1 1 16 16 SER CB C 16 63.752 63.752 63.505 0.247 19845 2979 1 10 . 1 1 16 16 SER H H 16 8.039 8.039 7.566 0.473 19845 2980 1 10 . 1 1 17 17 VAL N N 17 122.062 122.062 122.128 -0.066 19845 2981 1 10 . 1 1 17 17 VAL HA H 17 3.677 3.677 3.844 -0.167 19845 2982 1 10 . 1 1 17 17 VAL C C 17 174.474 174.474 177.070 -2.596 19845 2983 1 10 . 1 1 17 17 VAL CA C 17 66.671 66.671 65.593 1.078 19845 2984 1 10 . 1 1 17 17 VAL CB C 17 31.531 31.531 31.685 -0.154 19845 2985 1 10 . 1 1 17 17 VAL H H 17 7.896 7.896 8.012 -0.116 19845 2986 1 10 . 1 1 18 18 LEU N N 18 119.103 119.103 120.185 -1.082 19845 2987 1 10 . 1 1 18 18 LEU HA H 18 3.998 3.998 4.200 -0.202 19845 2988 1 10 . 1 1 18 18 LEU C C 18 175.511 175.511 178.301 -2.790 19845 2989 1 10 . 1 1 18 18 LEU CA C 18 58.107 58.107 57.529 0.578 19845 2990 1 10 . 1 1 18 18 LEU CB C 18 41.593 41.593 42.125 -0.532 19845 2991 1 10 . 1 1 18 18 LEU H H 18 7.857 7.857 7.409 0.448 19845 2992 1 10 . 1 1 19 19 LEU N N 19 118.291 118.291 120.651 -2.360 19845 2993 1 10 . 1 1 19 19 LEU HA H 19 4.152 4.152 4.159 -0.007 19845 2994 1 10 . 1 1 19 19 LEU C C 19 175.156 175.156 178.546 -3.390 19845 2995 1 10 . 1 1 19 19 LEU CA C 19 58.011 58.011 57.897 0.114 19845 2996 1 10 . 1 1 19 19 LEU CB C 19 42.027 42.027 41.759 0.268 19845 2997 1 10 . 1 1 19 19 LEU H H 19 7.745 7.745 7.632 0.113 19845 2998 1 10 . 1 1 20 20 PHE N N 20 118.415 118.415 119.078 -0.663 19845 2999 1 10 . 1 1 20 20 PHE HA H 20 4.188 4.188 4.139 0.049 19845 3000 1 10 . 1 1 20 20 PHE C C 20 174.260 174.260 177.380 -3.120 19845 3001 1 10 . 1 1 20 20 PHE CA C 20 61.626 61.626 61.993 -0.367 19845 3002 1 10 . 1 1 20 20 PHE CB C 20 38.643 38.643 38.889 -0.246 19845 3003 1 10 . 1 1 20 20 PHE H H 20 8.002 8.002 8.317 -0.315 19845 3004 1 10 . 1 1 21 21 LEU N N 21 118.571 118.571 119.676 -1.105 19845 3005 1 10 . 1 1 21 21 LEU HA H 21 3.797 3.797 4.098 -0.301 19845 3006 1 10 . 1 1 21 21 LEU C C 21 175.324 175.324 178.943 -3.619 19845 3007 1 10 . 1 1 21 21 LEU CA C 21 58.128 58.128 58.304 -0.176 19845 3008 1 10 . 1 1 21 21 LEU CB C 21 41.957 41.957 41.099 0.858 19845 3009 1 10 . 1 1 21 21 LEU H H 21 8.456 8.456 7.706 0.750 19845 3010 1 10 . 1 1 22 22 ALA N N 22 120.775 120.775 121.163 -0.388 19845 3011 1 10 . 1 1 22 22 ALA HA H 22 3.779 3.779 4.079 -0.300 19845 3012 1 10 . 1 1 22 22 ALA C C 22 175.697 175.697 180.179 -4.482 19845 3013 1 10 . 1 1 22 22 ALA CA C 22 55.721 55.721 54.736 0.985 19845 3014 1 10 . 1 1 22 22 ALA CB C 22 17.788 17.788 18.301 -0.513 19845 3015 1 10 . 1 1 22 22 ALA H H 22 8.353 8.353 7.644 0.709 19845 3016 1 10 . 1 1 23 23 PHE N N 23 117.860 117.860 119.795 -1.935 19845 3017 1 10 . 1 1 23 23 PHE HA H 23 4.108 4.108 4.347 -0.239 19845 3018 1 10 . 1 1 23 23 PHE C C 23 173.859 173.859 177.014 -3.155 19845 3019 1 10 . 1 1 23 23 PHE CA C 23 61.271 61.271 62.045 -0.774 19845 3020 1 10 . 1 1 23 23 PHE CB C 23 38.853 38.853 39.612 -0.759 19845 3021 1 10 . 1 1 23 23 PHE H H 23 8.121 8.121 8.309 -0.188 19845 3022 1 10 . 1 1 24 24 VAL N N 24 119.181 119.181 119.687 -0.506 19845 3023 1 10 . 1 1 24 24 VAL HA H 24 3.134 3.134 3.529 -0.395 19845 3024 1 10 . 1 1 24 24 VAL C C 24 174.684 174.684 177.898 -3.214 19845 3025 1 10 . 1 1 24 24 VAL CA C 24 67.419 67.419 66.756 0.663 19845 3026 1 10 . 1 1 24 24 VAL CB C 24 31.106 31.106 30.920 0.186 19845 3027 1 10 . 1 1 24 24 VAL H H 24 8.124 8.124 8.373 -0.249 19845 3028 1 10 . 1 1 25 25 VAL N N 25 119.215 119.215 117.401 1.814 19845 3029 1 10 . 1 1 25 25 VAL HA H 25 3.324 3.324 3.618 -0.294 19845 3030 1 10 . 1 1 25 25 VAL C C 25 174.244 174.244 177.556 -3.312 19845 3031 1 10 . 1 1 25 25 VAL CA C 25 67.740 67.740 66.185 1.555 19845 3032 1 10 . 1 1 25 25 VAL CB C 25 31.270 31.270 30.862 0.408 19845 3033 1 10 . 1 1 25 25 VAL H H 25 8.250 8.250 7.456 0.794 19845 3034 1 10 . 1 1 26 26 PHE N N 26 119.875 119.875 118.611 1.264 19845 3035 1 10 . 1 1 26 26 PHE HA H 26 3.900 3.900 4.141 -0.241 19845 3036 1 10 . 1 1 26 26 PHE C C 26 175.371 175.371 177.638 -2.267 19845 3037 1 10 . 1 1 26 26 PHE CA C 26 61.651 61.651 61.374 0.277 19845 3038 1 10 . 1 1 26 26 PHE CB C 26 38.760 38.760 38.602 0.158 19845 3039 1 10 . 1 1 26 26 PHE H H 26 8.413 8.413 7.128 1.285 19845 3040 1 10 . 1 1 27 27 LEU N N 27 122.548 122.548 119.132 3.416 19845 3041 1 10 . 1 1 27 27 LEU HA H 27 3.533 3.533 3.891 -0.358 19845 3042 1 10 . 1 1 27 27 LEU C C 27 175.256 175.256 179.191 -3.935 19845 3043 1 10 . 1 1 27 27 LEU CA C 27 58.211 58.211 57.707 0.504 19845 3044 1 10 . 1 1 27 27 LEU CB C 27 41.564 41.564 41.406 0.158 19845 3045 1 10 . 1 1 27 27 LEU H H 27 8.453 8.453 8.276 0.177 19845 3046 1 10 . 1 1 28 28 LEU N N 28 119.385 119.385 119.898 -0.513 19845 3047 1 10 . 1 1 28 28 LEU HA H 28 3.799 3.799 3.922 -0.123 19845 3048 1 10 . 1 1 28 28 LEU C C 28 175.881 175.881 179.307 -3.426 19845 3049 1 10 . 1 1 28 28 LEU CA C 28 58.492 58.492 58.016 0.476 19845 3050 1 10 . 1 1 28 28 LEU CB C 28 41.760 41.760 41.465 0.295 19845 3051 1 10 . 1 1 28 28 LEU H H 28 8.248 8.248 8.356 -0.108 19845 3052 1 10 . 1 1 29 29 VAL N N 29 118.515 118.515 117.845 0.670 19845 3053 1 10 . 1 1 29 29 VAL HA H 29 3.319 3.319 3.846 -0.527 19845 3054 1 10 . 1 1 29 29 VAL C C 29 174.734 174.734 177.831 -3.097 19845 3055 1 10 . 1 1 29 29 VAL CA C 29 67.192 67.192 65.445 1.748 19845 3056 1 10 . 1 1 29 29 VAL CB C 29 31.175 31.175 31.509 -0.334 19845 3057 1 10 . 1 1 29 29 VAL H H 29 8.446 8.446 7.374 1.072 19845 3058 1 10 . 1 1 30 30 THR N N 30 117.313 117.313 117.147 0.166 19845 3059 1 10 . 1 1 30 30 THR HA H 30 3.432 3.432 3.933 -0.501 19845 3060 1 10 . 1 1 30 30 THR CA C 30 68.606 68.606 66.729 1.877 19845 3061 1 10 . 1 1 30 30 THR CB C 30 67.147 67.147 68.376 -1.228 19845 3062 1 10 . 1 1 30 30 THR H H 30 7.923 7.923 8.227 -0.304 19845 3063 1 10 . 1 1 31 31 LEU N N 31 120.629 120.629 120.631 -0.002 19845 3064 1 10 . 1 1 31 31 LEU HA H 31 3.858 3.858 3.923 -0.065 19845 3065 1 10 . 1 1 31 31 LEU C C 31 177.164 177.164 178.472 -1.308 19845 3066 1 10 . 1 1 31 31 LEU CA C 31 58.145 58.145 57.770 0.375 19845 3067 1 10 . 1 1 31 31 LEU CB C 31 41.615 41.615 41.512 0.103 19845 3068 1 10 . 1 1 31 31 LEU H H 31 8.382 8.382 8.059 0.323 19845 3069 1 10 . 1 1 32 32 ALA N N 32 125.216 125.216 121.724 3.492 19845 3070 1 10 . 1 1 32 32 ALA HA H 32 3.836 3.836 3.919 -0.083 19845 3071 1 10 . 1 1 32 32 ALA C C 32 175.968 175.968 180.524 -4.556 19845 3072 1 10 . 1 1 32 32 ALA CA C 32 55.918 55.918 54.806 1.112 19845 3073 1 10 . 1 1 32 32 ALA CB C 32 17.802 17.802 18.137 -0.335 19845 3074 1 10 . 1 1 32 32 ALA H H 32 8.517 8.517 7.691 0.826 19845 3075 1 10 . 1 1 33 33 ILE N N 33 118.722 118.722 118.982 -0.260 19845 3076 1 10 . 1 1 33 33 ILE HA H 33 3.481 3.481 3.558 -0.077 19845 3077 1 10 . 1 1 33 33 ILE C C 33 175.004 175.004 178.068 -3.064 19845 3078 1 10 . 1 1 33 33 ILE CA C 33 65.554 65.554 65.101 0.453 19845 3079 1 10 . 1 1 33 33 ILE CB C 33 37.657 37.657 37.393 0.264 19845 3080 1 10 . 1 1 33 33 ILE H H 33 8.288 8.288 7.591 0.697 19845 3081 1 10 . 1 1 34 34 LEU N N 34 118.987 118.987 119.927 -0.940 19845 3082 1 10 . 1 1 34 34 LEU HA H 34 3.893 3.893 3.928 -0.035 19845 3083 1 10 . 1 1 34 34 LEU C C 34 176.439 176.439 178.442 -2.003 19845 3084 1 10 . 1 1 34 34 LEU CA C 34 58.436 58.436 57.931 0.505 19845 3085 1 10 . 1 1 34 34 LEU CB C 34 42.152 42.152 41.589 0.563 19845 3086 1 10 . 1 1 34 34 LEU H H 34 8.493 8.493 8.168 0.325 19845 3087 1 10 . 1 1 35 35 THR N N 35 116.630 116.630 115.618 1.012 19845 3088 1 10 . 1 1 35 35 THR HA H 35 3.652 3.652 3.900 -0.248 19845 3089 1 10 . 1 1 35 35 THR C C 35 173.366 173.366 175.812 -2.446 19845 3090 1 10 . 1 1 35 35 THR CA C 35 68.153 68.153 66.178 1.975 19845 3091 1 10 . 1 1 35 35 THR CB C 35 68.162 68.162 68.032 0.130 19845 3092 1 10 . 1 1 35 35 THR H H 35 8.215 8.215 8.170 0.045 19845 3093 1 10 . 1 1 36 36 ALA N N 36 124.667 124.667 123.191 1.476 19845 3094 1 10 . 1 1 36 36 ALA HA H 36 3.864 3.864 3.947 -0.083 19845 3095 1 10 . 1 1 36 36 ALA C C 36 176.510 176.510 179.186 -2.676 19845 3096 1 10 . 1 1 36 36 ALA CA C 36 55.758 55.758 55.070 0.688 19845 3097 1 10 . 1 1 36 36 ALA CB C 36 18.054 18.054 18.200 -0.146 19845 3098 1 10 . 1 1 36 36 ALA H H 36 8.358 8.358 7.959 0.399 19845 3099 1 10 . 1 1 37 37 LEU N N 37 116.565 116.565 117.953 -1.388 19845 3100 1 10 . 1 1 37 37 LEU HA H 37 3.973 3.973 4.097 -0.124 19845 3101 1 10 . 1 1 37 37 LEU C C 37 176.538 176.538 179.057 -2.519 19845 3102 1 10 . 1 1 37 37 LEU CA C 37 57.853 57.853 57.430 0.423 19845 3103 1 10 . 1 1 37 37 LEU CB C 37 42.018 42.018 40.813 1.205 19845 3104 1 10 . 1 1 37 37 LEU H H 37 8.360 8.360 7.537 0.823 19845 3105 1 10 . 1 1 38 38 ARG N N 38 119.392 119.392 119.807 -0.415 19845 3106 1 10 . 1 1 38 38 ARG HA H 38 4.104 4.104 4.056 0.048 19845 3107 1 10 . 1 1 38 38 ARG C C 38 176.208 176.208 179.335 -3.127 19845 3108 1 10 . 1 1 38 38 ARG CA C 38 58.100 58.100 59.437 -1.337 19845 3109 1 10 . 1 1 38 38 ARG CB C 38 29.502 29.502 29.916 -0.414 19845 3110 1 10 . 1 1 38 38 ARG H H 38 8.082 8.082 7.396 0.686 19845 3111 1 10 . 1 1 39 39 LEU N N 39 120.438 120.438 117.944 2.494 19845 3112 1 10 . 1 1 39 39 LEU HA H 39 4.243 4.243 3.934 0.309 19845 3113 1 10 . 1 1 39 39 LEU C C 39 175.702 175.702 178.576 -2.874 19845 3114 1 10 . 1 1 39 39 LEU CA C 39 56.979 56.979 57.447 -0.468 19845 3115 1 10 . 1 1 39 39 LEU CB C 39 41.893 41.893 41.283 0.610 19845 3116 1 10 . 1 1 39 39 LEU H H 39 8.446 8.446 7.812 0.634 19845 3117 1 10 . 1 1 40 40 ALA N N 40 122.512 122.512 120.717 1.795 19845 3118 1 10 . 1 1 40 40 ALA HA H 40 3.975 3.975 4.065 -0.090 19845 3119 1 10 . 1 1 40 40 ALA C C 40 175.838 175.838 178.664 -2.826 19845 3120 1 10 . 1 1 40 40 ALA CA C 40 54.710 54.710 54.534 0.176 19845 3121 1 10 . 1 1 40 40 ALA CB C 40 18.319 18.319 17.947 0.372 19845 3122 1 10 . 1 1 40 40 ALA H H 40 8.321 8.321 7.479 0.842 19845 3123 1 10 . 1 1 41 41 ALA N N 41 119.754 119.754 120.548 -0.794 19845 3124 1 10 . 1 1 41 41 ALA HA H 41 4.024 4.024 4.187 -0.163 19845 3125 1 10 . 1 1 41 41 ALA C C 41 176.517 176.517 179.879 -3.362 19845 3126 1 10 . 1 1 41 41 ALA CA C 41 54.486 54.486 54.712 -0.226 19845 3127 1 10 . 1 1 41 41 ALA CB C 41 18.468 18.468 18.681 -0.213 19845 3128 1 10 . 1 1 41 41 ALA H H 41 8.038 8.038 8.033 0.005 19845 3129 1 10 . 1 1 42 42 TYR N N 42 118.272 118.272 118.785 -0.513 19845 3130 1 10 . 1 1 42 42 TYR HA H 42 4.326 4.326 4.221 0.105 19845 3131 1 10 . 1 1 42 42 TYR C C 42 174.633 174.633 177.780 -3.147 19845 3132 1 10 . 1 1 42 42 TYR CA C 42 60.098 60.098 60.097 0.001 19845 3133 1 10 . 1 1 42 42 TYR CB C 42 38.936 38.936 37.392 1.544 19845 3134 1 10 . 1 1 42 42 TYR H H 42 7.814 7.814 8.031 -0.217 19845 3135 1 10 . 1 1 43 43 ALA N N 43 122.908 122.908 121.204 1.704 19845 3136 1 10 . 1 1 43 43 ALA HA H 43 4.111 4.111 4.165 -0.054 19845 3137 1 10 . 1 1 43 43 ALA C C 43 175.241 175.241 178.024 -2.783 19845 3138 1 10 . 1 1 43 43 ALA CA C 43 53.842 53.842 53.868 -0.026 19845 3139 1 10 . 1 1 43 43 ALA CB C 43 18.427 18.427 17.914 0.513 19845 3140 1 10 . 1 1 43 43 ALA H H 43 8.172 8.172 7.573 0.599 19845 3141 1 10 . 1 1 44 44 ALA N N 44 119.906 119.906 119.532 0.374 19845 3142 1 10 . 1 1 44 44 ALA HA H 44 4.051 4.051 4.210 -0.159 19845 3143 1 10 . 1 1 44 44 ALA C C 44 175.092 175.092 177.983 -2.891 19845 3144 1 10 . 1 1 44 44 ALA CA C 44 53.611 53.611 53.529 0.082 19845 3145 1 10 . 1 1 44 44 ALA CB C 44 18.689 18.689 19.108 -0.419 19845 3146 1 10 . 1 1 44 44 ALA H H 44 7.953 7.953 7.737 0.216 19845 3147 1 10 . 1 1 45 45 ASN N N 45 114.984 114.984 116.964 -1.980 19845 3148 1 10 . 1 1 45 45 ASN HA H 45 4.541 4.541 4.730 -0.189 19845 3149 1 10 . 1 1 45 45 ASN CA C 45 54.506 54.506 54.532 -0.026 19845 3150 1 10 . 1 1 45 45 ASN CB C 45 38.602 38.602 40.221 -1.619 19845 3151 1 10 . 1 1 45 45 ASN H H 45 7.847 7.847 8.149 -0.302 19845 3152 1 10 . 1 1 46 46 ILE N N 46 119.155 119.155 117.470 1.685 19845 3153 1 10 . 1 1 46 46 ILE HA H 46 4.033 4.033 4.371 -0.338 19845 3154 1 10 . 1 1 46 46 ILE C C 46 173.344 173.344 175.720 -2.376 19845 3155 1 10 . 1 1 46 46 ILE CA C 46 62.357 62.357 62.062 0.295 19845 3156 1 10 . 1 1 46 46 ILE CB C 46 38.657 38.657 38.617 0.040 19845 3157 1 10 . 1 1 46 46 ILE H H 46 7.790 7.790 7.636 0.154 19845 3158 1 10 . 1 1 47 47 VAL N N 47 117.526 117.526 114.927 2.599 19845 3159 1 10 . 1 1 47 47 VAL HA H 47 4.133 4.133 4.445 -0.312 19845 3160 1 10 . 1 1 47 47 VAL C C 47 172.672 172.672 175.284 -2.612 19845 3161 1 10 . 1 1 47 47 VAL CA C 47 62.149 62.149 59.925 2.224 19845 3162 1 10 . 1 1 47 47 VAL CB C 47 32.807 32.807 34.757 -1.950 19845 3163 1 10 . 1 1 47 47 VAL H H 47 7.582 7.582 7.525 0.057 19845 3164 1 10 . 1 1 48 48 ASN N N 48 120.091 120.091 120.113 -0.022 19845 3165 1 10 . 1 1 48 48 ASN HA H 48 4.658 4.658 4.917 -0.259 19845 3166 1 10 . 1 1 48 48 ASN CA C 48 53.478 53.478 52.933 0.545 19845 3167 1 10 . 1 1 48 48 ASN CB C 48 38.573 38.573 37.186 1.387 19845 3168 1 10 . 1 1 48 48 ASN H H 48 8.053 8.053 8.635 -0.582 19845 3169 1 10 . 1 1 49 49 VAL N N 49 118.854 118.854 120.316 -1.462 19845 3170 1 10 . 1 1 49 49 VAL HA H 49 4.133 4.133 4.225 -0.092 19845 3171 1 10 . 1 1 49 49 VAL C C 49 172.595 172.595 174.041 -1.446 19845 3172 1 10 . 1 1 49 49 VAL CA C 49 62.049 62.049 60.381 1.668 19845 3173 1 10 . 1 1 49 49 VAL CB C 49 33.271 33.271 33.531 -0.260 19845 3174 1 10 . 1 1 49 49 VAL H H 49 7.685 7.685 7.462 0.223 19845 3175 1 10 . 1 1 50 50 SER N N 50 118.689 118.689 121.585 -2.896 19845 3176 1 10 . 1 1 50 50 SER HA H 50 4.466 4.466 4.243 0.223 19845 3177 1 10 . 1 1 50 50 SER C C 50 171.430 171.430 172.417 -0.987 19845 3178 1 10 . 1 1 50 50 SER CA C 50 58.128 58.128 57.377 0.751 19845 3179 1 10 . 1 1 50 50 SER CB C 50 63.916 63.916 64.524 -0.608 19845 3180 1 10 . 1 1 50 50 SER H H 50 8.075 8.075 7.997 0.078 19845 3181 1 10 . 1 1 51 51 LEU N N 51 123.536 123.536 119.900 3.636 19845 3182 1 10 . 1 1 51 51 LEU HA H 51 4.305 4.305 4.697 -0.392 19845 3183 1 10 . 1 1 51 51 LEU C C 51 174.110 174.110 175.859 -1.749 19845 3184 1 10 . 1 1 51 51 LEU CA C 51 55.145 55.145 54.341 0.804 19845 3185 1 10 . 1 1 51 51 LEU CB C 51 42.674 42.674 44.498 -1.824 19845 3186 1 10 . 1 1 51 51 LEU H H 51 7.991 7.991 7.815 0.176 19845 3187 1 10 . 1 1 52 52 VAL N N 52 119.649 119.649 118.925 0.724 19845 3188 1 10 . 1 1 52 52 VAL HA H 52 3.992 3.992 4.246 -0.254 19845 3189 1 10 . 1 1 52 52 VAL C C 52 172.476 172.476 176.803 -4.327 19845 3190 1 10 . 1 1 52 52 VAL CA C 52 62.772 62.772 62.697 0.075 19845 3191 1 10 . 1 1 52 52 VAL CB C 52 33.066 33.066 32.639 0.427 19845 3192 1 10 . 1 1 52 52 VAL H H 52 7.536 7.536 8.145 -0.609 19845 3193 1 10 . 1 1 53 53 LYS N N 53 122.004 122.004 122.618 -0.614 19845 3194 1 10 . 1 1 53 53 LYS HA H 53 4.354 4.354 4.204 0.150 19845 3195 1 10 . 1 1 53 53 LYS CA C 53 56.567 56.567 59.752 -3.185 19845 3196 1 10 . 1 1 53 53 LYS CB C 53 31.689 31.689 30.005 1.684 19845 3197 1 10 . 1 1 53 53 LYS H H 53 8.038 8.038 8.490 -0.452 19845 3198 1 10 . 1 1 54 54 PRO HA H 54 4.353 4.353 4.481 -0.128 19845 3199 1 10 . 1 1 54 54 PRO CA C 54 65.103 65.103 65.016 0.087 19845 3200 1 10 . 1 1 54 54 PRO CB C 54 32.193 32.193 30.955 1.238 19845 3201 1 10 . 1 1 55 55 THR N N 55 111.485 111.485 111.455 0.030 19845 3202 1 10 . 1 1 55 55 THR HA H 55 3.910 3.910 4.768 -0.858 19845 3203 1 10 . 1 1 55 55 THR C C 55 172.822 172.822 176.650 -3.828 19845 3204 1 10 . 1 1 55 55 THR CA C 55 65.030 65.030 63.575 1.455 19845 3205 1 10 . 1 1 55 55 THR CB C 55 68.882 68.882 69.288 -0.406 19845 3206 1 10 . 1 1 55 55 THR H H 55 7.722 7.722 7.652 0.070 19845 3207 1 10 . 1 1 56 56 VAL N N 56 121.165 121.165 120.632 0.533 19845 3208 1 10 . 1 1 56 56 VAL HA H 56 3.772 3.772 3.745 0.027 19845 3209 1 10 . 1 1 56 56 VAL C C 56 174.904 174.904 176.759 -1.855 19845 3210 1 10 . 1 1 56 56 VAL CA C 56 64.971 64.971 66.272 -1.300 19845 3211 1 10 . 1 1 56 56 VAL CB C 56 31.989 31.989 30.454 1.535 19845 3212 1 10 . 1 1 56 56 VAL H H 56 7.597 7.597 7.722 -0.125 19845 3213 1 10 . 1 1 57 57 TYR N N 57 122.177 122.177 118.755 3.422 19845 3214 1 10 . 1 1 57 57 TYR HA H 57 4.227 4.227 4.229 -0.002 19845 3215 1 10 . 1 1 57 57 TYR C C 57 174.969 174.969 177.434 -2.465 19845 3216 1 10 . 1 1 57 57 TYR CA C 57 60.755 60.755 59.825 0.930 19845 3217 1 10 . 1 1 57 57 TYR CB C 57 38.453 38.453 36.737 1.716 19845 3218 1 10 . 1 1 57 57 TYR H H 57 7.964 7.964 7.984 -0.020 19845 3219 1 10 . 1 1 58 58 VAL N N 58 119.069 119.069 119.026 0.043 19845 3220 1 10 . 1 1 58 58 VAL HA H 58 3.529 3.529 3.350 0.179 19845 3221 1 10 . 1 1 58 58 VAL C C 58 174.250 174.250 177.100 -2.850 19845 3222 1 10 . 1 1 58 58 VAL CA C 58 66.223 66.223 64.447 1.776 19845 3223 1 10 . 1 1 58 58 VAL CB C 58 31.803 31.803 30.696 1.107 19845 3224 1 10 . 1 1 58 58 VAL H H 58 8.018 8.018 7.257 0.761 19845 3225 1 10 . 1 1 59 59 TYR N N 59 120.360 120.360 120.910 -0.550 19845 3226 1 10 . 1 1 59 59 TYR HA H 59 4.115 4.115 3.972 0.143 19845 3227 1 10 . 1 1 59 59 TYR C C 59 173.899 173.899 177.731 -3.832 19845 3228 1 10 . 1 1 59 59 TYR CA C 59 60.929 60.929 61.381 -0.452 19845 3229 1 10 . 1 1 59 59 TYR CB C 59 38.602 38.602 37.895 0.707 19845 3230 1 10 . 1 1 59 59 TYR H H 59 8.142 8.142 7.848 0.294 19845 3231 1 10 . 1 1 60 60 SER N N 60 113.480 113.480 113.109 0.371 19845 3232 1 10 . 1 1 60 60 SER HA H 60 3.979 3.979 4.009 -0.030 19845 3233 1 10 . 1 1 60 60 SER C C 60 172.887 172.887 176.750 -3.863 19845 3234 1 10 . 1 1 60 60 SER CA C 60 60.987 60.987 61.155 -0.168 19845 3235 1 10 . 1 1 60 60 SER CB C 60 63.267 63.267 62.794 0.473 19845 3236 1 10 . 1 1 60 60 SER H H 60 8.057 8.057 7.649 0.408 19845 3237 1 10 . 1 1 61 61 ARG N N 61 120.962 120.962 121.655 -0.693 19845 3238 1 10 . 1 1 61 61 ARG HA H 61 4.103 4.103 3.949 0.154 19845 3239 1 10 . 1 1 61 61 ARG C C 61 175.399 175.399 178.697 -3.298 19845 3240 1 10 . 1 1 61 61 ARG CA C 61 57.427 57.427 59.042 -1.615 19845 3241 1 10 . 1 1 61 61 ARG CB C 61 30.008 30.008 29.918 0.090 19845 3242 1 10 . 1 1 61 61 ARG H H 61 7.606 7.606 7.321 0.285 19845 3243 1 10 . 1 1 62 62 VAL N N 62 117.852 117.852 115.998 1.854 19845 3244 1 10 . 1 1 62 62 VAL HA H 62 3.805 3.805 3.679 0.126 19845 3245 1 10 . 1 1 62 62 VAL C C 62 174.155 174.155 177.472 -3.317 19845 3246 1 10 . 1 1 62 62 VAL CA C 62 64.458 64.458 66.123 -1.665 19845 3247 1 10 . 1 1 62 62 VAL CB C 62 31.969 31.969 31.343 0.626 19845 3248 1 10 . 1 1 62 62 VAL H H 62 7.848 7.848 7.884 -0.036 19845 3249 1 10 . 1 1 63 63 LYS N N 63 119.254 119.254 119.991 -0.737 19845 3250 1 10 . 1 1 63 63 LYS HA H 63 4.051 4.051 3.950 0.101 19845 3251 1 10 . 1 1 63 63 LYS C C 63 173.615 173.615 178.416 -4.801 19845 3252 1 10 . 1 1 63 63 LYS CA C 63 56.727 56.727 58.597 -1.870 19845 3253 1 10 . 1 1 63 63 LYS CB C 63 32.105 32.105 32.444 -0.339 19845 3254 1 10 . 1 1 63 63 LYS H H 63 7.759 7.759 7.414 0.345 19845 3255 1 10 . 1 1 64 64 ASN N N 64 117.696 117.696 116.256 1.440 19845 3256 1 10 . 1 1 64 64 ASN HA H 64 4.642 4.642 4.473 0.169 19845 3257 1 10 . 1 1 64 64 ASN C C 64 171.750 171.750 176.319 -4.569 19845 3258 1 10 . 1 1 64 64 ASN CA C 64 53.313 53.313 54.608 -1.295 19845 3259 1 10 . 1 1 64 64 ASN CB C 64 39.260 39.260 39.085 0.175 19845 3260 1 10 . 1 1 64 64 ASN H H 64 7.615 7.615 8.085 -0.470 19845 3261 1 11 . 1 1 9 9 THR N N 9 113.692 113.692 115.585 -1.893 19845 3262 1 11 . 1 1 9 9 THR HA H 9 4.213 4.213 4.563 -0.350 19845 3263 1 11 . 1 1 9 9 THR C C 9 172.757 172.757 175.173 -2.416 19845 3264 1 11 . 1 1 9 9 THR CA C 9 62.810 62.810 62.490 0.320 19845 3265 1 11 . 