NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
606775 | 2ndm | 26065 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 H GLY 1 9.512 2.009 0.348 2 HA2 GLY 1 HA1 GLY 1 10.560 0.275 -0.924 3 HA3 GLY 1 HA2 GLY 1 10.626 -0.270 0.746 4 H ARG 2 H ARG 2 8.405 -1.343 1.417 5 HA ARG 2 HA ARG 2 8.053 -3.542 -0.453 6 HB2 ARG 2 HB1 ARG 2 7.374 -3.086 2.428 7 HB3 ARG 2 HB2 ARG 2 6.563 -4.365 1.536 8 HG2 ARG 2 HG1 ARG 2 9.540 -4.200 1.481 9 HG3 ARG 2 HG2 ARG 2 8.724 -4.871 2.895 10 HD2 ARG 2 HD1 ARG 2 7.446 -6.322 1.189 11 HD3 ARG 2 HD2 ARG 2 8.728 -5.866 0.067 12 HE ARG 2 HE ARG 2 8.903 -7.772 2.167 13 HH11 ARG 2 HH11 ARG 2 10.732 -5.356 0.454 14 HH12 ARG 2 HH12 ARG 2 12.262 -6.109 0.759 15 HH21 ARG 2 HH21 ARG 2 10.911 -8.774 2.575 16 HH22 ARG 2 HH22 ARG 2 12.362 -8.055 1.965 17 HA PRO 3 HA PRO 3 4.114 -2.398 -2.009 18 HB2 PRO 3 HB1 PRO 3 2.829 -4.787 -2.128 19 HB3 PRO 3 HB2 PRO 3 4.141 -4.346 -3.227 20 HG2 PRO 3 HG1 PRO 3 4.226 -6.042 -0.761 21 HG3 PRO 3 HG2 PRO 3 5.006 -6.310 -2.331 22 HD2 PRO 3 HD1 PRO 3 6.339 -5.322 -0.192 23 HD3 PRO 3 HD2 PRO 3 6.736 -4.862 -1.859 24 H CYS 4 H CYS 4 2.447 -1.412 -1.069 25 HA CYS 4 HA CYS 4 1.304 -2.601 1.375 26 HB2 CYS 4 HB1 CYS 4 2.629 -0.290 1.386 27 HB3 CYS 4 HB2 CYS 4 1.062 0.327 0.872 28 H TYR 5 H TYR 5 -0.509 -3.578 0.680 29 HA TYR 5 HA TYR 5 -2.388 -1.972 -0.926 30 HB2 TYR 5 HB1 TYR 5 -2.221 -4.989 -0.882 31 HB3 TYR 5 HB2 TYR 5 -3.206 -3.993 -1.948 32 HD1 TYR 5 HD1 TYR 5 -1.387 -1.977 -2.928 33 HD2 TYR 5 HD2 TYR 5 -0.661 -6.102 -2.176 34 HE1 TYR 5 HE1 TYR 5 0.428 -1.954 -4.588 35 HE2 TYR 5 HE2 TYR 5 1.157 -6.090 -3.832 36 HH TYR 5 HH TYR 5 2.228 -4.909 -5.382 37 H THR 6 H THR 6 -4.084 -1.340 0.209 38 HA THR 6 HA THR 6 -5.298 -3.201 2.124 39 HB THR 6 HB THR 6 -5.664 -1.381 3.745 40 HG1 THR 6 HG1 THR 6 -5.218 0.611 3.202 41 HG21 THR 6 HG21 THR 6 -2.718 -1.479 3.174 42 HG22 THR 6 HG22 THR 6 -3.591 -2.911 3.720 43 HG23 THR 6 HG23 THR 6 -3.545 -1.467 4.731 44 H LEU 7 H LEU 7 -7.399 -1.882 3.019 45 HA LEU 7 HA LEU 7 -9.136 -1.751 0.778 46 HB2 LEU 7 HB1 LEU 7 -9.398 -1.347 3.711 47 HB3 LEU 7 HB2 LEU 7 -10.678 -0.729 2.669 48 HG LEU 7 HG LEU 7 -10.639 -3.181 1.715 49 HD11 LEU 7 HD11 LEU 7 -8.810 -4.096 2.876 50 HD12 LEU 7 HD12 LEU 7 -10.244 -4.756 3.661 51 HD13 LEU 7 HD13 LEU 7 -9.355 -3.436 4.418 52 HD21 LEU 7 HD21 LEU 7 -12.596 -2.252 2.690 53 HD22 LEU 7 HD22 LEU 7 -11.889 -2.291 4.305 54 HD23 LEU 7 HD23 LEU 7 -12.307 -3.798 3.490 55 H GLN 8 H GLN 8 -7.513 0.656 2.746 56 HA GLN 8 HA GLN 8 -8.887 2.830 1.371 57 HB2 GLN 8 HB1 GLN 8 -6.784 2.940 3.540 58 HB3 GLN 8 HB2 GLN 8 -7.719 4.301 2.935 59 HG2 GLN 8 HG1 GLN 8 -9.698 3.523 3.907 60 HG3 GLN 8 HG2 GLN 8 -9.043 1.905 4.154 61 HE21 GLN 8 HE21 GLN 8 -10.254 3.144 6.219 62 HE22 GLN 8 HE22 GLN 8 -9.092 3.622 7.405 63 H SER 9 H SER 9 -6.782 0.921 0.212 64 HA SER 9 HA SER 9 -5.071 1.010 -1.284 65 HB2 SER 9 HB1 SER 9 -6.710 2.668 -2.309 66 HB3 SER 9 HB2 SER 9 -5.721 3.943 -1.597 67 HG SER 9 HG SER 9 -5.280 2.460 -3.825 68 H CYS 10 H CYS 10 -3.630 0.690 0.555 69 HA CYS 10 HA CYS 10 -2.344 2.819 1.883 70 HB2 CYS 10 HB1 CYS 10 -2.400 0.420 2.638 71 HB3 CYS 10 HB2 CYS 10 -1.214 0.060 1.386 72 H PHE 11 H PHE 11 -0.219 3.638 1.634 73 HA PHE 11 HA PHE 11 0.586 3.843 -1.154 74 HB2 PHE 11 HB1 PHE 11 1.291 5.356 1.348 75 HB3 PHE 11 HB2 PHE 11 2.246 5.539 -0.119 76 HD1 PHE 11 HD2 PHE 11 0.370 5.609 -2.258 77 HD2 PHE 11 HD1 PHE 11 -0.006 7.217 1.665 78 HE1 PHE 11 HE2 PHE 11 -1.238 7.271 -3.097 79 HE2 PHE 11 HE1 PHE 11 -1.616 8.881 0.832 80 HZ PHE 11 HZ PHE 11 -2.234 8.910 -1.552 81 HA PRO 12 HA PRO 12 4.064 1.176 -0.935 82 HB2 PRO 12 HB1 PRO 12 5.824 2.450 -2.563 83 HB3 PRO 12 HB2 PRO 12 4.392 1.610 -3.168 84 HG2 PRO 12 HG1 PRO 12 4.806 4.533 -2.673 85 HG3 PRO 12 HG2 PRO 12 4.019 3.731 -4.045 86 HD2 PRO 12 HD1 PRO 12 2.621 4.856 -2.018 87 HD3 PRO 12 HD2 PRO 12 2.045 3.424 -2.896 88 H ASP 13 H ASP 13 6.022 0.875 0.096 89 HA ASP 13 HA ASP 13 7.587 3.102 1.035 90 HB2 ASP 13 HB1 ASP 13 5.722 1.641 2.835 91 HB3 ASP 13 HB2 ASP 13 7.318 2.030 3.469 Start of MODEL 2 1 H1 GLY 1 H GLY 1 9.037 2.070 -0.178 2 HA2 GLY 1 HA1 GLY 1 10.093 0.376 -1.346 3 HA3 GLY 1 HA2 GLY 1 10.490 -0.167 0.279 4 H ARG 2 H ARG 2 8.461 -1.304 1.348 5 HA ARG 2 HA ARG 2 7.986 -3.630 -0.251 6 HB2 ARG 2 HB1 ARG 2 7.302 -2.770 2.527 7 HB3 ARG 2 HB2 ARG 2 6.422 -4.120 1.822 8 HG2 ARG 2 HG1 ARG 2 8.672 -5.159 1.328 9 HG3 ARG 2 HG2 ARG 2 9.368 -3.905 2.357 10 HD2 ARG 2 HD1 ARG 2 7.106 -5.589 3.353 11 HD3 ARG 2 HD2 ARG 2 8.753 -6.219 3.373 12 HE ARG 2 HE ARG 2 8.466 -3.616 4.575 13 HH11 ARG 2 HH11 ARG 2 8.347 -7.057 5.088 14 HH12 ARG 2 HH12 ARG 2 8.654 -6.945 6.790 15 HH21 ARG 2 HH21 ARG 2 8.871 -3.456 6.814 16 HH22 ARG 2 HH22 ARG 2 8.951 -4.896 7.770 17 HA PRO 3 HA PRO 3 4.075 -2.755 -2.034 18 HB2 PRO 3 HB1 PRO 3 2.791 -5.136 -1.811 19 HB3 PRO 3 HB2 PRO 3 4.124 -4.866 -2.939 20 HG2 PRO 3 HG1 PRO 3 4.158 -6.164 -0.241 21 HG3 PRO 3 HG2 PRO 3 4.970 -6.667 -1.736 22 HD2 PRO 3 HD1 PRO 3 6.261 -5.360 0.253 23 HD3 PRO 3 HD2 PRO 3 6.692 -5.161 -1.458 24 H CYS 4 H CYS 4 2.510 -1.539 -1.198 25 HA CYS 4 HA CYS 4 1.299 -2.356 1.360 26 HB2 CYS 4 HB1 CYS 4 2.595 -0.092 1.067 27 HB3 CYS 4 HB2 CYS 4 1.103 0.438 0.298 28 H TYR 5 H TYR 5 -0.417 -3.561 