NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
568125 | 2m6g | 19132 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 H GLY 1 1.811 -0.001 0.854 2 HA2 GLY 1 2HA GLY 1 3.060 -0.394 -1.066 3 HA3 GLY 1 3HA GLY 1 1.564 -0.638 -1.955 4 H CYS 2 H CYS 2 4.008 0.946 -2.575 5 HA CYS 2 HA CYS 2 2.616 3.431 -3.258 6 HB2 CYS 2 2HB CYS 2 4.977 3.167 -1.524 7 HB3 CYS 2 3HB CYS 2 5.159 4.346 -2.819 8 HA PRO 3 HA PRO 3 3.571 5.360 -4.007 9 HB2 PRO 3 2HB PRO 3 3.002 6.538 -6.483 10 HB3 PRO 3 3HB PRO 3 4.480 6.759 -5.539 11 HG2 PRO 3 2HG PRO 3 3.930 4.842 -7.773 12 HG3 PRO 3 3HG PRO 3 5.365 5.844 -7.488 13 HD2 PRO 3 2HD PRO 3 4.402 2.960 -7.255 14 HD3 PRO 3 3HD PRO 3 5.725 3.989 -6.671 15 H DTR 4 H DTR 4 1.429 6.536 -4.081 16 HA DTR 4 HA DTR 4 -0.647 4.607 -4.692 17 HB2 DTR 4 2HB DTR 4 -0.667 7.380 -5.896 18 HB3 DTR 4 3HB DTR 4 -1.991 6.232 -5.938 19 HD1 DTR 4 HD1 DTR 4 -1.279 3.781 -7.301 20 HE1 DTR 4 HE1 DTR 4 0.065 3.427 -9.545 21 HZ2 DTR 4 HZ2 DTR 4 1.902 5.044 -11.012 22 HH2 DTR 4 HH2 DTR 4 3.034 7.297 -10.960 23 HZ3 DTR 4 HZ3 DTR 4 2.585 8.844 -9.122 24 HE3 DTR 4 HE3 DTR 4 1.032 8.310 -7.247 25 H ASP 5 H ASP 5 0.129 5.009 -2.273 26 HA ASP 5 HA ASP 5 -2.007 6.008 -0.839 27 HB2 ASP 5 2HB ASP 5 0.804 5.297 -0.164 28 HB3 ASP 5 3HB ASP 5 -0.111 6.214 1.030 29 HA PRO 6 HA PRO 6 -1.873 10.367 -0.502 30 HB2 PRO 6 2HB PRO 6 -1.883 10.801 2.189 31 HB3 PRO 6 3HB PRO 6 -3.314 10.303 1.279 32 HG2 PRO 6 2HG PRO 6 -1.348 8.565 2.763 33 HG3 PRO 6 3HG PRO 6 -3.106 8.656 2.979 34 HD2 PRO 6 2HD PRO 6 -1.996 6.849 1.488 35 HD3 PRO 6 3HD PRO 6 -3.355 7.421 0.499 36 H TRP 7 H TRP 7 0.548 8.464 1.096 37 HA TRP 7 HA TRP 7 2.281 10.778 1.508 38 HB2 TRP 7 2HB TRP 7 1.990 8.225 2.762 39 HB3 TRP 7 3HB TRP 7 3.629 8.355 2.131 40 HD1 TRP 7 HD1 TRP 7 5.289 9.483 3.713 41 HE1 TRP 7 HE1 TRP 7 5.129 11.064 5.738 42 HE3 TRP 7 HE3 TRP 7 0.241 10.292 3.715 43 HZ2 TRP 7 HZ2 TRP 7 3.128 12.467 7.150 44 HZ3 TRP 7 HZ3 TRP 7 -0.716 11.766 5.436 45 HH2 TRP 7 HH2 TRP 7 0.699 12.829 7.118 46 H CYS 8 H CYS 8 1.519 9.617 -1.170 47 HA CYS 8 HA CYS 8 4.213 9.616 -2.265 48 HB2 CYS 8 2HB CYS 8 2.299 7.307 -2.516 49 HB3 CYS 8 3HB CYS 8 3.523 7.614 -3.743 Start of MODEL 2 1 H1 GLY 1 H GLY 1 0.148 -0.850 -1.964 2 HA2 GLY 1 2HA GLY 1 1.839 -0.007 -0.516 3 HA3 GLY 1 3HA GLY 1 3.054 -0.599 -1.639 4 H CYS 2 H CYS 2 4.179 1.129 -2.268 5 HA CYS 2 HA CYS 2 2.670 3.478 -3.214 6 HB2 CYS 2 2HB CYS 2 5.018 3.246 -1.457 7 HB3 CYS 2 3HB CYS 2 5.188 4.442 -2.738 8 HA PRO 3 HA PRO 3 3.592 5.435 -3.933 9 HB2 PRO 3 2HB PRO 3 3.095 6.338 -6.667 10 HB3 PRO 3 3HB PRO 3 4.134 7.049 -5.426 11 