1 1 9 9 THR CB C 9 69.878 69.878 69.421 0.457 19845 3266 1 11 . 1 1 9 9 THR H H 9 7.930 7.930 8.710 -0.780 19845 3267 1 11 . 1 1 10 10 GLY N N 10 110.842 110.842 110.630 0.212 19845 3268 1 11 . 1 1 10 10 GLY C C 10 171.923 171.923 173.872 -1.949 19845 3269 1 11 . 1 1 10 10 GLY CA C 10 46.099 46.099 44.744 1.355 19845 3270 1 11 . 1 1 10 10 GLY H H 10 8.266 8.266 8.103 0.163 19845 3271 1 11 . 1 1 11 11 THR N N 11 113.754 113.754 116.834 -3.080 19845 3272 1 11 . 1 1 11 11 THR HA H 11 4.220 4.220 4.309 -0.089 19845 3273 1 11 . 1 1 11 11 THR C C 11 171.906 171.906 174.598 -2.692 19845 3274 1 11 . 1 1 11 11 THR CA C 11 62.721 62.721 63.672 -0.952 19845 3275 1 11 . 1 1 11 11 THR CB C 11 69.549 69.549 68.657 0.892 19845 3276 1 11 . 1 1 11 11 THR H H 11 7.753 7.753 7.943 -0.190 19845 3277 1 11 . 1 1 12 12 LEU N N 12 123.669 123.669 126.481 -2.812 19845 3278 1 11 . 1 1 12 12 LEU HA H 12 4.240 4.240 4.531 -0.291 19845 3279 1 11 . 1 1 12 12 LEU C C 12 175.221 175.221 178.313 -3.092 19845 3280 1 11 . 1 1 12 12 LEU CA C 12 56.799 56.799 55.568 1.231 19845 3281 1 11 . 1 1 12 12 LEU CB C 12 42.536 42.536 42.660 -0.124 19845 3282 1 11 . 1 1 12 12 LEU H H 12 7.980 7.980 8.610 -0.630 19845 3283 1 11 . 1 1 13 13 ILE N N 13 120.086 120.086 121.941 -1.855 19845 3284 1 11 . 1 1 13 13 ILE HA H 13 3.913 3.913 3.678 0.235 19845 3285 1 11 . 1 1 13 13 ILE C C 13 173.425 173.425 177.538 -4.113 19845 3286 1 11 . 1 1 13 13 ILE CA C 13 62.889 62.889 64.633 -1.744 19845 3287 1 11 . 1 1 13 13 ILE CB C 13 38.249 38.249 37.772 0.477 19845 3288 1 11 . 1 1 13 13 ILE H H 13 7.861 7.861 8.134 -0.273 19845 3289 1 11 . 1 1 14 14 VAL N N 14 119.785 119.785 119.505 0.280 19845 3290 1 11 . 1 1 14 14 VAL HA H 14 3.790 3.790 3.646 0.144 19845 3291 1 11 . 1 1 14 14 VAL C C 14 173.429 173.429 177.983 -4.554 19845 3292 1 11 . 1 1 14 14 VAL CA C 14 64.409 64.409 66.412 -2.003 19845 3293 1 11 . 1 1 14 14 VAL CB C 14 32.007 32.007 31.477 0.530 19845 3294 1 11 . 1 1 14 14 VAL H H 14 7.549 7.549 8.148 -0.599 19845 3295 1 11 . 1 1 15 15 ASN N N 15 119.567 119.567 117.240 2.327 19845 3296 1 11 . 1 1 15 15 ASN HA H 15 4.549 4.549 4.632 -0.083 19845 3297 1 11 . 1 1 15 15 ASN C C 15 173.619 173.619 177.784 -4.165 19845 3298 1 11 . 1 1 15 15 ASN CA C 15 54.805 54.805 55.676 -0.871 19845 3299 1 11 . 1 1 15 15 ASN CB C 15 38.824 38.824 38.347 0.477 19845 3300 1 11 . 1 1 15 15 ASN H H 15 8.010 8.010 7.954 0.056 19845 3301 1 11 . 1 1 16 16 SER N N 16 116.730 116.730 117.008 -0.278 19845 3302 1 11 . 1 1 16 16 SER HA H 16 4.177 4.177 4.447 -0.270 19845 3303 1 11 . 1 1 16 16 SER CA C 16 61.705 61.705 61.224 0.481 19845 3304 1 11 . 1 1 16 16 SER CB C 16 63.752 63.752 63.584 0.168 19845 3305 1 11 . 1 1 16 16 SER H H 16 8.039 8.039 8.247 -0.208 19845 3306 1 11 . 1 1 17 17 VAL N N 17 122.062 122.062 122.400 -0.338 19845 3307 1 11 . 1 1 17 17 VAL HA H 17 3.677 3.677 3.828 -0.151 19845 3308 1 11 . 1 1 17 17 VAL C C 17 174.474 174.474 177.401 -2.927 19845 3309 1 11 . 1 1 17 17 VAL CA C 17 66.671 66.671 65.829 0.842 19845 3310 1 11 . 1 1 17 17 VAL CB C 17 31.531 31.531 31.690 -0.159 19845 3311 1 11 . 1 1 17 17 VAL H H 17 7.896 7.896 8.345 -0.449 19845 3312 1 11 . 1 1 18 18 LEU N N 18 119.103 119.103 120.399 -1.296 19845 3313 1 11 . 1 1 18 18 LEU HA H 18 3.998 3.998 4.222 -0.224 19845 3314 1 11 . 1 1 18 18 LEU C C 18 175.511 175.511 177.994 -2.483 19845 3315 1 11 . 1 1 18 18 LEU CA C 18 58.107 58.107 57.820 0.287 19845 3316 1 11 . 1 1 18 18 LEU CB C 18 41.593 41.593 42.221 -0.628 19845 3317 1 11 . 1 1 18 18 LEU H H 18 7.857 7.857 7.548 0.309 19845 3318 1 11 . 1 1 19 19 LEU N N 19 118.291 118.291 119.768 -1.477 19845 3319 1 11 . 1 1 19 19 LEU HA H 19 4.152 4.152 4.007 0.145 19845 3320 1 11 . 1 1 19 19 LEU C C 19 175.156 175.156 178.975 -3.819 19845 3321 1 11 . 1 1 19 19 LEU CA C 19 58.011 58.011 57.804 0.207 19845 3322 1 11 . 1 1 19 19 LEU CB C 19 42.027 42.027 41.880 0.147 19845 3323 1 11 . 1 1 19 19 LEU H H 19 7.745 7.745 7.433 0.312 19845 3324 1 11 . 1 1 20 20 PHE N N 20 118.415 118.415 119.565 -1.150 19845 3325 1 11 . 1 1 20 20 PHE HA H 20 4.188 4.188 4.084 0.104 19845 3326 1 11 . 1 1 20 20 PHE C C 20 174.260 174.260 177.357 -3.097 19845 3327 1 11 . 1 1 20 20 PHE CA C 20 61.626 61.626 62.093 -0.467 19845 3328 1 11 . 1 1 20 20 PHE CB C 20 38.643 38.643 39.024 -0.381 19845 3329 1 11 . 1 1 20 20 PHE H H 20 8.002 8.002 8.702 -0.700 19845 3330 1 11 . 1 1 21 21 LEU N N 21 118.571 118.571 119.573 -1.002 19845 3331 1 11 . 1 1 21 21 LEU HA H 21 3.797 3.797 4.097 -0.300 19845 3332 1 11 . 1 1 21 21 LEU C C 21 175.324 175.324 179.029 -3.705 19845 3333 1 11 . 1 1 21 21 LEU CA C 21 58.128 58.128 58.302 -0.174 19845 3334 1 11 . 1 1 21 21 LEU CB C 21 41.957 41.957 41.023 0.934 19845 3335 1 11 . 1 1 21 21 LEU H H 21 8.456 8.456 7.710 0.746 19845 3336 1 11 . 1 1 22 22 ALA N N 22 120.775 120.775 120.887 -0.112 19845 3337 1 11 . 1 1 22 22 ALA HA H 22 3.779 3.779 4.182 -0.403 19845 3338 1 11 . 1 1 22 22 ALA C C 22 175.697 175.697 180.199 -4.502 19845 3339 1 11 . 1 1 22 22 ALA CA C 22 55.721 55.721 54.727 0.994 19845 3340 1 11 . 1 1 22 22 ALA CB C 22 17.788 17.788 18.239 -0.451 19845 3341 1 11 . 1 1 22 22 ALA H H 22 8.353 8.353 7.586 0.767 19845 3342 1 11 . 1 1 23 23 PHE N N 23 117.860 117.860 119.841 -1.981 19845 3343 1 11 . 1 1 23 23 PHE HA H 23 4.108 4.108 4.201 -0.093 19845 3344 1 11 . 1 1 23 23 PHE C C 23 173.859 173.859 176.985 -3.126 19845 3345 1 11 . 1 1 23 23 PHE CA C 23 61.271 61.271 61.824 -0.553 19845 3346 1 11 . 1 1 23 23 PHE CB C 23 38.853 38.853 39.598 -0.745 19845 3347 1 11 . 1 1 23 23 PHE H H 23 8.121 8.121 8.097 0.024 19845 3348 1 11 . 1 1 24 24 VAL N N 24 119.181 119.181 119.856 -0.675 19845 3349 1 11 . 1 1 24 24 VAL HA H 24 3.134 3.134 3.559 -0.425 19845 3350 1 11 . 1 1 24 24 VAL C C 24 174.684 174.684 177.990 -3.306 19845 3351 1 11 . 1 1 24 24 VAL CA C 24 67.419 67.419 66.621 0.798 19845 3352 1 11 . 1 1 24 24 VAL CB C 24 31.106 31.106 30.887 0.219 19845 3353 1 11 . 1 1 24 24 VAL H H 24 8.124 8.124 8.514 -0.390 19845 3354 1 11 . 1 1 25 25 VAL N N 25 119.215 119.215 117.167 2.048 19845 3355 1 11 . 1 1 25 25 VAL HA H 25 3.324 3.324 3.560 -0.236 19845 3356 1 11 . 1 1 25 25 VAL C C 25 174.244 174.244 177.847 -3.603 19845 3357 1 11 . 1 1 25 25 VAL CA C 25 67.740 67.740 66.416 1.324 19845 3358 1 11 . 1 1 25 25 VAL CB C 25 31.270 31.270 30.896 0.374 19845 3359 1 11 . 1 1 25 25 VAL H H 25 8.250 8.250 7.472 0.778 19845 3360 1 11 . 1 1 26 26 PHE N N 26 119.875 119.875 119.616 0.259 19845 3361 1 11 . 1 1 26 26 PHE HA H 26 3.900 3.900 4.124 -0.224 19845 3362 1 11 . 1 1 26 26 PHE C C 26 175.371 175.371 177.956 -2.585 19845 3363 1 11 . 1 1 26 26 PHE CA C 26 61.651 61.651 62.530 -0.879 19845 3364 1 11 . 1 1 26 26 PHE CB C 26 38.760 38.760 38.797 -0.038 19845 3365 1 11 . 1 1 26 26 PHE H H 26 8.413 8.413 7.303 1.110 19845 3366 1 11 . 1 1 27 27 LEU N N 27 122.548 122.548 119.640 2.908 19845 3367 1 11 . 1 1 27 27 LEU HA H 27 3.533 3.533 3.828 -0.295 19845 3368 1 11 . 1 1 27 27 LEU C C 27 175.256 175.256 178.895 -3.639 19845 3369 1 11 . 1 1 27 27 LEU CA C 27 58.211 58.211 57.874 0.336 19845 3370 1 11 . 1 1 27 27 LEU CB C 27 41.564 41.564 41.481 0.083 19845 3371 1 11 . 1 1 27 27 LEU H H 27 8.453 8.453 8.411 0.042 19845 3372 1 11 . 1 1 28 28 LEU N N 28 119.385 119.385 119.613 -0.228 19845 3373 1 11 . 1 1 28 28 LEU HA H 28 3.799 3.799 3.849 -0.050 19845 3374 1 11 . 1 1 28 28 LEU C C 28 175.881 175.881 179.388 -3.507 19845 3375 1 11 . 1 1 28 28 LEU CA C 28 58.492 58.492 58.039 0.453 19845 3376 1 11 . 1 1 28 28 LEU CB C 28 41.760 41.760 41.389 0.371 19845 3377 1 11 . 1 1 28 28 LEU H H 28 8.248 8.248 8.417 -0.169 19845 3378 1 11 . 1 1 29 29 VAL N N 29 118.515 118.515 117.162 1.353 19845 3379 1 11 . 1 1 29 29 VAL HA H 29 3.319 3.319 3.711 -0.392 19845 3380 1 11 . 1 1 29 29 VAL C C 29 174.734 174.734 177.517 -2.783 19845 3381 1 11 . 1 1 29 29 VAL CA C 29 67.192 67.192 65.660 1.532 19845 3382 1 11 . 1 1 29 29 VAL CB C 29 31.175 31.175 32.049 -0.874 19845 3383 1 11 . 1 1 29 29 VAL H H 29 8.446 8.446 7.322 1.124 19845 3384 1 11 . 1 1 30 30 THR N N 30 117.313 117.313 116.981 0.332 19845 3385 1 11 . 1 1 30 30 THR HA H 30 3.432 3.432 3.869 -0.437 19845 3386 1 11 . 1 1 30 30 THR CA C 30 68.606 68.606 66.539 2.067 19845 3387 1 11 . 1 1 30 30 THR CB C 30 67.147 67.147 68.438 -1.291 19845 3388 1 11 . 1 1 30 30 THR H H 30 7.923 7.923 8.133 -0.210 19845 3389 1 11 . 1 1 31 31 LEU N N 31 120.629 120.629 121.509 -0.880 19845 3390 1 11 . 1 1 31 31 LEU HA H 31 3.858 3.858 4.042 -0.184 19845 3391 1 11 . 1 1 31 31 LEU C C 31 177.164 177.164 178.539 -1.375 19845 3392 1 11 . 1 1 31 31 LEU CA C 31 58.145 58.145 57.801 0.344 19845 3393 1 11 . 1 1 31 31 LEU CB C 31 41.615 41.615 41.029 0.586 19845 3394 1 11 . 1 1 31 31 LEU H H 31 8.382 8.382 8.309 0.073 19845 3395 1 11 . 1 1 32 32 ALA N N 32 125.216 125.216 121.820 3.396 19845 3396 1 11 . 1 1 32 32 ALA HA H 32 3.836 3.836 3.913 -0.077 19845 3397 1 11 . 1 1 32 32 ALA C C 32 175.968 175.968 180.705 -4.737 19845 3398 1 11 . 1 1 32 32 ALA CA C 32 55.918 55.918 54.839 1.079 19845 3399 1 11 . 1 1 32 32 ALA CB C 32 17.802 17.802 18.157 -0.355 19845 3400 1 11 . 1 1 32 32 ALA H H 32 8.517 8.517 7.620 0.897 19845 3401 1 11 . 1 1 33 33 ILE N N 33 118.722 118.722 118.960 -0.238 19845 3402 1 11 . 1 1 33 33 ILE HA H 33 3.481 3.481 3.544 -0.063 19845 3403 1 11 . 1 1 33 33 ILE C C 33 175.004 175.004 178.047 -3.043 19845 3404 1 11 . 1 1 33 33 ILE CA C 33 65.554 65.554 65.090 0.464 19845 3405 1 11 . 1 1 33 33 ILE CB C 33 37.657 37.657 37.391 0.266 19845 3406 1 11 . 1 1 33 33 ILE H H 33 8.288 8.288 7.603 0.685 19845 3407 1 11 . 1 1 34 34 LEU N N 34 118.987 118.987 119.667 -0.680 19845 3408 1 11 . 1 1 34 34 LEU HA H 34 3.893 3.893 3.920 -0.027 19845 3409 1 11 . 1 1 34 34 LEU C C 34 176.439 176.439 178.540 -2.101 19845 3410 1 11 . 1 1 34 34 LEU CA C 34 58.436 58.436 57.862 0.574 19845 3411 1 11 . 1 1 34 34 LEU CB C 34 42.152 42.152 41.558 0.594 19845 3412 1 11 . 1 1 34 34 LEU H H 34 8.493 8.493 8.083 0.410 19845 3413 1 11 . 1 1 35 35 THR N N 35 116.630 116.630 114.851 1.779 19845 3414 1 11 . 1 1 35 35 THR HA H 35 3.652 3.652 3.899 -0.247 19845 3415 1 11 . 1 1 35 35 THR C C 35 173.366 173.366 176.035 -2.669 19845 3416 1 11 . 1 1 35 35 THR CA C 35 68.153 68.153 66.752 1.401 19845 3417 1 11 . 1 1 35 35 THR CB C 35 68.162 68.162 68.527 -0.365 19845 3418 1 11 . 1 1 35 35 THR H H 35 8.215 8.215 8.153 0.062 19845 3419 1 11 . 1 1 36 36 ALA N N 36 124.667 124.667 123.405 1.262 19845 3420 1 11 . 1 1 36 36 ALA HA H 36 3.864 3.864 3.940 -0.076 19845 3421 1 11 . 1 1 36 36 ALA C C 36 176.510 176.510 179.455 -2.945 19845 3422 1 11 . 1 1 36 36 ALA CA C 36 55.758 55.758 55.128 0.630 19845 3423 1 11 . 1 1 36 36 ALA CB C 36 18.054 18.054 18.146 -0.092 19845 3424 1 11 . 1 1 36 36 ALA H H 36 8.358 8.358 8.071 0.287 19845 3425 1 11 . 1 1 37 37 LEU N N 37 116.565 116.565 117.839 -1.274 19845 3426 1 11 . 1 1 37 37 LEU HA H 37 3.973 3.973 4.112 -0.139 19845 3427 1 11 . 1 1 37 37 LEU C C 37 176.538 176.538 179.188 -2.650 19845 3428 1 11 . 1 1 37 37 LEU CA C 37 57.853 57.853 57.242 0.611 19845 3429 1 11 . 1 1 37 37 LEU CB C 37 42.018 42.018 40.602 1.416 19845 3430 1 11 . 1 1 37 37 LEU H H 37 8.360 8.360 7.563 0.797 19845 3431 1 11 . 1 1 38 38 ARG N N 38 119.392 119.392 119.898 -0.506 19845 3432 1 11 . 1 1 38 38 ARG HA H 38 4.104 4.104 4.063 0.041 19845 3433 1 11 . 1 1 38 38 ARG C C 38 176.208 176.208 179.307 -3.099 19845 3434 1 11 . 1 1 38 38 ARG CA C 38 58.100 58.100 59.016 -0.916 19845 3435 1 11 . 1 1 38 38 ARG CB C 38 29.502 29.502 29.625 -0.123 19845 3436 1 11 . 1 1 38 38 ARG H H 38 8.082 8.082 7.407 0.675 19845 3437 1 11 . 1 1 39 39 LEU N N 39 120.438 120.438 118.324 2.114 19845 3438 1 11 . 1 1 39 39 LEU HA H 39 4.243 4.243 3.860 0.383 19845 3439 1 11 . 1 1 39 39 LEU C C 39 175.702 175.702 178.372 -2.670 19845 3440 1 11 . 1 1 39 39 LEU CA C 39 56.979 56.979 58.444 -1.465 19845 3441 1 11 . 1 1 39 39 LEU CB C 39 41.893 41.893 41.526 0.367 19845 3442 1 11 . 1 1 39 39 LEU H H 39 8.446 8.446 7.809 0.637 19845 3443 1 11 . 1 1 40 40 ALA N N 40 122.512 122.512 120.551 1.961 19845 3444 1 11 . 1 1 40 40 ALA HA H 40 3.975 3.975 4.076 -0.101 19845 3445 1 11 . 1 1 40 40 ALA C C 40 175.838 175.838 178.554 -2.716 19845 3446 1 11 . 1 1 40 40 ALA CA C 40 54.710 54.710 54.539 0.171 19845 3447 1 11 . 1 1 40 40 ALA CB C 40 18.319 18.319 17.960 0.359 19845 3448 1 11 . 1 1 40 40 ALA H H 40 8.321 8.321 7.388 0.933 19845 3449 1 11 . 1 1 41 41 ALA N N 41 119.754 119.754 120.494 -0.740 19845 3450 1 11 . 1 1 41 41 ALA HA H 41 4.024 4.024 4.192 -0.168 19845 3451 1 11 . 1 1 41 41 ALA C C 41 176.517 176.517 179.879 -3.362 19845 3452 1 11 . 1 1 41 41 ALA CA C 41 54.486 54.486 54.693 -0.207 19845 3453 1 11 . 1 1 41 41 ALA CB C 41 18.468 18.468 18.776 -0.308 19845 3454 1 11 . 1 1 41 41 ALA H H 41 8.038 8.038 8.030 0.008 19845 3455 1 11 . 1 1 42 42 TYR N N 42 118.272 118.272 118.680 -0.408 19845 3456 1 11 . 1 1 42 42 TYR HA H 42 4.326 4.326 4.322 0.004 19845 3457 1 11 . 1 1 42 42 TYR C C 42 174.633 174.633 178.077 -3.444 19845 3458 1 11 . 1 1 42 42 TYR CA C 42 60.098 60.098 59.629 0.469 19845 3459 1 11 . 1 1 42 42 TYR CB C 42 38.936 38.936 37.429 1.507 19845 3460 1 11 . 1 1 42 42 TYR H H 42 7.814 7.814 7.990 -0.176 19845 3461 1 11 . 1 1 43 43 ALA N N 43 122.908 122.908 121.540 1.368 19845 3462 1 11 . 1 1 43 43 ALA HA H 43 4.111 4.111 4.264 -0.153 19845 3463 1 11 . 1 1 43 43 ALA C C 43 175.241 175.241 178.225 -2.984 19845 3464 1 11 . 1 1 43 43 ALA CA C 43 53.842 53.842 54.072 -0.230 19845 3465 1 11 . 1 1 43 43 ALA CB C 43 18.427 18.427 17.592 0.835 19845 3466 1 11 . 1 1 43 43 ALA H H 43 8.172 8.172 7.560 0.612 19845 3467 1 11 . 1 1 44 44 ALA N N 44 119.906 119.906 119.290 0.616 19845 3468 1 11 . 1 1 44 44 ALA HA H 44 4.051 4.051 4.272 -0.221 19845 3469 1 11 . 1 1 44 44 ALA C C 44 175.092 175.092 178.104 -3.012 19845 3470 1 11 . 1 1 44 44 ALA CA C 44 53.611 53.611 53.537 0.074 19845 3471 1 11 . 1 1 44 44 ALA CB C 44 18.689 18.689 19.166 -0.477 19845 3472 1 11 . 1 1 44 44 ALA H H 44 7.953 7.953 7.739 0.214 19845 3473 1 11 . 1 1 45 45 ASN N N 45 114.984 114.984 117.320 -2.336 19845 3474 1 11 . 1 1 45 45 ASN HA H 45 4.541 4.541 4.804 -0.263 19845 3475 1 11 . 1 1 45 45 ASN CA C 45 54.506 54.506 54.842 -0.336 19845 3476 1 11 . 1 1 45 45 ASN CB C 45 38.602 38.602 39.475 -0.873 19845 3477 1 11 . 1 1 45 45 ASN H H 45 7.847 7.847 8.332 -0.485 19845 3478 1 11 . 1 1 46 46 ILE N N 46 119.155 119.155 116.969 2.186 19845 3479 1 11 . 1 1 46 46 ILE HA H 46 4.033 4.033 4.322 -0.289 19845 3480 1 11 . 1 1 46 46 ILE C C 46 173.344 173.344 175.730 -2.386 19845 3481 1 11 . 1 1 46 46 ILE CA C 46 62.357 62.357 61.931 0.426 19845 3482 1 11 . 1 1 46 46 ILE CB C 46 38.657 38.657 38.333 0.324 19845 3483 1 11 . 1 1 46 46 ILE H H 46 7.790 7.790 7.662 0.128 19845 3484 1 11 . 1 1 47 47 VAL N N 47 117.526 117.526 117.519 0.007 19845 3485 1 11 . 1 1 47 47 VAL HA H 47 4.133 4.133 4.365 -0.232 19845 3486 1 11 . 1 1 47 47 VAL C C 47 172.672 172.672 175.088 -2.416 19845 3487 1 11 . 1 1 47 47 VAL CA C 47 62.149 62.149 60.457 1.692 19845 3488 1 11 . 1 1 47 47 VAL CB C 47 32.807 32.807 35.000 -2.193 19845 3489 1 11 . 1 1 47 47 VAL H H 47 7.582 7.582 7.496 0.086 19845 3490 1 11 . 1 1 48 48 ASN N N 48 120.091 120.091 119.963 0.128 19845 3491 1 11 . 1 1 48 48 ASN HA H 48 4.658 4.658 4.871 -0.213 19845 3492 1 11 . 1 1 48 48 ASN CA C 48 53.478 53.478 53.089 0.390 19845 3493 1 11 . 1 1 48 48 ASN CB C 48 38.573 38.573 37.572 1.001 19845 3494 1 11 . 1 1 48 48 ASN H H 48 8.053 8.053 8.690 -0.637 19845 3495 1 11 . 1 1 49 49 VAL N N 49 118.854 118.854 119.898 -1.044 19845 3496 1 11 . 1 1 49 49 VAL HA H 49 4.133 4.133 4.176 -0.043 19845 3497 1 11 . 1 1 49 49 VAL C C 49 172.595 172.595 174.579 -1.984 19845 3498 1 11 . 1 1 49 49 VAL CA C 49 62.049 62.049 61.393 0.656 19845 3499 1 11 . 1 1 49 49 VAL CB C 49 33.271 33.271 33.910 -0.639 19845 3500 1 11 . 1 1 49 49 VAL H H 49 7.685 7.685 7.560 0.125 19845 3501 1 11 . 1 1 50 50 SER N N 50 118.689 118.689 119.135 -0.446 19845 3502 1 11 . 1 1 50 50 SER HA H 50 4.466 4.466 4.204 0.262 19845 3503 1 11 . 1 1 50 50 SER C C 50 171.430 171.430 172.515 -1.085 19845 3504 1 11 . 1 1 50 50 SER CA C 50 58.128 58.128 57.581 0.547 19845 3505 1 11 . 1 1 50 50 SER CB C 50 63.916 63.916 63.845 0.071 19845 3506 1 11 . 1 1 50 50 SER H H 50 8.075 8.075 8.002 0.073 19845 3507 1 11 . 1 1 51 51 LEU N N 51 123.536 123.536 122.751 0.785 19845 3508 1 11 . 1 1 51 51 LEU HA H 51 4.305 4.305 4.763 -0.458 19845 3509 1 11 . 1 1 51 51 LEU C C 51 174.110 174.110 175.181 -1.071 19845 3510 1 11 . 1 1 51 51 LEU CA C 51 55.145 55.145 54.290 0.855 19845 3511 1 11 . 1 1 51 51 LEU CB C 51 42.674 42.674 44.694 -2.020 19845 3512 1 11 . 1 1 51 51 LEU H H 51 7.991 7.991 8.082 -0.091 19845 3513 1 11 . 1 1 52 52 VAL N N 52 119.649 119.649 118.979 0.670 19845 3514 1 11 . 1 1 52 52 VAL HA H 52 3.992 3.992 4.246 -0.254 19845 3515 1 11 . 1 1 52 52 VAL C C 52 172.476 172.476 176.764 -4.288 19845 3516 1 11 . 1 1 52 52 VAL CA C 52 62.772 62.772 62.707 0.065 19845 3517 1 11 . 1 1 52 52 VAL CB C 52 33.066 33.066 32.712 0.354 19845 3518 1 11 . 1 1 52 52 VAL H H 52 7.536 7.536 8.182 -0.646 19845 3519 1 11 . 1 1 53 53 LYS N N 53 122.004 122.004 122.711 -0.707 19845 3520 1 11 . 1 1 53 53 LYS HA H 53 4.354 4.354 4.202 0.152 19845 3521 1 11 . 1 1 53 53 LYS CA C 53 56.567 56.567 59.757 -3.190 19845 3522 1 11 . 1 1 53 53 LYS CB C 53 31.689 31.689 30.032 1.657 19845 3523 1 11 . 1 1 53 53 LYS H H 53 8.038 8.038 8.508 -0.470 19845 3524 1 11 . 1 1 54 54 PRO HA H 54 4.353 4.353 4.450 -0.097 19845 3525 1 11 . 1 1 54 54 PRO CA C 54 65.103 65.103 64.824 0.279 19845 3526 1 11 . 1 1 54 54 PRO CB C 54 32.193 32.193 30.973 1.220 19845 3527 1 11 . 1 1 55 55 THR N N 55 111.485 111.485 110.334 1.151 19845 3528 1 11 . 1 1 55 55 THR HA H 55 3.910 3.910 4.689 -0.779 19845 3529 1 11 . 1 1 55 55 THR C C 55 172.822 172.822 176.592 -3.770 19845 3530 1 11 . 1 1 55 55 THR CA C 55 65.030 65.030 62.775 2.255 19845 3531 1 11 . 1 1 55 55 THR CB C 55 68.882 68.882 69.275 -0.393 19845 3532 1 11 . 1 1 55 55 THR H H 55 7.722 7.722 7.637 0.085 19845 3533 1 11 . 1 1 56 56 VAL N N 56 121.165 121.165 120.760 0.405 19845 3534 1 11 . 1 1 56 56 VAL HA H 56 3.772 3.772 3.664 0.108 19845 3535 1 11 . 1 1 56 56 VAL C C 56 174.904 174.904 176.991 -2.087 19845 3536 1 11 . 1 1 56 56 VAL CA C 56 64.971 64.971 66.043 -1.072 19845 3537 1 11 . 1 1 56 56 VAL CB C 56 31.989 31.989 31.267 0.722 19845 3538 1 11 . 1 1 56 56 VAL H H 56 7.597 7.597 7.632 -0.035 19845 3539 1 11 . 1 1 57 57 TYR N N 57 122.177 122.177 117.658 4.519 19845 3540 1 11 . 1 1 57 57 TYR HA H 57 4.227 4.227 4.198 0.029 19845 3541 1 11 . 1 1 57 57 TYR C C 57 174.969 174.969 177.056 -2.087 19845 3542 1 11 . 1 1 57 57 TYR CA C 57 60.755 60.755 59.417 1.338 19845 3543 1 11 . 1 1 57 57 TYR CB C 57 38.453 38.453 36.873 1.580 19845 3544 1 11 . 1 1 57 57 TYR H H 57 7.964 7.964 8.087 -0.123 19845 3545 1 11 . 1 1 58 58 VAL N N 58 119.069 119.069 119.593 -0.524 19845 3546 1 11 . 1 1 58 58 VAL HA H 58 3.529 3.529 3.153 0.376 19845 3547 1 11 . 1 1 58 58 VAL C C 58 174.250 174.250 177.205 -2.955 19845 3548 1 11 . 1 1 58 58 VAL CA C 58 66.223 66.223 65.347 0.876 19845 3549 1 11 . 1 1 58 58 VAL CB C 58 31.803 31.803 31.294 0.509 19845 3550 1 11 . 1 1 58 58 VAL H H 58 8.018 8.018 7.242 0.776 19845 3551 1 11 . 1 1 59 59 TYR N N 59 120.360 120.360 120.833 -0.473 19845 3552 1 11 . 1 1 59 59 TYR HA H 59 4.115 4.115 3.919 0.196 19845 3553 1 11 . 