NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
568113 | 2m6f | 19131 | 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 HA2 GLY 1 1.984 -0.972 -1.706 3 HA3 GLY 1 HA3 GLY 1 1.641 0.739 -1.908 4 H CYS 2 H CYS 2 3.907 0.010 -2.990 5 HA CYS 2 HA CYS 2 5.989 0.769 -1.045 6 HB2 CYS 2 HB2 CYS 2 5.965 -1.246 -3.236 7 HB3 CYS 2 HB3 CYS 2 7.464 -0.363 -2.964 8 H VAL 3 H VAL 3 5.499 2.996 -1.517 9 HA VAL 3 HA VAL 3 5.540 4.181 -4.033 10 HB VAL 3 HB VAL 3 6.280 6.267 -2.814 11 HG11 VAL 3 HG11 VAL 3 3.997 6.152 -3.029 12 HG12 VAL 3 HG12 VAL 3 3.877 4.648 -2.114 13 HG13 VAL 3 HG13 VAL 3 4.160 6.172 -1.273 14 HG21 VAL 3 HG21 VAL 3 5.764 5.235 -0.179 15 HG22 VAL 3 HG22 VAL 3 7.140 4.406 -0.908 16 HG23 VAL 3 HG23 VAL 3 7.143 6.164 -0.767 17 H DLE 4 H DLE 4 7.121 4.273 -5.586 18 HA DLE 4 HA DLE 4 9.864 4.570 -4.614 19 HB2 DLE 4 HB2 DLE 4 8.558 5.200 -7.261 20 HB3 DLE 4 HB3 DLE 4 10.289 5.271 -6.992 21 HG DLE 4 HG DLE 4 9.018 6.803 -4.936 22 HD11 DLE 4 HD11 DLE 4 7.663 8.345 -6.026 23 HD12 DLE 4 HD12 DLE 4 7.152 6.789 -6.723 24 HD13 DLE 4 HD13 DLE 4 8.235 7.863 -7.642 25 HD21 DLE 4 HD21 DLE 4 10.645 7.704 -7.328 26 HD22 DLE 4 HD22 DLE 4 11.314 7.077 -5.803 27 HD23 DLE 4 HD23 DLE 4 10.388 8.597 -5.810 28 H TYR 5 H TYR 5 8.598 2.090 -4.386 29 HA TYR 5 HA TYR 5 10.128 0.500 -6.337 30 HB2 TYR 5 HB2 TYR 5 9.281 -0.630 -3.704 31 HB3 TYR 5 HB3 TYR 5 10.697 -1.005 -4.680 32 HD1 TYR 5 HD2 TYR 5 12.664 0.494 -4.633 33 HD2 TYR 5 HD1 TYR 5 9.329 1.111 -2.064 34 HE1 TYR 5 HE2 TYR 5 14.033 1.969 -3.219 35 HE2 TYR 5 HE1 TYR 5 10.689 2.588 -0.643 36 HH TYR 5 HH TYR 5 13.048 2.987 -0.129 37 HA PRO 6 HA PRO 6 5.682 -0.467 -7.140 38 HB2 PRO 6 HB2 PRO 6 5.976 -0.610 -9.835 39 HB3 PRO 6 HB3 PRO 6 5.680 0.908 -8.981 40 HG2 PRO 6 HG2 PRO 6 8.260 -0.223 -9.992 41 HG3 PRO 6 HG3 PRO 6 7.657 1.442 -10.082 42 HD2 PRO 6 HD2 PRO 6 9.471 0.646 -8.235 43 HD3 PRO 6 HD3 PRO 6 8.272 1.914 -7.911 44 H TRP 7 H TRP 7 8.660 -2.005 -7.484 45 HA TRP 7 HA TRP 7 7.524 -4.444 -8.626 46 HB2 TRP 7 HB2 TRP 7 9.881 -5.257 -8.599 47 HB3 TRP 7 HB3 TRP 7 9.662 -3.780 -9.533 48 HD1 TRP 7 HD1 TRP 7 11.088 -4.972 -6.155 49 HE1 TRP 7 HE1 TRP 7 12.829 -3.249 -5.364 50 HE3 TRP 7 HE3 TRP 7 10.423 -1.425 -9.776 51 HZ2 TRP 7 HZ2 TRP 7 13.792 -0.720 -6.168 52 HZ3 TRP 7 HZ3 TRP 7 11.794 0.617 -9.693 53 HH2 TRP 7 HH2 TRP 7 13.442 0.961 -7.925 54 H CYS 8 H CYS 8 6.736 -3.522 -5.977 55 HA CYS 8 HA CYS 8 8.031 -5.354 -4.131 56 HB2 CYS 8 HB2 CYS 8 6.087 -3.111 -3.900 57 HB3 CYS 8 HB3 CYS 8 6.045 -4.354 -2.654 Start of MODEL 2 1 H1 GLY 1 H GLY 1 0.614 1.009 -0.115 2 HA2 GLY 1 HA2 GLY 1 1.834 -0.885 -0.564 3 HA3 GLY 1 HA3 GLY 1 1.932 -0.331 -2.228 4 H CYS 2 H CYS 2 3.922 -0.030 -2.947 5 HA CYS 2 HA CYS 2 6.008 0.735 -1.010 6 HB2 CYS 2 HB2 CYS 2 5.984 -1.275 -3.205 7 HB3 CYS 2 HB3 CYS 2 7.481 -0.386 -2.938 8 H VAL 3 H VAL 3 5.508 2.961 -1.474 9 HA VAL 3 HA VAL 3 5.533 4.151 -3.988 10 HB VAL 3 HB VAL 3 6.269 6.238 -2.767 11 HG11 VAL 3 HG11 VAL 3 3.997 6.174 -2.936 12 HG12 VAL 3 HG12 VAL 3 3.870 4.608 -2.131 13 HG13 VAL 3 HG13 VAL 3 4.151 6.068 -1.182 14 HG21 