0.689 29 HA TYR 5 HA TYR 5 -2.371 -2.210 -1.056 30 HB2 TYR 5 HB1 TYR 5 -1.819 -5.172 -0.787 31 HB3 TYR 5 HB2 TYR 5 -3.132 -4.478 -1.732 32 HD1 TYR 5 HD1 TYR 5 -2.553 -2.997 -3.698 33 HD2 TYR 5 HD2 TYR 5 0.351 -5.368 -1.685 34 HE1 TYR 5 HE1 TYR 5 -1.057 -2.804 -5.641 35 HE2 TYR 5 HE2 TYR 5 1.855 -5.180 -3.621 36 HH TYR 5 HH TYR 5 1.447 -2.947 -6.055 37 H THR 6 H THR 6 -3.917 -1.426 0.223 38 HA THR 6 HA THR 6 -5.176 -3.254 2.146 39 HB THR 6 HB THR 6 -5.518 -1.325 3.702 40 HG1 THR 6 HG1 THR 6 -5.125 0.401 2.300 41 HG21 THR 6 HG21 THR 6 -3.092 -1.261 4.474 42 HG22 THR 6 HG22 THR 6 -2.731 -2.273 3.076 43 HG23 THR 6 HG23 THR 6 -3.830 -2.854 4.327 44 H LEU 7 H LEU 7 -7.249 -1.925 3.040 45 HA LEU 7 HA LEU 7 -9.016 -1.785 0.840 46 HB2 LEU 7 HB1 LEU 7 -9.189 -1.329 3.759 47 HB3 LEU 7 HB2 LEU 7 -10.447 -0.600 2.764 48 HG LEU 7 HG LEU 7 -10.699 -3.003 1.794 49 HD11 LEU 7 HD11 LEU 7 -8.651 -3.816 2.993 50 HD12 LEU 7 HD12 LEU 7 -10.102 -4.785 3.246 51 HD13 LEU 7 HD13 LEU 7 -9.558 -3.669 4.498 52 HD21 LEU 7 HD21 LEU 7 -12.025 -3.508 4.076 53 HD22 LEU 7 HD22 LEU 7 -12.593 -2.373 2.851 54 HD23 LEU 7 HD23 LEU 7 -11.733 -1.779 4.271 55 H GLN 8 H GLN 8 -7.310 0.656 2.701 56 HA GLN 8 HA GLN 8 -8.630 2.804 1.234 57 HB2 GLN 8 HB1 GLN 8 -6.839 2.681 3.631 58 HB3 GLN 8 HB2 GLN 8 -6.991 4.190 2.740 59 HG2 GLN 8 HG1 GLN 8 -9.362 2.678 3.794 60 HG3 GLN 8 HG2 GLN 8 -8.506 3.899 4.734 61 HE21 GLN 8 HE21 GLN 8 -8.267 6.038 3.642 62 HE22 GLN 8 HE22 GLN 8 -9.615 6.619 2.732 63 H SER 9 H SER 9 -6.558 0.799 0.176 64 HA SER 9 HA SER 9 -4.716 0.776 -1.175 65 HB2 SER 9 HB1 SER 9 -4.751 2.396 -2.960 66 HB3 SER 9 HB2 SER 9 -6.422 2.006 -2.550 67 HG SER 9 HG SER 9 -6.711 4.023 -2.084 68 H CYS 10 H CYS 10 -3.654 1.146 1.097 69 HA CYS 10 HA CYS 10 -2.463 3.607 1.722 70 HB2 CYS 10 HB1 CYS 10 -0.957 2.309 3.161 71 HB3 CYS 10 HB2 CYS 10 -2.622 1.767 3.332 72 H PHE 11 H PHE 11 -0.576 4.568 1.150 73 HA PHE 11 HA PHE 11 0.573 3.950 -1.344 74 HB2 PHE 11 HB1 PHE 11 1.157 5.874 0.850 75 HB3 PHE 11 HB2 PHE 11 2.440 5.564 -0.315 76 HD1 PHE 11 HD1 PHE 11 -1.262 5.994 -0.559 77 HD2 PHE 11 HD2 PHE 11 2.593 7.235 -1.868 78 HE1 PHE 11 HE1 PHE 11 -2.307 7.579 -2.123 79 HE2 PHE 11 HE2 PHE 11 1.553 8.823 -3.435 80 HZ PHE 11 HZ PHE 11 -0.899 8.996 -3.565 81 HA PRO 12 HA PRO 12 3.691 0.993 -0.457 82 HB2 PRO 12 HB1 PRO 12 5.656 1.749 -2.171 83 HB3 PRO 12 HB2 PRO 12 4.157 0.979 -2.706 84 HG2 PRO 12 HG1 PRO 12 4.903 3.879 -2.703 85 HG3 PRO 12 HG2 PRO 12 4.079 2.936 -3.959 86 HD2 PRO 12 HD1 PRO 12 2.748 4.557 -2.246 87 HD3 PRO 12 HD2 PRO 12 2.039 3.065 -2.896 88 H ASP 13 H ASP 13 5.928 0.714 0.287 89 HA ASP 13 HA ASP 13 7.318 3.062 1.262 90 HB2 ASP 13 HB1 ASP 13 6.004 1.070 3.099 91 HB3 ASP 13 HB2 ASP 13 7.400 2.013 3.610 Start of MODEL 3 1 H1 GLY 1 H GLY 1 9.282 2.216 0.796 2 HA2 GLY 1 HA1 GLY 1 10.557 0.761 -0.495 3 HA3 GLY 1 HA2 GLY 1 10.423 -0.195 0.974 4 H ARG 2 H ARG 2 8.521 -1.647 1.126 5 HA ARG 2 HA ARG 2 8.138 -2.981 -1.435 6 HB2 ARG 2 HB1 ARG 2 7.760 -3.764 1.431 7 HB3 ARG 2 HB2 ARG 2 6.941 -4.671 0.168 8 HG2 ARG 2 HG1 ARG 2 9.288 -4.844 -0.903 9 HG3 ARG 2 HG2 ARG 2 9.867 -4.411 0.707 10 HD2 ARG 2 HD1 ARG 2 9.733 -6.580 1.201 11 HD3 ARG 2 HD2 ARG 2 7.982 -6.373 1.192 12 HE ARG 2 HE ARG 2 8.722 -6.823 -1.430 13 HH11 ARG 2 HH11 ARG 2 8.906 -8.521 1.604 14 HH12 ARG 2 HH12 ARG 2 8.820 -10.092 0.880 15 HH21 ARG 2 HH21 ARG 2 8.609 -8.886 -2.396 16 HH22 ARG 2 HH22 ARG 2 8.652 -10.299 -1.395 17 HA PRO 3 HA PRO 3 3.982 -1.742 -2.099 18 HB2 PRO 3 HB1 PRO 3 2.864 -4.011 -3.085 19 HB3 PRO 3 HB2 PRO 3 4.011 -3.029 -4.003 20 HG2 PRO 3 HG1 PRO 3 4.488 -5.545 -2.453 21 HG3 PRO 3 HG2 PRO 3 5.106 -5.079 -4.049 22 HD2 PRO 3 HD1 PRO 3 6.595 -4.885 -1.795 23 HD3 PRO 3 HD2 PRO 3 6.772 -3.759 -3.157 24 H CYS 4 H CYS 4 2.127 -1.551 -0.967 25 HA CYS 4 HA CYS 4 1.542 -3.611 1.059 26 HB2 CYS 4 HB1 CYS 4 0.810 -1.917 2.573 27 HB3 CYS 4 HB2 CYS 4 2.381 -1.409 1.961 28 H TYR 5 H TYR 5 -0.619 -4.124 1.450 29 HA TYR 5 HA TYR 5 -2.520 -3.129 -0.572 30 HB2 TYR 5 HB1 TYR 5 -2.502 -5.889 0.663 31 HB3 TYR 5 HB2 TYR 5 -3.549 -5.315 -0.632 32 HD1 TYR 5 HD1 TYR 5 -2.199 -4.355 -2.736 33 HD2 TYR 5 HD2 TYR 5 -0.689 -7.177 0.067 34 HE1 TYR 5 HE1 TYR 5 -0.565 -5.127 -4.404 35 HE2 TYR 5 HE2 TYR 5 0.951 -7.957 -1.593 36 HH TYR 5 HH TYR 5 0.884 -6.827 -4.912 37 H THR 6 H THR 6 -4.331 -2.234 0.168 38 HA THR 6 HA THR 6 -5.436 -3.000 2.740 39 HB THR 6 HB THR 6 -5.607 -0.589 3.467 40 HG1 THR 6 HG1 THR 6 -4.211 0.882 2.496 41 HG21 THR 6 HG21 THR 6 -4.024 -2.113 4.519 42 HG22 THR 6 HG22 THR 6 -3.315 -0.505 4.367 43 HG23 THR 6 HG23 THR 6 -2.842 -1.788 3.253 44 H LEU 7 H LEU 7 -7.389 -1.312 3.156 45 HA LEU 7 HA LEU 7 -9.098 -1.653 0.844 46 HB2 LEU 7 HB1 LEU 7 -9.467 -1.053 3.718 47 HB3 LEU 7 HB2 LEU 7 -10.692 -0.429 2.615 48 HG LEU 7 HG LEU 7 -11.319 -2.587 3.621 49 HD11 LEU 7 HD11 LEU 7 -12.061 -3.636 1.599 50 HD12 LEU 7 HD12 LEU 7 -10.808 -2.826 0.662 51 HD13 LEU 7 HD13 LEU 7 -12.120 -1.888 1.375 52 HD21 LEU 7 HD21 LEU 7 -8.960 -3.445 3.742 53 HD22 LEU 7 HD22 LEU 7 -9.069 -3.779 2.013 54 HD23 LEU 7 HD23 LEU 7 -10.151 -4.599 3.142 55 H GLN 8 H GLN 8 -7.606 0.961 2.650 56 HA GLN 8 HA GLN 8 -8.937 2.967 1.001 57 HB2 GLN 8 HB1 GLN 8 -7.207 3.088 3.454 58 HB3 GLN 8 HB2 GLN 