1 1 59 59 TYR C C 59 173.899 173.899 177.733 -3.834 19845 3554 1 11 . 1 1 59 59 TYR CA C 59 60.929 60.929 61.164 -0.235 19845 3555 1 11 . 1 1 59 59 TYR CB C 59 38.602 38.602 37.764 0.839 19845 3556 1 11 . 1 1 59 59 TYR H H 59 8.142 8.142 7.876 0.266 19845 3557 1 11 . 1 1 60 60 SER N N 60 113.480 113.480 113.453 0.027 19845 3558 1 11 . 1 1 60 60 SER HA H 60 3.979 3.979 3.956 0.023 19845 3559 1 11 . 1 1 60 60 SER C C 60 172.887 172.887 176.650 -3.763 19845 3560 1 11 . 1 1 60 60 SER CA C 60 60.987 60.987 61.837 -0.850 19845 3561 1 11 . 1 1 60 60 SER CB C 60 63.267 63.267 62.945 0.322 19845 3562 1 11 . 1 1 60 60 SER H H 60 8.057 8.057 7.733 0.324 19845 3563 1 11 . 1 1 61 61 ARG N N 61 120.962 120.962 121.792 -0.830 19845 3564 1 11 . 1 1 61 61 ARG HA H 61 4.103 4.103 4.070 0.033 19845 3565 1 11 . 1 1 61 61 ARG C C 61 175.399 175.399 178.916 -3.517 19845 3566 1 11 . 1 1 61 61 ARG CA C 61 57.427 57.427 59.185 -1.758 19845 3567 1 11 . 1 1 61 61 ARG CB C 61 30.008 30.008 30.056 -0.049 19845 3568 1 11 . 1 1 61 61 ARG H H 61 7.606 7.606 7.348 0.258 19845 3569 1 11 . 1 1 62 62 VAL N N 62 117.852 117.852 119.591 -1.739 19845 3570 1 11 . 1 1 62 62 VAL HA H 62 3.805 3.805 3.648 0.157 19845 3571 1 11 . 1 1 62 62 VAL C C 62 174.155 174.155 177.729 -3.574 19845 3572 1 11 . 1 1 62 62 VAL CA C 62 64.458 64.458 66.178 -1.720 19845 3573 1 11 . 1 1 62 62 VAL CB C 62 31.969 31.969 31.524 0.445 19845 3574 1 11 . 1 1 62 62 VAL H H 62 7.848 7.848 8.164 -0.316 19845 3575 1 11 . 1 1 63 63 LYS N N 63 119.254 119.254 119.471 -0.217 19845 3576 1 11 . 1 1 63 63 LYS HA H 63 4.051 4.051 3.984 0.067 19845 3577 1 11 . 1 1 63 63 LYS C C 63 173.615 173.615 178.247 -4.632 19845 3578 1 11 . 1 1 63 63 LYS CA C 63 56.727 56.727 58.484 -1.757 19845 3579 1 11 . 1 1 63 63 LYS CB C 63 32.105 32.105 32.601 -0.496 19845 3580 1 11 . 1 1 63 63 LYS H H 63 7.759 7.759 7.518 0.241 19845 3581 1 11 . 1 1 64 64 ASN N N 64 117.696 117.696 116.616 1.080 19845 3582 1 11 . 1 1 64 64 ASN HA H 64 4.642 4.642 4.445 0.197 19845 3583 1 11 . 1 1 64 64 ASN C C 64 171.750 171.750 176.302 -4.552 19845 3584 1 11 . 1 1 64 64 ASN CA C 64 53.313 53.313 54.451 -1.138 19845 3585 1 11 . 1 1 64 64 ASN CB C 64 39.260 39.260 38.690 0.570 19845 3586 1 11 . 1 1 64 64 ASN H H 64 7.615 7.615 8.087 -0.472 19845 3587 1 12 . 1 1 9 9 THR N N 9 113.692 113.692 114.924 -1.232 19845 3588 1 12 . 1 1 9 9 THR HA H 9 4.213 4.213 4.568 -0.355 19845 3589 1 12 . 1 1 9 9 THR C C 9 172.757 172.757 175.118 -2.361 19845 3590 1 12 . 1 1 9 9 THR CA C 9 62.810 62.810 62.462 0.348 19845 3591 1 12 . 1 1 9 9 THR CB C 9 69.878 69.878 69.169 0.709 19845 3592 1 12 . 1 1 9 9 THR H H 9 7.930 7.930 8.534 -0.604 19845 3593 1 12 . 1 1 10 10 GLY N N 10 110.842 110.842 108.586 2.256 19845 3594 1 12 . 1 1 10 10 GLY C C 10 171.923 171.923 173.759 -1.836 19845 3595 1 12 . 1 1 10 10 GLY CA C 10 46.099 46.099 44.609 1.490 19845 3596 1 12 . 1 1 10 10 GLY H H 10 8.266 8.266 7.953 0.313 19845 3597 1 12 . 1 1 11 11 THR N N 11 113.754 113.754 117.539 -3.785 19845 3598 1 12 . 1 1 11 11 THR HA H 11 4.220 4.220 4.405 -0.185 19845 3599 1 12 . 1 1 11 11 THR C C 11 171.906 171.906 174.493 -2.587 19845 3600 1 12 . 1 1 11 11 THR CA C 11 62.721 62.721 62.714 0.007 19845 3601 1 12 . 1 1 11 11 THR CB C 11 69.549 69.549 68.874 0.675 19845 3602 1 12 . 1 1 11 11 THR H H 11 7.753 7.753 7.916 -0.163 19845 3603 1 12 . 1 1 12 12 LEU N N 12 123.669 123.669 126.413 -2.744 19845 3604 1 12 . 1 1 12 12 LEU HA H 12 4.240 4.240 4.683 -0.443 19845 3605 1 12 . 1 1 12 12 LEU C C 12 175.221 175.221 177.560 -2.339 19845 3606 1 12 . 1 1 12 12 LEU CA C 12 56.799 56.799 54.675 2.124 19845 3607 1 12 . 1 1 12 12 LEU CB C 12 42.536 42.536 42.268 0.268 19845 3608 1 12 . 1 1 12 12 LEU H H 12 7.980 7.980 8.697 -0.717 19845 3609 1 12 . 1 1 13 13 ILE N N 13 120.086 120.086 121.569 -1.483 19845 3610 1 12 . 1 1 13 13 ILE HA H 13 3.913 3.913 4.077 -0.165 19845 3611 1 12 . 1 1 13 13 ILE C C 13 173.425 173.425 177.176 -3.751 19845 3612 1 12 . 1 1 13 13 ILE CA C 13 62.889 62.889 63.407 -0.518 19845 3613 1 12 . 1 1 13 13 ILE CB C 13 38.249 38.249 37.763 0.486 19845 3614 1 12 . 1 1 13 13 ILE H H 13 7.861 7.861 8.038 -0.177 19845 3615 1 12 . 1 1 14 14 VAL N N 14 119.785 119.785 119.674 0.111 19845 3616 1 12 . 1 1 14 14 VAL HA H 14 3.790 3.790 3.782 0.008 19845 3617 1 12 . 1 1 14 14 VAL C C 14 173.429 173.429 177.502 -4.073 19845 3618 1 12 . 1 1 14 14 VAL CA C 14 64.409 64.409 66.122 -1.713 19845 3619 1 12 . 1 1 14 14 VAL CB C 14 32.007 32.007 31.657 0.350 19845 3620 1 12 . 1 1 14 14 VAL H H 14 7.549 7.549 8.045 -0.496 19845 3621 1 12 . 1 1 15 15 ASN N N 15 119.567 119.567 115.091 4.476 19845 3622 1 12 . 1 1 15 15 ASN HA H 15 4.549 4.549 4.553 -0.004 19845 3623 1 12 . 1 1 15 15 ASN C C 15 173.619 173.619 177.052 -3.433 19845 3624 1 12 . 1 1 15 15 ASN CA C 15 54.805 54.805 55.366 -0.561 19845 3625 1 12 . 1 1 15 15 ASN CB C 15 38.824 38.824 38.108 0.716 19845 3626 1 12 . 1 1 15 15 ASN H H 15 8.010 8.010 8.409 -0.399 19845 3627 1 12 . 1 1 16 16 SER N N 16 116.730 116.730 115.622 1.108 19845 3628 1 12 . 1 1 16 16 SER HA H 16 4.177 4.177 4.416 -0.239 19845 3629 1 12 . 1 1 16 16 SER CA C 16 61.705 61.705 60.831 0.874 19845 3630 1 12 . 1 1 16 16 SER CB C 16 63.752 63.752 63.511 0.241 19845 3631 1 12 . 1 1 16 16 SER H H 16 8.039 8.039 7.516 0.523 19845 3632 1 12 . 1 1 17 17 VAL N N 17 122.062 122.062 122.580 -0.518 19845 3633 1 12 . 1 1 17 17 VAL HA H 17 3.677 3.677 3.903 -0.226 19845 3634 1 12 . 1 1 17 17 VAL C C 17 174.474 174.474 177.299 -2.825 19845 3635 1 12 . 1 1 17 17 VAL CA C 17 66.671 66.671 64.987 1.684 19845 3636 1 12 . 1 1 17 17 VAL CB C 17 31.531 31.531 31.472 0.059 19845 3637 1 12 . 1 1 17 17 VAL H H 17 7.896 7.896 7.788 0.108 19845 3638 1 12 . 1 1 18 18 LEU N N 18 119.103 119.103 119.975 -0.872 19845 3639 1 12 . 1 1 18 18 LEU HA H 18 3.998 3.998 4.205 -0.207 19845 3640 1 12 . 1 1 18 18 LEU C C 18 175.511 175.511 178.490 -2.979 19845 3641 1 12 . 1 1 18 18 LEU CA C 18 58.107 58.107 57.655 0.452 19845 3642 1 12 . 1 1 18 18 LEU CB C 18 41.593 41.593 42.044 -0.451 19845 3643 1 12 . 1 1 18 18 LEU H H 18 7.857 7.857 7.399 0.458 19845 3644 1 12 . 1 1 19 19 LEU N N 19 118.291 118.291 120.249 -1.958 19845 3645 1 12 . 1 1 19 19 LEU HA H 19 4.152 4.152 4.167 -0.015 19845 3646 1 12 . 1 1 19 19 LEU C C 19 175.156 175.156 178.964 -3.808 19845 3647 1 12 . 1 1 19 19 LEU CA C 19 58.011 58.011 57.331 0.680 19845 3648 1 12 . 1 1 19 19 LEU CB C 19 42.027 42.027 41.152 0.875 19845 3649 1 12 . 1 1 19 19 LEU H H 19 7.745 7.745 7.576 0.169 19845 3650 1 12 . 1 1 20 20 PHE N N 20 118.415 118.415 120.442 -2.027 19845 3651 1 12 . 1 1 20 20 PHE HA H 20 4.188 4.188 4.292 -0.104 19845 3652 1 12 . 1 1 20 20 PHE C C 20 174.260 174.260 177.653 -3.393 19845 3653 1 12 . 1 1 20 20 PHE CA C 20 61.626 61.626 62.182 -0.556 19845 3654 1 12 . 1 1 20 20 PHE CB C 20 38.643 38.643 39.050 -0.407 19845 3655 1 12 . 1 1 20 20 PHE H H 20 8.002 8.002 8.708 -0.706 19845 3656 1 12 . 1 1 21 21 LEU N N 21 118.571 118.571 119.467 -0.896 19845 3657 1 12 . 1 1 21 21 LEU HA H 21 3.797 3.797 4.234 -0.437 19845 3658 1 12 . 1 1 21 21 LEU C C 21 175.324 175.324 178.972 -3.648 19845 3659 1 12 . 1 1 21 21 LEU CA C 21 58.128 58.128 57.770 0.358 19845 3660 1 12 . 1 1 21 21 LEU CB C 21 41.957 41.957 41.080 0.877 19845 3661 1 12 . 1 1 21 21 LEU H H 21 8.456 8.456 7.762 0.694 19845 3662 1 12 . 1 1 22 22 ALA N N 22 120.775 120.775 121.552 -0.777 19845 3663 1 12 . 1 1 22 22 ALA HA H 22 3.779 3.779 4.197 -0.418 19845 3664 1 12 . 1 1 22 22 ALA C C 22 175.697 175.697 180.070 -4.373 19845 3665 1 12 . 1 1 22 22 ALA CA C 22 55.721 55.721 54.682 1.039 19845 3666 1 12 . 1 1 22 22 ALA CB C 22 17.788 17.788 18.391 -0.603 19845 3667 1 12 . 1 1 22 22 ALA H H 22 8.353 8.353 7.635 0.718 19845 3668 1 12 . 1 1 23 23 PHE N N 23 117.860 117.860 120.547 -2.687 19845 3669 1 12 . 1 1 23 23 PHE HA H 23 4.108 4.108 4.520 -0.412 19845 3670 1 12 . 1 1 23 23 PHE C C 23 173.859 173.859 176.957 -3.098 19845 3671 1 12 . 1 1 23 23 PHE CA C 23 61.271 61.271 59.602 1.669 19845 3672 1 12 . 1 1 23 23 PHE CB C 23 38.853 38.853 39.734 -0.881 19845 3673 1 12 . 1 1 23 23 PHE H H 23 8.121 8.121 8.203 -0.082 19845 3674 1 12 . 1 1 24 24 VAL N N 24 119.181 119.181 119.973 -0.792 19845 3675 1 12 . 1 1 24 24 VAL HA H 24 3.134 3.134 3.420 -0.286 19845 3676 1 12 . 1 1 24 24 VAL C C 24 174.684 174.684 177.563 -2.879 19845 3677 1 12 . 1 1 24 24 VAL CA C 24 67.419 67.419 66.079 1.340 19845 3678 1 12 . 1 1 24 24 VAL CB C 24 31.106 31.106 31.437 -0.331 19845 3679 1 12 . 1 1 24 24 VAL H H 24 8.124 8.124 7.985 0.139 19845 3680 1 12 . 1 1 25 25 VAL N N 25 119.215 119.215 116.298 2.917 19845 3681 1 12 . 1 1 25 25 VAL HA H 25 3.324 3.324 3.623 -0.299 19845 3682 1 12 . 1 1 25 25 VAL C C 25 174.244 174.244 177.556 -3.312 19845 3683 1 12 . 1 1 25 25 VAL CA C 25 67.740 67.740 66.327 1.413 19845 3684 1 12 . 1 1 25 25 VAL CB C 25 31.270 31.270 31.165 0.105 19845 3685 1 12 . 1 1 25 25 VAL H H 25 8.250 8.250 7.353 0.897 19845 3686 1 12 . 1 1 26 26 PHE N N 26 119.875 119.875 118.824 1.051 19845 3687 1 12 . 1 1 26 26 PHE HA H 26 3.900 3.900 4.198 -0.298 19845 3688 1 12 . 1 1 26 26 PHE C C 26 175.371 175.371 177.681 -2.310 19845 3689 1 12 . 1 1 26 26 PHE CA C 26 61.651 61.651 61.092 0.559 19845 3690 1 12 . 1 1 26 26 PHE CB C 26 38.760 38.760 38.784 -0.024 19845 3691 1 12 . 1 1 26 26 PHE H H 26 8.413 8.413 7.212 1.201 19845 3692 1 12 . 1 1 27 27 LEU N N 27 122.548 122.548 119.493 3.055 19845 3693 1 12 . 1 1 27 27 LEU HA H 27 3.533 3.533 3.824 -0.291 19845 3694 1 12 . 1 1 27 27 LEU C C 27 175.256 175.256 178.743 -3.487 19845 3695 1 12 . 1 1 27 27 LEU CA C 27 58.211 58.211 57.633 0.577 19845 3696 1 12 . 1 1 27 27 LEU CB C 27 41.564 41.564 41.151 0.413 19845 3697 1 12 . 1 1 27 27 LEU H H 27 8.453 8.453 8.153 0.300 19845 3698 1 12 . 1 1 28 28 LEU N N 28 119.385 119.385 119.618 -0.233 19845 3699 1 12 . 1 1 28 28 LEU HA H 28 3.799 3.799 3.864 -0.065 19845 3700 1 12 . 1 1 28 28 LEU C C 28 175.881 175.881 179.365 -3.484 19845 3701 1 12 . 1 1 28 28 LEU CA C 28 58.492 58.492 57.901 0.591 19845 3702 1 12 . 1 1 28 28 LEU CB C 28 41.760 41.760 41.392 0.368 19845 3703 1 12 . 1 1 28 28 LEU H H 28 8.248 8.248 8.119 0.129 19845 3704 1 12 . 1 1 29 29 VAL N N 29 118.515 118.515 117.536 0.979 19845 3705 1 12 . 1 1 29 29 VAL HA H 29 3.319 3.319 3.839 -0.520 19845 3706 1 12 . 1 1 29 29 VAL C C 29 174.734 174.734 177.775 -3.041 19845 3707 1 12 . 1 1 29 29 VAL CA C 29 67.192 67.192 65.216 1.976 19845 3708 1 12 . 1 1 29 29 VAL CB C 29 31.175 31.175 31.569 -0.394 19845 3709 1 12 . 1 1 29 29 VAL H H 29 8.446 8.446 7.356 1.090 19845 3710 1 12 . 1 1 30 30 THR N N 30 117.313 117.313 117.272 0.041 19845 3711 1 12 . 1 1 30 30 THR HA H 30 3.432 3.432 3.908 -0.476 19845 3712 1 12 . 1 1 30 30 THR CA C 30 68.606 68.606 66.885 1.721 19845 3713 1 12 . 1 1 30 30 THR CB C 30 67.147 67.147 68.514 -1.367 19845 3714 1 12 . 1 1 30 30 THR H H 30 7.923 7.923 8.285 -0.362 19845 3715 1 12 . 1 1 31 31 LEU N N 31 120.629 120.629 121.429 -0.800 19845 3716 1 12 . 1 1 31 31 LEU HA H 31 3.858 3.858 4.041 -0.183 19845 3717 1 12 . 1 1 31 31 LEU C C 31 177.164 177.164 178.505 -1.341 19845 3718 1 12 . 1 1 31 31 LEU CA C 31 58.145 58.145 57.835 0.310 19845 3719 1 12 . 1 1 31 31 LEU CB C 31 41.615 41.615 41.080 0.535 19845 3720 1 12 . 1 1 31 31 LEU H H 31 8.382 8.382 8.203 0.179 19845 3721 1 12 . 1 1 32 32 ALA N N 32 125.216 125.216 121.894 3.322 19845 3722 1 12 . 1 1 32 32 ALA HA H 32 3.836 3.836 3.911 -0.075 19845 3723 1 12 . 1 1 32 32 ALA C C 32 175.968 175.968 180.691 -4.723 19845 3724 1 12 . 1 1 32 32 ALA CA C 32 55.918 55.918 54.838 1.080 19845 3725 1 12 . 1 1 32 32 ALA CB C 32 17.802 17.802 18.165 -0.362 19845 3726 1 12 . 1 1 32 32 ALA H H 32 8.517 8.517 7.684 0.833 19845 3727 1 12 . 1 1 33 33 ILE N N 33 118.722 118.722 119.127 -0.405 19845 3728 1 12 . 1 1 33 33 ILE HA H 33 3.481 3.481 3.594 -0.113 19845 3729 1 12 . 1 1 33 33 ILE C C 33 175.004 175.004 178.146 -3.142 19845 3730 1 12 . 1 1 33 33 ILE CA C 33 65.554 65.554 65.014 0.540 19845 3731 1 12 . 1 1 33 33 ILE CB C 33 37.657 37.657 37.220 0.437 19845 3732 1 12 . 1 1 33 33 ILE H H 33 8.288 8.288 7.674 0.614 19845 3733 1 12 . 1 1 34 34 LEU N N 34 118.987 118.987 119.981 -0.994 19845 3734 1 12 . 1 1 34 34 LEU HA H 34 3.893 3.893 3.992 -0.099 19845 3735 1 12 . 1 1 34 34 LEU C C 34 176.439 176.439 178.877 -2.438 19845 3736 1 12 . 1 1 34 34 LEU CA C 34 58.436 58.436 57.962 0.475 19845 3737 1 12 . 1 1 34 34 LEU CB C 34 42.152 42.152 40.396 1.756 19845 3738 1 12 . 1 1 34 34 LEU H H 34 8.493 8.493 8.087 0.406 19845 3739 1 12 . 1 1 35 35 THR N N 35 116.630 116.630 115.273 1.357 19845 3740 1 12 . 1 1 35 35 THR HA H 35 3.652 3.652 3.851 -0.199 19845 3741 1 12 . 1 1 35 35 THR C C 35 173.366 173.366 175.959 -2.593 19845 3742 1 12 . 1 1 35 35 THR CA C 35 68.153 68.153 66.669 1.484 19845 3743 1 12 . 1 1 35 35 THR CB C 35 68.162 68.162 68.558 -0.397 19845 3744 1 12 . 1 1 35 35 THR H H 35 8.215 8.215 8.213 0.002 19845 3745 1 12 . 1 1 36 36 ALA N N 36 124.667 124.667 123.406 1.261 19845 3746 1 12 . 1 1 36 36 ALA HA H 36 3.864 3.864 3.940 -0.076 19845 3747 1 12 . 1 1 36 36 ALA C C 36 176.510 176.510 179.432 -2.922 19845 3748 1 12 . 1 1 36 36 ALA CA C 36 55.758 55.758 55.135 0.623 19845 3749 1 12 . 1 1 36 36 ALA CB C 36 18.054 18.054 18.172 -0.117 19845 3750 1 12 . 1 1 36 36 ALA H H 36 8.358 8.358 8.066 0.291 19845 3751 1 12 . 1 1 37 37 LEU N N 37 116.565 116.565 117.995 -1.430 19845 3752 1 12 . 1 1 37 37 LEU HA H 37 3.973 3.973 4.094 -0.121 19845 3753 1 12 . 1 1 37 37 LEU C C 37 176.538 176.538 179.145 -2.607 19845 3754 1 12 . 1 1 37 37 LEU CA C 37 57.853 57.853 57.330 0.523 19845 3755 1 12 . 1 1 37 37 LEU CB C 37 42.018 42.018 40.655 1.363 19845 3756 1 12 . 1 1 37 37 LEU H H 37 8.360 8.360 7.555 0.805 19845 3757 1 12 . 1 1 38 38 ARG N N 38 119.392 119.392 119.769 -0.377 19845 3758 1 12 . 1 1 38 38 ARG HA H 38 4.104 4.104 4.061 0.043 19845 3759 1 12 . 1 1 38 38 ARG C C 38 176.208 176.208 179.360 -3.152 19845 3760 1 12 . 1 1 38 38 ARG CA C 38 58.100 58.100 59.290 -1.190 19845 3761 1 12 . 1 1 38 38 ARG CB C 38 29.502 29.502 29.794 -0.292 19845 3762 1 12 . 1 1 38 38 ARG H H 38 8.082 8.082 7.391 0.691 19845 3763 1 12 . 1 1 39 39 LEU N N 39 120.438 120.438 118.000 2.438 19845 3764 1 12 . 1 1 39 39 LEU HA H 39 4.243 4.243 3.833 0.410 19845 3765 1 12 . 1 1 39 39 LEU C C 39 175.702 175.702 178.452 -2.750 19845 3766 1 12 . 1 1 39 39 LEU CA C 39 56.979 56.979 57.499 -0.520 19845 3767 1 12 . 1 1 39 39 LEU CB C 39 41.893 41.893 41.169 0.724 19845 3768 1 12 . 1 1 39 39 LEU H H 39 8.446 8.446 7.794 0.652 19845 3769 1 12 . 1 1 40 40 ALA N N 40 122.512 122.512 120.591 1.921 19845 3770 1 12 . 1 1 40 40 ALA HA H 40 3.975 3.975 4.068 -0.093 19845 3771 1 12 . 1 1 40 40 ALA C C 40 175.838 175.838 178.656 -2.818 19845 3772 1 12 . 1 1 40 40 ALA CA C 40 54.710 54.710 54.520 0.190 19845 3773 1 12 . 1 1 40 40 ALA CB C 40 18.319 18.319 17.968 0.351 19845 3774 1 12 . 1 1 40 40 ALA H H 40 8.321 8.321 7.450 0.871 19845 3775 1 12 . 1 1 41 41 ALA N N 41 119.754 119.754 120.539 -0.785 19845 3776 1 12 . 1 1 41 41 ALA HA H 41 4.024 4.024 4.193 -0.169 19845 3777 1 12 . 1 1 41 41 ALA C C 41 176.517 176.517 179.902 -3.385 19845 3778 1 12 . 1 1 41 41 ALA CA C 41 54.486 54.486 54.719 -0.233 19845 3779 1 12 . 1 1 41 41 ALA CB C 41 18.468 18.468 18.708 -0.240 19845 3780 1 12 . 1 1 41 41 ALA H H 41 8.038 8.038 8.009 0.029 19845 3781 1 12 . 1 1 42 42 TYR N N 42 118.272 118.272 119.026 -0.754 19845 3782 1 12 . 1 1 42 42 TYR HA H 42 4.326 4.326 4.485 -0.159 19845 3783 1 12 . 1 1 42 42 TYR C C 42 174.633 174.633 178.258 -3.625 19845 3784 1 12 . 1 1 42 42 TYR CA C 42 60.098 60.098 59.650 0.448 19845 3785 1 12 . 1 1 42 42 TYR CB C 42 38.936 38.936 37.394 1.542 19845 3786 1 12 . 1 1 42 42 TYR H H 42 7.814 7.814 7.981 -0.167 19845 3787 1 12 . 1 1 43 43 ALA N N 43 122.908 122.908 120.949 1.959 19845 3788 1 12 . 1 1 43 43 ALA HA H 43 4.111 4.111 4.175 -0.064 19845 3789 1 12 . 1 1 43 43 ALA C C 43 175.241 175.241 177.937 -2.696 19845 3790 1 12 . 1 1 43 43 ALA CA C 43 53.842 53.842 53.823 0.019 19845 3791 1 12 . 1 1 43 43 ALA CB C 43 18.427 18.427 17.920 0.507 19845 3792 1 12 . 1 1 43 43 ALA H H 43 8.172 8.172 7.629 0.543 19845 3793 1 12 . 1 1 44 44 ALA N N 44 119.906 119.906 119.637 0.269 19845 3794 1 12 . 1 1 44 44 ALA HA H 44 4.051 4.051 4.243 -0.192 19845 3795 1 12 . 1 1 44 44 ALA C C 44 175.092 175.092 177.989 -2.897 19845 3796 1 12 . 1 1 44 44 ALA CA C 44 53.611 53.611 53.618 -0.007 19845 3797 1 12 . 1 1 44 44 ALA CB C 44 18.689 18.689 19.177 -0.488 19845 3798 1 12 . 1 1 44 44 ALA H H 44 7.953 7.953 7.821 0.132 19845 3799 1 12 . 1 1 45 45 ASN N N 45 114.984 114.984 117.048 -2.064 19845 3800 1 12 . 1 1 45 45 ASN HA H 45 4.541 4.541 4.770 -0.229 19845 3801 1 12 . 1 1 45 45 ASN CA C 45 54.506 54.506 54.715 -0.209 19845 3802 1 12 . 1 1 45 45 ASN CB C 45 38.602 38.602 39.532 -0.930 19845 3803 1 12 . 1 1 45 45 ASN H H 45 7.847 7.847 8.383 -0.536 19845 3804 1 12 . 1 1 46 46 ILE N N 46 119.155 119.155 117.464 1.691 19845 3805 1 12 . 1 1 46 46 ILE HA H 46 4.033 4.033 4.292 -0.259 19845 3806 1 12 . 1 1 46 46 ILE C C 46 173.344 173.344 175.375 -2.031 19845 3807 1 12 . 1 1 46 46 ILE CA C 46 62.357 62.357 61.810 0.547 19845 3808 1 12 . 1 1 46 46 ILE CB C 46 38.657 38.657 38.482 0.175 19845 3809 1 12 . 1 1 46 46 ILE H H 46 7.790 7.790 7.652 0.138 19845 3810 1 12 . 1 1 47 47 VAL N N 47 117.526 117.526 117.052 0.474 19845 3811 1 12 . 1 1 47 47 VAL HA H 47 4.133 4.133 4.321 -0.188 19845 3812 1 12 . 1 1 47 47 VAL C C 47 172.672 172.672 175.031 -2.359 19845 3813 1 12 . 1 1 47 47 VAL CA C 47 62.149 62.149 60.344 1.805 19845 3814 1 12 . 1 1 47 47 VAL CB C 47 32.807 32.807 34.894 -2.087 19845 3815 1 12 . 1 1 47 47 VAL H H 47 7.582 7.582 7.589 -0.007 19845 3816 1 12 . 1 1 48 48 ASN N N 48 120.091 120.091 119.116 0.975 19845 3817 1 12 . 1 1 48 48 ASN HA H 48 4.658 4.658 4.833 -0.175 19845 3818 1 12 . 1 1 48 48 ASN CA C 48 53.478 53.478 53.210 0.268 19845 3819 1 12 . 1 1 48 48 ASN CB C 48 38.573 38.573 37.825 0.748 19845 3820 1 12 . 1 1 48 48 ASN H H 48 8.053 8.053 8.482 -0.429 19845 3821 1 12 . 1 1 49 49 VAL N N 49 118.854 118.854 118.691 0.163 19845 3822 1 12 . 1 1 49 49 VAL HA H 49 4.133 4.133 4.204 -0.071 19845 3823 1 12 . 1 1 49 49 VAL C C 49 172.595 172.595 174.732 -2.137 19845 3824 1 12 . 1 1 49 49 VAL CA C 49 62.049 62.049 60.598 1.451 19845 3825 1 12 . 1 1 49 49 VAL CB C 49 33.271 33.271 34.524 -1.253 19845 3826 1 12 . 1 1 49 49 VAL H H 49 7.685 7.685 7.319 0.366 19845 3827 1 12 . 1 1 50 50 SER N N 50 118.689 118.689 119.169 -0.480 19845 3828 1 12 . 1 1 50 50 SER HA H 50 4.466 4.466 4.252 0.214 19845 3829 1 12 . 1 1 50 50 SER C C 50 171.430 171.430 172.565 -1.135 19845 3830 1 12 . 1 1 50 50 SER CA C 50 58.128 58.128 57.370 0.758 19845 3831 1 12 . 1 1 50 50 SER CB C 50 63.916 63.916 63.925 -0.009 19845 3832 1 12 . 1 1 50 50 SER H H 50 8.075 8.075 8.028 0.047 19845 3833 1 12 . 1 1 51 51 LEU N N 51 123.536 123.536 120.515 3.021 19845 3834 1 12 . 1 1 51 51 LEU HA H 51 4.305 4.305 4.691 -0.386 19845 3835 1 12 . 1 1 51 51 LEU C C 51 174.110 174.110 175.186 -1.076 19845 3836 1 12 . 1 1 51 51 LEU CA C 51 55.145 55.145 54.533 0.612 19845 3837 1 12 . 1 1 51 51 LEU CB C 51 42.674 42.674 44.471 -1.797 19845 3838 1 12 . 1 1 51 51 LEU H H 51 7.991 7.991 7.860 0.131 19845 3839 1 12 . 1 1 52 52 VAL N N 52 119.649 119.649 118.877 0.772 19845 3840 1 12 . 