data_18493 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 18493 _Entry.PDB_ID 2LTQ 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 18493 _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 11 11 GLY N N 11 108.456 108.456 106.355 2.101 18493 2 1 1 . 1 1 11 11 GLY H H 11 8.433 8.433 7.477 0.956 18493 3 1 1 . 1 1 12 12 ARG C C 12 178.053 178.053 179.010 -0.957 18493 4 1 1 . 1 1 12 12 ARG CA C 12 57.504 57.504 59.993 -2.489 18493 5 1 1 . 1 1 12 12 ARG CB C 12 30.522 30.522 30.377 0.145 18493 6 1 1 . 1 1 13 13 GLY N N 13 108.265 108.265 107.548 0.717 18493 7 1 1 . 1 1 13 13 GLY C C 13 175.091 175.091 176.208 -1.117 18493 8 1 1 . 1 1 13 13 GLY CA C 13 45.326 45.326 46.827 -1.501 18493 9 1 1 . 1 1 14 14 ALA N N 14 123.181 123.181 124.955 -1.774 18493 10 1 1 . 1 1 14 14 ALA C C 14 179.173 179.173 180.097 -0.924 18493 11 1 1 . 1 1 14 14 ALA CA C 14 55.061 55.061 54.845 0.216 18493 12 1 1 . 1 1 14 14 ALA H H 14 9.285 9.285 8.249 1.036 18493 13 1 1 . 1 1 15 15 TRP N N 15 116.733 116.733 118.993 -2.260 18493 14 1 1 . 1 1 15 15 TRP C C 15 179.425 179.425 178.594 0.831 18493 15 1 1 . 1 1 15 15 TRP CA C 15 58.960 58.960 59.467 -0.507 18493 16 1 1 . 1 1 15 15 TRP CB C 15 29.529 29.529 30.060 -0.531 18493 17 1 1 . 1 1 15 15 TRP H H 15 7.091 7.091 8.401 -1.310 18493 18 1 1 . 1 1 16 16 LEU N N 16 118.671 118.671 120.135 -1.464 18493 19 1 1 . 1 1 16 16 LEU C C 16 178.461 178.461 179.443 -0.982 18493 20 1 1 . 1 1 16 16 LEU CA C 16 58.246 58.246 57.924 0.322 18493 21 1 1 . 1 1 16 16 LEU CB C 16 41.369 41.369 41.020 0.349 18493 22 1 1 . 1 1 16 16 LEU H H 16 9.180 9.180 8.673 0.507 18493 23 1 1 . 1 1 17 17 LEU N N 17 118.515 118.515 121.630 -3.115 18493 24 1 1 . 1 1 17 17 LEU C C 17 178.787 178.787 178.982 -0.195 18493 25 1 1 . 1 1 17 17 LEU CA C 17 57.832 57.832 58.686 -0.854 18493 26 1 1 . 1 1 17 17 LEU CB C 17 41.395 41.395 41.251 0.144 18493 27 1 1 . 1 1 18 18 MET N N 18 120.633 120.633 117.955 2.678 18493 28 1 1 . 1 1 18 18 MET C C 18 180.469 180.469 178.964 1.505 18493 29 1 1 . 1 1 18 18 MET CA C 18 60.277 60.277 58.377 1.900 18493 30 1 1 . 1 1 18 18 MET CB C 18 31.789 31.789 31.626 0.163 18493 31 1 1 . 1 1 19 19 ALA N N 19 123.958 123.958 122.440 1.518 18493 32 1 1 . 1 1 19 19 ALA C C 19 178.210 178.210 178.883 -0.673 18493 33 1 1 . 1 1 19 19 ALA CA C 19 55.468 55.468 55.007 0.461 18493 34 1 1 . 1 1 19 19 ALA CB C 19 17.865 17.865 18.386 -0.521 18493 35 1 1 . 1 1 19 19 ALA H H 19 9.398 9.398 8.521 0.877 18493 36 1 1 . 1 1 20 20 PHE N N 20 118.424 118.424 119.313 -0.889 18493 37 1 1 . 1 1 20 20 PHE C C 20 176.674 176.674 177.080 -0.406 18493 38 1 1 . 1 1 20 20 PHE CA C 20 62.546 62.546 61.777 0.769 18493 39 1 1 . 1 1 20 20 PHE CB C 20 38.697 38.697 39.420 -0.723 18493 40 1 1 . 1 1 21 21 THR N N 21 109.220 109.220 114.707 -5.487 18493 41 1 1 . 1 1 21 21 THR C C 21 174.203 174.203 176.731 -2.528 18493 42 1 1 . 1 1 21 21 THR CA C 21 66.052 66.052 66.696 -0.644 18493 43 1 1 . 1 1 21 21 THR CB C 21 68.956 68.956 68.415 0.541 18493 44 1 1 . 1 1 22 22 ALA N N 22 123.662 123.662 125.616 -1.954 18493 45 1 1 . 1 1 22 22 ALA C C 22 179.488 179.488 179.571 -0.083 18493 46 1 1 . 1 1 22 22 ALA CA C 22 54.847 54.847 54.705 0.143 18493 47 1 1 . 1 1 22 22 ALA CB C 22 17.801 17.801 18.500 -0.699 18493 48 1 1 . 1 1 23 23 LEU N N 23 118.917 118.917 120.678 -1.761 18493 49 1 1 . 1 1 23 23 LEU C C 23 178.028 178.028 178.863 -0.835 18493 50 1 1 . 1 1 23 23 LEU CA C 23 57.713 57.713 57.606 0.107 18493 51 1 1 . 1 1 23 23 LEU CB C 23 41.506 41.506 40.640 0.866 18493 52 1 1 . 1 1 23 23 LEU H H 23 8.581 8.581 8.120 0.461 18493 53 1 1 . 1 1 24 24 ALA N N 24 119.931 119.931 121.893 -1.962 18493 54 1 1 . 1 1 24 24 ALA C C 24 180.617 180.617 179.233 1.384 18493 55 1 1 . 1 1 24 24 ALA CA C 24 55.350 55.350 54.707 0.643 18493 56 1 1 . 1 1 24 24 ALA CB C 24 17.583 17.583 18.136 -0.553 18493 57 1 1 . 1 1 25 25 LEU N N 25 119.691 119.691 120.096 -0.405 18493 58 1 1 . 1 1 25 25 LEU CA C 25 58.078 58.078 57.942 0.136 18493 59 1 1 . 1 1 25 25 LEU CB C 25 43.597 43.597 42.132 1.465 18493 60 1 1 . 1 1 25 25 LEU H H 25 9.179 9.179 8.594 0.585 18493 61 1 1 . 1 1 26 26 GLU N N 26 119.651 119.651 117.277 2.374 18493 62 1 1 . 1 1 26 26 GLU C C 26 179.334 179.334 178.606 0.728 18493 63 1 1 . 1 1 26 26 GLU CA C 26 59.584 59.584 58.533 1.051 18493 64 1 1 . 1 1 26 26 GLU CB C 26 27.202 27.202 29.727 -2.525 18493 65 1 1 . 1 1 27 27 LEU N N 27 119.661 119.661 121.343 -1.682 18493 66 1 1 . 1 1 27 27 LEU CA C 27 57.887 57.887 57.433 0.454 18493 67 1 1 . 1 1 27 27 LEU CB C 27 41.591 41.591 42.487 -0.896 18493 68 1 1 . 1 1 27 27 LEU H H 27 9.410 9.410 7.480 1.930 18493 69 1 1 . 1 1 28 28 THR N N 28 118.484 118.484 114.261 4.223 18493 70 1 1 . 1 1 28 28 THR C C 28 175.898 175.898 176.762 -0.864 18493 71 1 1 . 1 1 28 28 THR CA C 28 67.459 67.459 66.156 1.303 18493 72 1 1 . 1 1 28 28 THR CB C 28 67.948 67.948 68.284 -0.336 18493 73 1 1 . 1 1 29 29 ALA N N 29 122.643 122.643 124.908 -2.265 18493 74 1 1 . 1 1 29 29 ALA C C 29 179.717 179.717 179.019 0.698 18493 75 1 1 . 1 1 29 29 ALA CA C 29 55.919 55.919 54.636 1.283 18493 76 1 1 . 1 1 29 29 ALA CB C 29 16.837 16.837 18.401 -1.564 18493 77 1 1 . 1 1 29 29 ALA H H 29 8.302 8.302 7.334 0.968 18493 78 1 1 . 1 1 30 30 LEU N N 30 117.408 117.408 115.340 2.068 18493 79 1 1 . 1 1 30 30 LEU C C 30 178.143 178.143 177.115 1.028 18493 80 1 1 . 1 1 30 30 LEU CA C 30 57.384 57.384 55.370 2.014 18493 81 1 1 . 1 1 30 30 LEU CB C 30 41.679 41.679 42.165 -0.486 18493 82 1 1 . 1 1 30 30 LEU H H 30 8.412 8.412 8.129 0.283 18493 83 1 1 . 1 1 31 31 TRP N N 31 125.692 125.692 120.315 5.377 18493 84 1 1 . 1 1 31 31 TRP C C 31 179.053 179.053 177.793 1.260 18493 85 1 1 . 1 1 31 31 TRP CA C 31 59.005 59.005 58.369 0.636 18493 86 1 1 . 1 1 31 31 TRP CB C 31 28.142 28.142 30.603 -2.461 18493 87 1 1 . 1 1 31 31 TRP H H 31 9.157 9.157 7.928 1.229 18493 88 1 1 . 1 1 32 32 PHE N N 32 119.195 119.195 120.961 -1.766 18493 89 1 1 . 1 1 32 32 PHE CA C 32 61.557 61.557 60.293 1.264 18493 90 1 1 . 1 1 32 32 PHE CB C 32 38.384 38.384 37.077 1.307 18493 91 1 1 . 1 1 32 32 PHE H H 32 9.374 9.374 8.813 0.561 18493 92 1 1 . 1 1 33 33 GLN C C 33 177.477 177.477 176.165 1.312 18493 93 1 1 . 1 1 33 33 GLN CA C 33 56.613 56.613 58.354 -1.741 18493 94 1 1 . 1 1 33 33 GLN CB C 33 29.433 29.433 27.949 1.484 18493 95 1 1 . 1 1 34 34 HIS N N 34 115.948 115.948 116.884 -0.936 18493 96 1 1 . 1 1 34 34 HIS C C 34 175.548 175.548 177.829 -2.281 18493 97 1 1 . 1 1 34 34 HIS CA C 34 58.733 58.733 57.983 0.751 18493 98 1 1 . 1 1 34 34 HIS CB C 34 32.084 32.084 29.255 2.829 18493 99 1 1 . 1 1 34 34 HIS H H 34 9.621 9.621 7.327 2.294 18493 100 1 1 . 1 1 35 35 VAL N N 35 116.902 116.902 120.424 -3.522 18493 101 1 1 . 1 1 35 35 VAL C C 35 177.853 177.853 176.686 1.167 18493 102 1 1 . 1 1 35 35 VAL CA C 35 64.075 64.075 64.282 -0.207 18493 103 1 1 . 1 1 35 35 VAL CB C 35 30.626 30.626 31.020 -0.394 18493 104 1 1 . 1 1 36 36 MET N N 36 114.145 114.145 119.015 -4.870 18493 105 1 1 . 1 1 36 36 MET C C 36 175.905 175.905 176.392 -0.487 18493 106 1 1 . 1 1 36 36 MET H H 36 7.605 7.605 7.555 0.050 18493 107 1 1 . 1 1 37 37 LEU N N 37 111.740 111.740 115.506 -3.766 18493 108 1 1 . 1 1 37 37 LEU H H 37 7.121 7.121 7.199 -0.078 18493 109 1 1 . 1 1 38 38 LEU C C 38 176.457 176.457 175.315 1.142 18493 110 1 1 . 1 1 39 39 LYS N N 39 121.418 121.418 119.612 1.806 18493 111 1 1 . 1 1 39 39 LYS CA C 39 57.471 57.471 56.531 0.940 18493 112 1 1 . 1 1 39 39 LYS H H 39 9.359 9.359 8.315 1.044 18493 113 1 1 . 1 1 40 40 PRO CA C 40 60.451 60.451 63.041 -2.590 18493 114 1 1 . 1 1 42 42 VAL N N 42 118.166 118.166 114.879 3.287 18493 115 1 1 . 1 1 42 42 VAL C C 42 179.261 179.261 176.434 2.827 18493 116 1 1 . 1 1 42 42 VAL CA C 42 67.223 67.223 63.774 3.449 18493 117 1 1 . 1 1 42 42 VAL CB C 42 30.941 30.941 30.509 0.432 18493 118 1 1 . 1 1 43 43 LEU N N 43 115.946 115.946 121.825 -5.879 18493 119 1 1 . 1 1 43 43 LEU C C 43 178.293 178.293 178.516 -0.223 18493 120 1 1 . 1 1 43 43 LEU CA C 43 57.129 57.129 57.427 -0.298 18493 121 1 1 . 1 1 43 43 LEU CB C 43 41.030 41.030 41.283 -0.253 18493 122 1 1 . 1 1 44 44 CYS N N 44 115.006 115.006 118.327 -3.321 18493 123 1 1 . 1 1 44 44 CYS C C 44 177.484 177.484 177.151 0.333 18493 124 1 1 . 1 1 44 44 CYS CA C 44 59.760 59.760 61.972 -2.212 18493 125 1 1 . 1 1 44 44 CYS CB C 44 30.651 30.651 25.866 4.785 18493 126 1 1 . 1 1 44 44 CYS H H 44 7.683 7.683 7.827 -0.144 18493 127 1 1 . 1 1 45 45 ILE N N 45 119.384 119.384 120.020 -0.636 18493 128 1 1 . 1 1 45 45 ILE C C 45 179.575 179.575 177.502 2.073 18493 129 1 1 . 1 1 45 45 ILE CA C 45 62.068 62.068 64.883 -2.815 18493 130 1 1 . 1 1 45 45 ILE CB C 45 33.583 33.583 35.768 -2.185 18493 131 1 1 . 1 1 46 46 TYR N N 46 120.126 120.126 120.818 -0.692 18493 132 1 1 . 1 1 46 46 TYR C C 46 178.397 178.397 177.568 0.829 18493 133 1 1 . 1 1 46 46 TYR CA C 46 59.129 59.129 62.140 -3.011 18493 134 1 1 . 1 1 46 46 TYR CB C 46 35.347 35.347 38.261 -2.914 18493 135 1 1 . 1 1 46 46 TYR H H 46 8.958 8.958 8.062 0.896 18493 136 1 1 . 1 1 47 47 GLU N N 47 121.779 121.779 118.346 3.433 18493 137 1 1 . 1 1 47 47 GLU C C 47 179.907 179.907 179.190 0.717 18493 138 1 1 . 1 1 47 47 GLU CA C 47 57.985 57.985 58.270 -0.285 18493 139 1 1 . 1 1 47 47 GLU CB C 47 27.290 27.290 29.329 -2.039 18493 140 1 1 . 1 1 47 47 GLU H H 47 9.681 9.681 7.634 2.047 18493 141 1 1 . 1 1 48 48 ARG N N 48 119.188 119.188 121.008 -1.820 18493 142 1 1 . 1 1 48 48 ARG C C 48 181.638 181.638 178.842 2.796 18493 143 1 1 . 1 1 48 48 ARG CA C 48 60.299 60.299 58.903 1.396 18493 144 1 1 . 1 1 48 48 ARG CB C 48 30.167 30.167 29.682 0.485 18493 145 1 1 . 1 1 48 48 ARG H H 48 9.213 9.213 8.428 0.785 18493 146 1 1 . 1 1 49 49 VAL N N 49 121.326 121.326 119.545 1.781 18493 147 1 1 . 1 1 49 49 VAL C C 49 177.326 177.326 177.568 -0.242 18493 148 1 1 . 1 1 49 49 VAL CA C 49 66.624 66.624 66.524 0.100 18493 149 1 1 . 1 1 49 49 VAL CB C 49 31.280 31.280 31.003 0.277 18493 150 1 1 . 1 1 50 50 ALA N N 50 122.955 122.955 121.812 1.143 18493 151 1 1 . 1 1 50 50 ALA C C 50 179.594 179.594 179.567 0.027 18493 152 1 1 . 1 1 50 50 ALA CA C 50 55.902 55.902 55.123 0.779 18493 153 1 1 . 1 1 50 50 ALA CB C 50 16.623 16.623 18.395 -1.772 18493 154 1 1 . 1 1 51 51 LEU N N 51 115.737 115.737 118.309 -2.572 18493 155 1 1 . 1 1 51 51 LEU C C 51 177.990 177.990 178.280 -0.290 18493 156 1 1 . 1 1 51 51 LEU CA C 51 57.285 57.285 57.972 -0.687 18493 157 1 1 . 1 1 51 51 LEU CB C 51 41.369 41.369 41.327 0.042 18493 158 1 1 . 1 1 52 52 PHE N N 52 122.707 122.707 118.561 4.146 18493 159 1 1 . 1 1 52 52 PHE C C 52 179.142 179.142 178.461 0.681 18493 160 1 1 . 1 1 52 52 PHE CA C 52 62.518 62.518 61.075 1.443 18493 161 1 1 . 1 1 52 52 PHE CB C 52 38.538 38.538 38.256 0.282 18493 162 1 1 . 1 1 52 52 PHE H H 52 8.863 8.863 7.796 1.067 18493 163 1 1 . 1 1 53 53 GLY N N 53 110.801 110.801 109.534 1.267 18493 164 1 1 . 1 1 53 53 GLY C C 53 175.378 175.378 175.900 -0.522 18493 165 1 1 . 1 1 53 53 GLY CA C 53 48.024 48.024 47.399 0.625 18493 166 1 1 . 1 1 53 53 GLY H H 53 9.027 9.027 8.311 0.716 18493 167 1 1 . 1 1 54 54 VAL N N 54 121.926 121.926 123.739 -1.813 18493 168 1 1 . 1 1 54 54 VAL C C 54 177.035 177.035 177.534 -0.499 18493 169 1 1 . 1 1 54 54 VAL CA C 54 67.448 67.448 64.670 2.778 18493 170 1 1 . 1 1 54 54 VAL CB C 54 31.246 31.246 31.592 -0.346 18493 171 1 1 . 1 1 54 54 VAL H H 54 7.948 7.948 8.071 -0.123 18493 172 1 1 . 1 1 55 55 LEU N N 55 119.894 119.894 120.664 -0.770 18493 173 1 1 . 1 1 55 55 LEU C C 55 178.175 178.175 178.397 -0.222 18493 174 1 1 . 1 1 55 55 LEU CA C 55 58.490 58.490 57.979 0.511 18493 175 1 1 . 1 1 55 55 LEU CB C 55 42.145 42.145 40.584 1.561 18493 176 1 1 . 1 1 55 55 LEU H H 55 8.646 8.646 8.854 -0.208 18493 177 1 1 . 1 1 56 56 GLY N N 56 106.262 106.262 107.450 -1.188 18493 178 1 1 . 1 1 56 56 GLY C C 56 174.618 174.618 175.647 -1.029 18493 179 1 1 . 1 1 56 56 GLY CA C 56 47.533 47.533 47.562 -0.029 18493 180 1 1 . 1 1 57 57 ALA N N 57 123.002 123.002 124.649 -1.647 18493 181 1 1 . 1 1 57 57 ALA C C 57 178.688 178.688 179.713 -1.025 18493 182 1 1 . 1 1 57 57 ALA CA C 57 55.548 55.548 55.226 0.322 18493 183 1 1 . 1 1 57 57 ALA CB C 57 18.065 18.065 18.409 -0.344 18493 184 1 1 . 1 1 58 58 ALA N N 58 118.866 118.866 121.811 -2.945 18493 185 1 1 . 1 1 58 58 ALA C C 58 179.348 179.348 179.902 -0.554 18493 186 1 1 . 1 1 58 58 ALA CA C 58 54.763 54.763 55.069 -0.306 18493 187 1 1 . 1 1 58 58 ALA CB C 58 17.898 17.898 18.363 -0.465 18493 188 1 1 . 1 1 58 58 ALA H H 58 8.674 8.674 7.877 0.797 18493 189 1 1 . 1 1 59 59 LEU N N 59 115.384 115.384 118.856 -3.472 18493 190 1 1 . 1 1 59 59 LEU C C 59 177.654 177.654 178.950 -1.296 18493 191 1 1 . 1 1 59 59 LEU CA C 59 57.387 57.387 57.684 -0.297 18493 192 1 1 . 1 1 59 59 LEU CB C 59 41.209 41.209 41.449 -0.240 18493 193 1 1 . 1 1 60 60 ILE N N 60 116.140 116.140 117.405 -1.265 18493 194 1 1 . 1 1 60 60 ILE C C 60 180.024 180.024 178.614 1.410 18493 195 1 1 . 1 1 60 60 ILE CA C 60 64.263 64.263 64.697 -0.434 18493 196 1 1 . 1 1 60 60 ILE CB C 60 37.240 37.240 38.315 -1.075 18493 197 1 1 . 1 1 61 61 GLY N N 61 110.127 110.127 107.438 2.689 18493 198 1 1 . 1 1 61 61 GLY C C 61 173.716 173.716 175.549 -1.833 18493 199 1 1 . 1 1 61 61 GLY CA C 61 45.617 45.617 46.724 -1.107 18493 200 1 1 . 1 1 61 61 GLY H H 61 9.046 9.046 8.867 0.179 18493 201 1 1 . 1 1 62 62 ALA N N 62 118.949 118.949 125.278 -6.329 18493 202 1 1 . 1 1 62 62 ALA C C 62 176.192 176.192 179.302 -3.110 18493 203 1 1 . 1 1 62 62 ALA CA C 62 53.268 53.268 54.753 -1.485 18493 204 1 1 . 1 1 62 62 ALA CB C 62 19.138 19.138 18.585 0.553 18493 205 1 1 . 1 1 62 62 ALA H H 62 8.066 8.066 8.021 0.045 18493 206 1 1 . 1 1 63 63 ILE N N 63 116.800 116.800 114.288 2.512 18493 207 1 1 . 1 1 63 63 ILE CA C 63 66.739 66.739 63.240 3.499 18493 208 1 1 . 1 1 63 63 ILE CB C 63 37.947 37.947 37.941 0.006 18493 209 1 1 . 1 1 64 64 ALA N N 64 123.957 123.957 120.294 3.663 18493 210 1 1 . 1 1 64 64 ALA CA C 64 52.934 52.934 51.117 1.817 18493 211 1 1 . 1 1 64 64 ALA CB C 64 19.428 19.428 19.125 0.303 18493 212 1 1 . 1 1 65 65 PRO CA C 65 65.350 65.350 62.988 2.362 18493 213 1 1 . 1 1 66 66 LYS N N 66 116.618 116.618 118.916 -2.298 18493 214 1 1 . 1 1 66 66 LYS C C 66 177.500 177.500 176.512 0.988 18493 215 1 1 . 1 1 66 66 LYS CA C 66 56.547 56.547 56.023 0.524 18493 216 1 1 . 1 1 66 66 LYS CB C 66 30.522 30.522 33.621 -3.099 18493 217 1 1 . 1 1 67 67 THR CA C 67 60.452 60.452 66.234 -5.782 18493 218 1 1 . 1 1 67 67 THR CB C 67 69.948 69.948 66.698 3.250 18493 219 1 1 . 1 1 68 68 PRO C C 68 177.070 177.070 175.540 1.530 18493 220 1 1 . 1 1 68 68 PRO CA C 68 63.315 63.315 62.694 0.621 18493 221 1 1 . 1 1 68 68 PRO CB C 68 32.458 32.458 31.795 0.663 18493 222 1 1 . 1 1 69 69 LEU N N 69 121.517 121.517 122.929 -1.412 18493 223 1 1 . 1 1 69 69 LEU C C 69 179.448 179.448 178.191 1.257 18493 224 1 1 . 1 1 69 69 LEU CA C 69 57.389 57.389 54.300 3.090 18493 225 1 1 . 1 1 69 69 LEU CB C 69 42.737 42.737 41.611 1.126 18493 226 1 1 . 1 1 69 69 LEU H H 69 8.882 8.882 8.282 0.600 18493 227 1 1 . 1 1 70 70 ARG N N 70 114.028 114.028 119.859 -5.831 18493 228 1 1 . 1 1 70 70 ARG C C 70 177.925 177.925 176.657 1.268 18493 229 1 1 . 1 1 70 70 ARG CA C 70 58.429 58.429 57.065 1.364 18493 230 1 1 . 1 1 70 70 ARG CB C 70 29.391 29.391 28.646 0.745 18493 231 1 1 . 1 1 70 70 ARG H H 70 8.202 8.202 7.986 0.216 18493 232 1 1 . 1 1 71 71 TYR N N 71 121.740 121.740 118.225 3.515 18493 233 1 1 . 1 1 71 71 TYR CA C 71 57.374 57.374 59.152 -1.778 18493 234 1 1 . 1 1 71 71 TYR H H 71 8.136 8.136 7.775 0.361 18493 235 1 1 . 1 1 72 72 VAL N N 72 118.416 118.416 118.411 0.005 18493 236 1 1 . 1 1 72 72 VAL C C 72 177.702 177.702 177.235 0.467 18493 237 1 1 . 1 1 72 72 VAL CA C 72 66.098 66.098 65.206 0.892 18493 238 1 1 . 1 1 72 72 VAL CB C 72 31.343 31.343 30.849 0.494 18493 239 1 1 . 1 1 73 73 ALA N N 73 120.283 120.283 122.224 -1.941 18493 240 1 1 . 1 1 73 73 ALA C C 73 179.763 179.763 179.517 0.246 18493 241 1 1 . 1 1 73 73 ALA CA C 73 55.785 55.785 55.092 0.693 18493 242 1 1 . 1 1 73 73 ALA CB C 73 19.265 19.265 18.826 0.439 18493 243 1 1 . 1 1 73 73 ALA H H 73 9.015 9.015 8.001 1.014 18493 244 1 1 . 1 1 74 74 MET N N 74 115.547 115.547 116.967 -1.420 18493 245 1 1 . 1 1 74 74 MET C C 74 177.223 177.223 178.438 -1.215 18493 246 1 1 . 1 1 74 74 MET CA C 74 61.023 61.023 59.279 1.744 18493 247 1 1 . 1 1 74 74 MET CB C 74 33.777 33.777 32.042 1.735 18493 248 1 1 . 1 1 74 74 MET H H 74 8.163 8.163 8.763 -0.600 18493 249 1 1 . 1 1 75 75 VAL N N 75 118.690 118.690 119.667 -0.977 18493 250 1 1 . 1 1 75 75 VAL C C 75 177.166 177.166 177.954 -0.788 18493 251 1 1 . 1 1 75 75 VAL CA C 75 67.581 67.581 66.880 0.701 18493 252 1 1 . 1 1 75 75 VAL CB C 75 31.408 31.408 30.948 0.460 18493 253 1 1 . 1 1 75 75 VAL H H 75 7.554 7.554 7.853 -0.299 18493 254 1 1 . 1 1 76 76 ILE N N 76 118.959 118.959 119.985 -1.026 18493 255 1 1 . 1 1 76 76 ILE C C 76 178.680 178.680 177.165 1.515 18493 256 1 1 . 1 1 76 76 ILE CA C 76 65.839 65.839 64.920 0.919 18493 257 1 1 . 1 1 76 76 ILE CB C 76 38.414 38.414 38.215 0.199 18493 258 1 1 . 1 1 77 77 TRP N N 77 125.440 125.440 122.573 2.867 18493 259 1 1 . 1 1 77 77 TRP C C 77 177.153 177.153 178.249 -1.096 18493 260 1 1 . 1 1 77 77 TRP CA C 77 58.779 58.779 59.583 -0.804 18493 261 1 1 . 1 1 77 77 TRP CB C 77 30.494 30.494 29.133 1.361 18493 262 1 1 . 1 1 77 77 TRP H H 77 9.515 9.515 8.214 1.301 18493 263 1 1 . 1 1 78 78 LEU N N 78 118.968 118.968 121.690 -2.722 18493 264 1 1 . 1 1 78 78 LEU C C 78 178.381 178.381 178.743 -0.362 18493 265 1 1 . 1 1 78 78 LEU CA C 78 58.041 58.041 58.225 -0.184 18493 266 1 1 . 1 1 78 78 LEU CB C 78 43.807 43.807 40.708 3.099 18493 267 1 1 . 1 1 78 78 LEU H H 78 9.367 9.367 8.731 0.636 18493 268 1 1 . 1 1 79 79 TYR N N 79 118.181 118.181 120.318 -2.137 18493 269 1 1 . 1 1 79 79 TYR C C 79 176.777 176.777 177.887 -1.110 18493 270 1 1 . 1 1 79 79 TYR CA C 79 62.849 62.849 62.421 0.428 18493 271 1 1 . 1 1 80 80 SER N N 80 114.286 114.286 115.115 -0.829 18493 272 1 1 . 1 1 80 80 SER C C 80 175.943 175.943 176.962 -1.019 18493 273 1 1 . 1 1 80 80 SER CA C 80 63.515 63.515 61.227 2.288 18493 274 1 1 . 1 1 80 80 SER CB C 80 63.941 63.941 63.006 0.935 18493 275 1 1 . 1 1 81 81 ALA N N 81 121.070 121.070 125.351 -4.281 18493 276 1 1 . 1 1 81 81 ALA C C 81 178.208 178.208 179.231 -1.023 18493 277 1 1 . 1 1 81 81 ALA CA C 81 55.224 55.224 55.095 0.129 18493 278 1 1 . 1 1 81 81 ALA CB C 81 17.897 17.897 18.674 -0.777 18493 279 1 1 . 1 1 82 82 PHE N N 82 117.560 117.560 120.137 -2.577 18493 280 1 1 . 1 1 82 82 PHE C C 82 176.975 176.975 177.172 -0.197 18493 281 1 1 . 1 1 82 82 PHE CA C 82 62.132 62.132 60.441 1.690 18493 282 1 1 . 1 1 82 82 PHE CB C 82 38.497 38.497 39.180 -0.683 18493 283 1 1 . 1 1 83 83 ARG N N 83 117.110 117.110 118.862 -1.752 18493 284 1 1 . 1 1 83 83 ARG C C 83 178.637 178.637 178.496 0.141 18493 285 1 1 . 1 1 83 83 ARG CA C 83 60.291 60.291 58.853 1.438 18493 286 1 1 . 1 1 83 83 ARG CB C 83 28.625 28.625 29.212 -0.587 18493 287 1 1 . 1 1 84 84 GLY N N 84 105.915 105.915 106.264 -0.349 18493 288 1 1 . 1 1 84 84 GLY C C 84 177.091 177.091 175.667 1.424 18493 289 1 1 . 1 1 84 84 GLY CA C 84 46.128 46.128 46.463 -0.335 18493 290 1 1 . 1 1 85 85 VAL N N 85 124.985 124.985 123.679 1.306 18493 291 1 1 . 1 1 85 85 VAL C C 85 176.387 176.387 177.557 -1.170 18493 292 1 1 . 1 1 85 85 VAL CA C 85 66.960 66.960 65.198 1.762 18493 293 1 1 . 1 1 85 85 VAL CB C 85 31.066 31.066 31.474 -0.408 18493 294 1 1 . 1 1 86 86 GLN N N 86 116.522 116.522 119.054 -2.532 18493 295 1 1 . 1 1 86 86 GLN C C 86 179.586 179.586 178.622 0.964 18493 296 1 1 . 1 1 86 86 GLN CA C 86 59.505 59.505 58.927 0.578 18493 297 1 1 . 1 1 86 86 GLN CB C 86 28.762 28.762 27.741 1.021 18493 298 1 1 . 1 1 87 87 LEU N N 87 121.211 121.211 120.124 1.087 18493 299 1 1 . 1 1 87 87 LEU C C 87 178.396 178.396 179.682 -1.286 18493 300 1 1 . 1 1 87 87 LEU CA C 87 57.847 57.847 56.930 0.917 18493 301 1 1 . 1 1 87 87 LEU CB C 87 41.924 41.924 41.661 0.263 18493 302 1 1 . 1 1 87 87 LEU H H 87 8.955 8.955 7.519 1.436 18493 303 1 1 . 1 1 88 88 THR N N 88 108.251 108.251 115.163 -6.912 18493 304 1 1 . 1 1 88 88 THR C C 88 180.013 180.013 176.570 3.443 18493 305 1 1 . 1 1 88 88 THR CA C 88 65.112 65.112 66.247 -1.135 18493 306 1 1 . 1 1 88 88 THR CB C 88 68.805 68.805 68.849 -0.044 18493 307 1 1 . 1 1 88 88 THR H H 88 8.764 8.764 8.262 0.502 18493 308 1 1 . 1 1 89 89 TYR N N 89 127.947 127.947 122.535 5.412 18493 309 1 1 . 1 1 89 89 TYR C C 89 177.244 177.244 176.769 0.475 18493 310 1 1 . 1 1 89 89 TYR H H 89 9.868 9.868 8.595 1.273 18493 311 1 1 . 1 1 90 90 GLU N N 90 121.163 121.163 117.968 3.195 18493 312 1 1 . 1 1 90 90 GLU C C 90 178.671 178.671 178.597 0.074 18493 313 1 1 . 1 1 90 90 GLU H H 90 8.515 8.515 8.028 0.487 18493 314 1 1 . 1 1 91 91 HIS N N 91 120.459 120.459 118.996 1.463 18493 315 1 1 . 1 1 91 91 HIS C C 91 177.605 177.605 176.400 1.205 18493 316 1 1 . 1 1 91 91 HIS CA C 91 57.085 57.085 57.791 -0.706 18493 317 1 1 . 1 1 91 91 HIS CB C 91 34.128 34.128 29.907 4.221 18493 318 1 1 . 1 1 91 91 HIS H H 91 9.102 9.102 7.590 1.512 18493 319 1 1 . 1 1 92 92 THR N N 92 115.463 115.463 114.581 0.882 18493 320 1 1 . 1 1 92 92 THR C C 92 176.189 176.189 175.837 0.352 18493 321 1 1 . 1 1 92 92 THR CA C 92 67.058 67.058 65.714 1.344 18493 322 1 1 . 1 1 92 92 THR CB C 92 68.564 68.564 69.145 -0.581 18493 323 1 1 . 1 1 92 92 THR H H 92 9.550 9.550 7.722 1.828 18493 324 1 1 . 1 1 93 93 MET N N 93 117.153 117.153 120.533 -3.380 18493 325 1 1 . 1 1 93 93 MET C C 93 176.972 176.972 178.303 -1.331 18493 326 1 1 . 1 1 93 93 MET CA C 93 62.369 62.369 56.550 5.819 18493 327 1 1 . 1 1 93 93 MET CB C 93 33.515 33.515 31.473 2.042 18493 328 1 1 . 1 1 94 94 LEU N N 94 117.981 117.981 117.523 0.458 18493 329 1 1 . 1 1 94 94 LEU CA C 94 57.489 57.489 57.555 -0.066 18493 330 1 1 . 1 1 94 94 LEU CB C 94 41.432 41.432 40.879 0.553 18493 331 1 1 . 1 1 94 94 LEU H H 94 8.497 8.497 8.468 0.029 18493 332 1 1 . 1 1 95 95 GLN C C 95 178.331 178.331 177.537 0.794 18493 333 1 1 . 1 1 95 95 GLN CA C 95 57.604 57.604 57.273 0.331 18493 334 1 1 . 1 1 95 95 GLN CB C 95 28.200 28.200 28.803 -0.603 18493 335 1 1 . 1 1 96 96 LEU N N 96 118.174 118.174 119.308 -1.134 18493 336 1 1 . 1 1 96 96 LEU C C 96 177.842 177.842 175.832 2.010 18493 337 1 1 . 1 1 96 96 LEU CA C 96 57.747 57.747 55.872 1.875 18493 338 1 1 . 1 1 96 96 LEU CB C 96 41.721 41.721 42.285 -0.564 18493 339 1 1 . 1 1 97 97 TYR N N 97 117.359 117.359 117.534 -0.175 18493 340 1 1 . 1 1 97 97 TYR CA C 97 57.581 57.581 55.419 2.162 18493 341 1 1 . 1 1 97 97 TYR H H 97 8.485 8.485 7.737 0.748 18493 342 1 1 . 1 1 98 98 PRO CA C 98 63.847 63.847 62.357 1.490 18493 343 1 1 . 1 1 99 99 SER CA C 99 58.145 58.145 54.871 3.274 18493 344 1 1 . 1 1 99 99 SER CB C 99 64.506 64.506 64.798 -0.292 18493 345 1 1 . 1 1 101 101 PHE C C 101 174.992 174.992 174.319 0.673 18493 346 1 1 . 1 1 102 102 ALA N N 102 120.614 120.614 124.661 -4.047 18493 347 1 1 . 1 1 102 102 ALA C C 102 176.810 176.810 177.280 -0.470 18493 348 1 1 . 1 1 102 102 ALA CA C 102 54.355 54.355 53.642 0.713 18493 349 1 1 . 1 1 102 102 ALA H H 102 7.383 7.383 7.457 -0.074 18493 350 1 1 . 1 1 103 103 THR N N 103 112.507 112.507 112.947 -0.440 18493 351 1 1 . 1 1 103 103 THR C C 103 175.666 175.666 173.213 2.453 18493 352 1 1 . 1 1 103 103 THR CA C 103 59.838 59.838 62.380 -2.542 18493 353 1 1 . 1 1 103 103 THR CB C 103 67.623 67.623 69.514 -1.891 18493 354 1 1 . 1 1 103 103 THR H H 103 9.278 9.278 7.301 1.977 18493 355 1 1 . 1 1 104 104 CYS N N 104 122.754 122.754 119.375 3.379 18493 356 1 1 . 1 1 104 104 CYS C C 104 174.474 174.474 174.586 -0.112 18493 357 1 1 . 1 1 104 104 CYS CA C 104 64.988 64.988 57.118 7.870 18493 358 1 1 . 1 1 104 104 CYS CB C 104 42.988 42.988 30.035 12.953 18493 359 1 1 . 1 1 104 104 CYS H H 104 9.934 9.934 8.219 1.715 18493 360 1 1 . 1 1 105 105 ASP N N 105 121.350 121.350 120.827 0.523 18493 361 1 1 . 1 1 105 105 ASP CB C 105 41.030 41.030 40.277 0.753 18493 362 1 1 . 1 1 105 105 ASP H H 105 8.153 8.153 8.603 -0.450 18493 363 1 1 . 1 1 115 115 PRO CA C 115 61.148 61.148 62.445 -1.297 18493 364 1 1 . 1 1 115 115 PRO CB C 115 30.280 30.280 32.526 -2.246 18493 365 1 1 . 1 1 116 116 LEU C C 116 178.163 178.163 174.935 3.228 18493 366 1 1 . 1 1 116 116 LEU CA C 116 58.746 58.746 55.779 2.967 18493 367 1 1 . 1 1 116 116 LEU CB C 116 42.932 42.932 42.837 0.096 18493 368 1 1 . 1 1 117 117 ASP N N 117 116.302 116.302 119.203 -2.901 18493 369 1 1 . 1 1 117 117 ASP C C 117 177.528 177.528 174.993 2.535 18493 370 1 1 . 1 1 117 117 ASP CB C 117 41.252 41.252 42.222 -0.970 18493 371 1 1 . 1 1 118 118 LYS N N 118 118.983 118.983 120.962 -1.979 18493 372 1 1 . 1 1 118 118 LYS H H 118 7.538 7.538 8.737 -1.199 18493 373 1 1 . 1 1 119 119 TRP C C 119 177.867 177.867 176.186 1.681 18493 374 1 1 . 1 1 120 120 VAL N N 120 113.149 113.149 111.797 1.352 18493 375 1 1 . 1 1 120 120 VAL CA C 120 58.651 58.651 58.837 -0.185 18493 376 1 1 . 1 1 120 120 VAL CB C 120 31.821 31.821 32.917 -1.096 18493 377 1 1 . 1 1 120 120 VAL H H 120 8.936 8.936 7.825 1.111 18493 378 1 1 . 1 1 121 121 PRO C C 121 178.888 178.888 177.255 1.633 18493 379 1 1 . 1 1 121 121 PRO CA C 121 65.185 65.185 63.018 2.167 18493 380 1 1 . 1 1 121 121 PRO CB C 121 31.781 31.781 31.831 -0.050 18493 381 1 1 . 1 1 122 122 GLN N N 122 116.304 116.304 119.473 -3.169 18493 382 1 1 . 1 1 122 122 GLN C C 122 174.326 174.326 177.084 -2.758 18493 383 1 1 . 1 1 122 122 GLN CA C 122 58.463 58.463 58.461 0.002 18493 384 1 1 . 1 1 122 122 GLN H H 122 9.809 9.809 8.278 1.531 18493 385 1 1 . 1 1 123 123 VAL N N 123 113.254 113.254 117.054 -3.800 18493 386 1 1 . 1 1 123 123 VAL C C 123 175.777 175.777 176.397 -0.620 18493 387 1 1 . 1 1 123 123 VAL CA C 123 61.689 61.689 64.941 -3.252 18493 388 1 1 . 1 1 123 123 VAL CB C 123 35.373 35.373 31.496 3.877 18493 389 1 1 . 1 1 123 123 VAL H H 123 8.219 8.219 8.300 -0.081 18493 390 1 1 . 1 1 124 124 PHE N N 124 112.242 112.242 115.797 -3.555 18493 391 1 1 . 1 1 124 124 PHE C C 124 172.759 172.759 173.792 -1.033 18493 392 1 1 . 1 1 124 124 PHE CB C 124 39.318 39.318 40.863 -1.545 18493 393 1 1 . 1 1 125 125 VAL N N 125 115.233 115.233 115.182 0.051 18493 394 1 1 . 1 1 125 125 VAL C C 125 177.034 177.034 174.629 2.405 18493 395 1 1 . 1 1 125 125 VAL CA C 125 61.950 61.950 60.941 1.009 18493 396 1 1 . 1 1 125 125 VAL CB C 125 33.376 33.376 35.522 -2.146 18493 397 1 1 . 1 1 125 125 VAL H H 125 7.799 7.799 8.071 -0.272 18493 398 1 1 . 1 1 126 126 ALA N N 126 130.709 130.709 122.892 7.817 18493 399 1 1 . 1 1 126 126 ALA C C 126 175.920 175.920 177.335 -1.415 18493 400 1 1 . 1 1 126 126 ALA CA C 126 54.493 54.493 52.494 1.999 18493 401 1 1 . 1 1 126 126 ALA CB C 126 17.215 17.215 20.295 -3.080 18493 402 1 1 . 1 1 126 126 ALA H H 126 9.014 9.014 8.436 0.578 18493 403 1 1 . 1 1 127 127 SER N N 127 112.716 112.716 116.783 -4.067 18493 404 1 1 . 1 1 127 127 SER CA C 127 58.101 58.101 58.941 -0.840 18493 405 1 1 . 1 1 127 127 SER CB C 127 64.539 64.539 62.998 1.541 18493 406 1 1 . 1 1 127 127 SER H H 127 8.145 8.145 8.060 0.085 18493 407 1 1 . 1 1 128 128 GLY N N 128 106.487 106.487 114.277 -7.790 18493 408 1 1 . 1 1 128 128 GLY C C 128 177.047 177.047 172.830 4.217 18493 409 1 1 . 1 1 128 128 GLY CA C 128 46.296 46.296 45.852 0.444 18493 410 1 1 . 1 1 128 128 GLY H H 128 8.595 8.595 8.430 0.165 18493 411 1 1 . 1 1 129 129 ASP C C 129 177.916 177.916 174.572 3.344 18493 412 1 1 . 1 1 129 129 ASP CB C 129 43.975 43.975 41.116 2.859 18493 413 1 1 . 1 1 130 130 CYS N N 130 122.984 122.984 119.151 3.833 18493 414 1 1 . 1 1 130 130 CYS C C 130 173.312 173.312 174.308 -0.996 18493 415 1 1 . 1 1 130 130 CYS CA C 130 64.581 64.581 57.673 6.908 18493 416 1 1 . 1 1 130 130 CYS CB C 130 42.879 42.879 29.428 13.451 18493 417 1 1 . 1 1 130 130 CYS H H 130 9.948 9.948 8.604 1.344 18493 418 1 1 . 1 1 131 131 ALA N N 131 121.534 121.534 123.941 -2.407 18493 419 1 1 . 1 1 131 131 ALA CA C 131 52.640 52.640 53.545 -0.905 18493 420 1 1 . 1 1 131 131 ALA CB C 131 18.497 18.497 18.235 0.262 18493 421 1 1 . 1 1 131 131 ALA H H 131 9.869 9.869 8.452 1.417 18493 422 1 1 . 1 1 136 136 ASP C C 136 172.916 172.916 175.696 -2.780 18493 423 1 1 . 1 1 137 137 PHE N N 137 117.677 117.677 117.095 0.582 18493 424 1 1 . 1 1 137 137 PHE CA C 137 57.310 57.310 58.566 -1.256 18493 425 1 1 . 1 1 137 137 PHE CB C 137 42.927 42.927 38.500 4.427 18493 426 1 1 . 1 1 137 137 PHE H H 137 8.959 8.959 8.219 0.740 18493 427 1 1 . 1 1 138 138 LEU CB C 138 43.547 43.547 41.916 1.631 18493 428 1 1 . 1 1 139 139 GLY C C 139 176.262 176.262 174.205 2.057 18493 429 1 1 . 1 1 139 139 GLY CA C 139 46.123 46.123 46.749 -0.626 18493 430 1 1 . 1 1 140 140 LEU N N 140 124.207 124.207 125.021 -0.814 18493 431 1 1 . 1 1 140 140 LEU CB C 140 40.503 40.503 41.754 -1.251 18493 432 1 1 . 1 1 142 142 MET CA C 142 56.442 56.442 57.472 -1.030 18493 433 1 1 . 1 1 143 143 PRO CA C 143 63.254 63.254 64.639 -1.385 18493 434 1 1 . 1 1 144 144 GLN C C 144 177.307 177.307 177.228 0.079 18493 435 1 1 . 1 1 145 145 TRP N N 145 120.795 120.795 124.586 -3.791 18493 436 1 1 . 1 1 145 145 TRP C C 145 178.709 178.709 178.203 0.506 18493 437 1 1 . 1 1 145 145 TRP CA C 145 59.535 59.535 60.853 -1.319 18493 438 1 1 . 1 1 145 145 TRP CB C 145 29.345 29.345 29.071 0.274 18493 439 1 1 . 1 1 145 145 TRP H H 145 8.386 8.386 8.009 0.377 18493 440 1 1 . 1 1 146 146 LEU N N 146 118.336 118.336 119.504 -1.168 18493 441 1 1 . 1 1 146 146 LEU C C 146 177.115 177.115 179.156 -2.041 18493 442 1 1 . 1 1 146 146 LEU CA C 146 57.793 57.793 58.097 -0.304 18493 443 1 1 . 1 1 146 146 LEU CB C 146 41.616 41.616 40.935 0.681 18493 444 1 1 . 1 1 146 146 LEU H H 146 9.033 9.033 7.715 1.318 18493 445 1 1 . 1 1 147 147 LEU N N 147 123.772 123.772 120.495 3.277 18493 446 1 1 . 1 1 147 147 LEU C C 147 178.787 178.787 178.828 -0.041 18493 447 1 1 . 1 1 147 147 LEU CA C 147 58.052 58.052 58.411 -0.359 18493 448 1 1 . 1 1 147 147 LEU CB C 147 41.047 41.047 41.160 -0.113 18493 449 1 1 . 1 1 147 147 LEU H H 147 8.480 8.480 8.186 0.294 18493 450 1 1 . 1 1 148 148 GLY N N 148 104.457 104.457 107.616 -3.159 18493 451 1 1 . 1 1 148 148 GLY C C 148 174.667 174.667 176.214 -1.547 18493 452 1 1 . 1 1 148 148 GLY CA C 148 48.102 48.102 47.104 0.998 18493 453 1 1 . 1 1 149 149 ILE N N 149 121.815 121.815 122.888 -1.073 18493 454 1 1 . 1 1 149 149 ILE C C 149 177.725 177.725 177.581 0.144 18493 455 1 1 . 1 1 149 149 ILE CA C 149 65.997 65.997 64.907 1.090 18493 456 1 1 . 1 1 149 149 ILE CB C 149 38.262 38.262 37.914 0.348 18493 457 1 1 . 1 1 150 150 PHE N N 150 118.894 118.894 117.866 1.028 18493 458 1 1 . 1 1 150 150 PHE C C 150 178.929 178.929 177.908 1.021 18493 459 1 1 . 1 1 150 150 PHE CA C 150 63.591 63.591 62.131 1.460 18493 460 1 1 . 1 1 150 150 PHE CB C 150 38.417 38.417 38.693 -0.276 18493 461 1 1 . 1 1 151 151 ILE N N 151 120.535 120.535 121.209 -0.674 18493 462 1 1 . 1 1 151 151 ILE C C 151 177.347 177.347 177.362 -0.015 18493 463 1 1 . 1 1 151 151 ILE CA C 151 66.478 66.478 64.348 2.130 18493 464 1 1 . 1 1 151 151 ILE CB C 151 37.302 37.302 37.714 -0.412 18493 465 1 1 . 1 1 152 152 ALA N N 152 122.855 122.855 123.233 -0.378 18493 466 1 1 . 1 1 152 152 ALA C C 152 179.165 179.165 180.048 -0.883 18493 467 1 1 . 1 1 152 152 ALA CA C 152 56.272 56.272 55.633 0.639 18493 468 1 1 . 1 1 152 152 ALA CB C 152 17.993 17.993 17.927 0.066 18493 469 1 1 . 1 1 153 153 TYR N N 153 116.156 116.156 118.373 -2.217 18493 470 1 1 . 1 1 153 153 TYR C C 153 179.682 179.682 178.798 0.884 18493 471 1 1 . 1 1 153 153 TYR CA C 153 64.391 64.391 59.389 5.003 18493 472 1 1 . 1 1 153 153 TYR CB C 153 39.553 39.553 37.628 1.925 18493 473 1 1 . 1 1 153 153 TYR H H 153 8.680 8.680 7.719 0.961 18493 474 1 1 . 1 1 154 154 LEU N N 154 122.327 122.327 122.114 0.213 18493 475 1 1 . 1 1 154 154 LEU C C 154 177.336 177.336 178.891 -1.555 18493 476 1 1 . 1 1 154 154 LEU CA C 154 57.905 57.905 58.936 -1.031 18493 477 1 1 . 1 1 154 154 LEU CB C 154 42.009 42.009 42.088 -0.079 18493 478 1 1 . 1 1 155 155 ILE N N 155 119.079 119.079 119.516 -0.437 18493 479 1 1 . 1 1 155 155 ILE C C 155 177.589 177.589 178.153 -0.564 18493 480 1 1 . 1 1 155 155 ILE CA C 155 65.996 65.996 65.420 0.576 18493 481 1 1 . 1 1 155 155 ILE CB C 155 38.179 38.179 38.023 0.156 18493 482 1 1 . 1 1 156 156 VAL N N 156 117.551 117.551 121.033 -3.482 18493 483 1 1 . 1 1 156 156 VAL C C 156 176.163 176.163 177.723 -1.560 18493 484 1 1 . 1 1 156 156 VAL CA C 156 67.664 67.664 66.672 0.992 18493 485 1 1 . 1 1 156 156 VAL CB C 156 31.694 31.694 31.281 0.413 18493 486 1 1 . 1 1 157 157 ALA N N 157 122.470 122.470 122.682 -0.212 18493 487 1 1 . 1 1 157 157 ALA C C 157 179.076 179.076 179.797 -0.721 18493 488 1 1 . 1 1 157 157 ALA CA C 157 54.803 54.803 55.492 -0.688 18493 489 1 1 . 1 1 157 157 ALA CB C 157 16.120 16.120 18.338 -2.218 18493 490 1 1 . 1 1 158 158 VAL N N 158 116.045 116.045 119.345 -3.300 18493 491 1 1 . 1 1 158 158 VAL C C 158 177.491 177.491 177.867 -0.376 18493 492 1 1 . 1 1 158 158 VAL CA C 158 67.160 67.160 66.531 0.629 18493 493 1 1 . 1 1 158 158 VAL CB C 158 31.331 31.331 31.892 -0.561 18493 494 1 1 . 1 1 159 159 LEU N N 159 116.776 116.776 120.352 -3.576 18493 495 1 1 . 1 1 159 159 LEU C C 159 178.312 178.312 178.317 -0.005 18493 496 1 1 . 1 1 159 159 LEU CA C 159 57.443 57.443 58.087 -0.644 18493 497 1 1 . 1 1 159 159 LEU CB C 159 41.567 41.567 41.843 -0.276 18493 498 1 1 . 1 1 160 160 VAL N N 160 118.890 118.890 119.250 -0.360 18493 499 1 1 . 1 1 160 160 VAL C C 160 177.508 177.508 177.055 0.453 18493 500 1 1 . 1 1 160 160 VAL CA C 160 67.366 67.366 64.931 2.435 18493 501 1 1 . 1 1 160 160 VAL CB C 160 31.106 31.106 32.471 -1.365 18493 502 1 1 . 1 1 161 161 VAL N N 161 118.360 118.360 115.798 2.562 18493 503 1 1 . 1 1 161 161 VAL C C 161 176.607 176.607 176.656 -0.049 18493 504 1 1 . 1 1 161 161 VAL CA C 161 67.614 67.614 62.587 5.027 18493 505 1 1 . 1 1 161 161 VAL CB C 161 31.646 31.646 32.745 -1.099 18493 506 1 2 . 1 1 11 11 GLY N N 11 108.456 108.456 109.418 -0.962 18493 507 1 2 . 1 1 11 11 GLY H H 11 8.433 8.433 7.795 0.638 18493 508 1 2 . 1 1 12 12 ARG C C 12 178.053 178.053 178.356 -0.303 18493 509 1 2 . 1 1 12 12 ARG CA C 12 57.504 57.504 58.320 -0.816 18493 510 1 2 . 1 1 12 12 ARG CB C 12 30.522 30.522 30.354 0.168 18493 511 1 2 . 1 1 13 13 GLY N N 13 108.265 108.265 108.822 -0.557 18493 512 1 2 . 1 1 13 13 GLY C C 13 175.091 175.091 175.658 -0.567 18493 513 1 2 . 1 1 13 13 GLY CA C 13 45.326 45.326 46.441 -1.115 18493 514 1 2 . 1 1 14 14 ALA N N 14 123.181 123.181 124.869 -1.688 18493 515 1 2 . 1 1 14 14 ALA C C 14 179.173 179.173 179.459 -0.286 18493 516 1 2 . 1 1 14 14 ALA CA C 14 55.061 55.061 54.845 0.216 18493 517 1 2 . 1 1 14 14 ALA H H 14 9.285 9.285 7.832 1.453 18493 518 1 2 . 1 1 15 15 TRP N N 15 116.733 116.733 117.348 -0.615 18493 519 1 2 . 1 1 15 15 TRP C C 15 179.425 179.425 178.994 0.431 18493 520 1 2 . 1 1 15 15 TRP CA C 15 58.960 58.960 60.402 -1.442 18493 521 1 2 . 1 1 15 15 TRP CB C 15 29.529 29.529 28.520 1.009 18493 522 1 2 . 1 1 15 15 TRP H H 15 7.091 7.091 8.038 -0.947 18493 523 1 2 . 1 1 16 16 LEU N N 16 118.671 118.671 119.427 -0.756 18493 524 1 2 . 1 1 16 16 LEU C C 16 178.461 178.461 179.222 -0.761 18493 525 1 2 . 1 1 16 16 LEU CA C 16 58.246 58.246 58.198 0.048 18493 526 1 2 . 1 1 16 16 LEU CB C 16 41.369 41.369 41.770 -0.401 18493 527 1 2 . 1 1 16 16 LEU H H 16 9.180 9.180 7.932 1.248 18493 528 1 2 . 1 1 17 17 LEU N N 17 118.515 118.515 121.751 -3.236 18493 529 1 2 . 1 1 17 17 LEU C C 17 178.787 178.787 178.075 0.712 18493 530 1 2 . 1 1 17 17 LEU CA C 17 57.832 57.832 58.372 -0.540 18493 531 1 2 . 1 1 17 17 LEU CB C 17 41.395 41.395 41.366 0.029 18493 532 1 2 . 1 1 18 18 MET N N 18 120.633 120.633 118.357 2.276 18493 533 1 2 . 1 1 18 18 MET C C 18 180.469 180.469 178.300 2.169 18493 534 1 2 . 1 1 18 18 MET CA C 18 60.277 60.277 59.059 1.218 18493 535 1 2 . 1 1 18 18 MET CB C 18 31.789 31.789 32.788 -0.999 18493 536 1 2 . 1 1 19 19 ALA N N 19 123.958 123.958 122.628 1.330 18493 537 1 2 . 1 1 19 19 ALA C C 19 178.210 178.210 178.968 -0.758 18493 538 1 2 . 1 1 19 19 ALA CA C 19 55.468 55.468 55.503 -0.035 18493 539 1 2 . 1 1 19 19 ALA CB C 19 17.865 17.865 18.393 -0.528 18493 540 1 2 . 1 1 19 19 ALA H H 19 9.398 9.398 8.526 0.872 18493 541 1 2 . 1 1 20 20 PHE N N 20 118.424 118.424 116.615 1.809 18493 542 1 2 . 1 1 20 20 PHE C C 20 176.674 176.674 177.248 -0.574 18493 543 1 2 . 1 1 20 20 PHE CA C 20 62.546 62.546 59.565 2.982 18493 544 1 2 . 1 1 20 20 PHE CB C 20 38.697 38.697 37.827 0.870 18493 545 1 2 . 1 1 21 21 THR N N 21 109.220 109.220 117.500 -8.280 18493 546 1 2 . 1 1 21 21 THR C C 21 174.203 174.203 176.801 -2.598 18493 547 1 2 . 1 1 21 21 THR CA C 21 66.052 66.052 67.194 -1.141 18493 548 1 2 . 1 1 21 21 THR CB C 21 68.956 68.956 67.650 1.306 18493 549 1 2 . 1 1 22 22 ALA N N 22 123.662 123.662 124.305 -0.643 18493 550 1 2 . 1 1 22 22 ALA C C 22 179.488 179.488 178.951 0.537 18493 551 1 2 . 1 1 22 22 ALA CA C 22 54.847 54.847 54.222 0.625 18493 552 1 2 . 1 1 22 22 ALA CB C 22 17.801 17.801 18.448 -0.647 18493 553 1 2 . 1 1 23 23 LEU N N 23 118.917 118.917 120.212 -1.295 18493 554 1 2 . 1 1 23 23 LEU C C 23 178.028 178.028 179.172 -1.144 18493 555 1 2 . 1 1 23 23 LEU CA C 23 57.713 57.713 57.603 0.110 18493 556 1 2 . 1 1 23 23 LEU CB C 23 41.506 41.506 41.952 -0.446 18493 557 1 2 . 1 1 23 23 LEU H H 23 8.581 8.581 7.867 0.714 18493 558 1 2 . 1 1 24 24 ALA N N 24 119.931 119.931 122.140 -2.209 18493 559 1 2 . 1 1 24 24 ALA C C 24 180.617 180.617 179.489 1.128 18493 560 1 2 . 1 1 24 24 ALA CA C 24 55.350 55.350 55.042 0.307 18493 561 1 2 . 1 1 24 24 ALA CB C 24 17.583 17.583 18.610 -1.027 18493 562 1 2 . 1 1 25 25 LEU N N 25 119.691 119.691 118.777 0.914 18493 563 1 2 . 1 1 25 25 LEU CA C 25 58.078 58.078 57.280 0.798 18493 564 1 2 . 1 1 25 25 LEU CB C 25 43.597 43.597 41.533 2.064 18493 565 1 2 . 1 1 25 25 LEU H H 25 9.179 9.179 7.962 1.217 18493 566 1 2 . 1 1 26 26 GLU N N 26 119.651 119.651 117.134 2.517 18493 567 1 2 . 1 1 26 26 GLU C C 26 179.334 179.334 178.444 0.890 18493 568 1 2 . 1 1 26 26 GLU CA C 26 59.584 59.584 58.548 1.036 18493 569 1 2 . 1 1 26 26 GLU CB C 26 27.202 27.202 29.186 -1.984 18493 570 1 2 . 1 1 27 27 LEU N N 27 119.661 119.661 119.126 0.535 18493 571 1 2 . 1 1 27 27 LEU CA C 27 57.887 57.887 57.532 0.355 18493 572 1 2 . 1 1 27 27 LEU CB C 27 41.591 41.591 42.349 -0.758 18493 573 1 2 . 1 1 27 27 LEU H H 27 9.410 9.410 7.414 1.996 18493 574 1 2 . 1 1 28 28 THR N N 28 118.484 118.484 114.298 4.186 18493 575 1 2 . 1 1 28 28 THR C C 28 175.898 175.898 176.707 -0.809 18493 576 1 2 . 1 1 28 28 THR CA C 28 67.459 67.459 66.325 1.134 18493 577 1 2 . 1 1 28 28 THR CB C 28 67.948 67.948 67.898 0.050 18493 578 1 2 . 1 1 29 29 ALA N N 29 122.643 122.643 124.877 -2.234 18493 579 1 2 . 1 1 29 29 ALA C C 29 179.717 179.717 179.242 0.475 18493 580 1 2 . 1 1 29 29 ALA CA C 29 55.919 55.919 54.716 1.203 18493 581 1 2 . 1 1 29 29 ALA CB C 29 16.837 16.837 18.071 -1.234 18493 582 1 2 . 1 1 29 29 ALA H H 29 8.302 8.302 7.600 0.702 18493 583 1 2 . 1 1 30 30 LEU N N 30 117.408 117.408 116.360 1.048 18493 584 1 2 . 1 1 30 30 LEU C C 30 178.143 178.143 177.667 0.476 18493 585 1 2 . 1 1 30 30 LEU CA C 30 57.384 57.384 55.624 1.760 18493 586 1 2 . 1 1 30 30 LEU CB C 30 41.679 41.679 42.354 -0.675 18493 587 1 2 . 1 1 30 30 LEU H H 30 8.412 8.412 8.120 0.292 18493 588 1 2 . 1 1 31 31 TRP N N 31 125.692 125.692 120.183 5.509 18493 589 1 2 . 1 1 31 31 TRP C C 31 179.053 179.053 176.592 2.461 18493 590 1 2 . 1 1 31 31 TRP CA C 31 59.005 59.005 60.402 -1.397 18493 591 1 2 . 1 1 31 31 TRP CB C 31 28.142 28.142 29.704 -1.562 18493 592 1 2 . 1 1 31 31 TRP H H 31 9.157 9.157 7.945 1.212 18493 593 1 2 . 1 1 32 32 PHE N N 32 119.195 119.195 118.517 0.678 18493 594 1 2 . 1 1 32 32 PHE CA C 32 61.557 61.557 59.928 1.629 18493 595 1 2 . 1 1 32 32 PHE CB C 32 38.384 38.384 37.550 0.834 18493 596 1 2 . 1 1 32 32 PHE H H 32 9.374 9.374 7.436 1.938 18493 597 1 2 . 1 1 33 33 GLN C C 33 177.477 177.477 174.238 3.239 18493 598 1 2 . 1 1 33 33 GLN CA C 33 56.613 56.613 57.939 -1.326 18493 599 1 2 . 1 1 33 33 GLN CB C 33 29.433 29.433 27.076 2.357 18493 600 1 2 . 1 1 34 34 HIS N N 34 115.948 115.948 117.390 -1.442 18493 601 1 2 . 1 1 34 34 HIS C C 34 175.548 175.548 177.499 -1.951 18493 602 1 2 . 1 1 34 34 HIS CA C 34 58.733 58.733 58.408 0.325 18493 603 1 2 . 1 1 34 34 HIS CB C 34 32.084 32.084 29.875 2.209 18493 604 1 2 . 1 1 34 34 HIS H H 34 9.621 9.621 7.974 1.647 18493 605 1 2 . 1 1 35 35 VAL N N 35 116.902 116.902 119.547 -2.645 18493 606 1 2 . 1 1 35 35 VAL C C 35 177.853 177.853 177.366 0.487 18493 607 1 2 . 1 1 35 35 VAL CA C 35 64.075 64.075 64.263 -0.188 18493 608 1 2 . 1 1 35 35 VAL CB C 35 30.626 30.626 31.468 -0.842 18493 609 1 2 . 1 1 36 36 MET N N 36 114.145 114.145 117.714 -3.569 18493 610 1 2 . 1 1 36 36 MET C C 36 175.905 175.905 174.878 1.027 18493 611 1 2 . 1 1 36 36 MET H H 36 7.605 7.605 7.670 -0.065 18493 612 1 2 . 1 1 37 37 LEU N N 37 111.740 111.740 117.273 -5.533 18493 613 1 2 . 1 1 37 37 LEU H H 37 7.121 7.121 7.598 -0.477 18493 614 1 2 . 1 1 38 38 LEU C C 38 176.457 176.457 174.513 1.944 18493 615 1 2 . 1 1 39 39 LYS N N 39 121.418 121.418 118.877 2.541 18493 616 1 2 . 1 1 39 39 LYS CA C 39 57.471 57.471 56.809 0.662 18493 617 1 2 . 1 1 39 39 LYS H H 39 9.359 9.359 8.403 0.956 18493 618 1 2 . 1 1 40 40 PRO CA C 40 60.451 60.451 64.911 -4.460 18493 619 1 2 . 1 1 42 42 VAL N N 42 118.166 118.166 115.193 2.973 18493 620 1 2 . 1 1 42 42 VAL C C 42 179.261 179.261 176.156 3.105 18493 621 1 2 . 1 1 42 42 VAL CA C 42 67.223 67.223 64.481 2.742 18493 622 1 2 . 1 1 42 42 VAL CB C 42 30.941 30.941 29.916 1.025 18493 623 1 2 . 1 1 43 43 LEU N N 43 115.946 115.946 122.380 -6.434 18493 624 1 2 . 1 1 43 43 LEU C C 43 178.293 178.293 178.734 -0.441 18493 625 1 2 . 1 1 43 43 LEU CA C 43 57.129 57.129 57.431 -0.302 18493 626 1 2 . 1 1 43 43 LEU CB C 43 41.030 41.030 41.527 -0.497 18493 627 1 2 . 1 1 44 44 CYS N N 44 115.006 115.006 119.029 -4.023 18493 628 1 2 . 1 1 44 44 CYS C C 44 177.484 177.484 177.338 0.146 18493 629 1 2 . 1 1 44 44 CYS CA C 44 59.760 59.760 62.310 -2.550 18493 630 1 2 . 1 1 44 44 CYS CB C 44 30.651 30.651 25.645 5.006 18493 631 1 2 . 1 1 44 44 CYS H H 44 7.683 7.683 8.474 -0.791 18493 632 1 2 . 1 1 45 45 ILE N N 45 119.384 119.384 121.242 -1.858 18493 633 1 2 . 1 1 45 45 ILE C C 45 179.575 179.575 176.668 2.907 18493 634 1 2 . 1 1 45 45 ILE CA C 45 62.068 62.068 65.165 -3.097 18493 635 1 2 . 1 1 45 45 ILE CB C 45 33.583 33.583 37.889 -4.306 18493 636 1 2 . 1 1 46 46 TYR N N 46 120.126 120.126 119.593 0.533 18493 637 1 2 . 1 1 46 46 TYR C C 46 178.397 178.397 176.824 1.573 18493 638 1 2 . 1 1 46 46 TYR CA C 46 59.129 59.129 60.720 -1.591 18493 639 1 2 . 1 1 46 46 TYR CB C 46 35.347 35.347 38.594 -3.247 18493 640 1 2 . 1 1 46 46 TYR H H 46 8.958 8.958 7.930 1.028 18493 641 1 2 . 1 1 47 47 GLU N N 47 121.779 121.779 117.653 4.126 18493 642 1 2 . 1 1 47 47 GLU C C 47 179.907 179.907 178.918 0.989 18493 643 1 2 . 1 1 47 47 GLU CA C 47 57.985 57.985 57.569 0.416 18493 644 1 2 . 1 1 47 47 GLU CB C 47 27.290 27.290 29.792 -2.502 18493 645 1 2 . 1 1 47 47 GLU H H 47 9.681 9.681 8.006 1.675 18493 646 1 2 . 1 1 48 48 ARG N N 48 119.188 119.188 121.862 -2.674 18493 647 1 2 . 1 1 48 48 ARG C C 48 181.638 181.638 178.290 3.348 18493 648 1 2 . 1 1 48 48 ARG CA C 48 60.299 60.299 59.407 0.892 18493 649 1 2 . 1 1 48 48 ARG CB C 48 30.167 30.167 30.091 0.076 18493 650 1 2 . 1 1 48 48 ARG H H 48 9.213 9.213 8.564 0.649 18493 651 1 2 . 1 1 49 49 VAL N N 49 121.326 121.326 118.376 2.950 18493 652 1 2 . 1 1 49 49 VAL C C 49 177.326 177.326 177.558 -0.232 18493 653 1 2 . 1 1 49 49 VAL CA C 49 66.624 66.624 65.638 0.986 18493 654 1 2 . 1 1 49 49 VAL CB C 49 31.280 31.280 30.961 0.319 18493 655 1 2 . 1 1 50 50 ALA N N 50 122.955 122.955 122.873 0.082 18493 656 1 2 . 1 1 50 50 ALA C C 50 179.594 179.594 179.689 -0.095 18493 657 1 2 . 1 1 50 50 ALA CA C 50 55.902 55.902 55.425 0.477 18493 658 1 2 . 1 1 50 50 ALA CB C 50 16.623 16.623 18.326 -1.702 18493 659 1 2 . 1 1 51 51 LEU N N 51 115.737 115.737 117.347 -1.610 18493 660 1 2 . 1 1 51 51 LEU C C 51 177.990 177.990 178.076 -0.086 18493 661 1 2 . 1 1 51 51 LEU CA C 51 57.285 57.285 57.678 -0.393 18493 662 1 2 . 1 1 51 51 LEU CB C 51 41.369 41.369 39.735 1.634 18493 663 1 2 . 1 1 52 52 PHE N N 52 122.707 122.707 120.251 2.456 18493 664 1 2 . 1 1 52 52 PHE C C 52 179.142 179.142 177.714 1.428 18493 665 1 2 . 1 1 52 52 PHE CA C 52 62.518 62.518 61.810 0.708 18493 666 1 2 . 1 1 52 52 PHE CB C 52 38.538 38.538 37.711 0.827 18493 667 1 2 . 1 1 52 52 PHE H H 52 8.863 8.863 7.558 1.305 18493 668 1 2 . 1 1 53 53 GLY N N 53 110.801 110.801 107.360 3.441 18493 669 1 2 . 1 1 53 53 GLY C C 53 175.378 175.378 176.524 -1.146 18493 670 1 2 . 1 1 53 53 GLY CA C 53 48.024 48.024 47.328 0.696 18493 671 1 2 . 1 1 53 53 GLY H H 53 9.027 9.027 7.879 1.148 18493 672 1 2 . 1 1 54 54 VAL N N 54 121.926 121.926 121.985 -0.059 18493 673 1 2 . 1 1 54 54 VAL C C 54 177.035 177.035 177.372 -0.337 18493 674 1 2 . 1 1 54 54 VAL CA C 54 67.448 67.448 65.165 2.283 18493 675 1 2 . 1 1 54 54 VAL CB C 54 31.246 31.246 31.147 0.099 18493 676 1 2 . 1 1 54 54 VAL H H 54 7.948 7.948 7.420 0.528 18493 677 1 2 . 1 1 55 55 LEU N N 55 119.894 119.894 120.807 -0.913 18493 678 1 2 . 1 1 55 55 LEU C C 55 178.175 178.175 178.623 -0.448 18493 679 1 2 . 1 1 55 55 LEU CA C 55 58.490 58.490 58.057 0.433 18493 680 1 2 . 1 1 55 55 LEU CB C 55 42.145 42.145 40.764 1.381 18493 681 1 2 . 1 1 55 55 LEU H H 55 8.646 8.646 9.081 -0.435 18493 682 1 2 . 1 1 56 56 GLY N N 56 106.262 106.262 107.180 -0.918 18493 683 1 2 . 1 1 56 56 GLY C C 56 174.618 174.618 175.600 -0.982 18493 684 1 2 . 1 1 56 56 GLY CA C 56 47.533 47.533 47.706 -0.173 18493 685 1 2 . 1 1 57 57 ALA N N 57 123.002 123.002 123.778 -0.776 18493 686 1 2 . 1 1 57 57 ALA C C 57 178.688 178.688 179.014 -0.326 18493 687 1 2 . 1 1 57 57 ALA CA C 57 55.548 55.548 54.697 0.851 18493 688 1 2 . 1 1 57 57 ALA CB C 57 18.065 18.065 18.387 -0.322 18493 689 1 2 . 1 1 58 58 ALA N N 58 118.866 118.866 121.049 -2.183 18493 690 1 2 . 1 1 58 58 ALA C C 58 179.348 179.348 179.426 -0.078 18493 691 1 2 . 1 1 58 58 ALA CA C 58 54.763 54.763 54.222 0.541 18493 692 1 2 . 1 1 58 58 ALA CB C 58 17.898 17.898 18.395 -0.497 18493 693 1 2 . 1 1 58 58 ALA H H 58 8.674 8.674 7.411 1.263 18493 694 1 2 . 1 1 59 59 LEU N N 59 115.384 115.384 119.857 -4.473 18493 695 1 2 . 1 1 59 59 LEU C C 59 177.654 177.654 178.566 -0.912 18493 696 1 2 . 1 1 59 59 LEU CA C 59 57.387 57.387 57.669 -0.281 18493 697 1 2 . 1 1 59 59 LEU CB C 59 41.209 41.209 42.786 -1.577 18493 698 1 2 . 1 1 60 60 ILE N N 60 116.140 116.140 116.751 -0.611 18493 699 1 2 . 1 1 60 60 ILE C C 60 180.024 180.024 178.282 1.742 18493 700 1 2 . 1 1 60 60 ILE CA C 60 64.263 64.263 64.717 -0.454 18493 701 1 2 . 1 1 60 60 ILE CB C 60 37.240 37.240 37.917 -0.677 18493 702 1 2 . 1 1 61 61 GLY N N 61 110.127 110.127 106.398 3.729 18493 703 1 2 . 1 1 61 61 GLY C C 61 173.716 173.716 174.082 -0.366 18493 704 1 2 . 1 1 61 61 GLY CA C 61 45.617 45.617 45.143 0.474 18493 705 1 2 . 1 1 61 61 GLY H H 61 9.046 9.046 7.953 1.093 18493 706 1 2 . 1 1 62 62 ALA N N 62 118.949 118.949 122.516 -3.567 18493 707 1 2 . 1 1 62 62 ALA C C 62 176.192 176.192 178.251 -2.059 18493 708 1 2 . 1 1 62 62 ALA CA C 62 53.268 53.268 53.024 0.244 18493 709 1 2 . 1 1 62 62 ALA CB C 62 19.138 19.138 19.509 -0.371 18493 710 1 2 . 