HG2 PRO 3 2HG PRO 3 5.136 5.830 -7.613 12 HG3 PRO 3 3HG PRO 3 5.958 5.791 -6.042 13 HD2 PRO 3 2HD PRO 3 4.300 3.231 -7.276 14 HD3 PRO 3 3HD PRO 3 5.810 3.872 -6.599 15 H DTR 4 H DTR 4 1.426 6.567 -4.019 16 HA DTR 4 HA DTR 4 -0.601 4.601 -4.691 17 HB2 DTR 4 2HB DTR 4 -0.574 7.384 -5.870 18 HB3 DTR 4 3HB DTR 4 -1.974 6.330 -5.849 19 HD1 DTR 4 HD1 DTR 4 -1.355 3.754 -7.128 20 HE1 DTR 4 HE1 DTR 4 -0.175 3.314 -9.447 21 HZ2 DTR 4 HZ2 DTR 4 1.553 4.871 -11.101 22 HH2 DTR 4 HH2 DTR 4 2.685 7.121 -11.214 23 HZ3 DTR 4 HZ3 DTR 4 2.367 8.737 -9.408 24 HE3 DTR 4 HE3 DTR 4 0.952 8.277 -7.408 25 H ASP 5 H ASP 5 0.159 4.966 -2.253 26 HA ASP 5 HA ASP 5 -2.015 5.865 -0.809 27 HB2 ASP 5 2HB ASP 5 0.821 5.251 -0.123 28 HB3 ASP 5 3HB ASP 5 -0.162 6.070 1.087 29 HA PRO 6 HA PRO 6 -2.017 10.216 -0.367 30 HB2 PRO 6 2HB PRO 6 -2.099 10.636 2.296 31 HB3 PRO 6 3HB PRO 6 -3.480 9.989 1.402 32 HG2 PRO 6 2HG PRO 6 -1.300 8.391 2.758 33 HG3 PRO 6 3HG PRO 6 -3.002 8.479 3.249 34 HD2 PRO 6 2HD PRO 6 -2.044 6.648 1.536 35 HD3 PRO 6 3HD PRO 6 -3.415 7.205 0.554 36 H TRP 7 H TRP 7 0.452 8.350 1.201 37 HA TRP 7 HA TRP 7 2.111 10.706 1.677 38 HB2 TRP 7 2HB TRP 7 1.861 8.178 2.928 39 HB3 TRP 7 3HB TRP 7 3.476 8.242 2.229 40 HD1 TRP 7 HD1 TRP 7 4.984 8.731 4.258 41 HE1 TRP 7 HE1 TRP 7 5.069 10.557 6.070 42 HE3 TRP 7 HE3 TRP 7 0.592 11.127 3.205 43 HZ2 TRP 7 HZ2 TRP 7 3.485 12.726 6.938 44 HZ3 TRP 7 HZ3 TRP 7 -0.050 13.068 4.573 45 HH2 TRP 7 HH2 TRP 7 1.367 13.849 6.402 46 H CYS 8 H CYS 8 1.400 9.584 -1.031 47 HA CYS 8 HA CYS 8 4.099 9.691 -2.109 48 HB2 CYS 8 2HB CYS 8 2.255 7.333 -2.430 49 HB3 CYS 8 3HB CYS 8 3.481 7.705 -3.638 Start of MODEL 3 1 H1 GLY 1 H GLY 1 -0.055 0.625 -0.500 2 HA2 GLY 1 2HA GLY 1 2.789 0.414 0.195 3 HA3 GLY 1 3HA GLY 1 2.229 -0.362 -1.279 4 H CYS 2 H CYS 2 3.895 1.110 -2.202 5 HA CYS 2 HA CYS 2 2.598 3.582 -3.062 6 HB2 CYS 2 2HB CYS 2 5.024 3.417 -1.406 7 HB3 CYS 2 3HB CYS 2 5.190 4.433 -2.834 8 HA PRO 3 HA PRO 3 3.590 5.372 -4.066 9 HB2 PRO 3 2HB PRO 3 3.059 5.813 -6.950 10 HB3 PRO 3 3HB PRO 3 3.967 6.808 -5.806 11 HG2 PRO 3 2HG PRO 3 5.101 5.133 -7.687 12 HG3 PRO 3 3HG PRO 3 5.911 5.709 -6.218 13 HD2 PRO 3 2HD PRO 3 3.715 3.173 -7.271 14 HD3 PRO 3 3HD PRO 3 5.350 2.866 -6.649 15 H DTR 4 H DTR 4 1.492 6.623 -4.189 16 HA DTR 4 HA DTR 4 -0.680 4.722 -4.567 17 HB2 DTR 4 2HB DTR 4 -0.617 7.435 -5.901 18 HB3 DTR 4 3HB DTR 4 -2.018 6.388 -5.797 19 HD1 DTR 4 HD1 DTR 4 -1.410 3.744 -6.962 20 HE1 DTR 4 HE1 DTR 4 -0.303 3.203 -9.295 21 HZ2 DTR 4 HZ2 DTR 4 1.348 4.697 -11.081 22 HH2 DTR 4 HH2 DTR 4 2.447 6.952 -11.342 23 HZ3 DTR 4 HZ3 DTR 4 2.170 