1 1 52 52 VAL HA H 52 3.992 3.992 4.397 -0.405 19845 3841 1 12 . 1 1 52 52 VAL C C 52 172.476 172.476 176.850 -4.374 19845 3842 1 12 . 1 1 52 52 VAL CA C 52 62.772 62.772 62.397 0.375 19845 3843 1 12 . 1 1 52 52 VAL CB C 52 33.066 33.066 32.689 0.377 19845 3844 1 12 . 1 1 52 52 VAL H H 52 7.536 7.536 8.300 -0.764 19845 3845 1 12 . 1 1 53 53 LYS N N 53 122.004 122.004 122.529 -0.525 19845 3846 1 12 . 1 1 53 53 LYS HA H 53 4.354 4.354 4.217 0.137 19845 3847 1 12 . 1 1 53 53 LYS CA C 53 56.567 56.567 59.880 -3.312 19845 3848 1 12 . 1 1 53 53 LYS CB C 53 31.689 31.689 29.910 1.779 19845 3849 1 12 . 1 1 53 53 LYS H H 53 8.038 8.038 8.519 -0.481 19845 3850 1 12 . 1 1 54 54 PRO HA H 54 4.353 4.353 4.518 -0.165 19845 3851 1 12 . 1 1 54 54 PRO CA C 54 65.103 65.103 64.989 0.114 19845 3852 1 12 . 1 1 54 54 PRO CB C 54 32.193 32.193 30.883 1.310 19845 3853 1 12 . 1 1 55 55 THR N N 55 111.485 111.485 111.145 0.340 19845 3854 1 12 . 1 1 55 55 THR HA H 55 3.910 3.910 4.759 -0.849 19845 3855 1 12 . 1 1 55 55 THR C C 55 172.822 172.822 176.345 -3.523 19845 3856 1 12 . 1 1 55 55 THR CA C 55 65.030 65.030 63.872 1.158 19845 3857 1 12 . 1 1 55 55 THR CB C 55 68.882 68.882 68.728 0.154 19845 3858 1 12 . 1 1 55 55 THR H H 55 7.722 7.722 7.428 0.294 19845 3859 1 12 . 1 1 56 56 VAL N N 56 121.165 121.165 119.982 1.183 19845 3860 1 12 . 1 1 56 56 VAL HA H 56 3.772 3.772 3.687 0.085 19845 3861 1 12 . 1 1 56 56 VAL C C 56 174.904 174.904 177.153 -2.249 19845 3862 1 12 . 1 1 56 56 VAL CA C 56 64.971 64.971 66.144 -1.173 19845 3863 1 12 . 1 1 56 56 VAL CB C 56 31.989 31.989 30.965 1.024 19845 3864 1 12 . 1 1 56 56 VAL H H 56 7.597 7.597 7.538 0.059 19845 3865 1 12 . 1 1 57 57 TYR N N 57 122.177 122.177 117.745 4.432 19845 3866 1 12 . 1 1 57 57 TYR HA H 57 4.227 4.227 4.237 -0.010 19845 3867 1 12 . 1 1 57 57 TYR C C 57 174.969 174.969 177.244 -2.275 19845 3868 1 12 . 1 1 57 57 TYR CA C 57 60.755 60.755 59.517 1.238 19845 3869 1 12 . 1 1 57 57 TYR CB C 57 38.453 38.453 37.116 1.337 19845 3870 1 12 . 1 1 57 57 TYR H H 57 7.964 7.964 7.763 0.201 19845 3871 1 12 . 1 1 58 58 VAL N N 58 119.069 119.069 118.647 0.422 19845 3872 1 12 . 1 1 58 58 VAL HA H 58 3.529 3.529 3.377 0.152 19845 3873 1 12 . 1 1 58 58 VAL C C 58 174.250 174.250 176.663 -2.413 19845 3874 1 12 . 1 1 58 58 VAL CA C 58 66.223 66.223 63.928 2.295 19845 3875 1 12 . 1 1 58 58 VAL CB C 58 31.803 31.803 31.241 0.562 19845 3876 1 12 . 1 1 58 58 VAL H H 58 8.018 8.018 7.238 0.780 19845 3877 1 12 . 1 1 59 59 TYR N N 59 120.360 120.360 121.518 -1.158 19845 3878 1 12 . 1 1 59 59 TYR HA H 59 4.115 4.115 4.018 0.097 19845 3879 1 12 . 1 1 59 59 TYR C C 59 173.899 173.899 177.381 -3.482 19845 3880 1 12 . 1 1 59 59 TYR CA C 59 60.929 60.929 61.139 -0.210 19845 3881 1 12 . 1 1 59 59 TYR CB C 59 38.602 38.602 37.992 0.610 19845 3882 1 12 . 1 1 59 59 TYR H H 59 8.142 8.142 8.077 0.065 19845 3883 1 12 . 1 1 60 60 SER N N 60 113.480 113.480 113.336 0.144 19845 3884 1 12 . 1 1 60 60 SER HA H 60 3.979 3.979 4.117 -0.138 19845 3885 1 12 . 1 1 60 60 SER C C 60 172.887 172.887 176.747 -3.860 19845 3886 1 12 . 1 1 60 60 SER CA C 60 60.987 60.987 61.168 -0.181 19845 3887 1 12 . 1 1 60 60 SER CB C 60 63.267 63.267 63.083 0.184 19845 3888 1 12 . 1 1 60 60 SER H H 60 8.057 8.057 7.791 0.266 19845 3889 1 12 . 1 1 61 61 ARG N N 61 120.962 120.962 122.707 -1.745 19845 3890 1 12 . 1 1 61 61 ARG HA H 61 4.103 4.103 4.022 0.081 19845 3891 1 12 . 1 1 61 61 ARG C C 61 175.399 175.399 178.502 -3.103 19845 3892 1 12 . 1 1 61 61 ARG CA C 61 57.427 57.427 59.187 -1.760 19845 3893 1 12 . 1 1 61 61 ARG CB C 61 30.008 30.008 30.301 -0.293 19845 3894 1 12 . 1 1 61 61 ARG H H 61 7.606 7.606 7.282 0.324 19845 3895 1 12 . 1 1 62 62 VAL N N 62 117.852 117.852 115.614 2.238 19845 3896 1 12 . 1 1 62 62 VAL HA H 62 3.805 3.805 3.672 0.133 19845 3897 1 12 . 1 1 62 62 VAL C C 62 174.155 174.155 177.144 -2.989 19845 3898 1 12 . 1 1 62 62 VAL CA C 62 64.458 64.458 66.109 -1.651 19845 3899 1 12 . 1 1 62 62 VAL CB C 62 31.969 31.969 31.561 0.408 19845 3900 1 12 . 1 1 62 62 VAL H H 62 7.848 7.848 8.301 -0.453 19845 3901 1 12 . 1 1 63 63 LYS N N 63 119.254 119.254 117.721 1.533 19845 3902 1 12 . 1 1 63 63 LYS HA H 63 4.051 4.051 4.068 -0.017 19845 3903 1 12 . 1 1 63 63 LYS C C 63 173.615 173.615 178.081 -4.466 19845 3904 1 12 . 1 1 63 63 LYS CA C 63 56.727 56.727 58.344 -1.617 19845 3905 1 12 . 1 1 63 63 LYS CB C 63 32.105 32.105 32.003 0.102 19845 3906 1 12 . 1 1 63 63 LYS H H 63 7.759 7.759 7.583 0.176 19845 3907 1 12 . 1 1 64 64 ASN N N 64 117.696 117.696 116.833 0.863 19845 3908 1 12 . 1 1 64 64 ASN HA H 64 4.642 4.642 4.436 0.206 19845 3909 1 12 . 1 1 64 64 ASN C C 64 171.750 171.750 175.745 -3.995 19845 3910 1 12 . 1 1 64 64 ASN CA C 64 53.313 53.313 55.048 -1.736 19845 3911 1 12 . 1 1 64 64 ASN CB C 64 39.260 39.260 39.072 0.188 19845 3912 1 12 . 1 1 64 64 ASN H H 64 7.615 7.615 7.949 -0.334 19845 3913 1 13 . 1 1 9 9 THR N N 9 113.692 113.692 117.084 -3.392 19845 3914 1 13 . 1 1 9 9 THR HA H 9 4.213 4.213 4.052 0.161 19845 3915 1 13 . 1 1 9 9 THR C C 9 172.757 172.757 174.183 -1.426 19845 3916 1 13 . 1 1 9 9 THR CA C 9 62.810 62.810 63.365 -0.555 19845 3917 1 13 . 1 1 9 9 THR CB C 9 69.878 69.878 67.805 2.074 19845 3918 1 13 . 1 1 9 9 THR H H 9 7.930 7.930 8.297 -0.367 19845 3919 1 13 . 1 1 10 10 GLY N N 10 110.842 110.842 107.665 3.177 19845 3920 1 13 . 1 1 10 10 GLY C C 10 171.923 171.923 173.786 -1.863 19845 3921 1 13 . 1 1 10 10 GLY CA C 10 46.099 46.099 44.517 1.582 19845 3922 1 13 . 1 1 10 10 GLY H H 10 8.266 8.266 8.123 0.143 19845 3923 1 13 . 1 1 11 11 THR N N 11 113.754 113.754 116.442 -2.688 19845 3924 1 13 . 1 1 11 11 THR HA H 11 4.220 4.220 4.508 -0.288 19845 3925 1 13 . 1 1 11 11 THR C C 11 171.906 171.906 174.697 -2.791 19845 3926 1 13 . 1 1 11 11 THR CA C 11 62.721 62.721 61.788 0.933 19845 3927 1 13 . 1 1 11 11 THR CB C 11 69.549 69.549 68.698 0.851 19845 3928 1 13 . 1 1 11 11 THR H H 11 7.753 7.753 7.989 -0.236 19845 3929 1 13 . 1 1 12 12 LEU N N 12 123.669 123.669 123.714 -0.045 19845 3930 1 13 . 1 1 12 12 LEU HA H 12 4.240 4.240 4.853 -0.613 19845 3931 1 13 . 1 1 12 12 LEU C C 12 175.221 175.221 177.230 -2.009 19845 3932 1 13 . 1 1 12 12 LEU CA C 12 56.799 56.799 55.320 1.479 19845 3933 1 13 . 1 1 12 12 LEU CB C 12 42.536 42.536 42.097 0.439 19845 3934 1 13 . 1 1 12 12 LEU H H 12 7.980 7.980 8.424 -0.444 19845 3935 1 13 . 1 1 13 13 ILE N N 13 120.086 120.086 120.483 -0.397 19845 3936 1 13 . 1 1 13 13 ILE HA H 13 3.913 3.913 4.140 -0.227 19845 3937 1 13 . 1 1 13 13 ILE C C 13 173.425 173.425 177.211 -3.786 19845 3938 1 13 . 1 1 13 13 ILE CA C 13 62.889 62.889 63.630 -0.741 19845 3939 1 13 . 1 1 13 13 ILE CB C 13 38.249 38.249 38.382 -0.133 19845 3940 1 13 . 1 1 13 13 ILE H H 13 7.861 7.861 7.768 0.093 19845 3941 1 13 . 1 1 14 14 VAL N N 14 119.785 119.785 120.717 -0.932 19845 3942 1 13 . 1 1 14 14 VAL HA H 14 3.790 3.790 3.841 -0.051 19845 3943 1 13 . 1 1 14 14 VAL C C 14 173.429 173.429 177.313 -3.884 19845 3944 1 13 . 1 1 14 14 VAL CA C 14 64.409 64.409 65.392 -0.983 19845 3945 1 13 . 1 1 14 14 VAL CB C 14 32.007 32.007 31.137 0.870 19845 3946 1 13 . 1 1 14 14 VAL H H 14 7.549 7.549 8.125 -0.576 19845 3947 1 13 . 1 1 15 15 ASN N N 15 119.567 119.567 115.664 3.903 19845 3948 1 13 . 1 1 15 15 ASN HA H 15 4.549 4.549 4.650 -0.101 19845 3949 1 13 . 1 1 15 15 ASN C C 15 173.619 173.619 177.318 -3.699 19845 3950 1 13 . 1 1 15 15 ASN CA C 15 54.805 54.805 55.343 -0.538 19845 3951 1 13 . 1 1 15 15 ASN CB C 15 38.824 38.824 38.307 0.517 19845 3952 1 13 . 1 1 15 15 ASN H H 15 8.010 8.010 8.432 -0.422 19845 3953 1 13 . 1 1 16 16 SER N N 16 116.730 116.730 117.071 -0.341 19845 3954 1 13 . 1 1 16 16 SER HA H 16 4.177 4.177 4.424 -0.247 19845 3955 1 13 . 1 1 16 16 SER CA C 16 61.705 61.705 61.065 0.640 19845 3956 1 13 . 1 1 16 16 SER CB C 16 63.752 63.752 63.402 0.350 19845 3957 1 13 . 1 1 16 16 SER H H 16 8.039 8.039 7.479 0.560 19845 3958 1 13 . 1 1 17 17 VAL N N 17 122.062 122.062 122.091 -0.029 19845 3959 1 13 . 1 1 17 17 VAL HA H 17 3.677 3.677 3.873 -0.196 19845 3960 1 13 . 1 1 17 17 VAL C C 17 174.474 174.474 176.989 -2.515 19845 3961 1 13 . 1 1 17 17 VAL CA C 17 66.671 66.671 65.747 0.924 19845 3962 1 13 . 1 1 17 17 VAL CB C 17 31.531 31.531 32.059 -0.528 19845 3963 1 13 . 1 1 17 17 VAL H H 17 7.896 7.896 8.404 -0.508 19845 3964 1 13 . 1 1 18 18 LEU N N 18 119.103 119.103 120.313 -1.210 19845 3965 1 13 . 1 1 18 18 LEU HA H 18 3.998 3.998 4.256 -0.258 19845 3966 1 13 . 1 1 18 18 LEU C C 18 175.511 175.511 178.126 -2.615 19845 3967 1 13 . 1 1 18 18 LEU CA C 18 58.107 58.107 57.928 0.179 19845 3968 1 13 . 1 1 18 18 LEU CB C 18 41.593 41.593 41.976 -0.383 19845 3969 1 13 . 1 1 18 18 LEU H H 18 7.857 7.857 7.437 0.420 19845 3970 1 13 . 1 1 19 19 LEU N N 19 118.291 118.291 120.256 -1.965 19845 3971 1 13 . 1 1 19 19 LEU HA H 19 4.152 4.152 4.143 0.009 19845 3972 1 13 . 1 1 19 19 LEU C C 19 175.156 175.156 178.608 -3.452 19845 3973 1 13 . 1 1 19 19 LEU CA C 19 58.011 58.011 57.962 0.049 19845 3974 1 13 . 1 1 19 19 LEU CB C 19 42.027 42.027 41.864 0.164 19845 3975 1 13 . 1 1 19 19 LEU H H 19 7.745 7.745 7.593 0.152 19845 3976 1 13 . 1 1 20 20 PHE N N 20 118.415 118.415 119.392 -0.977 19845 3977 1 13 . 1 1 20 20 PHE HA H 20 4.188 4.188 4.184 0.004 19845 3978 1 13 . 1 1 20 20 PHE C C 20 174.260 174.260 177.258 -2.998 19845 3979 1 13 . 1 1 20 20 PHE CA C 20 61.626 61.626 62.022 -0.396 19845 3980 1 13 . 1 1 20 20 PHE CB C 20 38.643 38.643 38.981 -0.338 19845 3981 1 13 . 1 1 20 20 PHE H H 20 8.002 8.002 8.254 -0.252 19845 3982 1 13 . 1 1 21 21 LEU N N 21 118.571 118.571 119.562 -0.991 19845 3983 1 13 . 1 1 21 21 LEU HA H 21 3.797 3.797 4.130 -0.333 19845 3984 1 13 . 1 1 21 21 LEU C C 21 175.324 175.324 179.110 -3.786 19845 3985 1 13 . 1 1 21 21 LEU CA C 21 58.128 58.128 58.124 0.004 19845 3986 1 13 . 1 1 21 21 LEU CB C 21 41.957 41.957 40.996 0.961 19845 3987 1 13 . 1 1 21 21 LEU H H 21 8.456 8.456 7.769 0.687 19845 3988 1 13 . 1 1 22 22 ALA N N 22 120.775 120.775 120.993 -0.218 19845 3989 1 13 . 1 1 22 22 ALA HA H 22 3.779 3.779 4.162 -0.383 19845 3990 1 13 . 1 1 22 22 ALA C C 22 175.697 175.697 179.999 -4.302 19845 3991 1 13 . 1 1 22 22 ALA CA C 22 55.721 55.721 54.518 1.203 19845 3992 1 13 . 1 1 22 22 ALA CB C 22 17.788 17.788 18.391 -0.603 19845 3993 1 13 . 1 1 22 22 ALA H H 22 8.353 8.353 7.610 0.743 19845 3994 1 13 . 1 1 23 23 PHE N N 23 117.860 117.860 120.248 -2.388 19845 3995 1 13 . 1 1 23 23 PHE HA H 23 4.108 4.108 4.394 -0.286 19845 3996 1 13 . 1 1 23 23 PHE C C 23 173.859 173.859 176.892 -3.033 19845 3997 1 13 . 1 1 23 23 PHE CA C 23 61.271 61.271 61.595 -0.324 19845 3998 1 13 . 1 1 23 23 PHE CB C 23 38.853 38.853 39.942 -1.089 19845 3999 1 13 . 1 1 23 23 PHE H H 23 8.121 8.121 8.122 -0.001 19845 4000 1 13 . 1 1 24 24 VAL N N 24 119.181 119.181 119.971 -0.790 19845 4001 1 13 . 1 1 24 24 VAL HA H 24 3.134 3.134 3.545 -0.410 19845 4002 1 13 . 1 1 24 24 VAL C C 24 174.684 174.684 177.406 -2.722 19845 4003 1 13 . 1 1 24 24 VAL CA C 24 67.419 67.419 66.809 0.610 19845 4004 1 13 . 1 1 24 24 VAL CB C 24 31.106 31.106 31.863 -0.757 19845 4005 1 13 . 1 1 24 24 VAL H H 24 8.124 8.124 8.379 -0.255 19845 4006 1 13 . 1 1 25 25 VAL N N 25 119.215 119.215 116.906 2.309 19845 4007 1 13 . 1 1 25 25 VAL HA H 25 3.324 3.324 3.666 -0.342 19845 4008 1 13 . 1 1 25 25 VAL C C 25 174.244 174.244 177.664 -3.420 19845 4009 1 13 . 1 1 25 25 VAL CA C 25 67.740 67.740 66.497 1.243 19845 4010 1 13 . 1 1 25 25 VAL CB C 25 31.270 31.270 30.635 0.635 19845 4011 1 13 . 1 1 25 25 VAL H H 25 8.250 8.250 7.411 0.839 19845 4012 1 13 . 1 1 26 26 PHE N N 26 119.875 119.875 119.528 0.347 19845 4013 1 13 . 1 1 26 26 PHE HA H 26 3.900 3.900 4.169 -0.269 19845 4014 1 13 . 1 1 26 26 PHE C C 26 175.371 175.371 177.987 -2.616 19845 4015 1 13 . 1 1 26 26 PHE CA C 26 61.651 61.651 61.418 0.233 19845 4016 1 13 . 1 1 26 26 PHE CB C 26 38.760 38.760 38.468 0.292 19845 4017 1 13 . 1 1 26 26 PHE H H 26 8.413 8.413 7.176 1.237 19845 4018 1 13 . 1 1 27 27 LEU N N 27 122.548 122.548 119.415 3.133 19845 4019 1 13 . 1 1 27 27 LEU HA H 27 3.533 3.533 3.933 -0.400 19845 4020 1 13 . 1 1 27 27 LEU C C 27 175.256 175.256 178.805 -3.549 19845 4021 1 13 . 1 1 27 27 LEU CA C 27 58.211 58.211 57.664 0.547 19845 4022 1 13 . 1 1 27 27 LEU CB C 27 41.564 41.564 41.434 0.129 19845 4023 1 13 . 1 1 27 27 LEU H H 27 8.453 8.453 8.096 0.357 19845 4024 1 13 . 1 1 28 28 LEU N N 28 119.385 119.385 119.534 -0.149 19845 4025 1 13 . 1 1 28 28 LEU HA H 28 3.799 3.799 3.897 -0.098 19845 4026 1 13 . 1 1 28 28 LEU C C 28 175.881 175.881 179.222 -3.341 19845 4027 1 13 . 1 1 28 28 LEU CA C 28 58.492 58.492 57.870 0.622 19845 4028 1 13 . 1 1 28 28 LEU CB C 28 41.760 41.760 41.404 0.356 19845 4029 1 13 . 1 1 28 28 LEU H H 28 8.248 8.248 8.209 0.039 19845 4030 1 13 . 1 1 29 29 VAL N N 29 118.515 118.515 114.258 4.257 19845 4031 1 13 . 1 1 29 29 VAL HA H 29 3.319 3.319 3.908 -0.589 19845 4032 1 13 . 1 1 29 29 VAL C C 29 174.734 174.734 177.831 -3.097 19845 4033 1 13 . 1 1 29 29 VAL CA C 29 67.192 67.192 65.082 2.110 19845 4034 1 13 . 1 1 29 29 VAL CB C 29 31.175 31.175 30.785 0.390 19845 4035 1 13 . 1 1 29 29 VAL H H 29 8.446 8.446 7.375 1.071 19845 4036 1 13 . 1 1 30 30 THR N N 30 117.313 117.313 117.834 -0.521 19845 4037 1 13 . 1 1 30 30 THR HA H 30 3.432 3.432 3.884 -0.452 19845 4038 1 13 . 1 1 30 30 THR CA C 30 68.606 68.606 66.522 2.083 19845 4039 1 13 . 1 1 30 30 THR CB C 30 67.147 67.147 68.645 -1.498 19845 4040 1 13 . 1 1 30 30 THR H H 30 7.923 7.923 8.068 -0.145 19845 4041 1 13 . 1 1 31 31 LEU N N 31 120.629 120.629 121.257 -0.628 19845 4042 1 13 . 1 1 31 31 LEU HA H 31 3.858 3.858 4.045 -0.187 19845 4043 1 13 . 1 1 31 31 LEU C C 31 177.164 177.164 178.428 -1.264 19845 4044 1 13 . 1 1 31 31 LEU CA C 31 58.145 58.145 57.844 0.301 19845 4045 1 13 . 1 1 31 31 LEU CB C 31 41.615 41.615 41.236 0.379 19845 4046 1 13 . 1 1 31 31 LEU H H 31 8.382 8.382 8.157 0.225 19845 4047 1 13 . 1 1 32 32 ALA N N 32 125.216 125.216 121.933 3.283 19845 4048 1 13 . 1 1 32 32 ALA HA H 32 3.836 3.836 3.927 -0.091 19845 4049 1 13 . 1 1 32 32 ALA C C 32 175.968 175.968 180.689 -4.721 19845 4050 1 13 . 1 1 32 32 ALA CA C 32 55.918 55.918 54.858 1.060 19845 4051 1 13 . 1 1 32 32 ALA CB C 32 17.802 17.802 18.173 -0.371 19845 4052 1 13 . 1 1 32 32 ALA H H 32 8.517 8.517 7.728 0.789 19845 4053 1 13 . 1 1 33 33 ILE N N 33 118.722 118.722 119.087 -0.365 19845 4054 1 13 . 1 1 33 33 ILE HA H 33 3.481 3.481 3.598 -0.117 19845 4055 1 13 . 1 1 33 33 ILE C C 33 175.004 175.004 178.145 -3.141 19845 4056 1 13 . 1 1 33 33 ILE CA C 33 65.554 65.554 64.990 0.564 19845 4057 1 13 . 1 1 33 33 ILE CB C 33 37.657 37.657 37.221 0.436 19845 4058 1 13 . 1 1 33 33 ILE H H 33 8.288 8.288 7.629 0.659 19845 4059 1 13 . 1 1 34 34 LEU N N 34 118.987 118.987 120.226 -1.239 19845 4060 1 13 . 1 1 34 34 LEU HA H 34 3.893 3.893 4.001 -0.108 19845 4061 1 13 . 1 1 34 34 LEU C C 34 176.439 176.439 178.910 -2.471 19845 4062 1 13 . 1 1 34 34 LEU CA C 34 58.436 58.436 58.074 0.362 19845 4063 1 13 . 1 1 34 34 LEU CB C 34 42.152 42.152 40.389 1.763 19845 4064 1 13 . 1 1 34 34 LEU H H 34 8.493 8.493 8.154 0.339 19845 4065 1 13 . 1 1 35 35 THR N N 35 116.630 116.630 114.910 1.720 19845 4066 1 13 . 1 1 35 35 THR HA H 35 3.652 3.652 3.964 -0.312 19845 4067 1 13 . 1 1 35 35 THR C C 35 173.366 173.366 176.106 -2.740 19845 4068 1 13 . 1 1 35 35 THR CA C 35 68.153 68.153 66.149 2.004 19845 4069 1 13 . 1 1 35 35 THR CB C 35 68.162 68.162 68.044 0.118 19845 4070 1 13 . 1 1 35 35 THR H H 35 8.215 8.215 8.189 0.026 19845 4071 1 13 . 1 1 36 36 ALA N N 36 124.667 124.667 123.324 1.343 19845 4072 1 13 . 1 1 36 36 ALA HA H 36 3.864 3.864 4.056 -0.192 19845 4073 1 13 . 1 1 36 36 ALA C C 36 176.510 176.510 179.754 -3.244 19845 4074 1 13 . 1 1 36 36 ALA CA C 36 55.758 55.758 54.886 0.872 19845 4075 1 13 . 1 1 36 36 ALA CB C 36 18.054 18.054 18.087 -0.033 19845 4076 1 13 . 1 1 36 36 ALA H H 36 8.358 8.358 7.965 0.393 19845 4077 1 13 . 1 1 37 37 LEU N N 37 116.565 116.565 117.676 -1.111 19845 4078 1 13 . 1 1 37 37 LEU HA H 37 3.973 3.973 4.115 -0.142 19845 4079 1 13 . 1 1 37 37 LEU C C 37 176.538 176.538 179.212 -2.674 19845 4080 1 13 . 1 1 37 37 LEU CA C 37 57.853 57.853 57.110 0.743 19845 4081 1 13 . 1 1 37 37 LEU CB C 37 42.018 42.018 40.489 1.529 19845 4082 1 13 . 1 1 37 37 LEU H H 37 8.360 8.360 7.575 0.785 19845 4083 1 13 . 1 1 38 38 ARG N N 38 119.392 119.392 119.856 -0.464 19845 4084 1 13 . 1 1 38 38 ARG HA H 38 4.104 4.104 4.061 0.043 19845 4085 1 13 . 1 1 38 38 ARG C C 38 176.208 176.208 179.312 -3.104 19845 4086 1 13 . 1 1 38 38 ARG CA C 38 58.100 58.100 58.997 -0.897 19845 4087 1 13 . 1 1 38 38 ARG CB C 38 29.502 29.502 29.625 -0.123 19845 4088 1 13 . 1 1 38 38 ARG H H 38 8.082 8.082 7.502 0.580 19845 4089 1 13 . 1 1 39 39 LEU N N 39 120.438 120.438 117.921 2.517 19845 4090 1 13 . 1 1 39 39 LEU HA H 39 4.243 4.243 3.860 0.383 19845 4091 1 13 . 1 1 39 39 LEU C C 39 175.702 175.702 178.473 -2.771 19845 4092 1 13 . 1 1 39 39 LEU CA C 39 56.979 56.979 58.388 -1.409 19845 4093 1 13 . 1 1 39 39 LEU CB C 39 41.893 41.893 41.485 0.408 19845 4094 1 13 . 1 1 39 39 LEU H H 39 8.446 8.446 7.761 0.685 19845 4095 1 13 . 1 1 40 40 ALA N N 40 122.512 122.512 120.926 1.586 19845 4096 1 13 . 1 1 40 40 ALA HA H 40 3.975 3.975 4.069 -0.094 19845 4097 1 13 . 1 1 40 40 ALA C C 40 175.838 175.838 178.572 -2.734 19845 4098 1 13 . 1 1 40 40 ALA CA C 40 54.710 54.710 54.587 0.123 19845 4099 1 13 . 1 1 40 40 ALA CB C 40 18.319 18.319 18.019 0.300 19845 4100 1 13 . 1 1 40 40 ALA H H 40 8.321 8.321 7.504 0.817 19845 4101 1 13 . 1 1 41 41 ALA N N 41 119.754 119.754 120.703 -0.949 19845 4102 1 13 . 1 1 41 41 ALA HA H 41 4.024 4.024 4.186 -0.162 19845 4103 1 13 . 1 1 41 41 ALA C C 41 176.517 176.517 179.894 -3.377 19845 4104 1 13 . 1 1 41 41 ALA CA C 41 54.486 54.486 54.757 -0.271 19845 4105 1 13 . 1 1 41 41 ALA CB C 41 18.468 18.468 18.675 -0.207 19845 4106 1 13 . 1 1 41 41 ALA H H 41 8.038 8.038 8.001 0.037 19845 4107 1 13 . 1 1 42 42 TYR N N 42 118.272 118.272 118.778 -0.506 19845 4108 1 13 . 1 1 42 42 TYR HA H 42 4.326 4.326 4.230 0.096 19845 4109 1 13 . 1 1 42 42 TYR C C 42 174.633 174.633 177.701 -3.068 19845 4110 1 13 . 1 1 42 42 TYR CA C 42 60.098 60.098 60.111 -0.013 19845 4111 1 13 . 1 1 42 42 TYR CB C 42 38.936 38.936 37.408 1.528 19845 4112 1 13 . 1 1 42 42 TYR H H 42 7.814 7.814 8.033 -0.219 19845 4113 1 13 . 1 1 43 43 ALA N N 43 122.908 122.908 121.298 1.610 19845 4114 1 13 . 1 1 43 43 ALA HA H 43 4.111 4.111 4.199 -0.088 19845 4115 1 13 . 1 1 43 43 ALA C C 43 175.241 175.241 178.326 -3.085 19845 4116 1 13 . 1 1 43 43 ALA CA C 43 53.842 53.842 54.068 -0.226 19845 4117 1 13 . 1 1 43 43 ALA CB C 43 18.427 18.427 17.820 0.607 19845 4118 1 13 . 1 1 43 43 ALA H H 43 8.172 8.172 7.580 0.592 19845 4119 1 13 . 1 1 44 44 ALA N N 44 119.906 119.906 119.367 0.539 19845 4120 1 13 . 1 1 44 44 ALA HA H 44 4.051 4.051 4.219 -0.168 19845 4121 1 13 . 1 1 44 44 ALA C C 44 175.092 175.092 178.063 -2.971 19845 4122 1 13 . 1 1 44 44 ALA CA C 44 53.611 53.611 53.517 0.094 19845 4123 1 13 . 1 1 44 44 ALA CB C 44 18.689 18.689 18.969 -0.280 19845 4124 1 13 . 1 1 44 44 ALA H H 44 7.953 7.953 7.714 0.239 19845 4125 1 13 . 1 1 45 45 ASN N N 45 114.984 114.984 117.041 -2.057 19845 4126 1 13 . 1 1 45 45 ASN HA H 45 4.541 4.541 4.720 -0.179 19845 4127 1 13 . 1 1 45 45 ASN CA C 45 54.506 54.506 54.719 -0.213 19845 4128 1 13 . 