1 1 62 62 ALA H H 62 8.066 8.066 7.194 0.872 18493 711 1 2 . 1 1 63 63 ILE N N 63 116.800 116.800 118.408 -1.608 18493 712 1 2 . 1 1 63 63 ILE CA C 63 66.739 66.739 62.427 4.312 18493 713 1 2 . 1 1 63 63 ILE CB C 63 37.947 37.947 36.959 0.988 18493 714 1 2 . 1 1 64 64 ALA N N 64 123.957 123.957 121.327 2.630 18493 715 1 2 . 1 1 64 64 ALA CA C 64 52.934 52.934 53.746 -0.812 18493 716 1 2 . 1 1 64 64 ALA CB C 64 19.428 19.428 16.625 2.803 18493 717 1 2 . 1 1 65 65 PRO CA C 65 65.350 65.350 63.554 1.796 18493 718 1 2 . 1 1 66 66 LYS N N 66 116.618 116.618 113.355 3.263 18493 719 1 2 . 1 1 66 66 LYS C C 66 177.500 177.500 174.926 2.574 18493 720 1 2 . 1 1 66 66 LYS CA C 66 56.547 56.547 57.414 -0.867 18493 721 1 2 . 1 1 66 66 LYS CB C 66 30.522 30.522 32.319 -1.798 18493 722 1 2 . 1 1 67 67 THR CA C 67 60.452 60.452 62.138 -1.686 18493 723 1 2 . 1 1 67 67 THR CB C 67 69.948 69.948 68.910 1.038 18493 724 1 2 . 1 1 68 68 PRO C C 68 177.070 177.070 176.741 0.329 18493 725 1 2 . 1 1 68 68 PRO CA C 68 63.315 63.315 61.914 1.401 18493 726 1 2 . 1 1 68 68 PRO CB C 68 32.458 32.458 32.331 0.127 18493 727 1 2 . 1 1 69 69 LEU N N 69 121.517 121.517 116.566 4.951 18493 728 1 2 . 1 1 69 69 LEU C C 69 179.448 179.448 177.119 2.329 18493 729 1 2 . 1 1 69 69 LEU CA C 69 57.389 57.389 55.941 1.448 18493 730 1 2 . 1 1 69 69 LEU CB C 69 42.737 42.737 41.288 1.449 18493 731 1 2 . 1 1 69 69 LEU H H 69 8.882 8.882 7.917 0.965 18493 732 1 2 . 1 1 70 70 ARG N N 70 114.028 114.028 118.962 -4.934 18493 733 1 2 . 1 1 70 70 ARG C C 70 177.925 177.925 177.135 0.790 18493 734 1 2 . 1 1 70 70 ARG CA C 70 58.429 58.429 56.366 2.063 18493 735 1 2 . 1 1 70 70 ARG CB C 70 29.391 29.391 29.342 0.049 18493 736 1 2 . 1 1 70 70 ARG H H 70 8.202 8.202 7.955 0.247 18493 737 1 2 . 1 1 71 71 TYR N N 71 121.740 121.740 117.862 3.878 18493 738 1 2 . 1 1 71 71 TYR CA C 71 57.374 57.374 56.075 1.299 18493 739 1 2 . 1 1 71 71 TYR H H 71 8.136 8.136 7.197 0.939 18493 740 1 2 . 1 1 72 72 VAL N N 72 118.416 118.416 122.327 -3.911 18493 741 1 2 . 1 1 72 72 VAL C C 72 177.702 177.702 176.995 0.707 18493 742 1 2 . 1 1 72 72 VAL CA C 72 66.098 66.098 64.362 1.736 18493 743 1 2 . 1 1 72 72 VAL CB C 72 31.343 31.343 31.653 -0.310 18493 744 1 2 . 1 1 73 73 ALA N N 73 120.283 120.283 122.272 -1.989 18493 745 1 2 . 1 1 73 73 ALA C C 73 179.763 179.763 179.831 -0.068 18493 746 1 2 . 1 1 73 73 ALA CA C 73 55.785 55.785 55.399 0.386 18493 747 1 2 . 1 1 73 73 ALA CB C 73 19.265 19.265 18.574 0.691 18493 748 1 2 . 1 1 73 73 ALA H H 73 9.015 9.015 8.281 0.734 18493 749 1 2 . 1 1 74 74 MET N N 74 115.547 115.547 117.639 -2.092 18493 750 1 2 . 1 1 74 74 MET C C 74 177.223 177.223 178.661 -1.438 18493 751 1 2 . 1 1 74 74 MET CA C 74 61.023 61.023 56.352 4.671 18493 752 1 2 . 1 1 74 74 MET CB C 74 33.777 33.777 31.022 2.755 18493 753 1 2 . 1 1 74 74 MET H H 74 8.163 8.163 7.852 0.311 18493 754 1 2 . 1 1 75 75 VAL N N 75 118.690 118.690 120.596 -1.906 18493 755 1 2 . 1 1 75 75 VAL C C 75 177.166 177.166 177.707 -0.541 18493 756 1 2 . 1 1 75 75 VAL CA C 75 67.581 67.581 66.019 1.562 18493 757 1 2 . 1 1 75 75 VAL CB C 75 31.408 31.408 31.345 0.063 18493 758 1 2 . 1 1 75 75 VAL H H 75 7.554 7.554 8.204 -0.650 18493 759 1 2 . 1 1 76 76 ILE N N 76 118.959 118.959 120.107 -1.148 18493 760 1 2 . 1 1 76 76 ILE C C 76 178.680 178.680 177.033 1.647 18493 761 1 2 . 1 1 76 76 ILE CA C 76 65.839 65.839 64.565 1.274 18493 762 1 2 . 1 1 76 76 ILE CB C 76 38.414 38.414 37.932 0.482 18493 763 1 2 . 1 1 77 77 TRP N N 77 125.440 125.440 121.385 4.055 18493 764 1 2 . 1 1 77 77 TRP C C 77 177.153 177.153 178.107 -0.954 18493 765 1 2 . 1 1 77 77 TRP CA C 77 58.779 58.779 61.375 -2.596 18493 766 1 2 . 1 1 77 77 TRP CB C 77 30.494 30.494 29.969 0.525 18493 767 1 2 . 1 1 77 77 TRP H H 77 9.515 9.515 7.887 1.628 18493 768 1 2 . 1 1 78 78 LEU N N 78 118.968 118.968 121.785 -2.817 18493 769 1 2 . 1 1 78 78 LEU C C 78 178.381 178.381 178.418 -0.037 18493 770 1 2 . 1 1 78 78 LEU CA C 78 58.041 58.041 58.839 -0.798 18493 771 1 2 . 1 1 78 78 LEU CB C 78 43.807 43.807 41.137 2.670 18493 772 1 2 . 1 1 78 78 LEU H H 78 9.367 9.367 8.436 0.931 18493 773 1 2 . 1 1 79 79 TYR N N 79 118.181 118.181 120.117 -1.936 18493 774 1 2 . 1 1 79 79 TYR C C 79 176.777 176.777 177.882 -1.105 18493 775 1 2 . 1 1 79 79 TYR CA C 79 62.849 62.849 61.967 0.882 18493 776 1 2 . 1 1 80 80 SER N N 80 114.286 114.286 115.642 -1.356 18493 777 1 2 . 1 1 80 80 SER C C 80 175.943 175.943 176.932 -0.989 18493 778 1 2 . 1 1 80 80 SER CA C 80 63.515 63.515 61.552 1.963 18493 779 1 2 . 1 1 80 80 SER CB C 80 63.941 63.941 62.903 1.038 18493 780 1 2 . 1 1 81 81 ALA N N 81 121.070 121.070 124.040 -2.970 18493 781 1 2 . 1 1 81 81 ALA C C 81 178.208 178.208 179.283 -1.075 18493 782 1 2 . 1 1 81 81 ALA CA C 81 55.224 55.224 54.986 0.238 18493 783 1 2 . 1 1 81 81 ALA CB C 81 17.897 17.897 18.439 -0.543 18493 784 1 2 . 1 1 82 82 PHE N N 82 117.560 117.560 120.561 -3.001 18493 785 1 2 . 1 1 82 82 PHE C C 82 176.975 176.975 177.275 -0.300 18493 786 1 2 . 1 1 82 82 PHE CA C 82 62.132 62.132 61.081 1.051 18493 787 1 2 . 1 1 82 82 PHE CB C 82 38.497 38.497 39.129 -0.632 18493 788 1 2 . 1 1 83 83 ARG N N 83 117.110 117.110 118.823 -1.713 18493 789 1 2 . 1 1 83 83 ARG C C 83 178.637 178.637 178.546 0.091 18493 790 1 2 . 1 1 83 83 ARG CA C 83 60.291 60.291 58.778 1.513 18493 791 1 2 . 1 1 83 83 ARG CB C 83 28.625 28.625 29.145 -0.520 18493 792 1 2 . 1 1 84 84 GLY N N 84 105.915 105.915 106.349 -0.434 18493 793 1 2 . 1 1 84 84 GLY C C 84 177.091 177.091 175.737 1.354 18493 794 1 2 . 1 1 84 84 GLY CA C 84 46.128 46.128 46.559 -0.431 18493 795 1 2 . 1 1 85 85 VAL N N 85 124.985 124.985 123.032 1.953 18493 796 1 2 . 1 1 85 85 VAL C C 85 176.387 176.387 177.732 -1.345 18493 797 1 2 . 1 1 85 85 VAL CA C 85 66.960 66.960 65.040 1.920 18493 798 1 2 . 1 1 85 85 VAL CB C 85 31.066 31.066 31.449 -0.383 18493 799 1 2 . 1 1 86 86 GLN N N 86 116.522 116.522 118.831 -2.309 18493 800 1 2 . 1 1 86 86 GLN C C 86 179.586 179.586 178.731 0.855 18493 801 1 2 . 1 1 86 86 GLN CA C 86 59.505 59.505 58.971 0.534 18493 802 1 2 . 1 1 86 86 GLN CB C 86 28.762 28.762 28.190 0.572 18493 803 1 2 . 1 1 87 87 LEU N N 87 121.211 121.211 119.254 1.957 18493 804 1 2 . 1 1 87 87 LEU C C 87 178.396 178.396 179.626 -1.230 18493 805 1 2 . 1 1 87 87 LEU CA C 87 57.847 57.847 57.553 0.293 18493 806 1 2 . 1 1 87 87 LEU CB C 87 41.924 41.924 41.178 0.746 18493 807 1 2 . 1 1 87 87 LEU H H 87 8.955 8.955 7.607 1.348 18493 808 1 2 . 1 1 88 88 THR N N 88 108.251 108.251 114.700 -6.449 18493 809 1 2 . 1 1 88 88 THR C C 88 180.013 180.013 176.612 3.401 18493 810 1 2 . 1 1 88 88 THR CA C 88 65.112 65.112 65.858 -0.746 18493 811 1 2 . 1 1 88 88 THR CB C 88 68.805 68.805 68.682 0.123 18493 812 1 2 . 1 1 88 88 THR H H 88 8.764 8.764 7.804 0.960 18493 813 1 2 . 1 1 89 89 TYR N N 89 127.947 127.947 123.103 4.844 18493 814 1 2 . 1 1 89 89 TYR C C 89 177.244 177.244 177.665 -0.421 18493 815 1 2 . 1 1 89 89 TYR H H 89 9.868 9.868 8.247 1.621 18493 816 1 2 . 1 1 90 90 GLU N N 90 121.163 121.163 117.662 3.501 18493 817 1 2 . 1 1 90 90 GLU C C 90 178.671 178.671 178.592 0.079 18493 818 1 2 . 1 1 90 90 GLU H H 90 8.515 8.515 8.027 0.488 18493 819 1 2 . 1 1 91 91 HIS N N 91 120.459 120.459 119.793 0.666 18493 820 1 2 . 1 1 91 91 HIS C C 91 177.605 177.605 177.633 -0.028 18493 821 1 2 . 1 1 91 91 HIS CA C 91 57.085 57.085 59.786 -2.701 18493 822 1 2 . 1 1 91 91 HIS CB C 91 34.128 34.128 29.985 4.143 18493 823 1 2 . 1 1 91 91 HIS H H 91 9.102 9.102 7.773 1.329 18493 824 1 2 . 1 1 92 92 THR N N 92 115.463 115.463 115.183 0.280 18493 825 1 2 . 1 1 92 92 THR C C 92 176.189 176.189 176.764 -0.575 18493 826 1 2 . 1 1 92 92 THR CA C 92 67.058 67.058 65.560 1.498 18493 827 1 2 . 1 1 92 92 THR CB C 92 68.564 68.564 68.755 -0.191 18493 828 1 2 . 1 1 92 92 THR H H 92 9.550 9.550 8.340 1.210 18493 829 1 2 . 1 1 93 93 MET N N 93 117.153 117.153 122.015 -4.862 18493 830 1 2 . 1 1 93 93 MET C C 93 176.972 176.972 178.804 -1.832 18493 831 1 2 . 1 1 93 93 MET CA C 93 62.369 62.369 57.154 5.215 18493 832 1 2 . 1 1 93 93 MET CB C 93 33.515 33.515 30.773 2.742 18493 833 1 2 . 1 1 94 94 LEU N N 94 117.981 117.981 118.088 -0.107 18493 834 1 2 . 1 1 94 94 LEU CA C 94 57.489 57.489 57.467 0.022 18493 835 1 2 . 1 1 94 94 LEU CB C 94 41.432 41.432 40.710 0.722 18493 836 1 2 . 1 1 94 94 LEU H H 94 8.497 8.497 8.582 -0.085 18493 837 1 2 . 1 1 95 95 GLN C C 95 178.331 178.331 176.570 1.761 18493 838 1 2 . 1 1 95 95 GLN CA C 95 57.604 57.604 57.913 -0.308 18493 839 1 2 . 1 1 95 95 GLN CB C 95 28.200 28.200 28.983 -0.783 18493 840 1 2 . 1 1 96 96 LEU N N 96 118.174 118.174 114.959 3.215 18493 841 1 2 . 1 1 96 96 LEU C C 96 177.842 177.842 175.225 2.617 18493 842 1 2 . 1 1 96 96 LEU CA C 96 57.747 57.747 54.480 3.267 18493 843 1 2 . 1 1 96 96 LEU CB C 96 41.721 41.721 43.345 -1.624 18493 844 1 2 . 1 1 97 97 TYR N N 97 117.359 117.359 119.347 -1.988 18493 845 1 2 . 1 1 97 97 TYR CA C 97 57.581 57.581 55.972 1.609 18493 846 1 2 . 1 1 97 97 TYR H H 97 8.485 8.485 7.499 0.986 18493 847 1 2 . 1 1 98 98 PRO CA C 98 63.847 63.847 63.035 0.812 18493 848 1 2 . 1 1 99 99 SER CA C 99 58.145 58.145 58.599 -0.454 18493 849 1 2 . 1 1 99 99 SER CB C 99 64.506 64.506 62.932 1.574 18493 850 1 2 . 1 1 101 101 PHE C C 101 174.992 174.992 176.367 -1.375 18493 851 1 2 . 1 1 102 102 ALA N N 102 120.614 120.614 125.665 -5.051 18493 852 1 2 . 1 1 102 102 ALA C C 102 176.810 176.810 176.325 0.485 18493 853 1 2 . 1 1 102 102 ALA CA C 102 54.355 54.355 52.587 1.768 18493 854 1 2 . 1 1 102 102 ALA H H 102 7.383 7.383 6.229 1.154 18493 855 1 2 . 1 1 103 103 THR N N 103 112.507 112.507 114.385 -1.878 18493 856 1 2 . 1 1 103 103 THR C C 103 175.666 175.666 172.963 2.703 18493 857 1 2 . 1 1 103 103 THR CA C 103 59.838 59.838 61.266 -1.428 18493 858 1 2 . 1 1 103 103 THR CB C 103 67.623 67.623 70.879 -3.256 18493 859 1 2 . 1 1 103 103 THR H H 103 9.278 9.278 8.305 0.973 18493 860 1 2 . 1 1 104 104 CYS N N 104 122.754 122.754 120.499 2.255 18493 861 1 2 . 1 1 104 104 CYS C C 104 174.474 174.474 174.601 -0.127 18493 862 1 2 . 1 1 104 104 CYS CA C 104 64.988 64.988 57.783 7.205 18493 863 1 2 . 1 1 104 104 CYS CB C 104 42.988 42.988 29.835 13.153 18493 864 1 2 . 1 1 104 104 CYS H H 104 9.934 9.934 8.499 1.435 18493 865 1 2 . 1 1 105 105 ASP N N 105 121.350 121.350 121.654 -0.304 18493 866 1 2 . 1 1 105 105 ASP CB C 105 41.030 41.030 40.326 0.704 18493 867 1 2 . 1 1 105 105 ASP H H 105 8.153 8.153 8.823 -0.670 18493 868 1 2 . 1 1 115 115 PRO CA C 115 61.148 61.148 63.792 -2.644 18493 869 1 2 . 1 1 115 115 PRO CB C 115 30.280 30.280 32.672 -2.392 18493 870 1 2 . 1 1 116 116 LEU C C 116 178.163 178.163 175.542 2.621 18493 871 1 2 . 1 1 116 116 LEU CA C 116 58.746 58.746 55.548 3.198 18493 872 1 2 . 1 1 116 116 LEU CB C 116 42.932 42.932 42.163 0.769 18493 873 1 2 . 1 1 117 117 ASP N N 117 116.302 116.302 119.921 -3.619 18493 874 1 2 . 1 1 117 117 ASP C C 117 177.528 177.528 176.581 0.947 18493 875 1 2 . 1 1 117 117 ASP CB C 117 41.252 41.252 41.206 0.046 18493 876 1 2 . 1 1 118 118 LYS N N 118 118.983 118.983 120.512 -1.529 18493 877 1 2 . 1 1 118 118 LYS H H 118 7.538 7.538 8.238 -0.700 18493 878 1 2 . 1 1 119 119 TRP C C 119 177.867 177.867 176.013 1.854 18493 879 1 2 . 1 1 120 120 VAL N N 120 113.149 113.149 113.473 -0.324 18493 880 1 2 . 1 1 120 120 VAL CA C 120 58.651 58.651 59.276 -0.625 18493 881 1 2 . 1 1 120 120 VAL CB C 120 31.821 31.821 31.858 -0.037 18493 882 1 2 . 1 1 120 120 VAL H H 120 8.936 8.936 7.732 1.204 18493 883 1 2 . 1 1 121 121 PRO C C 121 178.888 178.888 177.367 1.521 18493 884 1 2 . 1 1 121 121 PRO CA C 121 65.185 65.185 63.673 1.512 18493 885 1 2 . 1 1 121 121 PRO CB C 121 31.781 31.781 31.945 -0.164 18493 886 1 2 . 1 1 122 122 GLN N N 122 116.304 116.304 116.057 0.247 18493 887 1 2 . 1 1 122 122 GLN C C 122 174.326 174.326 176.702 -2.376 18493 888 1 2 . 1 1 122 122 GLN CA C 122 58.463 58.463 58.016 0.447 18493 889 1 2 . 1 1 122 122 GLN H H 122 9.809 9.809 8.443 1.366 18493 890 1 2 . 1 1 123 123 VAL N N 123 113.254 113.254 117.651 -4.397 18493 891 1 2 . 1 1 123 123 VAL C C 123 175.777 175.777 176.341 -0.564 18493 892 1 2 . 1 1 123 123 VAL CA C 123 61.689 61.689 63.523 -1.834 18493 893 1 2 . 1 1 123 123 VAL CB C 123 35.373 35.373 32.002 3.372 18493 894 1 2 . 1 1 123 123 VAL H H 123 8.219 8.219 7.400 0.819 18493 895 1 2 . 1 1 124 124 PHE N N 124 112.242 112.242 119.086 -6.844 18493 896 1 2 . 1 1 124 124 PHE C C 124 172.759 172.759 175.303 -2.544 18493 897 1 2 . 1 1 124 124 PHE CB C 124 39.318 39.318 39.122 0.196 18493 898 1 2 . 1 1 125 125 VAL N N 125 115.233 115.233 120.641 -5.408 18493 899 1 2 . 1 1 125 125 VAL C C 125 177.034 177.034 174.364 2.670 18493 900 1 2 . 1 1 125 125 VAL CA C 125 61.950 61.950 61.973 -0.023 18493 901 1 2 . 1 1 125 125 VAL CB C 125 33.376 33.376 34.165 -0.789 18493 902 1 2 . 1 1 125 125 VAL H H 125 7.799 7.799 8.364 -0.565 18493 903 1 2 . 1 1 126 126 ALA N N 126 130.709 130.709 129.481 1.228 18493 904 1 2 . 1 1 126 126 ALA C C 126 175.920 175.920 177.405 -1.485 18493 905 1 2 . 1 1 126 126 ALA CA C 126 54.493 54.493 52.453 2.040 18493 906 1 2 . 1 1 126 126 ALA CB C 126 17.215 17.215 19.583 -2.368 18493 907 1 2 . 1 1 126 126 ALA H H 126 9.014 9.014 8.216 0.798 18493 908 1 2 . 1 1 127 127 SER N N 127 112.716 112.716 114.511 -1.795 18493 909 1 2 . 1 1 127 127 SER CA C 127 58.101 58.101 59.678 -1.577 18493 910 1 2 . 1 1 127 127 SER CB C 127 64.539 64.539 63.605 0.934 18493 911 1 2 . 1 1 127 127 SER H H 127 8.145 8.145 8.180 -0.035 18493 912 1 2 . 1 1 128 128 GLY N N 128 106.487 106.487 106.722 -0.235 18493 913 1 2 . 1 1 128 128 GLY C C 128 177.047 177.047 173.356 3.691 18493 914 1 2 . 1 1 128 128 GLY CA C 128 46.296 46.296 45.138 1.158 18493 915 1 2 . 1 1 128 128 GLY H H 128 8.595 8.595 8.742 -0.147 18493 916 1 2 . 1 1 129 129 ASP C C 129 177.916 177.916 174.589 3.327 18493 917 1 2 . 1 1 129 129 ASP CB C 129 43.975 43.975 40.066 3.909 18493 918 1 2 . 1 1 130 130 CYS N N 130 122.984 122.984 119.884 3.100 18493 919 1 2 . 1 1 130 130 CYS C C 130 173.312 173.312 174.386 -1.074 18493 920 1 2 . 1 1 130 130 CYS CA C 130 64.581 64.581 58.002 6.579 18493 921 1 2 . 1 1 130 130 CYS CB C 130 42.879 42.879 29.782 13.097 18493 922 1 2 . 1 1 130 130 CYS H H 130 9.948 9.948 8.432 1.516 18493 923 1 2 . 1 1 131 131 ALA N N 131 121.534 121.534 124.237 -2.703 18493 924 1 2 . 1 1 131 131 ALA CA C 131 52.640 52.640 51.550 1.090 18493 925 1 2 . 1 1 131 131 ALA CB C 131 18.497 18.497 20.246 -1.749 18493 926 1 2 . 1 1 131 131 ALA H H 131 9.869 9.869 8.154 1.715 18493 927 1 2 . 1 1 136 136 ASP C C 136 172.916 172.916 176.169 -3.253 18493 928 1 2 . 1 1 137 137 PHE N N 137 117.677 117.677 120.873 -3.196 18493 929 1 2 . 1 1 137 137 PHE CA C 137 57.310 57.310 59.719 -2.409 18493 930 1 2 . 1 1 137 137 PHE CB C 137 42.927 42.927 39.726 3.201 18493 931 1 2 . 1 1 137 137 PHE H H 137 8.959 8.959 8.749 0.210 18493 932 1 2 . 1 1 138 138 LEU CB C 138 43.547 43.547 42.799 0.748 18493 933 1 2 . 1 1 139 139 GLY C C 139 176.262 176.262 173.763 2.499 18493 934 1 2 . 1 1 139 139 GLY CA C 139 46.123 46.123 46.486 -0.362 18493 935 1 2 . 1 1 140 140 LEU N N 140 124.207 124.207 118.615 5.592 18493 936 1 2 . 1 1 140 140 LEU CB C 140 40.503 40.503 45.455 -4.952 18493 937 1 2 . 1 1 142 142 MET CA C 142 56.442 56.442 57.664 -1.222 18493 938 1 2 . 1 1 143 143 PRO CA C 143 63.254 63.254 65.126 -1.872 18493 939 1 2 . 1 1 144 144 GLN C C 144 177.307 177.307 178.354 -1.047 18493 940 1 2 . 1 1 145 145 TRP N N 145 120.795 120.795 121.092 -0.297 18493 941 1 2 . 1 1 145 145 TRP C C 145 178.709 178.709 179.008 -0.299 18493 942 1 2 . 1 1 145 145 TRP CA C 145 59.535 59.535 59.067 0.468 18493 943 1 2 . 1 1 145 145 TRP CB C 145 29.345 29.345 29.302 0.043 18493 944 1 2 . 1 1 145 145 TRP H H 145 8.386 8.386 7.854 0.532 18493 945 1 2 . 1 1 146 146 LEU N N 146 118.336 118.336 118.873 -0.537 18493 946 1 2 . 1 1 146 146 LEU C C 146 177.115 177.115 178.864 -1.749 18493 947 1 2 . 1 1 146 146 LEU CA C 146 57.793 57.793 57.775 0.018 18493 948 1 2 . 1 1 146 146 LEU CB C 146 41.616 41.616 41.976 -0.360 18493 949 1 2 . 1 1 146 146 LEU H H 146 9.033 9.033 8.863 0.170 18493 950 1 2 . 1 1 147 147 LEU N N 147 123.772 123.772 120.808 2.964 18493 951 1 2 . 1 1 147 147 LEU C C 147 178.787 178.787 178.554 0.233 18493 952 1 2 . 1 1 147 147 LEU CA C 147 58.052 58.052 57.806 0.246 18493 953 1 2 . 1 1 147 147 LEU CB C 147 41.047 41.047 40.893 0.154 18493 954 1 2 . 1 1 147 147 LEU H H 147 8.480 8.480 7.948 0.532 18493 955 1 2 . 1 1 148 148 GLY N N 148 104.457 104.457 108.407 -3.950 18493 956 1 2 . 1 1 148 148 GLY C C 148 174.667 174.667 176.126 -1.459 18493 957 1 2 . 1 1 148 148 GLY CA C 148 48.102 48.102 47.445 0.657 18493 958 1 2 . 1 1 149 149 ILE N N 149 121.815 121.815 122.524 -0.709 18493 959 1 2 . 1 1 149 149 ILE C C 149 177.725 177.725 177.383 0.342 18493 960 1 2 . 1 1 149 149 ILE CA C 149 65.997 65.997 62.907 3.090 18493 961 1 2 . 1 1 149 149 ILE CB C 149 38.262 38.262 38.063 0.199 18493 962 1 2 . 1 1 150 150 PHE N N 150 118.894 118.894 119.577 -0.683 18493 963 1 2 . 1 1 150 150 PHE C C 150 178.929 178.929 177.725 1.204 18493 964 1 2 . 1 1 150 150 PHE CA C 150 63.591 63.591 63.076 0.515 18493 965 1 2 . 1 1 150 150 PHE CB C 150 38.417 38.417 38.945 -0.528 18493 966 1 2 . 1 1 151 151 ILE N N 151 120.535 120.535 120.083 0.452 18493 967 1 2 . 1 1 151 151 ILE C C 151 177.347 177.347 177.480 -0.133 18493 968 1 2 . 1 1 151 151 ILE CA C 151 66.478 66.478 65.729 0.749 18493 969 1 2 . 1 1 151 151 ILE CB C 151 37.302 37.302 37.626 -0.324 18493 970 1 2 . 1 1 152 152 ALA N N 152 122.855 122.855 123.064 -0.209 18493 971 1 2 . 1 1 152 152 ALA C C 152 179.165 179.165 179.766 -0.601 18493 972 1 2 . 1 1 152 152 ALA CA C 152 56.272 56.272 55.333 0.939 18493 973 1 2 . 1 1 152 152 ALA CB C 152 17.993 17.993 17.831 0.162 18493 974 1 2 . 1 1 153 153 TYR N N 153 116.156 116.156 118.734 -2.578 18493 975 1 2 . 1 1 153 153 TYR C C 153 179.682 179.682 177.827 1.855 18493 976 1 2 . 1 1 153 153 TYR CA C 153 64.391 64.391 61.981 2.410 18493 977 1 2 . 1 1 153 153 TYR CB C 153 39.553 39.553 38.482 1.071 18493 978 1 2 . 1 1 153 153 TYR H H 153 8.680 8.680 7.799 0.881 18493 979 1 2 . 1 1 154 154 LEU N N 154 122.327 122.327 122.078 0.249 18493 980 1 2 . 1 1 154 154 LEU C C 154 177.336 177.336 178.728 -1.392 18493 981 1 2 . 1 1 154 154 LEU CA C 154 57.905 57.905 58.626 -0.721 18493 982 1 2 . 1 1 154 154 LEU CB C 154 42.009 42.009 42.314 -0.305 18493 983 1 2 . 1 1 155 155 ILE N N 155 119.079 119.079 116.430 2.649 18493 984 1 2 . 1 1 155 155 ILE C C 155 177.589 177.589 177.689 -0.100 18493 985 1 2 . 1 1 155 155 ILE CA C 155 65.996 65.996 65.173 0.823 18493 986 1 2 . 1 1 155 155 ILE CB C 155 38.179 38.179 37.461 0.718 18493 987 1 2 . 1 1 156 156 VAL N N 156 117.551 117.551 120.955 -3.404 18493 988 1 2 . 1 1 156 156 VAL C C 156 176.163 176.163 178.028 -1.865 18493 989 1 2 . 1 1 156 156 VAL CA C 156 67.664 67.664 66.322 1.342 18493 990 1 2 . 1 1 156 156 VAL CB C 156 31.694 31.694 30.781 0.913 18493 991 1 2 . 1 1 157 157 ALA N N 157 122.470 122.470 122.288 0.182 18493 992 1 2 . 1 1 157 157 ALA C C 157 179.076 179.076 179.358 -0.282 18493 993 1 2 . 1 1 157 157 ALA CA C 157 54.803 54.803 54.956 -0.153 18493 994 1 2 . 1 1 157 157 ALA CB C 157 16.120 16.120 18.786 -2.666 18493 995 1 2 . 1 1 158 158 VAL N N 158 116.045 116.045 117.668 -1.623 18493 996 1 2 . 1 1 158 158 VAL C C 158 177.491 177.491 177.589 -0.098 18493 997 1 2 . 1 1 158 158 VAL CA C 158 67.160 67.160 64.925 2.235 18493 998 1 2 . 1 1 158 158 VAL CB C 158 31.331 31.331 30.872 0.459 18493 999 1 2 . 1 1 159 159 LEU N N 159 116.776 116.776 120.091 -3.315 18493 1000 1 2 . 1 1 159 159 LEU C C 159 178.312 178.312 178.673 -0.361 18493 1001 1 2 . 1 1 159 159 LEU CA C 159 57.443 57.443 57.816 -0.373 18493 1002 1 2 . 1 1 159 159 LEU CB C 159 41.567 41.567 41.433 0.134 18493 1003 1 2 . 1 1 160 160 VAL N N 160 118.890 118.890 115.194 3.696 18493 1004 1 2 . 1 1 160 160 VAL C C 160 177.508 177.508 177.341 0.167 18493 1005 1 2 . 1 1 160 160 VAL CA C 160 67.366 67.366 65.269 2.096 18493 1006 1 2 . 1 1 160 160 VAL CB C 160 31.106 31.106 32.118 -1.012 18493 1007 1 2 . 1 1 161 161 VAL N N 161 118.360 118.360 120.680 -2.320 18493 1008 1 2 . 1 1 161 161 VAL C C 161 176.607 176.607 176.925 -0.318 18493 1009 1 2 . 1 1 161 161 VAL CA C 161 67.614 67.614 65.430 2.184 18493 1010 1 2 . 1 1 161 161 VAL CB C 161 31.646 31.646 32.297 -0.651 18493 1011 1 3 . 1 1 11 11 GLY N N 11 108.456 108.456 106.889 1.567 18493 1012 1 3 . 1 1 11 11 GLY H H 11 8.433 8.433 7.814 0.619 18493 1013 1 3 . 1 1 12 12 ARG C C 12 178.053 178.053 177.955 0.098 18493 1014 1 3 . 1 1 12 12 ARG CA C 12 57.504 57.504 59.237 -1.733 18493 1015 1 3 . 1 1 12 12 ARG CB C 12 30.522 30.522 29.686 0.837 18493 1016 1 3 . 1 1 13 13 GLY N N 13 108.265 108.265 108.995 -0.730 18493 1017 1 3 . 1 1 13 13 GLY C C 13 175.091 175.091 175.687 -0.596 18493 1018 1 3 . 1 1 13 13 GLY CA C 13 45.326 45.326 46.453 -1.127 18493 1019 1 3 . 1 1 14 14 ALA N N 14 123.181 123.181 124.603 -1.422 18493 1020 1 3 . 1 1 14 14 ALA C C 14 179.173 179.173 179.571 -0.398 18493 1021 1 3 . 1 1 14 14 ALA CA C 14 55.061 55.061 54.478 0.583 18493 1022 1 3 . 1 1 14 14 ALA H H 14 9.285 9.285 8.286 0.999 18493 1023 1 3 . 1 1 15 15 TRP N N 15 116.733 116.733 120.652 -3.919 18493 1024 1 3 . 1 1 15 15 TRP C C 15 179.425 179.425 177.946 1.479 18493 1025 1 3 . 1 1 15 15 TRP CA C 15 58.960 58.960 59.996 -1.036 18493 1026 1 3 . 1 1 15 15 TRP CB C 15 29.529 29.529 29.721 -0.192 18493 1027 1 3 . 1 1 15 15 TRP H H 15 7.091 7.091 8.719 -1.628 18493 1028 1 3 . 1 1 16 16 LEU N N 16 118.671 118.671 119.514 -0.843 18493 1029 1 3 . 1 1 16 16 LEU C C 16 178.461 178.461 179.489 -1.028 18493 1030 1 3 . 1 1 16 16 LEU CA C 16 58.246 58.246 58.560 -0.314 18493 1031 1 3 . 1 1 16 16 LEU CB C 16 41.369 41.369 41.325 0.044 18493 1032 1 3 . 1 1 16 16 LEU H H 16 9.180 9.180 8.806 0.374 18493 1033 1 3 . 1 1 17 17 LEU N N 17 118.515 118.515 120.690 -2.175 18493 1034 1 3 . 1 1 17 17 LEU C C 17 178.787 178.787 178.835 -0.048 18493 1035 1 3 . 1 1 17 17 LEU CA C 17 57.832 57.832 58.644 -0.812 18493 1036 1 3 . 1 1 17 17 LEU CB C 17 41.395 41.395 41.983 -0.588 18493 1037 1 3 . 1 1 18 18 MET N N 18 120.633 120.633 119.172 1.461 18493 1038 1 3 . 1 1 18 18 MET C C 18 180.469 180.469 179.276 1.193 18493 1039 1 3 . 1 1 18 18 MET CA C 18 60.277 60.277 58.490 1.787 18493 1040 1 3 . 1 1 18 18 MET CB C 18 31.789 31.789 32.227 -0.438 18493 1041 1 3 . 1 1 19 19 ALA N N 19 123.958 123.958 122.349 1.609 18493 1042 1 3 . 1 1 19 19 ALA C C 19 178.210 178.210 178.917 -0.707 18493 1043 1 3 . 1 1 19 19 ALA CA C 19 55.468 55.468 55.339 0.129 18493 1044 1 3 . 1 1 19 19 ALA CB C 19 17.865 17.865 18.467 -0.602 18493 1045 1 3 . 1 1 19 19 ALA H H 19 9.398 9.398 8.900 0.498 18493 1046 1 3 . 1 1 20 20 PHE N N 20 118.424 118.424 119.513 -1.089 18493 1047 1 3 . 1 1 20 20 PHE C C 20 176.674 176.674 177.007 -0.333 18493 1048 1 3 . 1 1 20 20 PHE CA C 20 62.546 62.546 60.963 1.583 18493 1049 1 3 . 1 1 20 20 PHE CB C 20 38.697 38.697 39.097 -0.400 18493 1050 1 3 . 1 1 21 21 THR N N 21 109.220 109.220 115.816 -6.596 18493 1051 1 3 . 1 1 21 21 THR C C 21 174.203 174.203 176.790 -2.587 18493 1052 1 3 . 1 1 21 21 THR CA C 21 66.052 66.052 66.757 -0.705 18493 1053 1 3 . 1 1 21 21 THR CB C 21 68.956 68.956 68.003 0.953 18493 1054 1 3 . 1 1 22 22 ALA N N 22 123.662 123.662 125.173 -1.511 18493 1055 1 3 . 1 1 22 22 ALA C C 22 179.488 179.488 179.539 -0.051 18493 1056 1 3 . 1 1 22 22 ALA CA C 22 54.847 54.847 54.640 0.207 18493 1057 1 3 . 1 1 22 22 ALA CB C 22 17.801 17.801 18.528 -0.727 18493 1058 1 3 . 1 1 23 23 LEU N N 23 118.917 118.917 120.123 -1.206 18493 1059 1 3 . 1 1 23 23 LEU C C 23 178.028 178.028 179.148 -1.120 18493 1060 1 3 . 1 1 23 23 LEU CA C 23 57.713 57.713 57.773 -0.060 18493 1061 1 3 . 1 1 23 23 LEU CB C 23 41.506 41.506 41.076 0.430 18493 1062 1 3 . 1 1 23 23 LEU H H 23 8.581 8.581 7.919 0.662 18493 1063 1 3 . 1 1 24 24 ALA N N 24 119.931 119.931 121.595 -1.664 18493 1064 1 3 . 1 1 24 24 ALA C C 24 180.617 180.617 179.798 0.819 18493 1065 1 3 . 1 1 24 24 ALA CA C 24 55.350 55.350 54.786 0.564 18493 1066 1 3 . 1 1 24 24 ALA CB C 24 17.583 17.583 17.811 -0.227 18493 1067 1 3 . 1 1 25 25 LEU N N 25 119.691 119.691 118.406 1.285 18493 1068 1 3 . 1 1 25 25 LEU CA C 25 58.078 58.078 57.596 0.482 18493 1069 1 3 . 1 1 25 25 LEU CB C 25 43.597 43.597 41.843 1.754 18493 1070 1 3 . 1 1 25 25 LEU H H 25 9.179 9.179 8.446 0.733 18493 1071 1 3 . 1 1 26 26 GLU N N 26 119.651 119.651 117.387 2.264 18493 1072 1 3 . 1 1 26 26 GLU C C 26 179.334 179.334 178.560 0.774 18493 1073 1 3 . 1 1 26 26 GLU CA C 26 59.584 59.584 58.867 0.717 18493 1074 1 3 . 1 1 26 26 GLU CB C 26 27.202 27.202 28.964 -1.762 18493 1075 1 3 . 1 1 27 27 LEU N N 27 119.661 119.661 118.810 0.851 18493 1076 1 3 . 1 1 27 27 LEU CA C 27 57.887 57.887 57.489 0.398 18493 1077 1 3 . 1 1 27 27 LEU CB C 27 41.591 41.591 42.074 -0.483 18493 1078 1 3 . 1 1 27 27 LEU H H 27 9.410 9.410 7.600 1.810 18493 1079 1 3 . 1 1 28 28 THR N N 28 118.484 118.484 114.484 4.000 18493 1080 1 3 . 1 1 28 28 THR C C 28 175.898 175.898 176.412 -0.514 18493 1081 1 3 . 1 1 28 28 THR CA C 28 67.459 67.459 65.929 1.530 18493 1082 1 3 . 1 1 28 28 THR CB C 28 67.948 67.948 67.844 0.104 18493 1083 1 3 . 1 1 29 29 ALA N N 29 122.643 122.643 123.888 -1.245 18493 1084 1 3 . 1 1 29 29 ALA C C 29 179.717 179.717 179.447 0.270 18493 1085 1 3 . 1 1 29 29 ALA CA C 29 55.919 55.919 54.643 1.276 18493 1086 1 3 . 1 1 29 29 ALA CB C 29 16.837 16.837 18.044 -1.207 18493 1087 1 3 . 1 1 29 29 ALA H H 29 8.302 8.302 7.496 0.806 18493 1088 1 3 . 1 1 30 30 LEU N N 30 117.408 117.408 118.142 -0.734 18493 1089 1 3 . 1 1 30 30 LEU C C 30 178.143 178.143 177.192 0.951 18493 1090 1 3 . 1 1 30 30 LEU CA C 30 57.384 57.384 57.518 -0.134 18493 1091 1 3 . 1 1 30 30 LEU CB C 30 41.679 41.679 41.977 -0.298 18493 1092 1 3 . 1 1 30 30 LEU H H 30 8.412 8.412 7.989 0.423 18493 1093 1 3 . 1 1 31 31 TRP N N 31 125.692 125.692 119.542 6.150 18493 1094 1 3 . 1 1 31 31 TRP C C 31 179.053 179.053 177.611 1.442 18493 1095 1 3 . 1 1 31 31 TRP CA C 31 59.005 59.005 58.474 0.532 18493 1096 1 3 . 1 1 31 31 TRP CB C 31 28.142 28.142 29.511 -1.369 18493 1097 1 3 . 1 1 31 31 TRP H H 31 9.157 9.157 7.456 1.701 18493 1098 1 3 . 1 1 32 32 PHE N N 32 119.195 119.195 120.020 -0.825 18493 1099 1 3 . 1 1 32 32 PHE CA C 32 61.557 61.557 61.432 0.125 18493 1100 1 3 . 1 1 32 32 PHE CB C 32 38.384 38.384 38.005 0.379 18493 1101 1 3 . 1 1 32 32 PHE H H 32 9.374 9.374 7.263 2.111 18493 1102 1 3 . 1 1 33 33 GLN C C 33 177.477 177.477 178.250 -0.773 18493 1103 1 3 . 1 1 33 33 GLN CA C 33 56.613 56.613 58.927 -2.314 18493 1104 1 3 . 1 1 33 33 GLN CB C 33 29.433 29.433 27.912 1.521 18493 1105 1 3 . 1 1 34 34 HIS N N 34 115.948 115.948 118.367 -2.419 18493 1106 1 3 . 1 1 34 34 HIS C C 34 175.548 175.548 177.905 -2.357 18493 1107 1 3 . 1 1 34 34 HIS CA C 34 58.733 58.733 59.364 -0.631 18493 1108 1 3 . 1 1 34 34 HIS CB C 34 32.084 32.084 29.909 2.175 18493 1109 1 3 . 1 1 34 34 HIS H H 34 9.621 9.621 8.521 1.100 18493 1110 1 3 . 1 1 35 35 VAL N N 35 116.902 116.902 118.729 -1.827 18493 1111 1 3 . 1 1 35 35 VAL C C 35 177.853 177.853 177.328 0.525 18493 1112 1 3 . 1 1 35 35 VAL CA C 35 64.075 64.075 65.211 -1.136 18493 1113 1 3 . 1 1 35 35 VAL CB C 35 30.626 30.626 32.019 -1.393 18493 1114 1 3 . 1 1 36 36 MET N N 36 114.145 114.145 117.310 -3.165 18493 1115 1 3 . 1 1 36 36 MET C C 36 175.905 175.905 176.537 -0.632 18493 1116 1 3 . 1 1 36 36 MET H H 36 7.605 7.605 7.816 -0.211 18493 1117 1 3 . 1 1 37 37 LEU N N 37 111.740 111.740 122.063 -10.323 18493 1118 1 3 . 1 1 37 37 LEU H H 37 7.121 7.121 7.628 -0.507 18493 1119 1 3 . 1 1 38 38 LEU C C 38 176.457 176.457 176.341 0.116 18493 1120 1 3 . 1 1 39 39 LYS N N 39 121.418 121.418 120.358 1.060 18493 1121 1 3 . 1 1 39 39 LYS CA C 39 57.471 57.471 55.379 2.092 18493 1122 1 3 . 1 1 39 39 LYS H H 39 9.359 9.359 8.300 1.059 18493 1123 1 3 . 1 1 40 40 PRO CA C 40 60.451 60.451 63.094 -2.643 18493 1124 1 3 . 1 1 42 42 VAL N N 42 118.166 118.166 122.225 -4.059 18493 1125 1 3 . 1 1 42 42 VAL C C 42 179.261 179.261 175.891 3.370 18493 1126 1 3 . 1 1 42 42 VAL CA C 42 67.223 67.223 64.833 2.390 18493 1127 1 3 . 1 1 42 42 VAL CB C 42 30.941 30.941 31.474 -0.533 18493 1128 1 3 . 1 1 43 43 LEU N N 43 115.946 115.946 122.172 -6.226 18493 1129 1 3 . 1 1 43 43 LEU C C 43 178.293 178.293 178.427 -0.134 18493 1130 1 3 . 1 1 43 43 LEU CA C 43 57.129 57.129 57.792 -0.663 18493 1131 1 3 . 1 1 43 43 LEU CB C 43 41.030 41.030 40.953 0.077 18493 1132 1 3 . 1 1 44 44 CYS N N 44 115.006 115.006 116.985 -1.979 18493 1133 1 3 . 1 1 44 44 CYS C C 44 177.484 177.484 176.886 0.598 18493 1134 1 3 . 1 1 44 44 CYS CA C 44 59.760 59.760 63.659 -3.899 18493 1135 1 3 . 1 1 44 44 CYS CB C 44 30.651 30.651 25.988 4.663 18493 1136 1 3 . 1 1 44 44 CYS H H 44 7.683 7.683 7.966 -0.283 18493 1137 1 3 . 1 1 45 45 ILE N N 45 119.384 119.384 119.428 -0.044 18493 1138 1 3 . 1 1 45 45 ILE C C 45 179.575 179.575 177.410 2.165 18493 1139 1 3 . 1 1 45 45 ILE CA C 45 62.068 62.068 65.156 -3.088 18493 1140 1 3 . 1 1 45 45 ILE CB C 45 33.583 33.583 36.890 -3.307 18493 1141 1 3 . 1 1 46 46 TYR N N 46 120.126 120.126 120.219 -0.093 18493 1142 1 3 . 1 1 46 46 TYR C C 46 178.397 178.397 177.066 1.331 18493 1143 1 3 . 1 1 46 46 TYR CA C 46 59.129 59.129 60.726 -1.597 18493 1144 1 3 . 1 1 46 46 TYR CB C 46 35.347 35.347 38.181 -2.834 18493 1145 1 3 . 1 1 46 46 TYR H H 46 8.958 8.958 8.539 0.419 18493 1146 1 3 . 1 1 47 47 GLU N N 47 121.779 121.779 118.268 3.511 18493 1147 1 3 . 1 1 47 47 GLU C C 47 179.907 179.907 179.328 0.579 18493 1148 1 3 . 1 1 47 47 GLU CA C 47 57.985 57.985 58.365 -0.380 18493 1149 1 3 . 1 1 47 47 GLU CB C 47 27.290 27.290 29.830 -2.540 18493 1150 1 3 . 1 1 47 47 GLU H H 47 9.681 9.681 8.110 1.571 18493 1151 1 3 . 1 1 48 48 ARG N N 48 119.188 119.188 120.676 -1.488 18493 1152 1 3 . 1 1 48 48 ARG C C 48 181.638 181.638 178.798 2.840 18493 1153 1 3 . 1 1 48 48 ARG CA C 48 60.299 60.299 57.981 2.318 18493 1154 1 3 . 1 1 48 48 ARG CB C 48 30.167 30.167 29.375 0.792 18493 1155 1 3 . 1 1 48 48 ARG H H 48 9.213 9.213 8.505 0.708 18493 1156 1 3 . 1 1 49 49 VAL N N 49 121.326 121.326 119.864 1.462 18493 1157 1 3 . 1 1 49 49 VAL C C 49 177.326 177.326 177.620 -0.294 18493 1158 1 3 . 1 1 49 49 VAL CA C 49 66.624 66.624 66.251 0.373 18493 1159 1 3 . 1 1 49 49 VAL CB C 49 31.280 31.280 30.879 0.401 18493 1160 1 3 . 1 1 50 50 ALA N N 50 122.955 122.955 122.238 0.717 18493 1161 1 3 . 1 1 50 50 ALA C C 50 179.594 179.594 179.629 -0.035 18493 1162 1 3 . 1 1 50 50 ALA CA C 50 55.902 55.902 55.112 0.790 18493 1163 1 3 . 1 1 50 50 ALA CB C 50 16.623 16.623 18.259 -1.636 18493 1164 1 3 . 1 1 51 51 LEU N N 51 115.737 115.737 118.224 -2.487 18493 1165 1 3 . 1 1 51 51 LEU C C 51 177.990 177.990 178.156 -0.166 18493 1166 1 3 . 1 1 51 51 LEU CA C 51 57.285 57.285 58.483 -1.198 18493 1167 1 3 . 1 1 51 51 LEU CB C 51 41.369 41.369 41.291 0.078 18493 1168 1 3 . 1 1 52 52 PHE N N 52 122.707 122.707 120.461 2.246 18493 1169 1 3 . 1 1 52 52 PHE C C 52 179.142 179.142 177.900 1.242 18493 1170 1 3 . 1 1 52 52 PHE CA C 52 62.518 62.518 61.636 0.882 18493 1171 1 3 . 1 1 52 52 PHE CB C 52 38.538 38.538 38.988 -0.450 18493 1172 1 3 . 1 1 52 52 PHE H H 52 8.863 8.863 8.205 0.658 18493 1173 1 3 . 1 1 53 53 GLY N N 53 110.801 110.801 108.267 2.534 18493 1174 1 3 . 1 1 53 53 GLY C C 53 175.378 175.378 176.455 -1.077 18493 1175 1 3 . 1 1 53 53 GLY CA C 53 48.024 48.024 47.579 0.445 18493 1176 1 3 . 1 1 53 53 GLY H H 53 9.027 9.027 7.934 1.093 18493 1177 1 3 . 1 1 54 54 VAL N N 54 121.926 121.926 123.309 -1.383 18493 1178 1 3 . 1 1 54 54 VAL C C 54 177.035 177.035 178.279 -1.244 18493 1179 1 3 . 1 1 54 54 VAL CA C 54 67.448 67.448 66.300 1.148 18493 1180 1 3 . 1 1 54 54 VAL CB C 54 31.246 31.246 31.884 -0.638 18493 1181 1 3 . 1 1 54 54 VAL H H 54 7.948 7.948 8.124 -0.176 18493 1182 1 3 . 1 1 55 55 LEU N N 55 119.894 119.894 121.267 -1.373 18493 1183 1 3 . 1 1 55 55 LEU C C 55 178.175 178.175 179.240 -1.065 18493 1184 1 3 . 1 1 55 55 LEU CA C 55 58.490 58.490 58.117 0.373 18493 1185 1 3 . 1 1 55 55 LEU CB C 55 42.145 42.145 40.635 1.510 18493 1186 1 3 . 1 1 55 55 LEU H H 55 8.646 8.646 9.143 -0.497 18493 1187 1 3 . 1 1 56 56 GLY N N 56 106.262 106.262 106.515 -0.253 18493 1188 1 3 . 1 1 56 56 GLY C C 56 174.618 174.618 175.862 -1.244 18493 1189 1 3 . 1 1 56 56 GLY CA C 56 47.533 47.533 47.190 0.344 18493 1190 1 3 . 1 1 57 57 ALA N N 57 123.002 123.002 124.160 -1.158 18493 1191 1 3 . 1 1 57 57 ALA C C 57 178.688 178.688 179.124 -0.436 18493 1192 1 3 . 1 1 57 57 ALA CA C 57 55.548 55.548 54.972 0.576 18493 1193 1 3 . 1 1 57 57 ALA CB C 57 18.065 18.065 18.634 -0.569 18493 1194 1 3 . 1 1 58 58 ALA N N 58 118.866 118.866 120.620 -1.754 18493 1195 1 3 . 1 1 58 58 ALA C C 58 179.348 179.348 179.477 -0.129 18493 1196 1 3 . 1 1 58 58 ALA CA C 58 54.763 54.763 54.718 0.045 18493 1197 1 3 . 1 1 58 58 ALA CB C 58 17.898 17.898 19.348 -1.450 18493 1198 1 3 . 1 1 58 58 ALA H H 58 8.674 8.674 8.089 0.585 18493 1199 1 3 . 1 1 59 59 LEU N N 59 115.384 115.384 119.973 -4.589 18493 1200 1 3 . 1 1 59 59 LEU C C 59 177.654 177.654 178.462 -0.808 18493 1201 1 3 . 1 1 59 59 LEU CA C 59 57.387 57.387 58.124 -0.737 18493 1202 1 3 . 1 1 59 59 LEU CB C 59 41.209 41.209 41.775 -0.566 18493 1203 1 3 . 1 1 60 60 ILE N N 60 116.140 116.140 118.053 -1.913 18493 1204 1 3 . 1 1 60 60 ILE C C 60 180.024 180.024 176.847 3.177 18493 1205 1 3 . 1 1 60 60 ILE CA C 60 64.263 64.263 63.276 0.987 18493 1206 1 3 . 1 1 60 60 ILE CB C 60 37.240 37.240 37.801 -0.561 18493 1207 1 3 . 1 1 61 61 GLY N N 61 110.127 110.127 105.507 4.620 18493 1208 1 3 . 1 1 61 61 GLY C C 61 173.716 173.716 173.608 0.108 18493 1209 1 3 . 1 1 61 61 GLY CA C 61 45.617 45.617 44.618 0.999 18493 1210 1 3 . 1 1 61 61 GLY H H 61 9.046 9.046 7.489 1.557 18493 1211 1 3 . 1 1 62 62 ALA N N 62 118.949 118.949 124.685 -5.736 18493 1212 1 3 . 1 1 62 62 ALA C C 62 176.192 176.192 177.920 -1.728 18493 1213 1 3 . 1 1 62 62 ALA CA C 62 53.268 53.268 53.418 -0.150 18493 1214 1 3 . 1 1 62 62 ALA CB C 62 19.138 19.138 18.124 1.014 18493 1215 1 3 . 1 1 62 62 ALA H H 62 8.066 8.066 7.281 0.785 18493 1216 1 3 . 1 1 63 63 ILE N N 63 116.800 116.800 118.347 -1.547 18493 1217 1 3 . 1 1 63 63 ILE CA C 63 66.739 66.739 63.282 3.457 18493 1218 1 3 . 1 1 63 63 ILE CB C 63 37.947 37.947 38.138 -0.191 18493 1219 1 3 . 1 1 64 64 ALA N N 64 123.957 123.957 119.814 4.143 18493 1220 1 3 . 1 1 64 64 ALA CA C 64 52.934 52.934 49.266 3.668 18493 1221 1 3 . 1 1 64 64 ALA CB C 64 19.428 19.428 18.995 0.433 18493 1222 1 3 . 1 1 65 65 PRO CA C 65 65.350 65.350 62.540 2.810 18493 1223 1 3 . 1 1 66 66 LYS N N 66 116.618 116.618 119.017 -2.399 18493 1224 1 3 . 1 1 66 66 LYS C C 66 177.500 177.500 176.497 1.003 18493 1225 1 3 . 1 1 66 66 LYS CA C 66 56.547 56.547 59.767 -3.220 18493 1226 1 3 . 1 1 66 66 LYS CB C 66 30.522 30.522 31.926 -1.404 18493 1227 1 3 . 1 1 67 67 THR CA C 67 60.452 60.452 61.933 -1.481 18493 1228 1 3 . 1 1 67 67 THR CB C 67 69.948 69.948 68.155 1.793 18493 1229 1 3 . 1 1 68 68 PRO C C 68 177.070 177.070 178.152 -1.082 18493 1230 1 3 . 1 1 68 68 PRO CA C 68 63.315 63.315 62.965 0.350 18493 1231 1 3 . 1 1 68 68 PRO CB C 68 32.458 32.458 31.764 0.694 18493 1232 1 3 . 1 1 69 69 LEU N N 69 121.517 121.517 116.910 4.607 18493 1233 1 3 . 1 1 69 69 LEU C C 69 179.448 179.448 177.084 2.364 18493 1234 1 3 . 1 1 69 69 LEU CA C 69 57.389 57.389 57.138 0.251 18493 1235 1 3 . 1 1 69 69 LEU CB C 69 42.737 42.737 40.203 2.534 18493 1236 1 3 . 1 1 69 69 LEU H H 69 8.882 8.882 8.182 0.700 18493 1237 1 3 . 1 1 70 70 ARG N N 70 114.028 114.028 118.357 -4.329 18493 1238 1 3 . 1 1 70 70 ARG C C 70 177.925 177.925 177.634 0.291 18493 1239 1 3 . 1 1 70 70 ARG CA C 70 58.429 58.429 56.916 1.512 18493 1240 1 3 . 1 1 70 70 ARG CB C 70 29.391 29.391 27.540 1.851 18493 1241 1 3 . 1 1 70 70 ARG H H 70 8.202 8.202 8.368 -0.166 18493 1242 1 3 . 1 1 71 71 TYR N N 71 121.740 121.740 117.980 3.760 18493 1243 1 3 . 1 1 71 71 TYR CA C 71 57.374 57.374 55.319 2.055 18493 1244 1 3 . 1 1 71 71 TYR H H 71 8.136 8.136 7.215 0.921 18493 1245 1 3 . 1 1 72 72 VAL N N 72 118.416 118.416 123.778 -5.362 18493 1246 1 3 . 1 1 72 72 VAL C C 72 177.702 177.702 177.004 0.698 18493 1247 1 3 . 1 1 72 72 VAL CA C 72 66.098 66.098 63.628 2.470 18493 1248 1 3 . 1 1 72 72 VAL CB C 72 31.343 31.343 31.068 0.275 18493 1249 1 3 . 1 1 73 73 ALA N N 73 120.283 120.283 122.376 -2.093 18493 1250 1 3 . 1 1 73 73 ALA C C 73 179.763 179.763 179.576 0.187 18493 1251 1 3 . 1 1 73 73 ALA CA C 73 55.785 55.785 55.142 0.643 18493 1252 1 3 . 1 1 73 73 ALA CB C 73 19.265 19.265 18.362 0.903 18493 1253 1 3 . 1 1 73 73 ALA H H 73 9.015 9.015 7.782 1.233 18493 1254 1 3 . 1 1 74 74 MET N N 74 115.547 115.547 117.354 -1.807 18493 1255 1 3 . 1 1 74 74 MET C C 74 177.223 177.223 178.731 -1.508 18493 1256 1 3 . 1 1 74 74 MET CA C 74 61.023 61.023 56.453 4.570 18493 1257 1 3 . 1 1 74 74 MET CB C 74 33.777 33.777 31.215 2.562 18493 1258 1 3 . 1 1 74 74 MET H H 74 8.163 8.163 7.675 0.488 18493 1259 1 3 . 1 1 75 75 VAL N N 75 118.690 118.690 120.091 -1.401 18493 1260 1 3 . 1 1 75 75 VAL C C 75 177.166 177.166 177.339 -0.173 18493 1261 1 3 . 1 1 75 75 VAL CA C 75 67.581 67.581 67.141 0.440 18493 1262 1 3 . 1 1 75 75 VAL CB C 75 31.408 31.408 31.944 -0.536 18493 1263 1 3 . 1 1 75 75 VAL H H 75 7.554 7.554 8.092 -0.538 18493 1264 1 3 . 1 1 76 76 ILE N N 76 118.959 118.959 120.028 -1.069 18493 1265 1 3 . 1 1 76 76 ILE C C 76 178.680 178.680 177.298 1.382 18493 1266 1 3 . 1 1 76 76 ILE CA C 76 65.839 65.839 64.776 1.063 18493 1267 1 3 . 1 1 76 76 ILE CB C 76 38.414 38.414 37.935 0.479 18493 1268 1 3 . 1 1 77 77 TRP N N 77 125.440 125.440 121.750 3.690 18493 1269 1 3 . 1 1 77 77 TRP C C 77 177.153 177.153 177.966 -0.813 18493 1270 1 3 . 1 1 77 77 TRP CA C 77 58.779 58.779 60.115 -1.336 18493 1271 1 3 . 1 1 77 77 TRP CB C 77 30.494 30.494 29.660 0.834 18493 1272 1 3 . 1 1 77 77 TRP H H 77 9.515 9.515 8.186 1.329 18493 1273 1 3 . 1 1 78 78 LEU N N 78 118.968 118.968 122.589 -3.621 18493 1274 1 3 . 1 1 78 78 LEU C C 78 178.381 178.381 177.967 0.414 18493 1275 1 3 . 1 1 78 78 LEU CA C 78 58.041 58.041 57.443 0.598 18493 1276 1 3 . 1 1 78 78 LEU CB C 78 43.807 43.807 41.069 2.738 18493 1277 1 3 . 1 1 78 78 LEU H H 78 9.367 9.367 7.846 1.521 18493 1278 1 3 . 1 1 79 79 TYR N N 79 118.181 118.181 120.411 -2.230 18493 1279 1 3 . 1 1 79 79 TYR C C 79 176.777 176.777 177.311 -0.534 18493 1280 1 3 . 1 1 79 79 TYR CA C 79 62.849 62.849 62.389 0.460 18493 1281 1 3 . 1 1 80 80 SER N N 80 114.286 114.286 114.874 -0.588 18493 1282 1 3 . 1 1 80 80 SER C C 80 175.943 175.943 176.672 -0.729 18493 1283 1 3 . 1 1 80 80 SER CA C 80 63.515 63.515 61.735 1.780 18493 1284 1 3 . 1 1 80 80 SER CB C 80 63.941 63.941 62.201 1.740 18493 1285 1 3 . 1 1 81 81 ALA N N 81 121.070 121.070 123.555 -2.485 18493 1286 1 3 . 1 1 81 81 ALA C C 81 178.208 178.208 179.151 -0.943 18493 1287 1 3 . 1 1 81 81 ALA CA C 81 55.224 55.224 54.593 0.631 18493 1288 1 3 . 1 1 81 81 ALA CB C 81 17.897 17.897 18.097 -0.200 18493 1289 1 3 . 1 1 82 82 PHE N N 82 117.560 117.560 120.267 -2.707 18493 1290 1 3 . 1 1 82 82 PHE C C 82 176.975 176.975 176.975 0.000 18493 1291 1 3 . 1 1 82 82 PHE CA C 82 62.132 62.132 59.831 2.301 18493 1292 1 3 . 1 1 82 82 PHE CB C 82 38.497 38.497 38.889 -0.392 18493 1293 1 3 . 1 1 83 83 ARG N N 83 117.110 117.110 119.099 -1.989 18493 1294 1 3 . 1 1 83 83 ARG C C 83 178.637 178.637 178.245 0.392 18493 1295 1 3 . 1 1 83 83 ARG CA C 83 60.291 60.291 58.949 1.342 18493 1296 1 3 . 1 1 83 83 ARG CB C 83 28.625 28.625 29.635 -1.010 18493 1297 1 3 . 1 1 84 84 GLY N N 84 105.915 105.915 106.866 -0.951 18493 1298 1 3 . 1 1 84 84 GLY C C 84 177.091 177.091 175.448 1.643 18493 1299 1 3 . 1 1 84 84 GLY CA C 84 46.128 46.128 46.589 -0.461 18493 1300 1 3 . 1 1 85 85 VAL N N 85 124.985 124.985 123.146 1.839 18493 1301 1 3 . 1 1 85 85 VAL C C 85 176.387 176.387 178.300 -1.913 18493 1302 1 3 . 1 1 85 85 VAL CA C 85 66.960 66.960 65.887 1.073 18493 1303 1 3 . 1 1 85 85 VAL CB C 85 31.066 31.066 31.548 -0.482 18493 1304 1 3 . 1 1 86 86 GLN N N 86 116.522 116.522 118.603 -2.081 18493 1305 1 3 . 1 1 86 86 GLN C C 86 179.586 179.586 178.891 0.695 18493 1306 1 3 . 1 1 86 86 GLN CA C 86 59.505 59.505 58.798 0.707 18493 1307 1 3 . 1 1 86 86 GLN CB C 86 28.762 28.762 28.099 0.663 18493 1308 1 3 . 1 1 87 87 LEU N N 87 121.211 121.211 118.844 2.367 18493 1309 1 3 . 1 1 87 87 LEU C C 87 178.396 178.396 179.276 -0.880 18493 1310 1 3 . 1 1 87 87 LEU CA C 87 57.847 57.847 57.378 0.469 18493 1311 1 3 . 1 1 87 87 LEU CB C 87 41.924 41.924 41.355 0.569 18493 1312 1 3 . 1 1 87 87 LEU H H 87 8.955 8.955 7.667 1.288 18493 1313 1 3 . 1 1 88 88 THR N N 88 108.251 108.251 114.399 -6.148 18493 1314 1 3 . 1 1 88 88 THR C C 88 180.013 180.013 176.619 3.394 18493 1315 1 3 . 1 1 88 88 THR CA C 88 65.112 65.112 65.403 -0.291 18493 1316 1 3 . 1 1 88 88 THR CB C 88 68.805 68.805 68.823 -0.019 18493 1317 1 3 . 1 1 88 88 THR H H 88 8.764 8.764 8.417 0.347 18493 1318 1 3 . 1 1 89 89 TYR N N 89 127.947 127.947 123.163 4.784 18493 1319 1 3 . 1 1 89 89 TYR C C 89 177.244 177.244 176.955 0.289 18493 1320 1 3 . 1 1 89 89 TYR H H 89 9.868 9.868 8.705 1.163 18493 1321 1 3 . 1 1 90 90 GLU N N 90 121.163 121.163 119.382 1.781 18493 1322 1 3 . 1 1 90 90 GLU C C 90 178.671 178.671 178.528 0.143 18493 1323 1 3 . 1 1 90 90 GLU H H 90 8.515 8.515 8.017 0.498 18493 1324 1 3 . 1 1 91 91 HIS N N 91 120.459 120.459 118.420 2.039 18493 1325 1 3 . 1 1 91 91 HIS C C 91 177.605 177.605 177.606 -0.001 18493 1326 1 3 . 1 1 91 91 HIS CA C 91 57.085 57.085 58.888 -1.802 18493 1327 1 3 . 1 1 91 91 HIS CB C 91 34.128 34.128 30.046 4.082 18493 1328 1 3 . 1 1 91 91 HIS H H 91 9.102 9.102 7.879 1.223 18493 1329 1 3 . 1 1 92 92 THR N N 92 115.463 115.463 116.329 -0.866 18493 1330 1 3 . 1 1 92 92 THR C C 92 176.189 176.189 176.430 -0.241 18493 1331 1 3 . 1 1 92 92 THR CA C 92 67.058 67.058 65.960 1.098 18493 1332 1 3 . 1 1 92 92 THR CB C 92 68.564 68.564 68.551 0.013 18493 1333 1 3 . 1 1 92 92 THR H H 92 9.550 9.550 8.047 1.503 18493 1334 1 3 . 1 1 93 93 MET N N 93 117.153 117.153 121.600 -4.447 18493 1335 1 3 . 1 1 93 93 MET C C 93 176.972 176.972 178.127 -1.155 18493 1336 1 3 . 1 1 93 93 MET CA C 93 62.369 62.369 57.561 4.808 18493 1337 1 3 . 1 1 93 93 MET CB C 93 33.515 33.515 31.748 1.767 18493 1338 1 3 . 1 1 94 94 LEU N N 94 117.981 117.981 116.633 1.348 18493 1339 1 3 . 1 1 94 94 LEU CA C 94 57.489 57.489 58.010 -0.521 18493 1340 1 3 . 1 1 94 94 LEU CB C 94 41.432 41.432 41.170 0.262 18493 1341 1 3 . 1 1 94 94 LEU H H 94 8.497 8.497 8.125 0.372 18493 1342 1 3 . 1 1 95 95 GLN C C 95 178.331 178.331 178.360 -0.029 18493 1343 1 3 . 1 1 95 95 GLN CA C 95 57.604 57.604 57.651 -0.047 18493 1344 1 3 . 1 1 95 95 GLN CB C 95 28.200 28.200 28.671 -0.471 18493 1345 1 3 . 1 1 96 96 LEU N N 96 118.174 118.174 119.194 -1.020 18493 1346 1 3 . 1 1 96 96 LEU C C 96 177.842 177.842 176.412 1.430 18493 1347 1 3 . 1 1 96 96 LEU CA C 96 57.747 57.747 56.589 1.158 18493 1348 1 3 . 1 1 96 96 LEU CB C 96 41.721 41.721 42.070 -0.349 18493 1349 1 3 . 1 1 97 97 TYR N N 97 117.359 117.359 113.536 3.823 18493 1350 1 3 . 1 1 97 97 TYR CA C 97 57.581 57.581 54.973 2.608 18493 1351 1 3 . 1 1 97 97 TYR H H 97 8.485 8.485 7.764 0.721 18493 1352 1 3 . 1 1 98 98 PRO CA C 98 63.847 63.847 62.017 1.830 18493 1353 1 3 . 1 1 99 99 SER CA C 99 58.145 58.145 57.069 1.076 18493 1354 1 3 . 1 1 99 99 SER CB C 99 64.506 64.506 61.995 2.511 18493 1355 1 3 . 1 1 101 101 PHE C C 101 174.992 174.992 174.959 0.033 18493 1356 1 3 . 1 1 102 102 ALA N N 102 120.614 120.614 127.283 -6.669 18493 1357 1 3 . 1 1 102 102 ALA C C 102 176.810 176.810 177.586 -0.776 18493 1358 1 3 . 1 1 102 102 ALA CA C 102 54.355 54.355 52.290 2.065 18493 1359 1 3 . 1 1 102 102 ALA H H 102 7.383 7.383 8.379 -0.996 18493 1360 1 3 . 1 1 103 103 THR N N 103 112.507 112.507 116.624 -4.117 18493 1361 1 3 . 1 1 103 103 THR C C 103 175.666 175.666 173.997 1.669 18493 1362 1 3 . 1 1 103 103 THR CA C 103 59.838 59.838 63.313 -3.475 18493 1363 1 3 . 1 1 103 103 THR CB C 103 67.623 67.623 68.952 -1.329 18493 1364 1 3 . 1 1 103 103 THR H H 103 9.278 9.278 8.201 1.077 18493 1365 1 3 . 1 1 104 104 CYS N N 104 122.754 122.754 124.758 -2.004 18493 1366 1 3 . 1 1 104 104 CYS C C 104 174.474 174.474 173.998 0.476 18493 1367 1 3 . 1 1 104 104 CYS CA C 104 64.988 64.988 56.586 8.402 18493 1368 1 3 . 1 1 104 104 CYS CB C 104 42.988 42.988 28.198 14.790 18493 1369 1 3 . 1 1 104 104 CYS H H 104 9.934 9.934 8.661 1.273 18493 1370 1 3 . 1 1 105 105 ASP N N 105 121.350 121.350 122.590 -1.240 18493 1371 1 3 . 1 1 105 105 ASP CB C 105 41.030 41.030 42.981 -1.951 18493 1372 1 3 . 1 1 105 105 ASP H H 105 8.153 8.153 8.136 0.017 18493 1373 1 3 . 1 1 115 115 PRO CA C 115 61.148 61.148 62.754 -1.606 18493 1374 1 3 . 1 1 115 115 PRO CB C 115 30.280 30.280 32.154 -1.874 18493 1375 1 3 . 1 1 116 116 LEU C C 116 178.163 178.163 177.348 0.815 18493 1376 1 3 . 1 1 116 116 LEU CA C 116 58.746 58.746 55.572 3.174 18493 1377 1 3 . 1 1 116 116 LEU CB C 116 42.932 42.932 42.467 0.465 18493 1378 1 3 . 1 1 117 117 ASP N N 117 116.302 116.302 117.260 -0.958 18493 1379 1 3 . 1 1 117 117 ASP C C 117 177.528 177.528 176.935 0.593 18493 1380 1 3 . 1 1 117 117 ASP CB C 117 41.252 41.252 39.142 2.110 18493 1381 1 3 . 1 1 118 118 LYS N N 118 118.983 118.983 119.243 -0.260 18493 1382 1 3 . 1 1 118 118 LYS H H 118 7.538 7.538 7.957 -0.419 18493 1383 1 3 . 1 1 119 119 TRP C C 119 177.867 177.867 175.980 1.887 18493 1384 1 3 . 1 1 120 120 VAL N N 120 113.149 113.149 115.613 -2.464 18493 1385 1 3 . 1 1 120 120 VAL CA C 120 58.651 58.651 59.393 -0.742 18493 1386 1 3 . 1 1 120 120 VAL CB C 120 31.821 31.821 33.193 -1.372 18493 1387 1 3 . 1 1 120 120 VAL H H 120 8.936 8.936 7.650 1.286 18493 1388 1 3 . 1 1 121 121 PRO C C 121 178.888 178.888 178.166 0.722 18493 1389 1 3 . 1 1 121 121 PRO CA C 121 65.185 65.185 64.167 1.018 18493 1390 1 3 . 1 1 121 121 PRO CB C 121 31.781 31.781 32.188 -0.407 18493 1391 1 3 . 1 1 122 122 GLN N N 122 116.304 116.304 117.955 -1.651 18493 1392 1 3 . 1 1 122 122 GLN C C 122 174.326 174.326 177.444 -3.118 18493 1393 1 3 . 1 1 122 122 GLN CA C 122 58.463 58.463 58.702 -0.239 18493 1394 1 3 . 1 1 122 122 GLN H H 122 9.809 9.809 8.414 1.395 18493 1395 1 3 . 1 1 123 123 VAL N N 123 113.254 113.254 117.638 -4.384 18493 1396 1 3 . 1 1 123 123 VAL C C 123 175.777 175.777 175.787 -0.010 18493 1397 1 3 . 1 1 123 123 VAL CA C 123 61.689 61.689 64.676 -2.987 18493 1398 1 3 . 1 1 123 123 VAL CB C 123 35.373 35.373 31.668 3.705 18493 1399 1 3 . 1 1 123 123 VAL H H 123 8.219 8.219 8.203 0.016 18493 1400 1 3 . 1 1 124 124 PHE N N 124 112.242 112.242 116.450 -4.208 18493 1401 1 3 . 1 1 124 124 PHE C C 124 172.759 172.759 173.873 -1.114 18493 1402 1 3 . 1 1 124 124 PHE CB C 124 39.318 39.318 39.263 0.055 18493 1403 1 3 . 1 1 125 125 VAL N N 125 115.233 115.233 114.749 0.484 18493 1404 1 3 . 1 1 125 125 VAL C C 125 177.034 177.034 174.326 2.708 18493 1405 1 3 . 1 1 125 125 VAL CA C 125 61.950 61.950 60.598 1.352 18493 1406 1 3 . 1 1 125 125 VAL CB C 125 33.376 33.376 35.646 -2.270 18493 1407 1 3 . 1 1 125 125 VAL H H 125 7.799 7.799 7.674 0.125 18493 1408 1 3 . 1 1 126 126 ALA N N 126 130.709 130.709 124.041 6.668 18493 1409 1 3 . 1 1 126 126 ALA C C 126 175.920 175.920 176.477 -0.557 18493 1410 1 3 . 1 1 126 126 ALA CA C 126 54.493 54.493 52.157 2.336 18493 1411 1 3 . 1 1 126 126 ALA CB C 126 17.215 17.215 20.542 -3.327 18493 1412 1 3 . 