8 -7.505 4.530 2.492 59 HG2 GLN 8 HG1 GLN 8 -9.860 2.937 3.307 60 HG3 GLN 8 HG2 GLN 8 -9.016 3.843 4.563 61 HE21 GLN 8 HE21 GLN 8 -9.686 5.835 4.874 62 HE22 GLN 8 HE22 GLN 8 -10.505 6.829 3.722 63 H SER 9 H SER 9 -6.727 1.000 0.163 64 HA SER 9 HA SER 9 -4.856 0.982 -1.141 65 HB2 SER 9 HB1 SER 9 -6.193 3.549 -1.995 66 HB3 SER 9 HB2 SER 9 -4.738 2.940 -2.784 67 HG SER 9 HG SER 9 -6.031 0.916 -3.008 68 H CYS 10 H CYS 10 -3.322 1.077 0.521 69 HA CYS 10 HA CYS 10 -2.353 3.654 1.425 70 HB2 CYS 10 HB1 CYS 10 -0.788 2.308 2.799 71 HB3 CYS 10 HB2 CYS 10 -2.471 1.851 3.046 72 H PHE 11 H PHE 11 -0.202 4.393 1.157 73 HA PHE 11 HA PHE 11 0.864 3.848 -1.459 74 HB2 PHE 11 HB1 PHE 11 1.579 5.758 0.750 75 HB3 PHE 11 HB2 PHE 11 2.644 5.543 -0.635 76 HD1 PHE 11 HD1 PHE 11 -0.888 6.330 0.226 77 HD2 PHE 11 HD2 PHE 11 2.308 6.795 -2.547 78 HE1 PHE 11 HE1 PHE 11 -2.239 7.938 -1.057 79 HE2 PHE 11 HE2 PHE 11 0.962 8.405 -3.833 80 HZ PHE 11 HZ PHE 11 -1.315 8.977 -3.089 81 HA PRO 12 HA PRO 12 4.000 0.948 -0.455 82 HB2 PRO 12 HB1 PRO 12 5.980 1.685 -2.160 83 HB3 PRO 12 HB2 PRO 12 4.498 0.884 -2.698 84 HG2 PRO 12 HG1 PRO 12 5.210 3.792 -2.755 85 HG3 PRO 12 HG2 PRO 12 4.415 2.810 -3.999 86 HD2 PRO 12 HD1 PRO 12 3.042 4.456 -2.345 87 HD3 PRO 12 HD2 PRO 12 2.359 2.940 -2.967 88 H ASP 13 H ASP 13 5.742 0.685 0.875 89 HA ASP 13 HA ASP 13 7.290 3.068 1.617 90 HB2 ASP 13 HB1 ASP 13 5.353 2.316 3.249 91 HB3 ASP 13 HB2 ASP 13 6.539 1.115 3.751 Start of MODEL 4 1 H1 GLY 1 H GLY 1 9.082 2.278 0.287 2 HA2 GLY 1 HA1 GLY 1 10.451 0.802 -0.827 3 HA3 GLY 1 HA2 GLY 1 10.507 -0.028 0.721 4 H ARG 2 H ARG 2 8.550 -1.460 1.159 5 HA ARG 2 HA ARG 2 8.180 -3.146 -1.188 6 HB2 ARG 2 HB1 ARG 2 7.630 -3.551 1.750 7 HB3 ARG 2 HB2 ARG 2 7.129 -4.709 0.524 8 HG2 ARG 2 HG1 ARG 2 9.458 -5.008 -0.150 9 HG3 ARG 2 HG2 ARG 2 9.960 -3.844 1.079 10 HD2 ARG 2 HD1 ARG 2 8.621 -6.507 1.536 11 HD3 ARG 2 HD2 ARG 2 10.291 -6.082 1.912 12 HE ARG 2 HE ARG 2 8.000 -5.568 3.515 13 HH11 ARG 2 HH11 ARG 2 11.102 -4.277 2.603 14 HH12 ARG 2 HH12 ARG 2 11.310 -3.386 4.074 15 HH21 ARG 2 HH21 ARG 2 8.262 -4.399 5.456 16 HH22 ARG 2 HH22 ARG 2 9.694 -3.457 5.697 17 HA PRO 3 HA PRO 3 4.017 -2.026 -2.009 18 HB2 PRO 3 HB1 PRO 3 2.959 -4.404 -2.781 19 HB3 PRO 3 HB2 PRO 3 4.094 -3.487 -3.780 20 HG2 PRO 3 HG1 PRO 3 4.610 -5.832 -1.993 21 HG3 PRO 3 HG2 PRO 3 5.234 -5.508 -3.621 22 HD2 PRO 3 HD1 PRO 3 6.696 -5.064 -1.385 23 HD3 PRO 3 HD2 PRO 3 6.862 -4.071 -2.847 24 H CYS 4 H CYS 4 2.067 -1.855 -1.004 25 HA CYS 4 HA CYS 4 1.573 -3.658 1.276 26 HB2 CYS 4 HB1 CYS 4 0.496 -1.758 2.418 27 HB3 CYS 4 HB2 CYS 4 2.187 -1.426 2.056 28 H TYR 5 H TYR 5 -0.624 -4.121 1.780 29 HA TYR 5 HA TYR 5 -2.473 -3.687 -0.475 30 HB2 TYR 5 HB1 TYR 5 -2.295 -6.110 1.327 31 HB3 TYR 5 HB2 TYR 5 -3.459 -5.882 0.027 32 HD1 TYR 5 HD1 TYR 5 -2.416 -5.442 -2.343 33 HD2 TYR 5 HD2 TYR 5 -0.335 -7.265 0.889 34 HE1 TYR 5 HE1 TYR 5 -0.843 -6.459 -3.937 35 HE2 TYR 5 HE2 TYR 5 1.245 -8.286 -0.694 36 HH TYR 5 HH TYR 5 0.893 -7.818 -4.198 37 H THR 6 H THR 6 -4.005 -2.307 0.106 38 HA THR 6 HA THR 6 -5.441 -2.743 2.606 39 HB THR 6 HB THR 6 -5.313 -0.484 3.362 40 HG1 THR 6 HG1 THR 6 -4.799 1.111 2.059 41 HG21 THR 6 HG21 THR 6 -2.997 -0.263 3.926 42 HG22 THR 6 HG22 THR 6 -2.508 -1.219 2.526 43 HG23 THR 6 HG23 THR 6 -3.366 -1.986 3.863 44 H LEU 7 H LEU 7 -7.525 -1.714 2.668 45 HA LEU 7 HA LEU 7 -8.717 -1.543 0.034 46 HB2 LEU 7 HB1 LEU 7 -9.739 -2.783 1.961 47 HB3 LEU 7 HB2 LEU 7 -10.053 -1.221 2.714 48 HG LEU 7 HG LEU 7 -11.476 -0.636 0.753 49 HD11 LEU 7 HD11 LEU 7 -10.932 -1.900 -1.052 50 HD12 LEU 7 HD12 LEU 7 -12.254 -2.883 -0.425 51 HD13 LEU 7 HD13 LEU 7 -10.583 -3.335 -0.086 52 HD21 LEU 7 HD21 LEU 7 -12.028 -2.737 2.738 53 HD22 LEU 7 HD22 LEU 7 -13.154 -2.658 1.383 54 HD23 LEU 7 HD23 LEU 7 -12.892 -1.237 2.397 55 H GLN 8 H GLN 8 -7.711 0.590 2.563 56 HA GLN 8 HA GLN 8 -9.230 2.834 1.501 57 HB2 GLN 8 HB1 GLN 8 -7.437 2.462 3.885 58 HB3 GLN 8 HB2 GLN 8 -7.929 4.068 3.361 59 HG2 GLN 8 HG1 GLN 8 -10.190 3.644 3.811 60 HG3 GLN 8 HG2 GLN 8 -9.926 1.905 3.927 61 HE21 GLN 8 HE21 GLN 8 -10.256 4.757 5.630 62 HE22 GLN 8 HE22 GLN 8 -9.695 4.212 7.171 63 H SER 9 H SER 9 -6.888 1.394 0.140 64 HA SER 9 HA SER 9 -5.210 1.960 -1.287 65 HB2 SER 9 HB1 SER 9 -6.946 3.838 -1.771 66 HB3 SER 9 HB2 SER 9 -5.829 4.873 -0.883 67 HG SER 9 HG SER 9 -5.596 4.599 -3.298 68 H CYS 10 H CYS 10 -3.327 1.467 -0.341 69 HA CYS 10 HA CYS 10 -2.182 3.399 1.564 70 HB2 CYS 10 HB1 CYS 10 -2.334 1.405 2.757 71 HB3 CYS 10 HB2 CYS 10 -1.979 0.417 1.344 72 H PHE 11 H PHE 11 -0.151 4.198 1.238 73 HA PHE 11 HA PHE 11 0.903 3.959 -1.443 74 HB2 PHE 11 HB1 PHE 11 1.511 5.701 0.924 75 HB3 PHE 11 HB2 PHE 11 2.644 5.615 -0.421 76 HD1 PHE 11 HD1 PHE 11 -0.917 6.312 0.374 77 HD2 PHE 11 HD2 PHE 11 2.338 6.946 -2.294 78 HE1 PHE 11 HE1 PHE 11 -2.248 7.983 -0.847 79 HE2 PHE 11 HE2 PHE 11 1.012 8.619 -3.519 80 HZ PHE 11 HZ PHE 11 -1.284 9.138 -2.796 81 HA PRO 12 HA PRO 12 4.116 1.070 -0.676 82 HB2 PRO 12 HB1 PRO 12 6.073 2.000 -2.311 83 HB3 PRO 12 HB2 PRO 12 4.614 1.207 -2.916 84 HG2 PRO 12 HG1 PRO 12 5.244 4.128 -2.730 85 HG3 PRO 12 HG2 PRO 12 4.476 3.230 -4.052 86 HD2 PRO 12 HD1 PRO 12 3.058 4.694 -2.270 87 HD3 PRO 12 HD2 PRO 12 2.417 3.217 -3.017 88 H