1 1 45 45 ASN CB C 45 38.602 38.602 40.250 -1.648 19845 4129 1 13 . 1 1 45 45 ASN H H 45 7.847 7.847 8.153 -0.306 19845 4130 1 13 . 1 1 46 46 ILE N N 46 119.155 119.155 117.446 1.709 19845 4131 1 13 . 1 1 46 46 ILE HA H 46 4.033 4.033 4.361 -0.328 19845 4132 1 13 . 1 1 46 46 ILE C C 46 173.344 173.344 175.447 -2.103 19845 4133 1 13 . 1 1 46 46 ILE CA C 46 62.357 62.357 61.945 0.412 19845 4134 1 13 . 1 1 46 46 ILE CB C 46 38.657 38.657 38.765 -0.108 19845 4135 1 13 . 1 1 46 46 ILE H H 46 7.790 7.790 7.647 0.143 19845 4136 1 13 . 1 1 47 47 VAL N N 47 117.526 117.526 115.059 2.467 19845 4137 1 13 . 1 1 47 47 VAL HA H 47 4.133 4.133 4.457 -0.324 19845 4138 1 13 . 1 1 47 47 VAL C C 47 172.672 172.672 174.488 -1.816 19845 4139 1 13 . 1 1 47 47 VAL CA C 47 62.149 62.149 59.838 2.311 19845 4140 1 13 . 1 1 47 47 VAL CB C 47 32.807 32.807 34.083 -1.276 19845 4141 1 13 . 1 1 47 47 VAL H H 47 7.582 7.582 7.513 0.069 19845 4142 1 13 . 1 1 48 48 ASN N N 48 120.091 120.091 119.862 0.229 19845 4143 1 13 . 1 1 48 48 ASN HA H 48 4.658 4.658 4.801 -0.143 19845 4144 1 13 . 1 1 48 48 ASN CA C 48 53.478 53.478 53.203 0.275 19845 4145 1 13 . 1 1 48 48 ASN CB C 48 38.573 38.573 36.321 2.252 19845 4146 1 13 . 1 1 48 48 ASN H H 48 8.053 8.053 8.565 -0.512 19845 4147 1 13 . 1 1 49 49 VAL N N 49 118.854 118.854 119.978 -1.124 19845 4148 1 13 . 1 1 49 49 VAL HA H 49 4.133 4.133 4.229 -0.096 19845 4149 1 13 . 1 1 49 49 VAL C C 49 172.595 172.595 174.024 -1.429 19845 4150 1 13 . 1 1 49 49 VAL CA C 49 62.049 62.049 60.931 1.118 19845 4151 1 13 . 1 1 49 49 VAL CB C 49 33.271 33.271 34.142 -0.871 19845 4152 1 13 . 1 1 49 49 VAL H H 49 7.685 7.685 8.027 -0.342 19845 4153 1 13 . 1 1 50 50 SER N N 50 118.689 118.689 121.704 -3.015 19845 4154 1 13 . 1 1 50 50 SER HA H 50 4.466 4.466 3.888 0.578 19845 4155 1 13 . 1 1 50 50 SER C C 50 171.430 171.430 172.661 -1.231 19845 4156 1 13 . 1 1 50 50 SER CA C 50 58.128 58.128 56.580 1.548 19845 4157 1 13 . 1 1 50 50 SER CB C 50 63.916 63.916 64.121 -0.205 19845 4158 1 13 . 1 1 50 50 SER H H 50 8.075 8.075 8.214 -0.139 19845 4159 1 13 . 1 1 51 51 LEU N N 51 123.536 123.536 122.159 1.377 19845 4160 1 13 . 1 1 51 51 LEU HA H 51 4.305 4.305 4.621 -0.316 19845 4161 1 13 . 1 1 51 51 LEU C C 51 174.110 174.110 175.839 -1.729 19845 4162 1 13 . 1 1 51 51 LEU CA C 51 55.145 55.145 54.182 0.963 19845 4163 1 13 . 1 1 51 51 LEU CB C 51 42.674 42.674 45.044 -2.370 19845 4164 1 13 . 1 1 51 51 LEU H H 51 7.991 7.991 7.804 0.187 19845 4165 1 13 . 1 1 52 52 VAL N N 52 119.649 119.649 120.669 -1.020 19845 4166 1 13 . 1 1 52 52 VAL HA H 52 3.992 3.992 4.337 -0.345 19845 4167 1 13 . 1 1 52 52 VAL C C 52 172.476 172.476 177.249 -4.773 19845 4168 1 13 . 1 1 52 52 VAL CA C 52 62.772 62.772 63.657 -0.885 19845 4169 1 13 . 1 1 52 52 VAL CB C 52 33.066 33.066 33.038 0.028 19845 4170 1 13 . 1 1 52 52 VAL H H 52 7.536 7.536 8.415 -0.879 19845 4171 1 13 . 1 1 53 53 LYS N N 53 122.004 122.004 122.546 -0.542 19845 4172 1 13 . 1 1 53 53 LYS HA H 53 4.354 4.354 4.170 0.184 19845 4173 1 13 . 1 1 53 53 LYS CA C 53 56.567 56.567 60.025 -3.458 19845 4174 1 13 . 1 1 53 53 LYS CB C 53 31.689 31.689 30.178 1.511 19845 4175 1 13 . 1 1 53 53 LYS H H 53 8.038 8.038 8.643 -0.605 19845 4176 1 13 . 1 1 54 54 PRO HA H 54 4.353 4.353 4.450 -0.097 19845 4177 1 13 . 1 1 54 54 PRO CA C 54 65.103 65.103 64.865 0.238 19845 4178 1 13 . 1 1 54 54 PRO CB C 54 32.193 32.193 31.005 1.188 19845 4179 1 13 . 1 1 55 55 THR N N 55 111.485 111.485 110.148 1.337 19845 4180 1 13 . 1 1 55 55 THR HA H 55 3.910 3.910 4.808 -0.898 19845 4181 1 13 . 1 1 55 55 THR C C 55 172.822 172.822 176.727 -3.905 19845 4182 1 13 . 1 1 55 55 THR CA C 55 65.030 65.030 63.072 1.958 19845 4183 1 13 . 1 1 55 55 THR CB C 55 68.882 68.882 69.469 -0.587 19845 4184 1 13 . 1 1 55 55 THR H H 55 7.722 7.722 7.950 -0.228 19845 4185 1 13 . 1 1 56 56 VAL N N 56 121.165 121.165 120.835 0.330 19845 4186 1 13 . 1 1 56 56 VAL HA H 56 3.772 3.772 3.676 0.096 19845 4187 1 13 . 1 1 56 56 VAL C C 56 174.904 174.904 176.972 -2.068 19845 4188 1 13 . 1 1 56 56 VAL CA C 56 64.971 64.971 66.125 -1.154 19845 4189 1 13 . 1 1 56 56 VAL CB C 56 31.989 31.989 31.223 0.766 19845 4190 1 13 . 1 1 56 56 VAL H H 56 7.597 7.597 7.636 -0.039 19845 4191 1 13 . 1 1 57 57 TYR N N 57 122.177 122.177 117.614 4.563 19845 4192 1 13 . 1 1 57 57 TYR HA H 57 4.227 4.227 4.191 0.036 19845 4193 1 13 . 1 1 57 57 TYR C C 57 174.969 174.969 177.041 -2.072 19845 4194 1 13 . 1 1 57 57 TYR CA C 57 60.755 60.755 59.470 1.285 19845 4195 1 13 . 1 1 57 57 TYR CB C 57 38.453 38.453 36.889 1.565 19845 4196 1 13 . 1 1 57 57 TYR H H 57 7.964 7.964 8.052 -0.088 19845 4197 1 13 . 1 1 58 58 VAL N N 58 119.069 119.069 119.495 -0.426 19845 4198 1 13 . 1 1 58 58 VAL HA H 58 3.529 3.529 3.150 0.379 19845 4199 1 13 . 1 1 58 58 VAL C C 58 174.250 174.250 177.169 -2.919 19845 4200 1 13 . 1 1 58 58 VAL CA C 58 66.223 66.223 65.301 0.922 19845 4201 1 13 . 1 1 58 58 VAL CB C 58 31.803 31.803 31.280 0.523 19845 4202 1 13 . 1 1 58 58 VAL H H 58 8.018 8.018 7.229 0.789 19845 4203 1 13 . 1 1 59 59 TYR N N 59 120.360 120.360 120.891 -0.531 19845 4204 1 13 . 1 1 59 59 TYR HA H 59 4.115 4.115 3.901 0.214 19845 4205 1 13 . 1 1 59 59 TYR C C 59 173.899 173.899 177.701 -3.802 19845 4206 1 13 . 1 1 59 59 TYR CA C 59 60.929 60.929 61.630 -0.702 19845 4207 1 13 . 1 1 59 59 TYR CB C 59 38.602 38.602 37.983 0.619 19845 4208 1 13 . 1 1 59 59 TYR H H 59 8.142 8.142 7.855 0.287 19845 4209 1 13 . 1 1 60 60 SER N N 60 113.480 113.480 113.274 0.206 19845 4210 1 13 . 1 1 60 60 SER HA H 60 3.979 3.979 4.025 -0.046 19845 4211 1 13 . 1 1 60 60 SER C C 60 172.887 172.887 176.787 -3.900 19845 4212 1 13 . 1 1 60 60 SER CA C 60 60.987 60.987 61.582 -0.595 19845 4213 1 13 . 1 1 60 60 SER CB C 60 63.267 63.267 63.050 0.217 19845 4214 1 13 . 1 1 60 60 SER H H 60 8.057 8.057 7.700 0.357 19845 4215 1 13 . 1 1 61 61 ARG N N 61 120.962 120.962 121.318 -0.356 19845 4216 1 13 . 1 1 61 61 ARG HA H 61 4.103 4.103 3.934 0.169 19845 4217 1 13 . 1 1 61 61 ARG C C 61 175.399 175.399 178.680 -3.281 19845 4218 1 13 . 1 1 61 61 ARG CA C 61 57.427 57.427 59.123 -1.696 19845 4219 1 13 . 1 1 61 61 ARG CB C 61 30.008 30.008 29.994 0.014 19845 4220 1 13 . 1 1 61 61 ARG H H 61 7.606 7.606 7.339 0.267 19845 4221 1 13 . 1 1 62 62 VAL N N 62 117.852 117.852 118.482 -0.630 19845 4222 1 13 . 1 1 62 62 VAL HA H 62 3.805 3.805 3.746 0.059 19845 4223 1 13 . 1 1 62 62 VAL C C 62 174.155 174.155 176.916 -2.761 19845 4224 1 13 . 1 1 62 62 VAL CA C 62 64.458 64.458 65.444 -0.986 19845 4225 1 13 . 1 1 62 62 VAL CB C 62 31.969 31.969 31.459 0.510 19845 4226 1 13 . 1 1 62 62 VAL H H 62 7.848 7.848 8.116 -0.268 19845 4227 1 13 . 1 1 63 63 LYS N N 63 119.254 119.254 119.104 0.150 19845 4228 1 13 . 1 1 63 63 LYS HA H 63 4.051 4.051 4.064 -0.013 19845 4229 1 13 . 1 1 63 63 LYS C C 63 173.615 173.615 178.325 -4.710 19845 4230 1 13 . 1 1 63 63 LYS CA C 63 56.727 56.727 57.840 -1.113 19845 4231 1 13 . 1 1 63 63 LYS CB C 63 32.105 32.105 32.918 -0.813 19845 4232 1 13 . 1 1 63 63 LYS H H 63 7.759 7.759 7.657 0.102 19845 4233 1 13 . 1 1 64 64 ASN N N 64 117.696 117.696 117.245 0.451 19845 4234 1 13 . 1 1 64 64 ASN HA H 64 4.642 4.642 4.429 0.213 19845 4235 1 13 . 1 1 64 64 ASN C C 64 171.750 171.750 176.262 -4.512 19845 4236 1 13 . 1 1 64 64 ASN CA C 64 53.313 53.313 54.844 -1.531 19845 4237 1 13 . 1 1 64 64 ASN CB C 64 39.260 39.260 39.039 0.221 19845 4238 1 13 . 1 1 64 64 ASN H H 64 7.615 7.615 7.863 -0.248 19845 4239 1 14 . 1 1 9 9 THR N N 9 113.692 113.692 116.091 -2.399 19845 4240 1 14 . 1 1 9 9 THR HA H 9 4.213 4.213 4.557 -0.344 19845 4241 1 14 . 1 1 9 9 THR C C 9 172.757 172.757 175.077 -2.320 19845 4242 1 14 . 1 1 9 9 THR CA C 9 62.810 62.810 62.344 0.466 19845 4243 1 14 . 1 1 9 9 THR CB C 9 69.878 69.878 69.170 0.708 19845 4244 1 14 . 1 1 9 9 THR H H 9 7.930 7.930 8.491 -0.561 19845 4245 1 14 . 1 1 10 10 GLY N N 10 110.842 110.842 109.113 1.729 19845 4246 1 14 . 1 1 10 10 GLY C C 10 171.923 171.923 173.909 -1.986 19845 4247 1 14 . 1 1 10 10 GLY CA C 10 46.099 46.099 44.605 1.494 19845 4248 1 14 . 1 1 10 10 GLY H H 10 8.266 8.266 7.918 0.348 19845 4249 1 14 . 1 1 11 11 THR N N 11 113.754 113.754 118.765 -5.011 19845 4250 1 14 . 1 1 11 11 THR HA H 11 4.220 4.220 4.200 0.020 19845 4251 1 14 . 1 1 11 11 THR C C 11 171.906 171.906 174.489 -2.583 19845 4252 1 14 . 1 1 11 11 THR CA C 11 62.721 62.721 63.683 -0.962 19845 4253 1 14 . 1 1 11 11 THR CB C 11 69.549 69.549 68.475 1.074 19845 4254 1 14 . 1 1 11 11 THR H H 11 7.753 7.753 7.996 -0.243 19845 4255 1 14 . 1 1 12 12 LEU N N 12 123.669 123.669 126.942 -3.273 19845 4256 1 14 . 1 1 12 12 LEU HA H 12 4.240 4.240 4.683 -0.443 19845 4257 1 14 . 1 1 12 12 LEU C C 12 175.221 175.221 177.727 -2.506 19845 4258 1 14 . 1 1 12 12 LEU CA C 12 56.799 56.799 55.203 1.596 19845 4259 1 14 . 1 1 12 12 LEU CB C 12 42.536 42.536 41.974 0.562 19845 4260 1 14 . 1 1 12 12 LEU H H 12 7.980 7.980 8.286 -0.306 19845 4261 1 14 . 1 1 13 13 ILE N N 13 120.086 120.086 120.751 -0.665 19845 4262 1 14 . 1 1 13 13 ILE HA H 13 3.913 3.913 4.127 -0.214 19845 4263 1 14 . 1 1 13 13 ILE C C 13 173.425 173.425 177.395 -3.970 19845 4264 1 14 . 1 1 13 13 ILE CA C 13 62.889 62.889 63.586 -0.697 19845 4265 1 14 . 1 1 13 13 ILE CB C 13 38.249 38.249 37.762 0.487 19845 4266 1 14 . 1 1 13 13 ILE H H 13 7.861 7.861 7.697 0.165 19845 4267 1 14 . 1 1 14 14 VAL N N 14 119.785 119.785 120.831 -1.046 19845 4268 1 14 . 1 1 14 14 VAL HA H 14 3.790 3.790 3.936 -0.146 19845 4269 1 14 . 1 1 14 14 VAL C C 14 173.429 173.429 177.146 -3.717 19845 4270 1 14 . 1 1 14 14 VAL CA C 14 64.409 64.409 65.464 -1.055 19845 4271 1 14 . 1 1 14 14 VAL CB C 14 32.007 32.007 31.242 0.765 19845 4272 1 14 . 1 1 14 14 VAL H H 14 7.549 7.549 8.202 -0.653 19845 4273 1 14 . 1 1 15 15 ASN N N 15 119.567 119.567 116.718 2.849 19845 4274 1 14 . 1 1 15 15 ASN HA H 15 4.549 4.549 4.654 -0.105 19845 4275 1 14 . 1 1 15 15 ASN C C 15 173.619 173.619 177.439 -3.820 19845 4276 1 14 . 1 1 15 15 ASN CA C 15 54.805 54.805 55.844 -1.039 19845 4277 1 14 . 1 1 15 15 ASN CB C 15 38.824 38.824 38.164 0.660 19845 4278 1 14 . 1 1 15 15 ASN H H 15 8.010 8.010 8.115 -0.105 19845 4279 1 14 . 1 1 16 16 SER N N 16 116.730 116.730 117.038 -0.308 19845 4280 1 14 . 1 1 16 16 SER HA H 16 4.177 4.177 4.445 -0.268 19845 4281 1 14 . 1 1 16 16 SER CA C 16 61.705 61.705 61.695 0.010 19845 4282 1 14 . 1 1 16 16 SER CB C 16 63.752 63.752 63.500 0.252 19845 4283 1 14 . 1 1 16 16 SER H H 16 8.039 8.039 7.502 0.537 19845 4284 1 14 . 1 1 17 17 VAL N N 17 122.062 122.062 122.543 -0.481 19845 4285 1 14 . 1 1 17 17 VAL HA H 17 3.677 3.677 3.873 -0.196 19845 4286 1 14 . 1 1 17 17 VAL C C 17 174.474 174.474 177.027 -2.553 19845 4287 1 14 . 1 1 17 17 VAL CA C 17 66.671 66.671 65.488 1.183 19845 4288 1 14 . 1 1 17 17 VAL CB C 17 31.531 31.531 31.732 -0.201 19845 4289 1 14 . 1 1 17 17 VAL H H 17 7.896 7.896 8.002 -0.106 19845 4290 1 14 . 1 1 18 18 LEU N N 18 119.103 119.103 120.397 -1.294 19845 4291 1 14 . 1 1 18 18 LEU HA H 18 3.998 3.998 4.166 -0.168 19845 4292 1 14 . 1 1 18 18 LEU C C 18 175.511 175.511 178.534 -3.023 19845 4293 1 14 . 1 1 18 18 LEU CA C 18 58.107 58.107 57.718 0.389 19845 4294 1 14 . 1 1 18 18 LEU CB C 18 41.593 41.593 42.262 -0.669 19845 4295 1 14 . 1 1 18 18 LEU H H 18 7.857 7.857 7.392 0.465 19845 4296 1 14 . 1 1 19 19 LEU N N 19 118.291 118.291 119.527 -1.236 19845 4297 1 14 . 1 1 19 19 LEU HA H 19 4.152 4.152 4.121 0.031 19845 4298 1 14 . 1 1 19 19 LEU C C 19 175.156 175.156 179.286 -4.130 19845 4299 1 14 . 1 1 19 19 LEU CA C 19 58.011 58.011 57.974 0.038 19845 4300 1 14 . 1 1 19 19 LEU CB C 19 42.027 42.027 41.196 0.831 19845 4301 1 14 . 1 1 19 19 LEU H H 19 7.745 7.745 7.641 0.104 19845 4302 1 14 . 1 1 20 20 PHE N N 20 118.415 118.415 119.721 -1.306 19845 4303 1 14 . 1 1 20 20 PHE HA H 20 4.188 4.188 4.177 0.011 19845 4304 1 14 . 1 1 20 20 PHE C C 20 174.260 174.260 177.672 -3.412 19845 4305 1 14 . 1 1 20 20 PHE CA C 20 61.626 61.626 61.892 -0.266 19845 4306 1 14 . 1 1 20 20 PHE CB C 20 38.643 38.643 38.958 -0.315 19845 4307 1 14 . 1 1 20 20 PHE H H 20 8.002 8.002 8.161 -0.159 19845 4308 1 14 . 1 1 21 21 LEU N N 21 118.571 118.571 120.101 -1.530 19845 4309 1 14 . 1 1 21 21 LEU HA H 21 3.797 3.797 4.137 -0.340 19845 4310 1 14 . 1 1 21 21 LEU C C 21 175.324 175.324 179.026 -3.702 19845 4311 1 14 . 1 1 21 21 LEU CA C 21 58.128 58.128 58.460 -0.332 19845 4312 1 14 . 1 1 21 21 LEU CB C 21 41.957 41.957 40.769 1.188 19845 4313 1 14 . 1 1 21 21 LEU H H 21 8.456 8.456 7.687 0.769 19845 4314 1 14 . 1 1 22 22 ALA N N 22 120.775 120.775 120.589 0.186 19845 4315 1 14 . 1 1 22 22 ALA HA H 22 3.779 3.779 4.152 -0.373 19845 4316 1 14 . 1 1 22 22 ALA C C 22 175.697 175.697 180.128 -4.431 19845 4317 1 14 . 1 1 22 22 ALA CA C 22 55.721 55.721 54.476 1.245 19845 4318 1 14 . 1 1 22 22 ALA CB C 22 17.788 17.788 18.224 -0.436 19845 4319 1 14 . 1 1 22 22 ALA H H 22 8.353 8.353 7.530 0.823 19845 4320 1 14 . 1 1 23 23 PHE N N 23 117.860 117.860 120.460 -2.600 19845 4321 1 14 . 1 1 23 23 PHE HA H 23 4.108 4.108 4.406 -0.298 19845 4322 1 14 . 1 1 23 23 PHE C C 23 173.859 173.859 176.869 -3.010 19845 4323 1 14 . 1 1 23 23 PHE CA C 23 61.271 61.271 61.444 -0.173 19845 4324 1 14 . 1 1 23 23 PHE CB C 23 38.853 38.853 39.946 -1.093 19845 4325 1 14 . 1 1 23 23 PHE H H 23 8.121 8.121 8.234 -0.113 19845 4326 1 14 . 1 1 24 24 VAL N N 24 119.181 119.181 119.712 -0.531 19845 4327 1 14 . 1 1 24 24 VAL HA H 24 3.134 3.134 3.455 -0.321 19845 4328 1 14 . 1 1 24 24 VAL C C 24 174.684 174.684 177.494 -2.810 19845 4329 1 14 . 1 1 24 24 VAL CA C 24 67.419 67.419 66.623 0.796 19845 4330 1 14 . 1 1 24 24 VAL CB C 24 31.106 31.106 31.675 -0.569 19845 4331 1 14 . 1 1 24 24 VAL H H 24 8.124 8.124 8.317 -0.193 19845 4332 1 14 . 1 1 25 25 VAL N N 25 119.215 119.215 116.180 3.035 19845 4333 1 14 . 1 1 25 25 VAL HA H 25 3.324 3.324 3.621 -0.297 19845 4334 1 14 . 1 1 25 25 VAL C C 25 174.244 174.244 177.506 -3.262 19845 4335 1 14 . 1 1 25 25 VAL CA C 25 67.740 67.740 65.924 1.816 19845 4336 1 14 . 1 1 25 25 VAL CB C 25 31.270 31.270 31.124 0.146 19845 4337 1 14 . 1 1 25 25 VAL H H 25 8.250 8.250 7.351 0.899 19845 4338 1 14 . 1 1 26 26 PHE N N 26 119.875 119.875 119.289 0.586 19845 4339 1 14 . 1 1 26 26 PHE HA H 26 3.900 3.900 4.194 -0.294 19845 4340 1 14 . 1 1 26 26 PHE C C 26 175.371 175.371 177.604 -2.233 19845 4341 1 14 . 1 1 26 26 PHE CA C 26 61.651 61.651 60.941 0.710 19845 4342 1 14 . 1 1 26 26 PHE CB C 26 38.760 38.760 38.638 0.122 19845 4343 1 14 . 1 1 26 26 PHE H H 26 8.413 8.413 7.182 1.231 19845 4344 1 14 . 1 1 27 27 LEU N N 27 122.548 122.548 119.250 3.298 19845 4345 1 14 . 1 1 27 27 LEU HA H 27 3.533 3.533 3.931 -0.398 19845 4346 1 14 . 1 1 27 27 LEU C C 27 175.256 175.256 179.040 -3.784 19845 4347 1 14 . 1 1 27 27 LEU CA C 27 58.211 58.211 57.753 0.458 19845 4348 1 14 . 1 1 27 27 LEU CB C 27 41.564 41.564 41.446 0.118 19845 4349 1 14 . 1 1 27 27 LEU H H 27 8.453 8.453 8.241 0.212 19845 4350 1 14 . 1 1 28 28 LEU N N 28 119.385 119.385 119.816 -0.431 19845 4351 1 14 . 1 1 28 28 LEU HA H 28 3.799 3.799 3.882 -0.083 19845 4352 1 14 . 1 1 28 28 LEU C C 28 175.881 175.881 179.027 -3.146 19845 4353 1 14 . 1 1 28 28 LEU CA C 28 58.492 58.492 58.204 0.288 19845 4354 1 14 . 1 1 28 28 LEU CB C 28 41.760 41.760 41.453 0.307 19845 4355 1 14 . 1 1 28 28 LEU H H 28 8.248 8.248 7.900 0.348 19845 4356 1 14 . 1 1 29 29 VAL N N 29 118.515 118.515 117.435 1.080 19845 4357 1 14 . 1 1 29 29 VAL HA H 29 3.319 3.319 3.651 -0.332 19845 4358 1 14 . 1 1 29 29 VAL C C 29 174.734 174.734 177.788 -3.054 19845 4359 1 14 . 1 1 29 29 VAL CA C 29 67.192 67.192 65.914 1.278 19845 4360 1 14 . 1 1 29 29 VAL CB C 29 31.175 31.175 31.826 -0.651 19845 4361 1 14 . 1 1 29 29 VAL H H 29 8.446 8.446 7.311 1.135 19845 4362 1 14 . 1 1 30 30 THR N N 30 117.313 117.313 116.537 0.776 19845 4363 1 14 . 1 1 30 30 THR HA H 30 3.432 3.432 3.928 -0.496 19845 4364 1 14 . 1 1 30 30 THR CA C 30 68.606 68.606 66.853 1.753 19845 4365 1 14 . 1 1 30 30 THR CB C 30 67.147 67.147 68.413 -1.266 19845 4366 1 14 . 1 1 30 30 THR H H 30 7.923 7.923 8.019 -0.096 19845 4367 1 14 . 1 1 31 31 LEU N N 31 120.629 120.629 121.311 -0.682 19845 4368 1 14 . 1 1 31 31 LEU HA H 31 3.858 3.858 3.968 -0.110 19845 4369 1 14 . 1 1 31 31 LEU C C 31 177.164 177.164 178.547 -1.383 19845 4370 1 14 . 1 1 31 31 LEU CA C 31 58.145 58.145 57.670 0.475 19845 4371 1 14 . 1 1 31 31 LEU CB C 31 41.615 41.615 41.648 -0.033 19845 4372 1 14 . 1 1 31 31 LEU H H 31 8.382 8.382 7.989 0.393 19845 4373 1 14 . 1 1 32 32 ALA N N 32 125.216 125.216 121.637 3.579 19845 4374 1 14 . 1 1 32 32 ALA HA H 32 3.836 3.836 3.932 -0.096 19845 4375 1 14 . 1 1 32 32 ALA C C 32 175.968 175.968 180.524 -4.556 19845 4376 1 14 . 1 1 32 32 ALA CA C 32 55.918 55.918 54.865 1.053 19845 4377 1 14 . 1 1 32 32 ALA CB C 32 17.802 17.802 18.142 -0.340 19845 4378 1 14 . 1 1 32 32 ALA H H 32 8.517 8.517 7.598 0.919 19845 4379 1 14 . 1 1 33 33 ILE N N 33 118.722 118.722 118.932 -0.210 19845 4380 1 14 . 1 1 33 33 ILE HA H 33 3.481 3.481 3.589 -0.108 19845 4381 1 14 . 1 1 33 33 ILE C C 33 175.004 175.004 178.073 -3.069 19845 4382 1 14 . 1 1 33 33 ILE CA C 33 65.554 65.554 64.842 0.712 19845 4383 1 14 . 1 1 33 33 ILE CB C 33 37.657 37.657 37.362 0.295 19845 4384 1 14 . 1 1 33 33 ILE H H 33 8.288 8.288 7.542 0.746 19845 4385 1 14 . 1 1 34 34 LEU N N 34 118.987 118.987 119.746 -0.759 19845 4386 1 14 . 1 1 34 34 LEU HA H 34 3.893 3.893 3.996 -0.103 19845 4387 1 14 . 1 1 34 34 LEU C C 34 176.439 176.439 178.363 -1.924 19845 4388 1 14 . 1 1 34 34 LEU CA C 34 58.436 58.436 58.017 0.419 19845 4389 1 14 . 1 1 34 34 LEU CB C 34 42.152 42.152 41.125 1.027 19845 4390 1 14 . 1 1 34 34 LEU H H 34 8.493 8.493 8.082 0.411 19845 4391 1 14 . 1 1 35 35 THR N N 35 116.630 116.630 114.869 1.761 19845 4392 1 14 . 1 1 35 35 THR HA H 35 3.652 3.652 3.899 -0.247 19845 4393 1 14 . 1 1 35 35 THR C C 35 173.366 173.366 176.225 -2.859 19845 4394 1 14 . 1 1 35 35 THR CA C 35 68.153 68.153 66.840 1.313 19845 4395 1 14 . 1 1 35 35 THR CB C 35 68.162 68.162 68.380 -0.218 19845 4396 1 14 . 1 1 35 35 THR H H 35 8.215 8.215 8.195 0.020 19845 4397 1 14 . 1 1 36 36 ALA N N 36 124.667 124.667 123.711 0.956 19845 4398 1 14 . 1 1 36 36 ALA HA H 36 3.864 3.864 4.058 -0.194 19845 4399 1 14 . 1 1 36 36 ALA C C 36 176.510 176.510 179.888 -3.378 19845 4400 1 14 . 1 1 36 36 ALA CA C 36 55.758 55.758 55.006 0.752 19845 4401 1 14 . 1 1 36 36 ALA CB C 36 18.054 18.054 18.017 0.037 19845 4402 1 14 . 1 1 36 36 ALA H H 36 8.358 8.358 8.002 0.356 19845 4403 1 14 . 1 1 37 37 LEU N N 37 116.565 116.565 117.858 -1.293 19845 4404 1 14 . 1 1 37 37 LEU HA H 37 3.973 3.973 4.104 -0.131 19845 4405 1 14 . 1 1 37 37 LEU C C 37 176.538 176.538 179.234 -2.696 19845 4406 1 14 . 1 1 37 37 LEU CA C 37 57.853 57.853 57.321 0.532 19845 4407 1 14 . 1 1 37 37 LEU CB C 37 42.018 42.018 40.604 1.414 19845 4408 1 14 . 1 1 37 37 LEU H H 37 8.360 8.360 7.547 0.813 19845 4409 1 14 . 1 1 38 38 ARG N N 38 119.392 119.392 119.738 -0.346 19845 4410 1 14 . 1 1 38 38 ARG HA H 38 4.104 4.104 4.091 0.013 19845 4411 1 14 . 1 1 38 38 ARG C C 38 176.208 176.208 179.425 -3.217 19845 4412 1 14 . 1 1 38 38 ARG CA C 38 58.100 58.100 59.012 -0.912 19845 4413 1 14 . 1 1 38 38 ARG CB C 38 29.502 29.502 29.668 -0.166 19845 4414 1 14 . 1 1 38 38 ARG H H 38 8.082 8.082 7.465 0.617 19845 4415 1 14 . 