1 1 126 126 ALA H H 126 9.014 9.014 8.320 0.694 18493 1413 1 3 . 1 1 127 127 SER N N 127 112.716 112.716 111.144 1.572 18493 1414 1 3 . 1 1 127 127 SER CA C 127 58.101 58.101 57.664 0.437 18493 1415 1 3 . 1 1 127 127 SER CB C 127 64.539 64.539 64.562 -0.023 18493 1416 1 3 . 1 1 127 127 SER H H 127 8.145 8.145 7.971 0.174 18493 1417 1 3 . 1 1 128 128 GLY N N 128 106.487 106.487 107.177 -0.690 18493 1418 1 3 . 1 1 128 128 GLY C C 128 177.047 177.047 173.298 3.749 18493 1419 1 3 . 1 1 128 128 GLY CA C 128 46.296 46.296 45.702 0.594 18493 1420 1 3 . 1 1 128 128 GLY H H 128 8.595 8.595 8.484 0.111 18493 1421 1 3 . 1 1 129 129 ASP C C 129 177.916 177.916 174.956 2.960 18493 1422 1 3 . 1 1 129 129 ASP CB C 129 43.975 43.975 42.197 1.778 18493 1423 1 3 . 1 1 130 130 CYS N N 130 122.984 122.984 118.798 4.186 18493 1424 1 3 . 1 1 130 130 CYS C C 130 173.312 173.312 174.546 -1.234 18493 1425 1 3 . 1 1 130 130 CYS CA C 130 64.581 64.581 58.058 6.523 18493 1426 1 3 . 1 1 130 130 CYS CB C 130 42.879 42.879 28.869 14.010 18493 1427 1 3 . 1 1 130 130 CYS H H 130 9.948 9.948 8.500 1.448 18493 1428 1 3 . 1 1 131 131 ALA N N 131 121.534 121.534 123.885 -2.351 18493 1429 1 3 . 1 1 131 131 ALA CA C 131 52.640 52.640 53.046 -0.406 18493 1430 1 3 . 1 1 131 131 ALA CB C 131 18.497 18.497 19.440 -0.943 18493 1431 1 3 . 1 1 131 131 ALA H H 131 9.869 9.869 8.290 1.579 18493 1432 1 3 . 1 1 136 136 ASP C C 136 172.916 172.916 174.392 -1.476 18493 1433 1 3 . 1 1 137 137 PHE N N 137 117.677 117.677 116.069 1.608 18493 1434 1 3 . 1 1 137 137 PHE CA C 137 57.310 57.310 56.612 0.698 18493 1435 1 3 . 1 1 137 137 PHE CB C 137 42.927 42.927 39.870 3.057 18493 1436 1 3 . 1 1 137 137 PHE H H 137 8.959 8.959 7.400 1.559 18493 1437 1 3 . 1 1 138 138 LEU CB C 138 43.547 43.547 40.716 2.831 18493 1438 1 3 . 1 1 139 139 GLY C C 139 176.262 176.262 173.435 2.827 18493 1439 1 3 . 1 1 139 139 GLY CA C 139 46.123 46.123 45.239 0.884 18493 1440 1 3 . 1 1 140 140 LEU N N 140 124.207 124.207 118.917 5.290 18493 1441 1 3 . 1 1 140 140 LEU CB C 140 40.503 40.503 41.962 -1.458 18493 1442 1 3 . 1 1 142 142 MET CA C 142 56.442 56.442 57.447 -1.005 18493 1443 1 3 . 1 1 143 143 PRO CA C 143 63.254 63.254 66.379 -3.125 18493 1444 1 3 . 1 1 144 144 GLN C C 144 177.307 177.307 178.532 -1.225 18493 1445 1 3 . 1 1 145 145 TRP N N 145 120.795 120.795 120.691 0.104 18493 1446 1 3 . 1 1 145 145 TRP C C 145 178.709 178.709 178.951 -0.242 18493 1447 1 3 . 1 1 145 145 TRP CA C 145 59.535 59.535 59.347 0.188 18493 1448 1 3 . 1 1 145 145 TRP CB C 145 29.345 29.345 29.284 0.061 18493 1449 1 3 . 1 1 145 145 TRP H H 145 8.386 8.386 7.349 1.037 18493 1450 1 3 . 1 1 146 146 LEU N N 146 118.336 118.336 119.346 -1.010 18493 1451 1 3 . 1 1 146 146 LEU C C 146 177.115 177.115 179.037 -1.922 18493 1452 1 3 . 1 1 146 146 LEU CA C 146 57.793 57.793 58.024 -0.231 18493 1453 1 3 . 1 1 146 146 LEU CB C 146 41.616 41.616 41.295 0.321 18493 1454 1 3 . 1 1 146 146 LEU H H 146 9.033 9.033 8.573 0.460 18493 1455 1 3 . 1 1 147 147 LEU N N 147 123.772 123.772 118.849 4.923 18493 1456 1 3 . 1 1 147 147 LEU C C 147 178.787 178.787 179.051 -0.264 18493 1457 1 3 . 1 1 147 147 LEU CA C 147 58.052 58.052 57.897 0.155 18493 1458 1 3 . 1 1 147 147 LEU CB C 147 41.047 41.047 40.395 0.652 18493 1459 1 3 . 1 1 147 147 LEU H H 147 8.480 8.480 7.632 0.848 18493 1460 1 3 . 1 1 148 148 GLY N N 148 104.457 104.457 107.824 -3.367 18493 1461 1 3 . 1 1 148 148 GLY C C 148 174.667 174.667 176.464 -1.797 18493 1462 1 3 . 1 1 148 148 GLY CA C 148 48.102 48.102 47.369 0.733 18493 1463 1 3 . 1 1 149 149 ILE N N 149 121.815 121.815 120.600 1.215 18493 1464 1 3 . 1 1 149 149 ILE C C 149 177.725 177.725 176.997 0.728 18493 1465 1 3 . 1 1 149 149 ILE CA C 149 65.997 65.997 64.538 1.459 18493 1466 1 3 . 1 1 149 149 ILE CB C 149 38.262 38.262 37.743 0.519 18493 1467 1 3 . 1 1 150 150 PHE N N 150 118.894 118.894 118.337 0.557 18493 1468 1 3 . 1 1 150 150 PHE C C 150 178.929 178.929 177.576 1.353 18493 1469 1 3 . 1 1 150 150 PHE CA C 150 63.591 63.591 62.284 1.307 18493 1470 1 3 . 1 1 150 150 PHE CB C 150 38.417 38.417 38.706 -0.289 18493 1471 1 3 . 1 1 151 151 ILE N N 151 120.535 120.535 119.888 0.647 18493 1472 1 3 . 1 1 151 151 ILE C C 151 177.347 177.347 177.520 -0.173 18493 1473 1 3 . 1 1 151 151 ILE CA C 151 66.478 66.478 64.998 1.480 18493 1474 1 3 . 1 1 151 151 ILE CB C 151 37.302 37.302 37.534 -0.232 18493 1475 1 3 . 1 1 152 152 ALA N N 152 122.855 122.855 123.551 -0.696 18493 1476 1 3 . 1 1 152 152 ALA C C 152 179.165 179.165 179.745 -0.580 18493 1477 1 3 . 1 1 152 152 ALA CA C 152 56.272 56.272 55.469 0.803 18493 1478 1 3 . 1 1 152 152 ALA CB C 152 17.993 17.993 17.964 0.029 18493 1479 1 3 . 1 1 153 153 TYR N N 153 116.156 116.156 118.563 -2.407 18493 1480 1 3 . 1 1 153 153 TYR C C 153 179.682 179.682 178.082 1.600 18493 1481 1 3 . 1 1 153 153 TYR CA C 153 64.391 64.391 60.286 4.105 18493 1482 1 3 . 1 1 153 153 TYR CB C 153 39.553 39.553 37.949 1.604 18493 1483 1 3 . 1 1 153 153 TYR H H 153 8.680 8.680 8.042 0.638 18493 1484 1 3 . 1 1 154 154 LEU N N 154 122.327 122.327 121.732 0.595 18493 1485 1 3 . 1 1 154 154 LEU C C 154 177.336 177.336 178.804 -1.468 18493 1486 1 3 . 1 1 154 154 LEU CA C 154 57.905 57.905 57.922 -0.017 18493 1487 1 3 . 1 1 154 154 LEU CB C 154 42.009 42.009 41.392 0.617 18493 1488 1 3 . 1 1 155 155 ILE N N 155 119.079 119.079 119.648 -0.569 18493 1489 1 3 . 1 1 155 155 ILE C C 155 177.589 177.589 178.246 -0.657 18493 1490 1 3 . 1 1 155 155 ILE CA C 155 65.996 65.996 65.536 0.460 18493 1491 1 3 . 1 1 155 155 ILE CB C 155 38.179 38.179 37.910 0.269 18493 1492 1 3 . 1 1 156 156 VAL N N 156 117.551 117.551 120.201 -2.650 18493 1493 1 3 . 1 1 156 156 VAL C C 156 176.163 176.163 177.767 -1.604 18493 1494 1 3 . 1 1 156 156 VAL CA C 156 67.664 67.664 66.571 1.093 18493 1495 1 3 . 1 1 156 156 VAL CB C 156 31.694 31.694 30.988 0.706 18493 1496 1 3 . 1 1 157 157 ALA N N 157 122.470 122.470 122.004 0.466 18493 1497 1 3 . 1 1 157 157 ALA C C 157 179.076 179.076 179.843 -0.767 18493 1498 1 3 . 1 1 157 157 ALA CA C 157 54.803 54.803 55.662 -0.859 18493 1499 1 3 . 1 1 157 157 ALA CB C 157 16.120 16.120 18.265 -2.144 18493 1500 1 3 . 1 1 158 158 VAL N N 158 116.045 116.045 116.790 -0.745 18493 1501 1 3 . 1 1 158 158 VAL C C 158 177.491 177.491 177.687 -0.196 18493 1502 1 3 . 1 1 158 158 VAL CA C 158 67.160 67.160 65.797 1.363 18493 1503 1 3 . 1 1 158 158 VAL CB C 158 31.331 31.331 31.563 -0.232 18493 1504 1 3 . 1 1 159 159 LEU N N 159 116.776 116.776 120.293 -3.517 18493 1505 1 3 . 1 1 159 159 LEU C C 159 178.312 178.312 178.730 -0.418 18493 1506 1 3 . 1 1 159 159 LEU CA C 159 57.443 57.443 58.208 -0.765 18493 1507 1 3 . 1 1 159 159 LEU CB C 159 41.567 41.567 41.501 0.066 18493 1508 1 3 . 1 1 160 160 VAL N N 160 118.890 118.890 118.526 0.364 18493 1509 1 3 . 1 1 160 160 VAL C C 160 177.508 177.508 177.235 0.273 18493 1510 1 3 . 1 1 160 160 VAL CA C 160 67.366 67.366 65.410 1.956 18493 1511 1 3 . 1 1 160 160 VAL CB C 160 31.106 31.106 32.382 -1.276 18493 1512 1 3 . 1 1 161 161 VAL N N 161 118.360 118.360 118.629 -0.269 18493 1513 1 3 . 1 1 161 161 VAL C C 161 176.607 176.607 175.740 0.867 18493 1514 1 3 . 1 1 161 161 VAL CA C 161 67.614 67.614 62.342 5.272 18493 1515 1 3 . 1 1 161 161 VAL CB C 161 31.646 31.646 32.878 -1.232 18493 1516 1 4 . 1 1 11 11 GLY N N 11 108.456 108.456 109.684 -1.228 18493 1517 1 4 . 1 1 11 11 GLY H H 11 8.433 8.433 7.967 0.466 18493 1518 1 4 . 1 1 12 12 ARG C C 12 178.053 178.053 178.189 -0.136 18493 1519 1 4 . 1 1 12 12 ARG CA C 12 57.504 57.504 59.530 -2.026 18493 1520 1 4 . 1 1 12 12 ARG CB C 12 30.522 30.522 30.189 0.332 18493 1521 1 4 . 1 1 13 13 GLY N N 13 108.265 108.265 106.411 1.854 18493 1522 1 4 . 1 1 13 13 GLY C C 13 175.091 175.091 175.960 -0.869 18493 1523 1 4 . 1 1 13 13 GLY CA C 13 45.326 45.326 46.855 -1.529 18493 1524 1 4 . 1 1 14 14 ALA N N 14 123.181 123.181 125.475 -2.294 18493 1525 1 4 . 1 1 14 14 ALA C C 14 179.173 179.173 179.560 -0.387 18493 1526 1 4 . 1 1 14 14 ALA CA C 14 55.061 55.061 54.573 0.488 18493 1527 1 4 . 1 1 14 14 ALA H H 14 9.285 9.285 7.537 1.748 18493 1528 1 4 . 1 1 15 15 TRP N N 15 116.733 116.733 117.942 -1.209 18493 1529 1 4 . 1 1 15 15 TRP C C 15 179.425 179.425 178.384 1.041 18493 1530 1 4 . 1 1 15 15 TRP CA C 15 58.960 58.960 57.727 1.234 18493 1531 1 4 . 1 1 15 15 TRP CB C 15 29.529 29.529 29.715 -0.186 18493 1532 1 4 . 1 1 15 15 TRP H H 15 7.091 7.091 6.965 0.126 18493 1533 1 4 . 1 1 16 16 LEU N N 16 118.671 118.671 121.524 -2.853 18493 1534 1 4 . 1 1 16 16 LEU C C 16 178.461 178.461 178.678 -0.217 18493 1535 1 4 . 1 1 16 16 LEU CA C 16 58.246 58.246 58.039 0.207 18493 1536 1 4 . 1 1 16 16 LEU CB C 16 41.369 41.369 41.946 -0.577 18493 1537 1 4 . 1 1 16 16 LEU H H 16 9.180 9.180 9.060 0.120 18493 1538 1 4 . 1 1 17 17 LEU N N 17 118.515 118.515 119.344 -0.829 18493 1539 1 4 . 1 1 17 17 LEU C C 17 178.787 178.787 178.456 0.331 18493 1540 1 4 . 1 1 17 17 LEU CA C 17 57.832 57.832 58.315 -0.483 18493 1541 1 4 . 1 1 17 17 LEU CB C 17 41.395 41.395 41.462 -0.067 18493 1542 1 4 . 1 1 18 18 MET N N 18 120.633 120.633 118.793 1.840 18493 1543 1 4 . 1 1 18 18 MET C C 18 180.469 180.469 178.905 1.564 18493 1544 1 4 . 1 1 18 18 MET CA C 18 60.277 60.277 58.256 2.021 18493 1545 1 4 . 1 1 18 18 MET CB C 18 31.789 31.789 31.508 0.281 18493 1546 1 4 . 1 1 19 19 ALA N N 19 123.958 123.958 122.050 1.908 18493 1547 1 4 . 1 1 19 19 ALA C C 19 178.210 178.210 179.066 -0.856 18493 1548 1 4 . 1 1 19 19 ALA CA C 19 55.468 55.468 55.205 0.263 18493 1549 1 4 . 1 1 19 19 ALA CB C 19 17.865 17.865 18.394 -0.529 18493 1550 1 4 . 1 1 19 19 ALA H H 19 9.398 9.398 8.798 0.600 18493 1551 1 4 . 1 1 20 20 PHE N N 20 118.424 118.424 119.312 -0.888 18493 1552 1 4 . 1 1 20 20 PHE C C 20 176.674 176.674 177.173 -0.499 18493 1553 1 4 . 1 1 20 20 PHE CA C 20 62.546 62.546 60.942 1.604 18493 1554 1 4 . 1 1 20 20 PHE CB C 20 38.697 38.697 39.117 -0.421 18493 1555 1 4 . 1 1 21 21 THR N N 21 109.220 109.220 115.201 -5.981 18493 1556 1 4 . 1 1 21 21 THR C C 21 174.203 174.203 176.782 -2.579 18493 1557 1 4 . 1 1 21 21 THR CA C 21 66.052 66.052 66.654 -0.602 18493 1558 1 4 . 1 1 21 21 THR CB C 21 68.956 68.956 68.392 0.564 18493 1559 1 4 . 1 1 22 22 ALA N N 22 123.662 123.662 125.612 -1.950 18493 1560 1 4 . 1 1 22 22 ALA C C 22 179.488 179.488 179.605 -0.117 18493 1561 1 4 . 1 1 22 22 ALA CA C 22 54.847 54.847 54.520 0.327 18493 1562 1 4 . 1 1 22 22 ALA CB C 22 17.801 17.801 18.525 -0.724 18493 1563 1 4 . 1 1 23 23 LEU N N 23 118.917 118.917 119.963 -1.046 18493 1564 1 4 . 1 1 23 23 LEU C C 23 178.028 178.028 178.392 -0.364 18493 1565 1 4 . 1 1 23 23 LEU CA C 23 57.713 57.713 56.871 0.842 18493 1566 1 4 . 1 1 23 23 LEU CB C 23 41.506 41.506 41.489 0.017 18493 1567 1 4 . 1 1 23 23 LEU H H 23 8.581 8.581 8.056 0.525 18493 1568 1 4 . 1 1 24 24 ALA N N 24 119.931 119.931 121.122 -1.191 18493 1569 1 4 . 1 1 24 24 ALA C C 24 180.617 180.617 179.171 1.446 18493 1570 1 4 . 1 1 24 24 ALA CA C 24 55.350 55.350 54.300 1.050 18493 1571 1 4 . 1 1 24 24 ALA CB C 24 17.583 17.583 18.611 -1.028 18493 1572 1 4 . 1 1 25 25 LEU N N 25 119.691 119.691 118.857 0.834 18493 1573 1 4 . 1 1 25 25 LEU CA C 25 58.078 58.078 57.799 0.279 18493 1574 1 4 . 1 1 25 25 LEU CB C 25 43.597 43.597 41.801 1.796 18493 1575 1 4 . 1 1 25 25 LEU H H 25 9.179 9.179 8.708 0.471 18493 1576 1 4 . 1 1 26 26 GLU N N 26 119.651 119.651 117.366 2.285 18493 1577 1 4 . 1 1 26 26 GLU C C 26 179.334 179.334 177.970 1.364 18493 1578 1 4 . 1 1 26 26 GLU CA C 26 59.584 59.584 58.620 0.964 18493 1579 1 4 . 1 1 26 26 GLU CB C 26 27.202 27.202 28.852 -1.651 18493 1580 1 4 . 1 1 27 27 LEU N N 27 119.661 119.661 119.333 0.328 18493 1581 1 4 . 1 1 27 27 LEU CA C 27 57.887 57.887 56.876 1.011 18493 1582 1 4 . 1 1 27 27 LEU CB C 27 41.591 41.591 41.860 -0.269 18493 1583 1 4 . 1 1 27 27 LEU H H 27 9.410 9.410 7.569 1.841 18493 1584 1 4 . 1 1 28 28 THR N N 28 118.484 118.484 113.609 4.875 18493 1585 1 4 . 1 1 28 28 THR C C 28 175.898 175.898 176.696 -0.798 18493 1586 1 4 . 1 1 28 28 THR CA C 28 67.459 67.459 66.152 1.307 18493 1587 1 4 . 1 1 28 28 THR CB C 28 67.948 67.948 68.076 -0.128 18493 1588 1 4 . 1 1 29 29 ALA N N 29 122.643 122.643 125.190 -2.547 18493 1589 1 4 . 1 1 29 29 ALA C C 29 179.717 179.717 179.360 0.357 18493 1590 1 4 . 1 1 29 29 ALA CA C 29 55.919 55.919 54.755 1.164 18493 1591 1 4 . 1 1 29 29 ALA CB C 29 16.837 16.837 18.008 -1.171 18493 1592 1 4 . 1 1 29 29 ALA H H 29 8.302 8.302 7.741 0.561 18493 1593 1 4 . 1 1 30 30 LEU N N 30 117.408 117.408 116.653 0.755 18493 1594 1 4 . 1 1 30 30 LEU C C 30 178.143 178.143 178.316 -0.173 18493 1595 1 4 . 1 1 30 30 LEU CA C 30 57.384 57.384 56.118 1.266 18493 1596 1 4 . 1 1 30 30 LEU CB C 30 41.679 41.679 42.054 -0.375 18493 1597 1 4 . 1 1 30 30 LEU H H 30 8.412 8.412 8.365 0.047 18493 1598 1 4 . 1 1 31 31 TRP N N 31 125.692 125.692 121.404 4.288 18493 1599 1 4 . 1 1 31 31 TRP C C 31 179.053 179.053 178.184 0.869 18493 1600 1 4 . 1 1 31 31 TRP CA C 31 59.005 59.005 60.574 -1.569 18493 1601 1 4 . 1 1 31 31 TRP CB C 31 28.142 28.142 29.350 -1.208 18493 1602 1 4 . 1 1 31 31 TRP H H 31 9.157 9.157 7.948 1.209 18493 1603 1 4 . 1 1 32 32 PHE N N 32 119.195 119.195 118.593 0.602 18493 1604 1 4 . 1 1 32 32 PHE CA C 32 61.557 61.557 60.969 0.588 18493 1605 1 4 . 1 1 32 32 PHE CB C 32 38.384 38.384 38.242 0.142 18493 1606 1 4 . 1 1 32 32 PHE H H 32 9.374 9.374 8.327 1.047 18493 1607 1 4 . 1 1 33 33 GLN C C 33 177.477 177.477 177.441 0.036 18493 1608 1 4 . 1 1 33 33 GLN CA C 33 56.613 56.613 59.156 -2.543 18493 1609 1 4 . 1 1 33 33 GLN CB C 33 29.433 29.433 28.395 1.038 18493 1610 1 4 . 1 1 34 34 HIS N N 34 115.948 115.948 116.214 -0.266 18493 1611 1 4 . 1 1 34 34 HIS C C 34 175.548 175.548 177.646 -2.098 18493 1612 1 4 . 1 1 34 34 HIS CA C 34 58.733 58.733 56.606 2.127 18493 1613 1 4 . 1 1 34 34 HIS CB C 34 32.084 32.084 28.628 3.457 18493 1614 1 4 . 1 1 34 34 HIS H H 34 9.621 9.621 8.091 1.530 18493 1615 1 4 . 1 1 35 35 VAL N N 35 116.902 116.902 120.274 -3.372 18493 1616 1 4 . 1 1 35 35 VAL C C 35 177.853 177.853 177.305 0.548 18493 1617 1 4 . 1 1 35 35 VAL CA C 35 64.075 64.075 65.351 -1.276 18493 1618 1 4 . 1 1 35 35 VAL CB C 35 30.626 30.626 31.218 -0.592 18493 1619 1 4 . 1 1 36 36 MET N N 36 114.145 114.145 117.943 -3.798 18493 1620 1 4 . 1 1 36 36 MET C C 36 175.905 175.905 176.270 -0.365 18493 1621 1 4 . 1 1 36 36 MET H H 36 7.605 7.605 7.467 0.138 18493 1622 1 4 . 1 1 37 37 LEU N N 37 111.740 111.740 112.613 -0.873 18493 1623 1 4 . 1 1 37 37 LEU H H 37 7.121 7.121 7.516 -0.395 18493 1624 1 4 . 1 1 38 38 LEU C C 38 176.457 176.457 177.147 -0.690 18493 1625 1 4 . 1 1 39 39 LYS N N 39 121.418 121.418 122.261 -0.843 18493 1626 1 4 . 1 1 39 39 LYS CA C 39 57.471 57.471 58.034 -0.563 18493 1627 1 4 . 1 1 39 39 LYS H H 39 9.359 9.359 8.280 1.079 18493 1628 1 4 . 1 1 40 40 PRO CA C 40 60.451 60.451 62.216 -1.765 18493 1629 1 4 . 1 1 42 42 VAL N N 42 118.166 118.166 120.623 -2.457 18493 1630 1 4 . 1 1 42 42 VAL C C 42 179.261 179.261 177.170 2.091 18493 1631 1 4 . 1 1 42 42 VAL CA C 42 67.223 67.223 65.529 1.694 18493 1632 1 4 . 1 1 42 42 VAL CB C 42 30.941 30.941 31.063 -0.122 18493 1633 1 4 . 1 1 43 43 LEU N N 43 115.946 115.946 116.212 -0.266 18493 1634 1 4 . 1 1 43 43 LEU C C 43 178.293 178.293 178.550 -0.257 18493 1635 1 4 . 1 1 43 43 LEU CA C 43 57.129 57.129 57.158 -0.029 18493 1636 1 4 . 1 1 43 43 LEU CB C 43 41.030 41.030 41.387 -0.357 18493 1637 1 4 . 1 1 44 44 CYS N N 44 115.006 115.006 120.786 -5.780 18493 1638 1 4 . 1 1 44 44 CYS C C 44 177.484 177.484 176.641 0.843 18493 1639 1 4 . 1 1 44 44 CYS CA C 44 59.760 59.760 62.116 -2.356 18493 1640 1 4 . 1 1 44 44 CYS CB C 44 30.651 30.651 26.192 4.458 18493 1641 1 4 . 1 1 44 44 CYS H H 44 7.683 7.683 7.720 -0.037 18493 1642 1 4 . 1 1 45 45 ILE N N 45 119.384 119.384 119.363 0.021 18493 1643 1 4 . 1 1 45 45 ILE C C 45 179.575 179.575 177.646 1.929 18493 1644 1 4 . 1 1 45 45 ILE CA C 45 62.068 62.068 64.115 -2.047 18493 1645 1 4 . 1 1 45 45 ILE CB C 45 33.583 33.583 35.692 -2.109 18493 1646 1 4 . 1 1 46 46 TYR N N 46 120.126 120.126 120.604 -0.478 18493 1647 1 4 . 1 1 46 46 TYR C C 46 178.397 178.397 177.841 0.556 18493 1648 1 4 . 1 1 46 46 TYR CA C 46 59.129 59.129 62.172 -3.043 18493 1649 1 4 . 1 1 46 46 TYR CB C 46 35.347 35.347 38.187 -2.840 18493 1650 1 4 . 1 1 46 46 TYR H H 46 8.958 8.958 7.910 1.048 18493 1651 1 4 . 1 1 47 47 GLU N N 47 121.779 121.779 117.651 4.128 18493 1652 1 4 . 1 1 47 47 GLU C C 47 179.907 179.907 178.763 1.144 18493 1653 1 4 . 1 1 47 47 GLU CA C 47 57.985 57.985 58.537 -0.552 18493 1654 1 4 . 1 1 47 47 GLU CB C 47 27.290 27.290 28.974 -1.684 18493 1655 1 4 . 1 1 47 47 GLU H H 47 9.681 9.681 7.707 1.974 18493 1656 1 4 . 1 1 48 48 ARG N N 48 119.188 119.188 120.081 -0.893 18493 1657 1 4 . 1 1 48 48 ARG C C 48 181.638 181.638 178.677 2.961 18493 1658 1 4 . 1 1 48 48 ARG CA C 48 60.299 60.299 58.502 1.796 18493 1659 1 4 . 1 1 48 48 ARG CB C 48 30.167 30.167 29.467 0.700 18493 1660 1 4 . 1 1 48 48 ARG H H 48 9.213 9.213 7.929 1.284 18493 1661 1 4 . 1 1 49 49 VAL N N 49 121.326 121.326 119.671 1.655 18493 1662 1 4 . 1 1 49 49 VAL C C 49 177.326 177.326 177.657 -0.331 18493 1663 1 4 . 1 1 49 49 VAL CA C 49 66.624 66.624 66.379 0.245 18493 1664 1 4 . 1 1 49 49 VAL CB C 49 31.280 31.280 30.947 0.333 18493 1665 1 4 . 1 1 50 50 ALA N N 50 122.955 122.955 121.483 1.472 18493 1666 1 4 . 1 1 50 50 ALA C C 50 179.594 179.594 179.518 0.076 18493 1667 1 4 . 1 1 50 50 ALA CA C 50 55.902 55.902 55.079 0.823 18493 1668 1 4 . 1 1 50 50 ALA CB C 50 16.623 16.623 18.314 -1.691 18493 1669 1 4 . 1 1 51 51 LEU N N 51 115.737 115.737 118.701 -2.964 18493 1670 1 4 . 1 1 51 51 LEU C C 51 177.990 177.990 177.816 0.174 18493 1671 1 4 . 1 1 51 51 LEU CA C 51 57.285 57.285 58.057 -0.772 18493 1672 1 4 . 1 1 51 51 LEU CB C 51 41.369 41.369 40.379 0.990 18493 1673 1 4 . 1 1 52 52 PHE N N 52 122.707 122.707 120.619 2.088 18493 1674 1 4 . 1 1 52 52 PHE C C 52 179.142 179.142 177.791 1.351 18493 1675 1 4 . 1 1 52 52 PHE CA C 52 62.518 62.518 60.982 1.536 18493 1676 1 4 . 1 1 52 52 PHE CB C 52 38.538 38.538 39.121 -0.583 18493 1677 1 4 . 1 1 52 52 PHE H H 52 8.863 8.863 8.266 0.597 18493 1678 1 4 . 1 1 53 53 GLY N N 53 110.801 110.801 108.324 2.477 18493 1679 1 4 . 1 1 53 53 GLY C C 53 175.378 175.378 176.318 -0.940 18493 1680 1 4 . 1 1 53 53 GLY CA C 53 48.024 48.024 47.780 0.244 18493 1681 1 4 . 1 1 53 53 GLY H H 53 9.027 9.027 8.059 0.968 18493 1682 1 4 . 1 1 54 54 VAL N N 54 121.926 121.926 120.550 1.376 18493 1683 1 4 . 1 1 54 54 VAL C C 54 177.035 177.035 177.485 -0.450 18493 1684 1 4 . 1 1 54 54 VAL CA C 54 67.448 67.448 65.263 2.185 18493 1685 1 4 . 1 1 54 54 VAL CB C 54 31.246 31.246 31.112 0.134 18493 1686 1 4 . 1 1 54 54 VAL H H 54 7.948 7.948 8.272 -0.324 18493 1687 1 4 . 1 1 55 55 LEU N N 55 119.894 119.894 122.014 -2.120 18493 1688 1 4 . 1 1 55 55 LEU C C 55 178.175 178.175 178.223 -0.048 18493 1689 1 4 . 1 1 55 55 LEU CA C 55 58.490 58.490 58.134 0.356 18493 1690 1 4 . 1 1 55 55 LEU CB C 55 42.145 42.145 40.983 1.162 18493 1691 1 4 . 1 1 55 55 LEU H H 55 8.646 8.646 8.667 -0.021 18493 1692 1 4 . 1 1 56 56 GLY N N 56 106.262 106.262 106.198 0.064 18493 1693 1 4 . 1 1 56 56 GLY C C 56 174.618 174.618 175.322 -0.704 18493 1694 1 4 . 1 1 56 56 GLY CA C 56 47.533 47.533 47.191 0.342 18493 1695 1 4 . 1 1 57 57 ALA N N 57 123.002 123.002 124.784 -1.782 18493 1696 1 4 . 1 1 57 57 ALA C C 57 178.688 178.688 179.401 -0.713 18493 1697 1 4 . 1 1 57 57 ALA CA C 57 55.548 55.548 54.894 0.654 18493 1698 1 4 . 1 1 57 57 ALA CB C 57 18.065 18.065 18.361 -0.296 18493 1699 1 4 . 1 1 58 58 ALA N N 58 118.866 118.866 120.990 -2.124 18493 1700 1 4 . 1 1 58 58 ALA C C 58 179.348 179.348 178.844 0.504 18493 1701 1 4 . 1 1 58 58 ALA CA C 58 54.763 54.763 54.415 0.348 18493 1702 1 4 . 1 1 58 58 ALA CB C 58 17.898 17.898 18.144 -0.246 18493 1703 1 4 . 1 1 58 58 ALA H H 58 8.674 8.674 7.445 1.229 18493 1704 1 4 . 1 1 59 59 LEU N N 59 115.384 115.384 119.047 -3.663 18493 1705 1 4 . 1 1 59 59 LEU C C 59 177.654 177.654 179.336 -1.682 18493 1706 1 4 . 1 1 59 59 LEU CA C 59 57.387 57.387 57.613 -0.226 18493 1707 1 4 . 1 1 59 59 LEU CB C 59 41.209 41.209 42.219 -1.010 18493 1708 1 4 . 1 1 60 60 ILE N N 60 116.140 116.140 117.482 -1.342 18493 1709 1 4 . 1 1 60 60 ILE C C 60 180.024 180.024 177.496 2.528 18493 1710 1 4 . 1 1 60 60 ILE CA C 60 64.263 64.263 64.355 -0.092 18493 1711 1 4 . 1 1 60 60 ILE CB C 60 37.240 37.240 37.586 -0.346 18493 1712 1 4 . 1 1 61 61 GLY N N 61 110.127 110.127 105.150 4.977 18493 1713 1 4 . 1 1 61 61 GLY C C 61 173.716 173.716 174.421 -0.705 18493 1714 1 4 . 1 1 61 61 GLY CA C 61 45.617 45.617 45.510 0.107 18493 1715 1 4 . 1 1 61 61 GLY H H 61 9.046 9.046 7.879 1.167 18493 1716 1 4 . 1 1 62 62 ALA N N 62 118.949 118.949 123.501 -4.552 18493 1717 1 4 . 1 1 62 62 ALA C C 62 176.192 176.192 178.210 -2.018 18493 1718 1 4 . 1 1 62 62 ALA CA C 62 53.268 53.268 52.364 0.904 18493 1719 1 4 . 1 1 62 62 ALA CB C 62 19.138 19.138 18.728 0.410 18493 1720 1 4 . 1 1 62 62 ALA H H 62 8.066 8.066 7.699 0.367 18493 1721 1 4 . 1 1 63 63 ILE N N 63 116.800 116.800 119.986 -3.186 18493 1722 1 4 . 1 1 63 63 ILE CA C 63 66.739 66.739 63.035 3.704 18493 1723 1 4 . 1 1 63 63 ILE CB C 63 37.947 37.947 38.218 -0.272 18493 1724 1 4 . 1 1 64 64 ALA N N 64 123.957 123.957 120.463 3.494 18493 1725 1 4 . 1 1 64 64 ALA CA C 64 52.934 52.934 49.501 3.433 18493 1726 1 4 . 1 1 64 64 ALA CB C 64 19.428 19.428 18.894 0.534 18493 1727 1 4 . 1 1 65 65 PRO CA C 65 65.350 65.350 62.406 2.944 18493 1728 1 4 . 1 1 66 66 LYS N N 66 116.618 116.618 113.481 3.137 18493 1729 1 4 . 1 1 66 66 LYS C C 66 177.500 177.500 176.193 1.307 18493 1730 1 4 . 1 1 66 66 LYS CA C 66 56.547 56.547 56.616 -0.069 18493 1731 1 4 . 1 1 66 66 LYS CB C 66 30.522 30.522 29.129 1.393 18493 1732 1 4 . 1 1 67 67 THR CA C 67 60.452 60.452 63.216 -2.764 18493 1733 1 4 . 1 1 67 67 THR CB C 67 69.948 69.948 68.417 1.531 18493 1734 1 4 . 1 1 68 68 PRO C C 68 177.070 177.070 176.941 0.129 18493 1735 1 4 . 1 1 68 68 PRO CA C 68 63.315 63.315 61.591 1.724 18493 1736 1 4 . 1 1 68 68 PRO CB C 68 32.458 32.458 32.444 0.014 18493 1737 1 4 . 1 1 69 69 LEU N N 69 121.517 121.517 116.578 4.939 18493 1738 1 4 . 1 1 69 69 LEU C C 69 179.448 179.448 177.377 2.071 18493 1739 1 4 . 1 1 69 69 LEU CA C 69 57.389 57.389 57.107 0.282 18493 1740 1 4 . 1 1 69 69 LEU CB C 69 42.737 42.737 40.733 2.004 18493 1741 1 4 . 1 1 69 69 LEU H H 69 8.882 8.882 8.044 0.838 18493 1742 1 4 . 1 1 70 70 ARG N N 70 114.028 114.028 118.739 -4.711 18493 1743 1 4 . 1 1 70 70 ARG C C 70 177.925 177.925 177.438 0.487 18493 1744 1 4 . 1 1 70 70 ARG CA C 70 58.429 58.429 56.383 2.046 18493 1745 1 4 . 1 1 70 70 ARG CB C 70 29.391 29.391 28.815 0.576 18493 1746 1 4 . 1 1 70 70 ARG H H 70 8.202 8.202 7.839 0.363 18493 1747 1 4 . 1 1 71 71 TYR N N 71 121.740 121.740 118.206 3.534 18493 1748 1 4 . 1 1 71 71 TYR CA C 71 57.374 57.374 56.105 1.269 18493 1749 1 4 . 1 1 71 71 TYR H H 71 8.136 8.136 7.438 0.698 18493 1750 1 4 . 1 1 72 72 VAL N N 72 118.416 118.416 120.184 -1.768 18493 1751 1 4 . 1 1 72 72 VAL C C 72 177.702 177.702 177.229 0.473 18493 1752 1 4 . 1 1 72 72 VAL CA C 72 66.098 66.098 64.653 1.445 18493 1753 1 4 . 1 1 72 72 VAL CB C 72 31.343 31.343 30.896 0.447 18493 1754 1 4 . 1 1 73 73 ALA N N 73 120.283 120.283 122.469 -2.186 18493 1755 1 4 . 1 1 73 73 ALA C C 73 179.763 179.763 179.132 0.631 18493 1756 1 4 . 1 1 73 73 ALA CA C 73 55.785 55.785 54.984 0.801 18493 1757 1 4 . 1 1 73 73 ALA CB C 73 19.265 19.265 17.902 1.363 18493 1758 1 4 . 1 1 73 73 ALA H H 73 9.015 9.015 8.071 0.944 18493 1759 1 4 . 1 1 74 74 MET N N 74 115.547 115.547 116.906 -1.359 18493 1760 1 4 . 1 1 74 74 MET C C 74 177.223 177.223 178.715 -1.492 18493 1761 1 4 . 1 1 74 74 MET CA C 74 61.023 61.023 56.503 4.520 18493 1762 1 4 . 1 1 74 74 MET CB C 74 33.777 33.777 31.543 2.234 18493 1763 1 4 . 1 1 74 74 MET H H 74 8.163 8.163 7.540 0.623 18493 1764 1 4 . 1 1 75 75 VAL N N 75 118.690 118.690 120.334 -1.644 18493 1765 1 4 . 1 1 75 75 VAL C C 75 177.166 177.166 177.181 -0.015 18493 1766 1 4 . 1 1 75 75 VAL CA C 75 67.581 67.581 67.028 0.553 18493 1767 1 4 . 1 1 75 75 VAL CB C 75 31.408 31.408 32.142 -0.734 18493 1768 1 4 . 1 1 75 75 VAL H H 75 7.554 7.554 8.556 -1.002 18493 1769 1 4 . 1 1 76 76 ILE N N 76 118.959 118.959 120.139 -1.180 18493 1770 1 4 . 1 1 76 76 ILE C C 76 178.680 178.680 177.165 1.515 18493 1771 1 4 . 1 1 76 76 ILE CA C 76 65.839 65.839 64.745 1.094 18493 1772 1 4 . 1 1 76 76 ILE CB C 76 38.414 38.414 37.803 0.611 18493 1773 1 4 . 1 1 77 77 TRP N N 77 125.440 125.440 120.537 4.903 18493 1774 1 4 . 1 1 77 77 TRP C C 77 177.153 177.153 177.943 -0.790 18493 1775 1 4 . 1 1 77 77 TRP CA C 77 58.779 58.779 60.672 -1.893 18493 1776 1 4 . 1 1 77 77 TRP CB C 77 30.494 30.494 29.217 1.277 18493 1777 1 4 . 1 1 77 77 TRP H H 77 9.515 9.515 7.971 1.544 18493 1778 1 4 . 1 1 78 78 LEU N N 78 118.968 118.968 121.522 -2.554 18493 1779 1 4 . 1 1 78 78 LEU C C 78 178.381 178.381 178.278 0.103 18493 1780 1 4 . 1 1 78 78 LEU CA C 78 58.041 58.041 58.294 -0.253 18493 1781 1 4 . 1 1 78 78 LEU CB C 78 43.807 43.807 41.098 2.709 18493 1782 1 4 . 1 1 78 78 LEU H H 78 9.367 9.367 8.082 1.285 18493 1783 1 4 . 1 1 79 79 TYR N N 79 118.181 118.181 120.216 -2.035 18493 1784 1 4 . 1 1 79 79 TYR C C 79 176.777 176.777 177.922 -1.145 18493 1785 1 4 . 1 1 79 79 TYR CA C 79 62.849 62.849 62.365 0.483 18493 1786 1 4 . 1 1 80 80 SER N N 80 114.286 114.286 115.107 -0.821 18493 1787 1 4 . 1 1 80 80 SER C C 80 175.943 175.943 176.873 -0.930 18493 1788 1 4 . 1 1 80 80 SER CA C 80 63.515 63.515 61.732 1.783 18493 1789 1 4 . 1 1 80 80 SER CB C 80 63.941 63.941 62.844 1.097 18493 1790 1 4 . 1 1 81 81 ALA N N 81 121.070 121.070 123.601 -2.531 18493 1791 1 4 . 1 1 81 81 ALA C C 81 178.208 178.208 179.271 -1.063 18493 1792 1 4 . 1 1 81 81 ALA CA C 81 55.224 55.224 54.798 0.426 18493 1793 1 4 . 1 1 81 81 ALA CB C 81 17.897 17.897 18.166 -0.269 18493 1794 1 4 . 1 1 82 82 PHE N N 82 117.560 117.560 120.490 -2.930 18493 1795 1 4 . 1 1 82 82 PHE C C 82 176.975 176.975 176.998 -0.023 18493 1796 1 4 . 1 1 82 82 PHE CA C 82 62.132 62.132 61.157 0.975 18493 1797 1 4 . 1 1 82 82 PHE CB C 82 38.497 38.497 39.028 -0.531 18493 1798 1 4 . 1 1 83 83 ARG N N 83 117.110 117.110 119.021 -1.911 18493 1799 1 4 . 1 1 83 83 ARG C C 83 178.637 178.637 178.375 0.262 18493 1800 1 4 . 1 1 83 83 ARG CA C 83 60.291 60.291 59.248 1.043 18493 1801 1 4 . 1 1 83 83 ARG CB C 83 28.625 28.625 29.770 -1.145 18493 1802 1 4 . 1 1 84 84 GLY N N 84 105.915 105.915 106.673 -0.758 18493 1803 1 4 . 1 1 84 84 GLY C C 84 177.091 177.091 175.626 1.465 18493 1804 1 4 . 1 1 84 84 GLY CA C 84 46.128 46.128 46.675 -0.547 18493 1805 1 4 . 1 1 85 85 VAL N N 85 124.985 124.985 122.944 2.041 18493 1806 1 4 . 1 1 85 85 VAL C C 85 176.387 176.387 177.474 -1.087 18493 1807 1 4 . 1 1 85 85 VAL CA C 85 66.960 66.960 66.403 0.557 18493 1808 1 4 . 1 1 85 85 VAL CB C 85 31.066 31.066 31.923 -0.857 18493 1809 1 4 . 1 1 86 86 GLN N N 86 116.522 116.522 119.223 -2.701 18493 1810 1 4 . 1 1 86 86 GLN C C 86 179.586 179.586 178.453 1.133 18493 1811 1 4 . 1 1 86 86 GLN CA C 86 59.505 59.505 58.703 0.802 18493 1812 1 4 . 1 1 86 86 GLN CB C 86 28.762 28.762 27.982 0.780 18493 1813 1 4 . 1 1 87 87 LEU N N 87 121.211 121.211 121.238 -0.027 18493 1814 1 4 . 1 1 87 87 LEU C C 87 178.396 178.396 179.475 -1.079 18493 1815 1 4 . 1 1 87 87 LEU CA C 87 57.847 57.847 57.690 0.158 18493 1816 1 4 . 1 1 87 87 LEU CB C 87 41.924 41.924 41.593 0.331 18493 1817 1 4 . 1 1 87 87 LEU H H 87 8.955 8.955 7.908 1.047 18493 1818 1 4 . 1 1 88 88 THR N N 88 108.251 108.251 114.322 -6.071 18493 1819 1 4 . 1 1 88 88 THR C C 88 180.013 180.013 176.304 3.709 18493 1820 1 4 . 1 1 88 88 THR CA C 88 65.112 65.112 66.101 -0.989 18493 1821 1 4 . 1 1 88 88 THR CB C 88 68.805 68.805 68.690 0.115 18493 1822 1 4 . 1 1 88 88 THR H H 88 8.764 8.764 7.971 0.793 18493 1823 1 4 . 1 1 89 89 TYR N N 89 127.947 127.947 122.262 5.685 18493 1824 1 4 . 1 1 89 89 TYR C C 89 177.244 177.244 177.071 0.173 18493 1825 1 4 . 1 1 89 89 TYR H H 89 9.868 9.868 8.222 1.646 18493 1826 1 4 . 1 1 90 90 GLU N N 90 121.163 121.163 117.829 3.334 18493 1827 1 4 . 1 1 90 90 GLU C C 90 178.671 178.671 178.564 0.107 18493 1828 1 4 . 1 1 90 90 GLU H H 90 8.515 8.515 8.046 0.469 18493 1829 1 4 . 1 1 91 91 HIS N N 91 120.459 120.459 119.484 0.975 18493 1830 1 4 . 1 1 91 91 HIS C C 91 177.605 177.605 176.577 1.028 18493 1831 1 4 . 1 1 91 91 HIS CA C 91 57.085 57.085 58.661 -1.576 18493 1832 1 4 . 1 1 91 91 HIS CB C 91 34.128 34.128 29.830 4.298 18493 1833 1 4 . 1 1 91 91 HIS H H 91 9.102 9.102 7.683 1.419 18493 1834 1 4 . 1 1 92 92 THR N N 92 115.463 115.463 114.711 0.752 18493 1835 1 4 . 1 1 92 92 THR C C 92 176.189 176.189 176.084 0.105 18493 1836 1 4 . 1 1 92 92 THR CA C 92 67.058 67.058 65.582 1.476 18493 1837 1 4 . 1 1 92 92 THR CB C 92 68.564 68.564 69.351 -0.787 18493 1838 1 4 . 1 1 92 92 THR H H 92 9.550 9.550 7.966 1.584 18493 1839 1 4 . 1 1 93 93 MET N N 93 117.153 117.153 121.549 -4.396 18493 1840 1 4 . 1 1 93 93 MET C C 93 176.972 176.972 178.085 -1.113 18493 1841 1 4 . 1 1 93 93 MET CA C 93 62.369 62.369 57.323 5.046 18493 1842 1 4 . 1 1 93 93 MET CB C 93 33.515 33.515 31.378 2.136 18493 1843 1 4 . 1 1 94 94 LEU N N 94 117.981 117.981 117.863 0.118 18493 1844 1 4 . 1 1 94 94 LEU CA C 94 57.489 57.489 57.437 0.052 18493 1845 1 4 . 1 1 94 94 LEU CB C 94 41.432 41.432 40.319 1.113 18493 1846 1 4 . 1 1 94 94 LEU H H 94 8.497 8.497 8.327 0.170 18493 1847 1 4 . 1 1 95 95 GLN C C 95 178.331 178.331 177.677 0.654 18493 1848 1 4 . 1 1 95 95 GLN CA C 95 57.604 57.604 57.194 0.410 18493 1849 1 4 . 1 1 95 95 GLN CB C 95 28.200 28.200 28.940 -0.740 18493 1850 1 4 . 1 1 96 96 LEU N N 96 118.174 118.174 118.617 -0.443 18493 1851 1 4 . 1 1 96 96 LEU C C 96 177.842 177.842 176.212 1.630 18493 1852 1 4 . 1 1 96 96 LEU CA C 96 57.747 57.747 55.717 2.030 18493 1853 1 4 . 1 1 96 96 LEU CB C 96 41.721 41.721 42.223 -0.502 18493 1854 1 4 . 1 1 97 97 TYR N N 97 117.359 117.359 117.884 -0.525 18493 1855 1 4 . 1 1 97 97 TYR CA C 97 57.581 57.581 55.966 1.615 18493 1856 1 4 . 1 1 97 97 TYR H H 97 8.485 8.485 8.166 0.319 18493 1857 1 4 . 1 1 98 98 PRO CA C 98 63.847 63.847 62.156 1.692 18493 1858 1 4 . 1 1 99 99 SER CA C 99 58.145 58.145 55.418 2.727 18493 1859 1 4 . 1 1 99 99 SER CB C 99 64.506 64.506 64.047 0.459 18493 1860 1 4 . 1 1 101 101 PHE C C 101 174.992 174.992 174.792 0.200 18493 1861 1 4 . 1 1 102 102 ALA N N 102 120.614 120.614 122.285 -1.671 18493 1862 1 4 . 1 1 102 102 ALA C C 102 176.810 176.810 177.459 -0.649 18493 1863 1 4 . 1 1 102 102 ALA CA C 102 54.355 54.355 53.739 0.616 18493 1864 1 4 . 1 1 102 102 ALA H H 102 7.383 7.383 7.781 -0.398 18493 1865 1 4 . 1 1 103 103 THR N N 103 112.507 112.507 115.285 -2.778 18493 1866 1 4 . 1 1 103 103 THR C C 103 175.666 175.666 174.444 1.222 18493 1867 1 4 . 1 1 103 103 THR CA C 103 59.838 59.838 61.983 -2.145 18493 1868 1 4 . 1 1 103 103 THR CB C 103 67.623 67.623 69.637 -2.014 18493 1869 1 4 . 1 1 103 103 THR H H 103 9.278 9.278 7.999 1.279 18493 1870 1 4 . 1 1 104 104 CYS N N 104 122.754 122.754 119.593 3.161 18493 1871 1 4 . 1 1 104 104 CYS C C 104 174.474 174.474 173.805 0.669 18493 1872 1 4 . 1 1 104 104 CYS CA C 104 64.988 64.988 56.794 8.194 18493 1873 1 4 . 1 1 104 104 CYS CB C 104 42.988 42.988 30.100 12.888 18493 1874 1 4 . 1 1 104 104 CYS H H 104 9.934 9.934 8.683 1.251 18493 1875 1 4 . 1 1 105 105 ASP N N 105 121.350 121.350 121.948 -0.598 18493 1876 1 4 . 1 1 105 105 ASP CB C 105 41.030 41.030 39.741 1.289 18493 1877 1 4 . 1 1 105 105 ASP H H 105 8.153 8.153 7.955 0.198 18493 1878 1 4 . 1 1 115 115 PRO CA C 115 61.148 61.148 62.711 -1.563 18493 1879 1 4 . 1 1 115 115 PRO CB C 115 30.280 30.280 32.321 -2.041 18493 1880 1 4 . 1 1 116 116 LEU C C 116 178.163 178.163 175.946 2.217 18493 1881 1 4 . 1 1 116 116 LEU CA C 116 58.746 58.746 53.931 4.815 18493 1882 1 4 . 1 1 116 116 LEU CB C 116 42.932 42.932 44.877 -1.945 18493 1883 1 4 . 1 1 117 117 ASP N N 117 116.302 116.302 119.328 -3.026 18493 1884 1 4 . 1 1 117 117 ASP C C 117 177.528 177.528 177.090 0.438 18493 1885 1 4 . 1 1 117 117 ASP CB C 117 41.252 41.252 40.701 0.551 18493 1886 1 4 . 1 1 118 118 LYS N N 118 118.983 118.983 120.572 -1.589 18493 1887 1 4 . 1 1 118 118 LYS H H 118 7.538 7.538 8.415 -0.877 18493 1888 1 4 . 1 1 119 119 TRP C C 119 177.867 177.867 175.957 1.910 18493 1889 1 4 . 1 1 120 120 VAL N N 120 113.149 113.149 113.148 0.001 18493 1890 1 4 . 1 1 120 120 VAL CA C 120 58.651 58.651 59.444 -0.793 18493 1891 1 4 . 1 1 120 120 VAL CB C 120 31.821 31.821 34.161 -2.340 18493 1892 1 4 . 1 1 120 120 VAL H H 120 8.936 8.936 7.728 1.208 18493 1893 1 4 . 1 1 121 121 PRO C C 121 178.888 178.888 177.704 1.184 18493 1894 1 4 . 1 1 121 121 PRO CA C 121 65.185 65.185 64.484 0.702 18493 1895 1 4 . 1 1 121 121 PRO CB C 121 31.781 31.781 31.822 -0.041 18493 1896 1 4 . 1 1 122 122 GLN N N 122 116.304 116.304 117.231 -0.927 18493 1897 1 4 . 1 1 122 122 GLN C C 122 174.326 174.326 177.179 -2.853 18493 1898 1 4 . 1 1 122 122 GLN CA C 122 58.463 58.463 58.119 0.344 18493 1899 1 4 . 1 1 122 122 GLN H H 122 9.809 9.809 8.662 1.147 18493 1900 1 4 . 1 1 123 123 VAL N N 123 113.254 113.254 118.440 -5.186 18493 1901 1 4 . 1 1 123 123 VAL C C 123 175.777 175.777 176.294 -0.517 18493 1902 1 4 . 1 1 123 123 VAL CA C 123 61.689 61.689 65.003 -3.314 18493 1903 1 4 . 1 1 123 123 VAL CB C 123 35.373 35.373 32.256 3.117 18493 1904 1 4 . 1 1 123 123 VAL H H 123 8.219 8.219 7.776 0.443 18493 1905 1 4 . 1 1 124 124 PHE N N 124 112.242 112.242 117.774 -5.532 18493 1906 1 4 . 1 1 124 124 PHE C C 124 172.759 172.759 174.131 -1.372 18493 1907 1 4 . 1 1 124 124 PHE CB C 124 39.318 39.318 40.378 -1.060 18493 1908 1 4 . 1 1 125 125 VAL N N 125 115.233 115.233 122.708 -7.475 18493 1909 1 4 . 1 1 125 125 VAL C C 125 177.034 177.034 174.107 2.927 18493 1910 1 4 . 1 1 125 125 VAL CA C 125 61.950 61.950 62.024 -0.074 18493 1911 1 4 . 1 1 125 125 VAL CB C 125 33.376 33.376 35.418 -2.042 18493 1912 1 4 . 1 1 125 125 VAL H H 125 7.799 7.799 7.820 -0.021 18493 1913 1 4 . 1 1 126 126 ALA N N 126 130.709 130.709 127.118 3.591 18493 1914 1 4 . 1 1 126 126 ALA C C 126 175.920 175.920 177.328 -1.408 18493 1915 1 4 . 1 1 126 126 ALA CA C 126 54.493 54.493 52.143 2.350 18493 1916 1 4 . 1 1 126 126 ALA CB C 126 17.215 17.215 19.914 -2.699 18493 1917 1 4 . 1 1 126 126 ALA H H 126 9.014 9.014 8.252 0.762 18493 1918 1 4 . 1 1 127 127 SER N N 127 112.716 112.716 116.350 -3.634 18493 1919 1 4 . 1 1 127 127 SER CA C 127 58.101 58.101 59.198 -1.097 18493 1920 1 4 . 1 1 127 127 SER CB C 127 64.539 64.539 63.472 1.067 18493 1921 1 4 . 1 1 127 127 SER H H 127 8.145 8.145 7.947 0.198 18493 1922 1 4 . 1 1 128 128 GLY N N 128 106.487 106.487 112.165 -5.678 18493 1923 1 4 . 1 1 128 128 GLY C C 128 177.047 177.047 173.246 3.801 18493 1924 1 4 . 1 1 128 128 GLY CA C 128 46.296 46.296 44.871 1.425 18493 1925 1 4 . 1 1 128 128 GLY H H 128 8.595 8.595 8.531 0.064 18493 1926 1 4 . 1 1 129 129 ASP C C 129 177.916 177.916 176.143 1.773 18493 1927 1 4 . 1 1 129 129 ASP CB C 129 43.975 43.975 42.666 1.308 18493 1928 1 4 . 1 1 130 130 CYS N N 130 122.984 122.984 118.013 4.971 18493 1929 1 4 . 1 1 130 130 CYS C C 130 173.312 173.312 174.718 -1.406 18493 1930 1 4 . 1 1 130 130 CYS CA C 130 64.581 64.581 57.590 6.991 18493 1931 1 4 . 1 1 130 130 CYS CB C 130 42.879 42.879 28.292 14.587 18493 1932 1 4 . 1 1 130 130 CYS H H 130 9.948 9.948 8.424 1.524 18493 1933 1 4 . 1 1 131 131 ALA N N 131 121.534 121.534 123.268 -1.734 18493 1934 1 4 . 1 1 131 131 ALA CA C 131 52.640 52.640 52.924 -0.284 18493 1935 1 4 . 1 1 131 131 ALA CB C 131 18.497 18.497 19.070 -0.573 18493 1936 1 4 . 1 1 131 131 ALA H H 131 9.869 9.869 8.406 1.463 18493 1937 1 4 . 1 1 136 136 ASP C C 136 172.916 172.916 175.237 -2.321 18493 1938 1 4 . 1 1 137 137 PHE N N 137 117.677 117.677 119.204 -1.527 18493 1939 1 4 . 1 1 137 137 PHE CA C 137 57.310 57.310 56.871 0.439 18493 1940 1 4 . 1 1 137 137 PHE CB C 137 42.927 42.927 40.110 2.817 18493 1941 1 4 . 1 1 137 137 PHE H H 137 8.959 8.959 8.494 0.465 18493 1942 1 4 . 1 1 138 138 LEU CB C 138 43.547 43.547 39.338 4.209 18493 1943 1 4 . 1 1 139 139 GLY C C 139 176.262 176.262 172.868 3.394 18493 1944 1 4 . 1 1 139 139 GLY CA C 139 46.123 46.123 45.079 1.044 18493 1945 1 4 . 1 1 140 140 LEU N N 140 124.207 124.207 120.144 4.063 18493 1946 1 4 . 1 1 140 140 LEU CB C 140 40.503 40.503 43.606 -3.103 18493 1947 1 4 . 1 1 142 142 MET CA C 142 56.442 56.442 60.861 -4.418 18493 1948 1 4 . 1 1 143 143 PRO CA C 143 63.254 63.254 65.745 -2.490 18493 1949 1 4 . 1 1 144 144 GLN C C 144 177.307 177.307 178.774 -1.467 18493 1950 1 4 . 1 1 145 145 TRP N N 145 120.795 120.795 121.500 -0.705 18493 1951 1 4 . 1 1 145 145 TRP C C 145 178.709 178.709 178.957 -0.248 18493 1952 1 4 . 1 1 145 145 TRP CA C 145 59.535 59.535 58.869 0.666 18493 1953 1 4 . 1 1 145 145 TRP CB C 145 29.345 29.345 28.702 0.643 18493 1954 1 4 . 1 1 145 145 TRP H H 145 8.386 8.386 7.895 0.491 18493 1955 1 4 . 1 1 146 146 LEU N N 146 118.336 118.336 120.582 -2.246 18493 1956 1 4 . 1 1 146 146 LEU C C 146 177.115 177.115 178.753 -1.638 18493 1957 1 4 . 1 1 146 146 LEU CA C 146 57.793 57.793 58.301 -0.508 18493 1958 1 4 . 1 1 146 146 LEU CB C 146 41.616 41.616 41.634 -0.018 18493 1959 1 4 . 1 1 146 146 LEU H H 146 9.033 9.033 8.980 0.053 18493 1960 1 4 . 1 1 147 147 LEU N N 147 123.772 123.772 119.402 4.370 18493 1961 1 4 . 1 1 147 147 LEU C C 147 178.787 178.787 178.698 0.089 18493 1962 1 4 . 1 1 147 147 LEU CA C 147 58.052 58.052 57.935 0.117 18493 1963 1 4 . 1 1 147 147 LEU CB C 147 41.047 41.047 41.029 0.018 18493 1964 1 4 . 1 1 147 147 LEU H H 147 8.480 8.480 8.007 0.473 18493 1965 1 4 . 1 1 148 148 GLY N N 148 104.457 104.457 107.457 -3.000 18493 1966 1 4 . 1 1 148 148 GLY C C 148 174.667 174.667 176.196 -1.529 18493 1967 1 4 . 1 1 148 148 GLY CA C 148 48.102 48.102 47.190 0.912 18493 1968 1 4 . 1 1 149 149 ILE N N 149 121.815 121.815 122.892 -1.077 18493 1969 1 4 . 1 1 149 149 ILE C C 149 177.725 177.725 177.893 -0.168 18493 1970 1 4 . 1 1 149 149 ILE CA C 149 65.997 65.997 64.910 1.087 18493 1971 1 4 . 1 1 149 149 ILE CB C 149 38.262 38.262 38.000 0.262 18493 1972 1 4 . 1 1 150 150 PHE N N 150 118.894 118.894 118.405 0.489 18493 1973 1 4 . 1 1 150 150 PHE C C 150 178.929 178.929 177.833 1.096 18493 1974 1 4 . 1 1 150 150 PHE CA C 150 63.591 63.591 62.669 0.922 18493 1975 1 4 . 1 1 150 150 PHE CB C 150 38.417 38.417 38.509 -0.092 18493 1976 1 4 . 1 1 151 151 ILE N N 151 120.535 120.535 120.542 -0.007 18493 1977 1 4 . 1 1 151 151 ILE C C 151 177.347 177.347 177.775 -0.428 18493 1978 1 4 . 1 1 151 151 ILE CA C 151 66.478 66.478 65.512 0.966 18493 1979 1 4 . 1 1 151 151 ILE CB C 151 37.302 37.302 37.514 -0.212 18493 1980 1 4 . 1 1 152 152 ALA N N 152 122.855 122.855 123.207 -0.352 18493 1981 1 4 . 1 1 152 152 ALA C C 152 179.165 179.165 179.736 -0.571 18493 1982 1 4 . 1 1 152 152 ALA CA C 152 56.272 56.272 55.358 0.914 18493 1983 1 4 . 1 1 152 152 ALA CB C 152 17.993 17.993 17.937 0.056 18493 1984 1 4 . 1 1 153 153 TYR N N 153 116.156 116.156 118.500 -2.344 18493 1985 1 4 . 1 1 153 153 TYR C C 153 179.682 179.682 177.615 2.067 18493 1986 1 4 . 1 1 153 153 TYR CA C 153 64.391 64.391 61.598 2.793 18493 1987 1 4 . 1 1 153 153 TYR CB C 153 39.553 39.553 38.372 1.181 18493 1988 1 4 . 1 1 153 153 TYR H H 153 8.680 8.680 7.808 0.872 18493 1989 1 4 . 1 1 154 154 LEU N N 154 122.327 122.327 121.882 0.445 18493 1990 1 4 . 1 1 154 154 LEU C C 154 177.336 177.336 178.368 -1.032 18493 1991 1 4 . 1 1 154 154 LEU CA C 154 57.905 57.905 58.386 -0.482 18493 1992 1 4 . 1 1 154 154 LEU CB C 154 42.009 42.009 41.802 0.207 18493 1993 1 4 . 1 1 155 155 ILE N N 155 119.079 119.079 118.777 0.302 18493 1994 1 4 . 1 1 155 155 ILE C C 155 177.589 177.589 178.302 -0.713 18493 1995 1 4 . 1 1 155 155 ILE CA C 155 65.996 65.996 64.605 1.391 18493 1996 1 4 . 1 1 155 155 ILE CB C 155 38.179 38.179 36.599 1.581 18493 1997 1 4 . 1 1 156 156 VAL N N 156 117.551 117.551 121.538 -3.987 18493 1998 1 4 . 1 1 156 156 VAL C C 156 176.163 176.163 177.496 -1.333 18493 1999 1 4 . 1 1 156 156 VAL CA C 156 67.664 67.664 66.721 0.943 18493 2000 1 4 . 1 1 156 156 VAL CB C 156 31.694 31.694 31.015 0.680 18493 2001 1 4 . 1 1 157 157 ALA N N 157 122.470 122.470 121.675 0.795 18493 2002 1 4 . 1 1 157 157 ALA C C 157 179.076 179.076 179.906 -0.830 18493 2003 1 4 . 1 1 157 157 ALA CA C 157 54.803 54.803 55.151 -0.348 18493 2004 1 4 . 1 1 157 157 ALA CB C 157 16.120 16.120 17.738 -1.618 18493 2005 1 4 . 1 1 158 158 VAL N N 158 116.045 116.045 119.498 -3.453 18493 2006 1 4 . 1 1 158 158 VAL C C 158 177.491 177.491 177.951 -0.460 18493 2007 1 4 . 1 1 158 158 VAL CA C 158 67.160 67.160 66.591 0.569 18493 2008 1 4 . 1 1 158 158 VAL CB C 158 31.331 31.331 31.329 0.002 18493 2009 1 4 . 1 1 159 159 LEU N N 159 116.776 116.776 121.233 -4.457 18493 2010 1 4 . 1 1 159 159 LEU C C 159 178.312 178.312 178.722 -0.410 18493 2011 1 4 . 1 1 159 159 LEU CA C 159 57.443 57.443 58.293 -0.850 18493 2012 1 4 . 1 1 159 159 LEU CB C 159 41.567 41.567 41.912 -0.345 18493 2013 1 4 . 1 1 160 160 VAL N N 160 118.890 118.890 118.658 0.232 18493 2014 1 4 . 1 1 160 160 VAL C C 160 177.508 177.508 177.519 -0.011 18493 2015 1 4 . 1 1 160 160 VAL CA C 160 67.366 67.366 65.250 2.116 18493 2016 1 4 . 1 1 160 160 VAL CB C 160 31.106 31.106 32.196 -1.090 18493 2017 1 4 . 1 1 161 161 VAL N N 161 118.360 118.360 120.151 -1.791 18493 2018 1 4 . 1 1 161 161 VAL C C 161 176.607 176.607 176.673 -0.066 18493 2019 1 4 . 1 1 161 161 VAL CA C 161 67.614 67.614 64.575 3.039 18493 2020 1 4 . 1 1 161 161 VAL CB C 161 31.646 31.646 32.537 -0.891 18493 2021 1 5 . 1 1 11 11 GLY N N 11 108.456 108.456 109.625 -1.169 18493 2022 1 5 . 1 1 11 11 GLY H H 11 8.433 8.433 7.598 0.835 18493 2023 1 5 . 1 1 12 12 ARG C C 12 178.053 178.053 178.258 -0.205 18493 2024 1 5 . 1 1 12 12 ARG CA C 12 57.504 57.504 58.691 -1.187 18493 2025 1 5 . 1 1 12 12 ARG CB C 12 30.522 30.522 30.520 0.002 18493 2026 1 5 . 1 1 13 13 GLY N N 13 108.265 108.265 106.509 1.756 18493 2027 1 5 . 1 1 13 13 GLY C C 13 175.091 175.091 175.965 -0.874 18493 2028 1 5 . 1 1 13 13 GLY CA C 13 45.326 45.326 46.941 -1.615 18493 2029 1 5 . 1 1 14 14 ALA N N 14 123.181 123.181 124.479 -1.298 18493 2030 1 5 . 1 1 14 14 ALA C C 14 179.173 179.173 179.326 -0.153 18493 2031 1 5 . 1 1 14 14 ALA CA C 14 55.061 55.061 54.891 0.170 18493 2032 1 5 . 1 1 14 14 ALA H H 14 9.285 9.285 8.342 0.943 18493 2033 1 5 . 1 1 15 15 TRP N N 15 116.733 116.733 115.865 0.868 18493 2034 1 5 . 1 1 15 15 TRP C C 15 179.425 179.425 178.526 0.899 18493 2035 1 5 . 1 1 15 15 TRP CA C 15 58.960 58.960 57.414 1.546 18493 2036 1 5 . 1 1 15 15 TRP CB C 15 29.529 29.529 28.627 0.902 18493 2037 1 5 . 1 1 15 15 TRP H H 15 7.091 7.091 7.373 -0.282 18493 2038 1 5 . 1 1 16 16 LEU N N 16 118.671 118.671 121.915 -3.244 18493 2039 1 5 . 1 1 16 16 LEU C C 16 178.461 178.461 179.425 -0.964 18493 2040 1 5 . 1 1 16 16 LEU CA C 16 58.246 58.246 58.294 -0.048 18493 2041 1 5 . 1 1 16 16 LEU CB C 16 41.369 41.369 41.082 0.287 18493 2042 1 5 . 1 1 16 16 LEU H H 16 9.180 9.180 8.586 0.594 18493 2043 1 5 . 1 1 17 17 LEU N N 17 118.515 118.515 120.349 -1.834 18493 2044 1 5 . 1 1 17 17 LEU C C 17 178.787 178.787 178.921 -0.134 18493 2045 1 5 . 1 1 17 17 LEU CA C 17 57.832 57.832 58.472 -0.640 18493 2046 1 5 . 1 1 17 17 LEU CB C 17 41.395 41.395 42.123 -0.728 18493 2047 1 5 . 1 1 18 18 MET N N 18 120.633 120.633 117.731 2.902 18493 2048 1 5 . 1 1 18 18 MET C C 18 180.469 180.469 178.681 1.788 18493 2049 1 5 . 1 1 18 18 MET CA C 18 60.277 60.277 56.822 3.455 18493 2050 1 5 . 1 1 18 18 MET CB C 18 31.789 31.789 31.108 0.681 18493 2051 1 5 . 1 1 19 19 ALA N N 19 123.958 123.958 122.670 1.288 18493 2052 1 5 . 1 1 19 19 ALA C C 19 178.210 178.210 178.913 -0.703 18493 2053 1 5 . 1 1 19 19 ALA CA C 19 55.468 55.468 55.219 0.249 18493 2054 1 5 . 1 1 19 19 ALA CB C 19 17.865 17.865 18.422 -0.557 18493 2055 1 5 . 1 1 19 19 ALA H H 19 9.398 9.398 9.085 0.313 18493 2056 1 5 . 1 1 20 20 PHE N N 20 118.424 118.424 118.487 -0.063 18493 2057 1 5 . 1 1 20 20 PHE C C 20 176.674 176.674 177.325 -0.651 18493 2058 1 5 . 1 1 20 20 PHE CA C 20 62.546 62.546 61.155 1.391 18493 2059 1 5 . 1 1 20 20 PHE CB C 20 38.697 38.697 39.255 -0.558 18493 2060 1 5 . 1 1 21 21 THR N N 21 109.220 109.220 117.157 -7.937 18493 2061 1 5 . 1 1 21 21 THR C C 21 174.203 174.203 176.386 -2.183 18493 2062 1 5 . 1 1 21 21 THR CA C 21 66.052 66.052 67.741 -1.689 18493 2063 1 5 . 1 1 21 21 THR CB C 21 68.956 68.956 68.613 0.343 18493 2064 1 5 . 1 1 22 22 ALA N N 22 123.662 123.662 125.210 -1.548 18493 2065 1 5 . 1 1 22 22 ALA C C 22 179.488 179.488 179.309 0.179 18493 2066 1 5 . 1 1 22 22 ALA CA C 22 54.847 54.847 55.150 -0.303 18493 2067 1 5 . 1 1 22 22 ALA CB C 22 17.801 17.801 18.442 -0.641 18493 2068 1 5 . 1 1 23 23 LEU N N 23 118.917 118.917 119.991 -1.074 18493 2069 1 5 . 1 1 23 23 LEU C C 23 178.028 178.028 178.784 -0.756 18493 2070 1 5 . 1 1 23 23 LEU CA C 23 57.713 57.713 57.245 0.468 18493 2071 1 5 . 1 1 23 23 LEU CB C 23 41.506 41.506 41.385 0.121 18493 2072 1 5 . 1 1 23 23 LEU H H 23 8.581 8.581 7.461 1.120 18493 2073 1 5 . 1 1 24 24 ALA N N 24 119.931 119.931 122.129 -2.198 18493 2074 1 5 . 1 1 24 24 ALA C C 24 180.617 180.617 179.660 0.957 18493 2075 1 5 . 1 1 24 24 ALA CA C 24 55.350 55.350 54.561 0.789 18493 2076 1 5 . 1 1 24 24 ALA CB C 24 17.583 17.583 18.010 -0.427 18493 2077 1 5 . 1 1 25 25 LEU N N 25 119.691 119.691 118.693 0.998 18493 2078 1 5 . 1 1 25 25 LEU CA C 25 58.078 58.078 57.569 0.509 18493 2079 1 5 . 1 1 25 25 LEU CB C 25 43.597 43.597 41.198 2.399 18493 2080 1 5 . 1 1 25 25 LEU H H 25 9.179 9.179 8.634 0.545 18493 2081 1 5 . 1 1 26 26 GLU N N 26 119.651 119.651 120.249 -0.598 18493 2082 1 5 . 1 1 26 26 GLU C C 26 179.334 179.334 179.018 0.316 18493 2083 1 5 . 1 1 26 26 GLU CA C 26 59.584 59.584 58.998 0.586 18493 2084 1 5 . 1 1 26 26 GLU CB C 26 27.202 27.202 28.655 -1.453 18493 2085 1 5 . 1 1 27 27 LEU N N 27 119.661 119.661 120.648 -0.987 18493 2086 1 5 . 1 1 27 27 LEU CA C 27 57.887 57.887 58.133 -0.246 18493 2087 1 5 . 1 1 27 27 LEU CB C 27 41.591 41.591 41.028 0.563 18493 2088 1 5 . 1 1 27 27 LEU H H 27 9.410 9.410 7.562 1.848 18493 2089 1 5 . 1 1 28 28 THR N N 28 118.484 118.484 114.919 3.565 18493 2090 1 5 . 1 1 28 28 THR C C 28 175.898 175.898 176.666 -0.768 18493 2091 1 5 . 1 1 28 28 THR CA C 28 67.459 67.459 66.689 0.770 18493 2092 1 5 . 1 1 28 28 THR CB C 28 67.948 67.948 68.159 -0.211 18493 2093 1 5 . 1 1 29 29 ALA N N 29 122.643 122.643 124.959 -2.316 18493 2094 1 5 . 1 1 29 29 ALA C C 29 179.717 179.717 178.872 0.845 18493 2095 1 5 . 1 1 29 29 ALA CA C 29 55.919 55.919 54.916 1.003 18493 2096 1 5 . 1 1 29 29 ALA CB C 29 16.837 16.837 18.086 -1.249 18493 2097 1 5 . 1 1 29 29 ALA H H 29 8.302 8.302 8.182 0.120 18493 2098 1 5 . 1 1 30 30 LEU N N 30 117.408 117.408 115.607 1.801 18493 2099 1 5 . 1 1 30 30 LEU C C 30 178.143 178.143 177.826 0.317 18493 2100 1 5 . 1 1 30 30 LEU CA C 30 57.384 57.384 56.068 1.316 18493 2101 1 5 . 1 1 30 30 LEU CB C 30 41.679 41.679 41.526 0.153 18493 2102 1 5 . 1 1 30 30 LEU H H 30 8.412 8.412 7.912 0.500 18493 2103 1 5 . 1 1 31 31 TRP N N 31 125.692 125.692 119.683 6.009 18493 2104 1 5 . 1 1 31 31 TRP C C 31 179.053 179.053 177.916 1.137 18493 2105 1 5 . 1 1 31 31 TRP CA C 31 59.005 59.005 58.609 0.396 18493 2106 1 5 . 1 1 31 31 TRP CB C 31 28.142 28.142 31.108 -2.966 18493 2107 1 5 . 1 1 31 31 TRP H H 31 9.157 9.157 7.632 1.525 18493 2108 1 5 . 