8.650 -9.606 24 HE3 DTR 4 HE3 DTR 4 0.828 8.273 -7.539 25 H ASP 5 H ASP 5 0.287 5.241 -2.208 26 HA ASP 5 HA ASP 5 -1.752 6.327 -0.697 27 HB2 ASP 5 2HB ASP 5 0.994 5.436 -0.205 28 HB3 ASP 5 3HB ASP 5 0.451 6.677 0.921 29 HA PRO 6 HA PRO 6 -1.587 10.697 -0.606 30 HB2 PRO 6 2HB PRO 6 -1.444 11.297 2.036 31 HB3 PRO 6 3HB PRO 6 -2.920 10.705 1.266 32 HG2 PRO 6 2HG PRO 6 -0.881 9.195 2.860 33 HG3 PRO 6 3HG PRO 6 -2.650 9.113 2.946 34 HD2 PRO 6 2HD PRO 6 -1.592 7.292 1.574 35 HD3 PRO 6 3HD PRO 6 -3.010 7.819 0.645 36 H TRP 7 H TRP 7 0.926 8.869 0.936 37 HA TRP 7 HA TRP 7 2.687 11.192 1.111 38 HB2 TRP 7 2HB TRP 7 2.817 8.376 2.133 39 HB3 TRP 7 3HB TRP 7 4.292 9.330 2.001 40 HD1 TRP 7 HD1 TRP 7 4.213 11.758 3.414 41 HE1 TRP 7 HE1 TRP 7 3.184 12.213 5.729 42 HE3 TRP 7 HE3 TRP 7 1.067 7.739 3.707 43 HZ2 TRP 7 HZ2 TRP 7 1.291 11.024 7.452 44 HZ3 TRP 7 HZ3 TRP 7 -0.318 7.470 5.722 45 HH2 TRP 7 HH2 TRP 7 -0.207 9.079 7.555 46 H CYS 8 H CYS 8 1.752 9.888 -1.445 47 HA CYS 8 HA CYS 8 4.372 9.813 -2.707 48 HB2 CYS 8 2HB CYS 8 2.430 7.512 -2.730 49 HB3 CYS 8 3HB CYS 8 3.597 7.741 -4.028 Start of MODEL 4 1 H1 GLY 1 H GLY 1 0.867 -0.255 0.413 2 HA2 GLY 1 2HA GLY 1 2.881 -0.552 -1.493 3 HA3 GLY 1 3HA GLY 1 1.159 -0.567 -1.842 4 H CYS 2 H CYS 2 4.085 1.233 -1.981 5 HA CYS 2 HA CYS 2 2.640 3.522 -3.145 6 HB2 CYS 2 2HB CYS 2 4.980 3.325 -1.374 7 HB3 CYS 2 3HB CYS 2 5.184 4.440 -2.722 8 HA PRO 3 HA PRO 3 3.616 5.407 -3.974 9 HB2 PRO 3 2HB PRO 3 3.161 6.130 -6.781 10 HB3 PRO 3 3HB PRO 3 4.159 6.933 -5.564 11 HG2 PRO 3 2HG PRO 3 5.235 5.568 -7.623 12 HG3 PRO 3 3HG PRO 3 6.004 5.636 -6.026 13 HD2 PRO 3 2HD PRO 3 4.064 3.252 -7.271 14 HD3 PRO 3 3HD PRO 3 5.698 3.312 -6.577 15 H DTR 4 H DTR 4 1.483 6.592 -4.127 16 HA DTR 4 HA DTR 4 -0.597 4.650 -4.718 17 HB2 DTR 4 2HB DTR 4 -0.499 7.396 -5.977 18 HB3 DTR 4 3HB DTR 4 -1.925 6.378 -5.926 19 HD1 DTR 4 HD1 DTR 4 -1.366 3.748 -7.125 20 HE1 DTR 4 HE1 DTR 4 -0.201 3.212 -9.432 21 HZ2 DTR 4 HZ2 DTR 4 1.554 4.682 -11.136 22 HH2 DTR 4 HH2 DTR 4 2.734 6.903 -11.320 23 HZ3 DTR 4 HZ3 DTR 4 2.456 8.579 -9.563 24 HE3 DTR 4 HE3 DTR 4 1.037 8.210 -7.547 25 H ASP 5 H ASP 5 0.199 5.087 -2.292 26 HA ASP 5 HA ASP 5 -1.952 6.066 -0.865 27 HB2 ASP 5 2HB ASP 5 0.875 5.419 -0.184 28 HB3 ASP 5 3HB ASP 5 -0.065 6.320 1.002 29 HA PRO 6 HA PRO 6 -1.890 10.429 -0.577 30 HB2 PRO 6 2HB PRO 6 -1.768 10.668 2.240 31 HB3 PRO 6 3HB PRO 6 -3.222 10.634 1.236 32 HG2 PRO 6 2HG PRO 6 -1.984 8.480 2.819 33 HG3 PRO 6 3HG PRO 6 -3.661 8.657 2.271 34 HD2 PRO 6 2HD PRO 6 -1.951 6.933 1.452 35 HD3 PRO 6 3HD PRO 6 -3.321 7.471 0.460 36 H TRP 7 H