1 1 39 39 LEU N N 39 120.438 120.438 117.427 3.011 19845 4416 1 14 . 1 1 39 39 LEU HA H 39 4.243 4.243 3.915 0.328 19845 4417 1 14 . 1 1 39 39 LEU C C 39 175.702 175.702 178.451 -2.749 19845 4418 1 14 . 1 1 39 39 LEU CA C 39 56.979 56.979 57.459 -0.480 19845 4419 1 14 . 1 1 39 39 LEU CB C 39 41.893 41.893 41.068 0.825 19845 4420 1 14 . 1 1 39 39 LEU H H 39 8.446 8.446 7.831 0.615 19845 4421 1 14 . 1 1 40 40 ALA N N 40 122.512 122.512 120.754 1.758 19845 4422 1 14 . 1 1 40 40 ALA HA H 40 3.975 3.975 4.095 -0.120 19845 4423 1 14 . 1 1 40 40 ALA C C 40 175.838 175.838 178.532 -2.694 19845 4424 1 14 . 1 1 40 40 ALA CA C 40 54.710 54.710 54.436 0.274 19845 4425 1 14 . 1 1 40 40 ALA CB C 40 18.319 18.319 18.118 0.201 19845 4426 1 14 . 1 1 40 40 ALA H H 40 8.321 8.321 7.679 0.642 19845 4427 1 14 . 1 1 41 41 ALA N N 41 119.754 119.754 120.707 -0.953 19845 4428 1 14 . 1 1 41 41 ALA HA H 41 4.024 4.024 4.171 -0.147 19845 4429 1 14 . 1 1 41 41 ALA C C 41 176.517 176.517 179.901 -3.384 19845 4430 1 14 . 1 1 41 41 ALA CA C 41 54.486 54.486 54.757 -0.271 19845 4431 1 14 . 1 1 41 41 ALA CB C 41 18.468 18.468 18.705 -0.237 19845 4432 1 14 . 1 1 41 41 ALA H H 41 8.038 8.038 7.958 0.080 19845 4433 1 14 . 1 1 42 42 TYR N N 42 118.272 118.272 118.492 -0.220 19845 4434 1 14 . 1 1 42 42 TYR HA H 42 4.326 4.326 4.591 -0.265 19845 4435 1 14 . 1 1 42 42 TYR C C 42 174.633 174.633 178.098 -3.465 19845 4436 1 14 . 1 1 42 42 TYR CA C 42 60.098 60.098 59.671 0.427 19845 4437 1 14 . 1 1 42 42 TYR CB C 42 38.936 38.936 37.531 1.405 19845 4438 1 14 . 1 1 42 42 TYR H H 42 7.814 7.814 7.999 -0.185 19845 4439 1 14 . 1 1 43 43 ALA N N 43 122.908 122.908 121.039 1.869 19845 4440 1 14 . 1 1 43 43 ALA HA H 43 4.111 4.111 4.260 -0.148 19845 4441 1 14 . 1 1 43 43 ALA C C 43 175.241 175.241 178.078 -2.837 19845 4442 1 14 . 1 1 43 43 ALA CA C 43 53.842 53.842 53.939 -0.097 19845 4443 1 14 . 1 1 43 43 ALA CB C 43 18.427 18.427 17.884 0.543 19845 4444 1 14 . 1 1 43 43 ALA H H 43 8.172 8.172 7.514 0.658 19845 4445 1 14 . 1 1 44 44 ALA N N 44 119.906 119.906 119.178 0.728 19845 4446 1 14 . 1 1 44 44 ALA HA H 44 4.051 4.051 4.271 -0.220 19845 4447 1 14 . 1 1 44 44 ALA C C 44 175.092 175.092 178.003 -2.911 19845 4448 1 14 . 1 1 44 44 ALA CA C 44 53.611 53.611 53.413 0.198 19845 4449 1 14 . 1 1 44 44 ALA CB C 44 18.689 18.689 18.980 -0.291 19845 4450 1 14 . 1 1 44 44 ALA H H 44 7.953 7.953 7.687 0.266 19845 4451 1 14 . 1 1 45 45 ASN N N 45 114.984 114.984 117.440 -2.456 19845 4452 1 14 . 1 1 45 45 ASN HA H 45 4.541 4.541 4.744 -0.203 19845 4453 1 14 . 1 1 45 45 ASN CA C 45 54.506 54.506 54.824 -0.318 19845 4454 1 14 . 1 1 45 45 ASN CB C 45 38.602 38.602 39.425 -0.823 19845 4455 1 14 . 1 1 45 45 ASN H H 45 7.847 7.847 8.361 -0.514 19845 4456 1 14 . 1 1 46 46 ILE N N 46 119.155 119.155 115.547 3.608 19845 4457 1 14 . 1 1 46 46 ILE HA H 46 4.033 4.033 4.380 -0.347 19845 4458 1 14 . 1 1 46 46 ILE C C 46 173.344 173.344 175.782 -2.438 19845 4459 1 14 . 1 1 46 46 ILE CA C 46 62.357 62.357 61.871 0.486 19845 4460 1 14 . 1 1 46 46 ILE CB C 46 38.657 38.657 39.125 -0.468 19845 4461 1 14 . 1 1 46 46 ILE H H 46 7.790 7.790 7.747 0.043 19845 4462 1 14 . 1 1 47 47 VAL N N 47 117.526 117.526 119.366 -1.840 19845 4463 1 14 . 1 1 47 47 VAL HA H 47 4.133 4.133 4.372 -0.239 19845 4464 1 14 . 1 1 47 47 VAL C C 47 172.672 172.672 174.434 -1.762 19845 4465 1 14 . 1 1 47 47 VAL CA C 47 62.149 62.149 60.031 2.118 19845 4466 1 14 . 1 1 47 47 VAL CB C 47 32.807 32.807 35.302 -2.495 19845 4467 1 14 . 1 1 47 47 VAL H H 47 7.582 7.582 7.604 -0.022 19845 4468 1 14 . 1 1 48 48 ASN N N 48 120.091 120.091 121.720 -1.629 19845 4469 1 14 . 1 1 48 48 ASN HA H 48 4.658 4.658 4.710 -0.052 19845 4470 1 14 . 1 1 48 48 ASN CA C 48 53.478 53.478 53.903 -0.425 19845 4471 1 14 . 1 1 48 48 ASN CB C 48 38.573 38.573 37.134 1.439 19845 4472 1 14 . 1 1 48 48 ASN H H 48 8.053 8.053 8.539 -0.486 19845 4473 1 14 . 1 1 49 49 VAL N N 49 118.854 118.854 119.917 -1.063 19845 4474 1 14 . 1 1 49 49 VAL HA H 49 4.133 4.133 4.258 -0.125 19845 4475 1 14 . 1 1 49 49 VAL C C 49 172.595 172.595 173.549 -0.954 19845 4476 1 14 . 1 1 49 49 VAL CA C 49 62.049 62.049 60.737 1.312 19845 4477 1 14 . 1 1 49 49 VAL CB C 49 33.271 33.271 34.648 -1.377 19845 4478 1 14 . 1 1 49 49 VAL H H 49 7.685 7.685 8.142 -0.457 19845 4479 1 14 . 1 1 50 50 SER N N 50 118.689 118.689 120.887 -2.198 19845 4480 1 14 . 1 1 50 50 SER HA H 50 4.466 4.466 4.124 0.342 19845 4481 1 14 . 1 1 50 50 SER C C 50 171.430 171.430 172.617 -1.187 19845 4482 1 14 . 1 1 50 50 SER CA C 50 58.128 58.128 56.974 1.154 19845 4483 1 14 . 1 1 50 50 SER CB C 50 63.916 63.916 64.158 -0.242 19845 4484 1 14 . 1 1 50 50 SER H H 50 8.075 8.075 8.206 -0.131 19845 4485 1 14 . 1 1 51 51 LEU N N 51 123.536 123.536 122.777 0.759 19845 4486 1 14 . 1 1 51 51 LEU HA H 51 4.305 4.305 4.638 -0.333 19845 4487 1 14 . 1 1 51 51 LEU C C 51 174.110 174.110 175.194 -1.084 19845 4488 1 14 . 1 1 51 51 LEU CA C 51 55.145 55.145 54.160 0.985 19845 4489 1 14 . 1 1 51 51 LEU CB C 51 42.674 42.674 45.764 -3.090 19845 4490 1 14 . 1 1 51 51 LEU H H 51 7.991 7.991 8.097 -0.106 19845 4491 1 14 . 1 1 52 52 VAL N N 52 119.649 119.649 119.656 -0.007 19845 4492 1 14 . 1 1 52 52 VAL HA H 52 3.992 3.992 4.193 -0.201 19845 4493 1 14 . 1 1 52 52 VAL C C 52 172.476 172.476 176.914 -4.438 19845 4494 1 14 . 1 1 52 52 VAL CA C 52 62.772 62.772 63.050 -0.278 19845 4495 1 14 . 1 1 52 52 VAL CB C 52 33.066 33.066 33.101 -0.035 19845 4496 1 14 . 1 1 52 52 VAL H H 52 7.536 7.536 8.193 -0.657 19845 4497 1 14 . 1 1 53 53 LYS N N 53 122.004 122.004 122.733 -0.729 19845 4498 1 14 . 1 1 53 53 LYS HA H 53 4.354 4.354 4.150 0.204 19845 4499 1 14 . 1 1 53 53 LYS CA C 53 56.567 56.567 59.985 -3.418 19845 4500 1 14 . 1 1 53 53 LYS CB C 53 31.689 31.689 29.867 1.822 19845 4501 1 14 . 1 1 53 53 LYS H H 53 8.038 8.038 8.540 -0.502 19845 4502 1 14 . 1 1 54 54 PRO HA H 54 4.353 4.353 4.445 -0.092 19845 4503 1 14 . 1 1 54 54 PRO CA C 54 65.103 65.103 64.897 0.206 19845 4504 1 14 . 1 1 54 54 PRO CB C 54 32.193 32.193 31.012 1.181 19845 4505 1 14 . 1 1 55 55 THR N N 55 111.485 111.485 110.523 0.962 19845 4506 1 14 . 1 1 55 55 THR HA H 55 3.910 3.910 4.805 -0.895 19845 4507 1 14 . 1 1 55 55 THR C C 55 172.822 172.822 176.710 -3.888 19845 4508 1 14 . 1 1 55 55 THR CA C 55 65.030 65.030 63.250 1.780 19845 4509 1 14 . 1 1 55 55 THR CB C 55 68.882 68.882 69.459 -0.577 19845 4510 1 14 . 1 1 55 55 THR H H 55 7.722 7.722 7.963 -0.241 19845 4511 1 14 . 1 1 56 56 VAL N N 56 121.165 121.165 121.808 -0.643 19845 4512 1 14 . 1 1 56 56 VAL HA H 56 3.772 3.772 3.774 -0.002 19845 4513 1 14 . 1 1 56 56 VAL C C 56 174.904 174.904 176.951 -2.047 19845 4514 1 14 . 1 1 56 56 VAL CA C 56 64.971 64.971 65.264 -0.293 19845 4515 1 14 . 1 1 56 56 VAL CB C 56 31.989 31.989 30.299 1.690 19845 4516 1 14 . 1 1 56 56 VAL H H 56 7.597 7.597 7.736 -0.139 19845 4517 1 14 . 1 1 57 57 TYR N N 57 122.177 122.177 117.982 4.195 19845 4518 1 14 . 1 1 57 57 TYR HA H 57 4.227 4.227 4.247 -0.020 19845 4519 1 14 . 1 1 57 57 TYR C C 57 174.969 174.969 177.368 -2.399 19845 4520 1 14 . 1 1 57 57 TYR CA C 57 60.755 60.755 59.732 1.023 19845 4521 1 14 . 1 1 57 57 TYR CB C 57 38.453 38.453 36.833 1.620 19845 4522 1 14 . 1 1 57 57 TYR H H 57 7.964 7.964 8.021 -0.057 19845 4523 1 14 . 1 1 58 58 VAL N N 58 119.069 119.069 119.045 0.024 19845 4524 1 14 . 1 1 58 58 VAL HA H 58 3.529 3.529 3.231 0.298 19845 4525 1 14 . 1 1 58 58 VAL C C 58 174.250 174.250 177.409 -3.159 19845 4526 1 14 . 1 1 58 58 VAL CA C 58 66.223 66.223 65.412 0.812 19845 4527 1 14 . 1 1 58 58 VAL CB C 58 31.803 31.803 30.601 1.202 19845 4528 1 14 . 1 1 58 58 VAL H H 58 8.018 8.018 7.288 0.730 19845 4529 1 14 . 1 1 59 59 TYR N N 59 120.360 120.360 121.267 -0.907 19845 4530 1 14 . 1 1 59 59 TYR HA H 59 4.115 4.115 3.927 0.188 19845 4531 1 14 . 1 1 59 59 TYR C C 59 173.899 173.899 177.971 -4.072 19845 4532 1 14 . 1 1 59 59 TYR CA C 59 60.929 60.929 62.176 -1.247 19845 4533 1 14 . 1 1 59 59 TYR CB C 59 38.602 38.602 38.023 0.579 19845 4534 1 14 . 1 1 59 59 TYR H H 59 8.142 8.142 7.938 0.204 19845 4535 1 14 . 1 1 60 60 SER N N 60 113.480 113.480 113.200 0.280 19845 4536 1 14 . 1 1 60 60 SER HA H 60 3.979 3.979 4.183 -0.204 19845 4537 1 14 . 1 1 60 60 SER C C 60 172.887 172.887 176.848 -3.961 19845 4538 1 14 . 1 1 60 60 SER CA C 60 60.987 60.987 61.488 -0.501 19845 4539 1 14 . 1 1 60 60 SER CB C 60 63.267 63.267 62.973 0.294 19845 4540 1 14 . 1 1 60 60 SER H H 60 8.057 8.057 7.742 0.315 19845 4541 1 14 . 1 1 61 61 ARG N N 61 120.962 120.962 121.892 -0.930 19845 4542 1 14 . 1 1 61 61 ARG HA H 61 4.103 4.103 4.196 -0.093 19845 4543 1 14 . 1 1 61 61 ARG C C 61 175.399 175.399 178.718 -3.319 19845 4544 1 14 . 1 1 61 61 ARG CA C 61 57.427 57.427 58.959 -1.532 19845 4545 1 14 . 1 1 61 61 ARG CB C 61 30.008 30.008 29.820 0.188 19845 4546 1 14 . 1 1 61 61 ARG H H 61 7.606 7.606 7.402 0.204 19845 4547 1 14 . 1 1 62 62 VAL N N 62 117.852 117.852 118.745 -0.893 19845 4548 1 14 . 1 1 62 62 VAL HA H 62 3.805 3.805 3.744 0.061 19845 4549 1 14 . 1 1 62 62 VAL C C 62 174.155 174.155 176.880 -2.725 19845 4550 1 14 . 1 1 62 62 VAL CA C 62 64.458 64.458 65.484 -1.026 19845 4551 1 14 . 1 1 62 62 VAL CB C 62 31.969 31.969 31.384 0.585 19845 4552 1 14 . 1 1 62 62 VAL H H 62 7.848 7.848 8.161 -0.313 19845 4553 1 14 . 1 1 63 63 LYS N N 63 119.254 119.254 119.453 -0.199 19845 4554 1 14 . 1 1 63 63 LYS HA H 63 4.051 4.051 4.118 -0.067 19845 4555 1 14 . 1 1 63 63 LYS C C 63 173.615 173.615 178.039 -4.424 19845 4556 1 14 . 1 1 63 63 LYS CA C 63 56.727 56.727 57.849 -1.122 19845 4557 1 14 . 1 1 63 63 LYS CB C 63 32.105 32.105 33.189 -1.084 19845 4558 1 14 . 1 1 63 63 LYS H H 63 7.759 7.759 7.644 0.115 19845 4559 1 14 . 1 1 64 64 ASN N N 64 117.696 117.696 117.387 0.309 19845 4560 1 14 . 1 1 64 64 ASN HA H 64 4.642 4.642 4.443 0.199 19845 4561 1 14 . 1 1 64 64 ASN C C 64 171.750 171.750 176.264 -4.514 19845 4562 1 14 . 1 1 64 64 ASN CA C 64 53.313 53.313 55.026 -1.713 19845 4563 1 14 . 1 1 64 64 ASN CB C 64 39.260 39.260 38.784 0.476 19845 4564 1 14 . 1 1 64 64 ASN H H 64 7.615 7.615 8.170 -0.555 19845 4565 1 15 . 1 1 9 9 THR N N 9 113.692 113.692 115.737 -2.045 19845 4566 1 15 . 1 1 9 9 THR HA H 9 4.213 4.213 4.136 0.077 19845 4567 1 15 . 1 1 9 9 THR C C 9 172.757 172.757 174.337 -1.580 19845 4568 1 15 . 1 1 9 9 THR CA C 9 62.810 62.810 63.041 -0.231 19845 4569 1 15 . 1 1 9 9 THR CB C 9 69.878 69.878 68.488 1.390 19845 4570 1 15 . 1 1 9 9 THR H H 9 7.930 7.930 8.107 -0.177 19845 4571 1 15 . 1 1 10 10 GLY N N 10 110.842 110.842 107.761 3.081 19845 4572 1 15 . 1 1 10 10 GLY C C 10 171.923 171.923 173.602 -1.679 19845 4573 1 15 . 1 1 10 10 GLY CA C 10 46.099 46.099 44.552 1.547 19845 4574 1 15 . 1 1 10 10 GLY H H 10 8.266 8.266 7.965 0.300 19845 4575 1 15 . 1 1 11 11 THR N N 11 113.754 113.754 116.713 -2.959 19845 4576 1 15 . 1 1 11 11 THR HA H 11 4.220 4.220 4.401 -0.181 19845 4577 1 15 . 1 1 11 11 THR C C 11 171.906 171.906 174.824 -2.918 19845 4578 1 15 . 1 1 11 11 THR CA C 11 62.721 62.721 62.685 0.036 19845 4579 1 15 . 1 1 11 11 THR CB C 11 69.549 69.549 68.996 0.553 19845 4580 1 15 . 1 1 11 11 THR H H 11 7.753 7.753 8.052 -0.299 19845 4581 1 15 . 1 1 12 12 LEU N N 12 123.669 123.669 124.270 -0.601 19845 4582 1 15 . 1 1 12 12 LEU HA H 12 4.240 4.240 4.811 -0.571 19845 4583 1 15 . 1 1 12 12 LEU C C 12 175.221 175.221 177.251 -2.030 19845 4584 1 15 . 1 1 12 12 LEU CA C 12 56.799 56.799 55.617 1.182 19845 4585 1 15 . 1 1 12 12 LEU CB C 12 42.536 42.536 42.276 0.260 19845 4586 1 15 . 1 1 12 12 LEU H H 12 7.980 7.980 8.430 -0.450 19845 4587 1 15 . 1 1 13 13 ILE N N 13 120.086 120.086 121.102 -1.016 19845 4588 1 15 . 1 1 13 13 ILE HA H 13 3.913 3.913 4.163 -0.250 19845 4589 1 15 . 1 1 13 13 ILE C C 13 173.425 173.425 177.115 -3.690 19845 4590 1 15 . 1 1 13 13 ILE CA C 13 62.889 62.889 63.919 -1.030 19845 4591 1 15 . 1 1 13 13 ILE CB C 13 38.249 38.249 37.977 0.272 19845 4592 1 15 . 1 1 13 13 ILE H H 13 7.861 7.861 7.748 0.113 19845 4593 1 15 . 1 1 14 14 VAL N N 14 119.785 119.785 117.086 2.699 19845 4594 1 15 . 1 1 14 14 VAL HA H 14 3.790 3.790 3.857 -0.067 19845 4595 1 15 . 1 1 14 14 VAL C C 14 173.429 173.429 177.624 -4.195 19845 4596 1 15 . 1 1 14 14 VAL CA C 14 64.409 64.409 65.786 -1.377 19845 4597 1 15 . 1 1 14 14 VAL CB C 14 32.007 32.007 30.558 1.449 19845 4598 1 15 . 1 1 14 14 VAL H H 14 7.549 7.549 8.129 -0.580 19845 4599 1 15 . 1 1 15 15 ASN N N 15 119.567 119.567 117.308 2.259 19845 4600 1 15 . 1 1 15 15 ASN HA H 15 4.549 4.549 4.664 -0.115 19845 4601 1 15 . 1 1 15 15 ASN C C 15 173.619 173.619 177.261 -3.642 19845 4602 1 15 . 1 1 15 15 ASN CA C 15 54.805 54.805 55.726 -0.921 19845 4603 1 15 . 1 1 15 15 ASN CB C 15 38.824 38.824 38.321 0.503 19845 4604 1 15 . 1 1 15 15 ASN H H 15 8.010 8.010 8.448 -0.438 19845 4605 1 15 . 1 1 16 16 SER N N 16 116.730 116.730 116.893 -0.163 19845 4606 1 15 . 1 1 16 16 SER HA H 16 4.177 4.177 4.442 -0.265 19845 4607 1 15 . 1 1 16 16 SER CA C 16 61.705 61.705 60.947 0.758 19845 4608 1 15 . 1 1 16 16 SER CB C 16 63.752 63.752 63.368 0.384 19845 4609 1 15 . 1 1 16 16 SER H H 16 8.039 8.039 7.425 0.614 19845 4610 1 15 . 1 1 17 17 VAL N N 17 122.062 122.062 122.642 -0.580 19845 4611 1 15 . 1 1 17 17 VAL HA H 17 3.677 3.677 3.950 -0.273 19845 4612 1 15 . 1 1 17 17 VAL C C 17 174.474 174.474 177.331 -2.857 19845 4613 1 15 . 1 1 17 17 VAL CA C 17 66.671 66.671 65.411 1.260 19845 4614 1 15 . 1 1 17 17 VAL CB C 17 31.531 31.531 31.413 0.118 19845 4615 1 15 . 1 1 17 17 VAL H H 17 7.896 7.896 8.442 -0.546 19845 4616 1 15 . 1 1 18 18 LEU N N 18 119.103 119.103 119.593 -0.490 19845 4617 1 15 . 1 1 18 18 LEU HA H 18 3.998 3.998 4.242 -0.244 19845 4618 1 15 . 1 1 18 18 LEU C C 18 175.511 175.511 178.612 -3.101 19845 4619 1 15 . 1 1 18 18 LEU CA C 18 58.107 58.107 57.901 0.205 19845 4620 1 15 . 1 1 18 18 LEU CB C 18 41.593 41.593 40.970 0.623 19845 4621 1 15 . 1 1 18 18 LEU H H 18 7.857 7.857 7.468 0.389 19845 4622 1 15 . 1 1 19 19 LEU N N 19 118.291 118.291 120.915 -2.624 19845 4623 1 15 . 1 1 19 19 LEU HA H 19 4.152 4.152 4.137 0.015 19845 4624 1 15 . 1 1 19 19 LEU C C 19 175.156 175.156 178.793 -3.637 19845 4625 1 15 . 1 1 19 19 LEU CA C 19 58.011 58.011 57.765 0.246 19845 4626 1 15 . 1 1 19 19 LEU CB C 19 42.027 42.027 41.853 0.174 19845 4627 1 15 . 1 1 19 19 LEU H H 19 7.745 7.745 7.501 0.244 19845 4628 1 15 . 1 1 20 20 PHE N N 20 118.415 118.415 119.354 -0.939 19845 4629 1 15 . 1 1 20 20 PHE HA H 20 4.188 4.188 4.109 0.079 19845 4630 1 15 . 1 1 20 20 PHE C C 20 174.260 174.260 177.513 -3.253 19845 4631 1 15 . 1 1 20 20 PHE CA C 20 61.626 61.626 62.231 -0.605 19845 4632 1 15 . 1 1 20 20 PHE CB C 20 38.643 38.643 38.827 -0.184 19845 4633 1 15 . 1 1 20 20 PHE H H 20 8.002 8.002 8.742 -0.740 19845 4634 1 15 . 1 1 21 21 LEU N N 21 118.571 118.571 119.707 -1.136 19845 4635 1 15 . 1 1 21 21 LEU HA H 21 3.797 3.797 4.091 -0.294 19845 4636 1 15 . 1 1 21 21 LEU C C 21 175.324 175.324 179.019 -3.695 19845 4637 1 15 . 1 1 21 21 LEU CA C 21 58.128 58.128 58.318 -0.190 19845 4638 1 15 . 1 1 21 21 LEU CB C 21 41.957 41.957 41.009 0.948 19845 4639 1 15 . 1 1 21 21 LEU H H 21 8.456 8.456 7.710 0.746 19845 4640 1 15 . 1 1 22 22 ALA N N 22 120.775 120.775 121.056 -0.281 19845 4641 1 15 . 1 1 22 22 ALA HA H 22 3.779 3.779 4.197 -0.418 19845 4642 1 15 . 1 1 22 22 ALA C C 22 175.697 175.697 180.216 -4.519 19845 4643 1 15 . 1 1 22 22 ALA CA C 22 55.721 55.721 54.726 0.995 19845 4644 1 15 . 1 1 22 22 ALA CB C 22 17.788 17.788 18.253 -0.466 19845 4645 1 15 . 1 1 22 22 ALA H H 22 8.353 8.353 7.589 0.764 19845 4646 1 15 . 1 1 23 23 PHE N N 23 117.860 117.860 120.067 -2.207 19845 4647 1 15 . 1 1 23 23 PHE HA H 23 4.108 4.108 4.186 -0.078 19845 4648 1 15 . 1 1 23 23 PHE C C 23 173.859 173.859 177.131 -3.272 19845 4649 1 15 . 1 1 23 23 PHE CA C 23 61.271 61.271 61.788 -0.517 19845 4650 1 15 . 1 1 23 23 PHE CB C 23 38.853 38.853 39.685 -0.832 19845 4651 1 15 . 1 1 23 23 PHE H H 23 8.121 8.121 8.156 -0.035 19845 4652 1 15 . 1 1 24 24 VAL N N 24 119.181 119.181 119.229 -0.048 19845 4653 1 15 . 1 1 24 24 VAL HA H 24 3.134 3.134 3.623 -0.489 19845 4654 1 15 . 1 1 24 24 VAL C C 24 174.684 174.684 178.091 -3.407 19845 4655 1 15 . 1 1 24 24 VAL CA C 24 67.419 67.419 67.356 0.063 19845 4656 1 15 . 1 1 24 24 VAL CB C 24 31.106 31.106 31.307 -0.201 19845 4657 1 15 . 1 1 24 24 VAL H H 24 8.124 8.124 8.553 -0.429 19845 4658 1 15 . 1 1 25 25 VAL N N 25 119.215 119.215 116.947 2.268 19845 4659 1 15 . 1 1 25 25 VAL HA H 25 3.324 3.324 3.660 -0.336 19845 4660 1 15 . 1 1 25 25 VAL C C 25 174.244 174.244 177.572 -3.328 19845 4661 1 15 . 1 1 25 25 VAL CA C 25 67.740 67.740 66.576 1.164 19845 4662 1 15 . 1 1 25 25 VAL CB C 25 31.270 31.270 31.126 0.144 19845 4663 1 15 . 1 1 25 25 VAL H H 25 8.250 8.250 7.678 0.572 19845 4664 1 15 . 1 1 26 26 PHE N N 26 119.875 119.875 118.916 0.959 19845 4665 1 15 . 1 1 26 26 PHE HA H 26 3.900 3.900 4.133 -0.233 19845 4666 1 15 . 1 1 26 26 PHE C C 26 175.371 175.371 177.543 -2.172 19845 4667 1 15 . 1 1 26 26 PHE CA C 26 61.651 61.651 62.300 -0.649 19845 4668 1 15 . 1 1 26 26 PHE CB C 26 38.760 38.760 39.021 -0.261 19845 4669 1 15 . 1 1 26 26 PHE H H 26 8.413 8.413 7.392 1.021 19845 4670 1 15 . 1 1 27 27 LEU N N 27 122.548 122.548 119.345 3.203 19845 4671 1 15 . 1 1 27 27 LEU HA H 27 3.533 3.533 3.920 -0.387 19845 4672 1 15 . 1 1 27 27 LEU C C 27 175.256 175.256 179.122 -3.866 19845 4673 1 15 . 1 1 27 27 LEU CA C 27 58.211 58.211 57.793 0.418 19845 4674 1 15 . 1 1 27 27 LEU CB C 27 41.564 41.564 41.400 0.164 19845 4675 1 15 . 1 1 27 27 LEU H H 27 8.453 8.453 8.232 0.221 19845 4676 1 15 . 1 1 28 28 LEU N N 28 119.385 119.385 119.785 -0.400 19845 4677 1 15 . 1 1 28 28 LEU HA H 28 3.799 3.799 3.903 -0.104 19845 4678 1 15 . 1 1 28 28 LEU C C 28 175.881 175.881 179.347 -3.466 19845 4679 1 15 . 1 1 28 28 LEU CA C 28 58.492 58.492 58.043 0.449 19845 4680 1 15 . 1 1 28 28 LEU CB C 28 41.760 41.760 41.468 0.292 19845 4681 1 15 . 1 1 28 28 LEU H H 28 8.248 8.248 8.409 -0.161 19845 4682 1 15 . 1 1 29 29 VAL N N 29 118.515 118.515 117.467 1.048 19845 4683 1 15 . 1 1 29 29 VAL HA H 29 3.319 3.319 3.751 -0.432 19845 4684 1 15 . 1 1 29 29 VAL C C 29 174.734 174.734 177.381 -2.647 19845 4685 1 15 . 1 1 29 29 VAL CA C 29 67.192 67.192 65.459 1.734 19845 4686 1 15 . 1 1 29 29 VAL CB C 29 31.175 31.175 32.181 -1.006 19845 4687 1 15 . 1 1 29 29 VAL H H 29 8.446 8.446 7.328 1.118 19845 4688 1 15 . 1 1 30 30 THR N N 30 117.313 117.313 117.170 0.143 19845 4689 1 15 . 1 1 30 30 THR HA H 30 3.432 3.432 3.835 -0.403 19845 4690 1 15 . 1 1 30 30 THR CA C 30 68.606 68.606 66.832 1.774 19845 4691 1 15 . 1 1 30 30 THR CB C 30 67.147 67.147 68.624 -1.476 19845 4692 1 15 . 1 1 30 30 THR H H 30 7.923 7.923 8.056 -0.133 19845 4693 1 15 . 1 1 31 31 LEU N N 31 120.629 120.629 120.950 -0.321 19845 4694 1 15 . 1 1 31 31 LEU HA H 31 3.858 3.858 3.926 -0.068 19845 4695 1 15 . 1 1 31 31 LEU C C 31 177.164 177.164 178.527 -1.363 19845 4696 1 15 . 1 1 31 31 LEU CA C 31 58.145 58.145 57.673 0.472 19845 4697 1 15 . 1 1 31 31 LEU CB C 31 41.615 41.615 41.724 -0.108 19845 4698 1 15 . 1 1 31 31 LEU H H 31 8.382 8.382 8.017 0.365 19845 4699 1 15 . 1 1 32 32 ALA N N 32 125.216 125.216 121.604 3.612 19845 4700 1 15 . 1 1 32 32 ALA HA H 32 3.836 3.836 3.913 -0.077 19845 4701 1 15 . 1 1 32 32 ALA C C 32 175.968 175.968 180.498 -4.530 19845 4702 1 15 . 