VAL 3 HG21 VAL 3 5.769 5.204 -0.132 15 HG22 VAL 3 HG22 VAL 3 7.141 4.374 -0.867 16 HG23 VAL 3 HG23 VAL 3 7.146 6.132 -0.726 17 H DLE 4 H DLE 4 7.107 4.254 -5.547 18 HA DLE 4 HA DLE 4 9.853 4.561 -4.586 19 HB2 DLE 4 HB2 DLE 4 8.533 5.190 -7.226 20 HB3 DLE 4 HB3 DLE 4 10.264 5.268 -6.964 21 HG DLE 4 HG DLE 4 8.994 6.790 -4.900 22 HD11 DLE 4 HD11 DLE 4 7.033 6.967 -6.298 23 HD12 DLE 4 HD12 DLE 4 8.025 7.460 -7.692 24 HD13 DLE 4 HD13 DLE 4 7.889 8.527 -6.274 25 HD21 DLE 4 HD21 DLE 4 10.473 8.466 -5.559 26 HD22 DLE 4 HD22 DLE 4 10.470 7.941 -7.259 27 HD23 DLE 4 HD23 DLE 4 11.306 6.965 -6.028 28 H TYR 5 H TYR 5 8.597 2.075 -4.359 29 HA TYR 5 HA TYR 5 10.127 0.495 -6.319 30 HB2 TYR 5 HB2 TYR 5 9.295 -0.644 -3.685 31 HB3 TYR 5 HB3 TYR 5 10.709 -1.011 -4.667 32 HD1 TYR 5 HD1 TYR 5 12.669 0.499 -4.627 33 HD2 TYR 5 HD2 TYR 5 9.344 1.089 -2.038 34 HE1 TYR 5 HE1 TYR 5 14.038 1.977 -3.215 35 HE2 TYR 5 HE2 TYR 5 10.703 2.570 -0.621 36 HH TYR 5 HH TYR 5 13.953 3.532 -1.552 37 HA PRO 6 HA PRO 6 5.681 -0.489 -7.107 38 HB2 PRO 6 HB2 PRO 6 5.966 -0.625 -9.803 39 HB3 PRO 6 HB3 PRO 6 5.666 0.890 -8.944 40 HG2 PRO 6 HG2 PRO 6 8.247 -0.228 -9.968 41 HG3 PRO 6 HG3 PRO 6 7.637 1.435 -10.052 42 HD2 PRO 6 HD2 PRO 6 9.462 0.643 -8.215 43 HD3 PRO 6 HD3 PRO 6 8.258 1.905 -7.882 44 H TRP 7 H TRP 7 8.665 -2.013 -7.466 45 HA TRP 7 HA TRP 7 7.535 -4.455 -8.608 46 HB2 TRP 7 HB2 TRP 7 9.895 -5.258 -8.595 47 HB3 TRP 7 HB3 TRP 7 9.667 -3.778 -9.523 48 HD1 TRP 7 HD1 TRP 7 11.096 -4.967 -6.142 49 HE1 TRP 7 HE1 TRP 7 12.839 -3.244 -5.357 50 HE3 TRP 7 HE3 TRP 7 10.439 -1.433 -9.777 51 HZ2 TRP 7 HZ2 TRP 7 13.807 -0.720 -6.170 52 HZ3 TRP 7 HZ3 TRP 7 11.813 0.607 -9.701 53 HH2 TRP 7 HH2 TRP 7 13.461 0.954 -7.934 54 H CYS 8 H CYS 8 6.755 -3.542 -5.954 55 HA CYS 8 HA CYS 8 8.065 -5.373 -4.117 56 HB2 CYS 8 HB2 CYS 8 6.111 -3.139 -3.874 57 HB3 CYS 8 HB3 CYS 8 6.081 -4.384 -2.630 Start of MODEL 3 1 H1 GLY 1 H GLY 1 1.512 1.663 -0.204 2 HA2 GLY 1 HA2 GLY 1 1.828 -0.948 -0.627 3 HA3 GLY 1 HA3 GLY 1 1.922 -0.344 -2.274 4 H CYS 2 H CYS 2 3.918 -0.059 -2.981 5 HA CYS 2 HA CYS 2 6.000 0.684 -1.031 6 HB2 CYS 2 HB2 CYS 2 5.979 -1.303 -3.247 7 HB3 CYS 2 HB3 CYS 2 7.476 -0.418 -2.968 8 H VAL 3 H VAL 3 5.503 2.915 -1.472 9 HA VAL 3 HA VAL 3 5.535 4.133 -3.973 10 HB VAL 3 HB VAL 3 6.270 6.206 -2.728 11 HG11 VAL 3 HG11 VAL 3 3.904 4.600 -1.789 12 HG12 VAL 3 HG12 VAL 3 4.165 6.288 -1.343 13 HG13 VAL 3 HG13 VAL 3 3.947 5.846 -3.036 14 HG21 VAL 3 HG21 VAL 3 5.764 5.152 -0.104 15 HG22 VAL 3 HG22 VAL 3 7.129 4.315 -0.843 16 HG23 VAL 3 HG23 VAL 3 7.151 6.071 -0.691 17 H DLE 4 H DLE 4 7.113 4.250 -5.528 18 HA DLE 4 HA DLE 4 9.857 4.544 -4.557 19 HB2 DLE 4 HB2 DLE 4 8.544 5.203 -7.193 20 HB3 DLE 4 HB3 DLE 4 10.274 5.277 -6.926 21 HG DLE 4 HG DLE 4 9.002 6.777 -4.848 22 HD11 DLE 4 HD11 DLE 4 7.849 8.502 -6.137 23 HD12 DLE 4 HD12 DLE 4 7.053 6.921 -6.323 24 HD13 DLE 4 HD13 DLE 4 8.080 7.558 -7.629 25 HD21 DLE 4 HD21 DLE 4 10.841 7.382 -7.155 26 HD22 DLE 4 HD22 DLE 4 11.196 7.322 -5.412 27 HD23 DLE 4 HD23 DLE 4 10.244 8.670 -6.080 28 H TYR 5 H TYR 5 8.598 