TRP 7 0.565 8.585 1.038 37 HA TRP 7 HA TRP 7 2.259 10.933 1.420 38 HB2 TRP 7 2HB TRP 7 2.001 8.416 2.727 39 HB3 TRP 7 3HB TRP 7 3.628 8.511 2.059 40 HD1 TRP 7 HD1 TRP 7 5.267 10.361 3.071 41 HE1 TRP 7 HE1 TRP 7 5.195 11.718 5.257 42 HE3 TRP 7 HE3 TRP 7 0.389 9.550 4.368 43 HZ2 TRP 7 HZ2 TRP 7 3.318 12.359 7.266 44 HZ3 TRP 7 HZ3 TRP 7 -0.466 10.570 6.438 45 HH2 TRP 7 HH2 TRP 7 0.970 11.944 7.855 46 H CYS 8 H CYS 8 1.512 9.727 -1.242 47 HA CYS 8 HA CYS 8 4.205 9.758 -2.342 48 HB2 CYS 8 2HB CYS 8 2.323 7.419 -2.574 49 HB3 CYS 8 3HB CYS 8 3.552 7.730 -3.796 Start of MODEL 5 1 H1 GLY 1 H GLY 1 -0.009 0.048 -0.766 2 HA2 GLY 1 2HA GLY 1 2.429 0.084 -0.297 3 HA3 GLY 1 3HA GLY 1 2.635 -0.700 -1.856 4 H CYS 2 H CYS 2 4.105 1.108 -2.265 5 HA CYS 2 HA CYS 2 2.626 3.478 -3.201 6 HB2 CYS 2 2HB CYS 2 4.995 3.284 -1.469 7 HB3 CYS 2 3HB CYS 2 5.163 4.425 -2.799 8 HA PRO 3 HA PRO 3 3.562 5.391 -4.011 9 HB2 PRO 3 2HB PRO 3 3.102 6.073 -6.854 10 HB3 PRO 3 3HB PRO 3 3.956 6.982 -5.602 11 HG2 PRO 3 2HG PRO 3 5.343 5.826 -7.514 12 HG3 PRO 3 3HG PRO 3 5.908 5.711 -5.838 13 HD2 PRO 3 2HD PRO 3 3.868 3.677 -7.398 14 HD3 PRO 3 3HD PRO 3 5.411 3.056 -6.776 15 H DTR 4 H DTR 4 1.410 6.548 -4.112 16 HA DTR 4 HA DTR 4 -0.650 4.587 -4.718 17 HB2 DTR 4 2HB DTR 4 -0.671 7.384 -5.866 18 HB3 DTR 4 3HB DTR 4 -2.021 6.267 -5.890 19 HD1 DTR 4 HD1 DTR 4 -1.406 3.822 -7.305 20 HE1 DTR 4 HE1 DTR 4 -0.122 3.466 -9.583 21 HZ2 DTR 4 HZ2 DTR 4 1.724 5.056 -11.069 22 HH2 DTR 4 HH2 DTR 4 2.917 7.277 -11.011 23 HZ3 DTR 4 HZ3 DTR 4 2.550 8.808 -9.142 24 HE3 DTR 4 HE3 DTR 4 1.025 8.288 -7.239 25 H ASP 5 H ASP 5 0.186 4.975 -2.292 26 HA ASP 5 HA ASP 5 -1.957 5.873 -0.803 27 HB2 ASP 5 2HB ASP 5 0.907 5.306 -0.173 28 HB3 ASP 5 3HB ASP 5 -0.079 6.098 1.053 29 HA PRO 6 HA PRO 6 -1.976 10.228 -0.401 30 HB2 PRO 6 2HB PRO 6 -2.032 10.707 2.230 31 HB3 PRO 6 3HB PRO 6 -3.401 9.950 1.407 32 HG2 PRO 6 2HG PRO 6 -1.105 8.543 2.781 33 HG3 PRO 6 3HG PRO 6 -2.805 8.536 3.284 34 HD2 PRO 6 2HD PRO 6 -1.932 6.680 1.536 35 HD3 PRO 6 3HD PRO 6 -3.330 7.216 0.582 36 H TRP 7 H TRP 7 0.544 8.393 1.121 37 HA TRP 7 HA TRP 7 2.198 10.764 1.534 38 HB2 TRP 7 2HB TRP 7 2.018 8.200 2.770 39 HB3 TRP 7 3HB TRP 7 3.634 8.365 2.089 40 HD1 TRP 7 HD1 TRP 7 5.265 9.255 3.831 41 HE1 TRP 7 HE1 TRP 7 5.163 10.921 5.790 42 HE3 TRP 7 HE3 TRP 7 0.340 10.588 3.506 43 HZ2 TRP 7 HZ2 TRP 7 3.247 12.580 7.034 44 HZ3 TRP 7 HZ3 TRP 7 -0.549 12.219 5.118 45 HH2 TRP 7 HH2 TRP 7 0.876 13.193 6.845 46 H CYS 8 H CYS 8 1.426 9.611 -1.145 47 HA CYS 8 HA CYS 8 4.097 9.724 -2.292 48 HB2 CYS 8 2HB CYS 8 2.257 7.356 -2.553 49 HB3 CYS 