1 1 32 32 ALA CA C 32 55.918 55.918 54.806 1.111 19845 4703 1 15 . 1 1 32 32 ALA CB C 32 17.802 17.802 18.127 -0.325 19845 4704 1 15 . 1 1 32 32 ALA H H 32 8.517 8.517 7.684 0.833 19845 4705 1 15 . 1 1 33 33 ILE N N 33 118.722 118.722 118.917 -0.195 19845 4706 1 15 . 1 1 33 33 ILE HA H 33 3.481 3.481 3.546 -0.065 19845 4707 1 15 . 1 1 33 33 ILE C C 33 175.004 175.004 178.037 -3.033 19845 4708 1 15 . 1 1 33 33 ILE CA C 33 65.554 65.554 65.056 0.498 19845 4709 1 15 . 1 1 33 33 ILE CB C 33 37.657 37.657 37.389 0.269 19845 4710 1 15 . 1 1 33 33 ILE H H 33 8.288 8.288 7.517 0.771 19845 4711 1 15 . 1 1 34 34 LEU N N 34 118.987 118.987 119.679 -0.692 19845 4712 1 15 . 1 1 34 34 LEU HA H 34 3.893 3.893 3.920 -0.027 19845 4713 1 15 . 1 1 34 34 LEU C C 34 176.439 176.439 178.543 -2.104 19845 4714 1 15 . 1 1 34 34 LEU CA C 34 58.436 58.436 57.858 0.578 19845 4715 1 15 . 1 1 34 34 LEU CB C 34 42.152 42.152 41.553 0.599 19845 4716 1 15 . 1 1 34 34 LEU H H 34 8.493 8.493 8.089 0.404 19845 4717 1 15 . 1 1 35 35 THR N N 35 116.630 116.630 114.863 1.767 19845 4718 1 15 . 1 1 35 35 THR HA H 35 3.652 3.652 3.896 -0.244 19845 4719 1 15 . 1 1 35 35 THR C C 35 173.366 173.366 176.031 -2.665 19845 4720 1 15 . 1 1 35 35 THR CA C 35 68.153 68.153 66.751 1.402 19845 4721 1 15 . 1 1 35 35 THR CB C 35 68.162 68.162 68.528 -0.366 19845 4722 1 15 . 1 1 35 35 THR H H 35 8.215 8.215 8.149 0.066 19845 4723 1 15 . 1 1 36 36 ALA N N 36 124.667 124.667 123.409 1.258 19845 4724 1 15 . 1 1 36 36 ALA HA H 36 3.864 3.864 3.936 -0.072 19845 4725 1 15 . 1 1 36 36 ALA C C 36 176.510 176.510 179.455 -2.945 19845 4726 1 15 . 1 1 36 36 ALA CA C 36 55.758 55.758 55.125 0.633 19845 4727 1 15 . 1 1 36 36 ALA CB C 36 18.054 18.054 18.146 -0.092 19845 4728 1 15 . 1 1 36 36 ALA H H 36 8.358 8.358 8.071 0.287 19845 4729 1 15 . 1 1 37 37 LEU N N 37 116.565 116.565 117.861 -1.296 19845 4730 1 15 . 1 1 37 37 LEU HA H 37 3.973 3.973 4.117 -0.144 19845 4731 1 15 . 1 1 37 37 LEU C C 37 176.538 176.538 179.166 -2.628 19845 4732 1 15 . 1 1 37 37 LEU CA C 37 57.853 57.853 57.226 0.627 19845 4733 1 15 . 1 1 37 37 LEU CB C 37 42.018 42.018 40.584 1.434 19845 4734 1 15 . 1 1 37 37 LEU H H 37 8.360 8.360 7.567 0.793 19845 4735 1 15 . 1 1 38 38 ARG N N 38 119.392 119.392 119.939 -0.547 19845 4736 1 15 . 1 1 38 38 ARG HA H 38 4.104 4.104 4.061 0.043 19845 4737 1 15 . 1 1 38 38 ARG C C 38 176.208 176.208 179.277 -3.069 19845 4738 1 15 . 1 1 38 38 ARG CA C 38 58.100 58.100 58.916 -0.816 19845 4739 1 15 . 1 1 38 38 ARG CB C 38 29.502 29.502 29.572 -0.070 19845 4740 1 15 . 1 1 38 38 ARG H H 38 8.082 8.082 7.402 0.680 19845 4741 1 15 . 1 1 39 39 LEU N N 39 120.438 120.438 118.384 2.054 19845 4742 1 15 . 1 1 39 39 LEU HA H 39 4.243 4.243 3.951 0.292 19845 4743 1 15 . 1 1 39 39 LEU C C 39 175.702 175.702 178.699 -2.997 19845 4744 1 15 . 1 1 39 39 LEU CA C 39 56.979 56.979 58.308 -1.329 19845 4745 1 15 . 1 1 39 39 LEU CB C 39 41.893 41.893 41.501 0.392 19845 4746 1 15 . 1 1 39 39 LEU H H 39 8.446 8.446 7.774 0.672 19845 4747 1 15 . 1 1 40 40 ALA N N 40 122.512 122.512 120.565 1.947 19845 4748 1 15 . 1 1 40 40 ALA HA H 40 3.975 3.975 4.062 -0.087 19845 4749 1 15 . 1 1 40 40 ALA C C 40 175.838 175.838 178.617 -2.779 19845 4750 1 15 . 1 1 40 40 ALA CA C 40 54.710 54.710 54.566 0.145 19845 4751 1 15 . 1 1 40 40 ALA CB C 40 18.319 18.319 17.932 0.387 19845 4752 1 15 . 1 1 40 40 ALA H H 40 8.321 8.321 7.375 0.946 19845 4753 1 15 . 1 1 41 41 ALA N N 41 119.754 119.754 120.399 -0.645 19845 4754 1 15 . 1 1 41 41 ALA HA H 41 4.024 4.024 4.192 -0.168 19845 4755 1 15 . 1 1 41 41 ALA C C 41 176.517 176.517 179.900 -3.383 19845 4756 1 15 . 1 1 41 41 ALA CA C 41 54.486 54.486 54.680 -0.194 19845 4757 1 15 . 1 1 41 41 ALA CB C 41 18.468 18.468 18.729 -0.261 19845 4758 1 15 . 1 1 41 41 ALA H H 41 8.038 8.038 8.054 -0.016 19845 4759 1 15 . 1 1 42 42 TYR N N 42 118.272 118.272 118.741 -0.469 19845 4760 1 15 . 1 1 42 42 TYR HA H 42 4.326 4.326 4.234 0.092 19845 4761 1 15 . 1 1 42 42 TYR C C 42 174.633 174.633 177.789 -3.156 19845 4762 1 15 . 1 1 42 42 TYR CA C 42 60.098 60.098 60.011 0.087 19845 4763 1 15 . 1 1 42 42 TYR CB C 42 38.936 38.936 37.423 1.513 19845 4764 1 15 . 1 1 42 42 TYR H H 42 7.814 7.814 8.011 -0.197 19845 4765 1 15 . 1 1 43 43 ALA N N 43 122.908 122.908 121.620 1.288 19845 4766 1 15 . 1 1 43 43 ALA HA H 43 4.111 4.111 4.237 -0.126 19845 4767 1 15 . 1 1 43 43 ALA C C 43 175.241 175.241 178.294 -3.053 19845 4768 1 15 . 1 1 43 43 ALA CA C 43 53.842 53.842 54.178 -0.336 19845 4769 1 15 . 1 1 43 43 ALA CB C 43 18.427 18.427 17.617 0.809 19845 4770 1 15 . 1 1 43 43 ALA H H 43 8.172 8.172 7.558 0.614 19845 4771 1 15 . 1 1 44 44 ALA N N 44 119.906 119.906 119.212 0.694 19845 4772 1 15 . 1 1 44 44 ALA HA H 44 4.051 4.051 4.277 -0.226 19845 4773 1 15 . 1 1 44 44 ALA C C 44 175.092 175.092 178.105 -3.013 19845 4774 1 15 . 1 1 44 44 ALA CA C 44 53.611 53.611 53.370 0.241 19845 4775 1 15 . 1 1 44 44 ALA CB C 44 18.689 18.689 19.190 -0.501 19845 4776 1 15 . 1 1 44 44 ALA H H 44 7.953 7.953 7.683 0.270 19845 4777 1 15 . 1 1 45 45 ASN N N 45 114.984 114.984 117.186 -2.202 19845 4778 1 15 . 1 1 45 45 ASN HA H 45 4.541 4.541 4.763 -0.222 19845 4779 1 15 . 1 1 45 45 ASN CA C 45 54.506 54.506 54.668 -0.162 19845 4780 1 15 . 1 1 45 45 ASN CB C 45 38.602 38.602 40.276 -1.673 19845 4781 1 15 . 1 1 45 45 ASN H H 45 7.847 7.847 8.161 -0.314 19845 4782 1 15 . 1 1 46 46 ILE N N 46 119.155 119.155 117.152 2.003 19845 4783 1 15 . 1 1 46 46 ILE HA H 46 4.033 4.033 4.357 -0.324 19845 4784 1 15 . 1 1 46 46 ILE C C 46 173.344 173.344 175.401 -2.057 19845 4785 1 15 . 1 1 46 46 ILE CA C 46 62.357 62.357 62.201 0.156 19845 4786 1 15 . 1 1 46 46 ILE CB C 46 38.657 38.657 38.439 0.218 19845 4787 1 15 . 1 1 46 46 ILE H H 46 7.790 7.790 7.953 -0.163 19845 4788 1 15 . 1 1 47 47 VAL N N 47 117.526 117.526 115.898 1.628 19845 4789 1 15 . 1 1 47 47 VAL HA H 47 4.133 4.133 4.520 -0.387 19845 4790 1 15 . 1 1 47 47 VAL C C 47 172.672 172.672 174.992 -2.320 19845 4791 1 15 . 1 1 47 47 VAL CA C 47 62.149 62.149 59.647 2.502 19845 4792 1 15 . 1 1 47 47 VAL CB C 47 32.807 32.807 34.272 -1.465 19845 4793 1 15 . 1 1 47 47 VAL H H 47 7.582 7.582 7.432 0.150 19845 4794 1 15 . 1 1 48 48 ASN N N 48 120.091 120.091 118.563 1.528 19845 4795 1 15 . 1 1 48 48 ASN HA H 48 4.658 4.658 4.879 -0.221 19845 4796 1 15 . 1 1 48 48 ASN CA C 48 53.478 53.478 53.001 0.477 19845 4797 1 15 . 1 1 48 48 ASN CB C 48 38.573 38.573 36.904 1.669 19845 4798 1 15 . 1 1 48 48 ASN H H 48 8.053 8.053 8.619 -0.566 19845 4799 1 15 . 1 1 49 49 VAL N N 49 118.854 118.854 119.838 -0.984 19845 4800 1 15 . 1 1 49 49 VAL HA H 49 4.133 4.133 4.156 -0.023 19845 4801 1 15 . 1 1 49 49 VAL C C 49 172.595 172.595 174.361 -1.766 19845 4802 1 15 . 1 1 49 49 VAL CA C 49 62.049 62.049 61.750 0.299 19845 4803 1 15 . 1 1 49 49 VAL CB C 49 33.271 33.271 33.729 -0.458 19845 4804 1 15 . 1 1 49 49 VAL H H 49 7.685 7.685 7.496 0.189 19845 4805 1 15 . 1 1 50 50 SER N N 50 118.689 118.689 120.564 -1.875 19845 4806 1 15 . 1 1 50 50 SER HA H 50 4.466 4.466 4.140 0.326 19845 4807 1 15 . 1 1 50 50 SER C C 50 171.430 171.430 172.506 -1.076 19845 4808 1 15 . 1 1 50 50 SER CA C 50 58.128 58.128 57.641 0.487 19845 4809 1 15 . 1 1 50 50 SER CB C 50 63.916 63.916 64.028 -0.112 19845 4810 1 15 . 1 1 50 50 SER H H 50 8.075 8.075 8.049 0.026 19845 4811 1 15 . 1 1 51 51 LEU N N 51 123.536 123.536 120.272 3.264 19845 4812 1 15 . 1 1 51 51 LEU HA H 51 4.305 4.305 4.766 -0.461 19845 4813 1 15 . 1 1 51 51 LEU C C 51 174.110 174.110 175.106 -0.996 19845 4814 1 15 . 1 1 51 51 LEU CA C 51 55.145 55.145 54.157 0.987 19845 4815 1 15 . 1 1 51 51 LEU CB C 51 42.674 42.674 44.479 -1.805 19845 4816 1 15 . 1 1 51 51 LEU H H 51 7.991 7.991 8.189 -0.198 19845 4817 1 15 . 1 1 52 52 VAL N N 52 119.649 119.649 119.142 0.507 19845 4818 1 15 . 1 1 52 52 VAL HA H 52 3.992 3.992 4.392 -0.400 19845 4819 1 15 . 1 1 52 52 VAL C C 52 172.476 172.476 176.493 -4.017 19845 4820 1 15 . 1 1 52 52 VAL CA C 52 62.772 62.772 62.975 -0.203 19845 4821 1 15 . 1 1 52 52 VAL CB C 52 33.066 33.066 32.683 0.383 19845 4822 1 15 . 1 1 52 52 VAL H H 52 7.536 7.536 8.075 -0.539 19845 4823 1 15 . 1 1 53 53 LYS N N 53 122.004 122.004 122.452 -0.448 19845 4824 1 15 . 1 1 53 53 LYS HA H 53 4.354 4.354 4.229 0.125 19845 4825 1 15 . 1 1 53 53 LYS CA C 53 56.567 56.567 60.184 -3.617 19845 4826 1 15 . 1 1 53 53 LYS CB C 53 31.689 31.689 29.964 1.725 19845 4827 1 15 . 1 1 53 53 LYS H H 53 8.038 8.038 8.516 -0.478 19845 4828 1 15 . 1 1 54 54 PRO HA H 54 4.353 4.353 4.505 -0.152 19845 4829 1 15 . 1 1 54 54 PRO CA C 54 65.103 65.103 64.919 0.184 19845 4830 1 15 . 1 1 54 54 PRO CB C 54 32.193 32.193 30.914 1.279 19845 4831 1 15 . 1 1 55 55 THR N N 55 111.485 111.485 110.801 0.684 19845 4832 1 15 . 1 1 55 55 THR HA H 55 3.910 3.910 4.710 -0.800 19845 4833 1 15 . 1 1 55 55 THR C C 55 172.822 172.822 176.368 -3.546 19845 4834 1 15 . 1 1 55 55 THR CA C 55 65.030 65.030 63.256 1.774 19845 4835 1 15 . 1 1 55 55 THR CB C 55 68.882 68.882 68.894 -0.012 19845 4836 1 15 . 1 1 55 55 THR H H 55 7.722 7.722 7.433 0.289 19845 4837 1 15 . 1 1 56 56 VAL N N 56 121.165 121.165 120.442 0.723 19845 4838 1 15 . 1 1 56 56 VAL HA H 56 3.772 3.772 3.794 -0.022 19845 4839 1 15 . 1 1 56 56 VAL C C 56 174.904 174.904 176.828 -1.924 19845 4840 1 15 . 1 1 56 56 VAL CA C 56 64.971 64.971 66.044 -1.073 19845 4841 1 15 . 1 1 56 56 VAL CB C 56 31.989 31.989 31.321 0.668 19845 4842 1 15 . 1 1 56 56 VAL H H 56 7.597 7.597 7.624 -0.027 19845 4843 1 15 . 1 1 57 57 TYR N N 57 122.177 122.177 117.131 5.046 19845 4844 1 15 . 1 1 57 57 TYR HA H 57 4.227 4.227 4.268 -0.041 19845 4845 1 15 . 1 1 57 57 TYR C C 57 174.969 174.969 177.118 -2.149 19845 4846 1 15 . 1 1 57 57 TYR CA C 57 60.755 60.755 59.127 1.628 19845 4847 1 15 . 1 1 57 57 TYR CB C 57 38.453 38.453 36.987 1.466 19845 4848 1 15 . 1 1 57 57 TYR H H 57 7.964 7.964 7.924 0.040 19845 4849 1 15 . 1 1 58 58 VAL N N 58 119.069 119.069 119.334 -0.265 19845 4850 1 15 . 1 1 58 58 VAL HA H 58 3.529 3.529 3.329 0.200 19845 4851 1 15 . 1 1 58 58 VAL C C 58 174.250 174.250 177.384 -3.134 19845 4852 1 15 . 1 1 58 58 VAL CA C 58 66.223 66.223 64.867 1.356 19845 4853 1 15 . 1 1 58 58 VAL CB C 58 31.803 31.803 30.930 0.873 19845 4854 1 15 . 1 1 58 58 VAL H H 58 8.018 8.018 7.251 0.767 19845 4855 1 15 . 1 1 59 59 TYR N N 59 120.360 120.360 121.445 -1.085 19845 4856 1 15 . 1 1 59 59 TYR HA H 59 4.115 4.115 4.046 0.069 19845 4857 1 15 . 1 1 59 59 TYR C C 59 173.899 173.899 177.472 -3.573 19845 4858 1 15 . 1 1 59 59 TYR CA C 59 60.929 60.929 61.114 -0.185 19845 4859 1 15 . 1 1 59 59 TYR CB C 59 38.602 38.602 37.779 0.823 19845 4860 1 15 . 1 1 59 59 TYR H H 59 8.142 8.142 7.709 0.433 19845 4861 1 15 . 1 1 60 60 SER N N 60 113.480 113.480 113.701 -0.221 19845 4862 1 15 . 1 1 60 60 SER HA H 60 3.979 3.979 4.058 -0.079 19845 4863 1 15 . 1 1 60 60 SER C C 60 172.887 172.887 176.180 -3.293 19845 4864 1 15 . 1 1 60 60 SER CA C 60 60.987 60.987 60.875 0.112 19845 4865 1 15 . 1 1 60 60 SER CB C 60 63.267 63.267 63.359 -0.093 19845 4866 1 15 . 1 1 60 60 SER H H 60 8.057 8.057 7.724 0.333 19845 4867 1 15 . 1 1 61 61 ARG N N 61 120.962 120.962 122.949 -1.987 19845 4868 1 15 . 1 1 61 61 ARG HA H 61 4.103 4.103 4.121 -0.018 19845 4869 1 15 . 1 1 61 61 ARG C C 61 175.399 175.399 177.898 -2.499 19845 4870 1 15 . 1 1 61 61 ARG CA C 61 57.427 57.427 58.447 -1.020 19845 4871 1 15 . 1 1 61 61 ARG CB C 61 30.008 30.008 29.637 0.371 19845 4872 1 15 . 1 1 61 61 ARG H H 61 7.606 7.606 7.373 0.233 19845 4873 1 15 . 1 1 62 62 VAL N N 62 117.852 117.852 113.830 4.022 19845 4874 1 15 . 1 1 62 62 VAL HA H 62 3.805 3.805 4.203 -0.398 19845 4875 1 15 . 1 1 62 62 VAL C C 62 174.155 174.155 176.978 -2.823 19845 4876 1 15 . 1 1 62 62 VAL CA C 62 64.458 64.458 63.386 1.071 19845 4877 1 15 . 1 1 62 62 VAL CB C 62 31.969 31.969 31.796 0.173 19845 4878 1 15 . 1 1 62 62 VAL H H 62 7.848 7.848 8.029 -0.181 19845 4879 1 15 . 1 1 63 63 LYS N N 63 119.254 119.254 121.291 -2.037 19845 4880 1 15 . 1 1 63 63 LYS HA H 63 4.051 4.051 4.057 -0.006 19845 4881 1 15 . 1 1 63 63 LYS C C 63 173.615 173.615 178.194 -4.579 19845 4882 1 15 . 1 1 63 63 LYS CA C 63 56.727 56.727 58.334 -1.607 19845 4883 1 15 . 1 1 63 63 LYS CB C 63 32.105 32.105 32.719 -0.614 19845 4884 1 15 . 1 1 63 63 LYS H H 63 7.759 7.759 7.530 0.229 19845 4885 1 15 . 1 1 64 64 ASN N N 64 117.696 117.696 117.007 0.689 19845 4886 1 15 . 1 1 64 64 ASN HA H 64 4.642 4.642 4.482 0.160 19845 4887 1 15 . 1 1 64 64 ASN C C 64 171.750 171.750 176.058 -4.308 19845 4888 1 15 . 1 1 64 64 ASN CA C 64 53.313 53.313 54.061 -0.748 19845 4889 1 15 . 1 1 64 64 ASN CB C 64 39.260 39.260 38.554 0.706 19845 4890 1 15 . 1 1 64 64 ASN H H 64 7.615 7.615 8.077 -0.462 19845 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 55 1.803 -0.231 1.804 19845 2 1 1 "Average Difference" HA 57 0.248 0.121 0.218 19845 3 1 1 "Average Difference" C 50 3.089 2.979 0.824 19845 4 1 1 "Average Difference" CA 56 1.055 -0.237 1.037 19845 5 1 1 "Average Difference" CB 55 0.777 -0.191 0.760 19845 6 1 1 "Average Difference" HN 55 0.506 -0.185 0.476 19845 7 1 2 "Average Difference" N 55 1.817 -0.129 1.830 19845 8 1 2 "Average Difference" HA 57 0.252 0.126 0.220 19845 9 1 2 "Average Difference" C 50 3.135 2.998 0.924 19845 10 1 2 "Average Difference" CA 56 1.117 -0.190 1.110 19845 11 1 2 "Average Difference" CB 55 0.855 -0.260 0.822 19845 12 1 2 "Average Difference" HN 55 0.521 -0.141 0.506 19845 13 1 3 "Average Difference" N 55 1.827 -0.200 1.832 19845 14 1 3 "Average Difference" HA 57 0.252 0.132 0.216 19845 15 1 3 "Average Difference" C 50 3.085 2.962 0.871 19845 16 1 3 "Average Difference" CA 56 1.088 -0.256 1.067 19845 17 1 3 "Average Difference" CB 55 0.826 -0.251 0.794 19845 18 1 3 "Average Difference" HN 55 0.489 -0.171 0.462 19845 19 1 4 "Average Difference" N 55 1.842 0.029 1.859 19845 20 1 4 "Average Difference" HA 57 0.254 0.125 0.223 19845 21 1 4 "Average Difference" C 50 3.147 3.012 0.922 19845 22 1 4 "Average Difference" CA 56 1.145 -0.237 1.130 19845 23 1 4 "Average Difference" CB 55 0.859 -0.223 0.837 19845 24 1 4 "Average Difference" HN 55 0.499 -0.140 0.484 19845 25 1 5 "Average Difference" N 55 1.926 -0.361 1.909 19845 26 1 5 "Average Difference" HA 57 0.262 0.121 0.234 19845 27 1 5 "Average Difference" C 50 3.089 2.956 0.903 19845 28 1 5 "Average Difference" CA 56 1.138 -0.176 1.135 19845 29 1 5 "Average Difference" CB 55 0.879 -0.208 0.862 19845 30 1 5 "Average Difference" HN 55 0.516 -0.161 0.495 19845 31 1 6 "Average Difference" N 55 1.736 -0.088 1.749 19845 32 1 6 "Average Difference" HA 57 0.232 0.102 0.210 19845 33 1 6 "Average Difference" C 50 3.123 2.993 0.900 19845 34 1 6 "Average Difference" CA 56 1.143 -0.182 1.138 19845 35 1 6 "Average Difference" CB 55 0.839 -0.186 0.826 19845 36 1 6 "Average Difference" HN 55 0.514 -0.152 0.496 19845 37 1 7 "Average Difference" N 55 1.765 -0.157 1.774 19845 38 1 7 "Average Difference" HA 57 0.243 0.113 0.216 19845 39 1 7 "Average Difference" C 50 3.115 2.998 0.854 19845 40 1 7 "Average Difference" CA 56 1.097 -0.175 1.092 19845 41 1 7 "Average Difference" CB 55 0.790 -0.115 0.789 19845 42 1 7 "Average Difference" HN 55 0.497 -0.151 0.478 19845 43 1 8 "Average Difference" N 55 1.641 -0.195 1.644 19845 44 1 8 "Average Difference" HA 57 0.249 0.127 0.216 19845 45 1 8 "Average Difference" C 50 3.101 2.992 0.824 19845 46 1 8 "Average Difference" CA 56 1.096 -0.185 1.090 19845 47 1 8 "Average Difference" CB 55 0.841 -0.189 0.827 19845 48 1 8 "Average Difference" HN 55 0.515 -0.144 0.499 19845 49 1 9 "Average Difference" N 55 1.812 -0.244 1.812 19845 50 1 9 "Average Difference" HA 57 0.255 0.119 0.228 19845 51 1 9 "Average Difference" C 50 3.101 2.981 0.862 19845 52 1 9 "Average Difference" CA 56 0.991 -0.215 0.976 19845 53 1 9 "Average Difference" CB 55 0.858 -0.221 0.837 19845 54 1 9 "Average Difference" HN 55 0.502 -0.154 0.482 19845 55 1 10 "Average Difference" N 55 1.776 -0.133 1.787 19845 56 1 10 "Average Difference" HA 57 0.247 0.114 0.221 19845 57 1 10 "Average Difference" C 50 3.135 3.015 0.865 19845 58 1 10 "Average Difference" CA 56 1.097 -0.220 1.085 19845 59 1 10 "Average Difference" CB 55 0.814 -0.166 0.804 19845 60 1 10 "Average Difference" HN 55 0.493 -0.182 0.463 19845 61 1 11 "Average Difference" N 55 1.517 -0.036 1.531 19845 62 1 11 "Average Difference" HA 57 0.245 0.094 0.228 19845 63 1 11 "Average Difference" C 50 3.219 3.097 0.885 19845 64 1 11 "Average Difference" CA 56 1.100 -0.088 1.107 19845 65 1 11 "Average Difference" CB 55 0.785 -0.138 0.780 19845 66 1 11 "Average Difference" HN 55 0.502 -0.110 0.494 19845 67 1 12 "Average Difference" N 55 1.787 -0.277 1.782 19845 68 1 12 "Average Difference" HA 57 0.260 0.139 0.221 19845 69 1 12 "Average Difference" C 50 3.099 2.991 0.816 19845 70 1 12 "Average Difference" CA 56 1.166 -0.323 1.130 19845 71 1 12 "Average Difference" CB 55 0.813 -0.174 0.801 19845 72 1 12 "Average Difference" HN 55 0.502 -0.159 0.481 19845 73 1 13 "Average Difference" N 55 1.785 -0.192 1.791 19845 74 1 13 "Average Difference" HA 57 0.285 0.122 0.259 19845 75 1 13 "Average Difference" C 50 3.114 2.986 0.893 19845 76 1 13 "Average Difference" CA 56 1.126 -0.231 1.112 19845 77 1 13 "Average Difference" CB 55 0.921 -0.187 0.910 19845 78 1 13 "Average Difference" HN 55 0.488 -0.139 0.472 19845 79 1 14 "Average Difference" N 55 1.819 0.050 1.835 19845 80 1 14 "Average Difference" HA 57 0.258 0.137 0.220 19845 81 1 14 "Average Difference" C 50 3.150 3.019 0.907 19845 82 1 14 "Average Difference" CA 56 1.057 -0.204 1.047 19845 83 1 14 "Average Difference" CB 55 0.965 -0.134 0.964 19845 84 1 14 "Average Difference" HN 55 0.497 -0.151 0.478 19845 85 1 15 "Average Difference" N 55 1.817 -0.320 1.805 19845 86 1 15 "Average Difference" HA 57 0.265 0.141 0.226 19845 87 1 15 "Average Difference" C 50 3.079 2.955 0.873 19845 88 1 15 "Average Difference" CA 56 1.057 -0.212 1.045 19845 89 1 15 "Average Difference" CB 55 0.831 -0.194 0.816 19845 90 1 15 "Average Difference" HN 55 0.494 -0.152 0.474 19845 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 19845 _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 9 9 THR N N 9 113.692 113.692 115.770 -2.078 19845 2 1 . 1 1 9 9 THR HA H 9 4.213 4.213 4.447 -0.234 19845 3 1 . 1 1 9 9 THR C C 9 172.757 172.757 174.819 -2.062 19845 4 1 . 1 1 9 9 THR CA C 9 62.810 62.810 62.654 0.156 19845 5 1 . 1 1 9 9 THR CB C 9 69.878 69.878 68.861 1.018 19845 6 1 . 1 1 9 9 THR H H 9 7.930 7.930 8.509 -0.579 19845 7 1 . 1 1 10 10 GLY N N 10 110.842 110.842 108.910 1.932 19845 8 1 . 1 1 10 10 GLY C C 10 171.923 171.923 173.857 -1.934 19845 9 1 . 1 1 10 10 GLY CA C 10 46.099 46.099 44.636 1.464 19845 10 1 . 1 1 10 10 GLY H H 10 8.266 8.266 8.060 0.206 19845 11 1 . 1 1 11 11 THR N N 11 113.754 113.754 117.649 -3.895 19845 12 1 . 1 1 11 11 THR HA H 11 4.220 4.220 4.396 -0.176 19845 13 1 . 1 1 11 11 THR C C 11 171.906 171.906 174.657 -2.751 19845 14 1 . 1 1 11 11 THR CA C 11 62.721 62.721 62.782 -0.061 19845 15 1 . 1 1 11 11 THR CB C 11 69.549 69.549 68.747 0.802 19845 16 1 . 1 1 11 11 THR H H 11 7.753 7.753 7.984 -0.231 19845 17 1 . 1 1 12 12 LEU N N 12 123.669 123.669 125.605 -1.936 19845 18 1 . 1 1 12 12 LEU HA H 12 4.240 4.240 4.700 -0.460 19845 19 1 . 1 1 12 12 LEU C C 12 175.221 175.221 177.413 -2.192 19845 20 1 . 