ASP 13 H ASP 13 5.802 0.752 0.691 89 HA ASP 13 HA ASP 13 7.286 3.114 1.629 90 HB2 ASP 13 HB1 ASP 13 5.857 1.032 3.252 91 HB3 ASP 13 HB2 ASP 13 7.270 1.851 3.911 Start of MODEL 5 1 H1 GLY 1 H GLY 1 9.211 2.266 0.473 2 HA2 GLY 1 HA1 GLY 1 10.473 0.784 -0.797 3 HA3 GLY 1 HA2 GLY 1 10.499 -0.069 0.740 4 H ARG 2 H ARG 2 8.563 -1.509 1.137 5 HA ARG 2 HA ARG 2 8.161 -3.123 -1.255 6 HB2 ARG 2 HB1 ARG 2 7.703 -3.606 1.682 7 HB3 ARG 2 HB2 ARG 2 7.093 -4.710 0.456 8 HG2 ARG 2 HG1 ARG 2 9.988 -3.938 0.620 9 HG3 ARG 2 HG2 ARG 2 9.311 -5.293 1.525 10 HD2 ARG 2 HD1 ARG 2 8.737 -5.150 -1.382 11 HD3 ARG 2 HD2 ARG 2 10.373 -5.586 -0.893 12 HE ARG 2 HE ARG 2 8.077 -7.241 -0.774 13 HH11 ARG 2 HH11 ARG 2 11.002 -6.468 0.949 14 HH12 ARG 2 HH12 ARG 2 11.133 -8.028 1.690 15 HH21 ARG 2 HH21 ARG 2 8.239 -9.299 0.195 16 HH22 ARG 2 HH22 ARG 2 9.561 -9.639 1.260 17 HA PRO 3 HA PRO 3 3.987 -1.981 -1.985 18 HB2 PRO 3 HB1 PRO 3 2.907 -4.338 -2.789 19 HB3 PRO 3 HB2 PRO 3 4.029 -3.406 -3.787 20 HG2 PRO 3 HG1 PRO 3 4.564 -5.789 -2.056 21 HG3 PRO 3 HG2 PRO 3 5.164 -5.433 -3.686 22 HD2 PRO 3 HD1 PRO 3 6.663 -5.042 -1.465 23 HD3 PRO 3 HD2 PRO 3 6.809 -4.019 -2.909 24 H CYS 4 H CYS 4 2.018 -1.864 -0.985 25 HA CYS 4 HA CYS 4 1.582 -3.678 1.298 26 HB2 CYS 4 HB1 CYS 4 0.428 -1.775 2.412 27 HB3 CYS 4 HB2 CYS 4 2.139 -1.474 2.125 28 H TYR 5 H TYR 5 -0.629 -4.120 1.853 29 HA TYR 5 HA TYR 5 -2.481 -3.779 -0.414 30 HB2 TYR 5 HB1 TYR 5 -2.428 -6.122 1.494 31 HB3 TYR 5 HB2 TYR 5 -3.402 -5.959 0.038 32 HD1 TYR 5 HD1 TYR 5 -1.424 -4.979 -1.906 33 HD2 TYR 5 HD2 TYR 5 -1.051 -7.958 1.108 34 HE1 TYR 5 HE1 TYR 5 0.347 -6.072 -3.216 35 HE2 TYR 5 HE2 TYR 5 0.723 -9.060 -0.192 36 HH TYR 5 HH TYR 5 1.563 -7.982 -3.433 37 H THR 6 H THR 6 -3.985 -2.351 0.133 38 HA THR 6 HA THR 6 -5.452 -2.725 2.625 39 HB THR 6 HB THR 6 -5.295 -0.464 3.354 40 HG1 THR 6 HG1 THR 6 -3.948 -0.023 0.887 41 HG21 THR 6 HG21 THR 6 -3.009 -0.282 3.965 42 HG22 THR 6 HG22 THR 6 -2.482 -1.162 2.530 43 HG23 THR 6 HG23 THR 6 -3.338 -2.008 3.819 44 H LEU 7 H LEU 7 -7.536 -1.740 2.631 45 HA LEU 7 HA LEU 7 -8.676 -1.542 -0.024 46 HB2 LEU 7 HB1 LEU 7 -10.739 -1.849 0.963 47 HB3 LEU 7 HB2 LEU 7 -9.664 -2.761 2.020 48 HG LEU 7 HG LEU 7 -10.588 0.041 2.629 49 HD11 LEU 7 HD11 LEU 7 -11.968 -2.537 2.931 50 HD12 LEU 7 HD12 LEU 7 -12.615 -0.898 2.872 51 HD13 LEU 7 HD13 LEU 7 -11.934 -1.523 4.373 52 HD21 LEU 7 HD21 LEU 7 -9.223 -2.126 4.211 53 HD22 LEU 7 HD22 LEU 7 -9.980 -0.716 4.955 54 HD23 LEU 7 HD23 LEU 7 -8.627 -0.507 3.842 55 H GLN 8 H GLN 8 -7.694 0.568 2.522 56 HA GLN 8 HA GLN 8 -9.226 2.815 1.482 57 HB2 GLN 8 HB1 GLN 8 -7.604 2.296 3.923 58 HB3 GLN 8 HB2 GLN 8 -7.738 3.961 3.375 59 HG2 GLN 8 HG1 GLN 8 -10.221 3.679 3.396 60 HG3 GLN 8 HG2 GLN 8 -9.972 2.110 4.161 61 HE21 GLN 8 HE21 GLN 8 -10.793 2.477 6.134 62 HE22 GLN 8 HE22 GLN 8 -10.209 3.672 7.236 63 H SER 9 H SER 9 -6.874 1.402 0.114 64 HA SER 9 HA SER 9 -5.194 1.994 -1.302 65 HB2 SER 9 HB1 SER 9 -5.845 4.895 -0.850 66 HB3 SER 9 HB2 SER 9 -5.257 4.111 -2.315 67 HG SER 9 HG SER 9 -7.362 4.357 -2.722 68 H CYS 10 H CYS 10 -3.312 1.492 -0.364 69 HA CYS 10 HA CYS 10 -2.177 3.396 1.578 70 HB2 CYS 10 HB1 CYS 10 -2.329 1.376 2.729 71 HB3 CYS 10 HB2 CYS 10 -1.953 0.418 1.300 72 H PHE 11 H PHE 11 -0.148 4.207 1.271 73 HA PHE 11 HA PHE 11 0.910 4.033 -1.413 74 HB2 PHE 11 HB1 PHE 11 1.588 5.687 1.007 75 HB3 PHE 11 HB2 PHE 11 2.632 5.676 -0.410 76 HD1 PHE 11 HD2 PHE 11 1.582 6.298 -2.654 77 HD2 PHE 11 HD1 PHE 11 -0.266 7.082 1.099 78 HE1 PHE 11 HE2 PHE 11 0.164 8.007 -3.713 79 HE2 PHE 11 HE1 PHE 11 -1.688 8.791 0.046 80 HZ PHE 11 HZ PHE 11 -1.473 9.257 -2.363 81 HA PRO 12 HA PRO 12 4.118 1.118 -0.729 82 HB2 PRO 12 HB1 PRO 12 6.077 2.091 -2.336 83 HB3 PRO 12 HB2 PRO 12 4.617 1.318 -2.962 84 HG2 PRO 12 HG1 PRO 12 5.251 4.231 -2.694 85 HG3 PRO 12 HG2 PRO 12 4.483 3.373 -4.042 86 HD2 PRO 12 HD1 PRO 12 3.066 4.788 -2.219 87 HD3 PRO 12 HD2 PRO 12 2.423 3.333 -3.007 88 H ASP 13 H ASP 13 5.781 0.761 0.650 89 HA ASP 13 HA ASP 13 7.295 3.084 1.632 90 HB2 ASP 13 HB1 ASP 13 5.534 2.496 3.265 91 HB3 ASP 13 HB2 ASP 13 6.182 0.862 3.357 Start of MODEL 6 1 H1 GLY 1 H GLY 1 9.137 1.891 -0.283 2 HA2 GLY 1 HA1 GLY 1 10.440 0.088 -0.861 3 HA3 GLY 1 HA2 GLY 1 10.477 -0.232 0.867 4 H ARG 2 H ARG 2 8.122 -1.116 1.572 5 HA ARG 2 HA ARG 2 7.856 -3.596 0.070 6 HB2 ARG 2 HB1 ARG 2 7.053 -2.668 2.796 7 HB3 ARG 2 HB2 ARG 2 6.200 -4.028 2.078 8 HG2 ARG 2 HG1 ARG 2 8.613 -4.940 1.659 9 HG3 ARG 2 HG2 ARG 2 9.036 -3.820 2.955 10 HD2 ARG 2 HD1 ARG 2 8.605 -5.872 4.020 11 HD3 ARG 2 HD2 ARG 2 7.165 -4.891 4.292 12 HE ARG 2 HE ARG 2 6.818 -6.440 1.969 13 HH11 ARG 2 HH11 ARG 2 7.001 -6.771 5.431 14 HH12 ARG 2 HH12 ARG 2 5.994 -8.180 5.480 15 HH21 ARG 2 HH21 ARG 2 5.491 -8.295 2.022 16 HH22 ARG 2 HH22 ARG 2 5.136 -9.047 3.541 17 HA PRO 3 HA PRO 3 4.046 -2.687 -1.903 18 HB2 PRO 3 HB1 PRO 3 2.711 -5.042 -1.696 19 HB3 PRO 3 HB2 PRO 3 4.098 -4.815 -2.767 20 HG2 PRO 3 HG1 PRO 3 3.989 -6.063 -0.048 21 HG3 PRO 3 HG2 PRO 3 4.857 -6.608 -1.495 22 HD2 PRO 3 HD1 PRO 3 6.081 -5.286 0.527 23 HD3 PRO 3 HD2 PRO 3 6.592 -5.126 -1.166 24 H CYS 4 H CYS 4 2.294 -1.584 -1.298 25 HA CYS 4 HA CYS 4 1.052 -2.242 1.294 26 HB2 CYS 4 HB1 CYS 4 2.272 0.101 0.691 27 HB3 CYS 4 HB2 