2.057 -4.360 29 HA TYR 5 HA TYR 5 10.130 0.497 -6.334 30 HB2 TYR 5 HB2 TYR 5 9.292 -0.670 -3.715 31 HB3 TYR 5 HB3 TYR 5 10.707 -1.027 -4.698 32 HD1 TYR 5 HD1 TYR 5 12.670 0.477 -4.635 33 HD2 TYR 5 HD2 TYR 5 9.338 1.048 -2.050 34 HE1 TYR 5 HE1 TYR 5 14.037 1.938 -3.205 35 HE2 TYR 5 HE2 TYR 5 10.696 2.511 -0.614 36 HH TYR 5 HH TYR 5 13.180 4.029 -1.357 37 HA PRO 6 HA PRO 6 5.685 -0.474 -7.141 38 HB2 PRO 6 HB2 PRO 6 5.975 -0.580 -9.839 39 HB3 PRO 6 HB3 PRO 6 5.675 0.926 -8.964 40 HG2 PRO 6 HG2 PRO 6 8.257 -0.184 -9.995 41 HG3 PRO 6 HG3 PRO 6 7.649 1.480 -10.061 42 HD2 PRO 6 HD2 PRO 6 9.469 0.666 -8.229 43 HD3 PRO 6 HD3 PRO 6 8.266 1.926 -7.886 44 H TRP 7 H TRP 7 8.668 -1.997 -7.511 45 HA TRP 7 HA TRP 7 7.538 -4.424 -8.683 46 HB2 TRP 7 HB2 TRP 7 9.896 -5.230 -8.673 47 HB3 TRP 7 HB3 TRP 7 9.673 -3.739 -9.584 48 HD1 TRP 7 HD1 TRP 7 11.104 -4.980 -6.225 49 HE1 TRP 7 HE1 TRP 7 12.843 -3.266 -5.409 50 HE3 TRP 7 HE3 TRP 7 10.432 -1.381 -9.793 51 HZ2 TRP 7 HZ2 TRP 7 13.803 -0.725 -6.177 52 HZ3 TRP 7 HZ3 TRP 7 11.800 0.662 -9.680 53 HH2 TRP 7 HH2 TRP 7 13.450 0.981 -7.908 54 H CYS 8 H CYS 8 6.752 -3.539 -6.020 55 HA CYS 8 HA CYS 8 8.056 -5.393 -4.201 56 HB2 CYS 8 HB2 CYS 8 6.104 -3.159 -3.937 57 HB3 CYS 8 HB3 CYS 8 6.070 -4.418 -2.707 Start of MODEL 4 1 H1 GLY 1 H GLY 1 0.815 1.584 -1.311 2 HA2 GLY 1 HA2 GLY 1 1.896 -0.994 -0.641 3 HA3 GLY 1 HA3 GLY 1 1.926 -0.228 -2.222 4 H CYS 2 H CYS 2 3.936 -0.046 -2.930 5 HA CYS 2 HA CYS 2 6.029 0.726 -1.003 6 HB2 CYS 2 HB2 CYS 2 6.003 -1.284 -3.198 7 HB3 CYS 2 HB3 CYS 2 7.497 -0.388 -2.939 8 H VAL 3 H VAL 3 5.521 2.949 -1.461 9 HA VAL 3 HA VAL 3 5.526 4.142 -3.974 10 HB VAL 3 HB VAL 3 6.260 6.231 -2.756 11 HG11 VAL 3 HG11 VAL 3 3.901 5.599 -3.075 12 HG12 VAL 3 HG12 VAL 3 3.945 4.726 -1.542 13 HG13 VAL 3 HG13 VAL 3 4.164 6.476 -1.568 14 HG21 VAL 3 HG21 VAL 3 7.163 6.117 -0.729 15 HG22 VAL 3 HG22 VAL 3 5.778 5.213 -0.116 16 HG23 VAL 3 HG23 VAL 3 7.132 4.358 -0.855 17 H DLE 4 H DLE 4 7.091 4.251 -5.542 18 HA DLE 4 HA DLE 4 9.840 4.569 -4.596 19 HB2 DLE 4 HB2 DLE 4 8.504 5.194 -7.229 20 HB3 DLE 4 HB3 DLE 4 10.236 5.279 -6.976 21 HG DLE 4 HG DLE 4 8.972 6.795 -4.904 22 HD11 DLE 4 HD11 DLE 4 7.631 8.366 -6.012 23 HD12 DLE 4 HD12 DLE 4 7.070 6.789 -6.617 24 HD13 DLE 4 HD13 DLE 4 8.136 7.800 -7.622 25 HD21 DLE 4 HD21 DLE 4 10.242 8.662 -5.986 26 HD22 DLE 4 HD22 DLE 4 10.689 7.531 -7.286 27 HD23 DLE 4 HD23 DLE 4 11.213 7.218 -5.614 28 H TYR 5 H TYR 5 8.596 2.078 -4.364 29 HA TYR 5 HA TYR 5 10.122 0.506 -6.333 30 HB2 TYR 5 HB2 TYR 5 9.308 -0.638 -3.696 31 HB3 TYR 5 HB3 TYR 5 10.719 -0.999 -4.685 32 HD1 TYR 5 HD1 TYR 5 12.672 0.523 -4.656 33 HD2 TYR 5 HD2 TYR 5 9.360 1.091 -2.045 34 HE1 TYR 5 HE1 TYR 5 14.041 2.005 -3.250 35 HE2 TYR 5 HE2 TYR 5 10.720 2.576 -0.633 36 HH TYR 5 HH TYR 5 13.877 2.688 -0.591 37 HA PRO 6 HA PRO 6 5.677 -0.496 -7.098 38 HB2 PRO 6 HB2 PRO 6 5.947 -0.629 -9.796 39 HB3 PRO 6 HB3 PRO 6 5.646 0.885 -8.934 40 HG2 PRO 6 HG2 PRO 6 8.226 -0.222 -9.973 41 HG3 PRO 6 HG3 PRO 6 7.609 1.438 -10.052 42 HD2 PRO 6 HD2 PRO 6 9.446 0.652 -8.225 43 HD3 PRO 