1 1 32 32 PHE N N 32 119.195 119.195 116.178 3.017 18493 2109 1 5 . 1 1 32 32 PHE CA C 32 61.557 61.557 60.684 0.872 18493 2110 1 5 . 1 1 32 32 PHE CB C 32 38.384 38.384 37.583 0.801 18493 2111 1 5 . 1 1 32 32 PHE H H 32 9.374 9.374 6.877 2.497 18493 2112 1 5 . 1 1 33 33 GLN C C 33 177.477 177.477 177.583 -0.106 18493 2113 1 5 . 1 1 33 33 GLN CA C 33 56.613 56.613 59.086 -2.473 18493 2114 1 5 . 1 1 33 33 GLN CB C 33 29.433 29.433 27.279 2.155 18493 2115 1 5 . 1 1 34 34 HIS N N 34 115.948 115.948 115.874 0.074 18493 2116 1 5 . 1 1 34 34 HIS C C 34 175.548 175.548 176.427 -0.879 18493 2117 1 5 . 1 1 34 34 HIS CA C 34 58.733 58.733 57.596 1.137 18493 2118 1 5 . 1 1 34 34 HIS CB C 34 32.084 32.084 29.244 2.840 18493 2119 1 5 . 1 1 34 34 HIS H H 34 9.621 9.621 7.309 2.312 18493 2120 1 5 . 1 1 35 35 VAL N N 35 116.902 116.902 118.828 -1.926 18493 2121 1 5 . 1 1 35 35 VAL C C 35 177.853 177.853 176.683 1.170 18493 2122 1 5 . 1 1 35 35 VAL CA C 35 64.075 64.075 64.874 -0.799 18493 2123 1 5 . 1 1 35 35 VAL CB C 35 30.626 30.626 31.670 -1.044 18493 2124 1 5 . 1 1 36 36 MET N N 36 114.145 114.145 116.070 -1.925 18493 2125 1 5 . 1 1 36 36 MET C C 36 175.905 175.905 175.889 0.016 18493 2126 1 5 . 1 1 36 36 MET H H 36 7.605 7.605 7.277 0.328 18493 2127 1 5 . 1 1 37 37 LEU N N 37 111.740 111.740 119.451 -7.711 18493 2128 1 5 . 1 1 37 37 LEU H H 37 7.121 7.121 7.975 -0.854 18493 2129 1 5 . 1 1 38 38 LEU C C 38 176.457 176.457 175.868 0.589 18493 2130 1 5 . 1 1 39 39 LYS N N 39 121.418 121.418 120.974 0.444 18493 2131 1 5 . 1 1 39 39 LYS CA C 39 57.471 57.471 54.545 2.926 18493 2132 1 5 . 1 1 39 39 LYS H H 39 9.359 9.359 8.118 1.241 18493 2133 1 5 . 1 1 40 40 PRO CA C 40 60.451 60.451 62.023 -1.572 18493 2134 1 5 . 1 1 42 42 VAL N N 42 118.166 118.166 123.010 -4.844 18493 2135 1 5 . 1 1 42 42 VAL C C 42 179.261 179.261 175.934 3.327 18493 2136 1 5 . 1 1 42 42 VAL CA C 42 67.223 67.223 60.112 7.111 18493 2137 1 5 . 1 1 42 42 VAL CB C 42 30.941 30.941 34.310 -3.369 18493 2138 1 5 . 1 1 43 43 LEU N N 43 115.946 115.946 123.870 -7.924 18493 2139 1 5 . 1 1 43 43 LEU C C 43 178.293 178.293 178.725 -0.432 18493 2140 1 5 . 1 1 43 43 LEU CA C 43 57.129 57.129 58.303 -1.174 18493 2141 1 5 . 1 1 43 43 LEU CB C 43 41.030 41.030 40.802 0.228 18493 2142 1 5 . 1 1 44 44 CYS N N 44 115.006 115.006 116.449 -1.443 18493 2143 1 5 . 1 1 44 44 CYS C C 44 177.484 177.484 176.701 0.783 18493 2144 1 5 . 1 1 44 44 CYS CA C 44 59.760 59.760 60.320 -0.560 18493 2145 1 5 . 1 1 44 44 CYS CB C 44 30.651 30.651 25.997 4.654 18493 2146 1 5 . 1 1 44 44 CYS H H 44 7.683 7.683 8.331 -0.648 18493 2147 1 5 . 1 1 45 45 ILE N N 45 119.384 119.384 122.087 -2.703 18493 2148 1 5 . 1 1 45 45 ILE C C 45 179.575 179.575 177.084 2.491 18493 2149 1 5 . 1 1 45 45 ILE CA C 45 62.068 62.068 65.270 -3.202 18493 2150 1 5 . 1 1 45 45 ILE CB C 45 33.583 33.583 37.668 -4.085 18493 2151 1 5 . 1 1 46 46 TYR N N 46 120.126 120.126 119.898 0.228 18493 2152 1 5 . 1 1 46 46 TYR C C 46 178.397 178.397 176.994 1.403 18493 2153 1 5 . 1 1 46 46 TYR CA C 46 59.129 59.129 61.526 -2.397 18493 2154 1 5 . 1 1 46 46 TYR CB C 46 35.347 35.347 38.448 -3.101 18493 2155 1 5 . 1 1 46 46 TYR H H 46 8.958 8.958 7.982 0.976 18493 2156 1 5 . 1 1 47 47 GLU N N 47 121.779 121.779 116.079 5.700 18493 2157 1 5 . 1 1 47 47 GLU C C 47 179.907 179.907 179.033 0.874 18493 2158 1 5 . 1 1 47 47 GLU CA C 47 57.985 57.985 57.849 0.136 18493 2159 1 5 . 1 1 47 47 GLU CB C 47 27.290 27.290 29.202 -1.912 18493 2160 1 5 . 1 1 47 47 GLU H H 47 9.681 9.681 7.982 1.699 18493 2161 1 5 . 1 1 48 48 ARG N N 48 119.188 119.188 121.951 -2.763 18493 2162 1 5 . 1 1 48 48 ARG C C 48 181.638 181.638 178.493 3.145 18493 2163 1 5 . 1 1 48 48 ARG CA C 48 60.299 60.299 59.263 1.036 18493 2164 1 5 . 1 1 48 48 ARG CB C 48 30.167 30.167 30.043 0.124 18493 2165 1 5 . 1 1 48 48 ARG H H 48 9.213 9.213 8.202 1.011 18493 2166 1 5 . 1 1 49 49 VAL N N 49 121.326 121.326 119.514 1.812 18493 2167 1 5 . 1 1 49 49 VAL C C 49 177.326 177.326 177.200 0.126 18493 2168 1 5 . 1 1 49 49 VAL CA C 49 66.624 66.624 65.978 0.646 18493 2169 1 5 . 1 1 49 49 VAL CB C 49 31.280 31.280 31.672 -0.392 18493 2170 1 5 . 1 1 50 50 ALA N N 50 122.955 122.955 121.973 0.982 18493 2171 1 5 . 1 1 50 50 ALA C C 50 179.594 179.594 179.365 0.229 18493 2172 1 5 . 1 1 50 50 ALA CA C 50 55.902 55.902 55.057 0.845 18493 2173 1 5 . 1 1 50 50 ALA CB C 50 16.623 16.623 18.067 -1.444 18493 2174 1 5 . 1 1 51 51 LEU N N 51 115.737 115.737 117.179 -1.442 18493 2175 1 5 . 1 1 51 51 LEU C C 51 177.990 177.990 178.425 -0.435 18493 2176 1 5 . 1 1 51 51 LEU CA C 51 57.285 57.285 58.157 -0.873 18493 2177 1 5 . 1 1 51 51 LEU CB C 51 41.369 41.369 40.825 0.544 18493 2178 1 5 . 1 1 52 52 PHE N N 52 122.707 122.707 118.987 3.720 18493 2179 1 5 . 1 1 52 52 PHE C C 52 179.142 179.142 177.993 1.149 18493 2180 1 5 . 1 1 52 52 PHE CA C 52 62.518 62.518 61.652 0.866 18493 2181 1 5 . 1 1 52 52 PHE CB C 52 38.538 38.538 37.670 0.868 18493 2182 1 5 . 1 1 52 52 PHE H H 52 8.863 8.863 7.948 0.915 18493 2183 1 5 . 1 1 53 53 GLY N N 53 110.801 110.801 107.772 3.029 18493 2184 1 5 . 1 1 53 53 GLY C C 53 175.378 175.378 176.710 -1.332 18493 2185 1 5 . 1 1 53 53 GLY CA C 53 48.024 48.024 47.105 0.919 18493 2186 1 5 . 1 1 53 53 GLY H H 53 9.027 9.027 7.724 1.303 18493 2187 1 5 . 1 1 54 54 VAL N N 54 121.926 121.926 123.001 -1.075 18493 2188 1 5 . 1 1 54 54 VAL C C 54 177.035 177.035 177.404 -0.369 18493 2189 1 5 . 1 1 54 54 VAL CA C 54 67.448 67.448 64.725 2.723 18493 2190 1 5 . 1 1 54 54 VAL CB C 54 31.246 31.246 32.453 -1.207 18493 2191 1 5 . 1 1 54 54 VAL H H 54 7.948 7.948 8.036 -0.088 18493 2192 1 5 . 1 1 55 55 LEU N N 55 119.894 119.894 121.250 -1.356 18493 2193 1 5 . 1 1 55 55 LEU C C 55 178.175 178.175 178.422 -0.247 18493 2194 1 5 . 1 1 55 55 LEU CA C 55 58.490 58.490 58.396 0.094 18493 2195 1 5 . 1 1 55 55 LEU CB C 55 42.145 42.145 40.875 1.270 18493 2196 1 5 . 1 1 55 55 LEU H H 55 8.646 8.646 9.222 -0.576 18493 2197 1 5 . 1 1 56 56 GLY N N 56 106.262 106.262 106.770 -0.508 18493 2198 1 5 . 1 1 56 56 GLY C C 56 174.618 174.618 175.684 -1.066 18493 2199 1 5 . 1 1 56 56 GLY CA C 56 47.533 47.533 47.600 -0.067 18493 2200 1 5 . 1 1 57 57 ALA N N 57 123.002 123.002 124.672 -1.670 18493 2201 1 5 . 1 1 57 57 ALA C C 57 178.688 178.688 179.731 -1.043 18493 2202 1 5 . 1 1 57 57 ALA CA C 57 55.548 55.548 54.997 0.551 18493 2203 1 5 . 1 1 57 57 ALA CB C 57 18.065 18.065 18.543 -0.478 18493 2204 1 5 . 1 1 58 58 ALA N N 58 118.866 118.866 121.918 -3.052 18493 2205 1 5 . 1 1 58 58 ALA C C 58 179.348 179.348 179.810 -0.462 18493 2206 1 5 . 1 1 58 58 ALA CA C 58 54.763 54.763 55.170 -0.408 18493 2207 1 5 . 1 1 58 58 ALA CB C 58 17.898 17.898 18.537 -0.639 18493 2208 1 5 . 1 1 58 58 ALA H H 58 8.674 8.674 8.618 0.056 18493 2209 1 5 . 1 1 59 59 LEU N N 59 115.384 115.384 120.082 -4.698 18493 2210 1 5 . 1 1 59 59 LEU C C 59 177.654 177.654 178.772 -1.118 18493 2211 1 5 . 1 1 59 59 LEU CA C 59 57.387 57.387 57.972 -0.585 18493 2212 1 5 . 1 1 59 59 LEU CB C 59 41.209 41.209 41.270 -0.061 18493 2213 1 5 . 1 1 60 60 ILE N N 60 116.140 116.140 118.735 -2.595 18493 2214 1 5 . 1 1 60 60 ILE C C 60 180.024 180.024 178.120 1.904 18493 2215 1 5 . 1 1 60 60 ILE CA C 60 64.263 64.263 65.438 -1.175 18493 2216 1 5 . 1 1 60 60 ILE CB C 60 37.240 37.240 37.553 -0.313 18493 2217 1 5 . 1 1 61 61 GLY N N 61 110.127 110.127 106.877 3.250 18493 2218 1 5 . 1 1 61 61 GLY C C 61 173.716 173.716 174.518 -0.802 18493 2219 1 5 . 1 1 61 61 GLY CA C 61 45.617 45.617 46.354 -0.737 18493 2220 1 5 . 1 1 61 61 GLY H H 61 9.046 9.046 8.043 1.003 18493 2221 1 5 . 1 1 62 62 ALA N N 62 118.949 118.949 124.746 -5.797 18493 2222 1 5 . 1 1 62 62 ALA C C 62 176.192 176.192 178.734 -2.542 18493 2223 1 5 . 1 1 62 62 ALA CA C 62 53.268 53.268 54.244 -0.976 18493 2224 1 5 . 1 1 62 62 ALA CB C 62 19.138 19.138 18.502 0.636 18493 2225 1 5 . 1 1 62 62 ALA H H 62 8.066 8.066 7.677 0.389 18493 2226 1 5 . 1 1 63 63 ILE N N 63 116.800 116.800 117.748 -0.948 18493 2227 1 5 . 1 1 63 63 ILE CA C 63 66.739 66.739 62.409 4.330 18493 2228 1 5 . 1 1 63 63 ILE CB C 63 37.947 37.947 38.026 -0.079 18493 2229 1 5 . 1 1 64 64 ALA N N 64 123.957 123.957 121.982 1.975 18493 2230 1 5 . 1 1 64 64 ALA CA C 64 52.934 52.934 49.270 3.664 18493 2231 1 5 . 1 1 64 64 ALA CB C 64 19.428 19.428 18.767 0.660 18493 2232 1 5 . 1 1 65 65 PRO CA C 65 65.350 65.350 62.642 2.708 18493 2233 1 5 . 1 1 66 66 LYS N N 66 116.618 116.618 114.718 1.900 18493 2234 1 5 . 1 1 66 66 LYS C C 66 177.500 177.500 176.025 1.475 18493 2235 1 5 . 1 1 66 66 LYS CA C 66 56.547 56.547 59.049 -2.502 18493 2236 1 5 . 1 1 66 66 LYS CB C 66 30.522 30.522 31.306 -0.784 18493 2237 1 5 . 1 1 67 67 THR CA C 67 60.452 60.452 61.548 -1.096 18493 2238 1 5 . 1 1 67 67 THR CB C 67 69.948 69.948 69.172 0.776 18493 2239 1 5 . 1 1 68 68 PRO C C 68 177.070 177.070 177.367 -0.297 18493 2240 1 5 . 1 1 68 68 PRO CA C 68 63.315 63.315 62.115 1.200 18493 2241 1 5 . 1 1 68 68 PRO CB C 68 32.458 32.458 32.035 0.423 18493 2242 1 5 . 1 1 69 69 LEU N N 69 121.517 121.517 115.725 5.792 18493 2243 1 5 . 1 1 69 69 LEU C C 69 179.448 179.448 176.830 2.618 18493 2244 1 5 . 1 1 69 69 LEU CA C 69 57.389 57.389 56.565 0.824 18493 2245 1 5 . 1 1 69 69 LEU CB C 69 42.737 42.737 39.930 2.807 18493 2246 1 5 . 1 1 69 69 LEU H H 69 8.882 8.882 8.043 0.839 18493 2247 1 5 . 1 1 70 70 ARG N N 70 114.028 114.028 117.609 -3.581 18493 2248 1 5 . 1 1 70 70 ARG C C 70 177.925 177.925 177.392 0.533 18493 2249 1 5 . 1 1 70 70 ARG CA C 70 58.429 58.429 57.114 1.315 18493 2250 1 5 . 1 1 70 70 ARG CB C 70 29.391 29.391 28.852 0.539 18493 2251 1 5 . 1 1 70 70 ARG H H 70 8.202 8.202 8.026 0.176 18493 2252 1 5 . 1 1 71 71 TYR N N 71 121.740 121.740 118.101 3.639 18493 2253 1 5 . 1 1 71 71 TYR CA C 71 57.374 57.374 55.639 1.735 18493 2254 1 5 . 1 1 71 71 TYR H H 71 8.136 8.136 7.203 0.933 18493 2255 1 5 . 1 1 72 72 VAL N N 72 118.416 118.416 122.927 -4.511 18493 2256 1 5 . 1 1 72 72 VAL C C 72 177.702 177.702 176.858 0.844 18493 2257 1 5 . 1 1 72 72 VAL CA C 72 66.098 66.098 64.587 1.511 18493 2258 1 5 . 1 1 72 72 VAL CB C 72 31.343 31.343 31.738 -0.395 18493 2259 1 5 . 1 1 73 73 ALA N N 73 120.283 120.283 121.854 -1.571 18493 2260 1 5 . 1 1 73 73 ALA C C 73 179.763 179.763 179.783 -0.020 18493 2261 1 5 . 1 1 73 73 ALA CA C 73 55.785 55.785 55.176 0.609 18493 2262 1 5 . 1 1 73 73 ALA CB C 73 19.265 19.265 18.234 1.031 18493 2263 1 5 . 1 1 73 73 ALA H H 73 9.015 9.015 7.829 1.186 18493 2264 1 5 . 1 1 74 74 MET N N 74 115.547 115.547 116.774 -1.227 18493 2265 1 5 . 1 1 74 74 MET C C 74 177.223 177.223 178.617 -1.394 18493 2266 1 5 . 1 1 74 74 MET CA C 74 61.023 61.023 58.382 2.641 18493 2267 1 5 . 1 1 74 74 MET CB C 74 33.777 33.777 31.877 1.900 18493 2268 1 5 . 1 1 74 74 MET H H 74 8.163 8.163 7.741 0.422 18493 2269 1 5 . 1 1 75 75 VAL N N 75 118.690 118.690 118.417 0.273 18493 2270 1 5 . 1 1 75 75 VAL C C 75 177.166 177.166 177.557 -0.391 18493 2271 1 5 . 1 1 75 75 VAL CA C 75 67.581 67.581 66.421 1.160 18493 2272 1 5 . 1 1 75 75 VAL CB C 75 31.408 31.408 30.878 0.530 18493 2273 1 5 . 1 1 75 75 VAL H H 75 7.554 7.554 8.396 -0.842 18493 2274 1 5 . 1 1 76 76 ILE N N 76 118.959 118.959 120.640 -1.681 18493 2275 1 5 . 1 1 76 76 ILE C C 76 178.680 178.680 177.293 1.387 18493 2276 1 5 . 1 1 76 76 ILE CA C 76 65.839 65.839 64.809 1.030 18493 2277 1 5 . 1 1 76 76 ILE CB C 76 38.414 38.414 38.120 0.294 18493 2278 1 5 . 1 1 77 77 TRP N N 77 125.440 125.440 121.564 3.876 18493 2279 1 5 . 1 1 77 77 TRP C C 77 177.153 177.153 177.987 -0.834 18493 2280 1 5 . 1 1 77 77 TRP CA C 77 58.779 58.779 59.791 -1.012 18493 2281 1 5 . 1 1 77 77 TRP CB C 77 30.494 30.494 29.169 1.325 18493 2282 1 5 . 1 1 77 77 TRP H H 77 9.515 9.515 7.925 1.590 18493 2283 1 5 . 1 1 78 78 LEU N N 78 118.968 118.968 122.517 -3.549 18493 2284 1 5 . 1 1 78 78 LEU C C 78 178.381 178.381 178.555 -0.174 18493 2285 1 5 . 1 1 78 78 LEU CA C 78 58.041 58.041 58.641 -0.599 18493 2286 1 5 . 1 1 78 78 LEU CB C 78 43.807 43.807 41.026 2.781 18493 2287 1 5 . 1 1 78 78 LEU H H 78 9.367 9.367 8.420 0.947 18493 2288 1 5 . 1 1 79 79 TYR N N 79 118.181 118.181 120.298 -2.117 18493 2289 1 5 . 1 1 79 79 TYR C C 79 176.777 176.777 177.662 -0.885 18493 2290 1 5 . 1 1 79 79 TYR CA C 79 62.849 62.849 61.394 1.455 18493 2291 1 5 . 1 1 80 80 SER N N 80 114.286 114.286 115.194 -0.908 18493 2292 1 5 . 1 1 80 80 SER C C 80 175.943 175.943 176.651 -0.708 18493 2293 1 5 . 1 1 80 80 SER CA C 80 63.515 63.515 61.422 2.093 18493 2294 1 5 . 1 1 80 80 SER CB C 80 63.941 63.941 62.557 1.384 18493 2295 1 5 . 1 1 81 81 ALA N N 81 121.070 121.070 124.681 -3.611 18493 2296 1 5 . 1 1 81 81 ALA C C 81 178.208 178.208 179.208 -1.000 18493 2297 1 5 . 1 1 81 81 ALA CA C 81 55.224 55.224 54.728 0.496 18493 2298 1 5 . 1 1 81 81 ALA CB C 81 17.897 17.897 18.368 -0.471 18493 2299 1 5 . 1 1 82 82 PHE N N 82 117.560 117.560 120.591 -3.031 18493 2300 1 5 . 1 1 82 82 PHE C C 82 176.975 176.975 177.128 -0.153 18493 2301 1 5 . 1 1 82 82 PHE CA C 82 62.132 62.132 59.830 2.302 18493 2302 1 5 . 1 1 82 82 PHE CB C 82 38.497 38.497 39.047 -0.550 18493 2303 1 5 . 1 1 83 83 ARG N N 83 117.110 117.110 119.203 -2.093 18493 2304 1 5 . 1 1 83 83 ARG C C 83 178.637 178.637 178.335 0.302 18493 2305 1 5 . 1 1 83 83 ARG CA C 83 60.291 60.291 58.470 1.821 18493 2306 1 5 . 1 1 83 83 ARG CB C 83 28.625 28.625 29.206 -0.581 18493 2307 1 5 . 1 1 84 84 GLY N N 84 105.915 105.915 106.560 -0.645 18493 2308 1 5 . 1 1 84 84 GLY C C 84 177.091 177.091 175.583 1.508 18493 2309 1 5 . 1 1 84 84 GLY CA C 84 46.128 46.128 46.457 -0.329 18493 2310 1 5 . 1 1 85 85 VAL N N 85 124.985 124.985 121.935 3.050 18493 2311 1 5 . 1 1 85 85 VAL C C 85 176.387 176.387 177.750 -1.363 18493 2312 1 5 . 1 1 85 85 VAL CA C 85 66.960 66.960 65.767 1.193 18493 2313 1 5 . 1 1 85 85 VAL CB C 85 31.066 31.066 31.796 -0.730 18493 2314 1 5 . 1 1 86 86 GLN N N 86 116.522 116.522 119.032 -2.510 18493 2315 1 5 . 1 1 86 86 GLN C C 86 179.586 179.586 178.598 0.988 18493 2316 1 5 . 1 1 86 86 GLN CA C 86 59.505 59.505 59.132 0.374 18493 2317 1 5 . 1 1 86 86 GLN CB C 86 28.762 28.762 28.294 0.468 18493 2318 1 5 . 1 1 87 87 LEU N N 87 121.211 121.211 119.677 1.534 18493 2319 1 5 . 1 1 87 87 LEU C C 87 178.396 178.396 179.566 -1.170 18493 2320 1 5 . 1 1 87 87 LEU CA C 87 57.847 57.847 57.520 0.327 18493 2321 1 5 . 1 1 87 87 LEU CB C 87 41.924 41.924 41.246 0.678 18493 2322 1 5 . 1 1 87 87 LEU H H 87 8.955 8.955 7.578 1.377 18493 2323 1 5 . 1 1 88 88 THR N N 88 108.251 108.251 114.588 -6.337 18493 2324 1 5 . 1 1 88 88 THR C C 88 180.013 180.013 176.308 3.705 18493 2325 1 5 . 1 1 88 88 THR CA C 88 65.112 65.112 66.749 -1.637 18493 2326 1 5 . 1 1 88 88 THR CB C 88 68.805 68.805 68.935 -0.130 18493 2327 1 5 . 1 1 88 88 THR H H 88 8.764 8.764 8.239 0.525 18493 2328 1 5 . 1 1 89 89 TYR N N 89 127.947 127.947 122.038 5.909 18493 2329 1 5 . 1 1 89 89 TYR C C 89 177.244 177.244 177.303 -0.059 18493 2330 1 5 . 1 1 89 89 TYR H H 89 9.868 9.868 7.960 1.908 18493 2331 1 5 . 1 1 90 90 GLU N N 90 121.163 121.163 117.754 3.409 18493 2332 1 5 . 1 1 90 90 GLU C C 90 178.671 178.671 178.724 -0.053 18493 2333 1 5 . 1 1 90 90 GLU H H 90 8.515 8.515 8.006 0.509 18493 2334 1 5 . 1 1 91 91 HIS N N 91 120.459 120.459 119.734 0.725 18493 2335 1 5 . 1 1 91 91 HIS C C 91 177.605 177.605 176.887 0.718 18493 2336 1 5 . 1 1 91 91 HIS CA C 91 57.085 57.085 58.535 -1.450 18493 2337 1 5 . 1 1 91 91 HIS CB C 91 34.128 34.128 29.822 4.306 18493 2338 1 5 . 1 1 91 91 HIS H H 91 9.102 9.102 8.116 0.986 18493 2339 1 5 . 1 1 92 92 THR N N 92 115.463 115.463 114.580 0.883 18493 2340 1 5 . 1 1 92 92 THR C C 92 176.189 176.189 175.655 0.534 18493 2341 1 5 . 1 1 92 92 THR CA C 92 67.058 67.058 65.402 1.656 18493 2342 1 5 . 1 1 92 92 THR CB C 92 68.564 68.564 69.395 -0.831 18493 2343 1 5 . 1 1 92 92 THR H H 92 9.550 9.550 8.211 1.339 18493 2344 1 5 . 1 1 93 93 MET N N 93 117.153 117.153 122.324 -5.171 18493 2345 1 5 . 1 1 93 93 MET C C 93 176.972 176.972 177.316 -0.344 18493 2346 1 5 . 1 1 93 93 MET CA C 93 62.369 62.369 58.172 4.197 18493 2347 1 5 . 1 1 93 93 MET CB C 93 33.515 33.515 32.085 1.430 18493 2348 1 5 . 1 1 94 94 LEU N N 94 117.981 117.981 116.563 1.418 18493 2349 1 5 . 1 1 94 94 LEU CA C 94 57.489 57.489 56.961 0.528 18493 2350 1 5 . 1 1 94 94 LEU CB C 94 41.432 41.432 39.763 1.669 18493 2351 1 5 . 1 1 94 94 LEU H H 94 8.497 8.497 8.102 0.395 18493 2352 1 5 . 1 1 95 95 GLN C C 95 178.331 178.331 177.504 0.827 18493 2353 1 5 . 1 1 95 95 GLN CA C 95 57.604 57.604 57.492 0.112 18493 2354 1 5 . 1 1 95 95 GLN CB C 95 28.200 28.200 28.672 -0.472 18493 2355 1 5 . 1 1 96 96 LEU N N 96 118.174 118.174 120.317 -2.143 18493 2356 1 5 . 1 1 96 96 LEU C C 96 177.842 177.842 175.764 2.078 18493 2357 1 5 . 1 1 96 96 LEU CA C 96 57.747 57.747 56.018 1.729 18493 2358 1 5 . 1 1 96 96 LEU CB C 96 41.721 41.721 43.017 -1.296 18493 2359 1 5 . 1 1 97 97 TYR N N 97 117.359 117.359 116.308 1.051 18493 2360 1 5 . 1 1 97 97 TYR CA C 97 57.581 57.581 55.548 2.033 18493 2361 1 5 . 1 1 97 97 TYR H H 97 8.485 8.485 7.728 0.757 18493 2362 1 5 . 1 1 98 98 PRO CA C 98 63.847 63.847 62.247 1.600 18493 2363 1 5 . 1 1 99 99 SER CA C 99 58.145 58.145 57.244 0.901 18493 2364 1 5 . 1 1 99 99 SER CB C 99 64.506 64.506 63.486 1.020 18493 2365 1 5 . 1 1 101 101 PHE C C 101 174.992 174.992 172.951 2.041 18493 2366 1 5 . 1 1 102 102 ALA N N 102 120.614 120.614 123.566 -2.952 18493 2367 1 5 . 1 1 102 102 ALA C C 102 176.810 176.810 175.854 0.956 18493 2368 1 5 . 1 1 102 102 ALA CA C 102 54.355 54.355 52.145 2.210 18493 2369 1 5 . 1 1 102 102 ALA H H 102 7.383 7.383 7.893 -0.510 18493 2370 1 5 . 1 1 103 103 THR N N 103 112.507 112.507 118.543 -6.036 18493 2371 1 5 . 1 1 103 103 THR C C 103 175.666 175.666 173.389 2.277 18493 2372 1 5 . 1 1 103 103 THR CA C 103 59.838 59.838 62.441 -2.603 18493 2373 1 5 . 1 1 103 103 THR CB C 103 67.623 67.623 68.920 -1.297 18493 2374 1 5 . 1 1 103 103 THR H H 103 9.278 9.278 7.888 1.390 18493 2375 1 5 . 1 1 104 104 CYS N N 104 122.754 122.754 123.223 -0.469 18493 2376 1 5 . 1 1 104 104 CYS C C 104 174.474 174.474 173.358 1.116 18493 2377 1 5 . 1 1 104 104 CYS CA C 104 64.988 64.988 58.244 6.744 18493 2378 1 5 . 1 1 104 104 CYS CB C 104 42.988 42.988 31.893 11.095 18493 2379 1 5 . 1 1 104 104 CYS H H 104 9.934 9.934 8.582 1.352 18493 2380 1 5 . 1 1 105 105 ASP N N 105 121.350 121.350 123.044 -1.694 18493 2381 1 5 . 1 1 105 105 ASP CB C 105 41.030 41.030 39.774 1.256 18493 2382 1 5 . 1 1 105 105 ASP H H 105 8.153 8.153 8.862 -0.709 18493 2383 1 5 . 1 1 115 115 PRO CA C 115 61.148 61.148 62.666 -1.518 18493 2384 1 5 . 1 1 115 115 PRO CB C 115 30.280 30.280 32.555 -2.275 18493 2385 1 5 . 1 1 116 116 LEU C C 116 178.163 178.163 175.226 2.937 18493 2386 1 5 . 1 1 116 116 LEU CA C 116 58.746 58.746 55.020 3.726 18493 2387 1 5 . 1 1 116 116 LEU CB C 116 42.932 42.932 42.868 0.064 18493 2388 1 5 . 1 1 117 117 ASP N N 117 116.302 116.302 123.474 -7.172 18493 2389 1 5 . 1 1 117 117 ASP C C 117 177.528 177.528 176.828 0.700 18493 2390 1 5 . 1 1 117 117 ASP CB C 117 41.252 41.252 41.484 -0.232 18493 2391 1 5 . 1 1 118 118 LYS N N 118 118.983 118.983 120.329 -1.346 18493 2392 1 5 . 1 1 118 118 LYS H H 118 7.538 7.538 8.021 -0.483 18493 2393 1 5 . 1 1 119 119 TRP C C 119 177.867 177.867 175.656 2.211 18493 2394 1 5 . 1 1 120 120 VAL N N 120 113.149 113.149 117.332 -4.183 18493 2395 1 5 . 1 1 120 120 VAL CA C 120 58.651 58.651 59.392 -0.742 18493 2396 1 5 . 1 1 120 120 VAL CB C 120 31.821 31.821 34.045 -2.224 18493 2397 1 5 . 1 1 120 120 VAL H H 120 8.936 8.936 7.815 1.121 18493 2398 1 5 . 1 1 121 121 PRO C C 121 178.888 178.888 178.051 0.837 18493 2399 1 5 . 1 1 121 121 PRO CA C 121 65.185 65.185 64.451 0.734 18493 2400 1 5 . 1 1 121 121 PRO CB C 121 31.781 31.781 31.867 -0.086 18493 2401 1 5 . 1 1 122 122 GLN N N 122 116.304 116.304 119.232 -2.928 18493 2402 1 5 . 1 1 122 122 GLN C C 122 174.326 174.326 176.461 -2.135 18493 2403 1 5 . 1 1 122 122 GLN CA C 122 58.463 58.463 58.417 0.046 18493 2404 1 5 . 1 1 122 122 GLN H H 122 9.809 9.809 8.771 1.038 18493 2405 1 5 . 1 1 123 123 VAL N N 123 113.254 113.254 119.099 -5.845 18493 2406 1 5 . 1 1 123 123 VAL C C 123 175.777 175.777 175.730 0.047 18493 2407 1 5 . 1 1 123 123 VAL CA C 123 61.689 61.689 61.806 -0.117 18493 2408 1 5 . 1 1 123 123 VAL CB C 123 35.373 35.373 30.818 4.555 18493 2409 1 5 . 1 1 123 123 VAL H H 123 8.219 8.219 7.907 0.312 18493 2410 1 5 . 1 1 124 124 PHE N N 124 112.242 112.242 122.615 -10.373 18493 2411 1 5 . 1 1 124 124 PHE C C 124 172.759 172.759 175.822 -3.063 18493 2412 1 5 . 1 1 124 124 PHE CB C 124 39.318 39.318 39.901 -0.583 18493 2413 1 5 . 1 1 125 125 VAL N N 125 115.233 115.233 121.868 -6.635 18493 2414 1 5 . 1 1 125 125 VAL C C 125 177.034 177.034 173.378 3.656 18493 2415 1 5 . 1 1 125 125 VAL CA C 125 61.950 61.950 60.903 1.047 18493 2416 1 5 . 1 1 125 125 VAL CB C 125 33.376 33.376 32.527 0.849 18493 2417 1 5 . 1 1 125 125 VAL H H 125 7.799 7.799 7.621 0.178 18493 2418 1 5 . 1 1 126 126 ALA N N 126 130.709 130.709 125.527 5.182 18493 2419 1 5 . 1 1 126 126 ALA C C 126 175.920 175.920 174.865 1.055 18493 2420 1 5 . 1 1 126 126 ALA CA C 126 54.493 54.493 51.529 2.963 18493 2421 1 5 . 1 1 126 126 ALA CB C 126 17.215 17.215 21.035 -3.820 18493 2422 1 5 . 1 1 126 126 ALA H H 126 9.014 9.014 7.875 1.139 18493 2423 1 5 . 1 1 127 127 SER N N 127 112.716 112.716 112.919 -0.203 18493 2424 1 5 . 1 1 127 127 SER CA C 127 58.101 58.101 57.489 0.612 18493 2425 1 5 . 1 1 127 127 SER CB C 127 64.539 64.539 64.775 -0.236 18493 2426 1 5 . 1 1 127 127 SER H H 127 8.145 8.145 8.299 -0.154 18493 2427 1 5 . 1 1 128 128 GLY N N 128 106.487 106.487 108.238 -1.751 18493 2428 1 5 . 1 1 128 128 GLY C C 128 177.047 177.047 172.946 4.101 18493 2429 1 5 . 1 1 128 128 GLY CA C 128 46.296 46.296 44.475 1.821 18493 2430 1 5 . 1 1 128 128 GLY H H 128 8.595 8.595 8.326 0.269 18493 2431 1 5 . 1 1 129 129 ASP C C 129 177.916 177.916 175.887 2.029 18493 2432 1 5 . 1 1 129 129 ASP CB C 129 43.975 43.975 41.558 2.417 18493 2433 1 5 . 1 1 130 130 CYS N N 130 122.984 122.984 118.262 4.722 18493 2434 1 5 . 1 1 130 130 CYS C C 130 173.312 173.312 175.207 -1.895 18493 2435 1 5 . 1 1 130 130 CYS CA C 130 64.581 64.581 57.756 6.825 18493 2436 1 5 . 1 1 130 130 CYS CB C 130 42.879 42.879 28.166 14.713 18493 2437 1 5 . 1 1 130 130 CYS H H 130 9.948 9.948 7.997 1.951 18493 2438 1 5 . 1 1 131 131 ALA N N 131 121.534 121.534 123.370 -1.836 18493 2439 1 5 . 1 1 131 131 ALA CA C 131 52.640 52.640 52.744 -0.104 18493 2440 1 5 . 1 1 131 131 ALA CB C 131 18.497 18.497 19.386 -0.889 18493 2441 1 5 . 1 1 131 131 ALA H H 131 9.869 9.869 8.247 1.622 18493 2442 1 5 . 1 1 136 136 ASP C C 136 172.916 172.916 175.005 -2.089 18493 2443 1 5 . 1 1 137 137 PHE N N 137 117.677 117.677 117.426 0.251 18493 2444 1 5 . 1 1 137 137 PHE CA C 137 57.310 57.310 57.234 0.076 18493 2445 1 5 . 1 1 137 137 PHE CB C 137 42.927 42.927 39.134 3.793 18493 2446 1 5 . 1 1 137 137 PHE H H 137 8.959 8.959 8.529 0.430 18493 2447 1 5 . 1 1 138 138 LEU CB C 138 43.547 43.547 42.096 1.452 18493 2448 1 5 . 1 1 139 139 GLY C C 139 176.262 176.262 173.779 2.483 18493 2449 1 5 . 1 1 139 139 GLY CA C 139 46.123 46.123 46.297 -0.174 18493 2450 1 5 . 1 1 140 140 LEU N N 140 124.207 124.207 119.282 4.925 18493 2451 1 5 . 1 1 140 140 LEU CB C 140 40.503 40.503 44.675 -4.172 18493 2452 1 5 . 1 1 142 142 MET CA C 142 56.442 56.442 60.535 -4.093 18493 2453 1 5 . 1 1 143 143 PRO CA C 143 63.254 63.254 65.985 -2.731 18493 2454 1 5 . 1 1 144 144 GLN C C 144 177.307 177.307 178.624 -1.317 18493 2455 1 5 . 1 1 145 145 TRP N N 145 120.795 120.795 120.717 0.078 18493 2456 1 5 . 1 1 145 145 TRP C C 145 178.709 178.709 179.023 -0.314 18493 2457 1 5 . 1 1 145 145 TRP CA C 145 59.535 59.535 59.197 0.338 18493 2458 1 5 . 1 1 145 145 TRP CB C 145 29.345 29.345 29.627 -0.282 18493 2459 1 5 . 1 1 145 145 TRP H H 145 8.386 8.386 7.762 0.624 18493 2460 1 5 . 1 1 146 146 LEU N N 146 118.336 118.336 120.652 -2.316 18493 2461 1 5 . 1 1 146 146 LEU C C 146 177.115 177.115 179.185 -2.070 18493 2462 1 5 . 1 1 146 146 LEU CA C 146 57.793 57.793 57.926 -0.133 18493 2463 1 5 . 1 1 146 146 LEU CB C 146 41.616 41.616 41.223 0.393 18493 2464 1 5 . 1 1 146 146 LEU H H 146 9.033 9.033 9.085 -0.052 18493 2465 1 5 . 1 1 147 147 LEU N N 147 123.772 123.772 120.603 3.169 18493 2466 1 5 . 1 1 147 147 LEU C C 147 178.787 178.787 178.888 -0.101 18493 2467 1 5 . 1 1 147 147 LEU CA C 147 58.052 58.052 58.509 -0.457 18493 2468 1 5 . 1 1 147 147 LEU CB C 147 41.047 41.047 41.148 -0.101 18493 2469 1 5 . 1 1 147 147 LEU H H 147 8.480 8.480 8.515 -0.035 18493 2470 1 5 . 1 1 148 148 GLY N N 148 104.457 104.457 107.980 -3.523 18493 2471 1 5 . 1 1 148 148 GLY C C 148 174.667 174.667 176.374 -1.707 18493 2472 1 5 . 1 1 148 148 GLY CA C 148 48.102 48.102 47.447 0.655 18493 2473 1 5 . 1 1 149 149 ILE N N 149 121.815 121.815 121.935 -0.120 18493 2474 1 5 . 1 1 149 149 ILE C C 149 177.725 177.725 177.138 0.587 18493 2475 1 5 . 1 1 149 149 ILE CA C 149 65.997 65.997 62.172 3.825 18493 2476 1 5 . 1 1 149 149 ILE CB C 149 38.262 38.262 37.986 0.276 18493 2477 1 5 . 1 1 150 150 PHE N N 150 118.894 118.894 120.011 -1.117 18493 2478 1 5 . 1 1 150 150 PHE C C 150 178.929 178.929 177.668 1.261 18493 2479 1 5 . 1 1 150 150 PHE CA C 150 63.591 63.591 61.283 2.308 18493 2480 1 5 . 1 1 150 150 PHE CB C 150 38.417 38.417 38.868 -0.451 18493 2481 1 5 . 1 1 151 151 ILE N N 151 120.535 120.535 118.380 2.155 18493 2482 1 5 . 1 1 151 151 ILE C C 151 177.347 177.347 177.072 0.275 18493 2483 1 5 . 1 1 151 151 ILE CA C 151 66.478 66.478 65.184 1.294 18493 2484 1 5 . 1 1 151 151 ILE CB C 151 37.302 37.302 37.374 -0.072 18493 2485 1 5 . 1 1 152 152 ALA N N 152 122.855 122.855 123.573 -0.718 18493 2486 1 5 . 1 1 152 152 ALA C C 152 179.165 179.165 179.954 -0.789 18493 2487 1 5 . 1 1 152 152 ALA CA C 152 56.272 56.272 55.473 0.799 18493 2488 1 5 . 1 1 152 152 ALA CB C 152 17.993 17.993 17.843 0.150 18493 2489 1 5 . 1 1 153 153 TYR N N 153 116.156 116.156 118.037 -1.881 18493 2490 1 5 . 1 1 153 153 TYR C C 153 179.682 179.682 178.246 1.436 18493 2491 1 5 . 1 1 153 153 TYR CA C 153 64.391 64.391 58.819 5.572 18493 2492 1 5 . 1 1 153 153 TYR CB C 153 39.553 39.553 38.029 1.524 18493 2493 1 5 . 1 1 153 153 TYR H H 153 8.680 8.680 7.573 1.107 18493 2494 1 5 . 1 1 154 154 LEU N N 154 122.327 122.327 122.179 0.148 18493 2495 1 5 . 1 1 154 154 LEU C C 154 177.336 177.336 179.179 -1.843 18493 2496 1 5 . 1 1 154 154 LEU CA C 154 57.905 57.905 58.078 -0.173 18493 2497 1 5 . 1 1 154 154 LEU CB C 154 42.009 42.009 41.469 0.540 18493 2498 1 5 . 1 1 155 155 ILE N N 155 119.079 119.079 119.661 -0.582 18493 2499 1 5 . 1 1 155 155 ILE C C 155 177.589 177.589 178.306 -0.717 18493 2500 1 5 . 1 1 155 155 ILE CA C 155 65.996 65.996 65.381 0.615 18493 2501 1 5 . 1 1 155 155 ILE CB C 155 38.179 38.179 38.004 0.175 18493 2502 1 5 . 1 1 156 156 VAL N N 156 117.551 117.551 120.571 -3.020 18493 2503 1 5 . 1 1 156 156 VAL C C 156 176.163 176.163 177.394 -1.231 18493 2504 1 5 . 1 1 156 156 VAL CA C 156 67.664 67.664 67.272 0.392 18493 2505 1 5 . 1 1 156 156 VAL CB C 156 31.694 31.694 31.655 0.039 18493 2506 1 5 . 1 1 157 157 ALA N N 157 122.470 122.470 122.940 -0.470 18493 2507 1 5 . 1 1 157 157 ALA C C 157 179.076 179.076 179.470 -0.394 18493 2508 1 5 . 1 1 157 157 ALA CA C 157 54.803 54.803 55.543 -0.740 18493 2509 1 5 . 1 1 157 157 ALA CB C 157 16.120 16.120 18.605 -2.485 18493 2510 1 5 . 1 1 158 158 VAL N N 158 116.045 116.045 115.658 0.387 18493 2511 1 5 . 1 1 158 158 VAL C C 158 177.491 177.491 177.892 -0.401 18493 2512 1 5 . 1 1 158 158 VAL CA C 158 67.160 67.160 66.173 0.987 18493 2513 1 5 . 1 1 158 158 VAL CB C 158 31.331 31.331 31.563 -0.232 18493 2514 1 5 . 1 1 159 159 LEU N N 159 116.776 116.776 118.573 -1.797 18493 2515 1 5 . 1 1 159 159 LEU C C 159 178.312 178.312 178.855 -0.543 18493 2516 1 5 . 1 1 159 159 LEU CA C 159 57.443 57.443 57.431 0.012 18493 2517 1 5 . 1 1 159 159 LEU CB C 159 41.567 41.567 41.864 -0.297 18493 2518 1 5 . 1 1 160 160 VAL N N 160 118.890 118.890 116.275 2.615 18493 2519 1 5 . 1 1 160 160 VAL C C 160 177.508 177.508 177.831 -0.323 18493 2520 1 5 . 1 1 160 160 VAL CA C 160 67.366 67.366 65.329 2.037 18493 2521 1 5 . 1 1 160 160 VAL CB C 160 31.106 31.106 32.270 -1.163 18493 2522 1 5 . 1 1 161 161 VAL N N 161 118.360 118.360 114.050 4.310 18493 2523 1 5 . 1 1 161 161 VAL C C 161 176.607 176.607 176.031 0.576 18493 2524 1 5 . 1 1 161 161 VAL CA C 161 67.614 67.614 64.154 3.460 18493 2525 1 5 . 1 1 161 161 VAL CB C 161 31.646 31.646 32.534 -0.888 18493 2526 1 6 . 1 1 11 11 GLY N N 11 108.456 108.456 107.570 0.886 18493 2527 1 6 . 1 1 11 11 GLY H H 11 8.433 8.433 7.567 0.866 18493 2528 1 6 . 1 1 12 12 ARG C C 12 178.053 178.053 178.361 -0.308 18493 2529 1 6 . 1 1 12 12 ARG CA C 12 57.504 57.504 59.650 -2.146 18493 2530 1 6 . 1 1 12 12 ARG CB C 12 30.522 30.522 30.515 0.007 18493 2531 1 6 . 1 1 13 13 GLY N N 13 108.265 108.265 108.341 -0.076 18493 2532 1 6 . 1 1 13 13 GLY C C 13 175.091 175.091 176.288 -1.197 18493 2533 1 6 . 1 1 13 13 GLY CA C 13 45.326 45.326 47.065 -1.739 18493 2534 1 6 . 1 1 14 14 ALA N N 14 123.181 123.181 124.376 -1.195 18493 2535 1 6 . 1 1 14 14 ALA C C 14 179.173 179.173 179.662 -0.489 18493 2536 1 6 . 1 1 14 14 ALA CA C 14 55.061 55.061 54.414 0.647 18493 2537 1 6 . 1 1 14 14 ALA H H 14 9.285 9.285 8.370 0.915 18493 2538 1 6 . 1 1 15 15 TRP N N 15 116.733 116.733 117.602 -0.869 18493 2539 1 6 . 1 1 15 15 TRP C C 15 179.425 179.425 178.559 0.866 18493 2540 1 6 . 1 1 15 15 TRP CA C 15 58.960 58.960 58.819 0.141 18493 2541 1 6 . 1 1 15 15 TRP CB C 15 29.529 29.529 29.467 0.062 18493 2542 1 6 . 1 1 15 15 TRP H H 15 7.091 7.091 6.885 0.206 18493 2543 1 6 . 1 1 16 16 LEU N N 16 118.671 118.671 121.216 -2.545 18493 2544 1 6 . 1 1 16 16 LEU C C 16 178.461 178.461 179.302 -0.841 18493 2545 1 6 . 1 1 16 16 LEU CA C 16 58.246 58.246 58.391 -0.145 18493 2546 1 6 . 1 1 16 16 LEU CB C 16 41.369 41.369 41.105 0.264 18493 2547 1 6 . 1 1 16 16 LEU H H 16 9.180 9.180 9.138 0.042 18493 2548 1 6 . 1 1 17 17 LEU N N 17 118.515 118.515 120.128 -1.613 18493 2549 1 6 . 1 1 17 17 LEU C C 17 178.787 178.787 179.030 -0.243 18493 2550 1 6 . 1 1 17 17 LEU CA C 17 57.832 57.832 58.661 -0.829 18493 2551 1 6 . 1 1 17 17 LEU CB C 17 41.395 41.395 41.043 0.352 18493 2552 1 6 . 1 1 18 18 MET N N 18 120.633 120.633 119.769 0.864 18493 2553 1 6 . 1 1 18 18 MET C C 18 180.469 180.469 178.643 1.826 18493 2554 1 6 . 1 1 18 18 MET CA C 18 60.277 60.277 57.758 2.519 18493 2555 1 6 . 1 1 18 18 MET CB C 18 31.789 31.789 31.469 0.320 18493 2556 1 6 . 1 1 19 19 ALA N N 19 123.958 123.958 122.233 1.725 18493 2557 1 6 . 1 1 19 19 ALA C C 19 178.210 178.210 179.141 -0.931 18493 2558 1 6 . 1 1 19 19 ALA CA C 19 55.468 55.468 55.134 0.334 18493 2559 1 6 . 1 1 19 19 ALA CB C 19 17.865 17.865 18.235 -0.370 18493 2560 1 6 . 1 1 19 19 ALA H H 19 9.398 9.398 9.163 0.235 18493 2561 1 6 . 1 1 20 20 PHE N N 20 118.424 118.424 119.798 -1.374 18493 2562 1 6 . 1 1 20 20 PHE C C 20 176.674 176.674 177.448 -0.774 18493 2563 1 6 . 1 1 20 20 PHE CA C 20 62.546 62.546 61.642 0.904 18493 2564 1 6 . 1 1 20 20 PHE CB C 20 38.697 38.697 39.223 -0.526 18493 2565 1 6 . 1 1 21 21 THR N N 21 109.220 109.220 114.681 -5.461 18493 2566 1 6 . 1 1 21 21 THR C C 21 174.203 174.203 176.803 -2.600 18493 2567 1 6 . 1 1 21 21 THR CA C 21 66.052 66.052 66.810 -0.758 18493 2568 1 6 . 1 1 21 21 THR CB C 21 68.956 68.956 68.246 0.710 18493 2569 1 6 . 1 1 22 22 ALA N N 22 123.662 123.662 126.156 -2.494 18493 2570 1 6 . 1 1 22 22 ALA C C 22 179.488 179.488 179.818 -0.330 18493 2571 1 6 . 1 1 22 22 ALA CA C 22 54.847 54.847 55.056 -0.209 18493 2572 1 6 . 1 1 22 22 ALA CB C 22 17.801 17.801 18.439 -0.638 18493 2573 1 6 . 1 1 23 23 LEU N N 23 118.917 118.917 120.365 -1.448 18493 2574 1 6 . 1 1 23 23 LEU C C 23 178.028 178.028 179.162 -1.134 18493 2575 1 6 . 1 1 23 23 LEU CA C 23 57.713 57.713 57.283 0.430 18493 2576 1 6 . 1 1 23 23 LEU CB C 23 41.506 41.506 40.493 1.013 18493 2577 1 6 . 1 1 23 23 LEU H H 23 8.581 8.581 8.492 0.089 18493 2578 1 6 . 1 1 24 24 ALA N N 24 119.931 119.931 122.724 -2.793 18493 2579 1 6 . 1 1 24 24 ALA C C 24 180.617 180.617 179.847 0.770 18493 2580 1 6 . 1 1 24 24 ALA CA C 24 55.350 55.350 54.962 0.388 18493 2581 1 6 . 1 1 24 24 ALA CB C 24 17.583 17.583 18.744 -1.161 18493 2582 1 6 . 1 1 25 25 LEU N N 25 119.691 119.691 118.872 0.819 18493 2583 1 6 . 1 1 25 25 LEU CA C 25 58.078 58.078 58.156 -0.078 18493 2584 1 6 . 1 1 25 25 LEU CB C 25 43.597 43.597 41.412 2.185 18493 2585 1 6 . 1 1 25 25 LEU H H 25 9.179 9.179 8.780 0.399 18493 2586 1 6 . 1 1 26 26 GLU N N 26 119.651 119.651 117.864 1.787 18493 2587 1 6 . 1 1 26 26 GLU C C 26 179.334 179.334 179.085 0.249 18493 2588 1 6 . 1 1 26 26 GLU CA C 26 59.584 59.584 58.938 0.646 18493 2589 1 6 . 1 1 26 26 GLU CB C 26 27.202 27.202 29.592 -2.390 18493 2590 1 6 . 1 1 27 27 LEU N N 27 119.661 119.661 121.589 -1.928 18493 2591 1 6 . 1 1 27 27 LEU CA C 27 57.887 57.887 57.170 0.717 18493 2592 1 6 . 1 1 27 27 LEU CB C 27 41.591 41.591 41.285 0.306 18493 2593 1 6 . 1 1 27 27 LEU H H 27 9.410 9.410 7.598 1.812 18493 2594 1 6 . 1 1 28 28 THR N N 28 118.484 118.484 114.077 4.407 18493 2595 1 6 . 1 1 28 28 THR C C 28 175.898 175.898 176.561 -0.663 18493 2596 1 6 . 1 1 28 28 THR CA C 28 67.459 67.459 66.233 1.226 18493 2597 1 6 . 1 1 28 28 THR CB C 28 67.948 67.948 68.597 -0.649 18493 2598 1 6 . 1 1 29 29 ALA N N 29 122.643 122.643 124.567 -1.924 18493 2599 1 6 . 1 1 29 29 ALA C C 29 179.717 179.717 178.551 1.166 18493 2600 1 6 . 1 1 29 29 ALA CA C 29 55.919 55.919 54.785 1.134 18493 2601 1 6 . 1 1 29 29 ALA CB C 29 16.837 16.837 18.053 -1.216 18493 2602 1 6 . 1 1 29 29 ALA H H 29 8.302 8.302 7.277 1.025 18493 2603 1 6 . 1 1 30 30 LEU N N 30 117.408 117.408 117.718 -0.310 18493 2604 1 6 . 1 1 30 30 LEU C C 30 178.143 178.143 176.747 1.396 18493 2605 1 6 . 1 1 30 30 LEU CA C 30 57.384 57.384 56.057 1.327 18493 2606 1 6 . 1 1 30 30 LEU CB C 30 41.679 41.679 41.649 0.030 18493 2607 1 6 . 1 1 30 30 LEU H H 30 8.412 8.412 7.841 0.571 18493 2608 1 6 . 1 1 31 31 TRP N N 31 125.692 125.692 119.300 6.392 18493 2609 1 6 . 1 1 31 31 TRP C C 31 179.053 179.053 177.382 1.671 18493 2610 1 6 . 1 1 31 31 TRP CA C 31 59.005 59.005 57.621 1.384 18493 2611 1 6 . 1 1 31 31 TRP CB C 31 28.142 28.142 29.802 -1.660 18493 2612 1 6 . 1 1 31 31 TRP H H 31 9.157 9.157 7.073 2.084 18493 2613 1 6 . 1 1 32 32 PHE N N 32 119.195 119.195 119.290 -0.095 18493 2614 1 6 . 1 1 32 32 PHE CA C 32 61.557 61.557 58.980 2.577 18493 2615 1 6 . 1 1 32 32 PHE CB C 32 38.384 38.384 36.287 2.097 18493 2616 1 6 . 1 1 32 32 PHE H H 32 9.374 9.374 8.200 1.174 18493 2617 1 6 . 1 1 33 33 GLN C C 33 177.477 177.477 177.652 -0.175 18493 2618 1 6 . 1 1 33 33 GLN CA C 33 56.613 56.613 58.601 -1.988 18493 2619 1 6 . 1 1 33 33 GLN CB C 33 29.433 29.433 26.547 2.886 18493 2620 1 6 . 1 1 34 34 HIS N N 34 115.948 115.948 118.063 -2.115 18493 2621 1 6 . 1 1 34 34 HIS C C 34 175.548 175.548 177.734 -2.186 18493 2622 1 6 . 1 1 34 34 HIS CA C 34 58.733 58.733 57.883 0.850 18493 2623 1 6 . 1 1 34 34 HIS CB C 34 32.084 32.084 29.685 2.399 18493 2624 1 6 . 1 1 34 34 HIS H H 34 9.621 9.621 7.536 2.085 18493 2625 1 6 . 1 1 35 35 VAL N N 35 116.902 116.902 119.578 -2.676 18493 2626 1 6 . 1 1 35 35 VAL C C 35 177.853 177.853 177.127 0.726 18493 2627 1 6 . 1 1 35 35 VAL CA C 35 64.075 64.075 65.240 -1.165 18493 2628 1 6 . 1 1 35 35 VAL CB C 35 30.626 30.626 31.925 -1.299 18493 2629 1 6 . 1 1 36 36 MET N N 36 114.145 114.145 116.526 -2.381 18493 2630 1 6 . 1 1 36 36 MET C C 36 175.905 175.905 176.570 -0.665 18493 2631 1 6 . 1 1 36 36 MET H H 36 7.605 7.605 7.808 -0.203 18493 2632 1 6 . 1 1 37 37 LEU N N 37 111.740 111.740 114.788 -3.048 18493 2633 1 6 . 1 1 37 37 LEU H H 37 7.121 7.121 7.783 -0.662 18493 2634 1 6 . 1 1 38 38 LEU C C 38 176.457 176.457 177.877 -1.420 18493 2635 1 6 . 1 1 39 39 LYS N N 39 121.418 121.418 121.690 -0.272 18493 2636 1 6 . 1 1 39 39 LYS CA C 39 57.471 57.471 57.848 -0.377 18493 2637 1 6 . 1 1 39 39 LYS H H 39 9.359 9.359 8.243 1.116 18493 2638 1 6 . 1 1 40 40 PRO CA C 40 60.451 60.451 64.064 -3.614 18493 2639 1 6 . 1 1 42 42 VAL N N 42 118.166 118.166 120.083 -1.917 18493 2640 1 6 . 1 1 42 42 VAL C C 42 179.261 179.261 177.212 2.049 18493 2641 1 6 . 1 1 42 42 VAL CA C 42 67.223 67.223 63.585 3.638 18493 2642 1 6 . 1 1 42 42 VAL CB C 42 30.941 30.941 31.636 -0.695 18493 2643 1 6 . 1 1 43 43 LEU N N 43 115.946 115.946 120.362 -4.416 18493 2644 1 6 . 1 1 43 43 LEU C C 43 178.293 178.293 178.685 -0.392 18493 2645 1 6 . 1 1 43 43 LEU CA C 43 57.129 57.129 57.767 -0.638 18493 2646 1 6 . 1 1 43 43 LEU CB C 43 41.030 41.030 41.585 -0.555 18493 2647 1 6 . 1 1 44 44 CYS N N 44 115.006 115.006 115.248 -0.242 18493 2648 1 6 . 1 1 44 44 CYS C C 44 177.484 177.484 177.108 0.376 18493 2649 1 6 . 1 1 44 44 CYS CA C 44 59.760 59.760 62.080 -2.320 18493 2650 1 6 . 1 1 44 44 CYS CB C 44 30.651 30.651 26.505 4.146 18493 2651 1 6 . 1 1 44 44 CYS H H 44 7.683 7.683 8.231 -0.548 18493 2652 1 6 . 1 1 45 45 ILE N N 45 119.384 119.384 121.540 -2.156 18493 2653 1 6 . 1 1 45 45 ILE C C 45 179.575 179.575 177.096 2.479 18493 2654 1 6 . 1 1 45 45 ILE CA C 45 62.068 62.068 64.936 -2.868 18493 2655 1 6 . 1 1 45 45 ILE CB C 45 33.583 33.583 37.352 -3.769 18493 2656 1 6 . 1 1 46 46 TYR N N 46 120.126 120.126 120.434 -0.308 18493 2657 1 6 . 1 1 46 46 TYR C C 46 178.397 178.397 177.369 1.028 18493 2658 1 6 . 1 1 46 46 TYR CA C 46 59.129 59.129 60.616 -1.487 18493 2659 1 6 . 1 1 46 46 TYR CB C 46 35.347 35.347 38.244 -2.897 18493 2660 1 6 . 1 1 46 46 TYR H H 46 8.958 8.958 7.857 1.101 18493 2661 1 6 . 1 1 47 47 GLU N N 47 121.779 121.779 117.450 4.329 18493 2662 1 6 . 1 1 47 47 GLU C C 47 179.907 179.907 179.154 0.753 18493 2663 1 6 . 1 1 47 47 GLU CA C 47 57.985 57.985 58.257 -0.272 18493 2664 1 6 . 1 1 47 47 GLU CB C 47 27.290 27.290 29.820 -2.530 18493 2665 1 6 . 1 1 47 47 GLU H H 47 9.681 9.681 7.843 1.838 18493 2666 1 6 . 1 1 48 48 ARG N N 48 119.188 119.188 121.101 -1.913 18493 2667 1 6 . 1 1 48 48 ARG C C 48 181.638 181.638 179.011 2.627 18493 2668 1 6 . 1 1 48 48 ARG CA C 48 60.299 60.299 59.310 0.989 18493 2669 1 6 . 1 1 48 48 ARG CB C 48 30.167 30.167 30.289 -0.122 18493 2670 1 6 . 1 1 48 48 ARG H H 48 9.213 9.213 8.640 0.573 18493 2671 1 6 . 1 1 49 49 VAL N N 49 121.326 121.326 117.982 3.344 18493 2672 1 6 . 1 1 49 49 VAL C C 49 177.326 177.326 177.219 0.107 18493 2673 1 6 . 1 1 49 49 VAL CA C 49 66.624 66.624 65.923 0.701 18493 2674 1 6 . 1 1 49 49 VAL CB C 49 31.280 31.280 31.519 -0.239 18493 2675 1 6 . 1 1 50 50 ALA N N 50 122.955 122.955 122.822 0.133 18493 2676 1 6 . 1 1 50 50 ALA C C 50 179.594 179.594 179.381 0.213 18493 2677 1 6 . 1 1 50 50 ALA CA C 50 55.902 55.902 54.908 0.994 18493 2678 1 6 . 1 1 50 50 ALA CB C 50 16.623 16.623 18.269 -1.646 18493 2679 1 6 . 1 1 51 51 LEU N N 51 115.737 115.737 118.523 -2.786 18493 2680 1 6 . 1 1 51 51 LEU C C 51 177.990 177.990 178.205 -0.215 18493 2681 1 6 . 1 1 51 51 LEU CA C 51 57.285 57.285 57.980 -0.695 18493 2682 1 6 . 1 1 51 51 LEU CB C 51 41.369 41.369 41.340 0.028 18493 2683 1 6 . 1 1 52 52 PHE N N 52 122.707 122.707 120.510 2.197 18493 2684 1 6 . 1 1 52 52 PHE C C 52 179.142 179.142 178.068 1.074 18493 2685 1 6 . 1 1 52 52 PHE CA C 52 62.518 62.518 60.774 1.744 18493 2686 1 6 . 1 1 52 52 PHE CB C 52 38.538 38.538 39.024 -0.486 18493 2687 1 6 . 1 1 52 52 PHE H H 52 8.863 8.863 7.993 0.870 18493 2688 1 6 . 1 1 53 53 GLY N N 53 110.801 110.801 108.546 2.255 18493 2689 1 6 . 1 1 53 53 GLY C C 53 175.378 175.378 175.973 -0.595 18493 2690 1 6 . 1 1 53 53 GLY CA C 53 48.024 48.024 47.365 0.659 18493 2691 1 6 . 1 1 53 53 GLY H H 53 9.027 9.027 7.781 1.246 18493 2692 1 6 . 1 1 54 54 VAL N N 54 121.926 121.926 122.374 -0.448 18493 2693 1 6 . 1 1 54 54 VAL C C 54 177.035 177.035 177.416 -0.381 18493 2694 1 6 . 1 1 54 54 VAL CA C 54 67.448 67.448 64.829 2.619 18493 2695 1 6 . 1 1 54 54 VAL CB C 54 31.246 31.246 32.338 -1.092 18493 2696 1 6 . 1 1 54 54 VAL H H 54 7.948 7.948 8.274 -0.326 18493 2697 1 6 . 1 1 55 55 LEU N N 55 119.894 119.894 121.063 -1.169 18493 2698 1 6 . 1 1 55 55 LEU C C 55 178.175 178.175 178.451 -0.276 18493 2699 1 6 . 1 1 55 55 LEU CA C 55 58.490 58.490 58.046 0.444 18493 2700 1 6 . 1 1 55 55 LEU CB C 55 42.145 42.145 40.847 1.298 18493 2701 1 6 . 1 1 55 55 LEU H H 55 8.646 8.646 9.120 -0.474 18493 2702 1 6 . 1 1 56 56 GLY N N 56 106.262 106.262 106.354 -0.092 18493 2703 1 6 . 1 1 56 56 GLY C C 56 174.618 174.618 175.337 -0.719 18493 2704 1 6 . 1 1 56 56 GLY CA C 56 47.533 47.533 46.853 0.680 18493 2705 1 6 . 1 1 57 57 ALA N N 57 123.002 123.002 124.607 -1.605 18493 2706 1 6 . 1 1 57 57 ALA C C 57 178.688 178.688 179.610 -0.922 18493 2707 1 6 . 1 1 57 57 ALA CA C 57 55.548 55.548 55.037 0.511 18493 2708 1 6 . 1 1 57 57 ALA CB C 57 18.065 18.065 18.327 -0.262 18493 2709 1 6 . 1 1 58 58 ALA N N 58 118.866 118.866 120.515 -1.649 18493 2710 1 6 . 1 1 58 58 ALA C C 58 179.348 179.348 179.117 0.231 18493 2711 1 6 . 1 1 58 58 ALA CA C 58 54.763 54.763 54.643 0.120 18493 2712 1 6 . 1 1 58 58 ALA CB C 58 17.898 17.898 18.949 -1.051 18493 2713 1 6 . 1 1 58 58 ALA H H 58 8.674 8.674 7.616 1.058 18493 2714 1 6 . 1 1 59 59 LEU N N 59 115.384 115.384 120.610 -5.226 18493 2715 1 6 . 1 1 59 59 LEU C C 59 177.654 177.654 178.949 -1.295 18493 2716 1 6 . 1 1 59 59 LEU CA C 59 57.387 57.387 57.748 -0.361 18493 2717 1 6 . 1 1 59 59 LEU CB C 59 41.209 41.209 41.350 -0.141 18493 2718 1 6 . 1 1 60 60 ILE N N 60 116.140 116.140 117.049 -0.909 18493 2719 1 6 . 1 1 60 60 ILE C C 60 180.024 180.024 178.353 1.671 18493 2720 1 6 . 1 1 60 60 ILE CA C 60 64.263 64.263 64.575 -0.312 18493 2721 1 6 . 1 1 60 60 ILE CB C 60 37.240 37.240 37.021 0.219 18493 2722 1 6 . 1 1 61 61 GLY N N 61 110.127 110.127 106.710 3.417 18493 2723 1 6 . 1 1 61 61 GLY C C 61 173.716 173.716 175.691 -1.975 18493 2724 1 6 . 1 1 61 61 GLY CA C 61 45.617 45.617 46.010 -0.393 18493 2725 1 6 . 1 1 61 61 GLY H H 61 9.046 9.046 7.532 1.514 18493 2726 1 6 . 1 1 62 62 ALA N N 62 118.949 118.949 124.763 -5.814 18493 2727 1 6 . 1 1 62 62 ALA C C 62 176.192 176.192 178.628 -2.436 18493 2728 1 6 . 1 1 62 62 ALA CA C 62 53.268 53.268 55.028 -1.760 18493 2729 1 6 . 1 1 62 62 ALA CB C 62 19.138 19.138 18.198 0.940 18493 2730 1 6 . 1 1 62 62 ALA H H 62 8.066 8.066 7.841 0.225 18493 2731 1 6 . 1 1 63 63 ILE N N 63 116.800 116.800 117.824 -1.024 18493 2732 1 6 . 1 1 63 63 ILE CA C 63 66.739 66.739 62.361 4.378 18493 2733 1 6 . 1 1 63 63 ILE CB C 63 37.947 37.947 37.603 0.344 18493 2734 1 6 . 1 1 64 64 ALA N N 64 123.957 123.957 122.465 1.492 18493 2735 1 6 . 1 1 64 64 ALA CA C 64 52.934 52.934 49.079 3.855 18493 2736 1 6 . 1 1 64 64 ALA CB C 64 19.428 19.428 19.407 0.021 18493 2737 1 6 . 1 1 65 65 PRO CA C 65 65.350 65.350 63.248 2.102 18493 2738 1 6 . 1 1 66 66 LYS N N 66 116.618 116.618 124.592 -7.974 18493 2739 1 6 . 1 1 66 66 LYS C C 66 177.500 177.500 177.945 -0.445 18493 2740 1 6 . 1 1 66 66 LYS CA C 66 56.547 56.547 59.775 -3.228 18493 2741 1 6 . 1 1 66 66 LYS CB C 66 30.522 30.522 31.485 -0.963 18493 2742 1 6 . 1 1 67 67 THR CA C 67 60.452 60.452 64.473 -4.021 18493 2743 1 6 . 1 1 67 67 THR CB C 67 69.948 69.948 67.410 2.538 18493 2744 1 6 . 1 1 68 68 PRO C C 68 177.070 177.070 177.251 -0.181 18493 2745 1 6 . 1 1 68 68 PRO CA C 68 63.315 63.315 62.694 0.621 18493 2746 1 6 . 1 1 68 68 PRO CB C 68 32.458 32.458 31.580 0.878 18493 2747 1 6 . 1 1 69 69 LEU N N 69 121.517 121.517 116.791 4.726 18493 2748 1 6 . 1 1 69 69 LEU C C 69 179.448 179.448 177.597 1.851 18493 2749 1 6 . 1 1 69 69 LEU CA C 69 57.389 57.389 56.709 0.680 18493 2750 1 6 . 1 1 69 69 LEU CB C 69 42.737 42.737 40.442 2.295 18493 2751 1 6 . 1 1 69 69 LEU H H 69 8.882 8.882 8.142 0.740 18493 2752 1 6 . 1 1 70 70 ARG N N 70 114.028 114.028 120.366 -6.338 18493 2753 1 6 . 1 1 70 70 ARG C C 70 177.925 177.925 178.098 -0.173 18493 2754 1 6 . 1 1 70 70 ARG CA C 70 58.429 58.429 58.358 0.071 18493 2755 1 6 . 1 1 70 70 ARG CB C 70 29.391 29.391 29.196 0.195 18493 2756 1 6 . 1 1 70 70 ARG H H 70 8.202 8.202 8.137 0.065 18493 2757 1 6 . 1 1 71 71 TYR N N 71 121.740 121.740 116.670 5.070 18493 2758 1 6 . 1 1 71 71 TYR CA C 71 57.374 57.374 56.333 1.041 18493 2759 1 6 . 1 1 71 71 TYR H H 71 8.136 8.136 7.106 1.030 18493 2760 1 6 . 1 1 72 72 VAL N N 72 118.416 118.416 120.160 -1.744 18493 2761 1 6 . 1 1 72 72 VAL C C 72 177.702 177.702 177.320 0.382 18493 2762 1 6 . 1 1 72 72 VAL CA C 72 66.098 66.098 63.685 2.413 18493 2763 1 6 . 1 1 72 72 VAL CB C 72 31.343 31.343 30.088 1.255 18493 2764 1 6 . 1 1 73 73 ALA N N 73 120.283 120.283 121.894 -1.611 18493 2765 1 6 . 1 1 73 73 ALA C C 73 179.763 179.763 179.163 0.600 18493 2766 1 6 . 1 1 73 73 ALA CA C 73 55.785 55.785 54.796 0.989 18493 2767 1 6 . 1 1 73 73 ALA CB C 73 19.265 19.265 17.860 1.405 18493 2768 1 6 . 1 1 73 73 ALA H H 73 9.015 9.015 7.517 1.498 18493 2769 1 6 . 1 1 74 74 MET N N 74 115.547 115.547 117.446 -1.899 18493 2770 1 6 . 1 1 74 74 MET C C 74 177.223 177.223 178.468 -1.245 18493 2771 1 6 . 1 1 74 74 MET CA C 74 61.023 61.023 56.822 4.201 18493 2772 1 6 . 1 1 74 74 MET CB C 74 33.777 33.777 31.121 2.656 18493 2773 1 6 . 1 1 74 74 MET H H 74 8.163 8.163 7.472 0.691 18493 2774 1 6 . 1 1 75 75 VAL N N 75 118.690 118.690 116.646 2.044 18493 2775 1 6 . 1 1 75 75 VAL C C 75 177.166 177.166 177.897 -0.731 18493 2776 1 6 . 1 1 75 75 VAL CA C 75 67.581 67.581 66.269 1.312 18493 2777 1 6 . 1 1 75 75 VAL CB C 75 31.408 31.408 30.936 0.472 18493 2778 1 6 . 1 1 75 75 VAL H H 75 7.554 7.554 7.728 -0.174 18493 2779 1 6 . 1 1 76 76 ILE N N 76 118.959 118.959 120.859 -1.900 18493 2780 1 6 . 1 1 76 76 ILE C C 76 178.680 178.680 177.429 1.251 18493 2781 1 6 . 1 1 76 76 ILE CA C 76 65.839 65.839 64.379 1.460 18493 2782 1 6 . 1 1 76 76 ILE CB C 76 38.414 38.414 38.149 0.265 18493 2783 1 6 . 1 1 77 77 TRP N N 77 125.440 125.440 121.890 3.550 18493 2784 1 6 . 1 1 77 77 TRP C C 77 177.153 177.153 177.480 -0.327 18493 2785 1 6 . 1 1 77 77 TRP CA C 77 58.779 58.779 58.503 0.276 18493 2786 1 6 . 1 1 77 77 TRP CB C 77 30.494 30.494 28.549 1.945 18493 2787 1 6 . 1 1 77 77 TRP H H 77 9.515 9.515 8.263 1.252 18493 2788 1 6 . 1 1 78 78 LEU N N 78 118.968 118.968 124.071 -5.103 18493 2789 1 6 . 1 1 78 78 LEU C C 78 178.381 178.381 178.211 0.170 18493 2790 1 6 . 1 1 78 78 LEU CA C 78 58.041 58.041 57.831 0.210 18493 2791 1 6 . 1 1 78 78 LEU CB C 78 43.807 43.807 41.996 1.811 18493 2792 1 6 . 1 1 78 78 LEU H H 78 9.367 9.367 8.487 0.880 18493 2793 1 6 . 1 1 79 79 TYR N N 79 118.181 118.181 120.380 -2.199 18493 2794 1 6 . 1 1 79 79 TYR C C 79 176.777 176.777 177.375 -0.598 18493 2795 1 6 . 1 1 79 79 TYR CA C 79 62.849 62.849 62.174 0.675 18493 2796 1 6 . 1 1 80 80 SER N N 80 114.286 114.286 114.920 -0.634 18493 2797 1 6 . 1 1 80 80 SER C C 80 175.943 175.943 176.655 -0.712 18493 2798 1 6 . 1 1 80 80 SER CA C 80 63.515 63.515 61.466 2.049 18493 2799 1 6 . 1 1 80 80 SER CB C 80 63.941 63.941 62.359 1.582 18493 2800 1 6 . 1 1 81 81 ALA N N 81 121.070 121.070 124.419 -3.349 18493 2801 1 6 . 1 1 81 81 ALA C C 81 178.208 178.208 179.138 -0.930 18493 2802 1 6 . 1 1 81 81 ALA CA C 81 55.224 55.224 54.548 0.676 18493 2803 1 6 . 1 1 81 81 ALA CB C 81 17.897 17.897 18.189 -0.292 18493 2804 1 6 . 1 1 82 82 PHE N N 82 117.560 117.560 120.760 -3.200 18493 2805 1 6 . 1 1 82 82 PHE C C 82 176.975 176.975 176.895 0.080 18493 2806 1 6 . 1 1 82 82 PHE CA C 82 62.132 62.132 60.301 1.831 18493 2807 1 6 . 1 1 82 82 PHE CB C 82 38.497 38.497 39.027 -0.530 18493 2808 1 6 . 