8 3HB CYS 8 3.459 7.722 -3.786 Start of MODEL 6 1 H1 GLY 1 H GLY 1 1.540 -0.109 0.788 2 HA2 GLY 1 2HA GLY 1 2.945 -0.336 -1.034 3 HA3 GLY 1 3HA GLY 1 1.438 -0.725 -1.849 4 H CYS 2 H CYS 2 3.975 1.548 -1.496 5 HA CYS 2 HA CYS 2 2.591 3.618 -3.003 6 HB2 CYS 2 2HB CYS 2 5.022 3.458 -1.356 7 HB3 CYS 2 3HB CYS 2 5.182 4.472 -2.786 8 HA PRO 3 HA PRO 3 3.577 5.408 -4.012 9 HB2 PRO 3 2HB PRO 3 3.096 5.749 -6.943 10 HB3 PRO 3 3HB PRO 3 3.829 6.867 -5.787 11 HG2 PRO 3 2HG PRO 3 5.373 5.548 -7.467 12 HG3 PRO 3 3HG PRO 3 5.862 5.714 -5.771 13 HD2 PRO 3 2HD PRO 3 3.674 3.288 -7.231 14 HD3 PRO 3 3HD PRO 3 5.277 2.838 -6.613 15 H DTR 4 H DTR 4 1.478 6.656 -4.128 16 HA DTR 4 HA DTR 4 -0.694 4.753 -4.472 17 HB2 DTR 4 2HB DTR 4 -0.614 7.424 -5.887 18 HB3 DTR 4 3HB DTR 4 -2.037 6.413 -5.727 19 HD1 DTR 4 HD1 DTR 4 -1.577 3.750 -6.849 20 HE1 DTR 4 HE1 DTR 4 -0.490 3.091 -9.161 21 HZ2 DTR 4 HZ2 DTR 4 1.256 4.444 -10.969 22 HH2 DTR 4 HH2 DTR 4 2.487 6.624 -11.274 23 HZ3 DTR 4 HZ3 DTR 4 2.299 8.375 -9.580 24 HE3 DTR 4 HE3 DTR 4 0.926 8.125 -7.515 25 H ASP 5 H ASP 5 0.260 5.314 -2.127 26 HA ASP 5 HA ASP 5 -1.772 6.452 -0.646 27 HB2 ASP 5 2HB ASP 5 1.077 5.775 -0.082 28 HB3 ASP 5 3HB ASP 5 0.210 6.752 1.100 29 HA PRO 6 HA PRO 6 -1.564 10.820 -0.645 30 HB2 PRO 6 2HB PRO 6 -1.407 11.454 2.001 31 HB3 PRO 6 3HB PRO 6 -2.896 10.909 1.220 32 HG2 PRO 6 2HG PRO 6 -0.818 9.163 2.553 33 HG3 PRO 6 3HG PRO 6 -2.466 9.466 3.135 34 HD2 PRO 6 2HD PRO 6 -1.610 7.461 1.606 35 HD3 PRO 6 3HD PRO 6 -3.020 7.984 0.662 36 H TRP 7 H TRP 7 0.925 9.000 0.944 37 HA TRP 7 HA TRP 7 2.708 11.309 1.078 38 HB2 TRP 7 2HB TRP 7 2.871 8.487 2.111 39 HB3 TRP 7 3HB TRP 7 4.297 9.520 2.052 40 HD1 TRP 7 HD1 TRP 7 3.879 12.015 3.396 41 HE1 TRP 7 HE1 TRP 7 2.788 12.351 5.703 42 HE3 TRP 7 HE3 TRP 7 1.300 7.613 3.723 43 HZ2 TRP 7 HZ2 TRP 7 1.064 10.936 7.433 44 HZ3 TRP 7 HZ3 TRP 7 -0.045 7.181 5.737 45 HH2 TRP 7 HH2 TRP 7 -0.159 8.809 7.553 46 H CYS 8 H CYS 8 1.769 9.963 -1.454 47 HA CYS 8 HA CYS 8 4.392 9.838 -2.706 48 HB2 CYS 8 2HB CYS 8 2.432 7.553 -2.684 49 HB3 CYS 8 3HB CYS 8 3.600 7.746 -3.987 Start of MODEL 7 1 H1 GLY 1 H GLY 1 2.766 1.258 1.316 2 HA2 GLY 1 2HA GLY 1 2.797 -0.248 -0.810 3 HA3 GLY 1 3HA GLY 1 1.063 0.029 -0.736 4 H CYS 2 H CYS 2 3.828 1.031 -2.178 5 HA CYS 2 HA CYS 2 2.581 3.525 -3.027 6 HB2 CYS 2 2HB CYS 2 5.008 3.347 -1.375 7 HB3 CYS 2 3HB CYS 2 5.183 4.347 -2.814 8 HA PRO 3 HA PRO 3 3.580 5.290 -4.049 9 HB2 PRO 3 2HB PRO 3 3.265 6.645 -6.156 10 HB3 PRO 3 3HB PRO 3 4.856 5.883 -6.031 11 HG2 PRO 3 3HG PRO 3 2.747 4.170 -7.157 12 HG3 PRO 3 2HG PRO 3 4.413 4.418 -7.710 