6 HD3 PRO 6 8.239 1.909 -7.885 44 H TRP 7 H TRP 7 8.665 -2.008 -7.473 45 HA TRP 7 HA TRP 7 7.539 -4.453 -8.612 46 HB2 TRP 7 HB2 TRP 7 9.902 -5.246 -8.610 47 HB3 TRP 7 HB3 TRP 7 9.664 -3.767 -9.536 48 HD1 TRP 7 HD1 TRP 7 11.145 -4.971 -6.188 49 HE1 TRP 7 HE1 TRP 7 12.872 -3.233 -5.400 50 HE3 TRP 7 HE3 TRP 7 10.381 -1.391 -9.757 51 HZ2 TRP 7 HZ2 TRP 7 13.789 -0.682 -6.187 52 HZ3 TRP 7 HZ3 TRP 7 11.724 0.669 -9.668 53 HH2 TRP 7 HH2 TRP 7 13.392 1.014 -7.919 54 H CYS 8 H CYS 8 6.768 -3.544 -5.953 55 HA CYS 8 HA CYS 8 8.094 -5.372 -4.124 56 HB2 CYS 8 HB2 CYS 8 6.133 -3.146 -3.869 57 HB3 CYS 8 HB3 CYS 8 6.114 -4.392 -2.626 Start of MODEL 5 1 H1 GLY 1 H GLY 1 1.048 1.505 -0.251 2 HA2 GLY 1 HA2 GLY 1 1.981 -1.141 -1.137 3 HA3 GLY 1 HA3 GLY 1 1.797 0.273 -2.165 4 H CYS 2 H CYS 2 3.931 -0.042 -2.943 5 HA CYS 2 HA CYS 2 6.019 0.731 -1.011 6 HB2 CYS 2 HB2 CYS 2 6.008 -1.268 -3.223 7 HB3 CYS 2 HB3 CYS 2 7.503 -0.388 -2.919 8 H VAL 3 H VAL 3 5.551 2.954 -1.460 9 HA VAL 3 HA VAL 3 5.550 4.147 -3.978 10 HB VAL 3 HB VAL 3 6.295 6.232 -2.759 11 HG11 VAL 3 HG11 VAL 3 4.027 6.194 -2.902 12 HG12 VAL 3 HG12 VAL 3 3.894 4.607 -2.143 13 HG13 VAL 3 HG13 VAL 3 4.183 6.038 -1.153 14 HG21 VAL 3 HG21 VAL 3 7.174 4.367 -0.867 15 HG22 VAL 3 HG22 VAL 3 7.179 6.124 -0.721 16 HG23 VAL 3 HG23 VAL 3 5.806 5.193 -0.122 17 H DLE 4 H DLE 4 7.116 4.247 -5.546 18 HA DLE 4 HA DLE 4 9.866 4.554 -4.600 19 HB2 DLE 4 HB2 DLE 4 8.533 5.181 -7.233 20 HB3 DLE 4 HB3 DLE 4 10.265 5.259 -6.981 21 HG DLE 4 HG DLE 4 9.006 6.783 -4.911 22 HD11 DLE 4 HD11 DLE 4 7.127 6.764 -6.687 23 HD12 DLE 4 HD12 DLE 4 8.198 7.847 -7.607 24 HD13 DLE 4 HD13 DLE 4 7.634 8.320 -5.987 25 HD21 DLE 4 HD21 DLE 4 10.219 8.658 -6.289 26 HD22 DLE 4 HD22 DLE 4 10.893 7.276 -7.186 27 HD23 DLE 4 HD23 DLE 4 11.155 7.410 -5.430 28 H TYR 5 H TYR 5 8.608 2.068 -4.367 29 HA TYR 5 HA TYR 5 10.130 0.487 -6.331 30 HB2 TYR 5 HB2 TYR 5 9.304 -0.653 -3.696 31 HB3 TYR 5 HB3 TYR 5 10.716 -1.019 -4.681 32 HD1 TYR 5 HD1 TYR 5 12.676 0.490 -4.643 33 HD2 TYR 5 HD2 TYR 5 9.357 1.080 -2.048 34 HE1 TYR 5 HE1 TYR 5 14.048 1.967 -3.234 35 HE2 TYR 5 HE2 TYR 5 10.719 2.560 -0.632 36 HH TYR 5 HH TYR 5 12.929 4.085 -1.156 37 HA PRO 6 HA PRO 6 5.682 -0.493 -7.107 38 HB2 PRO 6 HB2 PRO 6 5.959 -0.631 -9.804 39 HB3 PRO 6 HB3 PRO 6 5.663 0.886 -8.945 40 HG2 PRO 6 HG2 PRO 6 8.241 -0.236 -9.975 41 HG3 PRO 6 HG3 PRO 6 7.632 1.427 -10.058 42 HD2 PRO 6 HD2 PRO 6 9.460 0.634 -8.225 43 HD3 PRO 6 HD3 PRO 6 8.259 1.897 -7.890 44 H TRP 7 H TRP 7 8.663 -2.021 -7.472 45 HA TRP 7 HA TRP 7 7.528 -4.461 -8.612 46 HB2 TRP 7 HB2 TRP 7 9.884 -5.268 -8.605 47 HB3 TRP 7 HB3 TRP 7 9.661 -3.783 -9.526 48 HD1 TRP 7 HD1 TRP 7 11.097 -5.001 -6.160 49 HE1 TRP 7 HE1 TRP 7 12.843 -3.286 -5.363 50 HE3 TRP 7 HE3 TRP 7 10.427 -1.429 -9.756 51 HZ2 TRP 7 HZ2 TRP 7 13.808 -0.754 -6.153 52 HZ3 TRP 7 HZ3 TRP 7 11.801 0.610 -9.663 53 HH2 TRP 7 HH2 TRP 7 13.455 0.939 -7.898 54 H CYS 8 H CYS 8 6.753 -3.545 -5.956 55 HA CYS 8 HA CYS 8 8.061 -5.380 -4.121 56 HB2 CYS 8 HB2 CYS 8 6.116 -3.139 -3.875 57 HB3 CYS 8 HB3 CYS 8 6.081 -4.385 -2.631 Start of MODEL 6 1 H1 GLY 1 H GLY 1 1.800 -2.025 -1.136 2 HA2 GLY 1 HA2 GLY 1 1.891 0.058 -2.234 3 HA3 GLY 1 HA3 GLY 1 1.535 0.853 -0.707 4 H CYS 2 H CYS 2 3.939 0.040 -2.927 5 HA CYS 2 HA CYS 2 6.042 0.770 -0.994 6 HB2 CYS 2 HB2 CYS 2 5.975 -1.246 -3.183 7 HB3 CYS 2 HB3 CYS 2 7.489 -0.389 -2.918 8 H VAL 3 H VAL 3 5.446 3.002 -1.528 9 HA VAL 3 HA VAL 3 5.550 4.170 -4.030 10 HB VAL 3 HB VAL 3 6.253 6.268 -2.843 11 HG11 VAL 3 HG11 VAL 3 3.858 5.166 -2.985 12 HG12 VAL 3 HG12 VAL 3 4.057 5.070 -1.234 13 HG13 VAL 3 HG13 VAL 3 4.141 6.633 -2.049 14 HG21 VAL 3 HG21 VAL 3 6.184 6.095 -0.311 15 HG22 VAL 3 HG22 VAL 3 6.404 4.358 -0.524 16 HG23 VAL 3 HG23 VAL 3 7.636 5.480 -1.101 17 H DLE 4 H DLE 4 7.137 4.284 -5.575 18 HA DLE 4 HA DLE 4 9.877 4.558 -4.592 19 HB2 DLE 4 HB2 DLE 4 8.589 5.192 -7.247 20 HB3 DLE 4 HB3 DLE 4 10.317 5.263 -6.963 21 HG DLE 4 HG DLE 4 9.030 6.794 -4.917 22 HD11 DLE 4 HD11 DLE 4 7.834 8.465 -6.165 23 HD12 DLE 4 HD12 DLE 4 7.114 6.873 -6.502 24 HD13 DLE 4 HD13 DLE 4 8.185 7.638 -7.701 25 HD21 DLE 4 HD21 DLE 4 10.907 7.345 -7.204 26 HD22 DLE 4 HD22 DLE 4 11.223 7.342 -5.452 27 HD23 DLE 4 HD23 DLE 4 10.287 8.667 -6.185 28 H TYR 5 H TYR 5 8.620 2.085 -4.357 29 HA TYR 5 HA TYR 5 10.136 0.489 -6.315 30 HB2 TYR 5 HB2 TYR 5 9.306 -0.632 -3.673 31 HB3 TYR 5 HB3 TYR 5 10.714 -1.013 -4.658 32 HD1 TYR 5 HD1 TYR 5 12.683 0.486 -4.634 33 HD2 TYR 5 HD2 TYR 5 9.373 1.108 -2.035 34 HE1 TYR 5 HE1 TYR 5 14.066 1.962 -3.235 35 HE2 TYR 5 HE2 TYR 5 10.746 2.587 -0.629 36 HH TYR 5 HH TYR 5 12.912 4.084 -1.100 37 HA PRO 6 HA PRO 6 5.683 -0.477 -7.084 38 HB2 PRO 6 HB2 PRO 6 5.958 -0.624 -9.781 39 HB3 PRO 6 HB3 PRO 6 5.668 0.896 -8.927 40 HG2 PRO 6 HG2 PRO 6 8.240 -0.238 -9.956 41 HG3 PRO 6 HG3 PRO 6 7.637 1.427 -10.043 42 HD2 PRO 6 HD2 PRO 6 9.465 0.634 -8.209 43 HD3 PRO 6 HD3 PRO 6 8.268 1.902 -7.878 44 H TRP 7 H TRP 7 8.658 -2.017 -7.444 45 HA TRP 7 HA TRP 7 7.516 -4.456 -8.578 46 HB2 TRP 7 HB2 TRP 7 9.876 -5.270 -8.549 47 HB3 TRP 7 HB3 TRP 7 9.648 -3.804 -9.498 48 HD1 TRP 7 HD1 TRP 7 11.104 -4.962 -6.122 49 HE1 TRP 7 HE1 TRP 7 12.839 -3.223 -5.354 50 HE3 TRP 7 HE3 TRP 7 10.386 -1.440 -9.757 51 HZ2 TRP 7 HZ2 TRP 7 13.778 -0.693 -6.179 52 HZ3 TRP 7 HZ3 TRP 7 11.743 0.612 -9.695 53 HH2 TRP 7 HH2 TRP 7 13.403 0.976 -7.942 54 H CYS 8 H CYS 8 6.739 -3.530 -5.926 55 HA CYS 8 HA CYS 8 8.039 -5.363 -4.084 56 HB2 CYS 8 HB2 CYS 8 6.111 -3.109 -3.850 57 HB3 CYS 8 HB3 CYS 8 6.050 -4.355 -2.607 Start of MODEL 7 1 H1 GLY 1 H GLY 1 2.430 -1.950 -0.866 2 HA2 GLY 1 HA2 GLY 1 1.755 0.556 -2.144 3 HA3 GLY 1 HA3 GLY 1 1.525 0.552 -0.402 4 H CYS 2 H CYS 2 3.912 0.072 -2.960 5 HA CYS 2 HA CYS 2 6.011 0.798 -1.021 6 HB2 CYS 2 HB2 CYS 2 5.946 -1.220 -3.208 7 HB3 CYS 2 HB3 CYS 2 7.462 -0.367 -2.938 8 H VAL 3 H VAL 3 5.422 3.031 -1.561 9 HA VAL 3 HA VAL 3 5.538 4.196 -4.064 10 HB VAL 3 HB VAL 3 6.242 6.293 -2.877 11 HG11 VAL 3 HG11 VAL 3 4.013 4.978 -1.368 12 HG12 VAL 3 HG12 VAL 3 4.144 6.644 -1.935 13 HG13 VAL 3 HG13 VAL 3 3.855 5.339 -3.087 14 HG21 VAL 3 HG21 VAL 3 6.382 4.387 -0.557 15 HG22 VAL 3 HG22 VAL 3 