1 1 12 12 LEU CA C 12 56.799 56.799 55.219 1.580 19845 21 1 . 1 1 12 12 LEU CB C 12 42.536 42.536 42.050 0.486 19845 22 1 . 1 1 12 12 LEU H H 12 7.980 7.980 8.412 -0.432 19845 23 1 . 1 1 13 13 ILE N N 13 120.086 120.086 121.037 -0.951 19845 24 1 . 1 1 13 13 ILE HA H 13 3.913 3.913 4.065 -0.152 19845 25 1 . 1 1 13 13 ILE C C 13 173.425 173.425 177.171 -3.746 19845 26 1 . 1 1 13 13 ILE CA C 13 62.889 62.889 63.455 -0.566 19845 27 1 . 1 1 13 13 ILE CB C 13 38.249 38.249 38.043 0.206 19845 28 1 . 1 1 13 13 ILE H H 13 7.861 7.861 7.718 0.143 19845 29 1 . 1 1 14 14 VAL N N 14 119.785 119.785 119.639 0.146 19845 30 1 . 1 1 14 14 VAL HA H 14 3.790 3.790 3.819 -0.029 19845 31 1 . 1 1 14 14 VAL C C 14 173.429 173.429 177.367 -3.938 19845 32 1 . 1 1 14 14 VAL CA C 14 64.409 64.409 65.576 -1.167 19845 33 1 . 1 1 14 14 VAL CB C 14 32.007 32.007 31.290 0.717 19845 34 1 . 1 1 14 14 VAL H H 14 7.549 7.549 8.088 -0.539 19845 35 1 . 1 1 15 15 ASN N N 15 119.567 119.567 116.589 2.978 19845 36 1 . 1 1 15 15 ASN HA H 15 4.549 4.549 4.640 -0.091 19845 37 1 . 1 1 15 15 ASN C C 15 173.619 173.619 177.313 -3.694 19845 38 1 . 1 1 15 15 ASN CA C 15 54.805 54.805 55.636 -0.831 19845 39 1 . 1 1 15 15 ASN CB C 15 38.824 38.824 38.334 0.490 19845 40 1 . 1 1 15 15 ASN H H 15 8.010 8.010 8.388 -0.378 19845 41 1 . 1 1 16 16 SER N N 16 116.730 116.730 116.709 0.021 19845 42 1 . 1 1 16 16 SER HA H 16 4.177 4.177 4.422 -0.245 19845 43 1 . 1 1 16 16 SER CA C 16 61.705 61.705 61.177 0.528 19845 44 1 . 1 1 16 16 SER CB C 16 63.752 63.752 63.437 0.315 19845 45 1 . 1 1 16 16 SER H H 16 8.039 8.039 7.536 0.503 19845 46 1 . 1 1 17 17 VAL N N 17 122.062 122.062 122.505 -0.443 19845 47 1 . 1 1 17 17 VAL HA H 17 3.677 3.677 3.864 -0.187 19845 48 1 . 1 1 17 17 VAL C C 17 174.474 174.474 177.241 -2.767 19845 49 1 . 1 1 17 17 VAL CA C 17 66.671 66.671 65.617 1.054 19845 50 1 . 1 1 17 17 VAL CB C 17 31.531 31.531 31.705 -0.174 19845 51 1 . 1 1 17 17 VAL H H 17 7.896 7.896 8.182 -0.286 19845 52 1 . 1 1 18 18 LEU N N 18 119.103 119.103 120.076 -0.973 19845 53 1 . 1 1 18 18 LEU HA H 18 3.998 3.998 4.214 -0.216 19845 54 1 . 1 1 18 18 LEU C C 18 175.511 175.511 178.339 -2.828 19845 55 1 . 1 1 18 18 LEU CA C 18 58.107 58.107 57.801 0.306 19845 56 1 . 1 1 18 18 LEU CB C 18 41.593 41.593 41.878 -0.285 19845 57 1 . 1 1 18 18 LEU H H 18 7.857 7.857 7.434 0.423 19845 58 1 . 1 1 19 19 LEU N N 19 118.291 118.291 120.274 -1.983 19845 59 1 . 1 1 19 19 LEU HA H 19 4.152 4.152 4.130 0.022 19845 60 1 . 1 1 19 19 LEU C C 19 175.156 175.156 178.827 -3.671 19845 61 1 . 1 1 19 19 LEU CA C 19 58.011 58.011 57.747 0.264 19845 62 1 . 1 1 19 19 LEU CB C 19 42.027 42.027 41.521 0.506 19845 63 1 . 1 1 19 19 LEU H H 19 7.745 7.745 7.544 0.201 19845 64 1 . 1 1 20 20 PHE N N 20 118.415 118.415 119.579 -1.164 19845 65 1 . 1 1 20 20 PHE HA H 20 4.188 4.188 4.150 0.038 19845 66 1 . 1 1 20 20 PHE C C 20 174.260 174.260 177.504 -3.244 19845 67 1 . 1 1 20 20 PHE CA C 20 61.626 61.626 62.098 -0.472 19845 68 1 . 1 1 20 20 PHE CB C 20 38.643 38.643 38.919 -0.276 19845 69 1 . 1 1 20 20 PHE H H 20 8.002 8.002 8.536 -0.534 19845 70 1 . 1 1 21 21 LEU N N 21 118.571 118.571 119.811 -1.240 19845 71 1 . 1 1 21 21 LEU HA H 21 3.797 3.797 4.119 -0.322 19845 72 1 . 1 1 21 21 LEU C C 21 175.324 175.324 178.829 -3.505 19845 73 1 . 1 1 21 21 LEU CA C 21 58.128 58.128 58.382 -0.254 19845 74 1 . 1 1 21 21 LEU CB C 21 41.957 41.957 41.242 0.715 19845 75 1 . 1 1 21 21 LEU H H 21 8.456 8.456 7.715 0.741 19845 76 1 . 1 1 22 22 ALA N N 22 120.775 120.775 121.071 -0.296 19845 77 1 . 1 1 22 22 ALA HA H 22 3.779 3.779 4.151 -0.372 19845 78 1 . 1 1 22 22 ALA C C 22 175.697 175.697 180.119 -4.422 19845 79 1 . 1 1 22 22 ALA CA C 22 55.721 55.721 54.678 1.043 19845 80 1 . 1 1 22 22 ALA CB C 22 17.788 17.788 18.284 -0.496 19845 81 1 . 1 1 22 22 ALA H H 22 8.353 8.353 7.588 0.765 19845 82 1 . 1 1 23 23 PHE N N 23 117.860 117.860 119.965 -2.105 19845 83 1 . 1 1 23 23 PHE HA H 23 4.108 4.108 4.315 -0.207 19845 84 1 . 1 1 23 23 PHE C C 23 173.859 173.859 176.976 -3.117 19845 85 1 . 1 1 23 23 PHE CA C 23 61.271 61.271 61.442 -0.171 19845 86 1 . 1 1 23 23 PHE CB C 23 38.853 38.853 39.691 -0.838 19845 87 1 . 1 1 23 23 PHE H H 23 8.121 8.121 8.229 -0.108 19845 88 1 . 1 1 24 24 VAL N N 24 119.181 119.181 119.713 -0.532 19845 89 1 . 1 1 24 24 VAL HA H 24 3.134 3.134 3.496 -0.362 19845 90 1 . 1 1 24 24 VAL C C 24 174.684 174.684 177.785 -3.101 19845 91 1 . 1 1 24 24 VAL CA C 24 67.419 67.419 67.023 0.396 19845 92 1 . 1 1 24 24 VAL CB C 24 31.106 31.106 31.383 -0.277 19845 93 1 . 1 1 24 24 VAL H H 24 8.124 8.124 8.301 -0.177 19845 94 1 . 1 1 25 25 VAL N N 25 119.215 119.215 116.962 2.253 19845 95 1 . 1 1 25 25 VAL HA H 25 3.324 3.324 3.610 -0.286 19845 96 1 . 1 1 25 25 VAL C C 25 174.244 174.244 177.632 -3.388 19845 97 1 . 1 1 25 25 VAL CA C 25 67.740 67.740 66.054 1.686 19845 98 1 . 1 1 25 25 VAL CB C 25 31.270 31.270 30.842 0.428 19845 99 1 . 1 1 25 25 VAL H H 25 8.250 8.250 7.471 0.779 19845 100 1 . 1 1 26 26 PHE N N 26 119.875 119.875 119.243 0.632 19845 101 1 . 1 1 26 26 PHE HA H 26 3.900 3.900 4.152 -0.252 19845 102 1 . 1 1 26 26 PHE C C 26 175.371 175.371 177.800 -2.429 19845 103 1 . 1 1 26 26 PHE CA C 26 61.651 61.651 61.802 -0.151 19845 104 1 . 1 1 26 26 PHE CB C 26 38.760 38.760 38.710 0.050 19845 105 1 . 1 1 26 26 PHE H H 26 8.413 8.413 7.235 1.178 19845 106 1 . 1 1 27 27 LEU N N 27 122.548 122.548 119.355 3.193 19845 107 1 . 1 1 27 27 LEU HA H 27 3.533 3.533 3.863 -0.330 19845 108 1 . 1 1 27 27 LEU C C 27 175.256 175.256 179.005 -3.749 19845 109 1 . 1 1 27 27 LEU CA C 27 58.211 58.211 57.731 0.480 19845 110 1 . 1 1 27 27 LEU CB C 27 41.564 41.564 41.387 0.177 19845 111 1 . 1 1 27 27 LEU H H 27 8.453 8.453 8.267 0.186 19845 112 1 . 1 1 28 28 LEU N N 28 119.385 119.385 119.673 -0.288 19845 113 1 . 1 1 28 28 LEU HA H 28 3.799 3.799 3.880 -0.081 19845 114 1 . 1 1 28 28 LEU C C 28 175.881 175.881 179.193 -3.312 19845 115 1 . 1 1 28 28 LEU CA C 28 58.492 58.492 58.051 0.441 19845 116 1 . 1 1 28 28 LEU CB C 28 41.760 41.760 41.426 0.334 19845 117 1 . 1 1 28 28 LEU H H 28 8.248 8.248 8.295 -0.047 19845 118 1 . 1 1 29 29 VAL N N 29 118.515 118.515 116.404 2.111 19845 119 1 . 1 1 29 29 VAL HA H 29 3.319 3.319 3.760 -0.441 19845 120 1 . 1 1 29 29 VAL C C 29 174.734 174.734 177.746 -3.012 19845 121 1 . 1 1 29 29 VAL CA C 29 67.192 67.192 65.650 1.542 19845 122 1 . 1 1 29 29 VAL CB C 29 31.175 31.175 31.553 -0.378 19845 123 1 . 1 1 29 29 VAL H H 29 8.446 8.446 7.328 1.118 19845 124 1 . 1 1 30 30 THR N N 30 117.313 117.313 117.050 0.263 19845 125 1 . 1 1 30 30 THR HA H 30 3.432 3.432 3.890 -0.458 19845 126 1 . 1 1 30 30 THR CA C 30 68.606 68.606 66.770 1.836 19845 127 1 . 1 1 30 30 THR CB C 30 67.147 67.147 68.439 -1.292 19845 128 1 . 1 1 30 30 THR H H 30 7.923 7.923 8.110 -0.187 19845 129 1 . 1 1 31 31 LEU N N 31 120.629 120.629 121.012 -0.383 19845 130 1 . 1 1 31 31 LEU HA H 31 3.858 3.858 3.958 -0.100 19845 131 1 . 1 1 31 31 LEU C C 31 177.164 177.164 178.490 -1.326 19845 132 1 . 1 1 31 31 LEU CA C 31 58.145 58.145 57.730 0.415 19845 133 1 . 1 1 31 31 LEU CB C 31 41.615 41.615 41.465 0.150 19845 134 1 . 1 1 31 31 LEU H H 31 8.382 8.382 8.075 0.307 19845 135 1 . 1 1 32 32 ALA N N 32 125.216 125.216 121.724 3.492 19845 136 1 . 1 1 32 32 ALA HA H 32 3.836 3.836 3.915 -0.079 19845 137 1 . 1 1 32 32 ALA C C 32 175.968 175.968 180.563 -4.595 19845 138 1 . 1 1 32 32 ALA CA C 32 55.918 55.918 54.828 1.090 19845 139 1 . 1 1 32 32 ALA CB C 32 17.802 17.802 18.142 -0.340 19845 140 1 . 1 1 32 32 ALA H H 32 8.517 8.517 7.645 0.872 19845 141 1 . 1 1 33 33 ILE N N 33 118.722 118.722 118.985 -0.263 19845 142 1 . 1 1 33 33 ILE HA H 33 3.481 3.481 3.568 -0.087 19845 143 1 . 1 1 33 33 ILE C C 33 175.004 175.004 178.076 -3.072 19845 144 1 . 1 1 33 33 ILE CA C 33 65.554 65.554 64.973 0.581 19845 145 1 . 1 1 33 33 ILE CB C 33 37.657 37.657 37.335 0.322 19845 146 1 . 1 1 33 33 ILE H H 33 8.288 8.288 7.588 0.700 19845 147 1 . 1 1 34 34 LEU N N 34 118.987 118.987 119.946 -0.959 19845 148 1 . 1 1 34 34 LEU HA H 34 3.893 3.893 3.965 -0.072 19845 149 1 . 1 1 34 34 LEU C C 34 176.439 176.439 178.494 -2.055 19845 150 1 . 1 1 34 34 LEU CA C 34 58.436 58.436 57.944 0.492 19845 151 1 . 1 1 34 34 LEU CB C 34 42.152 42.152 41.153 0.999 19845 152 1 . 1 1 34 34 LEU H H 34 8.493 8.493 8.102 0.391 19845 153 1 . 1 1 35 35 THR N N 35 116.630 116.630 115.216 1.414 19845 154 1 . 1 1 35 35 THR HA H 35 3.652 3.652 3.896 -0.244 19845 155 1 . 1 1 35 35 THR C C 35 173.366 173.366 176.041 -2.675 19845 156 1 . 1 1 35 35 THR CA C 35 68.153 68.153 66.596 1.557 19845 157 1 . 1 1 35 35 THR CB C 35 68.162 68.162 68.258 -0.096 19845 158 1 . 1 1 35 35 THR H H 35 8.215 8.215 8.174 0.041 19845 159 1 . 1 1 36 36 ALA N N 36 124.667 124.667 123.305 1.362 19845 160 1 . 1 1 36 36 ALA HA H 36 3.864 3.864 3.962 -0.098 19845 161 1 . 1 1 36 36 ALA C C 36 176.510 176.510 179.380 -2.870 19845 162 1 . 1 1 36 36 ALA CA C 36 55.758 55.758 55.062 0.696 19845 163 1 . 1 1 36 36 ALA CB C 36 18.054 18.054 18.171 -0.117 19845 164 1 . 1 1 36 36 ALA H H 36 8.358 8.358 8.004 0.354 19845 165 1 . 1 1 37 37 LEU N N 37 116.565 116.565 117.841 -1.276 19845 166 1 . 1 1 37 37 LEU HA H 37 3.973 3.973 4.109 -0.136 19845 167 1 . 1 1 37 37 LEU C C 37 176.538 176.538 179.149 -2.611 19845 168 1 . 1 1 37 37 LEU CA C 37 57.853 57.853 57.242 0.611 19845 169 1 . 1 1 37 37 LEU CB C 37 42.018 42.018 40.605 1.413 19845 170 1 . 1 1 37 37 LEU H H 37 8.360 8.360 7.553 0.807 19845 171 1 . 1 1 38 38 ARG N N 38 119.392 119.392 119.852 -0.460 19845 172 1 . 1 1 38 38 ARG HA H 38 4.104 4.104 4.063 0.041 19845 173 1 . 1 1 38 38 ARG C C 38 176.208 176.208 179.329 -3.121 19845 174 1 . 1 1 38 38 ARG CA C 38 58.100 58.100 59.084 -0.984 19845 175 1 . 1 1 38 38 ARG CB C 38 29.502 29.502 29.688 -0.186 19845 176 1 . 1 1 38 38 ARG H H 38 8.082 8.082 7.423 0.659 19845 177 1 . 1 1 39 39 LEU N N 39 120.438 120.438 118.043 2.395 19845 178 1 . 1 1 39 39 LEU HA H 39 4.243 4.243 3.898 0.345 19845 179 1 . 1 1 39 39 LEU C C 39 175.702 175.702 178.605 -2.903 19845 180 1 . 1 1 39 39 LEU CA C 39 56.979 56.979 57.974 -0.995 19845 181 1 . 1 1 39 39 LEU CB C 39 41.893 41.893 41.342 0.551 19845 182 1 . 1 1 39 39 LEU H H 39 8.446 8.446 7.793 0.653 19845 183 1 . 1 1 40 40 ALA N N 40 122.512 122.512 120.725 1.787 19845 184 1 . 1 1 40 40 ALA HA H 40 3.975 3.975 4.092 -0.117 19845 185 1 . 1 1 40 40 ALA C C 40 175.838 175.838 178.933 -3.095 19845 186 1 . 1 1 40 40 ALA CA C 40 54.710 54.710 54.531 0.179 19845 187 1 . 1 1 40 40 ALA CB C 40 18.319 18.319 17.977 0.342 19845 188 1 . 1 1 40 40 ALA H H 40 8.321 8.321 7.456 0.865 19845 189 1 . 1 1 41 41 ALA N N 41 119.754 119.754 121.011 -1.257 19845 190 1 . 1 1 41 41 ALA HA H 41 4.024 4.024 4.182 -0.158 19845 191 1 . 1 1 41 41 ALA C C 41 176.517 176.517 179.796 -3.279 19845 192 1 . 1 1 41 41 ALA CA C 41 54.486 54.486 54.706 -0.220 19845 193 1 . 1 1 41 41 ALA CB C 41 18.468 18.468 18.645 -0.177 19845 194 1 . 1 1 41 41 ALA H H 41 8.038 8.038 8.081 -0.043 19845 195 1 . 1 1 42 42 TYR N N 42 118.272 118.272 118.665 -0.393 19845 196 1 . 1 1 42 42 TYR HA H 42 4.326 4.326 4.304 0.022 19845 197 1 . 1 1 42 42 TYR C C 42 174.633 174.633 177.860 -3.227 19845 198 1 . 1 1 42 42 TYR CA C 42 60.098 60.098 59.811 0.287 19845 199 1 . 1 1 42 42 TYR CB C 42 38.936 38.936 37.438 1.498 19845 200 1 . 1 1 42 42 TYR H H 42 7.814 7.814 7.972 -0.158 19845 201 1 . 1 1 43 43 ALA N N 43 122.908 122.908 121.404 1.504 19845 202 1 . 1 1 43 43 ALA HA H 43 4.111 4.111 4.195 -0.084 19845 203 1 . 1 1 43 43 ALA C C 43 175.241 175.241 178.171 -2.930 19845 204 1 . 1 1 43 43 ALA CA C 43 53.842 53.842 54.052 -0.211 19845 205 1 . 1 1 43 43 ALA CB C 43 18.427 18.427 17.780 0.647 19845 206 1 . 1 1 43 43 ALA H H 43 8.172 8.172 7.559 0.613 19845 207 1 . 1 1 44 44 ALA N N 44 119.906 119.906 119.319 0.587 19845 208 1 . 1 1 44 44 ALA HA H 44 4.051 4.051 4.239 -0.188 19845 209 1 . 1 1 44 44 ALA C C 44 175.092 175.092 178.152 -3.060 19845 210 1 . 1 1 44 44 ALA CA C 44 53.611 53.611 53.569 0.042 19845 211 1 . 1 1 44 44 ALA CB C 44 18.689 18.689 19.079 -0.390 19845 212 1 . 1 1 44 44 ALA H H 44 7.953 7.953 7.718 0.235 19845 213 1 . 1 1 45 45 ASN N N 45 114.984 114.984 117.156 -2.172 19845 214 1 . 1 1 45 45 ASN HA H 45 4.541 4.541 4.772 -0.231 19845 215 1 . 1 1 45 45 ASN CA C 45 54.506 54.506 54.707 -0.201 19845 216 1 . 1 1 45 45 ASN CB C 45 38.602 38.602 39.862 -1.260 19845 217 1 . 1 1 45 45 ASN H H 45 7.847 7.847 8.272 -0.425 19845 218 1 . 1 1 46 46 ILE N N 46 119.155 119.155 117.029 2.126 19845 219 1 . 1 1 46 46 ILE HA H 46 4.033 4.033 4.340 -0.307 19845 220 1 . 1 1 46 46 ILE C C 46 173.344 173.344 175.542 -2.198 19845 221 1 . 1 1 46 46 ILE CA C 46 62.357 62.357 61.917 0.440 19845 222 1 . 1 1 46 46 ILE CB C 46 38.657 38.657 38.567 0.090 19845 223 1 . 1 1 46 46 ILE H H 46 7.790 7.790 7.673 0.117 19845 224 1 . 1 1 47 47 VAL N N 47 117.526 117.526 116.586 0.940 19845 225 1 . 1 1 47 47 VAL HA H 47 4.133 4.133 4.406 -0.273 19845 226 1 . 1 1 47 47 VAL C C 47 172.672 172.672 174.871 -2.199 19845 227 1 . 1 1 47 47 VAL CA C 47 62.149 62.149 60.029 2.120 19845 228 1 . 1 1 47 47 VAL CB C 47 32.807 32.807 34.567 -1.760 19845 229 1 . 1 1 47 47 VAL H H 47 7.582 7.582 7.540 0.042 19845 230 1 . 1 1 48 48 ASN N N 48 120.091 120.091 120.338 -0.247 19845 231 1 . 1 1 48 48 ASN HA H 48 4.658 4.658 4.845 -0.187 19845 232 1 . 1 1 48 48 ASN CA C 48 53.478 53.478 53.355 0.123 19845 233 1 . 1 1 48 48 ASN CB C 48 38.573 38.573 37.080 1.493 19845 234 1 . 1 1 48 48 ASN H H 48 8.053 8.053 8.579 -0.526 19845 235 1 . 1 1 49 49 VAL N N 49 118.854 118.854 119.666 -0.812 19845 236 1 . 1 1 49 49 VAL HA H 49 4.133 4.133 4.228 -0.095 19845 237 1 . 1 1 49 49 VAL C C 49 172.595 172.595 174.044 -1.449 19845 238 1 . 1 1 49 49 VAL CA C 49 62.049 62.049 60.821 1.228 19845 239 1 . 1 1 49 49 VAL CB C 49 33.271 33.271 33.975 -0.704 19845 240 1 . 1 1 49 49 VAL H H 49 7.685 7.685 7.751 -0.066 19845 241 1 . 1 1 50 50 SER N N 50 118.689 118.689 120.763 -2.074 19845 242 1 . 1 1 50 50 SER HA H 50 4.466 4.466 4.190 0.276 19845 243 1 . 1 1 50 50 SER C C 50 171.430 171.430 172.514 -1.084 19845 244 1 . 1 1 50 50 SER CA C 50 58.128 58.128 57.283 0.845 19845 245 1 . 1 1 50 50 SER CB C 50 63.916 63.916 64.183 -0.267 19845 246 1 . 1 1 50 50 SER H H 50 8.075 8.075 8.106 -0.031 19845 247 1 . 1 1 51 51 LEU N N 51 123.536 123.536 120.734 2.802 19845 248 1 . 1 1 51 51 LEU HA H 51 4.305 4.305 4.687 -0.382 19845 249 1 . 1 1 51 51 LEU C C 51 174.110 174.110 175.335 -1.225 19845 250 1 . 1 1 51 51 LEU CA C 51 55.145 55.145 54.324 0.821 19845 251 1 . 1 1 51 51 LEU CB C 51 42.674 42.674 44.645 -1.971 19845 252 1 . 1 1 51 51 LEU H H 51 7.991 7.991 7.897 0.094 19845 253 1 . 1 1 52 52 VAL N N 52 119.649 119.649 119.234 0.415 19845 254 1 . 1 1 52 52 VAL HA H 52 3.992 3.992 4.312 -0.320 19845 255 1 . 1 1 52 52 VAL C C 52 172.476 172.476 176.762 -4.286 19845 256 1 . 1 1 52 52 VAL CA C 52 62.772 62.772 62.930 -0.158 19845 257 1 . 1 1 52 52 VAL CB C 52 33.066 33.066 32.641 0.425 19845 258 1 . 1 1 52 52 VAL H H 52 7.536 7.536 8.253 -0.717 19845 259 1 . 1 1 53 53 LYS N N 53 122.004 122.004 122.368 -0.364 19845 260 1 . 1 1 53 53 LYS HA H 53 4.354 4.354 4.202 0.152 19845 261 1 . 1 1 53 53 LYS CA C 53 56.567 56.567 59.897 -3.330 19845 262 1 . 1 1 53 53 LYS CB C 53 31.689 31.689 30.016 1.673 19845 263 1 . 1 1 53 53 LYS H H 53 8.038 8.038 8.469 -0.431 19845 264 1 . 1 1 54 54 PRO HA H 54 4.353 4.353 4.473 -0.120 19845 265 1 . 1 1 54 54 PRO CA C 54 65.103 65.103 64.917 0.186 19845 266 1 . 1 1 54 54 PRO CB C 54 32.193 32.193 30.953 1.240 19845 267 1 . 1 1 55 55 THR N N 55 111.485 111.485 110.397 1.088 19845 268 1 . 1 1 55 55 THR HA H 55 3.910 3.910 4.759 -0.849 19845 269 1 . 1 1 55 55 THR C C 55 172.822 172.822 176.589 -3.767 19845 270 1 . 1 1 55 55 THR CA C 55 65.030 65.030 63.269 1.760 19845 271 1 . 1 1 55 55 THR CB C 55 68.882 68.882 69.205 -0.323 19845 272 1 . 1 1 55 55 THR H H 55 7.722 7.722 7.569 0.153 19845 273 1 . 1 1 56 56 VAL N N 56 121.165 121.165 120.795 0.370 19845 274 1 . 1 1 56 56 VAL HA H 56 3.772 3.772 3.711 0.061 19845 275 1 . 1 1 56 56 VAL C C 56 174.904 174.904 176.898 -1.994 19845 276 1 . 1 1 56 56 VAL CA C 56 64.971 64.971 65.969 -0.998 19845 277 1 . 1 1 56 56 VAL CB C 56 31.989 31.989 30.916 1.073 19845 278 1 . 1 1 56 56 VAL H H 56 7.597 7.597 7.667 -0.070 19845 279 1 . 1 1 57 57 TYR N N 57 122.177 122.177 117.921 4.256 19845 280 1 . 1 1 57 57 TYR HA H 57 4.227 4.227 4.234 -0.007 19845 281 1 . 1 1 57 57 TYR C C 57 174.969 174.969 177.236 -2.267 19845 282 1 . 1 1 57 57 TYR CA C 57 60.755 60.755 59.559 1.196 19845 283 1 . 1 1 57 57 TYR CB C 57 38.453 38.453 36.893 1.560 19845 284 1 . 1 1 57 57 TYR H H 57 7.964 7.964 7.966 -0.002 19845 285 1 . 1 1 58 58 VAL N N 58 119.069 119.069 119.177 -0.108 19845 286 1 . 1 1 58 58 VAL HA H 58 3.529 3.529 3.289 0.240 19845 287 1 . 1 1 58 58 VAL C C 58 174.250 174.250 177.156 -2.906 19845 288 1 . 1 1 58 58 VAL CA C 58 66.223 66.223 64.811 1.412 19845 289 1 . 1 1 58 58 VAL CB C 58 31.803 31.803 30.974 0.829 19845 290 1 . 1 1 58 58 VAL H H 58 8.018 8.018 7.271 0.747 19845 291 1 . 1 1 59 59 TYR N N 59 120.360 120.360 121.017 -0.657 19845 292 1 . 1 1 59 59 TYR HA H 59 4.115 4.115 3.968 0.147 19845 293 1 . 1 1 59 59 TYR C C 59 173.899 173.899 177.680 -3.781 19845 294 1 . 1 1 59 59 TYR CA C 59 60.929 60.929 61.283 -0.355 19845 295 1 . 1 1 59 59 TYR CB C 59 38.602 38.602 37.877 0.725 19845 296 1 . 1 1 59 59 TYR H H 59 8.142 8.142 7.886 0.256 19845 297 1 . 1 1 60 60 SER N N 60 113.480 113.480 113.352 0.128 19845 298 1 . 1 1 60 60 SER HA H 60 3.979 3.979 4.023 -0.044 19845 299 1 . 1 1 60 60 SER C C 60 172.887 172.887 176.739 -3.852 19845 300 1 . 1 1 60 60 SER CA C 60 60.987 60.987 61.177 -0.190 19845 301 1 . 1 1 60 60 SER CB C 60 63.267 63.267 62.979 0.288 19845 302 1 . 1 1 60 60 SER H H 60 8.057 8.057 7.711 0.346 19845 303 1 . 1 1 61 61 ARG N N 61 120.962 120.962 122.139 -1.177 19845 304 1 . 1 1 61 61 ARG HA H 61 4.103 4.103 4.021 0.082 19845 305 1 . 1 1 61 61 ARG C C 61 175.399 175.399 178.583 -3.184 19845 306 1 . 1 1 61 61 ARG CA C 61 57.427 57.427 59.066 -1.639 19845 307 1 . 1 1 61 61 ARG CB C 61 30.008 30.008 29.990 0.018 19845 308 1 . 1 1 61 61 ARG H H 61 7.606 7.606 7.320 0.286 19845 309 1 . 1 1 62 62 VAL N N 62 117.852 117.852 116.946 0.906 19845 310 1 . 1 1 62 62 VAL HA H 62 3.805 3.805 3.746 0.059 19845 311 1 . 1 1 62 62 VAL C C 62 174.155 174.155 177.335 -3.180 19845 312 1 . 1 1 62 62 VAL CA C 62 64.458 64.458 65.667 -1.209 19845 313 1 . 1 1 62 62 VAL CB C 62 31.969 31.969 31.291 0.678 19845 314 1 . 1 1 62 62 VAL H H 62 7.848 7.848 8.103 -0.255 19845 315 1 . 1 1 63 63 LYS N N 63 119.254 119.254 119.740 -0.486 19845 316 1 . 1 1 63 63 LYS HA H 63 4.051 4.051 4.017 0.034 19845 317 1 . 1 1 63 63 LYS C C 63 173.615 173.615 178.222 -4.607 19845 318 1 . 1 1 63 63 LYS CA C 63 56.727 56.727 58.358 -1.631 19845 319 1 . 1 1 63 63 LYS CB C 63 32.105 32.105 32.568 -0.463 19845 320 1 . 1 1 63 63 LYS H H 63 7.759 7.759 7.499 0.260 19845 321 1 . 1 1 64 64 ASN N N 64 117.696 117.696 116.719 0.977 19845 322 1 . 1 1 64 64 ASN HA H 64 4.642 4.642 4.478 0.164 19845 323 1 . 1 1 64 64 ASN C C 64 171.750 171.750 175.866 -4.116 19845 324 1 . 1 1 64 64 ASN CA C 64 53.313 53.313 54.691 -1.378 19845 325 1 . 1 1 64 64 ASN CB C 64 39.260 39.260 39.048 0.212 19845 326 1 . 1 1 64 64 ASN H H 64 7.615 7.615 8.029 -0.414 19845 stop_ save_