1 1 83 83 ARG N N 83 117.110 117.110 119.249 -2.139 18493 2809 1 6 . 1 1 83 83 ARG C C 83 178.637 178.637 178.449 0.188 18493 2810 1 6 . 1 1 83 83 ARG CA C 83 60.291 60.291 58.722 1.569 18493 2811 1 6 . 1 1 83 83 ARG CB C 83 28.625 28.625 29.353 -0.728 18493 2812 1 6 . 1 1 84 84 GLY N N 84 105.915 105.915 106.865 -0.950 18493 2813 1 6 . 1 1 84 84 GLY C C 84 177.091 177.091 175.028 2.063 18493 2814 1 6 . 1 1 84 84 GLY CA C 84 46.128 46.128 46.117 0.011 18493 2815 1 6 . 1 1 85 85 VAL N N 85 124.985 124.985 121.931 3.054 18493 2816 1 6 . 1 1 85 85 VAL C C 85 176.387 176.387 177.784 -1.397 18493 2817 1 6 . 1 1 85 85 VAL CA C 85 66.960 66.960 65.273 1.687 18493 2818 1 6 . 1 1 85 85 VAL CB C 85 31.066 31.066 31.651 -0.585 18493 2819 1 6 . 1 1 86 86 GLN N N 86 116.522 116.522 119.199 -2.677 18493 2820 1 6 . 1 1 86 86 GLN C C 86 179.586 179.586 178.506 1.080 18493 2821 1 6 . 1 1 86 86 GLN CA C 86 59.505 59.505 59.206 0.299 18493 2822 1 6 . 1 1 86 86 GLN CB C 86 28.762 28.762 28.308 0.454 18493 2823 1 6 . 1 1 87 87 LEU N N 87 121.211 121.211 119.374 1.837 18493 2824 1 6 . 1 1 87 87 LEU C C 87 178.396 178.396 179.506 -1.110 18493 2825 1 6 . 1 1 87 87 LEU CA C 87 57.847 57.847 57.348 0.499 18493 2826 1 6 . 1 1 87 87 LEU CB C 87 41.924 41.924 41.851 0.073 18493 2827 1 6 . 1 1 87 87 LEU H H 87 8.955 8.955 7.543 1.412 18493 2828 1 6 . 1 1 88 88 THR N N 88 108.251 108.251 114.236 -5.985 18493 2829 1 6 . 1 1 88 88 THR C C 88 180.013 180.013 176.658 3.355 18493 2830 1 6 . 1 1 88 88 THR CA C 88 65.112 65.112 66.522 -1.410 18493 2831 1 6 . 1 1 88 88 THR CB C 88 68.805 68.805 69.037 -0.232 18493 2832 1 6 . 1 1 88 88 THR H H 88 8.764 8.764 7.912 0.852 18493 2833 1 6 . 1 1 89 89 TYR N N 89 127.947 127.947 122.391 5.556 18493 2834 1 6 . 1 1 89 89 TYR C C 89 177.244 177.244 176.901 0.343 18493 2835 1 6 . 1 1 89 89 TYR H H 89 9.868 9.868 8.093 1.775 18493 2836 1 6 . 1 1 90 90 GLU N N 90 121.163 121.163 118.042 3.121 18493 2837 1 6 . 1 1 90 90 GLU C C 90 178.671 178.671 178.714 -0.043 18493 2838 1 6 . 1 1 90 90 GLU H H 90 8.515 8.515 8.133 0.382 18493 2839 1 6 . 1 1 91 91 HIS N N 91 120.459 120.459 118.727 1.732 18493 2840 1 6 . 1 1 91 91 HIS C C 91 177.605 177.605 177.465 0.140 18493 2841 1 6 . 1 1 91 91 HIS CA C 91 57.085 57.085 59.512 -2.427 18493 2842 1 6 . 1 1 91 91 HIS CB C 91 34.128 34.128 29.831 4.297 18493 2843 1 6 . 1 1 91 91 HIS H H 91 9.102 9.102 8.098 1.004 18493 2844 1 6 . 1 1 92 92 THR N N 92 115.463 115.463 115.787 -0.324 18493 2845 1 6 . 1 1 92 92 THR C C 92 176.189 176.189 176.296 -0.107 18493 2846 1 6 . 1 1 92 92 THR CA C 92 67.058 67.058 66.195 0.863 18493 2847 1 6 . 1 1 92 92 THR CB C 92 68.564 68.564 68.795 -0.231 18493 2848 1 6 . 1 1 92 92 THR H H 92 9.550 9.550 7.968 1.582 18493 2849 1 6 . 1 1 93 93 MET N N 93 117.153 117.153 121.708 -4.555 18493 2850 1 6 . 1 1 93 93 MET C C 93 176.972 176.972 178.254 -1.282 18493 2851 1 6 . 1 1 93 93 MET CA C 93 62.369 62.369 58.308 4.061 18493 2852 1 6 . 1 1 93 93 MET CB C 93 33.515 33.515 31.835 1.680 18493 2853 1 6 . 1 1 94 94 LEU N N 94 117.981 117.981 118.549 -0.568 18493 2854 1 6 . 1 1 94 94 LEU CA C 94 57.489 57.489 58.223 -0.734 18493 2855 1 6 . 1 1 94 94 LEU CB C 94 41.432 41.432 40.951 0.481 18493 2856 1 6 . 1 1 94 94 LEU H H 94 8.497 8.497 8.137 0.360 18493 2857 1 6 . 1 1 95 95 GLN C C 95 178.331 178.331 177.104 1.227 18493 2858 1 6 . 1 1 95 95 GLN CA C 95 57.604 57.604 57.561 0.043 18493 2859 1 6 . 1 1 95 95 GLN CB C 95 28.200 28.200 28.965 -0.765 18493 2860 1 6 . 1 1 96 96 LEU N N 96 118.174 118.174 118.974 -0.800 18493 2861 1 6 . 1 1 96 96 LEU C C 96 177.842 177.842 175.354 2.488 18493 2862 1 6 . 1 1 96 96 LEU CA C 96 57.747 57.747 55.145 2.602 18493 2863 1 6 . 1 1 96 96 LEU CB C 96 41.721 41.721 42.959 -1.238 18493 2864 1 6 . 1 1 97 97 TYR N N 97 117.359 117.359 116.165 1.194 18493 2865 1 6 . 1 1 97 97 TYR CA C 97 57.581 57.581 55.504 2.077 18493 2866 1 6 . 1 1 97 97 TYR H H 97 8.485 8.485 7.960 0.525 18493 2867 1 6 . 1 1 98 98 PRO CA C 98 63.847 63.847 62.154 1.693 18493 2868 1 6 . 1 1 99 99 SER CA C 99 58.145 58.145 54.473 3.672 18493 2869 1 6 . 1 1 99 99 SER CB C 99 64.506 64.506 63.132 1.374 18493 2870 1 6 . 1 1 101 101 PHE C C 101 174.992 174.992 175.596 -0.604 18493 2871 1 6 . 1 1 102 102 ALA N N 102 120.614 120.614 122.017 -1.403 18493 2872 1 6 . 1 1 102 102 ALA C C 102 176.810 176.810 177.268 -0.458 18493 2873 1 6 . 1 1 102 102 ALA CA C 102 54.355 54.355 52.503 1.852 18493 2874 1 6 . 1 1 102 102 ALA H H 102 7.383 7.383 7.934 -0.551 18493 2875 1 6 . 1 1 103 103 THR N N 103 112.507 112.507 117.675 -5.168 18493 2876 1 6 . 1 1 103 103 THR C C 103 175.666 175.666 174.730 0.936 18493 2877 1 6 . 1 1 103 103 THR CA C 103 59.838 59.838 62.997 -3.159 18493 2878 1 6 . 1 1 103 103 THR CB C 103 67.623 67.623 68.569 -0.946 18493 2879 1 6 . 1 1 103 103 THR H H 103 9.278 9.278 8.139 1.139 18493 2880 1 6 . 1 1 104 104 CYS N N 104 122.754 122.754 126.897 -4.143 18493 2881 1 6 . 1 1 104 104 CYS C C 104 174.474 174.474 173.811 0.663 18493 2882 1 6 . 1 1 104 104 CYS CA C 104 64.988 64.988 56.572 8.416 18493 2883 1 6 . 1 1 104 104 CYS CB C 104 42.988 42.988 28.469 14.519 18493 2884 1 6 . 1 1 104 104 CYS H H 104 9.934 9.934 8.272 1.662 18493 2885 1 6 . 1 1 105 105 ASP N N 105 121.350 121.350 123.667 -2.317 18493 2886 1 6 . 1 1 105 105 ASP CB C 105 41.030 41.030 42.853 -1.823 18493 2887 1 6 . 1 1 105 105 ASP H H 105 8.153 8.153 8.355 -0.202 18493 2888 1 6 . 1 1 115 115 PRO CA C 115 61.148 61.148 63.417 -2.269 18493 2889 1 6 . 1 1 115 115 PRO CB C 115 30.280 30.280 33.067 -2.787 18493 2890 1 6 . 1 1 116 116 LEU C C 116 178.163 178.163 175.275 2.888 18493 2891 1 6 . 1 1 116 116 LEU CA C 116 58.746 58.746 55.535 3.211 18493 2892 1 6 . 1 1 116 116 LEU CB C 116 42.932 42.932 42.343 0.589 18493 2893 1 6 . 1 1 117 117 ASP N N 117 116.302 116.302 119.717 -3.415 18493 2894 1 6 . 1 1 117 117 ASP C C 117 177.528 177.528 176.506 1.022 18493 2895 1 6 . 1 1 117 117 ASP CB C 117 41.252 41.252 40.916 0.336 18493 2896 1 6 . 1 1 118 118 LYS N N 118 118.983 118.983 119.009 -0.026 18493 2897 1 6 . 1 1 118 118 LYS H H 118 7.538 7.538 8.367 -0.829 18493 2898 1 6 . 1 1 119 119 TRP C C 119 177.867 177.867 175.622 2.245 18493 2899 1 6 . 1 1 120 120 VAL N N 120 113.149 113.149 114.569 -1.420 18493 2900 1 6 . 1 1 120 120 VAL CA C 120 58.651 58.651 59.354 -0.703 18493 2901 1 6 . 1 1 120 120 VAL CB C 120 31.821 31.821 33.985 -2.164 18493 2902 1 6 . 1 1 120 120 VAL H H 120 8.936 8.936 7.751 1.185 18493 2903 1 6 . 1 1 121 121 PRO C C 121 178.888 178.888 176.977 1.911 18493 2904 1 6 . 1 1 121 121 PRO CA C 121 65.185 65.185 63.209 1.976 18493 2905 1 6 . 1 1 121 121 PRO CB C 121 31.781 31.781 32.478 -0.697 18493 2906 1 6 . 1 1 122 122 GLN N N 122 116.304 116.304 117.250 -0.946 18493 2907 1 6 . 1 1 122 122 GLN C C 122 174.326 174.326 177.323 -2.997 18493 2908 1 6 . 1 1 122 122 GLN CA C 122 58.463 58.463 57.350 1.113 18493 2909 1 6 . 1 1 122 122 GLN H H 122 9.809 9.809 8.323 1.486 18493 2910 1 6 . 1 1 123 123 VAL N N 123 113.254 113.254 120.575 -7.321 18493 2911 1 6 . 1 1 123 123 VAL C C 123 175.777 175.777 174.305 1.472 18493 2912 1 6 . 1 1 123 123 VAL CA C 123 61.689 61.689 62.930 -1.241 18493 2913 1 6 . 1 1 123 123 VAL CB C 123 35.373 35.373 31.191 4.182 18493 2914 1 6 . 1 1 123 123 VAL H H 123 8.219 8.219 7.722 0.497 18493 2915 1 6 . 1 1 124 124 PHE N N 124 112.242 112.242 114.753 -2.511 18493 2916 1 6 . 1 1 124 124 PHE C C 124 172.759 172.759 173.061 -0.302 18493 2917 1 6 . 1 1 124 124 PHE CB C 124 39.318 39.318 40.659 -1.341 18493 2918 1 6 . 1 1 125 125 VAL N N 125 115.233 115.233 117.068 -1.835 18493 2919 1 6 . 1 1 125 125 VAL C C 125 177.034 177.034 173.949 3.085 18493 2920 1 6 . 1 1 125 125 VAL CA C 125 61.950 61.950 60.961 0.989 18493 2921 1 6 . 1 1 125 125 VAL CB C 125 33.376 33.376 35.933 -2.557 18493 2922 1 6 . 1 1 125 125 VAL H H 125 7.799 7.799 8.269 -0.470 18493 2923 1 6 . 1 1 126 126 ALA N N 126 130.709 130.709 123.704 7.005 18493 2924 1 6 . 1 1 126 126 ALA C C 126 175.920 175.920 175.504 0.416 18493 2925 1 6 . 1 1 126 126 ALA CA C 126 54.493 54.493 52.424 2.069 18493 2926 1 6 . 1 1 126 126 ALA CB C 126 17.215 17.215 21.020 -3.805 18493 2927 1 6 . 1 1 126 126 ALA H H 126 9.014 9.014 8.255 0.759 18493 2928 1 6 . 1 1 127 127 SER N N 127 112.716 112.716 113.982 -1.266 18493 2929 1 6 . 1 1 127 127 SER CA C 127 58.101 58.101 58.364 -0.263 18493 2930 1 6 . 1 1 127 127 SER CB C 127 64.539 64.539 64.248 0.291 18493 2931 1 6 . 1 1 127 127 SER H H 127 8.145 8.145 8.753 -0.608 18493 2932 1 6 . 1 1 128 128 GLY N N 128 106.487 106.487 110.984 -4.497 18493 2933 1 6 . 1 1 128 128 GLY C C 128 177.047 177.047 172.772 4.275 18493 2934 1 6 . 1 1 128 128 GLY CA C 128 46.296 46.296 45.259 1.037 18493 2935 1 6 . 1 1 128 128 GLY H H 128 8.595 8.595 7.772 0.823 18493 2936 1 6 . 1 1 129 129 ASP C C 129 177.916 177.916 174.968 2.948 18493 2937 1 6 . 1 1 129 129 ASP CB C 129 43.975 43.975 38.747 5.228 18493 2938 1 6 . 1 1 130 130 CYS N N 130 122.984 122.984 117.126 5.858 18493 2939 1 6 . 1 1 130 130 CYS C C 130 173.312 173.312 173.943 -0.631 18493 2940 1 6 . 1 1 130 130 CYS CA C 130 64.581 64.581 57.463 7.118 18493 2941 1 6 . 1 1 130 130 CYS CB C 130 42.879 42.879 30.774 12.105 18493 2942 1 6 . 1 1 130 130 CYS H H 130 9.948 9.948 7.492 2.456 18493 2943 1 6 . 1 1 131 131 ALA N N 131 121.534 121.534 124.034 -2.500 18493 2944 1 6 . 1 1 131 131 ALA CA C 131 52.640 52.640 51.871 0.769 18493 2945 1 6 . 1 1 131 131 ALA CB C 131 18.497 18.497 19.453 -0.956 18493 2946 1 6 . 1 1 131 131 ALA H H 131 9.869 9.869 8.508 1.361 18493 2947 1 6 . 1 1 136 136 ASP C C 136 172.916 172.916 175.743 -2.827 18493 2948 1 6 . 1 1 137 137 PHE N N 137 117.677 117.677 121.476 -3.799 18493 2949 1 6 . 1 1 137 137 PHE CA C 137 57.310 57.310 57.305 0.005 18493 2950 1 6 . 1 1 137 137 PHE CB C 137 42.927 42.927 39.243 3.684 18493 2951 1 6 . 1 1 137 137 PHE H H 137 8.959 8.959 8.327 0.632 18493 2952 1 6 . 1 1 138 138 LEU CB C 138 43.547 43.547 41.945 1.602 18493 2953 1 6 . 1 1 139 139 GLY C C 139 176.262 176.262 173.106 3.156 18493 2954 1 6 . 1 1 139 139 GLY CA C 139 46.123 46.123 42.981 3.142 18493 2955 1 6 . 1 1 140 140 LEU N N 140 124.207 124.207 119.256 4.951 18493 2956 1 6 . 1 1 140 140 LEU CB C 140 40.503 40.503 41.790 -1.287 18493 2957 1 6 . 1 1 142 142 MET CA C 142 56.442 56.442 61.269 -4.827 18493 2958 1 6 . 1 1 143 143 PRO CA C 143 63.254 63.254 66.615 -3.361 18493 2959 1 6 . 1 1 144 144 GLN C C 144 177.307 177.307 177.680 -0.373 18493 2960 1 6 . 1 1 145 145 TRP N N 145 120.795 120.795 119.574 1.221 18493 2961 1 6 . 1 1 145 145 TRP C C 145 178.709 178.709 178.776 -0.067 18493 2962 1 6 . 1 1 145 145 TRP CA C 145 59.535 59.535 57.998 1.537 18493 2963 1 6 . 1 1 145 145 TRP CB C 145 29.345 29.345 29.954 -0.610 18493 2964 1 6 . 1 1 145 145 TRP H H 145 8.386 8.386 8.449 -0.063 18493 2965 1 6 . 1 1 146 146 LEU N N 146 118.336 118.336 123.527 -5.191 18493 2966 1 6 . 1 1 146 146 LEU C C 146 177.115 177.115 178.982 -1.867 18493 2967 1 6 . 1 1 146 146 LEU CA C 146 57.793 57.793 58.338 -0.545 18493 2968 1 6 . 1 1 146 146 LEU CB C 146 41.616 41.616 41.570 0.046 18493 2969 1 6 . 1 1 146 146 LEU H H 146 9.033 9.033 9.031 0.002 18493 2970 1 6 . 1 1 147 147 LEU N N 147 123.772 123.772 117.011 6.761 18493 2971 1 6 . 1 1 147 147 LEU C C 147 178.787 178.787 178.624 0.163 18493 2972 1 6 . 1 1 147 147 LEU CA C 147 58.052 58.052 57.897 0.155 18493 2973 1 6 . 1 1 147 147 LEU CB C 147 41.047 41.047 40.692 0.355 18493 2974 1 6 . 1 1 147 147 LEU H H 147 8.480 8.480 8.081 0.399 18493 2975 1 6 . 1 1 148 148 GLY N N 148 104.457 104.457 108.003 -3.546 18493 2976 1 6 . 1 1 148 148 GLY C C 148 174.667 174.667 175.956 -1.289 18493 2977 1 6 . 1 1 148 148 GLY CA C 148 48.102 48.102 47.077 1.025 18493 2978 1 6 . 1 1 149 149 ILE N N 149 121.815 121.815 122.739 -0.924 18493 2979 1 6 . 1 1 149 149 ILE C C 149 177.725 177.725 177.207 0.518 18493 2980 1 6 . 1 1 149 149 ILE CA C 149 65.997 65.997 63.356 2.641 18493 2981 1 6 . 1 1 149 149 ILE CB C 149 38.262 38.262 37.666 0.596 18493 2982 1 6 . 1 1 150 150 PHE N N 150 118.894 118.894 118.941 -0.047 18493 2983 1 6 . 1 1 150 150 PHE C C 150 178.929 178.929 177.684 1.245 18493 2984 1 6 . 1 1 150 150 PHE CA C 150 63.591 63.591 62.247 1.344 18493 2985 1 6 . 1 1 150 150 PHE CB C 150 38.417 38.417 38.457 -0.040 18493 2986 1 6 . 1 1 151 151 ILE N N 151 120.535 120.535 117.696 2.839 18493 2987 1 6 . 1 1 151 151 ILE C C 151 177.347 177.347 177.460 -0.113 18493 2988 1 6 . 1 1 151 151 ILE CA C 151 66.478 66.478 64.593 1.885 18493 2989 1 6 . 1 1 151 151 ILE CB C 151 37.302 37.302 36.749 0.553 18493 2990 1 6 . 1 1 152 152 ALA N N 152 122.855 122.855 123.715 -0.860 18493 2991 1 6 . 1 1 152 152 ALA C C 152 179.165 179.165 180.023 -0.858 18493 2992 1 6 . 1 1 152 152 ALA CA C 152 56.272 56.272 55.125 1.147 18493 2993 1 6 . 1 1 152 152 ALA CB C 152 17.993 17.993 17.908 0.085 18493 2994 1 6 . 1 1 153 153 TYR N N 153 116.156 116.156 117.735 -1.579 18493 2995 1 6 . 1 1 153 153 TYR C C 153 179.682 179.682 178.018 1.664 18493 2996 1 6 . 1 1 153 153 TYR CA C 153 64.391 64.391 58.123 6.268 18493 2997 1 6 . 1 1 153 153 TYR CB C 153 39.553 39.553 37.895 1.658 18493 2998 1 6 . 1 1 153 153 TYR H H 153 8.680 8.680 7.686 0.994 18493 2999 1 6 . 1 1 154 154 LEU N N 154 122.327 122.327 122.982 -0.655 18493 3000 1 6 . 1 1 154 154 LEU C C 154 177.336 177.336 178.511 -1.175 18493 3001 1 6 . 1 1 154 154 LEU CA C 154 57.905 57.905 58.348 -0.443 18493 3002 1 6 . 1 1 154 154 LEU CB C 154 42.009 42.009 41.731 0.278 18493 3003 1 6 . 1 1 155 155 ILE N N 155 119.079 119.079 116.120 2.959 18493 3004 1 6 . 1 1 155 155 ILE C C 155 177.589 177.589 177.749 -0.160 18493 3005 1 6 . 1 1 155 155 ILE CA C 155 65.996 65.996 65.131 0.865 18493 3006 1 6 . 1 1 155 155 ILE CB C 155 38.179 38.179 37.377 0.802 18493 3007 1 6 . 1 1 156 156 VAL N N 156 117.551 117.551 121.756 -4.205 18493 3008 1 6 . 1 1 156 156 VAL C C 156 176.163 176.163 177.852 -1.689 18493 3009 1 6 . 1 1 156 156 VAL CA C 156 67.664 67.664 66.582 1.081 18493 3010 1 6 . 1 1 156 156 VAL CB C 156 31.694 31.694 31.098 0.596 18493 3011 1 6 . 1 1 157 157 ALA N N 157 122.470 122.470 122.635 -0.165 18493 3012 1 6 . 1 1 157 157 ALA C C 157 179.076 179.076 179.827 -0.751 18493 3013 1 6 . 1 1 157 157 ALA CA C 157 54.803 54.803 55.785 -0.982 18493 3014 1 6 . 1 1 157 157 ALA CB C 157 16.120 16.120 18.518 -2.398 18493 3015 1 6 . 1 1 158 158 VAL N N 158 116.045 116.045 119.737 -3.692 18493 3016 1 6 . 1 1 158 158 VAL C C 158 177.491 177.491 177.662 -0.171 18493 3017 1 6 . 1 1 158 158 VAL CA C 158 67.160 67.160 66.639 0.521 18493 3018 1 6 . 1 1 158 158 VAL CB C 158 31.331 31.331 32.108 -0.777 18493 3019 1 6 . 1 1 159 159 LEU N N 159 116.776 116.776 119.375 -2.599 18493 3020 1 6 . 1 1 159 159 LEU C C 159 178.312 178.312 179.087 -0.775 18493 3021 1 6 . 1 1 159 159 LEU CA C 159 57.443 57.443 58.107 -0.664 18493 3022 1 6 . 1 1 159 159 LEU CB C 159 41.567 41.567 40.959 0.608 18493 3023 1 6 . 1 1 160 160 VAL N N 160 118.890 118.890 118.714 0.176 18493 3024 1 6 . 1 1 160 160 VAL C C 160 177.508 177.508 178.002 -0.494 18493 3025 1 6 . 1 1 160 160 VAL CA C 160 67.366 67.366 65.744 1.622 18493 3026 1 6 . 1 1 160 160 VAL CB C 160 31.106 31.106 32.156 -1.050 18493 3027 1 6 . 1 1 161 161 VAL N N 161 118.360 118.360 116.447 1.913 18493 3028 1 6 . 1 1 161 161 VAL C C 161 176.607 176.607 176.848 -0.241 18493 3029 1 6 . 1 1 161 161 VAL CA C 161 67.614 67.614 64.945 2.669 18493 3030 1 6 . 1 1 161 161 VAL CB C 161 31.646 31.646 32.313 -0.667 18493 3031 1 7 . 1 1 11 11 GLY N N 11 108.456 108.456 107.329 1.127 18493 3032 1 7 . 1 1 11 11 GLY H H 11 8.433 8.433 6.852 1.581 18493 3033 1 7 . 1 1 12 12 ARG C C 12 178.053 178.053 178.244 -0.191 18493 3034 1 7 . 1 1 12 12 ARG CA C 12 57.504 57.504 59.020 -1.516 18493 3035 1 7 . 1 1 12 12 ARG CB C 12 30.522 30.522 30.121 0.401 18493 3036 1 7 . 1 1 13 13 GLY N N 13 108.265 108.265 108.438 -0.173 18493 3037 1 7 . 1 1 13 13 GLY C C 13 175.091 175.091 176.273 -1.182 18493 3038 1 7 . 1 1 13 13 GLY CA C 13 45.326 45.326 46.980 -1.654 18493 3039 1 7 . 1 1 14 14 ALA N N 14 123.181 123.181 124.946 -1.765 18493 3040 1 7 . 1 1 14 14 ALA C C 14 179.173 179.173 179.859 -0.686 18493 3041 1 7 . 1 1 14 14 ALA CA C 14 55.061 55.061 54.625 0.436 18493 3042 1 7 . 1 1 14 14 ALA H H 14 9.285 9.285 8.061 1.224 18493 3043 1 7 . 1 1 15 15 TRP N N 15 116.733 116.733 117.760 -1.027 18493 3044 1 7 . 1 1 15 15 TRP C C 15 179.425 179.425 178.803 0.622 18493 3045 1 7 . 1 1 15 15 TRP CA C 15 58.960 58.960 58.404 0.556 18493 3046 1 7 . 1 1 15 15 TRP CB C 15 29.529 29.529 29.283 0.246 18493 3047 1 7 . 1 1 15 15 TRP H H 15 7.091 7.091 7.134 -0.043 18493 3048 1 7 . 1 1 16 16 LEU N N 16 118.671 118.671 120.969 -2.298 18493 3049 1 7 . 1 1 16 16 LEU C C 16 178.461 178.461 179.306 -0.845 18493 3050 1 7 . 1 1 16 16 LEU CA C 16 58.246 58.246 58.511 -0.265 18493 3051 1 7 . 1 1 16 16 LEU CB C 16 41.369 41.369 41.075 0.294 18493 3052 1 7 . 1 1 16 16 LEU H H 16 9.180 9.180 8.931 0.249 18493 3053 1 7 . 1 1 17 17 LEU N N 17 118.515 118.515 120.579 -2.064 18493 3054 1 7 . 1 1 17 17 LEU C C 17 178.787 178.787 179.068 -0.281 18493 3055 1 7 . 1 1 17 17 LEU CA C 17 57.832 57.832 58.560 -0.728 18493 3056 1 7 . 1 1 17 17 LEU CB C 17 41.395 41.395 41.878 -0.483 18493 3057 1 7 . 1 1 18 18 MET N N 18 120.633 120.633 118.477 2.156 18493 3058 1 7 . 1 1 18 18 MET C C 18 180.469 180.469 179.244 1.225 18493 3059 1 7 . 1 1 18 18 MET CA C 18 60.277 60.277 56.007 4.270 18493 3060 1 7 . 1 1 18 18 MET CB C 18 31.789 31.789 31.122 0.667 18493 3061 1 7 . 1 1 19 19 ALA N N 19 123.958 123.958 122.553 1.405 18493 3062 1 7 . 1 1 19 19 ALA C C 19 178.210 178.210 178.986 -0.776 18493 3063 1 7 . 1 1 19 19 ALA CA C 19 55.468 55.468 55.104 0.364 18493 3064 1 7 . 1 1 19 19 ALA CB C 19 17.865 17.865 18.552 -0.687 18493 3065 1 7 . 1 1 19 19 ALA H H 19 9.398 9.398 9.196 0.202 18493 3066 1 7 . 1 1 20 20 PHE N N 20 118.424 118.424 119.627 -1.203 18493 3067 1 7 . 1 1 20 20 PHE C C 20 176.674 176.674 176.826 -0.152 18493 3068 1 7 . 1 1 20 20 PHE CA C 20 62.546 62.546 61.727 0.819 18493 3069 1 7 . 1 1 20 20 PHE CB C 20 38.697 38.697 39.154 -0.457 18493 3070 1 7 . 1 1 21 21 THR N N 21 109.220 109.220 115.651 -6.431 18493 3071 1 7 . 1 1 21 21 THR C C 21 174.203 174.203 176.897 -2.694 18493 3072 1 7 . 1 1 21 21 THR CA C 21 66.052 66.052 66.441 -0.389 18493 3073 1 7 . 1 1 21 21 THR CB C 21 68.956 68.956 67.951 1.005 18493 3074 1 7 . 1 1 22 22 ALA N N 22 123.662 123.662 124.813 -1.151 18493 3075 1 7 . 1 1 22 22 ALA C C 22 179.488 179.488 179.837 -0.349 18493 3076 1 7 . 1 1 22 22 ALA CA C 22 54.847 54.847 54.847 0.000 18493 3077 1 7 . 1 1 22 22 ALA CB C 22 17.801 17.801 18.299 -0.498 18493 3078 1 7 . 1 1 23 23 LEU N N 23 118.917 118.917 119.775 -0.858 18493 3079 1 7 . 1 1 23 23 LEU C C 23 178.028 178.028 178.837 -0.809 18493 3080 1 7 . 1 1 23 23 LEU CA C 23 57.713 57.713 57.348 0.365 18493 3081 1 7 . 1 1 23 23 LEU CB C 23 41.506 41.506 41.522 -0.016 18493 3082 1 7 . 1 1 23 23 LEU H H 23 8.581 8.581 7.551 1.030 18493 3083 1 7 . 1 1 24 24 ALA N N 24 119.931 119.931 121.701 -1.770 18493 3084 1 7 . 1 1 24 24 ALA C C 24 180.617 180.617 179.672 0.945 18493 3085 1 7 . 1 1 24 24 ALA CA C 24 55.350 55.350 54.833 0.517 18493 3086 1 7 . 1 1 24 24 ALA CB C 24 17.583 17.583 17.491 0.092 18493 3087 1 7 . 1 1 25 25 LEU N N 25 119.691 119.691 118.641 1.050 18493 3088 1 7 . 1 1 25 25 LEU CA C 25 58.078 58.078 57.758 0.320 18493 3089 1 7 . 1 1 25 25 LEU CB C 25 43.597 43.597 40.967 2.630 18493 3090 1 7 . 1 1 25 25 LEU H H 25 9.179 9.179 8.561 0.618 18493 3091 1 7 . 1 1 26 26 GLU N N 26 119.651 119.651 118.498 1.153 18493 3092 1 7 . 1 1 26 26 GLU C C 26 179.334 179.334 179.454 -0.120 18493 3093 1 7 . 1 1 26 26 GLU CA C 26 59.584 59.584 58.883 0.701 18493 3094 1 7 . 1 1 26 26 GLU CB C 26 27.202 27.202 28.886 -1.684 18493 3095 1 7 . 1 1 27 27 LEU N N 27 119.661 119.661 120.576 -0.915 18493 3096 1 7 . 1 1 27 27 LEU CA C 27 57.887 57.887 57.788 0.099 18493 3097 1 7 . 1 1 27 27 LEU CB C 27 41.591 41.591 41.667 -0.076 18493 3098 1 7 . 1 1 27 27 LEU H H 27 9.410 9.410 8.153 1.257 18493 3099 1 7 . 1 1 28 28 THR N N 28 118.484 118.484 112.461 6.023 18493 3100 1 7 . 1 1 28 28 THR C C 28 175.898 175.898 176.897 -0.999 18493 3101 1 7 . 1 1 28 28 THR CA C 28 67.459 67.459 65.701 1.758 18493 3102 1 7 . 1 1 28 28 THR CB C 28 67.948 67.948 68.522 -0.574 18493 3103 1 7 . 1 1 29 29 ALA N N 29 122.643 122.643 125.982 -3.339 18493 3104 1 7 . 1 1 29 29 ALA C C 29 179.717 179.717 178.753 0.964 18493 3105 1 7 . 1 1 29 29 ALA CA C 29 55.919 55.919 54.824 1.095 18493 3106 1 7 . 1 1 29 29 ALA CB C 29 16.837 16.837 18.512 -1.675 18493 3107 1 7 . 1 1 29 29 ALA H H 29 8.302 8.302 8.340 -0.038 18493 3108 1 7 . 1 1 30 30 LEU N N 30 117.408 117.408 115.513 1.895 18493 3109 1 7 . 1 1 30 30 LEU C C 30 178.143 178.143 176.761 1.382 18493 3110 1 7 . 1 1 30 30 LEU CA C 30 57.384 57.384 55.355 2.029 18493 3111 1 7 . 1 1 30 30 LEU CB C 30 41.679 41.679 41.910 -0.231 18493 3112 1 7 . 1 1 30 30 LEU H H 30 8.412 8.412 7.935 0.477 18493 3113 1 7 . 1 1 31 31 TRP N N 31 125.692 125.692 119.862 5.830 18493 3114 1 7 . 1 1 31 31 TRP C C 31 179.053 179.053 177.508 1.545 18493 3115 1 7 . 1 1 31 31 TRP CA C 31 59.005 59.005 57.520 1.485 18493 3116 1 7 . 1 1 31 31 TRP CB C 31 28.142 28.142 31.275 -3.133 18493 3117 1 7 . 1 1 31 31 TRP H H 31 9.157 9.157 7.607 1.550 18493 3118 1 7 . 1 1 32 32 PHE N N 32 119.195 119.195 113.454 5.741 18493 3119 1 7 . 1 1 32 32 PHE CA C 32 61.557 61.557 58.728 2.829 18493 3120 1 7 . 1 1 32 32 PHE CB C 32 38.384 38.384 35.368 3.016 18493 3121 1 7 . 1 1 32 32 PHE H H 32 9.374 9.374 7.954 1.420 18493 3122 1 7 . 1 1 33 33 GLN C C 33 177.477 177.477 177.045 0.432 18493 3123 1 7 . 1 1 33 33 GLN CA C 33 56.613 56.613 58.944 -2.331 18493 3124 1 7 . 1 1 33 33 GLN CB C 33 29.433 29.433 27.738 1.694 18493 3125 1 7 . 1 1 34 34 HIS N N 34 115.948 115.948 116.046 -0.098 18493 3126 1 7 . 1 1 34 34 HIS C C 34 175.548 175.548 178.362 -2.814 18493 3127 1 7 . 1 1 34 34 HIS CA C 34 58.733 58.733 58.080 0.653 18493 3128 1 7 . 1 1 34 34 HIS CB C 34 32.084 32.084 29.376 2.708 18493 3129 1 7 . 1 1 34 34 HIS H H 34 9.621 9.621 7.510 2.111 18493 3130 1 7 . 1 1 35 35 VAL N N 35 116.902 116.902 120.516 -3.614 18493 3131 1 7 . 1 1 35 35 VAL C C 35 177.853 177.853 177.126 0.727 18493 3132 1 7 . 1 1 35 35 VAL CA C 35 64.075 64.075 65.084 -1.009 18493 3133 1 7 . 1 1 35 35 VAL CB C 35 30.626 30.626 31.799 -1.173 18493 3134 1 7 . 1 1 36 36 MET N N 36 114.145 114.145 116.675 -2.530 18493 3135 1 7 . 1 1 36 36 MET C C 36 175.905 175.905 176.645 -0.740 18493 3136 1 7 . 1 1 36 36 MET H H 36 7.605 7.605 8.009 -0.404 18493 3137 1 7 . 1 1 37 37 LEU N N 37 111.740 111.740 116.635 -4.895 18493 3138 1 7 . 1 1 37 37 LEU H H 37 7.121 7.121 7.733 -0.612 18493 3139 1 7 . 1 1 38 38 LEU C C 38 176.457 176.457 176.139 0.318 18493 3140 1 7 . 1 1 39 39 LYS N N 39 121.418 121.418 119.604 1.814 18493 3141 1 7 . 1 1 39 39 LYS CA C 39 57.471 57.471 56.593 0.878 18493 3142 1 7 . 1 1 39 39 LYS H H 39 9.359 9.359 8.544 0.815 18493 3143 1 7 . 1 1 40 40 PRO CA C 40 60.451 60.451 63.923 -3.472 18493 3144 1 7 . 1 1 42 42 VAL N N 42 118.166 118.166 120.770 -2.604 18493 3145 1 7 . 1 1 42 42 VAL C C 42 179.261 179.261 176.596 2.665 18493 3146 1 7 . 1 1 42 42 VAL CA C 42 67.223 67.223 64.839 2.384 18493 3147 1 7 . 1 1 42 42 VAL CB C 42 30.941 30.941 30.563 0.378 18493 3148 1 7 . 1 1 43 43 LEU N N 43 115.946 115.946 121.328 -5.382 18493 3149 1 7 . 1 1 43 43 LEU C C 43 178.293 178.293 179.345 -1.052 18493 3150 1 7 . 1 1 43 43 LEU CA C 43 57.129 57.129 57.841 -0.712 18493 3151 1 7 . 1 1 43 43 LEU CB C 43 41.030 41.030 40.865 0.165 18493 3152 1 7 . 1 1 44 44 CYS N N 44 115.006 115.006 117.917 -2.911 18493 3153 1 7 . 1 1 44 44 CYS C C 44 177.484 177.484 177.440 0.044 18493 3154 1 7 . 1 1 44 44 CYS CA C 44 59.760 59.760 62.667 -2.907 18493 3155 1 7 . 1 1 44 44 CYS CB C 44 30.651 30.651 27.196 3.455 18493 3156 1 7 . 1 1 44 44 CYS H H 44 7.683 7.683 8.186 -0.503 18493 3157 1 7 . 1 1 45 45 ILE N N 45 119.384 119.384 121.397 -2.013 18493 3158 1 7 . 1 1 45 45 ILE C C 45 179.575 179.575 176.167 3.408 18493 3159 1 7 . 1 1 45 45 ILE CA C 45 62.068 62.068 63.956 -1.888 18493 3160 1 7 . 1 1 45 45 ILE CB C 45 33.583 33.583 36.079 -2.496 18493 3161 1 7 . 1 1 46 46 TYR N N 46 120.126 120.126 119.808 0.318 18493 3162 1 7 . 1 1 46 46 TYR C C 46 178.397 178.397 177.539 0.858 18493 3163 1 7 . 1 1 46 46 TYR CA C 46 59.129 59.129 61.484 -2.355 18493 3164 1 7 . 1 1 46 46 TYR CB C 46 35.347 35.347 38.345 -2.998 18493 3165 1 7 . 1 1 46 46 TYR H H 46 8.958 8.958 7.568 1.390 18493 3166 1 7 . 1 1 47 47 GLU N N 47 121.779 121.779 118.062 3.717 18493 3167 1 7 . 1 1 47 47 GLU C C 47 179.907 179.907 179.077 0.830 18493 3168 1 7 . 1 1 47 47 GLU CA C 47 57.985 57.985 58.328 -0.343 18493 3169 1 7 . 1 1 47 47 GLU CB C 47 27.290 27.290 29.543 -2.253 18493 3170 1 7 . 1 1 47 47 GLU H H 47 9.681 9.681 8.601 1.080 18493 3171 1 7 . 1 1 48 48 ARG N N 48 119.188 119.188 120.920 -1.732 18493 3172 1 7 . 1 1 48 48 ARG C C 48 181.638 181.638 178.851 2.787 18493 3173 1 7 . 1 1 48 48 ARG CA C 48 60.299 60.299 59.510 0.789 18493 3174 1 7 . 1 1 48 48 ARG CB C 48 30.167 30.167 30.053 0.114 18493 3175 1 7 . 1 1 48 48 ARG H H 48 9.213 9.213 7.664 1.549 18493 3176 1 7 . 1 1 49 49 VAL N N 49 121.326 121.326 119.219 2.107 18493 3177 1 7 . 1 1 49 49 VAL C C 49 177.326 177.326 177.505 -0.179 18493 3178 1 7 . 1 1 49 49 VAL CA C 49 66.624 66.624 66.278 0.346 18493 3179 1 7 . 1 1 49 49 VAL CB C 49 31.280 31.280 31.173 0.107 18493 3180 1 7 . 1 1 50 50 ALA N N 50 122.955 122.955 121.929 1.026 18493 3181 1 7 . 1 1 50 50 ALA C C 50 179.594 179.594 179.728 -0.134 18493 3182 1 7 . 1 1 50 50 ALA CA C 50 55.902 55.902 55.075 0.827 18493 3183 1 7 . 1 1 50 50 ALA CB C 50 16.623 16.623 18.081 -1.458 18493 3184 1 7 . 1 1 51 51 LEU N N 51 115.737 115.737 119.694 -3.957 18493 3185 1 7 . 1 1 51 51 LEU C C 51 177.990 177.990 178.082 -0.092 18493 3186 1 7 . 1 1 51 51 LEU CA C 51 57.285 57.285 58.020 -0.736 18493 3187 1 7 . 1 1 51 51 LEU CB C 51 41.369 41.369 41.986 -0.617 18493 3188 1 7 . 1 1 52 52 PHE N N 52 122.707 122.707 118.225 4.482 18493 3189 1 7 . 1 1 52 52 PHE C C 52 179.142 179.142 178.500 0.642 18493 3190 1 7 . 1 1 52 52 PHE CA C 52 62.518 62.518 61.988 0.530 18493 3191 1 7 . 1 1 52 52 PHE CB C 52 38.538 38.538 37.998 0.540 18493 3192 1 7 . 1 1 52 52 PHE H H 52 8.863 8.863 7.802 1.061 18493 3193 1 7 . 1 1 53 53 GLY N N 53 110.801 110.801 108.221 2.580 18493 3194 1 7 . 1 1 53 53 GLY C C 53 175.378 175.378 175.927 -0.549 18493 3195 1 7 . 1 1 53 53 GLY CA C 53 48.024 48.024 47.275 0.749 18493 3196 1 7 . 1 1 53 53 GLY H H 53 9.027 9.027 7.826 1.201 18493 3197 1 7 . 1 1 54 54 VAL N N 54 121.926 121.926 123.700 -1.774 18493 3198 1 7 . 1 1 54 54 VAL C C 54 177.035 177.035 178.132 -1.097 18493 3199 1 7 . 1 1 54 54 VAL CA C 54 67.448 67.448 66.091 1.357 18493 3200 1 7 . 1 1 54 54 VAL CB C 54 31.246 31.246 31.593 -0.347 18493 3201 1 7 . 1 1 54 54 VAL H H 54 7.948 7.948 7.755 0.193 18493 3202 1 7 . 1 1 55 55 LEU N N 55 119.894 119.894 121.177 -1.283 18493 3203 1 7 . 1 1 55 55 LEU C C 55 178.175 178.175 178.746 -0.571 18493 3204 1 7 . 1 1 55 55 LEU CA C 55 58.490 58.490 58.094 0.396 18493 3205 1 7 . 1 1 55 55 LEU CB C 55 42.145 42.145 40.640 1.505 18493 3206 1 7 . 1 1 55 55 LEU H H 55 8.646 8.646 9.154 -0.508 18493 3207 1 7 . 1 1 56 56 GLY N N 56 106.262 106.262 106.678 -0.416 18493 3208 1 7 . 1 1 56 56 GLY C C 56 174.618 174.618 175.812 -1.194 18493 3209 1 7 . 1 1 56 56 GLY CA C 56 47.533 47.533 47.627 -0.094 18493 3210 1 7 . 1 1 57 57 ALA N N 57 123.002 123.002 124.726 -1.724 18493 3211 1 7 . 1 1 57 57 ALA C C 57 178.688 178.688 179.655 -0.967 18493 3212 1 7 . 1 1 57 57 ALA CA C 57 55.548 55.548 54.897 0.651 18493 3213 1 7 . 1 1 57 57 ALA CB C 57 18.065 18.065 18.541 -0.476 18493 3214 1 7 . 1 1 58 58 ALA N N 58 118.866 118.866 122.202 -3.336 18493 3215 1 7 . 1 1 58 58 ALA C C 58 179.348 179.348 179.237 0.111 18493 3216 1 7 . 1 1 58 58 ALA CA C 58 54.763 54.763 55.037 -0.274 18493 3217 1 7 . 1 1 58 58 ALA CB C 58 17.898 17.898 18.524 -0.626 18493 3218 1 7 . 1 1 58 58 ALA H H 58 8.674 8.674 8.295 0.379 18493 3219 1 7 . 1 1 59 59 LEU N N 59 115.384 115.384 119.160 -3.776 18493 3220 1 7 . 1 1 59 59 LEU C C 59 177.654 177.654 178.409 -0.755 18493 3221 1 7 . 1 1 59 59 LEU CA C 59 57.387 57.387 57.436 -0.049 18493 3222 1 7 . 1 1 59 59 LEU CB C 59 41.209 41.209 42.761 -1.552 18493 3223 1 7 . 1 1 60 60 ILE N N 60 116.140 116.140 116.597 -0.457 18493 3224 1 7 . 1 1 60 60 ILE C C 60 180.024 180.024 177.444 2.580 18493 3225 1 7 . 1 1 60 60 ILE CA C 60 64.263 64.263 64.047 0.216 18493 3226 1 7 . 1 1 60 60 ILE CB C 60 37.240 37.240 37.711 -0.471 18493 3227 1 7 . 1 1 61 61 GLY N N 61 110.127 110.127 104.912 5.215 18493 3228 1 7 . 1 1 61 61 GLY C C 61 173.716 173.716 173.752 -0.036 18493 3229 1 7 . 1 1 61 61 GLY CA C 61 45.617 45.617 44.850 0.767 18493 3230 1 7 . 1 1 61 61 GLY H H 61 9.046 9.046 8.183 0.863 18493 3231 1 7 . 1 1 62 62 ALA N N 62 118.949 118.949 121.726 -2.777 18493 3232 1 7 . 1 1 62 62 ALA C C 62 176.192 176.192 177.581 -1.389 18493 3233 1 7 . 1 1 62 62 ALA CA C 62 53.268 53.268 51.892 1.376 18493 3234 1 7 . 1 1 62 62 ALA CB C 62 19.138 19.138 19.736 -0.598 18493 3235 1 7 . 1 1 62 62 ALA H H 62 8.066 8.066 7.350 0.716 18493 3236 1 7 . 1 1 63 63 ILE N N 63 116.800 116.800 119.169 -2.369 18493 3237 1 7 . 1 1 63 63 ILE CA C 63 66.739 66.739 63.198 3.541 18493 3238 1 7 . 1 1 63 63 ILE CB C 63 37.947 37.947 38.677 -0.730 18493 3239 1 7 . 1 1 64 64 ALA N N 64 123.957 123.957 122.244 1.713 18493 3240 1 7 . 1 1 64 64 ALA CA C 64 52.934 52.934 49.002 3.932 18493 3241 1 7 . 1 1 64 64 ALA CB C 64 19.428 19.428 18.902 0.526 18493 3242 1 7 . 1 1 65 65 PRO CA C 65 65.350 65.350 62.044 3.305 18493 3243 1 7 . 1 1 66 66 LYS N N 66 116.618 116.618 116.737 -0.119 18493 3244 1 7 . 1 1 66 66 LYS C C 66 177.500 177.500 174.963 2.537 18493 3245 1 7 . 1 1 66 66 LYS CA C 66 56.547 56.547 56.309 0.238 18493 3246 1 7 . 1 1 66 66 LYS CB C 66 30.522 30.522 31.131 -0.609 18493 3247 1 7 . 1 1 67 67 THR CA C 67 60.452 60.452 63.608 -3.156 18493 3248 1 7 . 1 1 67 67 THR CB C 67 69.948 69.948 68.323 1.625 18493 3249 1 7 . 1 1 68 68 PRO C C 68 177.070 177.070 177.242 -0.172 18493 3250 1 7 . 1 1 68 68 PRO CA C 68 63.315 63.315 61.574 1.741 18493 3251 1 7 . 1 1 68 68 PRO CB C 68 32.458 32.458 32.561 -0.103 18493 3252 1 7 . 1 1 69 69 LEU N N 69 121.517 121.517 118.701 2.816 18493 3253 1 7 . 1 1 69 69 LEU C C 69 179.448 179.448 177.983 1.465 18493 3254 1 7 . 1 1 69 69 LEU CA C 69 57.389 57.389 55.687 1.702 18493 3255 1 7 . 1 1 69 69 LEU CB C 69 42.737 42.737 39.737 3.000 18493 3256 1 7 . 1 1 69 69 LEU H H 69 8.882 8.882 8.276 0.606 18493 3257 1 7 . 1 1 70 70 ARG N N 70 114.028 114.028 117.948 -3.920 18493 3258 1 7 . 1 1 70 70 ARG C C 70 177.925 177.925 178.100 -0.175 18493 3259 1 7 . 1 1 70 70 ARG CA C 70 58.429 58.429 57.711 0.718 18493 3260 1 7 . 1 1 70 70 ARG CB C 70 29.391 29.391 28.472 0.919 18493 3261 1 7 . 1 1 70 70 ARG H H 70 8.202 8.202 8.088 0.114 18493 3262 1 7 . 1 1 71 71 TYR N N 71 121.740 121.740 117.682 4.058 18493 3263 1 7 . 1 1 71 71 TYR CA C 71 57.374 57.374 55.789 1.585 18493 3264 1 7 . 1 1 71 71 TYR H H 71 8.136 8.136 7.249 0.887 18493 3265 1 7 . 1 1 72 72 VAL N N 72 118.416 118.416 123.322 -4.906 18493 3266 1 7 . 1 1 72 72 VAL C C 72 177.702 177.702 176.869 0.833 18493 3267 1 7 . 1 1 72 72 VAL CA C 72 66.098 66.098 65.437 0.661 18493 3268 1 7 . 1 1 72 72 VAL CB C 72 31.343 31.343 31.703 -0.360 18493 3269 1 7 . 1 1 73 73 ALA N N 73 120.283 120.283 121.498 -1.215 18493 3270 1 7 . 1 1 73 73 ALA C C 73 179.763 179.763 179.336 0.427 18493 3271 1 7 . 1 1 73 73 ALA CA C 73 55.785 55.785 54.818 0.967 18493 3272 1 7 . 1 1 73 73 ALA CB C 73 19.265 19.265 18.069 1.196 18493 3273 1 7 . 1 1 73 73 ALA H H 73 9.015 9.015 7.528 1.487 18493 3274 1 7 . 1 1 74 74 MET N N 74 115.547 115.547 117.941 -2.394 18493 3275 1 7 . 1 1 74 74 MET C C 74 177.223 177.223 178.467 -1.244 18493 3276 1 7 . 1 1 74 74 MET CA C 74 61.023 61.023 59.173 1.850 18493 3277 1 7 . 1 1 74 74 MET CB C 74 33.777 33.777 31.986 1.791 18493 3278 1 7 . 1 1 74 74 MET H H 74 8.163 8.163 8.210 -0.047 18493 3279 1 7 . 1 1 75 75 VAL N N 75 118.690 118.690 119.417 -0.727 18493 3280 1 7 . 1 1 75 75 VAL C C 75 177.166 177.166 177.461 -0.295 18493 3281 1 7 . 1 1 75 75 VAL CA C 75 67.581 67.581 66.876 0.705 18493 3282 1 7 . 1 1 75 75 VAL CB C 75 31.408 31.408 31.727 -0.319 18493 3283 1 7 . 1 1 75 75 VAL H H 75 7.554 7.554 7.798 -0.244 18493 3284 1 7 . 1 1 76 76 ILE N N 76 118.959 118.959 120.464 -1.505 18493 3285 1 7 . 1 1 76 76 ILE C C 76 178.680 178.680 177.693 0.987 18493 3286 1 7 . 1 1 76 76 ILE CA C 76 65.839 65.839 63.925 1.914 18493 3287 1 7 . 1 1 76 76 ILE CB C 76 38.414 38.414 37.176 1.238 18493 3288 1 7 . 1 1 77 77 TRP N N 77 125.440 125.440 121.975 3.465 18493 3289 1 7 . 1 1 77 77 TRP C C 77 177.153 177.153 177.937 -0.784 18493 3290 1 7 . 1 1 77 77 TRP CA C 77 58.779 58.779 59.980 -1.202 18493 3291 1 7 . 1 1 77 77 TRP CB C 77 30.494 30.494 28.417 2.077 18493 3292 1 7 . 1 1 77 77 TRP H H 77 9.515 9.515 8.327 1.188 18493 3293 1 7 . 1 1 78 78 LEU N N 78 118.968 118.968 123.052 -4.084 18493 3294 1 7 . 1 1 78 78 LEU C C 78 178.381 178.381 178.357 0.024 18493 3295 1 7 . 1 1 78 78 LEU CA C 78 58.041 58.041 57.782 0.259 18493 3296 1 7 . 1 1 78 78 LEU CB C 78 43.807 43.807 41.849 1.958 18493 3297 1 7 . 1 1 78 78 LEU H H 78 9.367 9.367 8.213 1.154 18493 3298 1 7 . 1 1 79 79 TYR N N 79 118.181 118.181 120.341 -2.160 18493 3299 1 7 . 1 1 79 79 TYR C C 79 176.777 176.777 177.610 -0.833 18493 3300 1 7 . 1 1 79 79 TYR CA C 79 62.849 62.849 62.068 0.781 18493 3301 1 7 . 1 1 80 80 SER N N 80 114.286 114.286 114.231 0.055 18493 3302 1 7 . 1 1 80 80 SER C C 80 175.943 175.943 176.549 -0.606 18493 3303 1 7 . 1 1 80 80 SER CA C 80 63.515 63.515 61.697 1.818 18493 3304 1 7 . 1 1 80 80 SER CB C 80 63.941 63.941 62.769 1.172 18493 3305 1 7 . 1 1 81 81 ALA N N 81 121.070 121.070 124.727 -3.657 18493 3306 1 7 . 1 1 81 81 ALA C C 81 178.208 178.208 179.186 -0.978 18493 3307 1 7 . 1 1 81 81 ALA CA C 81 55.224 55.224 54.586 0.638 18493 3308 1 7 . 1 1 81 81 ALA CB C 81 17.897 17.897 18.185 -0.288 18493 3309 1 7 . 1 1 82 82 PHE N N 82 117.560 117.560 120.360 -2.800 18493 3310 1 7 . 1 1 82 82 PHE C C 82 176.975 176.975 176.943 0.032 18493 3311 1 7 . 1 1 82 82 PHE CA C 82 62.132 62.132 59.571 2.561 18493 3312 1 7 . 1 1 82 82 PHE CB C 82 38.497 38.497 38.708 -0.210 18493 3313 1 7 . 1 1 83 83 ARG N N 83 117.110 117.110 119.048 -1.938 18493 3314 1 7 . 1 1 83 83 ARG C C 83 178.637 178.637 178.300 0.337 18493 3315 1 7 . 1 1 83 83 ARG CA C 83 60.291 60.291 59.306 0.985 18493 3316 1 7 . 1 1 83 83 ARG CB C 83 28.625 28.625 29.514 -0.889 18493 3317 1 7 . 1 1 84 84 GLY N N 84 105.915 105.915 106.942 -1.027 18493 3318 1 7 . 1 1 84 84 GLY C C 84 177.091 177.091 175.673 1.418 18493 3319 1 7 . 1 1 84 84 GLY CA C 84 46.128 46.128 46.325 -0.197 18493 3320 1 7 . 1 1 85 85 VAL N N 85 124.985 124.985 123.566 1.419 18493 3321 1 7 . 1 1 85 85 VAL C C 85 176.387 176.387 177.928 -1.541 18493 3322 1 7 . 1 1 85 85 VAL CA C 85 66.960 66.960 65.539 1.421 18493 3323 1 7 . 1 1 85 85 VAL CB C 85 31.066 31.066 31.615 -0.549 18493 3324 1 7 . 1 1 86 86 GLN N N 86 116.522 116.522 119.180 -2.658 18493 3325 1 7 . 1 1 86 86 GLN C C 86 179.586 179.586 178.532 1.054 18493 3326 1 7 . 1 1 86 86 GLN CA C 86 59.505 59.505 58.903 0.603 18493 3327 1 7 . 1 1 86 86 GLN CB C 86 28.762 28.762 28.041 0.721 18493 3328 1 7 . 1 1 87 87 LEU N N 87 121.211 121.211 120.592 0.619 18493 3329 1 7 . 1 1 87 87 LEU C C 87 178.396 178.396 179.651 -1.255 18493 3330 1 7 . 1 1 87 87 LEU CA C 87 57.847 57.847 57.462 0.384 18493 3331 1 7 . 1 1 87 87 LEU CB C 87 41.924 41.924 41.619 0.305 18493 3332 1 7 . 1 1 87 87 LEU H H 87 8.955 8.955 7.826 1.129 18493 3333 1 7 . 1 1 88 88 THR N N 88 108.251 108.251 113.482 -5.231 18493 3334 1 7 . 1 1 88 88 THR C C 88 180.013 180.013 176.269 3.744 18493 3335 1 7 . 1 1 88 88 THR CA C 88 65.112 65.112 66.392 -1.280 18493 3336 1 7 . 1 1 88 88 THR CB C 88 68.805 68.805 68.948 -0.143 18493 3337 1 7 . 1 1 88 88 THR H H 88 8.764 8.764 8.194 0.570 18493 3338 1 7 . 1 1 89 89 TYR N N 89 127.947 127.947 122.420 5.527 18493 3339 1 7 . 1 1 89 89 TYR C C 89 177.244 177.244 176.907 0.337 18493 3340 1 7 . 1 1 89 89 TYR H H 89 9.868 9.868 7.958 1.910 18493 3341 1 7 . 1 1 90 90 GLU N N 90 121.163 121.163 118.479 2.684 18493 3342 1 7 . 1 1 90 90 GLU C C 90 178.671 178.671 178.698 -0.027 18493 3343 1 7 . 1 1 90 90 GLU H H 90 8.515 8.515 8.138 0.377 18493 3344 1 7 . 1 1 91 91 HIS N N 91 120.459 120.459 118.664 1.795 18493 3345 1 7 . 1 1 91 91 HIS C C 91 177.605 177.605 176.696 0.909 18493 3346 1 7 . 1 1 91 91 HIS CA C 91 57.085 57.085 59.291 -2.206 18493 3347 1 7 . 1 1 91 91 HIS CB C 91 34.128 34.128 29.695 4.433 18493 3348 1 7 . 1 1 91 91 HIS H H 91 9.102 9.102 8.314 0.788 18493 3349 1 7 . 1 1 92 92 THR N N 92 115.463 115.463 115.255 0.208 18493 3350 1 7 . 1 1 92 92 THR C C 92 176.189 176.189 176.416 -0.227 18493 3351 1 7 . 1 1 92 92 THR CA C 92 67.058 67.058 65.329 1.729 18493 3352 1 7 . 1 1 92 92 THR CB C 92 68.564 68.564 68.930 -0.365 18493 3353 1 7 . 1 1 92 92 THR H H 92 9.550 9.550 7.879 1.671 18493 3354 1 7 . 1 1 93 93 MET N N 93 117.153 117.153 122.036 -4.883 18493 3355 1 7 . 1 1 93 93 MET C C 93 176.972 176.972 177.929 -0.957 18493 3356 1 7 . 1 1 93 93 MET CA C 93 62.369 62.369 57.572 4.796 18493 3357 1 7 . 1 1 93 93 MET CB C 93 33.515 33.515 32.110 1.405 18493 3358 1 7 . 1 1 94 94 LEU N N 94 117.981 117.981 119.091 -1.110 18493 3359 1 7 . 1 1 94 94 LEU CA C 94 57.489 57.489 57.517 -0.028 18493 3360 1 7 . 1 1 94 94 LEU CB C 94 41.432 41.432 41.693 -0.261 18493 3361 1 7 . 1 1 94 94 LEU H H 94 8.497 8.497 8.401 0.096 18493 3362 1 7 . 1 1 95 95 GLN C C 95 178.331 178.331 177.746 0.585 18493 3363 1 7 . 1 1 95 95 GLN CA C 95 57.604 57.604 57.802 -0.198 18493 3364 1 7 . 1 1 95 95 GLN CB C 95 28.200 28.200 28.868 -0.668 18493 3365 1 7 . 1 1 96 96 LEU N N 96 118.174 118.174 118.971 -0.797 18493 3366 1 7 . 1 1 96 96 LEU C C 96 177.842 177.842 175.877 1.965 18493 3367 1 7 . 1 1 96 96 LEU CA C 96 57.747 57.747 55.179 2.568 18493 3368 1 7 . 1 1 96 96 LEU CB C 96 41.721 41.721 39.539 2.182 18493 3369 1 7 . 1 1 97 97 TYR N N 97 117.359 117.359 116.786 0.573 18493 3370 1 7 . 1 1 97 97 TYR CA C 97 57.581 57.581 56.480 1.101 18493 3371 1 7 . 1 1 97 97 TYR H H 97 8.485 8.485 8.702 -0.217 18493 3372 1 7 . 1 1 98 98 PRO CA C 98 63.847 63.847 62.152 1.695 18493 3373 1 7 . 1 1 99 99 SER CA C 99 58.145 58.145 55.158 2.987 18493 3374 1 7 . 1 1 99 99 SER CB C 99 64.506 64.506 63.844 0.661 18493 3375 1 7 . 1 1 101 101 PHE C C 101 174.992 174.992 176.337 -1.345 18493 3376 1 7 . 1 1 102 102 ALA N N 102 120.614 120.614 119.802 0.812 18493 3377 1 7 . 1 1 102 102 ALA C C 102 176.810 176.810 178.229 -1.419 18493 3378 1 7 . 1 1 102 102 ALA CA C 102 54.355 54.355 53.623 0.732 18493 3379 1 7 . 1 1 102 102 ALA H H 102 7.383 7.383 7.562 -0.179 18493 3380 1 7 . 1 1 103 103 THR N N 103 112.507 112.507 116.372 -3.865 18493 3381 1 7 . 1 1 103 103 THR C C 103 175.666 175.666 174.265 1.401 18493 3382 1 7 . 1 1 103 103 THR CA C 103 59.838 59.838 62.518 -2.680 18493 3383 1 7 . 1 1 103 103 THR CB C 103 67.623 67.623 69.403 -1.780 18493 3384 1 7 . 1 1 103 103 THR H H 103 9.278 9.278 7.896 1.382 18493 3385 1 7 . 1 1 104 104 CYS N N 104 122.754 122.754 119.659 3.095 18493 3386 1 7 . 1 1 104 104 CYS C C 104 174.474 174.474 174.015 0.459 18493 3387 1 7 . 1 1 104 104 CYS CA C 104 64.988 64.988 56.409 8.579 18493 3388 1 7 . 1 1 104 104 CYS CB C 104 42.988 42.988 30.116 12.872 18493 3389 1 7 . 1 1 104 104 CYS H H 104 9.934 9.934 8.535 1.399 18493 3390 1 7 . 1 1 105 105 ASP N N 105 121.350 121.350 121.184 0.166 18493 3391 1 7 . 1 1 105 105 ASP CB C 105 41.030 41.030 40.358 0.672 18493 3392 1 7 . 1 1 105 105 ASP H H 105 8.153 8.153 8.798 -0.645 18493 3393 1 7 . 1 1 115 115 PRO CA C 115 61.148 61.148 63.384 -2.236 18493 3394 1 7 . 1 1 115 115 PRO CB C 115 30.280 30.280 32.110 -1.830 18493 3395 1 7 . 1 1 116 116 LEU C C 116 178.163 178.163 176.343 1.820 18493 3396 1 7 . 1 1 116 116 LEU CA C 116 58.746 58.746 54.582 4.164 18493 3397 1 7 . 1 1 116 116 LEU CB C 116 42.932 42.932 42.632 0.300 18493 3398 1 7 . 1 1 117 117 ASP N N 117 116.302 116.302 122.940 -6.638 18493 3399 1 7 . 1 1 117 117 ASP C C 117 177.528 177.528 176.058 1.470 18493 3400 1 7 . 1 1 117 117 ASP CB C 117 41.252 41.252 41.315 -0.063 18493 3401 1 7 . 1 1 118 118 LYS N N 118 118.983 118.983 117.535 1.448 18493 3402 1 7 . 1 1 118 118 LYS H H 118 7.538 7.538 8.552 -1.014 18493 3403 1 7 . 1 1 119 119 TRP C C 119 177.867 177.867 174.902 2.965 18493 3404 1 7 . 1 1 120 120 VAL N N 120 113.149 113.149 114.641 -1.492 18493 3405 1 7 . 1 1 120 120 VAL CA C 120 58.651 58.651 60.055 -1.404 18493 3406 1 7 . 1 1 120 120 VAL CB C 120 31.821 31.821 32.814 -0.993 18493 3407 1 7 . 1 1 120 120 VAL H H 120 8.936 8.936 7.958 0.978 18493 3408 1 7 . 1 1 121 121 PRO C C 121 178.888 178.888 177.695 1.193 18493 3409 1 7 . 1 1 121 121 PRO CA C 121 65.185 65.185 63.563 1.622 18493 3410 1 7 . 1 1 121 121 PRO CB C 121 31.781 31.781 32.454 -0.673 18493 3411 1 7 . 1 1 122 122 GLN N N 122 116.304 116.304 118.458 -2.154 18493 3412 1 7 . 1 1 122 122 GLN C C 122 174.326 174.326 176.812 -2.486 18493 3413 1 7 . 1 1 122 122 GLN CA C 122 58.463 58.463 57.925 0.539 18493 3414 1 7 . 1 1 122 122 GLN H H 122 9.809 9.809 8.927 0.882 18493 3415 1 7 . 1 1 123 123 VAL N N 123 113.254 113.254 113.779 -0.525 18493 3416 1 7 . 1 1 123 123 VAL C C 123 175.777 175.777 176.222 -0.445 18493 3417 1 7 . 1 1 123 123 VAL CA C 123 61.689 61.689 64.156 -2.466 18493 3418 1 7 . 1 1 123 123 VAL CB C 123 35.373 35.373 31.809 3.564 18493 3419 1 7 . 1 1 123 123 VAL H H 123 8.219 8.219 7.584 0.635 18493 3420 1 7 . 1 1 124 124 PHE N N 124 112.242 112.242 119.340 -7.098 18493 3421 1 7 . 1 1 124 124 PHE C C 124 172.759 172.759 174.456 -1.697 18493 3422 1 7 . 1 1 124 124 PHE CB C 124 39.318 39.318 41.344 -2.026 18493 3423 1 7 . 1 1 125 125 VAL N N 125 115.233 115.233 116.587 -1.354 18493 3424 1 7 . 1 1 125 125 VAL C C 125 177.034 177.034 174.058 2.976 18493 3425 1 7 . 1 1 125 125 VAL CA C 125 61.950 61.950 60.790 1.160 18493 3426 1 7 . 1 1 125 125 VAL CB C 125 33.376 33.376 34.552 -1.176 18493 3427 1 7 . 1 1 125 125 VAL H H 125 7.799 7.799 8.038 -0.239 18493 3428 1 7 . 1 1 126 126 ALA N N 126 130.709 130.709 129.702 1.007 18493 3429 1 7 . 1 1 126 126 ALA C C 126 175.920 175.920 177.225 -1.305 18493 3430 1 7 . 1 1 126 126 ALA CA C 126 54.493 54.493 52.757 1.736 18493 3431 1 7 . 1 1 126 126 ALA CB C 126 17.215 17.215 20.022 -2.807 18493 3432 1 7 . 1 1 126 126 ALA H H 126 9.014 9.014 8.324 0.690 18493 3433 1 7 . 1 1 127 127 SER N N 127 112.716 112.716 114.263 -1.547 18493 3434 1 7 . 1 1 127 127 SER CA C 127 58.101 58.101 60.051 -1.950 18493 3435 1 7 . 1 1 127 127 SER CB C 127 64.539 64.539 61.812 2.727 18493 3436 1 7 . 1 1 127 127 SER H H 127 8.145 8.145 8.517 -0.372 18493 3437 1 7 . 1 1 128 128 GLY N N 128 106.487 106.487 111.121 -4.634 18493 3438 1 7 . 1 1 128 128 GLY C C 128 177.047 177.047 173.904 3.143 18493 3439 1 7 . 1 1 128 128 GLY CA C 128 46.296 46.296 45.480 0.816 18493 3440 1 7 . 1 1 128 128 GLY H H 128 8.595 8.595 8.284 0.311 18493 3441 1 7 . 1 1 129 129 ASP C C 129 177.916 177.916 175.563 2.353 18493 3442 1 7 . 1 1 129 129 ASP CB C 129 43.975 43.975 39.769 4.206 18493 3443 1 7 . 1 1 130 130 CYS N N 130 122.984 122.984 118.801 4.183 18493 3444 1 7 . 1 1 130 130 CYS C C 130 173.312 173.312 174.747 -1.435 18493 3445 1 7 . 1 1 130 130 CYS CA C 130 64.581 64.581 56.413 8.168 18493 3446 1 7 . 1 1 130 130 CYS CB C 130 42.879 42.879 28.823 14.056 18493 3447 1 7 . 1 1 130 130 CYS H H 130 9.948 9.948 8.144 1.804 18493 3448 1 7 . 1 1 131 131 ALA N N 131 121.534 121.534 123.348 -1.814 18493 3449 1 7 . 1 1 131 131 ALA CA C 131 52.640 52.640 52.686 -0.046 18493 3450 1 7 . 1 1 131 131 ALA CB C 131 18.497 18.497 19.069 -0.572 18493 3451 1 7 . 1 1 131 131 ALA H H 131 9.869 9.869 8.319 1.550 18493 3452 1 7 . 1 1 136 136 ASP C C 136 172.916 172.916 176.297 -3.381 18493 3453 1 7 . 1 1 137 137 PHE N N 137 117.677 117.677 120.826 -3.149 18493 3454 1 7 . 1 1 137 137 PHE CA C 137 57.310 57.310 58.306 -0.996 18493 3455 1 7 . 1 1 137 137 PHE CB C 137 42.927 42.927 39.337 3.590 18493 3456 1 7 . 1 1 137 137 PHE H H 137 8.959 8.959 8.273 0.686 18493 3457 1 7 . 1 1 138 138 LEU CB C 138 43.547 43.547 40.044 3.503 18493 3458 1 7 . 1 1 139 139 GLY C C 139 176.262 176.262 174.114 2.148 18493 3459 1 7 . 1 1 139 139 GLY CA C 139 46.123 46.123 47.198 -1.075 18493 3460 1 7 . 1 1 140 140 LEU N N 140 124.207 124.207 120.036 4.171 18493 3461 1 7 . 1 1 140 140 LEU CB C 140 40.503 40.503 42.802 -2.299 18493 3462 1 7 . 1 1 142 142 MET CA C 142 56.442 56.442 57.526 -1.084 18493 3463 1 7 . 1 1 143 143 PRO CA C 143 63.254 63.254 66.539 -3.285 18493 3464 1 7 . 1 1 144 144 GLN C C 144 177.307 177.307 178.392 -1.085 18493 3465 1 7 . 1 1 145 145 TRP N N 145 120.795 120.795 119.855 0.940 18493 3466 1 7 . 1 1 145 145 TRP C C 145 178.709 178.709 178.963 -0.254 18493 3467 1 7 . 1 1 145 145 TRP CA C 145 59.535 59.535 58.888 0.647 18493 3468 1 7 . 1 1 145 145 TRP CB C 145 29.345 29.345 29.265 0.080 18493 3469 1 7 . 1 1 145 145 TRP H H 145 8.386 8.386 7.224 1.162 18493 3470 1 7 . 1 1 146 146 LEU N N 146 118.336 118.336 120.066 -1.730 18493 3471 1 7 . 1 1 146 146 LEU C C 146 177.115 177.115 178.409 -1.294 18493 3472 1 7 . 1 1 146 146 LEU CA C 146 57.793 57.793 57.100 0.693 18493 3473 1 7 . 1 1 146 146 LEU CB C 146 41.616 41.616 41.253 0.363 18493 3474 1 7 . 1 1 146 146 LEU H H 146 9.033 9.033 8.970 0.063 18493 3475 1 7 . 1 1 147 147 LEU N N 147 123.772 123.772 120.036 3.736 18493 3476 1 7 . 1 1 147 147 LEU C C 147 178.787 178.787 178.912 -0.125 18493 3477 1 7 . 1 1 147 147 LEU CA C 147 58.052 58.052 58.181 -0.129 18493 3478 1 7 . 1 1 147 147 LEU CB C 147 41.047 41.047 40.807 0.240 18493 3479 1 7 . 1 1 147 147 LEU H H 147 8.480 8.480 8.736 -0.256 18493 3480 1 7 . 1 1 148 148 GLY N N 148 104.457 104.457 107.641 -3.184 18493 3481 1 7 . 1 1 148 148 GLY C C 148 174.667 174.667 176.229 -1.562 18493 3482 1 7 . 1 1 148 148 GLY CA C 148 48.102 48.102 47.257 0.845 18493 3483 1 7 . 1 1 149 149 ILE N N 149 121.815 121.815 122.705 -0.890 18493 3484 1 7 . 1 1 149 149 ILE C C 149 177.725 177.725 177.482 0.243 18493 3485 1 7 . 1 1 149 149 ILE CA C 149 65.997 65.997 64.715 1.282 18493 3486 1 7 . 1 1 149 149 ILE CB C 149 38.262 38.262 37.596 0.666 18493 3487 1 7 . 1 1 150 150 PHE N N 150 118.894 118.894 118.362 0.532 18493 3488 1 7 . 1 1 150 150 PHE C C 150 178.929 178.929 177.896 1.033 18493 3489 1 7 . 1 1 150 150 PHE CA C 150 63.591 63.591 62.014 1.577 18493 3490 1 7 . 1 1 150 150 PHE CB C 150 38.417 38.417 38.270 0.147 18493 3491 1 7 . 1 1 151 151 ILE N N 151 120.535 120.535 120.190 0.345 18493 3492 1 7 . 1 1 151 151 ILE C C 151 177.347 177.347 177.526 -0.179 18493 3493 1 7 . 1 1 151 151 ILE CA C 151 66.478 66.478 65.446 1.032 18493 3494 1 7 . 1 1 151 151 ILE CB C 151 37.302 37.302 37.444 -0.142 18493 3495 1 7 . 1 1 152 152 ALA N N 152 122.855 122.855 123.475 -0.620 18493 3496 1 7 . 1 1 152 152 ALA C C 152 179.165 179.165 179.897 -0.732 18493 3497 1 7 . 1 1 152 152 ALA CA C 152 56.272 56.272 55.477 0.795 18493 3498 1 7 . 1 1 152 152 ALA CB C 152 17.993 17.993 17.852 0.141 18493 3499 1 7 . 1 1 153 153 TYR N N 153 116.156 116.156 117.530 -1.374 18493 3500 1 7 . 1 1 153 153 TYR C C 153 179.682 179.682 178.219 1.463 18493 3501 1 7 . 1 1 153 153 TYR CA C 153 64.391 64.391 58.275 6.116 18493 3502 1 7 . 1 1 153 153 TYR CB C 153 39.553 39.553 37.604 1.949 18493 3503 1 7 . 