7.619 5.505 -1.131 16 HG23 VAL 3 HG23 VAL 3 6.167 6.125 -0.345 17 H DLE 4 H DLE 4 7.132 4.304 -5.603 18 HA DLE 4 HA DLE 4 9.869 4.572 -4.611 19 HB2 DLE 4 HB2 DLE 4 8.592 5.206 -7.271 20 HB3 DLE 4 HB3 DLE 4 10.319 5.272 -6.981 21 HG DLE 4 HG DLE 4 9.028 6.810 -4.943 22 HD11 DLE 4 HD11 DLE 4 7.086 7.037 -6.321 23 HD12 DLE 4 HD12 DLE 4 8.075 7.421 -7.750 24 HD13 DLE 4 HD13 DLE 4 7.994 8.566 -6.390 25 HD21 DLE 4 HD21 DLE 4 10.726 7.640 -7.313 26 HD22 DLE 4 HD22 DLE 4 11.322 7.117 -5.719 27 HD23 DLE 4 HD23 DLE 4 10.387 8.624 -5.869 28 H TYR 5 H TYR 5 8.605 2.103 -4.377 29 HA TYR 5 HA TYR 5 10.122 0.500 -6.328 30 HB2 TYR 5 HB2 TYR 5 9.281 -0.616 -3.687 31 HB3 TYR 5 HB3 TYR 5 10.691 -1.002 -4.667 32 HD1 TYR 5 HD2 TYR 5 12.665 0.489 -4.635 33 HD2 TYR 5 HD1 TYR 5 9.344 1.132 -2.055 34 HE1 TYR 5 HE2 TYR 5 14.047 1.963 -3.234 35 HE2 TYR 5 HE1 TYR 5 10.717 2.609 -0.647 36 HH TYR 5 HH TYR 5 13.471 2.744 -0.259 37 HA PRO 6 HA PRO 6 5.670 -0.455 -7.111 38 HB2 PRO 6 HB2 PRO 6 5.953 -0.607 -9.807 39 HB3 PRO 6 HB3 PRO 6 5.664 0.915 -8.956 40 HG2 PRO 6 HG2 PRO 6 8.237 -0.227 -9.974 41 HG3 PRO 6 HG3 PRO 6 7.639 1.440 -10.066 42 HD2 PRO 6 HD2 PRO 6 9.458 0.644 -8.225 43 HD3 PRO 6 HD3 PRO 6 8.264 1.916 -7.899 44 H TRP 7 H TRP 7 8.642 -2.004 -7.459 45 HA TRP 7 HA TRP 7 7.497 -4.441 -8.593 46 HB2 TRP 7 HB2 TRP 7 9.856 -5.262 -8.553 47 HB3 TRP 7 HB3 TRP 7 9.634 -3.798 -9.507 48 HD1 TRP 7 HD1 TRP 7 11.069 -4.942 -6.116 49 HE1 TRP 7 HE1 TRP 7 12.807 -3.205 -5.351 50 HE3 TRP 7 HE3 TRP 7 10.388 -1.443 -9.781 51 HZ2 TRP 7 HZ2 TRP 7 13.762 -0.685 -6.190 52 HZ3 TRP 7 HZ3 TRP 7 11.753 0.603 -9.727 53 HH2 TRP 7 HH2 TRP 7 13.405 0.972 -7.967 54 H CYS 8 H CYS 8 6.714 -3.509 -5.946 55 HA CYS 8 HA CYS 8 8.002 -5.344 -4.097 56 HB2 CYS 8 HB2 CYS 8 6.079 -3.085 -3.872 57 HB3 CYS 8 HB3 CYS 8 6.010 -4.328 -2.627 Start of MODEL 8 1 H1 GLY 1 H GLY 1 1.524 0.238 0.474 2 HA2 GLY 1 HA2 GLY 1 2.377 -1.622 -1.193 3 HA3 GLY 1 HA3 GLY 1 2.138 -0.305 -2.332 4 H CYS 2 H CYS 2 4.311 -0.157 -2.872 5 HA CYS 2 HA CYS 2 6.017 0.985 -0.759 6 HB2 CYS 2 HB2 CYS 2 7.192 -0.588 -3.026 7 HB3 CYS 2 HB3 CYS 2 7.874 -0.248 -1.439 8 H VAL 3 H VAL 3 5.635 3.101 -1.366 9 HA VAL 3 HA VAL 3 5.565 4.135 -3.942 10 HB VAL 3 HB VAL 3 6.297 6.308 -2.872 11 HG11 VAL 3 HG11 VAL 3 4.214 6.055 -1.156 12 HG12 VAL 3 HG12 VAL 3 4.048 6.323 -2.892 13 HG13 VAL 3 HG13 VAL 3 3.929 4.690 -2.235 14 HG21 VAL 3 HG21 VAL 3 7.224 6.340 -0.852 15 HG22 VAL 3 HG22 VAL 3 5.881 5.425 -0.167 16 HG23 VAL 3 HG23 VAL 3 7.249 4.577 -0.887 17 H DLE 4 H DLE 4 7.086 4.201 -5.556 18 HA DLE 4 HA DLE 4 9.853 4.611 -4.703 19 HB2 DLE 4 HB2 DLE 4 8.435 5.062 -7.329 20 HB3 DLE 4 HB3 DLE 4 10.172 5.187 -7.132 21 HG DLE 4 HG DLE 4 8.943 6.801 -5.114 22 HD11 DLE 4 HD11 DLE 4 7.001 6.659 -6.790 23 HD12 DLE 4 HD12 DLE 4 8.021 7.658 -7.853 24 HD13 DLE 4 HD13 DLE 4 7.532 8.272 -6.256 25 HD21 DLE 4 HD21 DLE 4 11.167 7.184 -5.946 26 HD22 DLE 4 HD22 DLE 4 10.167 8.615 -6.297 27 HD23 DLE 4 HD23 DLE 4 10.554 7.459 -7.594 28 H TYR 5 H TYR 5 8.459 2.101 -4.436 29 HA TYR 5 HA TYR 5 10.102 0.450 -6.239 30 HB2 