CYS 4 0.630 0.462 0.170 28 H TYR 5 H TYR 5 -0.542 -3.600 0.543 29 HA TYR 5 HA TYR 5 -2.525 -2.374 -1.261 30 HB2 TYR 5 HB1 TYR 5 -1.711 -5.273 -1.004 31 HB3 TYR 5 HB2 TYR 5 -3.132 -4.736 -1.893 32 HD1 TYR 5 HD2 TYR 5 0.562 -4.276 -1.729 33 HD2 TYR 5 HD1 TYR 5 -2.942 -4.152 -4.140 34 HE1 TYR 5 HE2 TYR 5 1.954 -3.918 -3.725 35 HE2 TYR 5 HE1 TYR 5 -1.559 -3.795 -6.142 36 HH TYR 5 HH TYR 5 0.641 -2.985 -6.740 37 H THR 6 H THR 6 -4.139 -1.683 -0.009 38 HA THR 6 HA THR 6 -5.545 -3.611 1.644 39 HB THR 6 HB THR 6 -5.645 -2.106 3.605 40 HG1 THR 6 HG1 THR 6 -3.763 -0.613 2.077 41 HG21 THR 6 HG21 THR 6 -3.960 -3.958 3.408 42 HG22 THR 6 HG22 THR 6 -3.496 -2.653 4.500 43 HG23 THR 6 HG23 THR 6 -2.787 -2.749 2.889 44 H LEU 7 H LEU 7 -7.570 -2.538 2.606 45 HA LEU 7 HA LEU 7 -9.167 -1.573 0.550 46 HB2 LEU 7 HB1 LEU 7 -9.406 -1.719 3.504 47 HB3 LEU 7 HB2 LEU 7 -10.549 -0.690 2.643 48 HG LEU 7 HG LEU 7 -10.983 -2.814 1.209 49 HD11 LEU 7 HD11 LEU 7 -9.302 -3.828 3.398 50 HD12 LEU 7 HD12 LEU 7 -9.593 -4.483 1.786 51 HD13 LEU 7 HD13 LEU 7 -10.768 -4.753 3.073 52 HD21 LEU 7 HD21 LEU 7 -11.945 -2.219 3.976 53 HD22 LEU 7 HD22 LEU 7 -12.537 -3.644 3.120 54 HD23 LEU 7 HD23 LEU 7 -12.781 -2.038 2.433 55 H GLN 8 H GLN 8 -7.277 0.167 2.948 56 HA GLN 8 HA GLN 8 -8.346 2.739 2.341 57 HB2 GLN 8 HB1 GLN 8 -5.831 1.865 3.760 58 HB3 GLN 8 HB2 GLN 8 -6.296 3.552 3.580 59 HG2 GLN 8 HG1 GLN 8 -7.142 3.115 5.646 60 HG3 GLN 8 HG2 GLN 8 -8.540 2.716 4.648 61 HE21 GLN 8 HE21 GLN 8 -9.443 1.258 6.028 62 HE22 GLN 8 HE22 GLN 8 -8.723 -0.264 6.416 63 H SER 9 H SER 9 -6.006 0.712 0.869 64 HA SER 9 HA SER 9 -4.764 0.938 -1.027 65 HB2 SER 9 HB1 SER 9 -6.917 2.275 -1.692 66 HB3 SER 9 HB2 SER 9 -5.871 3.684 -1.513 67 HG SER 9 HG SER 9 -6.072 2.248 -3.626 68 H CYS 10 H CYS 10 -3.518 1.519 1.315 69 HA CYS 10 HA CYS 10 -2.286 4.031 1.496 70 HB2 CYS 10 HB1 CYS 10 -0.554 2.814 2.856 71 HB3 CYS 10 HB2 CYS 10 -2.215 2.561 3.384 72 H PHE 11 H PHE 11 -0.167 4.704 0.941 73 HA PHE 11 HA PHE 11 0.666 3.795 -1.656 74 HB2 PHE 11 HB1 PHE 11 1.597 5.960 0.212 75 HB3 PHE 11 HB2 PHE 11 2.516 5.554 -1.233 76 HD1 PHE 11 HD2 PHE 11 1.390 5.744 -3.475 77 HD2 PHE 11 HD1 PHE 11 -0.303 7.321 0.098 78 HE1 PHE 11 HE2 PHE 11 -0.072 7.200 -4.814 79 HE2 PHE 11 HE1 PHE 11 -1.768 8.780 -1.236 80 HZ PHE 11 HZ PHE 11 -1.653 8.721 -3.696 81 HA PRO 12 HA PRO 12 3.865 1.000 -0.559 82 HB2 PRO 12 HB1 PRO 12 5.697 1.483 -2.504 83 HB3 PRO 12 HB2 PRO 12 4.170 0.645 -2.808 84 HG2 PRO 12 HG1 PRO 12 4.889 3.510 -3.297 85 HG3 PRO 12 HG2 PRO 12 3.985 2.390 -4.333 86 HD2 PRO 12 HD1 PRO 12 2.766 4.254 -2.794 87 HD3 PRO 12 HD2 PRO 12 2.025 2.683 -3.157 88 H ASP 13 H ASP 13 5.862 0.839 0.466 89 HA ASP 13 HA ASP 13 7.513 3.217 0.746 90 HB2 ASP 13 HB1 ASP 13 6.244 1.842 3.124 91 HB3 ASP 13 HB2 ASP 13 7.496 3.076 3.221 Start of MODEL 7 1 H1 GLY 1 H GLY 1 9.230 2.079 0.045 2 HA2 GLY 1 HA1 GLY 1 9.972 0.421 -1.509 3 HA3 GLY 1 HA2 GLY 1 10.482 -0.161 0.068 4 H ARG 2 H ARG 2 8.572 -1.359 1.248 5 HA ARG 2 HA ARG 2 8.015 -3.661 -0.321 6 HB2 ARG 2 HB1 ARG 2 7.405 -2.774 2.460 7 HB3 ARG 2 HB2 ARG 2 6.473 -4.107 1.792 8 HG2 ARG 2 HG1 ARG 2 8.912 -4.965 1.157 9 HG3 ARG 2 HG2 ARG 2 9.323 -3.980 2.563 10 HD2 ARG 2 HD1 ARG 2 8.118 -5.300 4.010 11 HD3 ARG 2 HD2 ARG 2 7.031 -5.876 2.745 12 HE ARG 2 HE ARG 2 8.455 -7.621 2.399 13 HH11 ARG 2 HH11 ARG 2 10.192 -5.078 4.021 14 HH12 ARG 2 HH12 ARG 2 11.636 -6.014 4.225 15 HH21 ARG 2 HH21 ARG 2 10.350 -8.866 2.661 16 HH22 ARG 2 HH22 ARG 2 11.724 -8.169 3.450 17 HA PRO 3 HA PRO 3 4.073 -2.814 -2.050 18 HB2 PRO 3 HB1 PRO 3 2.798 -5.196 -1.779 19 HB3 PRO 3 HB2 PRO 3 4.112 -4.935 -2.932 20 HG2 PRO 3 HG1 PRO 3 4.194 -6.202 -0.221 21 HG3 PRO 3 HG2 PRO 3 4.981 -6.721 -1.723 22 HD2 PRO 3 HD1 PRO 3 6.302 -5.389 0.230 23 HD3 PRO 3 HD2 PRO 3 6.705 -5.207 -1.490 24 H CYS 4 H CYS 4 2.520 -1.591 -1.200 25 HA CYS 4 HA CYS 4 1.352 -2.384 1.386 26 HB2 CYS 4 HB1 CYS 4 2.639 -0.121 1.049 27 HB3 CYS 4 HB2 CYS 4 1.135 0.399 0.299 28 H TYR 5 H TYR 5 -0.407 -3.558 0.823 29 HA TYR 5 HA TYR 5 -2.363 -2.261 -0.958 30 HB2 TYR 5 HB1 TYR 5 -2.077 -5.235 -0.515 31 HB3 TYR 5 HB2 TYR 5 -3.100 -4.427 -1.697 32 HD1 TYR 5 HD1 TYR 5 -1.254 -2.444 -2.840 33 HD2 TYR 5 HD2 TYR 5 -0.584 -6.507 -1.767 34 HE1 TYR 5 HE1 TYR 5 0.555 -2.578 -4.501 35 HE2 TYR 5 HE2 TYR 5 1.228 -6.651 -3.425 36 HH TYR 5 HH TYR 5 1.866 -4.049 -5.681 37 H THR 6 H THR 6 -3.989 -1.473 0.191 38 HA THR 6 HA THR 6 -5.183 -3.152 2.280 39 HB THR 6 HB THR 6 -5.573 -1.049 3.642 40 HG1 THR 6 HG1 THR 6 -4.730 0.770 2.957 41 HG21 THR 6 HG21 THR 6 -3.264 -1.058 4.597 42 HG22 THR 6 HG22 THR 6 -2.762 -2.072 3.244 43 HG23 THR 6 HG23 THR 6 -3.961 -2.664 4.392 44 H LEU 7 H LEU 7 -7.275 -1.806 3.084 45 HA LEU 7 HA LEU 7 -9.061 -1.863 0.901 46 HB2 LEU 7 HB1 LEU 7 -9.202 -1.221 3.775 47 HB3 LEU 7 HB2 LEU 7 -10.454 -0.499 2.767 48 HG LEU 7 HG LEU 7 -11.184 -2.601 3.797 49 HD11 LEU 7 HD11 LEU 7 -11.664 -1.774 1.297 50 HD12 LEU 7 HD12 LEU 7 -12.380 -3.229 1.987 51 HD13 LEU 7 HD13 LEU 7 -10.959 -3.352 0.950 52 HD21 LEU 7 HD21 LEU 7 -9.195 -4.029 2.059 53 HD22 LEU 7 HD22 LEU 7 -10.176 -4.674 3.376 54 HD23 LEU 7 HD23 LEU 7 -8.830 -3.590 3.728 55 H GLN 8 H GLN 8 -7.450 0.776 2.595 56 HA GLN 8 HA GLN 8 -8.747 2.735 0.858 57 HB2 