13 HD2 PRO 3 2HD PRO 3 3.963 2.597 -7.084 14 HD3 PRO 3 3HD PRO 3 5.533 3.263 -6.592 15 H DTR 4 H DTR 4 1.495 6.602 -4.281 16 HA DTR 4 HA DTR 4 -0.697 4.707 -4.631 17 HB2 DTR 4 2HB DTR 4 -0.758 7.463 -5.863 18 HB3 DTR 4 3HB DTR 4 -1.996 6.225 -5.951 19 HD1 DTR 4 HD1 DTR 4 -0.964 3.805 -7.256 20 HE1 DTR 4 HE1 DTR 4 0.404 3.601 -9.504 21 HZ2 DTR 4 HZ2 DTR 4 2.006 5.427 -11.002 22 HH2 DTR 4 HH2 DTR 4 2.833 7.809 -10.985 23 HZ3 DTR 4 HZ3 DTR 4 2.193 9.307 -9.163 24 HE3 DTR 4 HE3 DTR 4 0.733 8.598 -7.271 25 H ASP 5 H ASP 5 0.265 5.207 -2.264 26 HA ASP 5 HA ASP 5 -1.770 6.308 -0.759 27 HB2 ASP 5 2HB ASP 5 0.919 5.320 -0.263 28 HB3 ASP 5 3HB ASP 5 0.496 6.639 0.825 29 HA PRO 6 HA PRO 6 -1.566 10.675 -0.652 30 HB2 PRO 6 2HB PRO 6 -1.344 11.153 2.069 31 HB3 PRO 6 3HB PRO 6 -2.858 10.841 1.211 32 HG2 PRO 6 2HG PRO 6 -1.069 8.883 2.634 33 HG3 PRO 6 3HG PRO 6 -2.812 9.132 2.838 34 HD2 PRO 6 2HD PRO 6 -1.614 7.263 1.516 35 HD3 PRO 6 3HD PRO 6 -3.022 7.808 0.581 36 H TRP 7 H TRP 7 0.923 8.820 0.898 37 HA TRP 7 HA TRP 7 2.704 11.125 1.089 38 HB2 TRP 7 2HB TRP 7 2.769 8.319 2.127 39 HB3 TRP 7 3HB TRP 7 4.283 9.204 1.956 40 HD1 TRP 7 HD1 TRP 7 4.465 11.540 3.417 41 HE1 TRP 7 HE1 TRP 7 3.451 12.114 5.712 42 HE3 TRP 7 HE3 TRP 7 0.845 7.937 3.628 43 HZ2 TRP 7 HZ2 TRP 7 1.389 11.164 7.390 44 HZ3 TRP 7 HZ3 TRP 7 -0.606 7.837 5.612 45 HH2 TRP 7 HH2 TRP 7 -0.338 9.418 7.454 46 H CYS 8 H CYS 8 1.766 9.818 -1.473 47 HA CYS 8 HA CYS 8 4.389 9.740 -2.729 48 HB2 CYS 8 2HB CYS 8 2.448 7.438 -2.751 49 HB3 CYS 8 3HB CYS 8 3.619 7.665 -4.047 Start of MODEL 8 1 H1 GLY 1 H GLY 1 0.474 -0.477 -1.363 2 HA2 GLY 1 2HA GLY 1 2.560 0.316 0.477 3 HA3 GLY 1 3HA GLY 1 3.131 -0.627 -0.891 4 H CYS 2 H CYS 2 4.316 1.003 -1.835 5 HA CYS 2 HA CYS 2 2.729 3.222 -2.948 6 HB2 CYS 2 2HB CYS 2 5.243 3.270 -1.422 7 HB3 CYS 2 3HB CYS 2 5.278 4.219 -2.904 8 HA PRO 3 HA PRO 3 3.567 5.009 -4.089 9 HB2 PRO 3 2HB PRO 3 3.056 5.031 -7.065 10 HB3 PRO 3 3HB PRO 3 3.457 6.387 -6.004 11 HG2 PRO 3 3HG PRO 3 5.219 4.179 -7.004 12 HG3 PRO 3 2HG PRO 3 5.584 4.972 -5.461 13 HD2 PRO 3 2HD PRO 3 3.587 2.979 -7.245 14 HD3 PRO 3 3HD PRO 3 5.098 2.235 -6.684 15 H DTR 4 H DTR 4 1.400 6.141 -4.159 16 HA DTR 4 HA DTR 4 -0.677 4.120 -4.240 17 HB2 DTR 4 2HB DTR 4 -2.145 5.765 -5.540 18 HB3 DTR 4 3HB DTR 4 -1.009 4.767 -6.425 19 HD1 DTR 4 HD1 DTR 4 -1.138 8.422 -5.040 20 HE1 DTR 4 HE1 DTR 4 0.190 10.058 -6.629 21 HZ2 DTR 4 HZ2 DTR 4 1.752 9.672 -8.986 22 HH2 DTR 4 HH2 DTR 4 2.565 7.867 -10.549 23 HZ3 DTR 4 HZ3 DTR 4 1.949 5.537 -10.142 24 HE3 DTR 4 HE3 DTR 4 0.528 4.823 -8.223 25 H ASP 5 H ASP 5 0.300 