1 1 153 153 TYR H H 153 8.680 8.680 7.613 1.067 18493 3504 1 7 . 1 1 154 154 LEU N N 154 122.327 122.327 122.685 -0.358 18493 3505 1 7 . 1 1 154 154 LEU C C 154 177.336 177.336 178.954 -1.618 18493 3506 1 7 . 1 1 154 154 LEU CA C 154 57.905 57.905 58.135 -0.230 18493 3507 1 7 . 1 1 154 154 LEU CB C 154 42.009 42.009 41.562 0.446 18493 3508 1 7 . 1 1 155 155 ILE N N 155 119.079 119.079 116.623 2.456 18493 3509 1 7 . 1 1 155 155 ILE C C 155 177.589 177.589 177.736 -0.147 18493 3510 1 7 . 1 1 155 155 ILE CA C 155 65.996 65.996 65.158 0.838 18493 3511 1 7 . 1 1 155 155 ILE CB C 155 38.179 38.179 37.449 0.730 18493 3512 1 7 . 1 1 156 156 VAL N N 156 117.551 117.551 122.172 -4.621 18493 3513 1 7 . 1 1 156 156 VAL C C 156 176.163 176.163 178.008 -1.845 18493 3514 1 7 . 1 1 156 156 VAL CA C 156 67.664 67.664 67.478 0.186 18493 3515 1 7 . 1 1 156 156 VAL CB C 156 31.694 31.694 31.121 0.573 18493 3516 1 7 . 1 1 157 157 ALA N N 157 122.470 122.470 121.948 0.522 18493 3517 1 7 . 1 1 157 157 ALA C C 157 179.076 179.076 179.875 -0.799 18493 3518 1 7 . 1 1 157 157 ALA CA C 157 54.803 54.803 55.837 -1.034 18493 3519 1 7 . 1 1 157 157 ALA CB C 157 16.120 16.120 18.481 -2.361 18493 3520 1 7 . 1 1 158 158 VAL N N 158 116.045 116.045 119.745 -3.700 18493 3521 1 7 . 1 1 158 158 VAL C C 158 177.491 177.491 178.455 -0.964 18493 3522 1 7 . 1 1 158 158 VAL CA C 158 67.160 67.160 66.625 0.535 18493 3523 1 7 . 1 1 158 158 VAL CB C 158 31.331 31.331 31.450 -0.119 18493 3524 1 7 . 1 1 159 159 LEU N N 159 116.776 116.776 120.583 -3.807 18493 3525 1 7 . 1 1 159 159 LEU C C 159 178.312 178.312 178.964 -0.652 18493 3526 1 7 . 1 1 159 159 LEU CA C 159 57.443 57.443 58.132 -0.689 18493 3527 1 7 . 1 1 159 159 LEU CB C 159 41.567 41.567 41.059 0.508 18493 3528 1 7 . 1 1 160 160 VAL N N 160 118.890 118.890 115.099 3.791 18493 3529 1 7 . 1 1 160 160 VAL C C 160 177.508 177.508 177.445 0.063 18493 3530 1 7 . 1 1 160 160 VAL CA C 160 67.366 67.366 65.313 2.053 18493 3531 1 7 . 1 1 160 160 VAL CB C 160 31.106 31.106 31.968 -0.862 18493 3532 1 7 . 1 1 161 161 VAL N N 161 118.360 118.360 120.160 -1.800 18493 3533 1 7 . 1 1 161 161 VAL C C 161 176.607 176.607 177.026 -0.419 18493 3534 1 7 . 1 1 161 161 VAL CA C 161 67.614 67.614 64.547 3.067 18493 3535 1 7 . 1 1 161 161 VAL CB C 161 31.646 31.646 32.462 -0.816 18493 3536 1 8 . 1 1 11 11 GLY N N 11 108.456 108.456 107.892 0.564 18493 3537 1 8 . 1 1 11 11 GLY H H 11 8.433 8.433 6.919 1.514 18493 3538 1 8 . 1 1 12 12 ARG C C 12 178.053 178.053 178.553 -0.500 18493 3539 1 8 . 1 1 12 12 ARG CA C 12 57.504 57.504 60.273 -2.769 18493 3540 1 8 . 1 1 12 12 ARG CB C 12 30.522 30.522 30.239 0.283 18493 3541 1 8 . 1 1 13 13 GLY N N 13 108.265 108.265 106.097 2.168 18493 3542 1 8 . 1 1 13 13 GLY C C 13 175.091 175.091 175.947 -0.856 18493 3543 1 8 . 1 1 13 13 GLY CA C 13 45.326 45.326 46.584 -1.258 18493 3544 1 8 . 1 1 14 14 ALA N N 14 123.181 123.181 124.915 -1.734 18493 3545 1 8 . 1 1 14 14 ALA C C 14 179.173 179.173 179.429 -0.256 18493 3546 1 8 . 1 1 14 14 ALA CA C 14 55.061 55.061 54.209 0.852 18493 3547 1 8 . 1 1 14 14 ALA H H 14 9.285 9.285 7.019 2.266 18493 3548 1 8 . 1 1 15 15 TRP N N 15 116.733 116.733 117.796 -1.063 18493 3549 1 8 . 1 1 15 15 TRP C C 15 179.425 179.425 178.471 0.954 18493 3550 1 8 . 1 1 15 15 TRP CA C 15 58.960 58.960 58.108 0.851 18493 3551 1 8 . 1 1 15 15 TRP CB C 15 29.529 29.529 29.420 0.109 18493 3552 1 8 . 1 1 15 15 TRP H H 15 7.091 7.091 7.186 -0.095 18493 3553 1 8 . 1 1 16 16 LEU N N 16 118.671 118.671 121.352 -2.681 18493 3554 1 8 . 1 1 16 16 LEU C C 16 178.461 178.461 178.732 -0.271 18493 3555 1 8 . 1 1 16 16 LEU CA C 16 58.246 58.246 58.600 -0.354 18493 3556 1 8 . 1 1 16 16 LEU CB C 16 41.369 41.369 41.572 -0.203 18493 3557 1 8 . 1 1 16 16 LEU H H 16 9.180 9.180 8.640 0.540 18493 3558 1 8 . 1 1 17 17 LEU N N 17 118.515 118.515 119.999 -1.484 18493 3559 1 8 . 1 1 17 17 LEU C C 17 178.787 178.787 178.436 0.351 18493 3560 1 8 . 1 1 17 17 LEU CA C 17 57.832 57.832 58.732 -0.900 18493 3561 1 8 . 1 1 17 17 LEU CB C 17 41.395 41.395 41.675 -0.280 18493 3562 1 8 . 1 1 18 18 MET N N 18 120.633 120.633 118.083 2.550 18493 3563 1 8 . 1 1 18 18 MET C C 18 180.469 180.469 179.145 1.324 18493 3564 1 8 . 1 1 18 18 MET CA C 18 60.277 60.277 56.608 3.669 18493 3565 1 8 . 1 1 18 18 MET CB C 18 31.789 31.789 30.362 1.427 18493 3566 1 8 . 1 1 19 19 ALA N N 19 123.958 123.958 122.861 1.097 18493 3567 1 8 . 1 1 19 19 ALA C C 19 178.210 178.210 179.311 -1.101 18493 3568 1 8 . 1 1 19 19 ALA CA C 19 55.468 55.468 55.098 0.370 18493 3569 1 8 . 1 1 19 19 ALA CB C 19 17.865 17.865 18.433 -0.568 18493 3570 1 8 . 1 1 19 19 ALA H H 19 9.398 9.398 8.149 1.249 18493 3571 1 8 . 1 1 20 20 PHE N N 20 118.424 118.424 118.947 -0.523 18493 3572 1 8 . 1 1 20 20 PHE C C 20 176.674 176.674 177.220 -0.546 18493 3573 1 8 . 1 1 20 20 PHE CA C 20 62.546 62.546 61.118 1.427 18493 3574 1 8 . 1 1 20 20 PHE CB C 20 38.697 38.697 39.097 -0.400 18493 3575 1 8 . 1 1 21 21 THR N N 21 109.220 109.220 114.995 -5.775 18493 3576 1 8 . 1 1 21 21 THR C C 21 174.203 174.203 176.716 -2.513 18493 3577 1 8 . 1 1 21 21 THR CA C 21 66.052 66.052 66.471 -0.419 18493 3578 1 8 . 1 1 21 21 THR CB C 21 68.956 68.956 68.268 0.688 18493 3579 1 8 . 1 1 22 22 ALA N N 22 123.662 123.662 125.315 -1.653 18493 3580 1 8 . 1 1 22 22 ALA C C 22 179.488 179.488 180.236 -0.748 18493 3581 1 8 . 1 1 22 22 ALA CA C 22 54.847 54.847 54.609 0.237 18493 3582 1 8 . 1 1 22 22 ALA CB C 22 17.801 17.801 18.329 -0.528 18493 3583 1 8 . 1 1 23 23 LEU N N 23 118.917 118.917 118.802 0.115 18493 3584 1 8 . 1 1 23 23 LEU C C 23 178.028 178.028 178.661 -0.633 18493 3585 1 8 . 1 1 23 23 LEU CA C 23 57.713 57.713 57.029 0.685 18493 3586 1 8 . 1 1 23 23 LEU CB C 23 41.506 41.506 42.047 -0.541 18493 3587 1 8 . 1 1 23 23 LEU H H 23 8.581 8.581 7.595 0.986 18493 3588 1 8 . 1 1 24 24 ALA N N 24 119.931 119.931 122.631 -2.700 18493 3589 1 8 . 1 1 24 24 ALA C C 24 180.617 180.617 179.331 1.286 18493 3590 1 8 . 1 1 24 24 ALA CA C 24 55.350 55.350 54.843 0.507 18493 3591 1 8 . 1 1 24 24 ALA CB C 24 17.583 17.583 18.057 -0.474 18493 3592 1 8 . 1 1 25 25 LEU N N 25 119.691 119.691 117.559 2.132 18493 3593 1 8 . 1 1 25 25 LEU CA C 25 58.078 58.078 57.820 0.258 18493 3594 1 8 . 1 1 25 25 LEU CB C 25 43.597 43.597 41.464 2.133 18493 3595 1 8 . 1 1 25 25 LEU H H 25 9.179 9.179 8.714 0.465 18493 3596 1 8 . 1 1 26 26 GLU N N 26 119.651 119.651 116.373 3.278 18493 3597 1 8 . 1 1 26 26 GLU C C 26 179.334 179.334 178.940 0.394 18493 3598 1 8 . 1 1 26 26 GLU CA C 26 59.584 59.584 57.227 2.357 18493 3599 1 8 . 1 1 26 26 GLU CB C 26 27.202 27.202 29.672 -2.470 18493 3600 1 8 . 1 1 27 27 LEU N N 27 119.661 119.661 121.023 -1.362 18493 3601 1 8 . 1 1 27 27 LEU CA C 27 57.887 57.887 57.664 0.223 18493 3602 1 8 . 1 1 27 27 LEU CB C 27 41.591 41.591 41.984 -0.393 18493 3603 1 8 . 1 1 27 27 LEU H H 27 9.410 9.410 7.474 1.936 18493 3604 1 8 . 1 1 28 28 THR N N 28 118.484 118.484 113.697 4.787 18493 3605 1 8 . 1 1 28 28 THR C C 28 175.898 175.898 176.159 -0.261 18493 3606 1 8 . 1 1 28 28 THR CA C 28 67.459 67.459 65.796 1.663 18493 3607 1 8 . 1 1 28 28 THR CB C 28 67.948 67.948 67.877 0.071 18493 3608 1 8 . 1 1 29 29 ALA N N 29 122.643 122.643 124.245 -1.602 18493 3609 1 8 . 1 1 29 29 ALA C C 29 179.717 179.717 179.436 0.281 18493 3610 1 8 . 1 1 29 29 ALA CA C 29 55.919 55.919 55.096 0.823 18493 3611 1 8 . 1 1 29 29 ALA CB C 29 16.837 16.837 18.327 -1.490 18493 3612 1 8 . 1 1 29 29 ALA H H 29 8.302 8.302 7.858 0.444 18493 3613 1 8 . 1 1 30 30 LEU N N 30 117.408 117.408 117.347 0.061 18493 3614 1 8 . 1 1 30 30 LEU C C 30 178.143 178.143 177.284 0.859 18493 3615 1 8 . 1 1 30 30 LEU CA C 30 57.384 57.384 57.038 0.346 18493 3616 1 8 . 1 1 30 30 LEU CB C 30 41.679 41.679 41.784 -0.105 18493 3617 1 8 . 1 1 30 30 LEU H H 30 8.412 8.412 7.905 0.507 18493 3618 1 8 . 1 1 31 31 TRP N N 31 125.692 125.692 120.091 5.601 18493 3619 1 8 . 1 1 31 31 TRP C C 31 179.053 179.053 177.972 1.081 18493 3620 1 8 . 1 1 31 31 TRP CA C 31 59.005 59.005 59.448 -0.443 18493 3621 1 8 . 1 1 31 31 TRP CB C 31 28.142 28.142 29.229 -1.087 18493 3622 1 8 . 1 1 31 31 TRP H H 31 9.157 9.157 7.426 1.731 18493 3623 1 8 . 1 1 32 32 PHE N N 32 119.195 119.195 120.706 -1.511 18493 3624 1 8 . 1 1 32 32 PHE CA C 32 61.557 61.557 60.711 0.846 18493 3625 1 8 . 1 1 32 32 PHE CB C 32 38.384 38.384 38.169 0.215 18493 3626 1 8 . 1 1 32 32 PHE H H 32 9.374 9.374 7.134 2.240 18493 3627 1 8 . 1 1 33 33 GLN C C 33 177.477 177.477 177.105 0.372 18493 3628 1 8 . 1 1 33 33 GLN CA C 33 56.613 56.613 58.369 -1.756 18493 3629 1 8 . 1 1 33 33 GLN CB C 33 29.433 29.433 27.574 1.859 18493 3630 1 8 . 1 1 34 34 HIS N N 34 115.948 115.948 116.591 -0.643 18493 3631 1 8 . 1 1 34 34 HIS C C 34 175.548 175.548 177.885 -2.337 18493 3632 1 8 . 1 1 34 34 HIS CA C 34 58.733 58.733 58.310 0.423 18493 3633 1 8 . 1 1 34 34 HIS CB C 34 32.084 32.084 30.305 1.779 18493 3634 1 8 . 1 1 34 34 HIS H H 34 9.621 9.621 7.297 2.324 18493 3635 1 8 . 1 1 35 35 VAL N N 35 116.902 116.902 116.744 0.158 18493 3636 1 8 . 1 1 35 35 VAL C C 35 177.853 177.853 177.228 0.625 18493 3637 1 8 . 1 1 35 35 VAL CA C 35 64.075 64.075 65.235 -1.160 18493 3638 1 8 . 1 1 35 35 VAL CB C 35 30.626 30.626 30.976 -0.350 18493 3639 1 8 . 1 1 36 36 MET N N 36 114.145 114.145 117.196 -3.051 18493 3640 1 8 . 1 1 36 36 MET C C 36 175.905 175.905 176.487 -0.582 18493 3641 1 8 . 1 1 36 36 MET H H 36 7.605 7.605 6.698 0.907 18493 3642 1 8 . 1 1 37 37 LEU N N 37 111.740 111.740 121.038 -9.298 18493 3643 1 8 . 1 1 37 37 LEU H H 37 7.121 7.121 7.503 -0.382 18493 3644 1 8 . 1 1 38 38 LEU C C 38 176.457 176.457 176.104 0.353 18493 3645 1 8 . 1 1 39 39 LYS N N 39 121.418 121.418 121.474 -0.056 18493 3646 1 8 . 1 1 39 39 LYS CA C 39 57.471 57.471 54.013 3.458 18493 3647 1 8 . 1 1 39 39 LYS H H 39 9.359 9.359 8.450 0.909 18493 3648 1 8 . 1 1 40 40 PRO CA C 40 60.451 60.451 62.824 -2.373 18493 3649 1 8 . 1 1 42 42 VAL N N 42 118.166 118.166 118.520 -0.354 18493 3650 1 8 . 1 1 42 42 VAL C C 42 179.261 179.261 176.578 2.683 18493 3651 1 8 . 1 1 42 42 VAL CA C 42 67.223 67.223 63.030 4.193 18493 3652 1 8 . 1 1 42 42 VAL CB C 42 30.941 30.941 31.787 -0.846 18493 3653 1 8 . 1 1 43 43 LEU N N 43 115.946 115.946 122.685 -6.739 18493 3654 1 8 . 1 1 43 43 LEU C C 43 178.293 178.293 178.275 0.018 18493 3655 1 8 . 1 1 43 43 LEU CA C 43 57.129 57.129 57.337 -0.208 18493 3656 1 8 . 1 1 43 43 LEU CB C 43 41.030 41.030 41.995 -0.965 18493 3657 1 8 . 1 1 44 44 CYS N N 44 115.006 115.006 117.050 -2.044 18493 3658 1 8 . 1 1 44 44 CYS C C 44 177.484 177.484 176.176 1.308 18493 3659 1 8 . 1 1 44 44 CYS CA C 44 59.760 59.760 60.977 -1.217 18493 3660 1 8 . 1 1 44 44 CYS CB C 44 30.651 30.651 26.362 4.289 18493 3661 1 8 . 1 1 44 44 CYS H H 44 7.683 7.683 8.231 -0.548 18493 3662 1 8 . 1 1 45 45 ILE N N 45 119.384 119.384 121.846 -2.462 18493 3663 1 8 . 1 1 45 45 ILE C C 45 179.575 179.575 176.727 2.848 18493 3664 1 8 . 1 1 45 45 ILE CA C 45 62.068 62.068 64.359 -2.291 18493 3665 1 8 . 1 1 45 45 ILE CB C 45 33.583 33.583 37.378 -3.795 18493 3666 1 8 . 1 1 46 46 TYR N N 46 120.126 120.126 119.541 0.585 18493 3667 1 8 . 1 1 46 46 TYR C C 46 178.397 178.397 177.945 0.452 18493 3668 1 8 . 1 1 46 46 TYR CA C 46 59.129 59.129 61.584 -2.455 18493 3669 1 8 . 1 1 46 46 TYR CB C 46 35.347 35.347 38.125 -2.778 18493 3670 1 8 . 1 1 46 46 TYR H H 46 8.958 8.958 7.951 1.007 18493 3671 1 8 . 1 1 47 47 GLU N N 47 121.779 121.779 117.179 4.600 18493 3672 1 8 . 1 1 47 47 GLU C C 47 179.907 179.907 178.725 1.182 18493 3673 1 8 . 1 1 47 47 GLU CA C 47 57.985 57.985 58.987 -1.002 18493 3674 1 8 . 1 1 47 47 GLU CB C 47 27.290 27.290 28.941 -1.651 18493 3675 1 8 . 1 1 47 47 GLU H H 47 9.681 9.681 8.151 1.530 18493 3676 1 8 . 1 1 48 48 ARG N N 48 119.188 119.188 120.063 -0.875 18493 3677 1 8 . 1 1 48 48 ARG C C 48 181.638 181.638 178.682 2.956 18493 3678 1 8 . 1 1 48 48 ARG CA C 48 60.299 60.299 59.483 0.816 18493 3679 1 8 . 1 1 48 48 ARG CB C 48 30.167 30.167 30.032 0.135 18493 3680 1 8 . 1 1 48 48 ARG H H 48 9.213 9.213 7.605 1.608 18493 3681 1 8 . 1 1 49 49 VAL N N 49 121.326 121.326 119.255 2.071 18493 3682 1 8 . 1 1 49 49 VAL C C 49 177.326 177.326 177.798 -0.472 18493 3683 1 8 . 1 1 49 49 VAL CA C 49 66.624 66.624 66.258 0.366 18493 3684 1 8 . 1 1 49 49 VAL CB C 49 31.280 31.280 31.217 0.063 18493 3685 1 8 . 1 1 50 50 ALA N N 50 122.955 122.955 122.637 0.318 18493 3686 1 8 . 1 1 50 50 ALA C C 50 179.594 179.594 180.097 -0.503 18493 3687 1 8 . 1 1 50 50 ALA CA C 50 55.902 55.902 55.370 0.532 18493 3688 1 8 . 1 1 50 50 ALA CB C 50 16.623 16.623 18.005 -1.382 18493 3689 1 8 . 1 1 51 51 LEU N N 51 115.737 115.737 119.456 -3.719 18493 3690 1 8 . 1 1 51 51 LEU C C 51 177.990 177.990 178.833 -0.843 18493 3691 1 8 . 1 1 51 51 LEU CA C 51 57.285 57.285 57.989 -0.704 18493 3692 1 8 . 1 1 51 51 LEU CB C 51 41.369 41.369 41.138 0.231 18493 3693 1 8 . 1 1 52 52 PHE N N 52 122.707 122.707 118.424 4.283 18493 3694 1 8 . 1 1 52 52 PHE C C 52 179.142 179.142 178.032 1.110 18493 3695 1 8 . 1 1 52 52 PHE CA C 52 62.518 62.518 62.055 0.463 18493 3696 1 8 . 1 1 52 52 PHE CB C 52 38.538 38.538 38.645 -0.107 18493 3697 1 8 . 1 1 52 52 PHE H H 52 8.863 8.863 8.122 0.741 18493 3698 1 8 . 1 1 53 53 GLY N N 53 110.801 110.801 108.204 2.597 18493 3699 1 8 . 1 1 53 53 GLY C C 53 175.378 175.378 175.787 -0.409 18493 3700 1 8 . 1 1 53 53 GLY CA C 53 48.024 48.024 47.443 0.581 18493 3701 1 8 . 1 1 53 53 GLY H H 53 9.027 9.027 8.134 0.893 18493 3702 1 8 . 1 1 54 54 VAL N N 54 121.926 121.926 121.124 0.802 18493 3703 1 8 . 1 1 54 54 VAL C C 54 177.035 177.035 177.820 -0.785 18493 3704 1 8 . 1 1 54 54 VAL CA C 54 67.448 67.448 65.562 1.886 18493 3705 1 8 . 1 1 54 54 VAL CB C 54 31.246 31.246 31.936 -0.690 18493 3706 1 8 . 1 1 54 54 VAL H H 54 7.948 7.948 7.793 0.155 18493 3707 1 8 . 1 1 55 55 LEU N N 55 119.894 119.894 121.878 -1.984 18493 3708 1 8 . 1 1 55 55 LEU C C 55 178.175 178.175 178.789 -0.614 18493 3709 1 8 . 1 1 55 55 LEU CA C 55 58.490 58.490 57.688 0.803 18493 3710 1 8 . 1 1 55 55 LEU CB C 55 42.145 42.145 41.477 0.668 18493 3711 1 8 . 1 1 55 55 LEU H H 55 8.646 8.646 8.873 -0.227 18493 3712 1 8 . 1 1 56 56 GLY N N 56 106.262 106.262 106.853 -0.591 18493 3713 1 8 . 1 1 56 56 GLY C C 56 174.618 174.618 175.632 -1.014 18493 3714 1 8 . 1 1 56 56 GLY CA C 56 47.533 47.533 47.525 0.008 18493 3715 1 8 . 1 1 57 57 ALA N N 57 123.002 123.002 124.555 -1.553 18493 3716 1 8 . 1 1 57 57 ALA C C 57 178.688 178.688 179.516 -0.828 18493 3717 1 8 . 1 1 57 57 ALA CA C 57 55.548 55.548 54.825 0.723 18493 3718 1 8 . 1 1 57 57 ALA CB C 57 18.065 18.065 18.623 -0.558 18493 3719 1 8 . 1 1 58 58 ALA N N 58 118.866 118.866 121.333 -2.467 18493 3720 1 8 . 1 1 58 58 ALA C C 58 179.348 179.348 178.983 0.365 18493 3721 1 8 . 1 1 58 58 ALA CA C 58 54.763 54.763 54.531 0.232 18493 3722 1 8 . 1 1 58 58 ALA CB C 58 17.898 17.898 18.205 -0.307 18493 3723 1 8 . 1 1 58 58 ALA H H 58 8.674 8.674 8.276 0.398 18493 3724 1 8 . 1 1 59 59 LEU N N 59 115.384 115.384 118.858 -3.474 18493 3725 1 8 . 1 1 59 59 LEU C C 59 177.654 177.654 178.362 -0.708 18493 3726 1 8 . 1 1 59 59 LEU CA C 59 57.387 57.387 57.835 -0.448 18493 3727 1 8 . 1 1 59 59 LEU CB C 59 41.209 41.209 42.962 -1.753 18493 3728 1 8 . 1 1 60 60 ILE N N 60 116.140 116.140 117.069 -0.929 18493 3729 1 8 . 1 1 60 60 ILE C C 60 180.024 180.024 177.412 2.612 18493 3730 1 8 . 1 1 60 60 ILE CA C 60 64.263 64.263 63.987 0.276 18493 3731 1 8 . 1 1 60 60 ILE CB C 60 37.240 37.240 37.640 -0.400 18493 3732 1 8 . 1 1 61 61 GLY N N 61 110.127 110.127 105.600 4.527 18493 3733 1 8 . 1 1 61 61 GLY C C 61 173.716 173.716 173.399 0.317 18493 3734 1 8 . 1 1 61 61 GLY CA C 61 45.617 45.617 44.843 0.774 18493 3735 1 8 . 1 1 61 61 GLY H H 61 9.046 9.046 8.021 1.025 18493 3736 1 8 . 1 1 62 62 ALA N N 62 118.949 118.949 123.159 -4.210 18493 3737 1 8 . 1 1 62 62 ALA C C 62 176.192 176.192 177.843 -1.651 18493 3738 1 8 . 1 1 62 62 ALA CA C 62 53.268 53.268 52.304 0.964 18493 3739 1 8 . 1 1 62 62 ALA CB C 62 19.138 19.138 20.070 -0.932 18493 3740 1 8 . 1 1 62 62 ALA H H 62 8.066 8.066 7.274 0.792 18493 3741 1 8 . 1 1 63 63 ILE N N 63 116.800 116.800 120.125 -3.325 18493 3742 1 8 . 1 1 63 63 ILE CA C 63 66.739 66.739 64.700 2.039 18493 3743 1 8 . 1 1 63 63 ILE CB C 63 37.947 37.947 38.415 -0.468 18493 3744 1 8 . 1 1 64 64 ALA N N 64 123.957 123.957 120.994 2.963 18493 3745 1 8 . 1 1 64 64 ALA CA C 64 52.934 52.934 54.097 -1.163 18493 3746 1 8 . 1 1 64 64 ALA CB C 64 19.428 19.428 16.700 2.728 18493 3747 1 8 . 1 1 65 65 PRO CA C 65 65.350 65.350 63.167 2.183 18493 3748 1 8 . 1 1 66 66 LYS N N 66 116.618 116.618 114.250 2.368 18493 3749 1 8 . 1 1 66 66 LYS C C 66 177.500 177.500 175.197 2.303 18493 3750 1 8 . 1 1 66 66 LYS CA C 66 56.547 56.547 57.788 -1.241 18493 3751 1 8 . 1 1 66 66 LYS CB C 66 30.522 30.522 33.543 -3.021 18493 3752 1 8 . 1 1 67 67 THR CA C 67 60.452 60.452 62.175 -1.723 18493 3753 1 8 . 1 1 67 67 THR CB C 67 69.948 69.948 68.473 1.475 18493 3754 1 8 . 1 1 68 68 PRO C C 68 177.070 177.070 177.068 0.002 18493 3755 1 8 . 1 1 68 68 PRO CA C 68 63.315 63.315 62.088 1.227 18493 3756 1 8 . 1 1 68 68 PRO CB C 68 32.458 32.458 32.125 0.333 18493 3757 1 8 . 1 1 69 69 LEU N N 69 121.517 121.517 117.261 4.256 18493 3758 1 8 . 1 1 69 69 LEU C C 69 179.448 179.448 176.937 2.511 18493 3759 1 8 . 1 1 69 69 LEU CA C 69 57.389 57.389 56.267 1.122 18493 3760 1 8 . 1 1 69 69 LEU CB C 69 42.737 42.737 40.702 2.035 18493 3761 1 8 . 1 1 69 69 LEU H H 69 8.882 8.882 8.126 0.756 18493 3762 1 8 . 1 1 70 70 ARG N N 70 114.028 114.028 115.676 -1.648 18493 3763 1 8 . 1 1 70 70 ARG C C 70 177.925 177.925 177.595 0.330 18493 3764 1 8 . 1 1 70 70 ARG CA C 70 58.429 58.429 56.768 1.661 18493 3765 1 8 . 1 1 70 70 ARG CB C 70 29.391 29.391 29.356 0.035 18493 3766 1 8 . 1 1 70 70 ARG H H 70 8.202 8.202 7.721 0.481 18493 3767 1 8 . 1 1 71 71 TYR N N 71 121.740 121.740 117.325 4.415 18493 3768 1 8 . 1 1 71 71 TYR CA C 71 57.374 57.374 54.735 2.639 18493 3769 1 8 . 1 1 71 71 TYR H H 71 8.136 8.136 7.691 0.445 18493 3770 1 8 . 1 1 72 72 VAL N N 72 118.416 118.416 123.248 -4.832 18493 3771 1 8 . 1 1 72 72 VAL C C 72 177.702 177.702 176.997 0.705 18493 3772 1 8 . 1 1 72 72 VAL CA C 72 66.098 66.098 65.148 0.950 18493 3773 1 8 . 1 1 72 72 VAL CB C 72 31.343 31.343 31.569 -0.226 18493 3774 1 8 . 1 1 73 73 ALA N N 73 120.283 120.283 121.265 -0.982 18493 3775 1 8 . 1 1 73 73 ALA C C 73 179.763 179.763 179.345 0.418 18493 3776 1 8 . 1 1 73 73 ALA CA C 73 55.785 55.785 54.940 0.846 18493 3777 1 8 . 1 1 73 73 ALA CB C 73 19.265 19.265 18.026 1.240 18493 3778 1 8 . 1 1 73 73 ALA H H 73 9.015 9.015 7.696 1.319 18493 3779 1 8 . 1 1 74 74 MET N N 74 115.547 115.547 116.886 -1.339 18493 3780 1 8 . 1 1 74 74 MET C C 74 177.223 177.223 178.202 -0.979 18493 3781 1 8 . 1 1 74 74 MET CA C 74 61.023 61.023 58.613 2.410 18493 3782 1 8 . 1 1 74 74 MET CB C 74 33.777 33.777 31.723 2.054 18493 3783 1 8 . 1 1 74 74 MET H H 74 8.163 8.163 8.299 -0.136 18493 3784 1 8 . 1 1 75 75 VAL N N 75 118.690 118.690 120.254 -1.564 18493 3785 1 8 . 1 1 75 75 VAL C C 75 177.166 177.166 177.648 -0.482 18493 3786 1 8 . 1 1 75 75 VAL CA C 75 67.581 67.581 65.739 1.842 18493 3787 1 8 . 1 1 75 75 VAL CB C 75 31.408 31.408 31.433 -0.025 18493 3788 1 8 . 1 1 75 75 VAL H H 75 7.554 7.554 7.815 -0.261 18493 3789 1 8 . 1 1 76 76 ILE N N 76 118.959 118.959 120.370 -1.411 18493 3790 1 8 . 1 1 76 76 ILE C C 76 178.680 178.680 177.288 1.392 18493 3791 1 8 . 1 1 76 76 ILE CA C 76 65.839 65.839 64.589 1.250 18493 3792 1 8 . 1 1 76 76 ILE CB C 76 38.414 38.414 37.854 0.560 18493 3793 1 8 . 1 1 77 77 TRP N N 77 125.440 125.440 120.672 4.768 18493 3794 1 8 . 1 1 77 77 TRP C C 77 177.153 177.153 177.488 -0.335 18493 3795 1 8 . 1 1 77 77 TRP CA C 77 58.779 58.779 59.618 -0.839 18493 3796 1 8 . 1 1 77 77 TRP CB C 77 30.494 30.494 29.966 0.528 18493 3797 1 8 . 1 1 77 77 TRP H H 77 9.515 9.515 8.595 0.920 18493 3798 1 8 . 1 1 78 78 LEU N N 78 118.968 118.968 121.215 -2.247 18493 3799 1 8 . 1 1 78 78 LEU C C 78 178.381 178.381 177.986 0.395 18493 3800 1 8 . 1 1 78 78 LEU CA C 78 58.041 58.041 57.153 0.888 18493 3801 1 8 . 1 1 78 78 LEU CB C 78 43.807 43.807 41.961 1.846 18493 3802 1 8 . 1 1 78 78 LEU H H 78 9.367 9.367 7.865 1.502 18493 3803 1 8 . 1 1 79 79 TYR N N 79 118.181 118.181 120.464 -2.283 18493 3804 1 8 . 1 1 79 79 TYR C C 79 176.777 176.777 177.599 -0.822 18493 3805 1 8 . 1 1 79 79 TYR CA C 79 62.849 62.849 62.359 0.490 18493 3806 1 8 . 1 1 80 80 SER N N 80 114.286 114.286 114.556 -0.270 18493 3807 1 8 . 1 1 80 80 SER C C 80 175.943 175.943 176.767 -0.824 18493 3808 1 8 . 1 1 80 80 SER CA C 80 63.515 63.515 61.863 1.652 18493 3809 1 8 . 1 1 80 80 SER CB C 80 63.941 63.941 62.342 1.599 18493 3810 1 8 . 1 1 81 81 ALA N N 81 121.070 121.070 124.273 -3.203 18493 3811 1 8 . 1 1 81 81 ALA C C 81 178.208 178.208 179.133 -0.925 18493 3812 1 8 . 1 1 81 81 ALA CA C 81 55.224 55.224 54.493 0.731 18493 3813 1 8 . 1 1 81 81 ALA CB C 81 17.897 17.897 18.277 -0.380 18493 3814 1 8 . 1 1 82 82 PHE N N 82 117.560 117.560 120.317 -2.757 18493 3815 1 8 . 1 1 82 82 PHE C C 82 176.975 176.975 177.099 -0.124 18493 3816 1 8 . 1 1 82 82 PHE CA C 82 62.132 62.132 60.664 1.468 18493 3817 1 8 . 1 1 82 82 PHE CB C 82 38.497 38.497 39.039 -0.542 18493 3818 1 8 . 1 1 83 83 ARG N N 83 117.110 117.110 118.903 -1.793 18493 3819 1 8 . 1 1 83 83 ARG C C 83 178.637 178.637 178.393 0.244 18493 3820 1 8 . 1 1 83 83 ARG CA C 83 60.291 60.291 58.336 1.955 18493 3821 1 8 . 1 1 83 83 ARG CB C 83 28.625 28.625 29.228 -0.603 18493 3822 1 8 . 1 1 84 84 GLY N N 84 105.915 105.915 107.210 -1.295 18493 3823 1 8 . 1 1 84 84 GLY C C 84 177.091 177.091 175.761 1.330 18493 3824 1 8 . 1 1 84 84 GLY CA C 84 46.128 46.128 46.607 -0.479 18493 3825 1 8 . 1 1 85 85 VAL N N 85 124.985 124.985 122.809 2.176 18493 3826 1 8 . 1 1 85 85 VAL C C 85 176.387 176.387 178.396 -2.009 18493 3827 1 8 . 1 1 85 85 VAL CA C 85 66.960 66.960 65.228 1.732 18493 3828 1 8 . 1 1 85 85 VAL CB C 85 31.066 31.066 31.243 -0.177 18493 3829 1 8 . 1 1 86 86 GLN N N 86 116.522 116.522 119.081 -2.559 18493 3830 1 8 . 1 1 86 86 GLN C C 86 179.586 179.586 178.645 0.941 18493 3831 1 8 . 1 1 86 86 GLN CA C 86 59.505 59.505 58.913 0.592 18493 3832 1 8 . 1 1 86 86 GLN CB C 86 28.762 28.762 28.132 0.630 18493 3833 1 8 . 1 1 87 87 LEU N N 87 121.211 121.211 118.248 2.963 18493 3834 1 8 . 1 1 87 87 LEU C C 87 178.396 178.396 179.610 -1.214 18493 3835 1 8 . 1 1 87 87 LEU CA C 87 57.847 57.847 57.139 0.708 18493 3836 1 8 . 1 1 87 87 LEU CB C 87 41.924 41.924 41.167 0.757 18493 3837 1 8 . 1 1 87 87 LEU H H 87 8.955 8.955 7.752 1.203 18493 3838 1 8 . 1 1 88 88 THR N N 88 108.251 108.251 113.080 -4.829 18493 3839 1 8 . 1 1 88 88 THR C C 88 180.013 180.013 176.801 3.212 18493 3840 1 8 . 1 1 88 88 THR CA C 88 65.112 65.112 65.759 -0.647 18493 3841 1 8 . 1 1 88 88 THR CB C 88 68.805 68.805 69.116 -0.311 18493 3842 1 8 . 1 1 88 88 THR H H 88 8.764 8.764 8.209 0.555 18493 3843 1 8 . 1 1 89 89 TYR N N 89 127.947 127.947 124.040 3.907 18493 3844 1 8 . 1 1 89 89 TYR C C 89 177.244 177.244 177.087 0.157 18493 3845 1 8 . 1 1 89 89 TYR H H 89 9.868 9.868 8.563 1.305 18493 3846 1 8 . 1 1 90 90 GLU N N 90 121.163 121.163 118.129 3.034 18493 3847 1 8 . 1 1 90 90 GLU C C 90 178.671 178.671 178.503 0.168 18493 3848 1 8 . 1 1 90 90 GLU H H 90 8.515 8.515 8.145 0.370 18493 3849 1 8 . 1 1 91 91 HIS N N 91 120.459 120.459 119.708 0.751 18493 3850 1 8 . 1 1 91 91 HIS C C 91 177.605 177.605 177.623 -0.018 18493 3851 1 8 . 1 1 91 91 HIS CA C 91 57.085 57.085 59.490 -2.405 18493 3852 1 8 . 1 1 91 91 HIS CB C 91 34.128 34.128 29.910 4.218 18493 3853 1 8 . 1 1 91 91 HIS H H 91 9.102 9.102 7.876 1.226 18493 3854 1 8 . 1 1 92 92 THR N N 92 115.463 115.463 116.111 -0.648 18493 3855 1 8 . 1 1 92 92 THR C C 92 176.189 176.189 176.419 -0.230 18493 3856 1 8 . 1 1 92 92 THR CA C 92 67.058 67.058 66.428 0.630 18493 3857 1 8 . 1 1 92 92 THR CB C 92 68.564 68.564 68.756 -0.192 18493 3858 1 8 . 1 1 92 92 THR H H 92 9.550 9.550 8.139 1.411 18493 3859 1 8 . 1 1 93 93 MET N N 93 117.153 117.153 120.728 -3.575 18493 3860 1 8 . 1 1 93 93 MET C C 93 176.972 176.972 178.508 -1.536 18493 3861 1 8 . 1 1 93 93 MET CA C 93 62.369 62.369 57.054 5.315 18493 3862 1 8 . 1 1 93 93 MET CB C 93 33.515 33.515 31.507 2.008 18493 3863 1 8 . 1 1 94 94 LEU N N 94 117.981 117.981 118.800 -0.819 18493 3864 1 8 . 1 1 94 94 LEU CA C 94 57.489 57.489 58.252 -0.763 18493 3865 1 8 . 1 1 94 94 LEU CB C 94 41.432 41.432 41.121 0.311 18493 3866 1 8 . 1 1 94 94 LEU H H 94 8.497 8.497 8.737 -0.240 18493 3867 1 8 . 1 1 95 95 GLN C C 95 178.331 178.331 176.541 1.790 18493 3868 1 8 . 1 1 95 95 GLN CA C 95 57.604 57.604 57.618 -0.014 18493 3869 1 8 . 1 1 95 95 GLN CB C 95 28.200 28.200 28.408 -0.208 18493 3870 1 8 . 1 1 96 96 LEU N N 96 118.174 118.174 119.524 -1.350 18493 3871 1 8 . 1 1 96 96 LEU C C 96 177.842 177.842 174.864 2.978 18493 3872 1 8 . 1 1 96 96 LEU CA C 96 57.747 57.747 54.021 3.726 18493 3873 1 8 . 1 1 96 96 LEU CB C 96 41.721 41.721 41.624 0.097 18493 3874 1 8 . 1 1 97 97 TYR N N 97 117.359 117.359 117.575 -0.216 18493 3875 1 8 . 1 1 97 97 TYR CA C 97 57.581 57.581 56.210 1.371 18493 3876 1 8 . 1 1 97 97 TYR H H 97 8.485 8.485 8.551 -0.066 18493 3877 1 8 . 1 1 98 98 PRO CA C 98 63.847 63.847 62.567 1.280 18493 3878 1 8 . 1 1 99 99 SER CA C 99 58.145 58.145 57.178 0.967 18493 3879 1 8 . 1 1 99 99 SER CB C 99 64.506 64.506 63.892 0.614 18493 3880 1 8 . 1 1 101 101 PHE C C 101 174.992 174.992 175.015 -0.023 18493 3881 1 8 . 1 1 102 102 ALA N N 102 120.614 120.614 125.280 -4.666 18493 3882 1 8 . 1 1 102 102 ALA C C 102 176.810 176.810 177.545 -0.735 18493 3883 1 8 . 1 1 102 102 ALA CA C 102 54.355 54.355 53.483 0.872 18493 3884 1 8 . 1 1 102 102 ALA H H 102 7.383 7.383 8.527 -1.144 18493 3885 1 8 . 1 1 103 103 THR N N 103 112.507 112.507 110.046 2.461 18493 3886 1 8 . 1 1 103 103 THR C C 103 175.666 175.666 172.701 2.965 18493 3887 1 8 . 1 1 103 103 THR CA C 103 59.838 59.838 60.945 -1.107 18493 3888 1 8 . 1 1 103 103 THR CB C 103 67.623 67.623 69.549 -1.926 18493 3889 1 8 . 1 1 103 103 THR H H 103 9.278 9.278 7.194 2.084 18493 3890 1 8 . 1 1 104 104 CYS N N 104 122.754 122.754 120.079 2.675 18493 3891 1 8 . 1 1 104 104 CYS C C 104 174.474 174.474 175.340 -0.866 18493 3892 1 8 . 1 1 104 104 CYS CA C 104 64.988 64.988 58.258 6.730 18493 3893 1 8 . 1 1 104 104 CYS CB C 104 42.988 42.988 29.112 13.876 18493 3894 1 8 . 1 1 104 104 CYS H H 104 9.934 9.934 7.979 1.955 18493 3895 1 8 . 1 1 105 105 ASP N N 105 121.350 121.350 122.542 -1.192 18493 3896 1 8 . 1 1 105 105 ASP CB C 105 41.030 41.030 41.412 -0.382 18493 3897 1 8 . 1 1 105 105 ASP H H 105 8.153 8.153 9.054 -0.901 18493 3898 1 8 . 1 1 115 115 PRO CA C 115 61.148 61.148 63.205 -2.057 18493 3899 1 8 . 1 1 115 115 PRO CB C 115 30.280 30.280 32.303 -2.022 18493 3900 1 8 . 1 1 116 116 LEU C C 116 178.163 178.163 175.445 2.718 18493 3901 1 8 . 1 1 116 116 LEU CA C 116 58.746 58.746 54.860 3.886 18493 3902 1 8 . 1 1 116 116 LEU CB C 116 42.932 42.932 40.430 2.502 18493 3903 1 8 . 1 1 117 117 ASP N N 117 116.302 116.302 120.201 -3.899 18493 3904 1 8 . 1 1 117 117 ASP C C 117 177.528 177.528 175.999 1.529 18493 3905 1 8 . 1 1 117 117 ASP CB C 117 41.252 41.252 41.945 -0.693 18493 3906 1 8 . 1 1 118 118 LYS N N 118 118.983 118.983 124.988 -6.005 18493 3907 1 8 . 1 1 118 118 LYS H H 118 7.538 7.538 8.370 -0.832 18493 3908 1 8 . 1 1 119 119 TRP C C 119 177.867 177.867 175.892 1.975 18493 3909 1 8 . 1 1 120 120 VAL N N 120 113.149 113.149 112.726 0.423 18493 3910 1 8 . 1 1 120 120 VAL CA C 120 58.651 58.651 59.802 -1.151 18493 3911 1 8 . 1 1 120 120 VAL CB C 120 31.821 31.821 32.575 -0.754 18493 3912 1 8 . 1 1 120 120 VAL H H 120 8.936 8.936 7.581 1.355 18493 3913 1 8 . 1 1 121 121 PRO C C 121 178.888 178.888 177.519 1.369 18493 3914 1 8 . 1 1 121 121 PRO CA C 121 65.185 65.185 63.928 1.257 18493 3915 1 8 . 1 1 121 121 PRO CB C 121 31.781 31.781 32.056 -0.275 18493 3916 1 8 . 1 1 122 122 GLN N N 122 116.304 116.304 119.022 -2.718 18493 3917 1 8 . 1 1 122 122 GLN C C 122 174.326 174.326 176.735 -2.409 18493 3918 1 8 . 1 1 122 122 GLN CA C 122 58.463 58.463 58.577 -0.114 18493 3919 1 8 . 1 1 122 122 GLN H H 122 9.809 9.809 8.745 1.064 18493 3920 1 8 . 1 1 123 123 VAL N N 123 113.254 113.254 118.383 -5.129 18493 3921 1 8 . 1 1 123 123 VAL C C 123 175.777 175.777 176.622 -0.845 18493 3922 1 8 . 1 1 123 123 VAL CA C 123 61.689 61.689 63.837 -2.148 18493 3923 1 8 . 1 1 123 123 VAL CB C 123 35.373 35.373 32.018 3.355 18493 3924 1 8 . 1 1 123 123 VAL H H 123 8.219 8.219 7.687 0.532 18493 3925 1 8 . 1 1 124 124 PHE N N 124 112.242 112.242 119.327 -7.085 18493 3926 1 8 . 1 1 124 124 PHE C C 124 172.759 172.759 175.592 -2.833 18493 3927 1 8 . 1 1 124 124 PHE CB C 124 39.318 39.318 40.022 -0.704 18493 3928 1 8 . 1 1 125 125 VAL N N 125 115.233 115.233 117.780 -2.547 18493 3929 1 8 . 1 1 125 125 VAL C C 125 177.034 177.034 174.782 2.252 18493 3930 1 8 . 1 1 125 125 VAL CA C 125 61.950 61.950 62.141 -0.191 18493 3931 1 8 . 1 1 125 125 VAL CB C 125 33.376 33.376 32.344 1.032 18493 3932 1 8 . 1 1 125 125 VAL H H 125 7.799 7.799 7.916 -0.117 18493 3933 1 8 . 1 1 126 126 ALA N N 126 130.709 130.709 128.657 2.052 18493 3934 1 8 . 1 1 126 126 ALA C C 126 175.920 175.920 177.569 -1.649 18493 3935 1 8 . 1 1 126 126 ALA CA C 126 54.493 54.493 52.703 1.790 18493 3936 1 8 . 1 1 126 126 ALA CB C 126 17.215 17.215 19.402 -2.187 18493 3937 1 8 . 1 1 126 126 ALA H H 126 9.014 9.014 9.054 -0.040 18493 3938 1 8 . 1 1 127 127 SER N N 127 112.716 112.716 116.822 -4.106 18493 3939 1 8 . 1 1 127 127 SER CA C 127 58.101 58.101 58.716 -0.615 18493 3940 1 8 . 1 1 127 127 SER CB C 127 64.539 64.539 63.821 0.718 18493 3941 1 8 . 1 1 127 127 SER H H 127 8.145 8.145 8.320 -0.175 18493 3942 1 8 . 1 1 128 128 GLY N N 128 106.487 106.487 112.692 -6.205 18493 3943 1 8 . 1 1 128 128 GLY C C 128 177.047 177.047 172.877 4.170 18493 3944 1 8 . 1 1 128 128 GLY CA C 128 46.296 46.296 45.084 1.212 18493 3945 1 8 . 1 1 128 128 GLY H H 128 8.595 8.595 8.662 -0.067 18493 3946 1 8 . 1 1 129 129 ASP C C 129 177.916 177.916 174.702 3.214 18493 3947 1 8 . 1 1 129 129 ASP CB C 129 43.975 43.975 42.716 1.259 18493 3948 1 8 . 1 1 130 130 CYS N N 130 122.984 122.984 117.929 5.055 18493 3949 1 8 . 1 1 130 130 CYS C C 130 173.312 173.312 174.004 -0.692 18493 3950 1 8 . 1 1 130 130 CYS CA C 130 64.581 64.581 57.974 6.607 18493 3951 1 8 . 1 1 130 130 CYS CB C 130 42.879 42.879 29.008 13.871 18493 3952 1 8 . 1 1 130 130 CYS H H 130 9.948 9.948 9.004 0.944 18493 3953 1 8 . 1 1 131 131 ALA N N 131 121.534 121.534 124.202 -2.668 18493 3954 1 8 . 1 1 131 131 ALA CA C 131 52.640 52.640 52.966 -0.326 18493 3955 1 8 . 1 1 131 131 ALA CB C 131 18.497 18.497 18.617 -0.120 18493 3956 1 8 . 1 1 131 131 ALA H H 131 9.869 9.869 8.464 1.405 18493 3957 1 8 . 1 1 136 136 ASP C C 136 172.916 172.916 175.974 -3.058 18493 3958 1 8 . 1 1 137 137 PHE N N 137 117.677 117.677 116.394 1.283 18493 3959 1 8 . 1 1 137 137 PHE CA C 137 57.310 57.310 58.525 -1.215 18493 3960 1 8 . 1 1 137 137 PHE CB C 137 42.927 42.927 39.118 3.809 18493 3961 1 8 . 1 1 137 137 PHE H H 137 8.959 8.959 8.946 0.013 18493 3962 1 8 . 1 1 138 138 LEU CB C 138 43.547 43.547 43.016 0.531 18493 3963 1 8 . 1 1 139 139 GLY C C 139 176.262 176.262 174.412 1.850 18493 3964 1 8 . 1 1 139 139 GLY CA C 139 46.123 46.123 44.227 1.896 18493 3965 1 8 . 1 1 140 140 LEU N N 140 124.207 124.207 116.884 7.323 18493 3966 1 8 . 1 1 140 140 LEU CB C 140 40.503 40.503 40.655 -0.152 18493 3967 1 8 . 1 1 142 142 MET CA C 142 56.442 56.442 59.113 -2.671 18493 3968 1 8 . 1 1 143 143 PRO CA C 143 63.254 63.254 66.435 -3.181 18493 3969 1 8 . 1 1 144 144 GLN C C 144 177.307 177.307 178.084 -0.777 18493 3970 1 8 . 1 1 145 145 TRP N N 145 120.795 120.795 120.965 -0.170 18493 3971 1 8 . 1 1 145 145 TRP C C 145 178.709 178.709 178.648 0.061 18493 3972 1 8 . 1 1 145 145 TRP CA C 145 59.535 59.535 58.630 0.905 18493 3973 1 8 . 1 1 145 145 TRP CB C 145 29.345 29.345 29.692 -0.347 18493 3974 1 8 . 1 1 145 145 TRP H H 145 8.386 8.386 7.894 0.492 18493 3975 1 8 . 1 1 146 146 LEU N N 146 118.336 118.336 122.054 -3.718 18493 3976 1 8 . 1 1 146 146 LEU C C 146 177.115 177.115 179.135 -2.020 18493 3977 1 8 . 1 1 146 146 LEU CA C 146 57.793 57.793 57.998 -0.205 18493 3978 1 8 . 1 1 146 146 LEU CB C 146 41.616 41.616 41.065 0.551 18493 3979 1 8 . 1 1 146 146 LEU H H 146 9.033 9.033 8.923 0.110 18493 3980 1 8 . 1 1 147 147 LEU N N 147 123.772 123.772 118.737 5.035 18493 3981 1 8 . 1 1 147 147 LEU C C 147 178.787 178.787 179.157 -0.370 18493 3982 1 8 . 1 1 147 147 LEU CA C 147 58.052 58.052 57.949 0.103 18493 3983 1 8 . 1 1 147 147 LEU CB C 147 41.047 41.047 40.551 0.496 18493 3984 1 8 . 1 1 147 147 LEU H H 147 8.480 8.480 7.994 0.486 18493 3985 1 8 . 1 1 148 148 GLY N N 148 104.457 104.457 108.243 -3.786 18493 3986 1 8 . 1 1 148 148 GLY C C 148 174.667 174.667 176.215 -1.548 18493 3987 1 8 . 1 1 148 148 GLY CA C 148 48.102 48.102 47.298 0.804 18493 3988 1 8 . 1 1 149 149 ILE N N 149 121.815 121.815 123.192 -1.377 18493 3989 1 8 . 1 1 149 149 ILE C C 149 177.725 177.725 177.194 0.531 18493 3990 1 8 . 1 1 149 149 ILE CA C 149 65.997 65.997 63.224 2.773 18493 3991 1 8 . 1 1 149 149 ILE CB C 149 38.262 38.262 37.897 0.365 18493 3992 1 8 . 1 1 150 150 PHE N N 150 118.894 118.894 119.458 -0.564 18493 3993 1 8 . 1 1 150 150 PHE C C 150 178.929 178.929 177.915 1.014 18493 3994 1 8 . 1 1 150 150 PHE CA C 150 63.591 63.591 63.125 0.466 18493 3995 1 8 . 1 1 150 150 PHE CB C 150 38.417 38.417 38.723 -0.306 18493 3996 1 8 . 1 1 151 151 ILE N N 151 120.535 120.535 120.113 0.422 18493 3997 1 8 . 1 1 151 151 ILE C C 151 177.347 177.347 177.528 -0.181 18493 3998 1 8 . 1 1 151 151 ILE CA C 151 66.478 66.478 65.691 0.787 18493 3999 1 8 . 1 1 151 151 ILE CB C 151 37.302 37.302 37.586 -0.284 18493 4000 1 8 . 1 1 152 152 ALA N N 152 122.855 122.855 123.338 -0.483 18493 4001 1 8 . 1 1 152 152 ALA C C 152 179.165 179.165 179.724 -0.559 18493 4002 1 8 . 1 1 152 152 ALA CA C 152 56.272 56.272 55.454 0.818 18493 4003 1 8 . 1 1 152 152 ALA CB C 152 17.993 17.993 17.951 0.042 18493 4004 1 8 . 1 1 153 153 TYR N N 153 116.156 116.156 119.158 -3.002 18493 4005 1 8 . 1 1 153 153 TYR C C 153 179.682 179.682 177.731 1.951 18493 4006 1 8 . 1 1 153 153 TYR CA C 153 64.391 64.391 60.768 3.623 18493 4007 1 8 . 1 1 153 153 TYR CB C 153 39.553 39.553 38.405 1.148 18493 4008 1 8 . 1 1 153 153 TYR H H 153 8.680 8.680 8.505 0.175 18493 4009 1 8 . 1 1 154 154 LEU N N 154 122.327 122.327 122.120 0.207 18493 4010 1 8 . 1 1 154 154 LEU C C 154 177.336 177.336 178.769 -1.433 18493 4011 1 8 . 1 1 154 154 LEU CA C 154 57.905 57.905 58.418 -0.513 18493 4012 1 8 . 1 1 154 154 LEU CB C 154 42.009 42.009 42.129 -0.120 18493 4013 1 8 . 1 1 155 155 ILE N N 155 119.079 119.079 119.109 -0.030 18493 4014 1 8 . 1 1 155 155 ILE C C 155 177.589 177.589 178.579 -0.990 18493 4015 1 8 . 1 1 155 155 ILE CA C 155 65.996 65.996 65.046 0.950 18493 4016 1 8 . 1 1 155 155 ILE CB C 155 38.179 38.179 36.645 1.534 18493 4017 1 8 . 1 1 156 156 VAL N N 156 117.551 117.551 120.009 -2.458 18493 4018 1 8 . 1 1 156 156 VAL C C 156 176.163 176.163 178.359 -2.196 18493 4019 1 8 . 1 1 156 156 VAL CA C 156 67.664 67.664 66.633 1.031 18493 4020 1 8 . 1 1 156 156 VAL CB C 156 31.694 31.694 30.819 0.875 18493 4021 1 8 . 1 1 157 157 ALA N N 157 122.470 122.470 122.293 0.177 18493 4022 1 8 . 1 1 157 157 ALA C C 157 179.076 179.076 179.717 -0.641 18493 4023 1 8 . 1 1 157 157 ALA CA C 157 54.803 54.803 55.090 -0.287 18493 4024 1 8 . 1 1 157 157 ALA CB C 157 16.120 16.120 17.857 -1.737 18493 4025 1 8 . 1 1 158 158 VAL N N 158 116.045 116.045 118.446 -2.401 18493 4026 1 8 . 1 1 158 158 VAL C C 158 177.491 177.491 177.841 -0.350 18493 4027 1 8 . 1 1 158 158 VAL CA C 158 67.160 67.160 65.724 1.436 18493 4028 1 8 . 1 1 158 158 VAL CB C 158 31.331 31.331 31.760 -0.429 18493 4029 1 8 . 1 1 159 159 LEU N N 159 116.776 116.776 120.733 -3.957 18493 4030 1 8 . 1 1 159 159 LEU C C 159 178.312 178.312 179.470 -1.158 18493 4031 1 8 . 1 1 159 159 LEU CA C 159 57.443 57.443 58.001 -0.558 18493 4032 1 8 . 1 1 159 159 LEU CB C 159 41.567 41.567 40.771 0.796 18493 4033 1 8 . 1 1 160 160 VAL N N 160 118.890 118.890 119.859 -0.969 18493 4034 1 8 . 1 1 160 160 VAL C C 160 177.508 177.508 177.618 -0.110 18493 4035 1 8 . 1 1 160 160 VAL CA C 160 67.366 67.366 65.270 2.096 18493 4036 1 8 . 1 1 160 160 VAL CB C 160 31.106 31.106 31.487 -0.381 18493 4037 1 8 . 1 1 161 161 VAL N N 161 118.360 118.360 118.241 0.119 18493 4038 1 8 . 1 1 161 161 VAL C C 161 176.607 176.607 175.889 0.718 18493 4039 1 8 . 1 1 161 161 VAL CA C 161 67.614 67.614 64.463 3.151 18493 4040 1 8 . 1 1 161 161 VAL CB C 161 31.646 31.646 32.648 -1.002 18493 4041 1 9 . 1 1 11 11 GLY N N 11 108.456 108.456 105.390 3.066 18493 4042 1 9 . 1 1 11 11 GLY H H 11 8.433 8.433 7.222 1.211 18493 4043 1 9 . 1 1 12 12 ARG C C 12 178.053 178.053 178.738 -0.685 18493 4044 1 9 . 1 1 12 12 ARG CA C 12 57.504 57.504 59.394 -1.890 18493 4045 1 9 . 1 1 12 12 ARG CB C 12 30.522 30.522 30.149 0.373 18493 4046 1 9 . 1 1 13 13 GLY N N 13 108.265 108.265 108.415 -0.150 18493 4047 1 9 . 1 1 13 13 GLY C C 13 175.091 175.091 175.896 -0.805 18493 4048 1 9 . 1 1 13 13 GLY CA C 13 45.326 45.326 47.293 -1.967 18493 4049 1 9 . 1 1 14 14 ALA N N 14 123.181 123.181 123.716 -0.535 18493 4050 1 9 . 1 1 14 14 ALA C C 14 179.173 179.173 179.871 -0.698 18493 4051 1 9 . 1 1 14 14 ALA CA C 14 55.061 55.061 54.906 0.155 18493 4052 1 9 . 1 1 14 14 ALA H H 14 9.285 9.285 7.923 1.362 18493 4053 1 9 . 1 1 15 15 TRP N N 15 116.733 116.733 119.265 -2.532 18493 4054 1 9 . 1 1 15 15 TRP C C 15 179.425 179.425 178.825 0.600 18493 4055 1 9 . 1 1 15 15 TRP CA C 15 58.960 58.960 59.713 -0.753 18493 4056 1 9 . 1 1 15 15 TRP CB C 15 29.529 29.529 30.024 -0.495 18493 4057 1 9 . 1 1 15 15 TRP H H 15 7.091 7.091 8.184 -1.093 18493 4058 1 9 . 1 1 16 16 LEU N N 16 118.671 118.671 120.179 -1.508 18493 4059 1 9 . 1 1 16 16 LEU C C 16 178.461 178.461 179.236 -0.775 18493 4060 1 9 . 1 1 16 16 LEU CA C 16 58.246 58.246 58.845 -0.599 18493 4061 1 9 . 1 1 16 16 LEU CB C 16 41.369 41.369 41.584 -0.214 18493 4062 1 9 . 1 1 16 16 LEU H H 16 9.180 9.180 9.103 0.077 18493 4063 1 9 . 1 1 17 17 LEU N N 17 118.515 118.515 121.437 -2.922 18493 4064 1 9 . 1 1 17 17 LEU C C 17 178.787 178.787 178.961 -0.174 18493 4065 1 9 . 1 1 17 17 LEU CA C 17 57.832 57.832 58.777 -0.945 18493 4066 1 9 . 1 1 17 17 LEU CB C 17 41.395 41.395 41.345 0.050 18493 4067 1 9 . 1 1 18 18 MET N N 18 120.633 120.633 118.729 1.904 18493 4068 1 9 . 1 1 18 18 MET C C 18 180.469 180.469 179.012 1.457 18493 4069 1 9 . 1 1 18 18 MET CA C 18 60.277 60.277 56.595 3.682 18493 4070 1 9 . 1 1 18 18 MET CB C 18 31.789 31.789 30.983 0.806 18493 4071 1 9 . 1 1 19 19 ALA N N 19 123.958 123.958 122.421 1.537 18493 4072 1 9 . 1 1 19 19 ALA C C 19 178.210 178.210 179.311 -1.101 18493 4073 1 9 . 1 1 19 19 ALA CA C 19 55.468 55.468 55.160 0.308 18493 4074 1 9 . 1 1 19 19 ALA CB C 19 17.865 17.865 18.501 -0.636 18493 4075 1 9 . 1 1 19 19 ALA H H 19 9.398 9.398 8.803 0.595 18493 4076 1 9 . 1 1 20 20 PHE N N 20 118.424 118.424 119.723 -1.299 18493 4077 1 9 . 1 1 20 20 PHE C C 20 176.674 176.674 176.861 -0.187 18493 4078 1 9 . 1 1 20 20 PHE CA C 20 62.546 62.546 61.766 0.780 18493 4079 1 9 . 1 1 20 20 PHE CB C 20 38.697 38.697 39.291 -0.594 18493 4080 1 9 . 1 1 21 21 THR N N 21 109.220 109.220 115.887 -6.667 18493 4081 1 9 . 1 1 21 21 THR C C 21 174.203 174.203 176.882 -2.679 18493 4082 1 9 . 1 1 21 21 THR CA C 21 66.052 66.052 66.710 -0.658 18493 4083 1 9 . 1 1 21 21 THR CB C 21 68.956 68.956 67.771 1.185 18493 4084 1 9 . 1 1 22 22 ALA N N 22 123.662 123.662 124.499 -0.837 18493 4085 1 9 . 1 1 22 22 ALA C C 22 179.488 179.488 179.569 -0.081 18493 4086 1 9 . 1 1 22 22 ALA CA C 22 54.847 54.847 54.523 0.324 18493 4087 1 9 . 1 1 22 22 ALA CB C 22 17.801 17.801 17.785 0.016 18493 4088 1 9 . 1 1 23 23 LEU N N 23 118.917 118.917 120.094 -1.177 18493 4089 1 9 . 1 1 23 23 LEU C C 23 178.028 178.028 179.032 -1.004 18493 4090 1 9 . 1 1 23 23 LEU CA C 23 57.713 57.713 57.334 0.379 18493 4091 1 9 . 1 1 23 23 LEU CB C 23 41.506 41.506 40.592 0.914 18493 4092 1 9 . 1 1 23 23 LEU H H 23 8.581 8.581 7.872 0.709 18493 4093 1 9 . 1 1 24 24 ALA N N 24 119.931 119.931 121.784 -1.853 18493 4094 1 9 . 1 1 24 24 ALA C C 24 180.617 180.617 179.522 1.095 18493 4095 1 9 . 1 1 24 24 ALA CA C 24 55.350 55.350 54.757 0.593 18493 4096 1 9 . 1 1 24 24 ALA CB C 24 17.583 17.583 18.188 -0.605 18493 4097 1 9 . 1 1 25 25 LEU N N 25 119.691 119.691 119.840 -0.149 18493 4098 1 9 . 1 1 25 25 LEU CA C 25 58.078 58.078 57.723 0.355 18493 4099 1 9 . 1 1 25 25 LEU CB C 25 43.597 43.597 41.408 2.189 18493 4100 1 9 . 1 1 25 25 LEU H H 25 9.179 9.179 8.473 0.706 18493 4101 1 9 . 1 1 26 26 GLU N N 26 119.651 119.651 117.589 2.062 18493 4102 1 9 . 1 1 26 26 GLU C C 26 179.334 179.334 179.331 0.003 18493 4103 1 9 . 1 1 26 26 GLU CA C 26 59.584 59.584 58.535 1.049 18493 4104 1 9 . 1 1 26 26 GLU CB C 26 27.202 27.202 29.288 -2.086 18493 4105 1 9 . 1 1 27 27 LEU N N 27 119.661 119.661 122.591 -2.930 18493 4106 1 9 . 1 1 27 27 LEU CA C 27 57.887 57.887 57.654 0.233 18493 4107 1 9 . 1 1 27 27 LEU CB C 27 41.591 41.591 41.251 0.341 18493 4108 1 9 . 1 1 27 27 LEU H H 27 9.410 9.410 7.624 1.786 18493 4109 1 9 . 1 1 28 28 THR N N 28 118.484 118.484 114.679 3.805 18493 4110 1 9 . 1 1 28 28 THR C C 28 175.898 175.898 176.654 -0.756 18493 4111 1 9 . 1 1 28 28 THR CA C 28 67.459 67.459 66.074 1.385 18493 4112 1 9 . 1 1 28 28 THR CB C 28 67.948 67.948 68.344 -0.396 18493 4113 1 9 . 1 1 29 29 ALA N N 29 122.643 122.643 125.007 -2.364 18493 4114 1 9 . 1 1 29 29 ALA C C 29 179.717 179.717 178.893 0.824 18493 4115 1 9 . 1 1 29 29 ALA CA C 29 55.919 55.919 54.780 1.139 18493 4116 1 9 . 1 1 29 29 ALA CB C 29 16.837 16.837 18.390 -1.553 18493 4117 1 9 . 1 1 29 29 ALA H H 29 8.302 8.302 7.583 0.719 18493 4118 1 9 . 1 1 30 30 LEU N N 30 117.408 117.408 117.246 0.162 18493 4119 1 9 . 1 1 30 30 LEU C C 30 178.143 178.143 177.464 0.679 18493 4120 1 9 . 1 1 30 30 LEU CA C 30 57.384 57.384 56.944 0.440 18493 4121 1 9 . 1 1 30 30 LEU CB C 30 41.679 41.679 41.807 -0.128 18493 4122 1 9 . 1 1 30 30 LEU H H 30 8.412 8.412 7.857 0.555 18493 4123 1 9 . 1 1 31 31 TRP N N 31 125.692 125.692 118.887 6.805 18493 4124 1 9 . 1 1 31 31 TRP C C 31 179.053 179.053 175.684 3.369 18493 4125 1 9 . 1 1 31 31 TRP CA C 31 59.005 59.005 59.050 -0.045 18493 4126 1 9 . 1 1 31 31 TRP CB C 31 28.142 28.142 29.777 -1.635 18493 4127 1 9 . 1 1 31 31 TRP H H 31 9.157 9.157 7.462 1.695 18493 4128 1 9 . 1 1 32 32 PHE N N 32 119.195 119.195 113.794 5.401 18493 4129 1 9 . 1 1 32 32 PHE CA C 32 61.557 61.557 58.101 3.456 18493 4130 1 9 . 1 1 32 32 PHE CB C 32 38.384 38.384 36.710 1.674 18493 4131 1 9 . 1 1 32 32 PHE H H 32 9.374 9.374 6.732 2.642 18493 4132 1 9 . 1 1 33 33 GLN C C 33 177.477 177.477 175.566 1.911 18493 4133 1 9 . 1 1 33 33 GLN CA C 33 56.613 56.613 58.238 -1.625 18493 4134 1 9 . 1 1 33 33 GLN CB C 33 29.433 29.433 26.493 2.940 18493 4135 1 9 . 1 1 34 34 HIS N N 34 115.948 115.948 118.527 -2.579 18493 4136 1 9 . 1 1 34 34 HIS C C 34 175.548 175.548 177.885 -2.337 18493 4137 1 9 . 1 1 34 34 HIS CA C 34 58.733 58.733 57.452 1.281 18493 4138 1 9 . 1 1 34 34 HIS CB C 34 32.084 32.084 29.706 2.378 18493 4139 1 9 . 1 1 34 34 HIS H H 34 9.621 9.621 8.383 1.238 18493 4140 1 9 . 1 1 35 35 VAL N N 35 116.902 116.902 121.605 -4.703 18493 4141 1 9 . 1 1 35 35 VAL C C 35 177.853 177.853 176.738 1.115 18493 4142 1 9 . 1 1 35 35 VAL CA C 35 64.075 64.075 65.350 -1.275 18493 4143 1 9 . 1 1 35 35 VAL CB C 35 30.626 30.626 31.701 -1.075 18493 4144 1 9 . 1 1 36 36 MET N N 36 114.145 114.145 117.973 -3.828 18493 4145 1 9 . 1 1 36 36 MET C C 36 175.905 175.905 176.382 -0.477 18493 4146 1 9 . 1 1 36 36 MET H H 36 7.605 7.605 7.726 -0.121 18493 4147 1 9 . 1 1 37 37 LEU N N 37 111.740 111.740 121.194 -9.454 18493 4148 1 9 . 1 1 37 37 LEU H H 37 7.121 7.121 7.350 -0.229 18493 4149 1 9 . 1 1 38 38 LEU C C 38 176.457 176.457 174.865 1.592 18493 4150 1 9 . 1 1 39 39 LYS N N 39 121.418 121.418 120.690 0.728 18493 4151 1 9 . 1 1 39 39 LYS CA C 39 57.471 57.471 52.976 4.495 18493 4152 1 9 . 1 1 39 39 LYS H H 39 9.359 9.359 8.187 1.172 18493 4153 1 9 . 1 1 40 40 PRO CA C 40 60.451 60.451 62.419 -1.968 18493 4154 1 9 . 1 1 42 42 VAL N N 42 118.166 118.166 124.232 -6.066 18493 4155 1 9 . 1 1 42 42 VAL C C 42 179.261 179.261 175.599 3.662 18493 4156 1 9 . 1 1 42 42 VAL CA C 42 67.223 67.223 60.535 6.688 18493 4157 1 9 . 1 1 42 42 VAL CB C 42 30.941 30.941 34.106 -3.166 18493 4158 1 9 . 1 1 43 43 LEU N N 43 115.946 115.946 122.700 -6.754 18493 4159 1 9 . 1 1 43 43 LEU C C 43 178.293 178.293 178.087 0.206 18493 4160 1 9 . 1 1 43 43 LEU CA C 43 57.129 57.129 56.798 0.331 18493 4161 1 9 . 1 1 43 43 LEU CB C 43 41.030 41.030 41.249 -0.219 18493 4162 1 9 . 1 1 44 44 CYS N N 44 115.006 115.006 117.379 -2.373 18493 4163 1 9 . 1 1 44 44 CYS C C 44 177.484 177.484 176.542 0.942 18493 4164 1 9 . 1 1 44 44 CYS CA C 44 59.760 59.760 63.038 -3.278 18493 4165 1 9 . 1 1 44 44 CYS CB C 44 30.651 30.651 26.830 3.821 18493 4166 1 9 . 1 1 44 44 CYS H H 44 7.683 7.683 8.490 -0.807 18493 4167 1 9 . 1 1 45 45 ILE N N 45 119.384 119.384 119.589 -0.205 18493 4168 1 9 . 1 1 45 45 ILE C C 45 179.575 179.575 175.178 4.397 18493 4169 1 9 . 1 1 45 45 ILE CA C 45 62.068 62.068 62.786 -0.718 18493 4170 1 9 . 1 1 45 45 ILE CB C 45 33.583 33.583 37.539 -3.956 18493 4171 1 9 . 1 1 46 46 TYR N N 46 120.126 120.126 118.826 1.300 18493 4172 1 9 . 1 1 46 46 TYR C C 46 178.397 178.397 176.406 1.991 18493 4173 1 9 . 1 1 46 46 TYR CA C 46 59.129 59.129 59.963 -0.834 18493 4174 1 9 . 1 1 46 46 TYR CB C 46 35.347 35.347 39.554 -4.207 18493 4175 1 9 . 1 1 46 46 TYR H H 46 8.958 8.958 7.853 1.105 18493 4176 1 9 . 1 1 47 47 GLU N N 47 121.779 121.779 117.984 3.795 18493 4177 1 9 . 1 1 47 47 GLU C C 47 179.907 179.907 178.326 1.581 18493 4178 1 9 . 1 1 47 47 GLU CA C 47 57.985 57.985 58.194 -0.209 18493 4179 1 9 . 1 1 47 47 GLU CB C 47 27.290 27.290 30.446 -3.156 18493 4180 1 9 . 1 1 47 47 GLU H H 47 9.681 9.681 8.474 1.207 18493 4181 1 9 . 1 1 48 48 ARG N N 48 119.188 119.188 120.295 -1.107 18493 4182 1 9 . 1 1 48 48 ARG C C 48 181.638 181.638 177.975 3.663 18493 4183 1 9 . 1 1 48 48 ARG CA C 48 60.299 60.299 58.844 1.455 18493 4184 1 9 . 1 1 48 48 ARG CB C 48 30.167 30.167 28.810 1.357 18493 4185 1 9 . 1 1 48 48 ARG H H 48 9.213 9.213 7.585 1.628 18493 4186 1 9 . 1 1 49 49 VAL N N 49 121.326 121.326 119.838 1.488 18493 4187 1 9 . 1 1 49 49 VAL C C 49 177.326 177.326 178.113 -0.787 18493 4188 1 9 . 1 1 49 49 VAL CA C 49 66.624 66.624 66.240 0.384 18493 4189 1 9 . 1 1 49 49 VAL CB C 49 31.280 31.280 31.015 0.265 18493 4190 1 9 . 1 1 50 50 ALA N N 50 122.955 122.955 122.037 0.918 18493 4191 1 9 . 1 1 50 50 ALA C C 50 179.594 179.594 179.680 -0.086 18493 4192 1 9 . 1 1 50 50 ALA CA C 50 55.902 55.902 55.281 0.621 18493 4193 1 9 . 1 1 50 50 ALA CB C 50 16.623 16.623 18.755 -2.132 18493 4194 1 9 . 1 1 51 51 LEU N N 51 115.737 115.737 118.174 -2.437 18493 4195 1 9 . 1 1 51 51 LEU C C 51 177.990 177.990 178.468 -0.478 18493 4196 1 9 . 1 1 51 51 LEU CA C 51 57.285 57.285 57.947 -0.661 18493 4197 1 9 . 1 1 51 51 LEU CB C 51 41.369 41.369 40.597 0.771 18493 4198 1 9 . 1 1 52 52 PHE N N 52 122.707 122.707 119.030 3.677 18493 4199 1 9 . 1 1 52 52 PHE C C 52 179.142 179.142 178.273 0.869 18493 4200 1 9 . 1 1 52 52 PHE CA C 52 62.518 62.518 60.581 1.937 18493 4201 1 9 . 