GLN 8 HB1 GLN 8 -6.992 3.016 3.296 58 HB3 GLN 8 HB2 GLN 8 -7.505 4.387 2.322 59 HG2 GLN 8 HG1 GLN 8 -9.646 2.585 3.237 60 HG3 GLN 8 HG2 GLN 8 -8.821 3.510 4.489 61 HE21 GLN 8 HE21 GLN 8 -9.587 5.454 4.891 62 HE22 GLN 8 HE22 GLN 8 -10.555 6.409 3.824 63 H SER 9 H SER 9 -6.518 0.736 0.163 64 HA SER 9 HA SER 9 -4.596 0.670 -1.064 65 HB2 SER 9 HB1 SER 9 -5.270 3.374 -2.173 66 HB3 SER 9 HB2 SER 9 -4.642 1.952 -3.005 67 HG SER 9 HG SER 9 -7.273 2.534 -2.206 68 H CYS 10 H CYS 10 -3.478 1.012 1.051 69 HA CYS 10 HA CYS 10 -2.472 3.549 1.786 70 HB2 CYS 10 HB1 CYS 10 -0.905 2.276 3.216 71 HB3 CYS 10 HB2 CYS 10 -2.567 1.720 3.388 72 H PHE 11 H PHE 11 -0.594 4.592 1.307 73 HA PHE 11 HA PHE 11 0.609 4.172 -1.181 74 HB2 PHE 11 HB1 PHE 11 1.342 5.814 1.222 75 HB3 PHE 11 HB2 PHE 11 2.445 5.711 -0.147 76 HD1 PHE 11 HD2 PHE 11 1.377 6.211 -2.482 77 HD2 PHE 11 HD1 PHE 11 -0.268 7.456 1.243 78 HE1 PHE 11 HE2 PHE 11 0.112 7.979 -3.634 79 HE2 PHE 11 HE1 PHE 11 -1.535 9.225 0.095 80 HZ PHE 11 HZ PHE 11 -1.347 9.488 -2.347 81 HA PRO 12 HA PRO 12 3.694 1.115 -0.553 82 HB2 PRO 12 HB1 PRO 12 5.681 2.011 -2.171 83 HB3 PRO 12 HB2 PRO 12 4.181 1.310 -2.789 84 HG2 PRO 12 HG1 PRO 12 4.950 4.189 -2.505 85 HG3 PRO 12 HG2 PRO 12 4.130 3.377 -3.852 86 HD2 PRO 12 HD1 PRO 12 2.797 4.841 -2.005 87 HD3 PRO 12 HD2 PRO 12 2.082 3.423 -2.797 88 H ASP 13 H ASP 13 5.922 0.747 0.180 89 HA ASP 13 HA ASP 13 7.315 2.981 1.391 90 HB2 ASP 13 HB1 ASP 13 7.381 1.712 3.623 91 HB3 ASP 13 HB2 ASP 13 5.897 2.575 3.225 Start of MODEL 8 1 H1 GLY 1 H GLY 1 9.259 2.096 -0.022 2 HA2 GLY 1 HA1 GLY 1 10.365 0.327 -1.105 3 HA3 GLY 1 HA2 GLY 1 10.536 -0.118 0.586 4 H ARG 2 H ARG 2 8.248 -1.127 1.373 5 HA ARG 2 HA ARG 2 7.965 -3.504 -0.282 6 HB2 ARG 2 HB1 ARG 2 7.379 -2.803 2.552 7 HB3 ARG 2 HB2 ARG 2 6.425 -4.082 1.813 8 HG2 ARG 2 HG1 ARG 2 8.858 -4.907 1.090 9 HG3 ARG 2 HG2 ARG 2 9.280 -4.035 2.565 10 HD2 ARG 2 HD1 ARG 2 7.049 -6.044 2.484 11 HD3 ARG 2 HD2 ARG 2 8.722 -6.520 2.777 12 HE ARG 2 HE ARG 2 7.929 -4.423 4.520 13 HH11 ARG 2 HH11 ARG 2 7.622 -7.849 3.987 14 HH12 ARG 2 HH12 ARG 2 7.359 -8.218 5.658 15 HH21 ARG 2 HH21 ARG 2 7.584 -4.896 6.725 16 HH22 ARG 2 HH22 ARG 2 7.338 -6.538 7.215 17 HA PRO 3 HA PRO 3 4.008 -2.594 -1.943 18 HB2 PRO 3 HB1 PRO 3 2.766 -5.004 -1.828 19 HB3 PRO 3 HB2 PRO 3 4.073 -4.651 -2.964 20 HG2 PRO 3 HG1 PRO 3 4.180 -6.094 -0.344 21 HG3 PRO 3 HG2 PRO 3 4.969 -6.502 -1.878 22 HD2 PRO 3 HD1 PRO 3 6.278 -5.285 0.155 23 HD3 PRO 3 HD2 PRO 3 6.673 -4.986 -1.549 24 H CYS 4 H CYS 4 2.422 -1.467 -1.028 25 HA CYS 4 HA CYS 4 1.206 -2.500 1.451 26 HB2 CYS 4 HB1 CYS 4 2.614 -0.201 1.300 27 HB3 CYS 4 HB2 CYS 4 1.015 0.401 0.877 28 H TYR 5 H TYR 5 -0.541 -3.527 0.572 29 HA TYR 5 HA TYR 5 -2.415 -1.838 -0.954 30 HB2 TYR 5 HB1 TYR 5 -2.111 -4.843 -1.127 31 HB3 TYR 5 HB2 TYR 5 -3.223 -3.854 -2.067 32 HD1 TYR 5 HD1 TYR 5 -1.986 -1.858 -3.379 33 HD2 TYR 5 HD2 TYR 5 -0.173 -5.513 -2.172 34 HE1 TYR 5 HE1 TYR 5 -0.270 -1.574 -5.118 35 HE2 TYR 5 HE2 TYR 5 1.549 -5.239 -3.907 36 HH TYR 5 HH TYR 5 1.542 -3.855 -6.303 37 H THR 6 H THR 6 -4.237 -1.389 0.072 38 HA THR 6 HA THR 6 -5.517 -3.376 1.760 39 HB THR 6 HB THR 6 -5.791 -1.808 3.659 40 HG1 THR 6 HG1 THR 6 -5.203 0.195 3.372 41 HG21 THR 6 HG21 THR 6 -2.909 -2.382 2.957 42 HG22 THR 6 HG22 THR 6 -4.029 -3.519 3.709 43 HG23 THR 6 HG23 THR 6 -3.540 -2.060 4.571 44 H LEU 7 H LEU 7 -7.585 -2.233 2.775 45 HA LEU 7 HA LEU 7 -9.275 -1.594 0.646 46 HB2 LEU 7 HB1 LEU 7 -9.857 -2.456 2.978 47 HB3 LEU 7 HB2 LEU 7 -9.785 -0.771 3.489 48 HG LEU 7 HG LEU 7 -11.532 -0.379 1.619 49 HD11 LEU 7 HD11 LEU 7 -11.392 -3.332 1.771 50 HD12 LEU 7 HD12 LEU 7 -11.784 -2.281 0.411 51 HD13 LEU 7 HD13 LEU 7 -12.993 -2.602 1.653 52 HD21 LEU 7 HD21 LEU 7 -12.000 -0.123 3.986 53 HD22 LEU 7 HD22 LEU 7 -12.218 -1.865 4.153 54 HD23 LEU 7 HD23 LEU 7 -13.349 -0.923 3.180 55 H GLN 8 H GLN 8 -7.375 0.442 2.763 56 HA GLN 8 HA GLN 8 -8.580 2.865 1.681 57 HB2 GLN 8 HB1 GLN 8 -6.417 2.495 3.759 58 HB3 GLN 8 HB2 GLN 8 -7.120 4.038 3.295 59 HG2 GLN 8 HG1 GLN 8 -8.821 1.804 4.334 60 HG3 GLN 8 HG2 GLN 8 -7.970 2.899 5.423 61 HE21 GLN 8 HE21 GLN 8 -9.043 4.627 6.040 62 HE22 GLN 8 HE22 GLN 8 -10.379 5.348 5.216 63 H SER 9 H SER 9 -6.746 0.895 0.216 64 HA SER 9 HA SER 9 -4.986 0.930 -1.240 65 HB2 SER 9 HB1 SER 9 -4.948 2.836 -2.742 66 HB3 SER 9 HB2 SER 9 -6.623 2.459 -2.339 67 HG SER 9 HG SER 9 -5.771 4.764 -2.213 68 H CYS 10 H CYS 10 -3.589 0.729 0.728 69 HA CYS 10 HA CYS 10 -2.251 2.916 1.863 70 HB2 CYS 10 HB1 CYS 10 -2.307 0.585 2.785 71 HB3 CYS 10 HB2 CYS 10 -1.161 0.116 1.533 72 H PHE 11 H PHE 11 -0.135 3.717 1.533 73 HA PHE 11 HA PHE 11 0.651 3.715 -1.271 74 HB2 PHE 11 HB1 PHE 11 1.205 5.458 1.088 75 HB3 PHE 11 HB2 PHE 11 2.365 5.452 -0.236 76 HD1 PHE 11 HD1 PHE 11 -1.235 5.949 0.524 77 HD2 PHE 11 HD2 PHE 11 1.995 6.744 -2.132 78 HE1 PHE 11 HE1 PHE 11 -2.647 7.540 -0.712 79 HE2 PHE 11 HE2 PHE 11 0.588 8.337 -3.372 80 HZ PHE 11 HZ PHE 11 -1.737 8.737 -2.663 81 HA PRO 12 HA PRO 12 4.141 1.088 -0.866 82 HB2 PRO 12 HB1 PRO 12 5.886 2.237 -2.600 83 HB3 PRO 12 HB2 PRO 12 4.454 1.345 -3.127 84 HG2 PRO 12 HG1 PRO 12 4.856 4.300 -2.867 85 HG3 PRO 12 HG2 PRO 12 4.064 3.389 -4.167 86 HD2 PRO 12 HD1 PRO 12 2.673 4.664 -2.225 87 