4.936 -2.007 26 HA ASP 5 HA ASP 5 -1.722 6.155 -0.577 27 HB2 ASP 5 2HB ASP 5 1.130 5.530 -0.054 28 HB3 ASP 5 3HB ASP 5 0.375 6.703 1.021 29 HA PRO 6 HA PRO 6 -1.646 10.508 -1.000 30 HB2 PRO 6 2HB PRO 6 -1.337 11.289 1.657 31 HB3 PRO 6 3HB PRO 6 -2.871 10.899 0.870 32 HG2 PRO 6 2HG PRO 6 -1.270 9.297 2.742 33 HG3 PRO 6 3HG PRO 6 -2.991 9.169 2.335 34 HD2 PRO 6 2HD PRO 6 -1.522 7.382 1.562 35 HD3 PRO 6 3HD PRO 6 -2.975 7.771 0.619 36 H TRP 7 H TRP 7 0.944 8.918 0.673 37 HA TRP 7 HA TRP 7 2.659 11.277 0.526 38 HB2 TRP 7 2HB TRP 7 2.998 8.555 1.781 39 HB3 TRP 7 3HB TRP 7 4.328 9.701 1.649 40 HD1 TRP 7 HD1 TRP 7 3.775 12.199 2.871 41 HE1 TRP 7 HE1 TRP 7 2.618 12.608 5.133 42 HE3 TRP 7 HE3 TRP 7 1.385 7.709 3.384 43 HZ2 TRP 7 HZ2 TRP 7 0.918 11.212 6.902 44 HZ3 TRP 7 HZ3 TRP 7 0.013 7.326 5.390 45 HH2 TRP 7 HH2 TRP 7 -0.214 9.042 7.112 46 H CYS 8 H CYS 8 1.687 9.668 -1.833 47 HA CYS 8 HA CYS 8 4.273 9.494 -3.153 48 HB2 CYS 8 2HB CYS 8 2.393 7.166 -2.832 49 HB3 CYS 8 3HB CYS 8 3.498 7.264 -4.199 Start of MODEL 9 1 H1 GLY 1 H GLY 1 2.977 -1.429 -1.865 2 HA2 GLY 1 2HA GLY 1 0.976 0.165 -0.509 3 HA3 GLY 1 3HA GLY 1 2.710 0.205 -0.230 4 H CYS 2 H CYS 2 4.036 1.307 -1.878 5 HA CYS 2 HA CYS 2 2.551 3.556 -3.070 6 HB2 CYS 2 2HB CYS 2 5.001 3.439 -1.448 7 HB3 CYS 2 3HB CYS 2 5.130 4.454 -2.880 8 HA PRO 3 HA PRO 3 3.496 5.362 -4.092 9 HB2 PRO 3 2HB PRO 3 3.105 5.542 -7.080 10 HB3 PRO 3 3HB PRO 3 3.511 6.831 -5.941 11 HG2 PRO 3 3HG PRO 3 5.234 4.609 -6.978 12 HG3 PRO 3 2HG PRO 3 5.564 5.315 -5.385 13 HD2 PRO 3 2HD PRO 3 3.571 3.482 -7.338 14 HD3 PRO 3 3HD PRO 3 5.032 2.658 -6.756 15 H DTR 4 H DTR 4 1.374 6.573 -4.185 16 HA DTR 4 HA DTR 4 -0.768 4.633 -4.507 17 HB2 DTR 4 2HB DTR 4 -0.893 7.343 -5.836 18 HB3 DTR 4 3HB DTR 4 -2.145 6.117 -5.819 19 HD1 DTR 4 HD1 DTR 4 -1.587 3.823 -7.320 20 HE1 DTR 4 HE1 DTR 4 -0.165 3.430 -9.509 21 HZ2 DTR 4 HZ2 DTR 4 1.878 4.929 -10.822 22 HH2 DTR 4 HH2 DTR 4 3.196 7.070 -10.628 23 HZ3 DTR 4 HZ3 DTR 4 2.788 8.586 -8.755 24 HE3 DTR 4 HE3 DTR 4 1.100 8.127 -6.979 25 H ASP 5 H ASP 5 0.203 5.208 -2.172 26 HA ASP 5 HA ASP 5 -1.833 6.307 -0.667 27 HB2 ASP 5 2HB ASP 5 0.969 5.530 -0.169 28 HB3 ASP 5 3HB ASP 5 0.304 6.692 0.976 29 HA PRO 6 HA PRO 6 -1.706 10.679 -0.663 30 HB2 PRO 6 2HB PRO 6 -1.391 11.100 2.114 31 HB3 PRO 6 3HB PRO 6 -2.912 11.009 1.219 32 HG2 PRO 6 2HG PRO 6 -1.510 8.914 2.783 33 HG3 PRO 6 3HG PRO 6 -3.246 9.144 2.507 34 HD2 PRO 6 2HD PRO 6 -1.663 7.317 1.584 35 HD3 PRO 6 3HD PRO 6 -3.093 7.815 0.657 36 H TRP 7 H TRP 7 0.835 8.904 0.895 37 HA TRP 7 HA TRP 7 2.576 11.245 1.011 38 HB2 TRP 7 2HB