1 1 52 52 PHE CB C 52 38.538 38.538 38.716 -0.178 18493 4202 1 9 . 1 1 52 52 PHE H H 52 8.863 8.863 8.143 0.720 18493 4203 1 9 . 1 1 53 53 GLY N N 53 110.801 110.801 108.504 2.297 18493 4204 1 9 . 1 1 53 53 GLY C C 53 175.378 175.378 176.720 -1.342 18493 4205 1 9 . 1 1 53 53 GLY CA C 53 48.024 48.024 47.260 0.764 18493 4206 1 9 . 1 1 53 53 GLY H H 53 9.027 9.027 8.251 0.776 18493 4207 1 9 . 1 1 54 54 VAL N N 54 121.926 121.926 122.906 -0.980 18493 4208 1 9 . 1 1 54 54 VAL C C 54 177.035 177.035 177.432 -0.397 18493 4209 1 9 . 1 1 54 54 VAL CA C 54 67.448 67.448 65.586 1.862 18493 4210 1 9 . 1 1 54 54 VAL CB C 54 31.246 31.246 31.822 -0.576 18493 4211 1 9 . 1 1 54 54 VAL H H 54 7.948 7.948 8.209 -0.261 18493 4212 1 9 . 1 1 55 55 LEU N N 55 119.894 119.894 122.643 -2.749 18493 4213 1 9 . 1 1 55 55 LEU C C 55 178.175 178.175 178.758 -0.583 18493 4214 1 9 . 1 1 55 55 LEU CA C 55 58.490 58.490 57.914 0.576 18493 4215 1 9 . 1 1 55 55 LEU CB C 55 42.145 42.145 40.803 1.342 18493 4216 1 9 . 1 1 55 55 LEU H H 55 8.646 8.646 8.579 0.067 18493 4217 1 9 . 1 1 56 56 GLY N N 56 106.262 106.262 106.457 -0.195 18493 4218 1 9 . 1 1 56 56 GLY C C 56 174.618 174.618 175.462 -0.844 18493 4219 1 9 . 1 1 56 56 GLY CA C 56 47.533 47.533 47.442 0.091 18493 4220 1 9 . 1 1 57 57 ALA N N 57 123.002 123.002 124.337 -1.335 18493 4221 1 9 . 1 1 57 57 ALA C C 57 178.688 178.688 179.231 -0.543 18493 4222 1 9 . 1 1 57 57 ALA CA C 57 55.548 55.548 54.550 0.998 18493 4223 1 9 . 1 1 57 57 ALA CB C 57 18.065 18.065 18.276 -0.211 18493 4224 1 9 . 1 1 58 58 ALA N N 58 118.866 118.866 121.221 -2.355 18493 4225 1 9 . 1 1 58 58 ALA C C 58 179.348 179.348 179.423 -0.075 18493 4226 1 9 . 1 1 58 58 ALA CA C 58 54.763 54.763 54.106 0.657 18493 4227 1 9 . 1 1 58 58 ALA CB C 58 17.898 17.898 17.594 0.304 18493 4228 1 9 . 1 1 58 58 ALA H H 58 8.674 8.674 8.122 0.552 18493 4229 1 9 . 1 1 59 59 LEU N N 59 115.384 115.384 119.198 -3.814 18493 4230 1 9 . 1 1 59 59 LEU C C 59 177.654 177.654 178.895 -1.241 18493 4231 1 9 . 1 1 59 59 LEU CA C 59 57.387 57.387 57.984 -0.598 18493 4232 1 9 . 1 1 59 59 LEU CB C 59 41.209 41.209 42.175 -0.966 18493 4233 1 9 . 1 1 60 60 ILE N N 60 116.140 116.140 117.927 -1.787 18493 4234 1 9 . 1 1 60 60 ILE C C 60 180.024 180.024 178.297 1.727 18493 4235 1 9 . 1 1 60 60 ILE CA C 60 64.263 64.263 65.193 -0.930 18493 4236 1 9 . 1 1 60 60 ILE CB C 60 37.240 37.240 37.743 -0.503 18493 4237 1 9 . 1 1 61 61 GLY N N 61 110.127 110.127 106.852 3.275 18493 4238 1 9 . 1 1 61 61 GLY C C 61 173.716 173.716 174.819 -1.103 18493 4239 1 9 . 1 1 61 61 GLY CA C 61 45.617 45.617 46.444 -0.827 18493 4240 1 9 . 1 1 61 61 GLY H H 61 9.046 9.046 8.184 0.862 18493 4241 1 9 . 1 1 62 62 ALA N N 62 118.949 118.949 121.202 -2.253 18493 4242 1 9 . 1 1 62 62 ALA C C 62 176.192 176.192 178.146 -1.954 18493 4243 1 9 . 1 1 62 62 ALA CA C 62 53.268 53.268 52.800 0.468 18493 4244 1 9 . 1 1 62 62 ALA CB C 62 19.138 19.138 19.680 -0.542 18493 4245 1 9 . 1 1 62 62 ALA H H 62 8.066 8.066 7.742 0.324 18493 4246 1 9 . 1 1 63 63 ILE N N 63 116.800 116.800 118.788 -1.988 18493 4247 1 9 . 1 1 63 63 ILE CA C 63 66.739 66.739 62.152 4.587 18493 4248 1 9 . 1 1 63 63 ILE CB C 63 37.947 37.947 39.133 -1.186 18493 4249 1 9 . 1 1 64 64 ALA N N 64 123.957 123.957 121.835 2.122 18493 4250 1 9 . 1 1 64 64 ALA CA C 64 52.934 52.934 49.787 3.147 18493 4251 1 9 . 1 1 64 64 ALA CB C 64 19.428 19.428 18.950 0.478 18493 4252 1 9 . 1 1 65 65 PRO CA C 65 65.350 65.350 62.370 2.980 18493 4253 1 9 . 1 1 66 66 LYS N N 66 116.618 116.618 115.486 1.132 18493 4254 1 9 . 1 1 66 66 LYS C C 66 177.500 177.500 174.977 2.523 18493 4255 1 9 . 1 1 66 66 LYS CA C 66 56.547 56.547 56.207 0.340 18493 4256 1 9 . 1 1 66 66 LYS CB C 66 30.522 30.522 31.042 -0.520 18493 4257 1 9 . 1 1 67 67 THR CA C 67 60.452 60.452 62.738 -2.286 18493 4258 1 9 . 1 1 67 67 THR CB C 67 69.948 69.948 67.477 2.471 18493 4259 1 9 . 1 1 68 68 PRO C C 68 177.070 177.070 177.451 -0.381 18493 4260 1 9 . 1 1 68 68 PRO CA C 68 63.315 63.315 61.571 1.744 18493 4261 1 9 . 1 1 68 68 PRO CB C 68 32.458 32.458 32.602 -0.144 18493 4262 1 9 . 1 1 69 69 LEU N N 69 121.517 121.517 115.452 6.065 18493 4263 1 9 . 1 1 69 69 LEU C C 69 179.448 179.448 177.477 1.971 18493 4264 1 9 . 1 1 69 69 LEU CA C 69 57.389 57.389 56.785 0.604 18493 4265 1 9 . 1 1 69 69 LEU CB C 69 42.737 42.737 41.130 1.607 18493 4266 1 9 . 1 1 69 69 LEU H H 69 8.882 8.882 8.142 0.740 18493 4267 1 9 . 1 1 70 70 ARG N N 70 114.028 114.028 119.626 -5.598 18493 4268 1 9 . 1 1 70 70 ARG C C 70 177.925 177.925 177.963 -0.038 18493 4269 1 9 . 1 1 70 70 ARG CA C 70 58.429 58.429 57.365 1.064 18493 4270 1 9 . 1 1 70 70 ARG CB C 70 29.391 29.391 29.776 -0.385 18493 4271 1 9 . 1 1 70 70 ARG H H 70 8.202 8.202 7.688 0.514 18493 4272 1 9 . 1 1 71 71 TYR N N 71 121.740 121.740 117.515 4.225 18493 4273 1 9 . 1 1 71 71 TYR CA C 71 57.374 57.374 57.251 0.123 18493 4274 1 9 . 1 1 71 71 TYR H H 71 8.136 8.136 8.155 -0.019 18493 4275 1 9 . 1 1 72 72 VAL N N 72 118.416 118.416 122.183 -3.767 18493 4276 1 9 . 1 1 72 72 VAL C C 72 177.702 177.702 177.312 0.390 18493 4277 1 9 . 1 1 72 72 VAL CA C 72 66.098 66.098 65.220 0.878 18493 4278 1 9 . 1 1 72 72 VAL CB C 72 31.343 31.343 31.467 -0.124 18493 4279 1 9 . 1 1 73 73 ALA N N 73 120.283 120.283 121.521 -1.238 18493 4280 1 9 . 1 1 73 73 ALA C C 73 179.763 179.763 179.608 0.155 18493 4281 1 9 . 1 1 73 73 ALA CA C 73 55.785 55.785 55.183 0.602 18493 4282 1 9 . 1 1 73 73 ALA CB C 73 19.265 19.265 18.481 0.784 18493 4283 1 9 . 1 1 73 73 ALA H H 73 9.015 9.015 7.889 1.126 18493 4284 1 9 . 1 1 74 74 MET N N 74 115.547 115.547 118.128 -2.581 18493 4285 1 9 . 1 1 74 74 MET C C 74 177.223 177.223 178.662 -1.439 18493 4286 1 9 . 1 1 74 74 MET CA C 74 61.023 61.023 59.920 1.103 18493 4287 1 9 . 1 1 74 74 MET CB C 74 33.777 33.777 32.128 1.649 18493 4288 1 9 . 1 1 74 74 MET H H 74 8.163 8.163 8.483 -0.320 18493 4289 1 9 . 1 1 75 75 VAL N N 75 118.690 118.690 117.146 1.544 18493 4290 1 9 . 1 1 75 75 VAL C C 75 177.166 177.166 177.746 -0.580 18493 4291 1 9 . 1 1 75 75 VAL CA C 75 67.581 67.581 65.899 1.682 18493 4292 1 9 . 1 1 75 75 VAL CB C 75 31.408 31.408 30.473 0.935 18493 4293 1 9 . 1 1 75 75 VAL H H 75 7.554 7.554 7.829 -0.275 18493 4294 1 9 . 1 1 76 76 ILE N N 76 118.959 118.959 120.230 -1.271 18493 4295 1 9 . 1 1 76 76 ILE C C 76 178.680 178.680 177.543 1.137 18493 4296 1 9 . 1 1 76 76 ILE CA C 76 65.839 65.839 64.866 0.973 18493 4297 1 9 . 1 1 76 76 ILE CB C 76 38.414 38.414 38.026 0.388 18493 4298 1 9 . 1 1 77 77 TRP N N 77 125.440 125.440 120.887 4.553 18493 4299 1 9 . 1 1 77 77 TRP C C 77 177.153 177.153 178.824 -1.671 18493 4300 1 9 . 1 1 77 77 TRP CA C 77 58.779 58.779 60.037 -1.258 18493 4301 1 9 . 1 1 77 77 TRP CB C 77 30.494 30.494 29.365 1.129 18493 4302 1 9 . 1 1 77 77 TRP H H 77 9.515 9.515 8.419 1.096 18493 4303 1 9 . 1 1 78 78 LEU N N 78 118.968 118.968 122.348 -3.380 18493 4304 1 9 . 1 1 78 78 LEU C C 78 178.381 178.381 178.817 -0.436 18493 4305 1 9 . 1 1 78 78 LEU CA C 78 58.041 58.041 58.104 -0.063 18493 4306 1 9 . 1 1 78 78 LEU CB C 78 43.807 43.807 40.815 2.992 18493 4307 1 9 . 1 1 78 78 LEU H H 78 9.367 9.367 8.667 0.700 18493 4308 1 9 . 1 1 79 79 TYR N N 79 118.181 118.181 119.982 -1.801 18493 4309 1 9 . 1 1 79 79 TYR C C 79 176.777 176.777 177.574 -0.797 18493 4310 1 9 . 1 1 79 79 TYR CA C 79 62.849 62.849 61.484 1.365 18493 4311 1 9 . 1 1 80 80 SER N N 80 114.286 114.286 115.258 -0.972 18493 4312 1 9 . 1 1 80 80 SER C C 80 175.943 175.943 176.553 -0.610 18493 4313 1 9 . 1 1 80 80 SER CA C 80 63.515 63.515 61.138 2.377 18493 4314 1 9 . 1 1 80 80 SER CB C 80 63.941 63.941 62.969 0.972 18493 4315 1 9 . 1 1 81 81 ALA N N 81 121.070 121.070 123.260 -2.190 18493 4316 1 9 . 1 1 81 81 ALA C C 81 178.208 178.208 179.191 -0.983 18493 4317 1 9 . 1 1 81 81 ALA CA C 81 55.224 55.224 54.481 0.743 18493 4318 1 9 . 1 1 81 81 ALA CB C 81 17.897 17.897 18.750 -0.853 18493 4319 1 9 . 1 1 82 82 PHE N N 82 117.560 117.560 120.456 -2.896 18493 4320 1 9 . 1 1 82 82 PHE C C 82 176.975 176.975 177.226 -0.251 18493 4321 1 9 . 1 1 82 82 PHE CA C 82 62.132 62.132 60.220 1.912 18493 4322 1 9 . 1 1 82 82 PHE CB C 82 38.497 38.497 39.187 -0.690 18493 4323 1 9 . 1 1 83 83 ARG N N 83 117.110 117.110 118.360 -1.250 18493 4324 1 9 . 1 1 83 83 ARG C C 83 178.637 178.637 178.387 0.250 18493 4325 1 9 . 1 1 83 83 ARG CA C 83 60.291 60.291 58.552 1.739 18493 4326 1 9 . 1 1 83 83 ARG CB C 83 28.625 28.625 29.539 -0.914 18493 4327 1 9 . 1 1 84 84 GLY N N 84 105.915 105.915 106.484 -0.569 18493 4328 1 9 . 1 1 84 84 GLY C C 84 177.091 177.091 175.229 1.862 18493 4329 1 9 . 1 1 84 84 GLY CA C 84 46.128 46.128 46.268 -0.140 18493 4330 1 9 . 1 1 85 85 VAL N N 85 124.985 124.985 120.541 4.444 18493 4331 1 9 . 1 1 85 85 VAL C C 85 176.387 176.387 178.003 -1.616 18493 4332 1 9 . 1 1 85 85 VAL CA C 85 66.960 66.960 65.893 1.067 18493 4333 1 9 . 1 1 85 85 VAL CB C 85 31.066 31.066 30.941 0.125 18493 4334 1 9 . 1 1 86 86 GLN N N 86 116.522 116.522 118.988 -2.466 18493 4335 1 9 . 1 1 86 86 GLN C C 86 179.586 179.586 178.820 0.766 18493 4336 1 9 . 1 1 86 86 GLN CA C 86 59.505 59.505 58.527 0.978 18493 4337 1 9 . 1 1 86 86 GLN CB C 86 28.762 28.762 27.717 1.045 18493 4338 1 9 . 1 1 87 87 LEU N N 87 121.211 121.211 119.046 2.165 18493 4339 1 9 . 1 1 87 87 LEU C C 87 178.396 178.396 179.291 -0.895 18493 4340 1 9 . 1 1 87 87 LEU CA C 87 57.847 57.847 57.390 0.457 18493 4341 1 9 . 1 1 87 87 LEU CB C 87 41.924 41.924 41.213 0.711 18493 4342 1 9 . 1 1 87 87 LEU H H 87 8.955 8.955 7.556 1.399 18493 4343 1 9 . 1 1 88 88 THR N N 88 108.251 108.251 114.280 -6.029 18493 4344 1 9 . 1 1 88 88 THR C C 88 180.013 180.013 176.558 3.455 18493 4345 1 9 . 1 1 88 88 THR CA C 88 65.112 65.112 65.123 -0.011 18493 4346 1 9 . 1 1 88 88 THR CB C 88 68.805 68.805 69.316 -0.511 18493 4347 1 9 . 1 1 88 88 THR H H 88 8.764 8.764 8.207 0.557 18493 4348 1 9 . 1 1 89 89 TYR N N 89 127.947 127.947 123.474 4.473 18493 4349 1 9 . 1 1 89 89 TYR C C 89 177.244 177.244 177.501 -0.257 18493 4350 1 9 . 1 1 89 89 TYR H H 89 9.868 9.868 8.659 1.209 18493 4351 1 9 . 1 1 90 90 GLU N N 90 121.163 121.163 116.754 4.409 18493 4352 1 9 . 1 1 90 90 GLU C C 90 178.671 178.671 178.720 -0.049 18493 4353 1 9 . 1 1 90 90 GLU H H 90 8.515 8.515 7.997 0.518 18493 4354 1 9 . 1 1 91 91 HIS N N 91 120.459 120.459 119.453 1.006 18493 4355 1 9 . 1 1 91 91 HIS C C 91 177.605 177.605 177.003 0.602 18493 4356 1 9 . 1 1 91 91 HIS CA C 91 57.085 57.085 58.219 -1.134 18493 4357 1 9 . 1 1 91 91 HIS CB C 91 34.128 34.128 30.129 3.999 18493 4358 1 9 . 1 1 91 91 HIS H H 91 9.102 9.102 7.791 1.311 18493 4359 1 9 . 1 1 92 92 THR N N 92 115.463 115.463 113.662 1.801 18493 4360 1 9 . 1 1 92 92 THR C C 92 176.189 176.189 175.646 0.543 18493 4361 1 9 . 1 1 92 92 THR CA C 92 67.058 67.058 64.871 2.187 18493 4362 1 9 . 1 1 92 92 THR CB C 92 68.564 68.564 68.614 -0.050 18493 4363 1 9 . 1 1 92 92 THR H H 92 9.550 9.550 8.208 1.342 18493 4364 1 9 . 1 1 93 93 MET N N 93 117.153 117.153 119.648 -2.495 18493 4365 1 9 . 1 1 93 93 MET C C 93 176.972 176.972 178.128 -1.156 18493 4366 1 9 . 1 1 93 93 MET CA C 93 62.369 62.369 57.081 5.288 18493 4367 1 9 . 1 1 93 93 MET CB C 93 33.515 33.515 32.125 1.390 18493 4368 1 9 . 1 1 94 94 LEU N N 94 117.981 117.981 121.248 -3.267 18493 4369 1 9 . 1 1 94 94 LEU CA C 94 57.489 57.489 58.861 -1.373 18493 4370 1 9 . 1 1 94 94 LEU CB C 94 41.432 41.432 41.522 -0.090 18493 4371 1 9 . 1 1 94 94 LEU H H 94 8.497 8.497 8.481 0.016 18493 4372 1 9 . 1 1 95 95 GLN C C 95 178.331 178.331 176.579 1.752 18493 4373 1 9 . 1 1 95 95 GLN CA C 95 57.604 57.604 57.529 0.075 18493 4374 1 9 . 1 1 95 95 GLN CB C 95 28.200 28.200 27.599 0.601 18493 4375 1 9 . 1 1 96 96 LEU N N 96 118.174 118.174 118.518 -0.344 18493 4376 1 9 . 1 1 96 96 LEU C C 96 177.842 177.842 174.621 3.221 18493 4377 1 9 . 1 1 96 96 LEU CA C 96 57.747 57.747 54.446 3.301 18493 4378 1 9 . 1 1 96 96 LEU CB C 96 41.721 41.721 44.107 -2.386 18493 4379 1 9 . 1 1 97 97 TYR N N 97 117.359 117.359 116.657 0.702 18493 4380 1 9 . 1 1 97 97 TYR CA C 97 57.581 57.581 55.137 2.444 18493 4381 1 9 . 1 1 97 97 TYR H H 97 8.485 8.485 7.910 0.575 18493 4382 1 9 . 1 1 98 98 PRO CA C 98 63.847 63.847 63.393 0.454 18493 4383 1 9 . 1 1 99 99 SER CA C 99 58.145 58.145 58.530 -0.385 18493 4384 1 9 . 1 1 99 99 SER CB C 99 64.506 64.506 62.615 1.891 18493 4385 1 9 . 1 1 101 101 PHE C C 101 174.992 174.992 176.048 -1.056 18493 4386 1 9 . 1 1 102 102 ALA N N 102 120.614 120.614 128.127 -7.513 18493 4387 1 9 . 1 1 102 102 ALA C C 102 176.810 176.810 176.784 0.026 18493 4388 1 9 . 1 1 102 102 ALA CA C 102 54.355 54.355 52.972 1.383 18493 4389 1 9 . 1 1 102 102 ALA H H 102 7.383 7.383 8.460 -1.077 18493 4390 1 9 . 1 1 103 103 THR N N 103 112.507 112.507 112.176 0.331 18493 4391 1 9 . 1 1 103 103 THR C C 103 175.666 175.666 173.543 2.123 18493 4392 1 9 . 1 1 103 103 THR CA C 103 59.838 59.838 60.754 -0.916 18493 4393 1 9 . 1 1 103 103 THR CB C 103 67.623 67.623 71.466 -3.843 18493 4394 1 9 . 1 1 103 103 THR H H 103 9.278 9.278 7.463 1.815 18493 4395 1 9 . 1 1 104 104 CYS N N 104 122.754 122.754 120.376 2.378 18493 4396 1 9 . 1 1 104 104 CYS C C 104 174.474 174.474 173.630 0.844 18493 4397 1 9 . 1 1 104 104 CYS CA C 104 64.988 64.988 57.418 7.570 18493 4398 1 9 . 1 1 104 104 CYS CB C 104 42.988 42.988 29.365 13.623 18493 4399 1 9 . 1 1 104 104 CYS H H 104 9.934 9.934 8.415 1.519 18493 4400 1 9 . 1 1 105 105 ASP N N 105 121.350 121.350 124.599 -3.249 18493 4401 1 9 . 1 1 105 105 ASP CB C 105 41.030 41.030 43.670 -2.640 18493 4402 1 9 . 1 1 105 105 ASP H H 105 8.153 8.153 8.376 -0.223 18493 4403 1 9 . 1 1 115 115 PRO CA C 115 61.148 61.148 62.776 -1.628 18493 4404 1 9 . 1 1 115 115 PRO CB C 115 30.280 30.280 32.615 -2.335 18493 4405 1 9 . 1 1 116 116 LEU C C 116 178.163 178.163 176.260 1.903 18493 4406 1 9 . 1 1 116 116 LEU CA C 116 58.746 58.746 55.164 3.582 18493 4407 1 9 . 1 1 116 116 LEU CB C 116 42.932 42.932 42.466 0.466 18493 4408 1 9 . 1 1 117 117 ASP N N 117 116.302 116.302 117.234 -0.932 18493 4409 1 9 . 1 1 117 117 ASP C C 117 177.528 177.528 175.679 1.849 18493 4410 1 9 . 1 1 117 117 ASP CB C 117 41.252 41.252 40.879 0.373 18493 4411 1 9 . 1 1 118 118 LYS N N 118 118.983 118.983 120.855 -1.872 18493 4412 1 9 . 1 1 118 118 LYS H H 118 7.538 7.538 8.441 -0.903 18493 4413 1 9 . 1 1 119 119 TRP C C 119 177.867 177.867 176.609 1.258 18493 4414 1 9 . 1 1 120 120 VAL N N 120 113.149 113.149 111.057 2.092 18493 4415 1 9 . 1 1 120 120 VAL CA C 120 58.651 58.651 58.812 -0.161 18493 4416 1 9 . 1 1 120 120 VAL CB C 120 31.821 31.821 32.391 -0.570 18493 4417 1 9 . 1 1 120 120 VAL H H 120 8.936 8.936 7.614 1.322 18493 4418 1 9 . 1 1 121 121 PRO C C 121 178.888 178.888 177.704 1.184 18493 4419 1 9 . 1 1 121 121 PRO CA C 121 65.185 65.185 64.428 0.757 18493 4420 1 9 . 1 1 121 121 PRO CB C 121 31.781 31.781 31.829 -0.048 18493 4421 1 9 . 1 1 122 122 GLN N N 122 116.304 116.304 117.613 -1.309 18493 4422 1 9 . 1 1 122 122 GLN C C 122 174.326 174.326 177.205 -2.879 18493 4423 1 9 . 1 1 122 122 GLN CA C 122 58.463 58.463 58.121 0.342 18493 4424 1 9 . 1 1 122 122 GLN H H 122 9.809 9.809 8.633 1.176 18493 4425 1 9 . 1 1 123 123 VAL N N 123 113.254 113.254 118.473 -5.219 18493 4426 1 9 . 1 1 123 123 VAL C C 123 175.777 175.777 177.270 -1.493 18493 4427 1 9 . 1 1 123 123 VAL CA C 123 61.689 61.689 65.296 -3.607 18493 4428 1 9 . 1 1 123 123 VAL CB C 123 35.373 35.373 31.933 3.440 18493 4429 1 9 . 1 1 123 123 VAL H H 123 8.219 8.219 7.765 0.454 18493 4430 1 9 . 1 1 124 124 PHE N N 124 112.242 112.242 120.287 -8.045 18493 4431 1 9 . 1 1 124 124 PHE C C 124 172.759 172.759 174.627 -1.868 18493 4432 1 9 . 1 1 124 124 PHE CB C 124 39.318 39.318 39.638 -0.320 18493 4433 1 9 . 1 1 125 125 VAL N N 125 115.233 115.233 122.072 -6.839 18493 4434 1 9 . 1 1 125 125 VAL C C 125 177.034 177.034 173.899 3.135 18493 4435 1 9 . 1 1 125 125 VAL CA C 125 61.950 61.950 60.827 1.123 18493 4436 1 9 . 1 1 125 125 VAL CB C 125 33.376 33.376 34.822 -1.446 18493 4437 1 9 . 1 1 125 125 VAL H H 125 7.799 7.799 7.627 0.172 18493 4438 1 9 . 1 1 126 126 ALA N N 126 130.709 130.709 127.393 3.316 18493 4439 1 9 . 1 1 126 126 ALA C C 126 175.920 175.920 176.760 -0.840 18493 4440 1 9 . 1 1 126 126 ALA CA C 126 54.493 54.493 52.594 1.899 18493 4441 1 9 . 1 1 126 126 ALA CB C 126 17.215 17.215 20.041 -2.826 18493 4442 1 9 . 1 1 126 126 ALA H H 126 9.014 9.014 8.574 0.440 18493 4443 1 9 . 1 1 127 127 SER N N 127 112.716 112.716 115.166 -2.450 18493 4444 1 9 . 1 1 127 127 SER CA C 127 58.101 58.101 60.178 -2.077 18493 4445 1 9 . 1 1 127 127 SER CB C 127 64.539 64.539 61.818 2.721 18493 4446 1 9 . 1 1 127 127 SER H H 127 8.145 8.145 8.363 -0.218 18493 4447 1 9 . 1 1 128 128 GLY N N 128 106.487 106.487 111.863 -5.376 18493 4448 1 9 . 1 1 128 128 GLY C C 128 177.047 177.047 173.222 3.825 18493 4449 1 9 . 1 1 128 128 GLY CA C 128 46.296 46.296 45.388 0.908 18493 4450 1 9 . 1 1 128 128 GLY H H 128 8.595 8.595 8.298 0.297 18493 4451 1 9 . 1 1 129 129 ASP C C 129 177.916 177.916 175.283 2.633 18493 4452 1 9 . 1 1 129 129 ASP CB C 129 43.975 43.975 40.699 3.276 18493 4453 1 9 . 1 1 130 130 CYS N N 130 122.984 122.984 120.924 2.060 18493 4454 1 9 . 1 1 130 130 CYS C C 130 173.312 173.312 175.288 -1.976 18493 4455 1 9 . 1 1 130 130 CYS CA C 130 64.581 64.581 58.471 6.110 18493 4456 1 9 . 1 1 130 130 CYS CB C 130 42.879 42.879 28.515 14.364 18493 4457 1 9 . 1 1 130 130 CYS H H 130 9.948 9.948 8.336 1.612 18493 4458 1 9 . 1 1 131 131 ALA N N 131 121.534 121.534 124.650 -3.116 18493 4459 1 9 . 1 1 131 131 ALA CA C 131 52.640 52.640 51.772 0.868 18493 4460 1 9 . 1 1 131 131 ALA CB C 131 18.497 18.497 20.056 -1.559 18493 4461 1 9 . 1 1 131 131 ALA H H 131 9.869 9.869 8.148 1.721 18493 4462 1 9 . 1 1 136 136 ASP C C 136 172.916 172.916 176.332 -3.416 18493 4463 1 9 . 1 1 137 137 PHE N N 137 117.677 117.677 121.168 -3.491 18493 4464 1 9 . 1 1 137 137 PHE CA C 137 57.310 57.310 58.683 -1.373 18493 4465 1 9 . 1 1 137 137 PHE CB C 137 42.927 42.927 38.946 3.981 18493 4466 1 9 . 1 1 137 137 PHE H H 137 8.959 8.959 8.570 0.389 18493 4467 1 9 . 1 1 138 138 LEU CB C 138 43.547 43.547 41.774 1.773 18493 4468 1 9 . 1 1 139 139 GLY C C 139 176.262 176.262 175.083 1.179 18493 4469 1 9 . 1 1 139 139 GLY CA C 139 46.123 46.123 44.980 1.143 18493 4470 1 9 . 1 1 140 140 LEU N N 140 124.207 124.207 125.046 -0.839 18493 4471 1 9 . 1 1 140 140 LEU CB C 140 40.503 40.503 42.046 -1.543 18493 4472 1 9 . 1 1 142 142 MET CA C 142 56.442 56.442 58.651 -2.209 18493 4473 1 9 . 1 1 143 143 PRO CA C 143 63.254 63.254 65.852 -2.598 18493 4474 1 9 . 1 1 144 144 GLN C C 144 177.307 177.307 178.484 -1.177 18493 4475 1 9 . 1 1 145 145 TRP N N 145 120.795 120.795 121.089 -0.294 18493 4476 1 9 . 1 1 145 145 TRP C C 145 178.709 178.709 179.054 -0.345 18493 4477 1 9 . 1 1 145 145 TRP CA C 145 59.535 59.535 59.607 -0.072 18493 4478 1 9 . 1 1 145 145 TRP CB C 145 29.345 29.345 29.019 0.326 18493 4479 1 9 . 1 1 145 145 TRP H H 145 8.386 8.386 7.785 0.601 18493 4480 1 9 . 1 1 146 146 LEU N N 146 118.336 118.336 121.086 -2.750 18493 4481 1 9 . 1 1 146 146 LEU C C 146 177.115 177.115 179.112 -1.997 18493 4482 1 9 . 1 1 146 146 LEU CA C 146 57.793 57.793 58.017 -0.224 18493 4483 1 9 . 1 1 146 146 LEU CB C 146 41.616 41.616 41.143 0.473 18493 4484 1 9 . 1 1 146 146 LEU H H 146 9.033 9.033 8.209 0.824 18493 4485 1 9 . 1 1 147 147 LEU N N 147 123.772 123.772 119.200 4.572 18493 4486 1 9 . 1 1 147 147 LEU C C 147 178.787 178.787 178.430 0.357 18493 4487 1 9 . 1 1 147 147 LEU CA C 147 58.052 58.052 58.031 0.021 18493 4488 1 9 . 1 1 147 147 LEU CB C 147 41.047 41.047 41.564 -0.517 18493 4489 1 9 . 1 1 147 147 LEU H H 147 8.480 8.480 8.224 0.256 18493 4490 1 9 . 1 1 148 148 GLY N N 148 104.457 104.457 108.060 -3.603 18493 4491 1 9 . 1 1 148 148 GLY C C 148 174.667 174.667 176.423 -1.756 18493 4492 1 9 . 1 1 148 148 GLY CA C 148 48.102 48.102 47.392 0.710 18493 4493 1 9 . 1 1 149 149 ILE N N 149 121.815 121.815 121.986 -0.171 18493 4494 1 9 . 1 1 149 149 ILE C C 149 177.725 177.725 176.664 1.061 18493 4495 1 9 . 1 1 149 149 ILE CA C 149 65.997 65.997 63.916 2.081 18493 4496 1 9 . 1 1 149 149 ILE CB C 149 38.262 38.262 37.558 0.704 18493 4497 1 9 . 1 1 150 150 PHE N N 150 118.894 118.894 120.384 -1.490 18493 4498 1 9 . 1 1 150 150 PHE C C 150 178.929 178.929 177.779 1.150 18493 4499 1 9 . 1 1 150 150 PHE CA C 150 63.591 63.591 61.793 1.798 18493 4500 1 9 . 1 1 150 150 PHE CB C 150 38.417 38.417 38.534 -0.117 18493 4501 1 9 . 1 1 151 151 ILE N N 151 120.535 120.535 119.705 0.830 18493 4502 1 9 . 1 1 151 151 ILE C C 151 177.347 177.347 177.384 -0.037 18493 4503 1 9 . 1 1 151 151 ILE CA C 151 66.478 66.478 64.290 2.188 18493 4504 1 9 . 1 1 151 151 ILE CB C 151 37.302 37.302 37.428 -0.126 18493 4505 1 9 . 1 1 152 152 ALA N N 152 122.855 122.855 123.773 -0.918 18493 4506 1 9 . 1 1 152 152 ALA C C 152 179.165 179.165 179.392 -0.227 18493 4507 1 9 . 1 1 152 152 ALA CA C 152 56.272 56.272 55.292 0.980 18493 4508 1 9 . 1 1 152 152 ALA CB C 152 17.993 17.993 17.862 0.131 18493 4509 1 9 . 1 1 153 153 TYR N N 153 116.156 116.156 119.920 -3.764 18493 4510 1 9 . 1 1 153 153 TYR C C 153 179.682 179.682 178.168 1.514 18493 4511 1 9 . 1 1 153 153 TYR CA C 153 64.391 64.391 62.425 1.966 18493 4512 1 9 . 1 1 153 153 TYR CB C 153 39.553 39.553 38.850 0.703 18493 4513 1 9 . 1 1 153 153 TYR H H 153 8.680 8.680 8.839 -0.159 18493 4514 1 9 . 1 1 154 154 LEU N N 154 122.327 122.327 121.291 1.036 18493 4515 1 9 . 1 1 154 154 LEU C C 154 177.336 177.336 178.684 -1.348 18493 4516 1 9 . 1 1 154 154 LEU CA C 154 57.905 57.905 58.538 -0.634 18493 4517 1 9 . 1 1 154 154 LEU CB C 154 42.009 42.009 42.058 -0.049 18493 4518 1 9 . 1 1 155 155 ILE N N 155 119.079 119.079 119.769 -0.690 18493 4519 1 9 . 1 1 155 155 ILE C C 155 177.589 177.589 178.161 -0.572 18493 4520 1 9 . 1 1 155 155 ILE CA C 155 65.996 65.996 65.536 0.460 18493 4521 1 9 . 1 1 155 155 ILE CB C 155 38.179 38.179 38.344 -0.165 18493 4522 1 9 . 1 1 156 156 VAL N N 156 117.551 117.551 120.325 -2.774 18493 4523 1 9 . 1 1 156 156 VAL C C 156 176.163 176.163 177.022 -0.859 18493 4524 1 9 . 1 1 156 156 VAL CA C 156 67.664 67.664 66.235 1.429 18493 4525 1 9 . 1 1 156 156 VAL CB C 156 31.694 31.694 31.291 0.403 18493 4526 1 9 . 1 1 157 157 ALA N N 157 122.470 122.470 120.900 1.570 18493 4527 1 9 . 1 1 157 157 ALA C C 157 179.076 179.076 178.825 0.251 18493 4528 1 9 . 1 1 157 157 ALA CA C 157 54.803 54.803 54.289 0.514 18493 4529 1 9 . 1 1 157 157 ALA CB C 157 16.120 16.120 19.005 -2.885 18493 4530 1 9 . 1 1 158 158 VAL N N 158 116.045 116.045 116.285 -0.240 18493 4531 1 9 . 1 1 158 158 VAL C C 158 177.491 177.491 177.196 0.295 18493 4532 1 9 . 1 1 158 158 VAL CA C 158 67.160 67.160 64.981 2.179 18493 4533 1 9 . 1 1 158 158 VAL CB C 158 31.331 31.331 32.447 -1.116 18493 4534 1 9 . 1 1 159 159 LEU N N 159 116.776 116.776 121.424 -4.648 18493 4535 1 9 . 1 1 159 159 LEU C C 159 178.312 178.312 178.428 -0.116 18493 4536 1 9 . 1 1 159 159 LEU CA C 159 57.443 57.443 57.547 -0.104 18493 4537 1 9 . 1 1 159 159 LEU CB C 159 41.567 41.567 41.353 0.214 18493 4538 1 9 . 1 1 160 160 VAL N N 160 118.890 118.890 118.893 -0.003 18493 4539 1 9 . 1 1 160 160 VAL C C 160 177.508 177.508 177.107 0.401 18493 4540 1 9 . 1 1 160 160 VAL CA C 160 67.366 67.366 65.024 2.342 18493 4541 1 9 . 1 1 160 160 VAL CB C 160 31.106 31.106 31.817 -0.711 18493 4542 1 9 . 1 1 161 161 VAL N N 161 118.360 118.360 120.480 -2.120 18493 4543 1 9 . 1 1 161 161 VAL C C 161 176.607 176.607 175.774 0.833 18493 4544 1 9 . 1 1 161 161 VAL CA C 161 67.614 67.614 64.640 2.974 18493 4545 1 9 . 1 1 161 161 VAL CB C 161 31.646 31.646 32.672 -1.026 18493 4546 1 10 . 1 1 11 11 GLY N N 11 108.456 108.456 110.665 -2.209 18493 4547 1 10 . 1 1 11 11 GLY H H 11 8.433 8.433 8.058 0.375 18493 4548 1 10 . 1 1 12 12 ARG C C 12 178.053 178.053 178.220 -0.167 18493 4549 1 10 . 1 1 12 12 ARG CA C 12 57.504 57.504 58.410 -0.906 18493 4550 1 10 . 1 1 12 12 ARG CB C 12 30.522 30.522 30.243 0.279 18493 4551 1 10 . 1 1 13 13 GLY N N 13 108.265 108.265 107.181 1.084 18493 4552 1 10 . 1 1 13 13 GLY C C 13 175.091 175.091 176.224 -1.133 18493 4553 1 10 . 1 1 13 13 GLY CA C 13 45.326 45.326 46.730 -1.404 18493 4554 1 10 . 1 1 14 14 ALA N N 14 123.181 123.181 123.251 -0.070 18493 4555 1 10 . 1 1 14 14 ALA C C 14 179.173 179.173 179.832 -0.659 18493 4556 1 10 . 1 1 14 14 ALA CA C 14 55.061 55.061 54.859 0.202 18493 4557 1 10 . 1 1 14 14 ALA H H 14 9.285 9.285 8.579 0.706 18493 4558 1 10 . 1 1 15 15 TRP N N 15 116.733 116.733 118.496 -1.763 18493 4559 1 10 . 1 1 15 15 TRP C C 15 179.425 179.425 178.508 0.917 18493 4560 1 10 . 1 1 15 15 TRP CA C 15 58.960 58.960 58.035 0.925 18493 4561 1 10 . 1 1 15 15 TRP CB C 15 29.529 29.529 29.348 0.181 18493 4562 1 10 . 1 1 15 15 TRP H H 15 7.091 7.091 7.585 -0.494 18493 4563 1 10 . 1 1 16 16 LEU N N 16 118.671 118.671 121.216 -2.545 18493 4564 1 10 . 1 1 16 16 LEU C C 16 178.461 178.461 179.339 -0.878 18493 4565 1 10 . 1 1 16 16 LEU CA C 16 58.246 58.246 58.530 -0.284 18493 4566 1 10 . 1 1 16 16 LEU CB C 16 41.369 41.369 41.785 -0.416 18493 4567 1 10 . 1 1 16 16 LEU H H 16 9.180 9.180 8.820 0.360 18493 4568 1 10 . 1 1 17 17 LEU N N 17 118.515 118.515 120.212 -1.697 18493 4569 1 10 . 1 1 17 17 LEU C C 17 178.787 178.787 178.535 0.252 18493 4570 1 10 . 1 1 17 17 LEU CA C 17 57.832 57.832 58.697 -0.865 18493 4571 1 10 . 1 1 17 17 LEU CB C 17 41.395 41.395 41.961 -0.566 18493 4572 1 10 . 1 1 18 18 MET N N 18 120.633 120.633 118.929 1.704 18493 4573 1 10 . 1 1 18 18 MET C C 18 180.469 180.469 179.022 1.447 18493 4574 1 10 . 1 1 18 18 MET CA C 18 60.277 60.277 57.805 2.472 18493 4575 1 10 . 1 1 18 18 MET CB C 18 31.789 31.789 31.695 0.094 18493 4576 1 10 . 1 1 19 19 ALA N N 19 123.958 123.958 122.260 1.698 18493 4577 1 10 . 1 1 19 19 ALA C C 19 178.210 178.210 179.099 -0.889 18493 4578 1 10 . 1 1 19 19 ALA CA C 19 55.468 55.468 55.393 0.075 18493 4579 1 10 . 1 1 19 19 ALA CB C 19 17.865 17.865 18.333 -0.468 18493 4580 1 10 . 1 1 19 19 ALA H H 19 9.398 9.398 8.600 0.798 18493 4581 1 10 . 1 1 20 20 PHE N N 20 118.424 118.424 119.028 -0.604 18493 4582 1 10 . 1 1 20 20 PHE C C 20 176.674 176.674 177.102 -0.428 18493 4583 1 10 . 1 1 20 20 PHE CA C 20 62.546 62.546 61.340 1.206 18493 4584 1 10 . 1 1 20 20 PHE CB C 20 38.697 38.697 39.211 -0.514 18493 4585 1 10 . 1 1 21 21 THR N N 21 109.220 109.220 115.240 -6.020 18493 4586 1 10 . 1 1 21 21 THR C C 21 174.203 174.203 176.825 -2.622 18493 4587 1 10 . 1 1 21 21 THR CA C 21 66.052 66.052 66.769 -0.717 18493 4588 1 10 . 1 1 21 21 THR CB C 21 68.956 68.956 68.094 0.862 18493 4589 1 10 . 1 1 22 22 ALA N N 22 123.662 123.662 126.567 -2.905 18493 4590 1 10 . 1 1 22 22 ALA C C 22 179.488 179.488 179.944 -0.456 18493 4591 1 10 . 1 1 22 22 ALA CA C 22 54.847 54.847 54.450 0.397 18493 4592 1 10 . 1 1 22 22 ALA CB C 22 17.801 17.801 17.848 -0.047 18493 4593 1 10 . 1 1 23 23 LEU N N 23 118.917 118.917 120.329 -1.412 18493 4594 1 10 . 1 1 23 23 LEU C C 23 178.028 178.028 178.917 -0.889 18493 4595 1 10 . 1 1 23 23 LEU CA C 23 57.713 57.713 57.758 -0.045 18493 4596 1 10 . 1 1 23 23 LEU CB C 23 41.506 41.506 40.802 0.704 18493 4597 1 10 . 1 1 23 23 LEU H H 23 8.581 8.581 7.973 0.608 18493 4598 1 10 . 1 1 24 24 ALA N N 24 119.931 119.931 121.283 -1.352 18493 4599 1 10 . 1 1 24 24 ALA C C 24 180.617 180.617 179.543 1.074 18493 4600 1 10 . 1 1 24 24 ALA CA C 24 55.350 55.350 54.855 0.495 18493 4601 1 10 . 1 1 24 24 ALA CB C 24 17.583 17.583 17.666 -0.083 18493 4602 1 10 . 1 1 25 25 LEU N N 25 119.691 119.691 118.104 1.587 18493 4603 1 10 . 1 1 25 25 LEU CA C 25 58.078 58.078 57.676 0.402 18493 4604 1 10 . 1 1 25 25 LEU CB C 25 43.597 43.597 42.136 1.461 18493 4605 1 10 . 1 1 25 25 LEU H H 25 9.179 9.179 8.356 0.823 18493 4606 1 10 . 1 1 26 26 GLU N N 26 119.651 119.651 116.222 3.429 18493 4607 1 10 . 1 1 26 26 GLU C C 26 179.334 179.334 179.281 0.053 18493 4608 1 10 . 1 1 26 26 GLU CA C 26 59.584 59.584 57.342 2.242 18493 4609 1 10 . 1 1 26 26 GLU CB C 26 27.202 27.202 29.486 -2.284 18493 4610 1 10 . 1 1 27 27 LEU N N 27 119.661 119.661 121.994 -2.333 18493 4611 1 10 . 1 1 27 27 LEU CA C 27 57.887 57.887 57.403 0.484 18493 4612 1 10 . 1 1 27 27 LEU CB C 27 41.591 41.591 41.109 0.482 18493 4613 1 10 . 1 1 27 27 LEU H H 27 9.410 9.410 8.243 1.167 18493 4614 1 10 . 1 1 28 28 THR N N 28 118.484 118.484 113.573 4.911 18493 4615 1 10 . 1 1 28 28 THR C C 28 175.898 175.898 176.603 -0.705 18493 4616 1 10 . 1 1 28 28 THR CA C 28 67.459 67.459 66.140 1.319 18493 4617 1 10 . 1 1 28 28 THR CB C 28 67.948 67.948 68.029 -0.081 18493 4618 1 10 . 1 1 29 29 ALA N N 29 122.643 122.643 125.106 -2.463 18493 4619 1 10 . 1 1 29 29 ALA C C 29 179.717 179.717 179.651 0.066 18493 4620 1 10 . 1 1 29 29 ALA CA C 29 55.919 55.919 54.946 0.973 18493 4621 1 10 . 1 1 29 29 ALA CB C 29 16.837 16.837 18.025 -1.188 18493 4622 1 10 . 1 1 29 29 ALA H H 29 8.302 8.302 7.402 0.900 18493 4623 1 10 . 1 1 30 30 LEU N N 30 117.408 117.408 116.350 1.058 18493 4624 1 10 . 1 1 30 30 LEU C C 30 178.143 178.143 179.146 -1.003 18493 4625 1 10 . 1 1 30 30 LEU CA C 30 57.384 57.384 57.313 0.071 18493 4626 1 10 . 1 1 30 30 LEU CB C 30 41.679 41.679 40.947 0.732 18493 4627 1 10 . 1 1 30 30 LEU H H 30 8.412 8.412 8.397 0.015 18493 4628 1 10 . 1 1 31 31 TRP N N 31 125.692 125.692 121.732 3.960 18493 4629 1 10 . 1 1 31 31 TRP C C 31 179.053 179.053 177.996 1.057 18493 4630 1 10 . 1 1 31 31 TRP CA C 31 59.005 59.005 60.206 -1.200 18493 4631 1 10 . 1 1 31 31 TRP CB C 31 28.142 28.142 29.062 -0.920 18493 4632 1 10 . 1 1 31 31 TRP H H 31 9.157 9.157 8.110 1.047 18493 4633 1 10 . 1 1 32 32 PHE N N 32 119.195 119.195 119.214 -0.019 18493 4634 1 10 . 1 1 32 32 PHE CA C 32 61.557 61.557 60.558 0.999 18493 4635 1 10 . 1 1 32 32 PHE CB C 32 38.384 38.384 37.685 0.698 18493 4636 1 10 . 1 1 32 32 PHE H H 32 9.374 9.374 7.778 1.596 18493 4637 1 10 . 1 1 33 33 GLN C C 33 177.477 177.477 177.517 -0.040 18493 4638 1 10 . 1 1 33 33 GLN CA C 33 56.613 56.613 58.470 -1.857 18493 4639 1 10 . 1 1 33 33 GLN CB C 33 29.433 29.433 27.627 1.806 18493 4640 1 10 . 1 1 34 34 HIS N N 34 115.948 115.948 117.902 -1.954 18493 4641 1 10 . 1 1 34 34 HIS C C 34 175.548 175.548 177.497 -1.949 18493 4642 1 10 . 1 1 34 34 HIS CA C 34 58.733 58.733 58.284 0.449 18493 4643 1 10 . 1 1 34 34 HIS CB C 34 32.084 32.084 29.458 2.626 18493 4644 1 10 . 1 1 34 34 HIS H H 34 9.621 9.621 7.935 1.686 18493 4645 1 10 . 1 1 35 35 VAL N N 35 116.902 116.902 118.740 -1.838 18493 4646 1 10 . 1 1 35 35 VAL C C 35 177.853 177.853 177.029 0.824 18493 4647 1 10 . 1 1 35 35 VAL CA C 35 64.075 64.075 65.241 -1.166 18493 4648 1 10 . 1 1 35 35 VAL CB C 35 30.626 30.626 31.527 -0.901 18493 4649 1 10 . 1 1 36 36 MET N N 36 114.145 114.145 115.904 -1.759 18493 4650 1 10 . 1 1 36 36 MET C C 36 175.905 175.905 176.677 -0.772 18493 4651 1 10 . 1 1 36 36 MET H H 36 7.605 7.605 7.476 0.129 18493 4652 1 10 . 1 1 37 37 LEU N N 37 111.740 111.740 115.213 -3.473 18493 4653 1 10 . 1 1 37 37 LEU H H 37 7.121 7.121 7.768 -0.647 18493 4654 1 10 . 1 1 38 38 LEU C C 38 176.457 176.457 175.153 1.304 18493 4655 1 10 . 1 1 39 39 LYS N N 39 121.418 121.418 125.522 -4.104 18493 4656 1 10 . 1 1 39 39 LYS CA C 39 57.471 57.471 55.970 1.501 18493 4657 1 10 . 1 1 39 39 LYS H H 39 9.359 9.359 8.228 1.131 18493 4658 1 10 . 1 1 40 40 PRO CA C 40 60.451 60.451 64.352 -3.901 18493 4659 1 10 . 1 1 42 42 VAL N N 42 118.166 118.166 118.947 -0.781 18493 4660 1 10 . 1 1 42 42 VAL C C 42 179.261 179.261 176.856 2.405 18493 4661 1 10 . 1 1 42 42 VAL CA C 42 67.223 67.223 63.780 3.443 18493 4662 1 10 . 1 1 42 42 VAL CB C 42 30.941 30.941 31.106 -0.165 18493 4663 1 10 . 1 1 43 43 LEU N N 43 115.946 115.946 116.680 -0.734 18493 4664 1 10 . 1 1 43 43 LEU C C 43 178.293 178.293 178.369 -0.076 18493 4665 1 10 . 1 1 43 43 LEU CA C 43 57.129 57.129 54.984 2.145 18493 4666 1 10 . 1 1 43 43 LEU CB C 43 41.030 41.030 39.596 1.434 18493 4667 1 10 . 1 1 44 44 CYS N N 44 115.006 115.006 121.117 -6.111 18493 4668 1 10 . 1 1 44 44 CYS C C 44 177.484 177.484 176.546 0.938 18493 4669 1 10 . 1 1 44 44 CYS CA C 44 59.760 59.760 64.022 -4.262 18493 4670 1 10 . 1 1 44 44 CYS CB C 44 30.651 30.651 26.853 3.798 18493 4671 1 10 . 1 1 44 44 CYS H H 44 7.683 7.683 8.642 -0.959 18493 4672 1 10 . 1 1 45 45 ILE N N 45 119.384 119.384 120.034 -0.650 18493 4673 1 10 . 1 1 45 45 ILE C C 45 179.575 179.575 176.973 2.602 18493 4674 1 10 . 1 1 45 45 ILE CA C 45 62.068 62.068 64.681 -2.613 18493 4675 1 10 . 1 1 45 45 ILE CB C 45 33.583 33.583 37.528 -3.945 18493 4676 1 10 . 1 1 46 46 TYR N N 46 120.126 120.126 119.737 0.389 18493 4677 1 10 . 1 1 46 46 TYR C C 46 178.397 178.397 176.548 1.849 18493 4678 1 10 . 1 1 46 46 TYR CA C 46 59.129 59.129 61.587 -2.458 18493 4679 1 10 . 1 1 46 46 TYR CB C 46 35.347 35.347 38.985 -3.638 18493 4680 1 10 . 1 1 46 46 TYR H H 46 8.958 8.958 7.911 1.047 18493 4681 1 10 . 1 1 47 47 GLU N N 47 121.779 121.779 117.890 3.889 18493 4682 1 10 . 1 1 47 47 GLU C C 47 179.907 179.907 178.304 1.603 18493 4683 1 10 . 1 1 47 47 GLU CA C 47 57.985 57.985 57.840 0.145 18493 4684 1 10 . 1 1 47 47 GLU CB C 47 27.290 27.290 30.259 -2.969 18493 4685 1 10 . 1 1 47 47 GLU H H 47 9.681 9.681 7.578 2.103 18493 4686 1 10 . 1 1 48 48 ARG N N 48 119.188 119.188 121.541 -2.353 18493 4687 1 10 . 1 1 48 48 ARG C C 48 181.638 181.638 178.566 3.072 18493 4688 1 10 . 1 1 48 48 ARG CA C 48 60.299 60.299 58.552 1.747 18493 4689 1 10 . 1 1 48 48 ARG CB C 48 30.167 30.167 29.608 0.559 18493 4690 1 10 . 1 1 48 48 ARG H H 48 9.213 9.213 8.700 0.513 18493 4691 1 10 . 1 1 49 49 VAL N N 49 121.326 121.326 120.845 0.481 18493 4692 1 10 . 1 1 49 49 VAL C C 49 177.326 177.326 177.112 0.214 18493 4693 1 10 . 1 1 49 49 VAL CA C 49 66.624 66.624 65.762 0.862 18493 4694 1 10 . 1 1 49 49 VAL CB C 49 31.280 31.280 31.160 0.120 18493 4695 1 10 . 1 1 50 50 ALA N N 50 122.955 122.955 122.178 0.777 18493 4696 1 10 . 1 1 50 50 ALA C C 50 179.594 179.594 179.853 -0.259 18493 4697 1 10 . 1 1 50 50 ALA CA C 50 55.902 55.902 55.094 0.808 18493 4698 1 10 . 1 1 50 50 ALA CB C 50 16.623 16.623 18.275 -1.652 18493 4699 1 10 . 1 1 51 51 LEU N N 51 115.737 115.737 119.244 -3.507 18493 4700 1 10 . 1 1 51 51 LEU C C 51 177.990 177.990 178.349 -0.359 18493 4701 1 10 . 1 1 51 51 LEU CA C 51 57.285 57.285 58.378 -1.093 18493 4702 1 10 . 1 1 51 51 LEU CB C 51 41.369 41.369 40.742 0.627 18493 4703 1 10 . 1 1 52 52 PHE N N 52 122.707 122.707 118.047 4.660 18493 4704 1 10 . 1 1 52 52 PHE C C 52 179.142 179.142 178.253 0.889 18493 4705 1 10 . 1 1 52 52 PHE CA C 52 62.518 62.518 61.468 1.050 18493 4706 1 10 . 1 1 52 52 PHE CB C 52 38.538 38.538 38.324 0.214 18493 4707 1 10 . 1 1 52 52 PHE H H 52 8.863 8.863 7.759 1.104 18493 4708 1 10 . 1 1 53 53 GLY N N 53 110.801 110.801 108.648 2.153 18493 4709 1 10 . 1 1 53 53 GLY C C 53 175.378 175.378 176.311 -0.933 18493 4710 1 10 . 1 1 53 53 GLY CA C 53 48.024 48.024 47.343 0.681 18493 4711 1 10 . 1 1 53 53 GLY H H 53 9.027 9.027 8.584 0.443 18493 4712 1 10 . 1 1 54 54 VAL N N 54 121.926 121.926 123.758 -1.832 18493 4713 1 10 . 1 1 54 54 VAL C C 54 177.035 177.035 177.642 -0.607 18493 4714 1 10 . 1 1 54 54 VAL CA C 54 67.448 67.448 65.633 1.815 18493 4715 1 10 . 1 1 54 54 VAL CB C 54 31.246 31.246 31.447 -0.201 18493 4716 1 10 . 1 1 54 54 VAL H H 54 7.948 7.948 8.592 -0.644 18493 4717 1 10 . 1 1 55 55 LEU N N 55 119.894 119.894 121.527 -1.633 18493 4718 1 10 . 1 1 55 55 LEU C C 55 178.175 178.175 178.425 -0.250 18493 4719 1 10 . 1 1 55 55 LEU CA C 55 58.490 58.490 58.209 0.281 18493 4720 1 10 . 1 1 55 55 LEU CB C 55 42.145 42.145 40.609 1.536 18493 4721 1 10 . 1 1 55 55 LEU H H 55 8.646 8.646 8.990 -0.344 18493 4722 1 10 . 1 1 56 56 GLY N N 56 106.262 106.262 106.643 -0.381 18493 4723 1 10 . 1 1 56 56 GLY C C 56 174.618 174.618 175.597 -0.979 18493 4724 1 10 . 1 1 56 56 GLY CA C 56 47.533 47.533 47.606 -0.073 18493 4725 1 10 . 1 1 57 57 ALA N N 57 123.002 123.002 124.502 -1.500 18493 4726 1 10 . 1 1 57 57 ALA C C 57 178.688 178.688 179.160 -0.472 18493 4727 1 10 . 1 1 57 57 ALA CA C 57 55.548 55.548 54.854 0.694 18493 4728 1 10 . 1 1 57 57 ALA CB C 57 18.065 18.065 18.240 -0.175 18493 4729 1 10 . 1 1 58 58 ALA N N 58 118.866 118.866 119.469 -0.603 18493 4730 1 10 . 1 1 58 58 ALA C C 58 179.348 179.348 179.118 0.230 18493 4731 1 10 . 1 1 58 58 ALA CA C 58 54.763 54.763 54.356 0.407 18493 4732 1 10 . 1 1 58 58 ALA CB C 58 17.898 17.898 18.256 -0.358 18493 4733 1 10 . 1 1 58 58 ALA H H 58 8.674 8.674 7.559 1.115 18493 4734 1 10 . 1 1 59 59 LEU N N 59 115.384 115.384 118.724 -3.340 18493 4735 1 10 . 1 1 59 59 LEU C C 59 177.654 177.654 178.669 -1.015 18493 4736 1 10 . 1 1 59 59 LEU CA C 59 57.387 57.387 57.523 -0.136 18493 4737 1 10 . 1 1 59 59 LEU CB C 59 41.209 41.209 42.190 -0.981 18493 4738 1 10 . 1 1 60 60 ILE N N 60 116.140 116.140 113.499 2.641 18493 4739 1 10 . 1 1 60 60 ILE C C 60 180.024 180.024 176.896 3.128 18493 4740 1 10 . 1 1 60 60 ILE CA C 60 64.263 64.263 63.303 0.960 18493 4741 1 10 . 1 1 60 60 ILE CB C 60 37.240 37.240 37.625 -0.385 18493 4742 1 10 . 1 1 61 61 GLY N N 61 110.127 110.127 106.842 3.285 18493 4743 1 10 . 1 1 61 61 GLY C C 61 173.716 173.716 174.191 -0.475 18493 4744 1 10 . 1 1 61 61 GLY CA C 61 45.617 45.617 44.740 0.877 18493 4745 1 10 . 1 1 61 61 GLY H H 61 9.046 9.046 7.766 1.280 18493 4746 1 10 . 1 1 62 62 ALA N N 62 118.949 118.949 123.060 -4.111 18493 4747 1 10 . 1 1 62 62 ALA C C 62 176.192 176.192 179.032 -2.840 18493 4748 1 10 . 1 1 62 62 ALA CA C 62 53.268 53.268 52.604 0.664 18493 4749 1 10 . 1 1 62 62 ALA CB C 62 19.138 19.138 20.222 -1.084 18493 4750 1 10 . 1 1 62 62 ALA H H 62 8.066 8.066 7.163 0.903 18493 4751 1 10 . 1 1 63 63 ILE N N 63 116.800 116.800 120.418 -3.618 18493 4752 1 10 . 1 1 63 63 ILE CA C 63 66.739 66.739 63.641 3.098 18493 4753 1 10 . 1 1 63 63 ILE CB C 63 37.947 37.947 38.165 -0.218 18493 4754 1 10 . 1 1 64 64 ALA N N 64 123.957 123.957 120.735 3.222 18493 4755 1 10 . 1 1 64 64 ALA CA C 64 52.934 52.934 48.511 4.423 18493 4756 1 10 . 1 1 64 64 ALA CB C 64 19.428 19.428 18.963 0.465 18493 4757 1 10 . 1 1 65 65 PRO CA C 65 65.350 65.350 62.941 2.409 18493 4758 1 10 . 1 1 66 66 LYS N N 66 116.618 116.618 116.674 -0.056 18493 4759 1 10 . 1 1 66 66 LYS C C 66 177.500 177.500 176.302 1.198 18493 4760 1 10 . 1 1 66 66 LYS CA C 66 56.547 56.547 58.301 -1.754 18493 4761 1 10 . 1 1 66 66 LYS CB C 66 30.522 30.522 31.287 -0.765 18493 4762 1 10 . 1 1 67 67 THR CA C 67 60.452 60.452 59.370 1.083 18493 4763 1 10 . 1 1 67 67 THR CB C 67 69.948 69.948 69.222 0.726 18493 4764 1 10 . 1 1 68 68 PRO C C 68 177.070 177.070 177.566 -0.496 18493 4765 1 10 . 1 1 68 68 PRO CA C 68 63.315 63.315 62.888 0.427 18493 4766 1 10 . 1 1 68 68 PRO CB C 68 32.458 32.458 32.039 0.419 18493 4767 1 10 . 1 1 69 69 LEU N N 69 121.517 121.517 117.589 3.928 18493 4768 1 10 . 1 1 69 69 LEU C C 69 179.448 179.448 178.301 1.147 18493 4769 1 10 . 1 1 69 69 LEU CA C 69 57.389 57.389 56.915 0.474 18493 4770 1 10 . 1 1 69 69 LEU CB C 69 42.737 42.737 40.407 2.330 18493 4771 1 10 . 1 1 69 69 LEU H H 69 8.882 8.882 8.363 0.519 18493 4772 1 10 . 1 1 70 70 ARG N N 70 114.028 114.028 117.201 -3.173 18493 4773 1 10 . 1 1 70 70 ARG C C 70 177.925 177.925 176.597 1.328 18493 4774 1 10 . 1 1 70 70 ARG CA C 70 58.429 58.429 57.850 0.579 18493 4775 1 10 . 1 1 70 70 ARG CB C 70 29.391 29.391 28.786 0.605 18493 4776 1 10 . 1 1 70 70 ARG H H 70 8.202 8.202 8.213 -0.011 18493 4777 1 10 . 1 1 71 71 TYR N N 71 121.740 121.740 118.180 3.560 18493 4778 1 10 . 1 1 71 71 TYR CA C 71 57.374 57.374 61.109 -3.735 18493 4779 1 10 . 1 1 71 71 TYR H H 71 8.136 8.136 7.466 0.670 18493 4780 1 10 . 1 1 72 72 VAL N N 72 118.416 118.416 117.963 0.453 18493 4781 1 10 . 1 1 72 72 VAL C C 72 177.702 177.702 177.317 0.385 18493 4782 1 10 . 1 1 72 72 VAL CA C 72 66.098 66.098 65.106 0.992 18493 4783 1 10 . 1 1 72 72 VAL CB C 72 31.343 31.343 30.457 0.886 18493 4784 1 10 . 1 1 73 73 ALA N N 73 120.283 120.283 123.116 -2.833 18493 4785 1 10 . 1 1 73 73 ALA C C 73 179.763 179.763 179.479 0.284 18493 4786 1 10 . 1 1 73 73 ALA CA C 73 55.785 55.785 55.291 0.494 18493 4787 1 10 . 1 1 73 73 ALA CB C 73 19.265 19.265 18.469 0.796 18493 4788 1 10 . 1 1 73 73 ALA H H 73 9.015 9.015 8.360 0.655 18493 4789 1 10 . 1 1 74 74 MET N N 74 115.547 115.547 116.796 -1.249 18493 4790 1 10 . 1 1 74 74 MET C C 74 177.223 177.223 178.797 -1.574 18493 4791 1 10 . 1 1 74 74 MET CA C 74 61.023 61.023 56.990 4.033 18493 4792 1 10 . 1 1 74 74 MET CB C 74 33.777 33.777 31.118 2.659 18493 4793 1 10 . 1 1 74 74 MET H H 74 8.163 8.163 7.858 0.305 18493 4794 1 10 . 1 1 75 75 VAL N N 75 118.690 118.690 120.210 -1.520 18493 4795 1 10 . 1 1 75 75 VAL C C 75 177.166 177.166 178.461 -1.295 18493 4796 1 10 . 1 1 75 75 VAL CA C 75 67.581 67.581 66.905 0.676 18493 4797 1 10 . 1 1 75 75 VAL CB C 75 31.408 31.408 31.252 0.157 18493 4798 1 10 . 1 1 75 75 VAL H H 75 7.554 7.554 7.550 0.004 18493 4799 1 10 . 1 1 76 76 ILE N N 76 118.959 118.959 120.823 -1.864 18493 4800 1 10 . 1 1 76 76 ILE C C 76 178.680 178.680 177.596 1.084 18493 4801 1 10 . 1 1 76 76 ILE CA C 76 65.839 65.839 64.755 1.084 18493 4802 1 10 . 1 1 76 76 ILE CB C 76 38.414 38.414 37.793 0.621 18493 4803 1 10 . 1 1 77 77 TRP N N 77 125.440 125.440 122.115 3.325 18493 4804 1 10 . 1 1 77 77 TRP C C 77 177.153 177.153 179.143 -1.990 18493 4805 1 10 . 1 1 77 77 TRP CA C 77 58.779 58.779 60.349 -1.570 18493 4806 1 10 . 1 1 77 77 TRP CB C 77 30.494 30.494 29.162 1.332 18493 4807 1 10 . 1 1 77 77 TRP H H 77 9.515 9.515 8.304 1.211 18493 4808 1 10 . 1 1 78 78 LEU N N 78 118.968 118.968 121.574 -2.606 18493 4809 1 10 . 1 1 78 78 LEU C C 78 178.381 178.381 178.540 -0.159 18493 4810 1 10 . 1 1 78 78 LEU CA C 78 58.041 58.041 58.508 -0.467 18493 4811 1 10 . 1 1 78 78 LEU CB C 78 43.807 43.807 41.732 2.075 18493 4812 1 10 . 1 1 78 78 LEU H H 78 9.367 9.367 8.691 0.676 18493 4813 1 10 . 1 1 79 79 TYR N N 79 118.181 118.181 119.230 -1.049 18493 4814 1 10 . 1 1 79 79 TYR C C 79 176.777 176.777 177.561 -0.784 18493 4815 1 10 . 1 1 79 79 TYR CA C 79 62.849 62.849 61.687 1.162 18493 4816 1 10 . 1 1 80 80 SER N N 80 114.286 114.286 115.761 -1.475 18493 4817 1 10 . 1 1 80 80 SER C C 80 175.943 175.943 176.546 -0.603 18493 4818 1 10 . 1 1 80 80 SER CA C 80 63.515 63.515 61.350 2.165 18493 4819 1 10 . 1 1 80 80 SER CB C 80 63.941 63.941 62.867 1.074 18493 4820 1 10 . 1 1 81 81 ALA N N 81 121.070 121.070 123.882 -2.812 18493 4821 1 10 . 1 1 81 81 ALA C C 81 178.208 178.208 179.427 -1.219 18493 4822 1 10 . 1 1 81 81 ALA CA C 81 55.224 55.224 53.854 1.370 18493 4823 1 10 . 1 1 81 81 ALA CB C 81 17.897 17.897 18.971 -1.073 18493 4824 1 10 . 1 1 82 82 PHE N N 82 117.560 117.560 121.596 -4.036 18493 4825 1 10 . 1 1 82 82 PHE C C 82 176.975 176.975 177.739 -0.764 18493 4826 1 10 . 1 1 82 82 PHE CA C 82 62.132 62.132 61.459 0.673 18493 4827 1 10 . 1 1 82 82 PHE CB C 82 38.497 38.497 38.983 -0.486 18493 4828 1 10 . 1 1 83 83 ARG N N 83 117.110 117.110 118.955 -1.845 18493 4829 1 10 . 1 1 83 83 ARG C C 83 178.637 178.637 178.469 0.168 18493 4830 1 10 . 1 1 83 83 ARG CA C 83 60.291 60.291 58.958 1.333 18493 4831 1 10 . 1 1 83 83 ARG CB C 83 28.625 28.625 29.639 -1.014 18493 4832 1 10 . 1 1 84 84 GLY N N 84 105.915 105.915 107.173 -1.258 18493 4833 1 10 . 1 1 84 84 GLY C C 84 177.091 177.091 175.470 1.621 18493 4834 1 10 . 1 1 84 84 GLY CA C 84 46.128 46.128 46.698 -0.570 18493 4835 1 10 . 1 1 85 85 VAL N N 85 124.985 124.985 123.752 1.233 18493 4836 1 10 . 1 1 85 85 VAL C C 85 176.387 176.387 177.655 -1.268 18493 4837 1 10 . 1 1 85 85 VAL CA C 85 66.960 66.960 65.358 1.602 18493 4838 1 10 . 1 1 85 85 VAL CB C 85 31.066 31.066 31.581 -0.515 18493 4839 1 10 . 1 1 86 86 GLN N N 86 116.522 116.522 118.716 -2.194 18493 4840 1 10 . 1 1 86 86 GLN C C 86 179.586 179.586 178.608 0.978 18493 4841 1 10 . 1 1 86 86 GLN CA C 86 59.505 59.505 58.715 0.790 18493 4842 1 10 . 1 1 86 86 GLN CB C 86 28.762 28.762 27.844 0.918 18493 4843 1 10 . 1 1 87 87 LEU N N 87 121.211 121.211 120.770 0.441 18493 4844 1 10 . 1 1 87 87 LEU C C 87 178.396 178.396 179.623 -1.227 18493 4845 1 10 . 1 1 87 87 LEU CA C 87 57.847 57.847 57.622 0.225 18493 4846 1 10 . 1 1 87 87 LEU CB C 87 41.924 41.924 41.143 0.781 18493 4847 1 10 . 1 1 87 87 LEU H H 87 8.955 8.955 7.846 1.109 18493 4848 1 10 . 1 1 88 88 THR N N 88 108.251 108.251 114.105 -5.854 18493 4849 1 10 . 1 1 88 88 THR C C 88 180.013 180.013 176.249 3.764 18493 4850 1 10 . 1 1 88 88 THR CA C 88 65.112 65.112 66.481 -1.369 18493 4851 1 10 . 1 1 88 88 THR CB C 88 68.805 68.805 68.903 -0.097 18493 4852 1 10 . 1 1 88 88 THR H H 88 8.764 8.764 8.426 0.338 18493 4853 1 10 . 1 1 89 89 TYR N N 89 127.947 127.947 122.496 5.451 18493 4854 1 10 . 1 1 89 89 TYR C C 89 177.244 177.244 177.471 -0.227 18493 4855 1 10 . 1 1 89 89 TYR H H 89 9.868 9.868 8.453 1.415 18493 4856 1 10 . 1 1 90 90 GLU N N 90 121.163 121.163 117.927 3.236 18493 4857 1 10 . 1 1 90 90 GLU C C 90 178.671 178.671 178.555 0.116 18493 4858 1 10 . 1 1 90 90 GLU H H 90 8.515 8.515 7.888 0.627 18493 4859 1 10 . 1 1 91 91 HIS N N 91 120.459 120.459 119.547 0.912 18493 4860 1 10 . 1 1 91 91 HIS C C 91 177.605 177.605 176.783 0.822 18493 4861 1 10 . 1 1 91 91 HIS CA C 91 57.085 57.085 59.190 -2.105 18493 4862 1 10 . 1 1 91 91 HIS CB C 91 34.128 34.128 29.708 4.420 18493 4863 1 10 . 1 1 91 91 HIS H H 91 9.102 9.102 7.798 1.304 18493 4864 1 10 . 1 1 92 92 THR N N 92 115.463 115.463 110.759 4.704 18493 4865 1 10 . 1 1 92 92 THR C C 92 176.189 176.189 176.894 -0.705 18493 4866 1 10 . 1 1 92 92 THR CA C 92 67.058 67.058 64.021 3.037 18493 4867 1 10 . 1 1 92 92 THR CB C 92 68.564 68.564 69.676 -1.112 18493 4868 1 10 . 1 1 92 92 THR H H 92 9.550 9.550 7.662 1.888 18493 4869 1 10 . 1 1 93 93 MET N N 93 117.153 117.153 121.764 -4.611 18493 4870 1 10 . 1 1 93 93 MET C C 93 176.972 176.972 178.479 -1.507 18493 4871 1 10 . 1 1 93 93 MET CA C 93 62.369 62.369 57.569 4.801 18493 4872 1 10 . 1 1 93 93 MET CB C 93 33.515 33.515 31.256 2.259 18493 4873 1 10 . 1 1 94 94 LEU N N 94 117.981 117.981 119.841 -1.860 18493 4874 1 10 . 1 1 94 94 LEU CA C 94 57.489 57.489 57.976 -0.487 18493 4875 1 10 . 1 1 94 94 LEU CB C 94 41.432 41.432 41.403 0.029 18493 4876 1 10 . 1 1 94 94 LEU H H 94 8.497 8.497 8.535 -0.038 18493 4877 1 10 . 1 1 95 95 GLN C C 95 178.331 178.331 177.946 0.385 18493 4878 1 10 . 1 1 95 95 GLN CA C 95 57.604 57.604 57.786 -0.182 18493 4879 1 10 . 1 1 95 95 GLN CB C 95 28.200 28.200 28.613 -0.413 18493 4880 1 10 . 1 1 96 96 LEU N N 96 118.174 118.174 117.670 0.504 18493 4881 1 10 . 1 1 96 96 LEU C C 96 177.842 177.842 176.258 1.584 18493 4882 1 10 . 1 1 96 96 LEU CA C 96 57.747 57.747 56.125 1.622 18493 4883 1 10 . 1 1 96 96 LEU CB C 96 41.721 41.721 42.823 -1.102 18493 4884 1 10 . 1 1 97 97 TYR N N 97 117.359 117.359 117.383 -0.024 18493 4885 1 10 . 1 1 97 97 TYR CA C 97 57.581 57.581 55.779 1.802 18493 4886 1 10 . 1 1 97 97 TYR H H 97 8.485 8.485 7.608 0.877 18493 4887 1 10 . 1 1 98 98 PRO CA C 98 63.847 63.847 62.454 1.393 18493 4888 1 10 . 1 1 99 99 SER CA C 99 58.145 58.145 56.609 1.536 18493 4889 1 10 . 1 1 99 99 SER CB C 99 64.506 64.506 63.614 0.892 18493 4890 1 10 . 1 1 101 101 PHE C C 101 174.992 174.992 175.028 -0.036 18493 4891 1 10 . 1 1 102 102 ALA N N 102 120.614 120.614 126.260 -5.646 18493 4892 1 10 . 1 1 102 102 ALA C C 102 176.810 176.810 177.437 -0.627 18493 4893 1 10 . 1 1 102 102 ALA CA C 102 54.355 54.355 53.257 1.098 18493 4894 1 10 . 1 1 102 102 ALA H H 102 7.383 7.383 8.266 -0.883 18493 4895 1 10 . 1 1 103 103 THR N N 103 112.507 112.507 109.972 2.535 18493 4896 1 10 . 