HD3 PRO 12 HD2 PRO 12 2.099 3.165 -2.983 88 H ASP 13 H ASP 13 5.964 0.866 0.341 89 HA ASP 13 HA ASP 13 7.468 3.245 1.127 90 HB2 ASP 13 HB1 ASP 13 5.935 1.458 2.985 91 HB3 ASP 13 HB2 ASP 13 7.424 2.219 3.537 Start of MODEL 9 1 H1 GLY 1 H GLY 1 9.034 2.276 0.187 2 HA2 GLY 1 HA1 GLY 1 10.424 0.797 -0.889 3 HA3 GLY 1 HA2 GLY 1 10.521 -0.004 0.673 4 H ARG 2 H ARG 2 8.537 -1.410 1.175 5 HA ARG 2 HA ARG 2 8.163 -3.170 -1.114 6 HB2 ARG 2 HB1 ARG 2 7.183 -3.649 1.695 7 HB3 ARG 2 HB2 ARG 2 7.500 -4.837 0.438 8 HG2 ARG 2 HG1 ARG 2 9.391 -5.151 1.610 9 HG3 ARG 2 HG2 ARG 2 9.947 -3.765 0.669 10 HD2 ARG 2 HD1 ARG 2 9.840 -2.342 2.447 11 HD3 ARG 2 HD2 ARG 2 8.505 -3.213 3.201 12 HE ARG 2 HE ARG 2 10.627 -4.919 3.392 13 HH11 ARG 2 HH11 ARG 2 10.012 -1.633 4.366 14 HH12 ARG 2 HH12 ARG 2 11.067 -1.703 5.738 15 HH21 ARG 2 HH21 ARG 2 12.020 -5.024 5.195 16 HH22 ARG 2 HH22 ARG 2 12.209 -3.633 6.208 17 HA PRO 3 HA PRO 3 4.017 -2.013 -1.983 18 HB2 PRO 3 HB1 PRO 3 2.974 -4.389 -2.785 19 HB3 PRO 3 HB2 PRO 3 4.117 -3.462 -3.764 20 HG2 PRO 3 HG1 PRO 3 4.620 -5.819 -1.988 21 HG3 PRO 3 HG2 PRO 3 5.260 -5.480 -3.606 22 HD2 PRO 3 HD1 PRO 3 6.697 -5.051 -1.351 23 HD3 PRO 3 HD2 PRO 3 6.876 -4.045 -2.803 24 H CYS 4 H CYS 4 2.066 -1.843 -0.985 25 HA CYS 4 HA CYS 4 1.542 -3.672 1.266 26 HB2 CYS 4 HB1 CYS 4 0.456 -1.777 2.416 27 HB3 CYS 4 HB2 CYS 4 2.158 -1.462 2.089 28 H TYR 5 H TYR 5 -0.651 -4.156 1.731 29 HA TYR 5 HA TYR 5 -2.485 -3.664 -0.524 30 HB2 TYR 5 HB1 TYR 5 -2.526 -6.114 1.238 31 HB3 TYR 5 HB2 TYR 5 -3.388 -5.859 -0.274 32 HD1 TYR 5 HD1 TYR 5 -1.611 -5.126 -2.255 33 HD2 TYR 5 HD2 TYR 5 -0.794 -7.616 1.096 34 HE1 TYR 5 HE1 TYR 5 0.241 -6.171 -3.491 35 HE2 TYR 5 HE2 TYR 5 1.061 -8.667 -0.129 36 HH TYR 5 HH TYR 5 2.086 -8.859 -2.109 37 H THR 6 H THR 6 -3.968 -2.247 0.108 38 HA THR 6 HA THR 6 -5.426 -2.755 2.591 39 HB THR 6 HB THR 6 -5.315 -0.502 3.369 40 HG1 THR 6 HG1 THR 6 -4.521 1.141 2.174 41 HG21 THR 6 HG21 THR 6 -2.496 -1.170 2.533 42 HG22 THR 6 HG22 THR 6 -3.348 -2.022 3.821 43 HG23 THR 6 HG23 THR 6 -3.023 -0.296 3.971 44 H LEU 7 H LEU 7 -7.513 -1.715 2.674 45 HA LEU 7 HA LEU 7 -8.722 -1.541 0.049 46 HB2 LEU 7 HB1 LEU 7 -9.696 -1.777 2.845 47 HB3 LEU 7 HB2 LEU 7 -10.786 -1.079 1.648 48 HG LEU 7 HG LEU 7 -9.489 -3.765 1.261 49 HD11 LEU 7 HD11 LEU 7 -10.999 -3.397 3.392 50 HD12 LEU 7 HD12 LEU 7 -11.138 -4.850 2.401 51 HD13 LEU 7 HD13 LEU 7 -12.296 -3.535 2.205 52 HD21 LEU 7 HD21 LEU 7 -11.679 -2.205 -0.042 53 HD22 LEU 7 HD22 LEU 7 -11.709 -3.967 -0.087 54 HD23 LEU 7 HD23 LEU 7 -10.341 -3.090 -0.774 55 H GLN 8 H GLN 8 -7.702 0.590 2.576 56 HA GLN 8 HA GLN 8 -9.223 2.835 1.521 57 HB2 GLN 8 HB1 GLN 8 -7.551 2.355 3.943 58 HB3 GLN 8 HB2 GLN 8 -7.751 4.010 3.385 59 HG2 GLN 8 HG1 GLN 8 -9.478 3.839 4.869 60 HG3 GLN 8 HG2 GLN 8 -10.285 3.389 3.368 61 HE21 GLN 8 HE21 GLN 8 -11.453 1.613 3.420 62 HE22 GLN 8 HE22 GLN 8 -11.290 0.318 4.552 63 H SER 9 H SER 9 -6.886 1.394 0.151 64 HA SER 9 HA SER 9 -5.213 1.959 -1.282 65 HB2 SER 9 HB1 SER 9 -5.714 4.883 -0.923 66 HB3 SER 9 HB2 SER 9 -5.377 3.974 -2.396 67 HG SER 9 HG SER 9 -7.723 4.741 -1.493 68 H CYS 10 H CYS 10 -3.332 1.460 -0.334 69 HA CYS 10 HA CYS 10 -2.176 3.396 1.561 70 HB2 CYS 10 HB1 CYS 10 -2.337 1.403 2.757 71 HB3 CYS 10 HB2 CYS 10 -1.975 0.412 1.348 72 H PHE 11 H PHE 11 -0.143 4.186 1.229 73 HA PHE 11 HA PHE 11 0.908 3.926 -1.453 74 HB2 PHE 11 HB1 PHE 11 1.680 5.646 0.904 75 HB3 PHE 11 HB2 PHE 11 2.577 5.647 -0.610 76 HD1 PHE 11 HD2 PHE 11 1.061 5.993 -2.758 77 HD2 PHE 11 HD1 PHE 11 0.042 7.223 1.188 78 HE1 PHE 11 HE2 PHE 11 -0.499 7.656 -3.683 79 HE2 PHE 11 HE1 PHE 11 -1.521 8.887 0.269 80 HZ PHE 11 HZ PHE 11 -1.794 9.105 -2.169 81 HA PRO 12 HA PRO 12 4.129 1.055 -0.651 82 HB2 PRO 12 HB1 PRO 12 6.084 1.971 -2.297 83 HB3 PRO 12 HB2 PRO 12 4.626 1.166 -2.892 84 HG2 PRO 12 HG1 PRO 12 5.247 4.091 -2.744 85 HG3 PRO 12 HG2 PRO 12 4.482 3.174 -4.055 86 HD2 PRO 12 HD1 PRO 12 3.060 4.656 -2.290 87 HD3 PRO 12 HD2 PRO 12 2.423 3.168 -3.018 88 H ASP 13 H ASP 13 5.842 0.757 0.694 89 HA ASP 13 HA ASP 13 7.296 3.141 1.621 90 HB2 ASP 13 HB1 ASP 13 7.316 1.866 3.903 91 HB3 ASP 13 HB2 ASP 13 5.903 2.814 3.449 Start of MODEL 10 1 H1 GLY 1 H GLY 1 9.037 2.070 -0.178 2 HA2 GLY 1 HA1 GLY 1 10.093 0.376 -1.346 3 HA3 GLY 1 HA2 GLY 1 10.490 -0.167 0.279 4 H ARG 2 H ARG 2 8.461 -1.304 1.348 5 HA ARG 2 HA ARG 2 7.986 -3.630 -0.251 6 HB2 ARG 2 HB1 ARG 2 7.302 -2.770 2.527 7 HB3 ARG 2 HB2 ARG 2 6.422 -4.120 1.822 8 HG2 ARG 2 HG1 ARG 2 8.672 -5.159 1.328 9 HG3 ARG 2 HG2 ARG 2 9.368 -3.905 2.357 10 HD2 ARG 2 HD1 ARG 2 7.106 -5.589 3.353 11 HD3 ARG 2 HD2 ARG 2 8.753 -6.219 3.373 12 HE ARG 2 HE ARG 2 8.466 -3.616 4.575 13 HH11 ARG 2 HH11 ARG 2 8.347 -7.057 5.088 14 HH12 ARG 2 HH12 ARG 2 8.654 -6.945 6.790 15 HH21 ARG 2 HH21 ARG 2 8.871 -3.456 6.814 16 HH22 ARG 2 HH22 ARG 2 8.951 -4.896 7.770 17 HA PRO 3 HA PRO 3 4.075 -2.755 -2.034 18 HB2 PRO 3 HB1 PRO 3 2.791 -5.136 -1.811 19 HB3 PRO 3 HB2 PRO 3 4.124 -4.866 -2.939 20 HG2 PRO 3 HG1 PRO 3 4.158 -6.164 -0.241 21 HG3 PRO 3 HG2 PRO 3 4.970 -6.667 -1.736 22 HD2 PRO 3 HD1 PRO 3 6.260 -5.360 0.253 23 HD3 PRO 3 HD2 PRO 3 6.692 -5.161 -1.458 24 H CYS 4 H CYS 4 2.510 -1.539 -1.198 25 HA CYS 4 HA CYS 4 1.299 -2.356 1.360 26 