TRP 7 2.661 8.489 2.150 39 HB3 TRP 7 3HB TRP 7 4.190 9.319 1.875 40 HD1 TRP 7 HD1 TRP 7 4.208 11.943 3.043 41 HE1 TRP 7 HE1 TRP 7 3.423 12.564 5.414 42 HE3 TRP 7 HE3 TRP 7 1.199 7.918 3.982 43 HZ2 TRP 7 HZ2 TRP 7 1.750 11.489 7.418 44 HZ3 TRP 7 HZ3 TRP 7 0.043 7.790 6.150 45 HH2 TRP 7 HH2 TRP 7 0.314 9.539 7.832 46 H CYS 8 H CYS 8 1.635 9.886 -1.512 47 HA CYS 8 HA CYS 8 4.246 9.808 -2.792 48 HB2 CYS 8 2HB CYS 8 2.325 7.489 -2.751 49 HB3 CYS 8 3HB CYS 8 3.475 7.704 -4.068 Start of MODEL 10 1 H1 GLY 1 H GLY 1 2.743 0.061 0.085 2 HA2 GLY 1 2HA GLY 1 3.295 -0.803 -2.153 3 HA3 GLY 1 3HA GLY 1 1.566 -0.901 -2.450 4 H CYS 2 H CYS 2 4.358 1.088 -2.518 5 HA CYS 2 HA CYS 2 2.722 3.397 -3.339 6 HB2 CYS 2 2HB CYS 2 5.167 3.153 -1.722 7 HB3 CYS 2 3HB CYS 2 5.228 4.422 -2.942 8 HA PRO 3 HA PRO 3 3.544 5.421 -3.995 9 HB2 PRO 3 2HB PRO 3 3.158 6.119 -6.907 10 HB3 PRO 3 3HB PRO 3 3.466 7.202 -5.544 11 HG2 PRO 3 3HG PRO 3 5.346 5.331 -6.939 12 HG3 PRO 3 2HG PRO 3 5.617 5.753 -5.238 13 HD2 PRO 3 2HD PRO 3 3.769 4.179 -7.529 14 HD3 PRO 3 3HD PRO 3 5.281 3.364 -7.080 15 H DTR 4 H DTR 4 1.334 6.588 -4.069 16 HA DTR 4 HA DTR 4 -0.666 4.549 -4.543 17 HB2 DTR 4 2HB DTR 4 -0.866 7.257 -5.873 18 HB3 DTR 4 3HB DTR 4 -2.110 6.023 -5.845 19 HD1 DTR 4 HD1 DTR 4 -1.365 3.616 -7.190 20 HE1 DTR 4 HE1 DTR 4 0.007 3.238 -9.412 21 HZ2 DTR 4 HZ2 DTR 4 1.843 4.849 -10.887 22 HH2 DTR 4 HH2 DTR 4 2.952 7.114 -10.863 23 HZ3 DTR 4 HZ3 DTR 4 2.466 8.687 -9.057 24 HE3 DTR 4 HE3 DTR 4 0.898 8.170 -7.189 25 H ASP 5 H ASP 5 0.004 4.984 -2.168 26 HA ASP 5 HA ASP 5 -2.118 6.083 -0.785 27 HB2 ASP 5 2HB ASP 5 0.653 5.278 -0.050 28 HB3 ASP 5 3HB ASP 5 -0.250 6.241 1.115 29 HA PRO 6 HA PRO 6 -1.813 10.438 -0.518 30 HB2 PRO 6 2HB PRO 6 -1.853 10.859 2.204 31 HB3 PRO 6 3HB PRO 6 -3.285 10.534 1.220 32 HG2 PRO 6 2HG PRO 6 -1.870 8.772 3.088 33 HG3 PRO 6 3HG PRO 6 -3.517 8.641 2.445 34 HD2 PRO 6 2HD PRO 6 -2.132 6.948 1.509 35 HD3 PRO 6 3HD PRO 6 -3.447 7.586 0.501 36 H TRP 7 H TRP 7 0.481 8.462 1.171 37 HA TRP 7 HA TRP 7 2.290 10.711 1.613 38 HB2 TRP 7 2HB TRP 7 1.850 8.211 2.905 39 HB3 TRP 7 3HB TRP 7 3.501 8.218 2.292 40 HD1 TRP 7 HD1 TRP 7 5.097 8.957 4.137 41 HE1 TRP 7 HE1 TRP 7 5.068 10.709 6.022 42 HE3 TRP 7 HE3 TRP 7 0.399 10.841 3.422 43 HZ2 TRP 7 HZ2 TRP 7 3.289 12.634 7.068 44 HZ3 TRP 7 HZ3 TRP 7 -0.391 12.636 4.908 45 HH2 TRP 7 HH2 TRP 7 1.026 13.512 6.693 46 H CYS 8 H CYS 8 1.565 9.561 -1.075 47 HA CYS 8 HA CYS 8 4.294 9.416 -2.079 48 HB2 CYS 8 2HB CYS 8 2.241 7.242 -2.472 49 HB3 CYS 8 3HB CYS 8 3.603 7.456 -3.566
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