1 1 103 103 THR C C 103 175.666 175.666 173.228 2.438 18493 4897 1 10 . 1 1 103 103 THR CA C 103 59.838 59.838 61.807 -1.969 18493 4898 1 10 . 1 1 103 103 THR CB C 103 67.623 67.623 69.410 -1.787 18493 4899 1 10 . 1 1 103 103 THR H H 103 9.278 9.278 7.471 1.807 18493 4900 1 10 . 1 1 104 104 CYS N N 104 122.754 122.754 124.116 -1.362 18493 4901 1 10 . 1 1 104 104 CYS C C 104 174.474 174.474 174.072 0.402 18493 4902 1 10 . 1 1 104 104 CYS CA C 104 64.988 64.988 56.671 8.317 18493 4903 1 10 . 1 1 104 104 CYS CB C 104 42.988 42.988 30.965 12.023 18493 4904 1 10 . 1 1 104 104 CYS H H 104 9.934 9.934 8.469 1.465 18493 4905 1 10 . 1 1 105 105 ASP N N 105 121.350 121.350 124.302 -2.952 18493 4906 1 10 . 1 1 105 105 ASP CB C 105 41.030 41.030 39.883 1.147 18493 4907 1 10 . 1 1 105 105 ASP H H 105 8.153 8.153 8.762 -0.609 18493 4908 1 10 . 1 1 115 115 PRO CA C 115 61.148 61.148 63.177 -2.029 18493 4909 1 10 . 1 1 115 115 PRO CB C 115 30.280 30.280 31.965 -1.685 18493 4910 1 10 . 1 1 116 116 LEU C C 116 178.163 178.163 175.233 2.930 18493 4911 1 10 . 1 1 116 116 LEU CA C 116 58.746 58.746 55.218 3.528 18493 4912 1 10 . 1 1 116 116 LEU CB C 116 42.932 42.932 39.918 3.014 18493 4913 1 10 . 1 1 117 117 ASP N N 117 116.302 116.302 112.561 3.741 18493 4914 1 10 . 1 1 117 117 ASP C C 117 177.528 177.528 175.387 2.141 18493 4915 1 10 . 1 1 117 117 ASP CB C 117 41.252 41.252 40.892 0.359 18493 4916 1 10 . 1 1 118 118 LYS N N 118 118.983 118.983 120.659 -1.676 18493 4917 1 10 . 1 1 118 118 LYS H H 118 7.538 7.538 8.016 -0.478 18493 4918 1 10 . 1 1 119 119 TRP C C 119 177.867 177.867 176.772 1.095 18493 4919 1 10 . 1 1 120 120 VAL N N 120 113.149 113.149 116.324 -3.175 18493 4920 1 10 . 1 1 120 120 VAL CA C 120 58.651 58.651 60.411 -1.760 18493 4921 1 10 . 1 1 120 120 VAL CB C 120 31.821 31.821 33.753 -1.932 18493 4922 1 10 . 1 1 120 120 VAL H H 120 8.936 8.936 7.499 1.437 18493 4923 1 10 . 1 1 121 121 PRO C C 121 178.888 178.888 177.285 1.603 18493 4924 1 10 . 1 1 121 121 PRO CA C 121 65.185 65.185 64.234 0.951 18493 4925 1 10 . 1 1 121 121 PRO CB C 121 31.781 31.781 31.481 0.300 18493 4926 1 10 . 1 1 122 122 GLN N N 122 116.304 116.304 118.398 -2.094 18493 4927 1 10 . 1 1 122 122 GLN C C 122 174.326 174.326 177.174 -2.848 18493 4928 1 10 . 1 1 122 122 GLN CA C 122 58.463 58.463 58.398 0.065 18493 4929 1 10 . 1 1 122 122 GLN H H 122 9.809 9.809 8.483 1.326 18493 4930 1 10 . 1 1 123 123 VAL N N 123 113.254 113.254 118.816 -5.562 18493 4931 1 10 . 1 1 123 123 VAL C C 123 175.777 175.777 177.271 -1.494 18493 4932 1 10 . 1 1 123 123 VAL CA C 123 61.689 61.689 64.133 -2.444 18493 4933 1 10 . 1 1 123 123 VAL CB C 123 35.373 35.373 31.990 3.383 18493 4934 1 10 . 1 1 123 123 VAL H H 123 8.219 8.219 7.974 0.245 18493 4935 1 10 . 1 1 124 124 PHE N N 124 112.242 112.242 120.431 -8.189 18493 4936 1 10 . 1 1 124 124 PHE C C 124 172.759 172.759 174.851 -2.092 18493 4937 1 10 . 1 1 124 124 PHE CB C 124 39.318 39.318 38.897 0.422 18493 4938 1 10 . 1 1 125 125 VAL N N 125 115.233 115.233 117.936 -2.703 18493 4939 1 10 . 1 1 125 125 VAL C C 125 177.034 177.034 173.200 3.834 18493 4940 1 10 . 1 1 125 125 VAL CA C 125 61.950 61.950 60.135 1.815 18493 4941 1 10 . 1 1 125 125 VAL CB C 125 33.376 33.376 34.519 -1.143 18493 4942 1 10 . 1 1 125 125 VAL H H 125 7.799 7.799 7.853 -0.054 18493 4943 1 10 . 1 1 126 126 ALA N N 126 130.709 130.709 127.659 3.050 18493 4944 1 10 . 1 1 126 126 ALA C C 126 175.920 175.920 175.769 0.151 18493 4945 1 10 . 1 1 126 126 ALA CA C 126 54.493 54.493 51.525 2.968 18493 4946 1 10 . 1 1 126 126 ALA CB C 126 17.215 17.215 20.182 -2.967 18493 4947 1 10 . 1 1 126 126 ALA H H 126 9.014 9.014 7.443 1.571 18493 4948 1 10 . 1 1 127 127 SER N N 127 112.716 112.716 114.932 -2.216 18493 4949 1 10 . 1 1 127 127 SER CA C 127 58.101 58.101 59.139 -1.038 18493 4950 1 10 . 1 1 127 127 SER CB C 127 64.539 64.539 63.344 1.195 18493 4951 1 10 . 1 1 127 127 SER H H 127 8.145 8.145 8.434 -0.289 18493 4952 1 10 . 1 1 128 128 GLY N N 128 106.487 106.487 109.819 -3.332 18493 4953 1 10 . 1 1 128 128 GLY C C 128 177.047 177.047 173.190 3.857 18493 4954 1 10 . 1 1 128 128 GLY CA C 128 46.296 46.296 45.413 0.883 18493 4955 1 10 . 1 1 128 128 GLY H H 128 8.595 8.595 8.399 0.196 18493 4956 1 10 . 1 1 129 129 ASP C C 129 177.916 177.916 176.327 1.589 18493 4957 1 10 . 1 1 129 129 ASP CB C 129 43.975 43.975 41.894 2.081 18493 4958 1 10 . 1 1 130 130 CYS N N 130 122.984 122.984 118.127 4.857 18493 4959 1 10 . 1 1 130 130 CYS C C 130 173.312 173.312 174.651 -1.339 18493 4960 1 10 . 1 1 130 130 CYS CA C 130 64.581 64.581 58.544 6.037 18493 4961 1 10 . 1 1 130 130 CYS CB C 130 42.879 42.879 28.234 14.645 18493 4962 1 10 . 1 1 130 130 CYS H H 130 9.948 9.948 8.305 1.643 18493 4963 1 10 . 1 1 131 131 ALA N N 131 121.534 121.534 124.364 -2.830 18493 4964 1 10 . 1 1 131 131 ALA CA C 131 52.640 52.640 53.250 -0.610 18493 4965 1 10 . 1 1 131 131 ALA CB C 131 18.497 18.497 19.142 -0.645 18493 4966 1 10 . 1 1 131 131 ALA H H 131 9.869 9.869 8.412 1.456 18493 4967 1 10 . 1 1 136 136 ASP C C 136 172.916 172.916 173.351 -0.435 18493 4968 1 10 . 1 1 137 137 PHE N N 137 117.677 117.677 124.103 -6.426 18493 4969 1 10 . 1 1 137 137 PHE CA C 137 57.310 57.310 58.779 -1.469 18493 4970 1 10 . 1 1 137 137 PHE CB C 137 42.927 42.927 38.285 4.642 18493 4971 1 10 . 1 1 137 137 PHE H H 137 8.959 8.959 7.859 1.100 18493 4972 1 10 . 1 1 138 138 LEU CB C 138 43.547 43.547 41.910 1.637 18493 4973 1 10 . 1 1 139 139 GLY C C 139 176.262 176.262 173.867 2.395 18493 4974 1 10 . 1 1 139 139 GLY CA C 139 46.123 46.123 46.050 0.073 18493 4975 1 10 . 1 1 140 140 LEU N N 140 124.207 124.207 120.621 3.586 18493 4976 1 10 . 1 1 140 140 LEU CB C 140 40.503 40.503 43.758 -3.256 18493 4977 1 10 . 1 1 142 142 MET CA C 142 56.442 56.442 58.309 -1.867 18493 4978 1 10 . 1 1 143 143 PRO CA C 143 63.254 63.254 66.364 -3.110 18493 4979 1 10 . 1 1 144 144 GLN C C 144 177.307 177.307 178.318 -1.011 18493 4980 1 10 . 1 1 145 145 TRP N N 145 120.795 120.795 120.636 0.159 18493 4981 1 10 . 1 1 145 145 TRP C C 145 178.709 178.709 178.779 -0.070 18493 4982 1 10 . 1 1 145 145 TRP CA C 145 59.535 59.535 59.248 0.287 18493 4983 1 10 . 1 1 145 145 TRP CB C 145 29.345 29.345 29.347 -0.002 18493 4984 1 10 . 1 1 145 145 TRP H H 145 8.386 8.386 7.736 0.650 18493 4985 1 10 . 1 1 146 146 LEU N N 146 118.336 118.336 120.412 -2.076 18493 4986 1 10 . 1 1 146 146 LEU C C 146 177.115 177.115 178.314 -1.199 18493 4987 1 10 . 1 1 146 146 LEU CA C 146 57.793 57.793 57.775 0.018 18493 4988 1 10 . 1 1 146 146 LEU CB C 146 41.616 41.616 41.432 0.184 18493 4989 1 10 . 1 1 146 146 LEU H H 146 9.033 9.033 8.918 0.115 18493 4990 1 10 . 1 1 147 147 LEU N N 147 123.772 123.772 119.595 4.177 18493 4991 1 10 . 1 1 147 147 LEU C C 147 178.787 178.787 178.987 -0.200 18493 4992 1 10 . 1 1 147 147 LEU CA C 147 58.052 58.052 58.377 -0.325 18493 4993 1 10 . 1 1 147 147 LEU CB C 147 41.047 41.047 40.811 0.236 18493 4994 1 10 . 1 1 147 147 LEU H H 147 8.480 8.480 7.866 0.614 18493 4995 1 10 . 1 1 148 148 GLY N N 148 104.457 104.457 108.200 -3.743 18493 4996 1 10 . 1 1 148 148 GLY C C 148 174.667 174.667 176.766 -2.099 18493 4997 1 10 . 1 1 148 148 GLY CA C 148 48.102 48.102 47.434 0.668 18493 4998 1 10 . 1 1 149 149 ILE N N 149 121.815 121.815 122.836 -1.021 18493 4999 1 10 . 1 1 149 149 ILE C C 149 177.725 177.725 177.107 0.618 18493 5000 1 10 . 1 1 149 149 ILE CA C 149 65.997 65.997 62.453 3.545 18493 5001 1 10 . 1 1 149 149 ILE CB C 149 38.262 38.262 37.730 0.532 18493 5002 1 10 . 1 1 150 150 PHE N N 150 118.894 118.894 122.490 -3.596 18493 5003 1 10 . 1 1 150 150 PHE C C 150 178.929 178.929 177.175 1.754 18493 5004 1 10 . 1 1 150 150 PHE CA C 150 63.591 63.591 61.428 2.163 18493 5005 1 10 . 1 1 150 150 PHE CB C 150 38.417 38.417 38.853 -0.436 18493 5006 1 10 . 1 1 151 151 ILE N N 151 120.535 120.535 121.485 -0.950 18493 5007 1 10 . 1 1 151 151 ILE C C 151 177.347 177.347 176.911 0.436 18493 5008 1 10 . 1 1 151 151 ILE CA C 151 66.478 66.478 63.478 3.000 18493 5009 1 10 . 1 1 151 151 ILE CB C 151 37.302 37.302 37.731 -0.429 18493 5010 1 10 . 1 1 152 152 ALA N N 152 122.855 122.855 122.491 0.364 18493 5011 1 10 . 1 1 152 152 ALA C C 152 179.165 179.165 179.557 -0.392 18493 5012 1 10 . 1 1 152 152 ALA CA C 152 56.272 56.272 55.235 1.037 18493 5013 1 10 . 1 1 152 152 ALA CB C 152 17.993 17.993 17.836 0.157 18493 5014 1 10 . 1 1 153 153 TYR N N 153 116.156 116.156 119.855 -3.699 18493 5015 1 10 . 1 1 153 153 TYR C C 153 179.682 179.682 177.437 2.245 18493 5016 1 10 . 1 1 153 153 TYR CA C 153 64.391 64.391 62.249 2.142 18493 5017 1 10 . 1 1 153 153 TYR CB C 153 39.553 39.553 38.881 0.672 18493 5018 1 10 . 1 1 153 153 TYR H H 153 8.680 8.680 7.828 0.852 18493 5019 1 10 . 1 1 154 154 LEU N N 154 122.327 122.327 121.130 1.197 18493 5020 1 10 . 1 1 154 154 LEU C C 154 177.336 177.336 178.450 -1.114 18493 5021 1 10 . 1 1 154 154 LEU CA C 154 57.905 57.905 58.282 -0.377 18493 5022 1 10 . 1 1 154 154 LEU CB C 154 42.009 42.009 41.659 0.350 18493 5023 1 10 . 1 1 155 155 ILE N N 155 119.079 119.079 118.227 0.852 18493 5024 1 10 . 1 1 155 155 ILE C C 155 177.589 177.589 178.039 -0.450 18493 5025 1 10 . 1 1 155 155 ILE CA C 155 65.996 65.996 64.543 1.453 18493 5026 1 10 . 1 1 155 155 ILE CB C 155 38.179 38.179 38.368 -0.189 18493 5027 1 10 . 1 1 156 156 VAL N N 156 117.551 117.551 121.332 -3.781 18493 5028 1 10 . 1 1 156 156 VAL C C 156 176.163 176.163 176.869 -0.706 18493 5029 1 10 . 1 1 156 156 VAL CA C 156 67.664 67.664 66.724 0.940 18493 5030 1 10 . 1 1 156 156 VAL CB C 156 31.694 31.694 31.170 0.524 18493 5031 1 10 . 1 1 157 157 ALA N N 157 122.470 122.470 118.880 3.590 18493 5032 1 10 . 1 1 157 157 ALA C C 157 179.076 179.076 179.207 -0.131 18493 5033 1 10 . 1 1 157 157 ALA CA C 157 54.803 54.803 53.522 1.281 18493 5034 1 10 . 1 1 157 157 ALA CB C 157 16.120 16.120 17.909 -1.789 18493 5035 1 10 . 1 1 158 158 VAL N N 158 116.045 116.045 118.610 -2.565 18493 5036 1 10 . 1 1 158 158 VAL C C 158 177.491 177.491 177.365 0.126 18493 5037 1 10 . 1 1 158 158 VAL CA C 158 67.160 67.160 65.562 1.597 18493 5038 1 10 . 1 1 158 158 VAL CB C 158 31.331 31.331 32.052 -0.721 18493 5039 1 10 . 1 1 159 159 LEU N N 159 116.776 116.776 120.345 -3.569 18493 5040 1 10 . 1 1 159 159 LEU C C 159 178.312 178.312 177.941 0.371 18493 5041 1 10 . 1 1 159 159 LEU CA C 159 57.443 57.443 57.478 -0.035 18493 5042 1 10 . 1 1 159 159 LEU CB C 159 41.567 41.567 41.449 0.118 18493 5043 1 10 . 1 1 160 160 VAL N N 160 118.890 118.890 115.614 3.276 18493 5044 1 10 . 1 1 160 160 VAL C C 160 177.508 177.508 177.280 0.228 18493 5045 1 10 . 1 1 160 160 VAL CA C 160 67.366 67.366 65.252 2.114 18493 5046 1 10 . 1 1 160 160 VAL CB C 160 31.106 31.106 31.378 -0.272 18493 5047 1 10 . 1 1 161 161 VAL N N 161 118.360 118.360 118.371 -0.011 18493 5048 1 10 . 1 1 161 161 VAL C C 161 176.607 176.607 175.618 0.989 18493 5049 1 10 . 1 1 161 161 VAL CA C 161 67.614 67.614 63.301 4.313 18493 5050 1 10 . 1 1 161 161 VAL CB C 161 31.646 31.646 33.209 -1.563 18493 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 113 2.895 0.753 2.808 18493 2 1 1 "Average Difference" HA 0 0.000 0.000 0.000 18493 3 1 1 "Average Difference" C 108 1.420 -0.138 1.420 18493 4 1 1 "Average Difference" CA 118 1.981 -0.531 1.916 18493 5 1 1 "Average Difference" CB 104 2.373 -0.334 2.361 18493 6 1 1 "Average Difference" HN 62 0.988 -0.646 0.753 18493 7 1 2 "Average Difference" N 113 2.951 0.609 2.901 18493 8 1 2 "Average Difference" HA 0 0.000 0.000 0.000 18493 9 1 2 "Average Difference" C 108 1.519 -0.224 1.510 18493 10 1 2 "Average Difference" CA 118 1.848 -0.540 1.775 18493 11 1 2 "Average Difference" CB 104 2.434 -0.340 2.422 18493 12 1 2 "Average Difference" HN 62 1.036 -0.740 0.730 18493 13 1 3 "Average Difference" N 113 3.010 0.650 2.952 18493 14 1 3 "Average Difference" HA 0 0.000 0.000 0.000 18493 15 1 3 "Average Difference" C 108 1.337 -0.107 1.339 18493 16 1 3 "Average Difference" CA 118 1.960 -0.574 1.882 18493 17 1 3 "Average Difference" CB 104 2.482 -0.393 2.462 18493 18 1 3 "Average Difference" HN 62 0.990 -0.676 0.730 18493 19 1 4 "Average Difference" N 113 2.864 0.663 2.799 18493 20 1 4 "Average Difference" HA 0 0.000 0.000 0.000 18493 21 1 4 "Average Difference" C 108 1.321 -0.125 1.321 18493 22 1 4 "Average Difference" CA 118 1.928 -0.580 1.846 18493 23 1 4 "Average Difference" CB 104 2.388 -0.376 2.370 18493 24 1 4 "Average Difference" HN 62 0.948 -0.689 0.657 18493 25 1 5 "Average Difference" N 113 3.335 0.774 3.258 18493 26 1 5 "Average Difference" HA 0 0.000 0.000 0.000 18493 27 1 5 "Average Difference" C 108 1.428 -0.220 1.418 18493 28 1 5 "Average Difference" CA 118 2.025 -0.697 1.910 18493 29 1 5 "Average Difference" CB 104 2.410 -0.307 2.402 18493 30 1 5 "Average Difference" HN 62 1.037 -0.698 0.774 18493 31 1 6 "Average Difference" N 113 3.143 0.767 3.062 18493 32 1 6 "Average Difference" HA 0 0.000 0.000 0.000 18493 33 1 6 "Average Difference" C 108 1.393 -0.137 1.393 18493 34 1 6 "Average Difference" CA 118 2.138 -0.646 2.047 18493 35 1 6 "Average Difference" CB 104 2.462 -0.370 2.445 18493 36 1 6 "Average Difference" HN 62 1.036 -0.700 0.770 18493 37 1 7 "Average Difference" N 113 2.935 0.640 2.877 18493 38 1 7 "Average Difference" HA 0 0.000 0.000 0.000 18493 39 1 7 "Average Difference" C 108 1.385 -0.061 1.390 18493 40 1 7 "Average Difference" CA 118 2.052 -0.641 1.957 18493 41 1 7 "Average Difference" CB 104 2.428 -0.452 2.397 18493 42 1 7 "Average Difference" HN 62 0.979 -0.649 0.739 18493 43 1 8 "Average Difference" N 113 3.097 0.686 3.034 18493 44 1 8 "Average Difference" HA 0 0.000 0.000 0.000 18493 45 1 8 "Average Difference" C 108 1.456 -0.144 1.455 18493 46 1 8 "Average Difference" CA 118 1.835 -0.603 1.741 18493 47 1 8 "Average Difference" CB 104 2.366 -0.373 2.348 18493 48 1 8 "Average Difference" HN 62 1.064 -0.694 0.812 18493 49 1 9 "Average Difference" N 113 3.262 0.873 3.157 18493 50 1 9 "Average Difference" HA 0 0.000 0.000 0.000 18493 51 1 9 "Average Difference" C 108 1.554 -0.202 1.548 18493 52 1 9 "Average Difference" CA 118 1.980 -0.715 1.854 18493 53 1 9 "Average Difference" CB 104 2.539 -0.288 2.535 18493 54 1 9 "Average Difference" HN 62 0.992 -0.640 0.764 18493 55 1 10 "Average Difference" N 113 2.989 0.735 2.910 18493 56 1 10 "Average Difference" HA 0 0.000 0.000 0.000 18493 57 1 10 "Average Difference" C 108 1.420 -0.158 1.418 18493 58 1 10 "Average Difference" CA 118 2.007 -0.611 1.920 18493 59 1 10 "Average Difference" CB 104 2.387 -0.391 2.366 18493 60 1 10 "Average Difference" HN 62 0.977 -0.653 0.733 18493 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 18493 _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 11 11 GLY N N 11 108.456 108.456 108.082 0.374 18493 2 1 . 1 1 11 11 GLY H H 11 8.433 8.433 7.527 0.906 18493 3 1 . 1 1 12 12 ARG C C 12 178.053 178.053 178.388 -0.335 18493 4 1 . 1 1 12 12 ARG CA C 12 57.504 57.504 59.252 -1.748 18493 5 1 . 1 1 12 12 ARG CB C 12 30.522 30.522 30.239 0.283 18493 6 1 . 1 1 13 13 GLY N N 13 108.265 108.265 107.676 0.589 18493 7 1 . 1 1 13 13 GLY C C 13 175.091 175.091 176.011 -0.920 18493 8 1 . 1 1 13 13 GLY CA C 13 45.326 45.326 46.817 -1.491 18493 9 1 . 1 1 14 14 ALA N N 14 123.181 123.181 124.559 -1.377 18493 10 1 . 1 1 14 14 ALA C C 14 179.173 179.173 179.667 -0.494 18493 11 1 . 1 1 14 14 ALA CA C 14 55.061 55.061 54.664 0.396 18493 12 1 . 1 1 14 14 ALA H H 14 9.285 9.285 8.020 1.265 18493 13 1 . 1 1 15 15 TRP N N 15 116.733 116.733 118.172 -1.439 18493 14 1 . 1 1 15 15 TRP C C 15 179.425 179.425 178.561 0.864 18493 15 1 . 1 1 15 15 TRP CA C 15 58.960 58.960 58.809 0.152 18493 16 1 . 1 1 15 15 TRP CB C 15 29.529 29.529 29.419 0.110 18493 17 1 . 1 1 15 15 TRP H H 15 7.091 7.091 7.647 -0.556 18493 18 1 . 1 1 16 16 LEU N N 16 118.671 118.671 120.745 -2.074 18493 19 1 . 1 1 16 16 LEU C C 16 178.461 178.461 179.217 -0.756 18493 20 1 . 1 1 16 16 LEU CA C 16 58.246 58.246 58.389 -0.143 18493 21 1 . 1 1 16 16 LEU CB C 16 41.369 41.369 41.426 -0.057 18493 22 1 . 1 1 16 16 LEU H H 16 9.180 9.180 8.769 0.411 18493 23 1 . 1 1 17 17 LEU N N 17 118.515 118.515 120.612 -2.097 18493 24 1 . 1 1 17 17 LEU C C 17 178.787 178.787 178.730 0.057 18493 25 1 . 1 1 17 17 LEU CA C 17 57.832 57.832 58.592 -0.760 18493 26 1 . 1 1 17 17 LEU CB C 17 41.395 41.395 41.609 -0.214 18493 27 1 . 1 1 18 18 MET N N 18 120.633 120.633 118.600 2.034 18493 28 1 . 1 1 18 18 MET C C 18 180.469 180.469 178.919 1.550 18493 29 1 . 1 1 18 18 MET CA C 18 60.277 60.277 57.578 2.699 18493 30 1 . 1 1 18 18 MET CB C 18 31.789 31.789 31.489 0.300 18493 31 1 . 1 1 19 19 ALA N N 19 123.958 123.958 122.446 1.511 18493 32 1 . 1 1 19 19 ALA C C 19 178.210 178.210 179.060 -0.849 18493 33 1 . 1 1 19 19 ALA CA C 19 55.468 55.468 55.216 0.252 18493 34 1 . 1 1 19 19 ALA CB C 19 17.865 17.865 18.412 -0.547 18493 35 1 . 1 1 19 19 ALA H H 19 9.398 9.398 8.774 0.624 18493 36 1 . 1 1 20 20 PHE N N 20 118.424 118.424 119.036 -0.612 18493 37 1 . 1 1 20 20 PHE C C 20 176.674 176.674 177.129 -0.455 18493 38 1 . 1 1 20 20 PHE CA C 20 62.546 62.546 61.200 1.346 18493 39 1 . 1 1 20 20 PHE CB C 20 38.697 38.697 39.069 -0.372 18493 40 1 . 1 1 21 21 THR N N 21 109.220 109.220 115.684 -6.463 18493 41 1 . 1 1 21 21 THR C C 21 174.203 174.203 176.761 -2.558 18493 42 1 . 1 1 21 21 THR CA C 21 66.052 66.052 66.824 -0.772 18493 43 1 . 1 1 21 21 THR CB C 21 68.956 68.956 68.140 0.816 18493 44 1 . 1 1 22 22 ALA N N 22 123.662 123.662 125.327 -1.665 18493 45 1 . 1 1 22 22 ALA C C 22 179.488 179.488 179.638 -0.150 18493 46 1 . 1 1 22 22 ALA CA C 22 54.847 54.847 54.672 0.175 18493 47 1 . 1 1 22 22 ALA CB C 22 17.801 17.801 18.314 -0.513 18493 48 1 . 1 1 23 23 LEU N N 23 118.917 118.917 120.033 -1.116 18493 49 1 . 1 1 23 23 LEU C C 23 178.028 178.028 178.897 -0.869 18493 50 1 . 1 1 23 23 LEU CA C 23 57.713 57.713 57.385 0.328 18493 51 1 . 1 1 23 23 LEU CB C 23 41.506 41.506 41.200 0.306 18493 52 1 . 1 1 23 23 LEU H H 23 8.581 8.581 7.891 0.690 18493 53 1 . 1 1 24 24 ALA N N 24 119.931 119.931 121.900 -1.969 18493 54 1 . 1 1 24 24 ALA C C 24 180.617 180.617 179.527 1.090 18493 55 1 . 1 1 24 24 ALA CA C 24 55.350 55.350 54.765 0.585 18493 56 1 . 1 1 24 24 ALA CB C 24 17.583 17.583 18.132 -0.549 18493 57 1 . 1 1 25 25 LEU N N 25 119.691 119.691 118.784 0.907 18493 58 1 . 1 1 25 25 LEU CA C 25 58.078 58.078 57.732 0.346 18493 59 1 . 1 1 25 25 LEU CB C 25 43.597 43.597 41.589 2.008 18493 60 1 . 1 1 25 25 LEU H H 25 9.179 9.179 8.523 0.656 18493 61 1 . 1 1 26 26 GLU N N 26 119.651 119.651 117.596 2.055 18493 62 1 . 1 1 26 26 GLU C C 26 179.334 179.334 178.869 0.465 18493 63 1 . 1 1 26 26 GLU CA C 26 59.584 59.584 58.449 1.135 18493 64 1 . 1 1 26 26 GLU CB C 26 27.202 27.202 29.231 -2.029 18493 65 1 . 1 1 27 27 LEU N N 27 119.661 119.661 120.703 -1.042 18493 66 1 . 1 1 27 27 LEU CA C 27 57.887 57.887 57.514 0.373 18493 67 1 . 1 1 27 27 LEU CB C 27 41.591 41.591 41.709 -0.118 18493 68 1 . 1 1 27 27 LEU H H 27 9.410 9.410 7.672 1.738 18493 69 1 . 1 1 28 28 THR N N 28 118.484 118.484 114.006 4.478 18493 70 1 . 1 1 28 28 THR C C 28 175.898 175.898 176.612 -0.714 18493 71 1 . 1 1 28 28 THR CA C 28 67.459 67.459 66.119 1.339 18493 72 1 . 1 1 28 28 THR CB C 28 67.948 67.948 68.163 -0.215 18493 73 1 . 1 1 29 29 ALA N N 29 122.643 122.643 124.873 -2.230 18493 74 1 . 1 1 29 29 ALA C C 29 179.717 179.717 179.122 0.595 18493 75 1 . 1 1 29 29 ALA CA C 29 55.919 55.919 54.810 1.109 18493 76 1 . 1 1 29 29 ALA CB C 29 16.837 16.837 18.192 -1.355 18493 77 1 . 1 1 29 29 ALA H H 29 8.302 8.302 7.681 0.621 18493 78 1 . 1 1 30 30 LEU N N 30 117.408 117.408 116.628 0.780 18493 79 1 . 1 1 30 30 LEU C C 30 178.143 178.143 177.552 0.591 18493 80 1 . 1 1 30 30 LEU CA C 30 57.384 57.384 56.341 1.043 18493 81 1 . 1 1 30 30 LEU CB C 30 41.679 41.679 41.817 -0.138 18493 82 1 . 1 1 30 30 LEU H H 30 8.412 8.412 8.045 0.367 18493 83 1 . 1 1 31 31 TRP N N 31 125.692 125.692 120.100 5.592 18493 84 1 . 1 1 31 31 TRP C C 31 179.053 179.053 177.464 1.589 18493 85 1 . 1 1 31 31 TRP CA C 31 59.005 59.005 59.027 -0.022 18493 86 1 . 1 1 31 31 TRP CB C 31 28.142 28.142 29.942 -1.800 18493 87 1 . 1 1 31 31 TRP H H 31 9.157 9.157 7.659 1.498 18493 88 1 . 1 1 32 32 PHE N N 32 119.195 119.195 118.073 1.122 18493 89 1 . 1 1 32 32 PHE CA C 32 61.557 61.557 60.038 1.518 18493 90 1 . 1 1 32 32 PHE CB C 32 38.384 38.384 37.268 1.116 18493 91 1 . 1 1 32 32 PHE H H 32 9.374 9.374 7.651 1.723 18493 92 1 . 1 1 33 33 GLN C C 33 177.477 177.477 176.856 0.621 18493 93 1 . 1 1 33 33 GLN CA C 33 56.613 56.613 58.608 -1.995 18493 94 1 . 1 1 33 33 GLN CB C 33 29.433 29.433 27.459 1.974 18493 95 1 . 1 1 34 34 HIS N N 34 115.948 115.948 117.186 -1.238 18493 96 1 . 1 1 34 34 HIS C C 34 175.548 175.548 177.667 -2.119 18493 97 1 . 1 1 34 34 HIS CA C 34 58.733 58.733 57.997 0.737 18493 98 1 . 1 1 34 34 HIS CB C 34 32.084 32.084 29.544 2.540 18493 99 1 . 1 1 34 34 HIS H H 34 9.621 9.621 7.788 1.833 18493 100 1 . 1 1 35 35 VAL N N 35 116.902 116.902 119.498 -2.596 18493 101 1 . 1 1 35 35 VAL C C 35 177.853 177.853 177.062 0.791 18493 102 1 . 1 1 35 35 VAL CA C 35 64.075 64.075 65.013 -0.938 18493 103 1 . 1 1 35 35 VAL CB C 35 30.626 30.626 31.532 -0.906 18493 104 1 . 1 1 36 36 MET N N 36 114.145 114.145 117.233 -3.088 18493 105 1 . 1 1 36 36 MET C C 36 175.905 175.905 176.273 -0.368 18493 106 1 . 1 1 36 36 MET H H 36 7.605 7.605 7.550 0.055 18493 107 1 . 1 1 37 37 LEU N N 37 111.740 111.740 117.577 -5.837 18493 108 1 . 1 1 37 37 LEU H H 37 7.121 7.121 7.605 -0.484 18493 109 1 . 1 1 38 38 LEU C C 38 176.457 176.457 175.932 0.525 18493 110 1 . 1 1 39 39 LYS N N 39 121.418 121.418 121.106 0.312 18493 111 1 . 1 1 39 39 LYS CA C 39 57.471 57.471 55.870 1.601 18493 112 1 . 1 1 39 39 LYS H H 39 9.359 9.359 8.307 1.052 18493 113 1 . 1 1 40 40 PRO CA C 40 60.451 60.451 63.287 -2.836 18493 114 1 . 1 1 42 42 VAL N N 42 118.166 118.166 119.848 -1.682 18493 115 1 . 1 1 42 42 VAL C C 42 179.261 179.261 176.443 2.818 18493 116 1 . 1 1 42 42 VAL CA C 42 67.223 67.223 63.450 3.773 18493 117 1 . 1 1 42 42 VAL CB C 42 30.941 30.941 31.647 -0.706 18493 118 1 . 1 1 43 43 LEU N N 43 115.946 115.946 121.021 -5.075 18493 119 1 . 1 1 43 43 LEU C C 43 178.293 178.293 178.571 -0.278 18493 120 1 . 1 1 43 43 LEU CA C 43 57.129 57.129 57.284 -0.155 18493 121 1 . 1 1 43 43 LEU CB C 43 41.030 41.030 41.124 -0.094 18493 122 1 . 1 1 44 44 CYS N N 44 115.006 115.006 118.029 -3.023 18493 123 1 . 1 1 44 44 CYS C C 44 177.484 177.484 176.853 0.631 18493 124 1 . 1 1 44 44 CYS CA C 44 59.760 59.760 62.316 -2.556 18493 125 1 . 1 1 44 44 CYS CB C 44 30.651 30.651 26.343 4.308 18493 126 1 . 1 1 44 44 CYS H H 44 7.683 7.683 8.210 -0.527 18493 127 1 . 1 1 45 45 ILE N N 45 119.384 119.384 120.655 -1.271 18493 128 1 . 1 1 45 45 ILE C C 45 179.575 179.575 176.845 2.730 18493 129 1 . 1 1 45 45 ILE CA C 45 62.068 62.068 64.531 -2.463 18493 130 1 . 1 1 45 45 ILE CB C 45 33.583 33.583 36.978 -3.395 18493 131 1 . 1 1 46 46 TYR N N 46 120.126 120.126 119.948 0.178 18493 132 1 . 1 1 46 46 TYR C C 46 178.397 178.397 177.210 1.187 18493 133 1 . 1 1 46 46 TYR CA C 46 59.129 59.129 61.252 -2.123 18493 134 1 . 1 1 46 46 TYR CB C 46 35.347 35.347 38.492 -3.145 18493 135 1 . 1 1 46 46 TYR H H 46 8.958 8.958 7.956 1.002 18493 136 1 . 1 1 47 47 GLU N N 47 121.779 121.779 117.656 4.123 18493 137 1 . 1 1 47 47 GLU C C 47 179.907 179.907 178.882 1.025 18493 138 1 . 1 1 47 47 GLU CA C 47 57.985 57.985 58.220 -0.235 18493 139 1 . 1 1 47 47 GLU CB C 47 27.290 27.290 29.614 -2.324 18493 140 1 . 1 1 47 47 GLU H H 47 9.681 9.681 8.009 1.672 18493 141 1 . 1 1 48 48 ARG N N 48 119.188 119.188 120.950 -1.762 18493 142 1 . 1 1 48 48 ARG C C 48 181.638 181.638 178.618 3.019 18493 143 1 . 1 1 48 48 ARG CA C 48 60.299 60.299 58.975 1.323 18493 144 1 . 1 1 48 48 ARG CB C 48 30.167 30.167 29.745 0.422 18493 145 1 . 1 1 48 48 ARG H H 48 9.213 9.213 8.182 1.031 18493 146 1 . 1 1 49 49 VAL N N 49 121.326 121.326 119.411 1.915 18493 147 1 . 1 1 49 49 VAL C C 49 177.326 177.326 177.535 -0.209 18493 148 1 . 1 1 49 49 VAL CA C 49 66.624 66.624 66.123 0.501 18493 149 1 . 1 1 49 49 VAL CB C 49 31.280 31.280 31.155 0.125 18493 150 1 . 1 1 50 50 ALA N N 50 122.955 122.955 122.198 0.757 18493 151 1 . 1 1 50 50 ALA C C 50 179.594 179.594 179.651 -0.057 18493 152 1 . 1 1 50 50 ALA CA C 50 55.902 55.902 55.152 0.750 18493 153 1 . 1 1 50 50 ALA CB C 50 16.623 16.623 18.275 -1.651 18493 154 1 . 1 1 51 51 LEU N N 51 115.737 115.737 118.485 -2.748 18493 155 1 . 1 1 51 51 LEU C C 51 177.990 177.990 178.269 -0.279 18493 156 1 . 1 1 51 51 LEU CA C 51 57.285 57.285 58.066 -0.781 18493 157 1 . 1 1 51 51 LEU CB C 51 41.369 41.369 40.936 0.433 18493 158 1 . 1 1 52 52 PHE N N 52 122.707 122.707 119.311 3.395 18493 159 1 . 1 1 52 52 PHE C C 52 179.142 179.142 178.098 1.043 18493 160 1 . 1 1 52 52 PHE CA C 52 62.518 62.518 61.402 1.116 18493 161 1 . 1 1 52 52 PHE CB C 52 38.538 38.538 38.445 0.093 18493 162 1 . 1 1 52 52 PHE H H 52 8.863 8.863 7.959 0.904 18493 163 1 . 1 1 53 53 GLY N N 53 110.801 110.801 108.338 2.463 18493 164 1 . 1 1 53 53 GLY C C 53 175.378 175.378 176.262 -0.885 18493 165 1 . 1 1 53 53 GLY CA C 53 48.024 48.024 47.388 0.636 18493 166 1 . 1 1 53 53 GLY H H 53 9.027 9.027 8.048 0.979 18493 167 1 . 1 1 54 54 VAL N N 54 121.926 121.926 122.645 -0.719 18493 168 1 . 1 1 54 54 VAL C C 54 177.035 177.035 177.652 -0.617 18493 169 1 . 1 1 54 54 VAL CA C 54 67.448 67.448 65.382 2.066 18493 170 1 . 1 1 54 54 VAL CB C 54 31.246 31.246 31.732 -0.486 18493 171 1 . 1 1 54 54 VAL H H 54 7.948 7.948 8.055 -0.107 18493 172 1 . 1 1 55 55 LEU N N 55 119.894 119.894 121.429 -1.535 18493 173 1 . 1 1 55 55 LEU C C 55 178.175 178.175 178.607 -0.432 18493 174 1 . 1 1 55 55 LEU CA C 55 58.490 58.490 58.063 0.427 18493 175 1 . 1 1 55 55 LEU CB C 55 42.145 42.145 40.822 1.323 18493 176 1 . 1 1 55 55 LEU H H 55 8.646 8.646 8.968 -0.322 18493 177 1 . 1 1 56 56 GLY N N 56 106.262 106.262 106.710 -0.448 18493 178 1 . 1 1 56 56 GLY C C 56 174.618 174.618 175.595 -0.977 18493 179 1 . 1 1 56 56 GLY CA C 56 47.533 47.533 47.430 0.103 18493 180 1 . 1 1 57 57 ALA N N 57 123.002 123.002 124.477 -1.475 18493 181 1 . 1 1 57 57 ALA C C 57 178.688 178.688 179.416 -0.728 18493 182 1 . 1 1 57 57 ALA CA C 57 55.548 55.548 54.895 0.653 18493 183 1 . 1 1 57 57 ALA CB C 57 18.065 18.065 18.434 -0.369 18493 184 1 . 1 1 58 58 ALA N N 58 118.866 118.866 121.113 -2.247 18493 185 1 . 1 1 58 58 ALA C C 58 179.348 179.348 179.334 0.014 18493 186 1 . 1 1 58 58 ALA CA C 58 54.763 54.763 54.627 0.136 18493 187 1 . 1 1 58 58 ALA CB C 58 17.898 17.898 18.431 -0.533 18493 188 1 . 1 1 58 58 ALA H H 58 8.674 8.674 7.931 0.743 18493 189 1 . 1 1 59 59 LEU N N 59 115.384 115.384 119.436 -4.053 18493 190 1 . 1 1 59 59 LEU C C 59 177.654 177.654 178.737 -1.083 18493 191 1 . 1 1 59 59 LEU CA C 59 57.387 57.387 57.759 -0.372 18493 192 1 . 1 1 59 59 LEU CB C 59 41.209 41.209 42.094 -0.885 18493 193 1 . 1 1 60 60 ILE N N 60 116.140 116.140 117.057 -0.917 18493 194 1 . 1 1 60 60 ILE C C 60 180.024 180.024 177.776 2.248 18493 195 1 . 1 1 60 60 ILE CA C 60 64.263 64.263 64.359 -0.096 18493 196 1 . 1 1 60 60 ILE CB C 60 37.240 37.240 37.691 -0.451 18493 197 1 . 1 1 61 61 GLY N N 61 110.127 110.127 106.229 3.898 18493 198 1 . 1 1 61 61 GLY C C 61 173.716 173.716 174.403 -0.687 18493 199 1 . 1 1 61 61 GLY CA C 61 45.617 45.617 45.524 0.093 18493 200 1 . 1 1 61 61 GLY H H 61 9.046 9.046 7.992 1.054 18493 201 1 . 1 1 62 62 ALA N N 62 118.949 118.949 123.464 -4.515 18493 202 1 . 1 1 62 62 ALA C C 62 176.192 176.192 178.365 -2.173 18493 203 1 . 1 1 62 62 ALA CA C 62 53.268 53.268 53.243 0.025 18493 204 1 . 1 1 62 62 ALA CB C 62 19.138 19.138 19.135 0.003 18493 205 1 . 1 1 62 62 ALA H H 62 8.066 8.066 7.524 0.542 18493 206 1 . 1 1 63 63 ILE N N 63 116.800 116.800 118.510 -1.710 18493 207 1 . 1 1 63 63 ILE CA C 63 66.739 66.739 63.044 3.695 18493 208 1 . 1 1 63 63 ILE CB C 63 37.947 37.947 38.128 -0.181 18493 209 1 . 1 1 64 64 ALA N N 64 123.957 123.957 121.215 2.742 18493 210 1 . 1 1 64 64 ALA CA C 64 52.934 52.934 50.338 2.596 18493 211 1 . 1 1 64 64 ALA CB C 64 19.428 19.428 18.533 0.895 18493 212 1 . 1 1 65 65 PRO CA C 65 65.350 65.350 62.790 2.560 18493 213 1 . 1 1 66 66 LYS N N 66 116.618 116.618 116.723 -0.105 18493 214 1 . 1 1 66 66 LYS C C 66 177.500 177.500 175.954 1.546 18493 215 1 . 1 1 66 66 LYS CA C 66 56.547 56.547 57.725 -1.178 18493 216 1 . 1 1 66 66 LYS CB C 66 30.522 30.522 31.679 -1.157 18493 217 1 . 1 1 67 67 THR CA C 67 60.452 60.452 62.743 -2.291 18493 218 1 . 1 1 67 67 THR CB C 67 69.948 69.948 68.226 1.722 18493 219 1 . 1 1 68 68 PRO C C 68 177.070 177.070 177.132 -0.062 18493 220 1 . 1 1 68 68 PRO CA C 68 63.315 63.315 62.209 1.106 18493 221 1 . 1 1 68 68 PRO CB C 68 32.458 32.458 32.128 0.330 18493 222 1 . 1 1 69 69 LEU N N 69 121.517 121.517 117.450 4.067 18493 223 1 . 1 1 69 69 LEU C C 69 179.448 179.448 177.490 1.958 18493 224 1 . 1 1 69 69 LEU CA C 69 57.389 57.389 56.341 1.048 18493 225 1 . 1 1 69 69 LEU CB C 69 42.737 42.737 40.618 2.119 18493 226 1 . 1 1 69 69 LEU H H 69 8.882 8.882 8.152 0.730 18493 227 1 . 1 1 70 70 ARG N N 70 114.028 114.028 118.434 -4.406 18493 228 1 . 1 1 70 70 ARG C C 70 177.925 177.925 177.461 0.464 18493 229 1 . 1 1 70 70 ARG CA C 70 58.429 58.429 57.190 1.239 18493 230 1 . 1 1 70 70 ARG CB C 70 29.391 29.391 28.878 0.513 18493 231 1 . 1 1 70 70 ARG H H 70 8.202 8.202 8.002 0.200 18493 232 1 . 1 1 71 71 TYR N N 71 121.740 121.740 117.775 3.965 18493 233 1 . 1 1 71 71 TYR CA C 71 57.374 57.374 56.751 0.623 18493 234 1 . 1 1 71 71 TYR H H 71 8.136 8.136 7.450 0.686 18493 235 1 . 1 1 72 72 VAL N N 72 118.416 118.416 121.450 -3.034 18493 236 1 . 1 1 72 72 VAL C C 72 177.702 177.702 177.114 0.588 18493 237 1 . 1 1 72 72 VAL CA C 72 66.098 66.098 64.703 1.395 18493 238 1 . 1 1 72 72 VAL CB C 72 31.343 31.343 31.149 0.194 18493 239 1 . 1 1 73 73 ALA N N 73 120.283 120.283 122.049 -1.766 18493 240 1 . 1 1 73 73 ALA C C 73 179.763 179.763 179.477 0.286 18493 241 1 . 1 1 73 73 ALA CA C 73 55.785 55.785 55.082 0.703 18493 242 1 . 1 1 73 73 ALA CB C 73 19.265 19.265 18.280 0.985 18493 243 1 . 1 1 73 73 ALA H H 73 9.015 9.015 7.895 1.120 18493 244 1 . 1 1 74 74 MET N N 74 115.547 115.547 117.284 -1.737 18493 245 1 . 1 1 74 74 MET C C 74 177.223 177.223 178.576 -1.353 18493 246 1 . 1 1 74 74 MET CA C 74 61.023 61.023 57.849 3.174 18493 247 1 . 1 1 74 74 MET CB C 74 33.777 33.777 31.577 2.200 18493 248 1 . 1 1 74 74 MET H H 74 8.163 8.163 7.989 0.174 18493 249 1 . 1 1 75 75 VAL N N 75 118.690 118.690 119.278 -0.588 18493 250 1 . 1 1 75 75 VAL C C 75 177.166 177.166 177.695 -0.529 18493 251 1 . 1 1 75 75 VAL CA C 75 67.581 67.581 66.518 1.063 18493 252 1 . 1 1 75 75 VAL CB C 75 31.408 31.408 31.308 0.100 18493 253 1 . 1 1 75 75 VAL H H 75 7.554 7.554 7.982 -0.428 18493 254 1 . 1 1 76 76 ILE N N 76 118.959 118.959 120.364 -1.405 18493 255 1 . 1 1 76 76 ILE C C 76 178.680 178.680 177.350 1.330 18493 256 1 . 1 1 76 76 ILE CA C 76 65.839 65.839 64.633 1.206 18493 257 1 . 1 1 76 76 ILE CB C 76 38.414 38.414 37.900 0.514 18493 258 1 . 1 1 77 77 TRP N N 77 125.440 125.440 121.535 3.905 18493 259 1 . 1 1 77 77 TRP C C 77 177.153 177.153 178.112 -0.959 18493 260 1 . 1 1 77 77 TRP CA C 77 58.779 58.779 60.002 -1.223 18493 261 1 . 1 1 77 77 TRP CB C 77 30.494 30.494 29.261 1.233 18493 262 1 . 1 1 77 77 TRP H H 77 9.515 9.515 8.209 1.306 18493 263 1 . 1 1 78 78 LEU N N 78 118.968 118.968 122.236 -3.268 18493 264 1 . 1 1 78 78 LEU C C 78 178.381 178.381 178.387 -0.006 18493 265 1 . 1 1 78 78 LEU CA C 78 58.041 58.041 58.082 -0.041 18493 266 1 . 1 1 78 78 LEU CB C 78 43.807 43.807 41.339 2.468 18493 267 1 . 1 1 78 78 LEU H H 78 9.367 9.367 8.344 1.023 18493 268 1 . 1 1 79 79 TYR N N 79 118.181 118.181 120.176 -1.995 18493 269 1 . 1 1 79 79 TYR C C 79 176.777 176.777 177.638 -0.861 18493 270 1 . 1 1 79 79 TYR CA C 79 62.849 62.849 62.031 0.818 18493 271 1 . 1 1 80 80 SER N N 80 114.286 114.286 115.066 -0.780 18493 272 1 . 1 1 80 80 SER C C 80 175.943 175.943 176.716 -0.773 18493 273 1 . 1 1 80 80 SER CA C 80 63.515 63.515 61.518 1.997 18493 274 1 . 1 1 80 80 SER CB C 80 63.941 63.941 62.682 1.259 18493 275 1 . 1 1 81 81 ALA N N 81 121.070 121.070 124.179 -3.109 18493 276 1 . 1 1 81 81 ALA C C 81 178.208 178.208 179.222 -1.014 18493 277 1 . 1 1 81 81 ALA CA C 81 55.224 55.224 54.616 0.608 18493 278 1 . 1 1 81 81 ALA CB C 81 17.897 17.897 18.412 -0.515 18493 279 1 . 1 1 82 82 PHE N N 82 117.560 117.560 120.554 -2.994 18493 280 1 . 1 1 82 82 PHE C C 82 176.975 176.975 177.145 -0.170 18493 281 1 . 1 1 82 82 PHE CA C 82 62.132 62.132 60.456 1.676 18493 282 1 . 1 1 82 82 PHE CB C 82 38.497 38.497 39.022 -0.525 18493 283 1 . 1 1 83 83 ARG N N 83 117.110 117.110 118.952 -1.842 18493 284 1 . 1 1 83 83 ARG C C 83 178.637 178.637 178.400 0.237 18493 285 1 . 1 1 83 83 ARG CA C 83 60.291 60.291 58.817 1.474 18493 286 1 . 1 1 83 83 ARG CB C 83 28.625 28.625 29.424 -0.799 18493 287 1 . 1 1 84 84 GLY N N 84 105.915 105.915 106.739 -0.824 18493 288 1 . 1 1 84 84 GLY C C 84 177.091 177.091 175.522 1.569 18493 289 1 . 1 1 84 84 GLY CA C 84 46.128 46.128 46.476 -0.348 18493 290 1 . 1 1 85 85 VAL N N 85 124.985 124.985 122.734 2.252 18493 291 1 . 1 1 85 85 VAL C C 85 176.387 176.387 177.858 -1.471 18493 292 1 . 1 1 85 85 VAL CA C 85 66.960 66.960 65.559 1.401 18493 293 1 . 1 1 85 85 VAL CB C 85 31.066 31.066 31.522 -0.456 18493 294 1 . 1 1 86 86 GLN N N 86 116.522 116.522 118.991 -2.469 18493 295 1 . 1 1 86 86 GLN C C 86 179.586 179.586 178.641 0.945 18493 296 1 . 1 1 86 86 GLN CA C 86 59.505 59.505 58.880 0.626 18493 297 1 . 1 1 86 86 GLN CB C 86 28.762 28.762 28.035 0.727 18493 298 1 . 1 1 87 87 LEU N N 87 121.211 121.211 119.717 1.494 18493 299 1 . 1 1 87 87 LEU C C 87 178.396 178.396 179.531 -1.135 18493 300 1 . 1 1 87 87 LEU CA C 87 57.847 57.847 57.403 0.444 18493 301 1 . 1 1 87 87 LEU CB C 87 41.924 41.924 41.403 0.521 18493 302 1 . 1 1 87 87 LEU H H 87 8.955 8.955 7.680 1.275 18493 303 1 . 1 1 88 88 THR N N 88 108.251 108.251 114.236 -5.984 18493 304 1 . 1 1 88 88 THR C C 88 180.013 180.013 176.495 3.518 18493 305 1 . 1 1 88 88 THR CA C 88 65.112 65.112 66.064 -0.951 18493 306 1 . 1 1 88 88 THR CB C 88 68.805 68.805 68.930 -0.125 18493 307 1 . 1 1 88 88 THR H H 88 8.764 8.764 8.164 0.600 18493 308 1 . 1 1 89 89 TYR N N 89 127.947 127.947 122.792 5.155 18493 309 1 . 1 1 89 89 TYR C C 89 177.244 177.244 177.163 0.081 18493 310 1 . 1 1 89 89 TYR H H 89 9.868 9.868 8.346 1.523 18493 311 1 . 1 1 90 90 GLU N N 90 121.163 121.163 117.993 3.170 18493 312 1 . 1 1 90 90 GLU C C 90 178.671 178.671 178.619 0.052 18493 313 1 . 1 1 90 90 GLU H H 90 8.515 8.515 8.043 0.472 18493 314 1 . 1 1 91 91 HIS N N 91 120.459 120.459 119.253 1.206 18493 315 1 . 1 1 91 91 HIS C C 91 177.605 177.605 177.067 0.538 18493 316 1 . 1 1 91 91 HIS CA C 91 57.085 57.085 58.936 -1.851 18493 317 1 . 1 1 91 91 HIS CB C 91 34.128 34.128 29.886 4.242 18493 318 1 . 1 1 91 91 HIS H H 91 9.102 9.102 7.892 1.210 18493 319 1 . 1 1 92 92 THR N N 92 115.463 115.463 114.696 0.767 18493 320 1 . 1 1 92 92 THR C C 92 176.189 176.189 176.244 -0.055 18493 321 1 . 1 1 92 92 THR CA C 92 67.058 67.058 65.506 1.552 18493 322 1 . 1 1 92 92 THR CB C 92 68.564 68.564 68.997 -0.433 18493 323 1 . 1 1 92 92 THR H H 92 9.550 9.550 8.014 1.536 18493 324 1 . 1 1 93 93 MET N N 93 117.153 117.153 121.390 -4.237 18493 325 1 . 1 1 93 93 MET C C 93 176.972 176.972 178.193 -1.221 18493 326 1 . 1 1 93 93 MET CA C 93 62.369 62.369 57.434 4.935 18493 327 1 . 1 1 93 93 MET CB C 93 33.515 33.515 31.629 1.886 18493 328 1 . 1 1 94 94 LEU N N 94 117.981 117.981 118.420 -0.439 18493 329 1 . 1 1 94 94 LEU CA C 94 57.489 57.489 57.826 -0.337 18493 330 1 . 1 1 94 94 LEU CB C 94 41.432 41.432 40.953 0.479 18493 331 1 . 1 1 94 94 LEU H H 94 8.497 8.497 8.389 0.108 18493 332 1 . 1 1 95 95 GLN C C 95 178.331 178.331 177.356 0.975 18493 333 1 . 1 1 95 95 GLN CA C 95 57.604 57.604 57.582 0.022 18493 334 1 . 1 1 95 95 GLN CB C 95 28.200 28.200 28.652 -0.452 18493 335 1 . 1 1 96 96 LEU N N 96 118.174 118.174 118.605 -0.431 18493 336 1 . 1 1 96 96 LEU C C 96 177.842 177.842 175.642 2.200 18493 337 1 . 1 1 96 96 LEU CA C 96 57.747 57.747 55.359 2.388 18493 338 1 . 1 1 96 96 LEU CB C 96 41.721 41.721 42.399 -0.678 18493 339 1 . 1 1 97 97 TYR N N 97 117.359 117.359 116.917 0.442 18493 340 1 . 1 1 97 97 TYR CA C 97 57.581 57.581 55.699 1.882 18493 341 1 . 1 1 97 97 TYR H H 97 8.485 8.485 7.963 0.522 18493 342 1 . 1 1 98 98 PRO CA C 98 63.847 63.847 62.453 1.394 18493 343 1 . 1 1 99 99 SER CA C 99 58.145 58.145 56.515 1.630 18493 344 1 . 1 1 99 99 SER CB C 99 64.506 64.506 63.436 1.070 18493 345 1 . 1 1 101 101 PHE C C 101 174.992 174.992 175.141 -0.149 18493 346 1 . 1 1 102 102 ALA N N 102 120.614 120.614 124.495 -3.881 18493 347 1 . 1 1 102 102 ALA C C 102 176.810 176.810 177.177 -0.367 18493 348 1 . 1 1 102 102 ALA CA C 102 54.355 54.355 53.024 1.331 18493 349 1 . 1 1 102 102 ALA H H 102 7.383 7.383 7.849 -0.466 18493 350 1 . 1 1 103 103 THR N N 103 112.507 112.507 114.402 -1.896 18493 351 1 . 1 1 103 103 THR C C 103 175.666 175.666 173.647 2.019 18493 352 1 . 1 1 103 103 THR CA C 103 59.838 59.838 62.040 -2.202 18493 353 1 . 1 1 103 103 THR CB C 103 67.623 67.623 69.630 -2.007 18493 354 1 . 1 1 103 103 THR H H 103 9.278 9.278 7.786 1.492 18493 355 1 . 1 1 104 104 CYS N N 104 122.754 122.754 121.858 0.897 18493 356 1 . 1 1 104 104 CYS C C 104 174.474 174.474 174.122 0.352 18493 357 1 . 1 1 104 104 CYS CA C 104 64.988 64.988 57.185 7.803 18493 358 1 . 1 1 104 104 CYS CB C 104 42.988 42.988 29.809 13.179 18493 359 1 . 1 1 104 104 CYS H H 104 9.934 9.934 8.431 1.503 18493 360 1 . 1 1 105 105 ASP N N 105 121.350 121.350 122.636 -1.286 18493 361 1 . 1 1 105 105 ASP CB C 105 41.030 41.030 41.127 -0.098 18493 362 1 . 1 1 105 105 ASP H H 105 8.153 8.153 8.572 -0.419 18493 363 1 . 1 1 115 115 PRO CA C 115 61.148 61.148 63.033 -1.885 18493 364 1 . 1 1 115 115 PRO CB C 115 30.280 30.280 32.429 -2.149 18493 365 1 . 1 1 116 116 LEU C C 116 178.163 178.163 175.755 2.408 18493 366 1 . 1 1 116 116 LEU CA C 116 58.746 58.746 55.121 3.625 18493 367 1 . 1 1 116 116 LEU CB C 116 42.932 42.932 42.300 0.632 18493 368 1 . 1 1 117 117 ASP N N 117 116.302 116.302 119.184 -2.882 18493 369 1 . 1 1 117 117 ASP C C 117 177.528 177.528 176.206 1.322 18493 370 1 . 1 1 117 117 ASP CB C 117 41.252 41.252 41.070 0.182 18493 371 1 . 1 1 118 118 LYS N N 118 118.983 118.983 120.466 -1.483 18493 372 1 . 1 1 118 118 LYS H H 118 7.538 7.538 8.311 -0.773 18493 373 1 . 1 1 119 119 TRP C C 119 177.867 177.867 175.959 1.908 18493 374 1 . 1 1 120 120 VAL N N 120 113.149 113.149 114.068 -0.919 18493 375 1 . 1 1 120 120 VAL CA C 120 58.651 58.651 59.478 -0.827 18493 376 1 . 1 1 120 120 VAL CB C 120 31.821 31.821 33.169 -1.348 18493 377 1 . 1 1 120 120 VAL H H 120 8.936 8.936 7.715 1.221 18493 378 1 . 1 1 121 121 PRO C C 121 178.888 178.888 177.572 1.316 18493 379 1 . 1 1 121 121 PRO CA C 121 65.185 65.185 63.916 1.270 18493 380 1 . 1 1 121 121 PRO CB C 121 31.781 31.781 31.995 -0.214 18493 381 1 . 1 1 122 122 GLN N N 122 116.304 116.304 118.069 -1.765 18493 382 1 . 1 1 122 122 GLN C C 122 174.326 174.326 177.012 -2.686 18493 383 1 . 1 1 122 122 GLN CA C 122 58.463 58.463 58.209 0.255 18493 384 1 . 1 1 122 122 GLN H H 122 9.809 9.809 8.568 1.241 18493 385 1 . 1 1 123 123 VAL N N 123 113.254 113.254 117.991 -4.737 18493 386 1 . 1 1 123 123 VAL C C 123 175.777 175.777 176.224 -0.447 18493 387 1 . 1 1 123 123 VAL CA C 123 61.689 61.689 64.030 -2.341 18493 388 1 . 1 1 123 123 VAL CB C 123 35.373 35.373 31.718 3.655 18493 389 1 . 1 1 123 123 VAL H H 123 8.219 8.219 7.832 0.387 18493 390 1 . 1 1 124 124 PHE N N 124 112.242 112.242 118.586 -6.344 18493 391 1 . 1 1 124 124 PHE C C 124 172.759 172.759 174.551 -1.792 18493 392 1 . 1 1 124 124 PHE CB C 124 39.318 39.318 40.009 -0.691 18493 393 1 . 1 1 125 125 VAL N N 125 115.233 115.233 118.659 -3.426 18493 394 1 . 1 1 125 125 VAL C C 125 177.034 177.034 174.069 2.965 18493 395 1 . 1 1 125 125 VAL CA C 125 61.950 61.950 61.129 0.821 18493 396 1 . 1 1 125 125 VAL CB C 125 33.376 33.376 34.545 -1.169 18493 397 1 . 1 1 125 125 VAL H H 125 7.799 7.799 7.925 -0.126 18493 398 1 . 1 1 126 126 ALA N N 126 130.709 130.709 126.617 4.092 18493 399 1 . 1 1 126 126 ALA C C 126 175.920 175.920 176.624 -0.704 18493 400 1 . 1 1 126 126 ALA CA C 126 54.493 54.493 52.278 2.215 18493 401 1 . 1 1 126 126 ALA CB C 126 17.215 17.215 20.204 -2.989 18493 402 1 . 1 1 126 126 ALA H H 126 9.014 9.014 8.275 0.739 18493 403 1 . 1 1 127 127 SER N N 127 112.716 112.716 114.687 -1.971 18493 404 1 . 1 1 127 127 SER CA C 127 58.101 58.101 58.942 -0.841 18493 405 1 . 1 1 127 127 SER CB C 127 64.539 64.539 63.446 1.094 18493 406 1 . 1 1 127 127 SER H H 127 8.145 8.145 8.284 -0.139 18493 407 1 . 1 1 128 128 GLY N N 128 106.487 106.487 110.506 -4.019 18493 408 1 . 1 1 128 128 GLY C C 128 177.047 177.047 173.164 3.883 18493 409 1 . 1 1 128 128 GLY CA C 128 46.296 46.296 45.266 1.030 18493 410 1 . 1 1 128 128 GLY H H 128 8.595 8.595 8.393 0.202 18493 411 1 . 1 1 129 129 ASP C C 129 177.916 177.916 175.299 2.617 18493 412 1 . 1 1 129 129 ASP CB C 129 43.975 43.975 41.143 2.832 18493 413 1 . 1 1 130 130 CYS N N 130 122.984 122.984 118.701 4.283 18493 414 1 . 1 1 130 130 CYS C C 130 173.312 173.312 174.580 -1.268 18493 415 1 . 1 1 130 130 CYS CA C 130 64.581 64.581 57.794 6.787 18493 416 1 . 1 1 130 130 CYS CB C 130 42.879 42.879 28.989 13.890 18493 417 1 . 1 1 130 130 CYS H H 130 9.948 9.948 8.324 1.624 18493 418 1 . 1 1 131 131 ALA N N 131 121.534 121.534 123.930 -2.396 18493 419 1 . 1 1 131 131 ALA CA C 131 52.640 52.640 52.635 0.005 18493 420 1 . 1 1 131 131 ALA CB C 131 18.497 18.497 19.271 -0.774 18493 421 1 . 1 1 131 131 ALA H H 131 9.869 9.869 8.340 1.529 18493 422 1 . 1 1 136 136 ASP C C 136 172.916 172.916 175.420 -2.504 18493 423 1 . 1 1 137 137 PHE N N 137 117.677 117.677 119.463 -1.786 18493 424 1 . 1 1 137 137 PHE CA C 137 57.310 57.310 58.060 -0.750 18493 425 1 . 1 1 137 137 PHE CB C 137 42.927 42.927 39.227 3.700 18493 426 1 . 1 1 137 137 PHE H H 137 8.959 8.959 8.337 0.622 18493 427 1 . 1 1 138 138 LEU CB C 138 43.547 43.547 41.555 1.992 18493 428 1 . 1 1 139 139 GLY C C 139 176.262 176.262 173.863 2.399 18493 429 1 . 1 1 139 139 GLY CA C 139 46.123 46.123 45.529 0.595 18493 430 1 . 1 1 140 140 LEU N N 140 124.207 124.207 120.382 3.825 18493 431 1 . 1 1 140 140 LEU CB C 140 40.503 40.503 42.850 -2.347 18493 432 1 . 1 1 142 142 MET CA C 142 56.442 56.442 58.885 -2.443 18493 433 1 . 1 1 143 143 PRO CA C 143 63.254 63.254 65.968 -2.714 18493 434 1 . 1 1 144 144 GLN C C 144 177.307 177.307 178.247 -0.940 18493 435 1 . 1 1 145 145 TRP N N 145 120.795 120.795 121.070 -0.275 18493 436 1 . 1 1 145 145 TRP C C 145 178.709 178.709 178.836 -0.127 18493 437 1 . 1 1 145 145 TRP CA C 145 59.535 59.535 59.170 0.364 18493 438 1 . 1 1 145 145 TRP CB C 145 29.345 29.345 29.326 0.019 18493 439 1 . 1 1 145 145 TRP H H 145 8.386 8.386 7.796 0.590 18493 440 1 . 1 1 146 146 LEU N N 146 118.336 118.336 120.610 -2.274 18493 441 1 . 1 1 146 146 LEU C C 146 177.115 177.115 178.895 -1.780 18493 442 1 . 1 1 146 146 LEU CA C 146 57.793 57.793 57.935 -0.142 18493 443 1 . 1 1 146 146 LEU CB C 146 41.616 41.616 41.353 0.263 18493 444 1 . 1 1 146 146 LEU H H 146 9.033 9.033 8.727 0.306 18493 445 1 . 1 1 147 147 LEU N N 147 123.772 123.772 119.474 4.298 18493 446 1 . 1 1 147 147 LEU C C 147 178.787 178.787 178.813 -0.026 18493 447 1 . 1 1 147 147 LEU CA C 147 58.052 58.052 58.099 -0.047 18493 448 1 . 1 1 147 147 LEU CB C 147 41.047 41.047 40.905 0.142 18493 449 1 . 1 1 147 147 LEU H H 147 8.480 8.480 8.119 0.361 18493 450 1 . 1 1 148 148 GLY N N 148 104.457 104.457 107.943 -3.486 18493 451 1 . 1 1 148 148 GLY C C 148 174.667 174.667 176.296 -1.629 18493 452 1 . 1 1 148 148 GLY CA C 148 48.102 48.102 47.301 0.801 18493 453 1 . 1 1 149 149 ILE N N 149 121.815 121.815 122.430 -0.615 18493 454 1 . 1 1 149 149 ILE C C 149 177.725 177.725 177.265 0.460 18493 455 1 . 1 1 149 149 ILE CA C 149 65.997 65.997 63.710 2.287 18493 456 1 . 1 1 149 149 ILE CB C 149 38.262 38.262 37.815 0.447 18493 457 1 . 1 1 150 150 PHE N N 150 118.894 118.894 119.383 -0.489 18493 458 1 . 1 1 150 150 PHE C C 150 178.929 178.929 177.716 1.213 18493 459 1 . 1 1 150 150 PHE CA C 150 63.591 63.591 62.205 1.386 18493 460 1 . 1 1 150 150 PHE CB C 150 38.417 38.417 38.656 -0.239 18493 461 1 . 1 1 151 151 ILE N N 151 120.535 120.535 119.929 0.606 18493 462 1 . 1 1 151 151 ILE C C 151 177.347 177.347 177.402 -0.055 18493 463 1 . 1 1 151 151 ILE CA C 151 66.478 66.478 64.927 1.551 18493 464 1 . 1 1 151 151 ILE CB C 151 37.302 37.302 37.470 -0.168 18493 465 1 . 1 1 152 152 ALA N N 152 122.855 122.855 123.342 -0.487 18493 466 1 . 1 1 152 152 ALA C C 152 179.165 179.165 179.784 -0.619 18493 467 1 . 1 1 152 152 ALA CA C 152 56.272 56.272 55.385 0.887 18493 468 1 . 1 1 152 152 ALA CB C 152 17.993 17.993 17.891 0.102 18493 469 1 . 1 1 153 153 TYR N N 153 116.156 116.156 118.641 -2.484 18493 470 1 . 1 1 153 153 TYR C C 153 179.682 179.682 178.014 1.668 18493 471 1 . 1 1 153 153 TYR CA C 153 64.391 64.391 60.391 4.000 18493 472 1 . 1 1 153 153 TYR CB C 153 39.553 39.553 38.210 1.343 18493 473 1 . 1 1 153 153 TYR H H 153 8.680 8.680 7.941 0.739 18493 474 1 . 1 1 154 154 LEU N N 154 122.327 122.327 122.019 0.308 18493 475 1 . 1 1 154 154 LEU C C 154 177.336 177.336 178.734 -1.398 18493 476 1 . 1 1 154 154 LEU CA C 154 57.905 57.905 58.367 -0.462 18493 477 1 . 1 1 154 154 LEU CB C 154 42.009 42.009 41.820 0.189 18493 478 1 . 1 1 155 155 ILE N N 155 119.079 119.079 118.388 0.691 18493 479 1 . 1 1 155 155 ILE C C 155 177.589 177.589 178.096 -0.507 18493 480 1 . 1 1 155 155 ILE CA C 155 65.996 65.996 65.153 0.843 18493 481 1 . 1 1 155 155 ILE CB C 155 38.179 38.179 37.618 0.561 18493 482 1 . 1 1 156 156 VAL N N 156 117.551 117.551 120.989 -3.438 18493 483 1 . 1 1 156 156 VAL C C 156 176.163 176.163 177.652 -1.489 18493 484 1 . 1 1 156 156 VAL CA C 156 67.664 67.664 66.721 0.943 18493 485 1 . 1 1 156 156 VAL CB C 156 31.694 31.694 31.122 0.572 18493 486 1 . 1 1 157 157 ALA N N 157 122.470 122.470 121.824 0.645 18493 487 1 . 1 1 157 157 ALA C C 157 179.076 179.076 179.583 -0.507 18493 488 1 . 1 1 157 157 ALA CA C 157 54.803 54.803 55.133 -0.330 18493 489 1 . 1 1 157 157 ALA CB C 157 16.120 16.120 18.350 -2.230 18493 490 1 . 1 1 158 158 VAL N N 158 116.045 116.045 118.178 -2.133 18493 491 1 . 1 1 158 158 VAL C C 158 177.491 177.491 177.750 -0.260 18493 492 1 . 1 1 158 158 VAL CA C 158 67.160 67.160 65.955 1.205 18493 493 1 . 1 1 158 158 VAL CB C 158 31.331 31.331 31.704 -0.373 18493 494 1 . 1 1 159 159 LEU N N 159 116.776 116.776 120.300 -3.524 18493 495 1 . 1 1 159 159 LEU C C 159 178.312 178.312 178.719 -0.407 18493 496 1 . 1 1 159 159 LEU CA C 159 57.443 57.443 57.910 -0.467 18493 497 1 . 1 1 159 159 LEU CB C 159 41.567 41.567 41.414 0.153 18493 498 1 . 1 1 160 160 VAL N N 160 118.890 118.890 117.608 1.282 18493 499 1 . 1 1 160 160 VAL C C 160 177.508 177.508 177.443 0.065 18493 500 1 . 1 1 160 160 VAL CA C 160 67.366 67.366 65.279 2.087 18493 501 1 . 1 1 160 160 VAL CB C 160 31.106 31.106 32.024 -0.918 18493 502 1 . 1 1 161 161 VAL N N 161 118.360 118.360 118.301 0.059 18493 503 1 . 1 1 161 161 VAL C C 161 176.607 176.607 176.318 0.289 18493 504 1 . 1 1 161 161 VAL CA C 161 67.614 67.614 64.098 3.516 18493 505 1 . 1 1 161 161 VAL CB C 161 31.646 31.646 32.630 -0.984 18493 stop_ save_