TYR 5 HB2 TYR 5 9.090 -0.507 -3.579 31 HB3 TYR 5 HB3 TYR 5 10.470 -1.080 -4.508 32 HD1 TYR 5 HD1 TYR 5 9.244 1.599 -2.296 33 HD2 TYR 5 HD2 TYR 5 12.618 -0.040 -4.304 34 HE1 TYR 5 HE1 TYR 5 10.728 3.038 -0.963 35 HE2 TYR 5 HE2 TYR 5 14.112 1.393 -2.975 36 HH TYR 5 HH TYR 5 13.421 2.750 -0.256 37 HA PRO 6 HA PRO 6 5.671 -0.491 -7.223 38 HB2 PRO 6 HB2 PRO 6 6.051 -0.572 -9.910 39 HB3 PRO 6 HB3 PRO 6 5.712 0.925 -9.033 40 HG2 PRO 6 HG2 PRO 6 8.334 -0.159 -9.987 41 HG3 PRO 6 HG3 PRO 6 7.717 1.502 -10.059 42 HD2 PRO 6 HD2 PRO 6 9.481 0.683 -8.175 43 HD3 PRO 6 HD3 PRO 6 8.259 1.932 -7.861 44 H TRP 7 H TRP 7 8.664 -1.999 -7.469 45 HA TRP 7 HA TRP 7 7.618 -4.412 -8.739 46 HB2 TRP 7 HB2 TRP 7 9.992 -5.214 -8.519 47 HB3 TRP 7 HB3 TRP 7 9.795 -3.767 -9.504 48 HD1 TRP 7 HD1 TRP 7 11.037 -4.836 -6.013 49 HE1 TRP 7 HE1 TRP 7 12.681 -3.048 -5.162 50 HE3 TRP 7 HE3 TRP 7 10.511 -1.399 -9.762 51 HZ2 TRP 7 HZ2 TRP 7 13.630 -0.516 -5.973 52 HZ3 TRP 7 HZ3 TRP 7 11.822 0.680 -9.648 53 HH2 TRP 7 HH2 TRP 7 13.348 1.111 -7.792 54 H CYS 8 H CYS 8 6.696 -3.527 -6.094 55 HA CYS 8 HA CYS 8 7.848 -5.454 -4.248 56 HB2 CYS 8 HB2 CYS 8 5.983 -3.148 -4.039 57 HB3 CYS 8 HB3 CYS 8 5.804 -4.433 -2.848 Start of MODEL 9 1 H1 GLY 1 H GLY 1 1.862 -0.730 0.690 2 HA2 GLY 1 HA2 GLY 1 2.436 -1.475 -1.824 3 HA3 GLY 1 HA3 GLY 1 1.863 0.169 -2.069 4 H CYS 2 H CYS 2 4.287 -0.121 -2.917 5 HA CYS 2 HA CYS 2 5.990 0.995 -0.789 6 HB2 CYS 2 HB2 CYS 2 7.165 -0.577 -3.058 7 HB3 CYS 2 HB3 CYS 2 7.841 -0.251 -1.465 8 H VAL 3 H VAL 3 5.631 3.117 -1.386 9 HA VAL 3 HA VAL 3 5.584 4.165 -3.958 10 HB VAL 3 HB VAL 3 6.330 6.326 -2.872 11 HG11 VAL 3 HG11 VAL 3 4.223 6.729 -2.028 12 HG12 VAL 3 HG12 VAL 3 3.933 5.301 -3.024 13 HG13 VAL 3 HG13 VAL 3 4.104 5.138 -1.276 14 HG21 VAL 3 HG21 VAL 3 5.891 5.412 -0.176 15 HG22 VAL 3 HG22 VAL 3 7.272 4.586 -0.899 16 HG23 VAL 3 HG23 VAL 3 7.232 6.348 -0.838 17 H DLE 4 H DLE 4 7.115 4.226 -5.563 18 HA DLE 4 HA DLE 4 9.880 4.607 -4.693 19 HB2 DLE 4 HB2 DLE 4 8.481 5.084 -7.324 20 HB3 DLE 4 HB3 DLE 4 10.218 5.193 -7.117 21 HG DLE 4 HG DLE 4 8.992 6.807 -5.098 22 HD11 DLE 4 HD11 DLE 4 7.482 8.169 -6.134 23 HD12 DLE 4 HD12 DLE 4 7.123 6.638 -6.968 24 HD13 DLE 4 HD13 DLE 4 8.144 7.865 -7.758 25 HD21 DLE 4 HD21 DLE 4 10.909 7.094 -7.342 26 HD22 DLE 4 HD22 DLE 4 11.048 7.574 -5.634 27 HD23 DLE 4 HD23 DLE 4 10.126 8.587 -6.771 28 H TYR 5 H TYR 5 8.463 2.108 -4.446 29 HA TYR 5 HA TYR 5 10.102 0.452 -6.249 30 HB2 TYR 5 HB2 TYR 5 9.066 -0.509 -3.600 31 HB3 TYR 5 HB3 TYR 5 10.447 -1.090 -4.524 32 HD1 TYR 5 HD1 TYR 5 9.231 1.589 -2.305 33 HD2 TYR 5 HD2 TYR 5 12.602 -0.070 -4.302 34 HE1 TYR 5 HE1 TYR 5 10.720 3.007 -0.956 35 HE2 TYR 5 HE2 TYR 5 14.101 1.343 -2.958 36 HH TYR 5 HH TYR 5 12.924 3.240 -0.276 37 HA PRO 6 HA PRO 6 5.668 -0.445 -7.263 38 HB2 PRO 6 HB2 PRO 6 6.062 -0.515 -9.948 39 HB3 PRO 6 HB3 PRO 6 5.732 0.980 -9.065 40 HG2 PRO 6 HG2 PRO 6 8.350 -0.122 -10.010 41 HG3 PRO 6 HG3 PRO 6 7.748 1.544 -10.077 42 HD2 PRO 6 HD2 PRO 6 9.494 0.701 -8.187 43 HD3 PRO 6 HD3 PRO 6 8.281 1.958 -7.873 44 H TRP 7 H TRP 7 8.649 -1.978 -7.500 45 HA TRP 7 HA TRP 7 7.589 -4.375 -8.788 46 HB2 TRP 7 HB2 TRP 7 9.955 -5.199 -8.558 47 HB3 TRP 7 HB3 TRP 7 9.776 -3.746 -9.537 48 HD1 TRP 7 HD1 TRP 7 10.989 -4.843 -6.045 49 HE1 TRP 7 HE1 TRP 7 12.644 -3.073 -5.176 50 HE3 TRP 7 HE3 TRP 7 10.514 -1.383 -9.779 51 HZ2 TRP 7 HZ2 TRP 7 13.619 -0.545 -5.968 52 HZ3 TRP 7 HZ3 TRP 7 11.842 0.684 -9.647 53 HH2 TRP 7 HH2 TRP 7 13.361 1.093 -7.780 54 H CYS 8 H CYS 8 6.660 -3.495 -6.143 55 HA CYS 8 HA CYS 8 7.784 -5.443 -4.301 56 HB2 CYS 8 HB2 CYS 8 5.939 -3.120 -4.090 57 HB3 CYS 8 HB3 CYS 8 5.742 -4.410 -2.908 Start of MODEL 10 1 H1 GLY 1 H GLY 1 0.456 0.029 -0.638 2 HA2 GLY 1 HA2 GLY 1 2.431 -1.621 -1.209 3 HA3 GLY 1 HA3 GLY 1 2.139 -0.236 -2.250 4 H CYS 2 H CYS 2 4.338 -0.153 -2.830 5 HA CYS 2 HA CYS 2 6.063 0.980 -0.729 6 HB2 CYS 2 HB2 CYS 2 7.217 -0.594 -3.007 7 HB3 CYS 2 HB3 CYS 2 7.911 -0.258 -1.424 8 H VAL 3 H VAL 3 5.683 3.098 -1.330 9 HA VAL 3 HA VAL 3 5.597 4.135 -3.905 10 HB VAL 3 HB VAL 3 6.345 6.304 -2.837 11 HG11 VAL 3 HG11 VAL 3 4.283 6.549 -1.519 12 HG12 VAL 3 HG12 VAL 3 3.996 5.728 -3.055 13 HG13 VAL 3 HG13 VAL 3 4.065 4.799 -1.557 14 HG21 VAL 3 HG21 VAL 3 5.945 5.420 -0.131 15 HG22 VAL 3 HG22 VAL 3 7.305 4.566 -0.861 16 HG23 VAL 3 HG23 VAL 3 7.289 6.329 -0.823 17 H DLE 4 H DLE 4 7.106 4.198 -5.529 18 HA DLE 4 HA DLE 4 9.881 4.599 -4.697 19 HB2 DLE 4 HB2 DLE 4 8.445 5.057 -7.312 20 HB3 DLE 4 HB3 DLE 4 10.184 5.177 -7.127 21 HG DLE 4 HG DLE 4 8.975 6.792 -5.099 22 HD11 DLE 4 HD11 DLE 4 6.954 7.007 -6.269 23 HD12 DLE 4 HD12 DLE 4 7.771 7.109 -7.847 24 HD13 DLE 4 HD13 DLE 4 7.883 8.463 -6.698 25 HD21 DLE 4 HD21 DLE 4 11.225 6.906 -6.440 26 HD22 DLE 4 HD22 DLE 4 10.450 8.393 -5.840 27 HD23 DLE 4 HD23 DLE 4 10.277 7.925 -7.549 28 H TYR 5 H TYR 5 8.481 2.093 -4.422 29 HA TYR 5 HA TYR 5 10.105 0.439 -6.240 30 HB2 TYR 5 HB2 TYR 5 9.110 -0.518 -3.574 31 HB3 TYR 5 HB3 TYR 5 10.482 -1.094 -4.514 32 HD1 TYR 5 HD1 TYR 5 9.280 1.586 -2.290 33 HD2 TYR 5 HD2 TYR 5 12.634 -0.061 -4.324 34 HE1 TYR 5 HE1 TYR 5 10.779 3.018 -0.966 35 HE2 TYR 5 HE2 TYR 5 14.142 1.365 -3.005 36 HH TYR 5 HH TYR 5 12.884 3.776 -0.747 37 HA PRO 6 HA PRO 6 5.664 -0.487 -7.192 38 HB2 PRO 6 HB2 PRO 6 6.024 -0.565 -9.882 39 HB3 PRO 6 HB3 PRO 6 5.696 0.931 -9.000 40 HG2 PRO 6 HG2 PRO 6 8.307 -0.160 -9.976 41 HG3 PRO 6 HG3 PRO 6 7.695 1.503 -10.041 42 HD2 PRO 6 HD2 PRO 6 9.471 0.677 -8.171 43 HD3 PRO 6 HD3 PRO 6 8.255 1.929 -7.846 44 H TRP 7 H TRP 7 8.651 -2.004 -7.463 45 HA TRP 7 HA TRP 7 7.588 -4.412 -8.728 46 HB2 TRP 7 HB2 TRP 7 9.961 -5.222 -8.526 47 HB3 TRP 7 HB3 TRP 7 9.761 -3.773 -9.508 48 HD1 TRP 7 HD1 TRP 7 11.026 -4.850 -6.028 49 HE1 TRP 7 HE1 TRP 7 12.682 -3.068 -5.187 50 HE3 TRP 7 HE3 TRP 7 10.481 -1.407 -9.768 51 HZ2 TRP 7 HZ2 TRP 7 13.632 -0.538 -6.001 52 HZ3 TRP 7 HZ3 TRP 7 11.800 0.668 -9.662 53 HH2 TRP 7 HH2 TRP 7 13.341 1.092 -7.816 54 H CYS 8 H CYS 8 6.688 -3.527 -6.074 55 HA CYS 8 HA CYS 8 7.848 -5.461 -4.240 56 HB2 CYS 8 HB2 CYS 8 5.992 -3.149 -4.013 57 HB3 CYS 8 HB3 CYS 8 5.818 -4.435 -2.823
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