HB2 CYS 4 HB1 CYS 4 2.595 -0.092 1.067 27 HB3 CYS 4 HB2 CYS 4 1.103 0.438 0.298 28 H TYR 5 H TYR 5 -0.417 -3.561 0.689 29 HA TYR 5 HA TYR 5 -2.371 -2.210 -1.056 30 HB2 TYR 5 HB1 TYR 5 -1.819 -5.172 -0.787 31 HB3 TYR 5 HB2 TYR 5 -3.132 -4.478 -1.732 32 HD1 TYR 5 HD1 TYR 5 -2.553 -2.997 -3.698 33 HD2 TYR 5 HD2 TYR 5 0.351 -5.368 -1.685 34 HE1 TYR 5 HE1 TYR 5 -1.057 -2.804 -5.641 35 HE2 TYR 5 HE2 TYR 5 1.855 -5.180 -3.621 36 HH TYR 5 HH TYR 5 1.447 -2.947 -6.055 37 H THR 6 H THR 6 -3.917 -1.426 0.223 38 HA THR 6 HA THR 6 -5.176 -3.254 2.146 39 HB THR 6 HB THR 6 -5.518 -1.325 3.702 40 HG1 THR 6 HG1 THR 6 -5.125 0.401 2.300 41 HG21 THR 6 HG21 THR 6 -3.092 -1.261 4.474 42 HG22 THR 6 HG22 THR 6 -2.731 -2.273 3.076 43 HG23 THR 6 HG23 THR 6 -3.830 -2.854 4.327 44 H LEU 7 H LEU 7 -7.249 -1.925 3.040 45 HA LEU 7 HA LEU 7 -9.016 -1.785 0.840 46 HB2 LEU 7 HB1 LEU 7 -9.189 -1.329 3.759 47 HB3 LEU 7 HB2 LEU 7 -10.447 -0.600 2.764 48 HG LEU 7 HG LEU 7 -10.699 -3.003 1.794 49 HD11 LEU 7 HD11 LEU 7 -8.651 -3.816 2.993 50 HD12 LEU 7 HD12 LEU 7 -10.102 -4.785 3.246 51 HD13 LEU 7 HD13 LEU 7 -9.558 -3.669 4.498 52 HD21 LEU 7 HD21 LEU 7 -12.025 -3.508 4.076 53 HD22 LEU 7 HD22 LEU 7 -12.593 -2.373 2.851 54 HD23 LEU 7 HD23 LEU 7 -11.733 -1.779 4.271 55 H GLN 8 H GLN 8 -7.310 0.656 2.701 56 HA GLN 8 HA GLN 8 -8.630 2.804 1.234 57 HB2 GLN 8 HB1 GLN 8 -6.839 2.681 3.631 58 HB3 GLN 8 HB2 GLN 8 -6.991 4.190 2.740 59 HG2 GLN 8 HG1 GLN 8 -9.362 2.678 3.794 60 HG3 GLN 8 HG2 GLN 8 -8.506 3.899 4.734 61 HE21 GLN 8 HE21 GLN 8 -8.267 6.038 3.642 62 HE22 GLN 8 HE22 GLN 8 -9.615 6.619 2.732 63 H SER 9 H SER 9 -6.558 0.799 0.176 64 HA SER 9 HA SER 9 -4.716 0.776 -1.175 65 HB2 SER 9 HB1 SER 9 -4.751 2.396 -2.960 66 HB3 SER 9 HB2 SER 9 -6.422 2.006 -2.550 67 HG SER 9 HG SER 9 -6.711 4.023 -2.084 68 H CYS 10 H CYS 10 -3.654 1.146 1.097 69 HA CYS 10 HA CYS 10 -2.463 3.607 1.722 70 HB2 CYS 10 HB1 CYS 10 -0.957 2.309 3.161 71 HB3 CYS 10 HB2 CYS 10 -2.622 1.767 3.332 72 H PHE 11 H PHE 11 -0.576 4.568 1.150 73 HA PHE 11 HA PHE 11 0.573 3.950 -1.344 74 HB2 PHE 11 HB1 PHE 11 1.157 5.874 0.850 75 HB3 PHE 11 HB2 PHE 11 2.440 5.564 -0.315 76 HD1 PHE 11 HD1 PHE 11 -1.262 5.994 -0.559 77 HD2 PHE 11 HD2 PHE 11 2.593 7.235 -1.868 78 HE1 PHE 11 HE1 PHE 11 -2.307 7.579 -2.123 79 HE2 PHE 11 HE2 PHE 11 1.553 8.823 -3.435 80 HZ PHE 11 HZ PHE 11 -0.899 8.996 -3.565 81 HA PRO 12 HA PRO 12 3.691 0.993 -0.457 82 HB2 PRO 12 HB1 PRO 12 5.656 1.749 -2.171 83 HB3 PRO 12 HB2 PRO 12 4.157 0.979 -2.706 84 HG2 PRO 12 HG1 PRO 12 4.903 3.879 -2.703 85 HG3 PRO 12 HG2 PRO 12 4.079 2.936 -3.959 86 HD2 PRO 12 HD1 PRO 12 2.748 4.557 -2.246 87 HD3 PRO 12 HD2 PRO 12 2.039 3.065 -2.896 88 H ASP 13 H ASP 13 5.928 0.714 0.287 89 HA ASP 13 HA ASP 13 7.318 3.062 1.262 90 HB2 ASP 13 HB1 ASP 13 6.004 1.070 3.099 91 HB3 ASP 13 HB2 ASP 13 7.400 2.013 3.610 Start of MODEL 11 1 H1 GLY 1 H GLY 1 9.307 1.949 0.292 2 HA2 GLY 1 HA1 GLY 1 10.350 0.165 -0.835 3 HA3 GLY 1 HA2 GLY 1 10.371 -0.385 0.833 4 H ARG 2 H ARG 2 8.098 -1.372 1.469 5 HA ARG 2 HA ARG 2 7.679 -3.541 -0.426 6 HB2 ARG 2 HB1 ARG 2 7.063 -3.103 2.467 7 HB3 ARG 2 HB2 ARG 2 6.142 -4.306 1.574 8 HG2 ARG 2 HG1 ARG 2 8.477 -5.184 0.857 9 HG3 ARG 2 HG2 ARG 2 9.047 -4.269 2.255 10 HD2 ARG 2 HD1 ARG 2 8.651 -6.436 3.067 11 HD3 ARG 2 HD2 ARG 2 7.256 -5.492 3.585 12 HE ARG 2 HE ARG 2 5.923 -6.787 2.246 13 HH11 ARG 2 HH11 ARG 2 9.256 -7.278 1.368 14 HH12 ARG 2 HH12 ARG 2 8.915 -8.597 0.298 15 HH21 ARG 2 HH21 ARG 2 5.462 -8.522 0.839 16 HH22 ARG 2 HH22 ARG 2 6.757 -9.303 -0.003 17 HA PRO 3 HA PRO 3 3.776 -2.244 -1.955 18 HB2 PRO 3 HB1 PRO 3 2.401 -4.580 -2.082 19 HB3 PRO 3 HB2 PRO 3 3.724 -4.184 -3.185 20 HG2 PRO 3 HG1 PRO 3 3.753 -5.896 -0.730 21 HG3 PRO 3 HG2 PRO 3 4.516 -6.185 -2.304 22 HD2 PRO 3 HD1 PRO 3 5.895 -5.261 -0.164 23 HD3 PRO 3 HD2 PRO 3 6.303 -4.807 -1.831 24 H CYS 4 H CYS 4 1.738 -1.617 -1.321 25 HA CYS 4 HA CYS 4 0.903 -2.434 1.385 26 HB2 CYS 4 HB1 CYS 4 1.653 -0.136 1.438 27 HB3 CYS 4 HB2 CYS 4 0.652 0.267 0.047 28 H TYR 5 H TYR 5 -0.552 -4.002 0.789 29 HA TYR 5 HA TYR 5 -2.710 -3.238 -1.044 30 HB2 TYR 5 HB1 TYR 5 -1.676 -5.892 -0.077 31 HB3 TYR 5 HB2 TYR 5 -3.262 -5.751 -0.828 32 HD1 TYR 5 HD2 TYR 5 0.220 -4.551 -1.508 33 HD2 TYR 5 HD1 TYR 5 -3.343 -6.278 -3.065 34 HE1 TYR 5 HE2 TYR 5 1.266 -4.694 -3.729 35 HE2 TYR 5 HE1 TYR 5 -2.306 -6.427 -5.289 36 HH TYR 5 HH TYR 5 0.288 -6.573 -6.104 37 H THR 6 H THR 6 -4.337 -2.271 -0.016 38 HA THR 6 HA THR 6 -5.750 -3.693 2.053 39 HB THR 6 HB THR 6 -5.753 -1.462 3.459 40 HG1 THR 6 HG1 THR 6 -4.161 -0.638 1.734 41 HG21 THR 6 HG21 THR 6 -4.220 -2.442 4.955 42 HG22 THR 6 HG22 THR 6 -3.316 -3.215 3.652 43 HG23 THR 6 HG23 THR 6 -4.923 -3.800 4.077 44 H LEU 7 H LEU 7 -7.686 -2.304 2.812 45 HA LEU 7 HA LEU 7 -9.259 -1.680 0.595 46 HB2 LEU 7 HB1 LEU 7 -10.203 -2.305 2.740 47 HB3 LEU 7 HB2 LEU 7 -9.578 -0.828 3.469 48 HG LEU 7 HG LEU 7 -11.452 -0.554 1.179 49 HD11 LEU 7 HD11 LEU 7 -13.388 -0.777 2.642 50 HD12 LEU 7 HD12 LEU 7 -12.341 -1.287 3.966 51 HD13 LEU 7 HD13 LEU 7 -12.501 -2.298 2.530 52 HD21 LEU 7 HD21 LEU 7 -10.283 1.097 3.160 53 HD22 LEU 7 HD22 LEU 7 -12.022 1.065 3.449 54 HD23 LEU 7 HD23 LEU 7 -11.400 1.551 1.872 55 H GLN 8 H GLN 8 -7.278 0.369 2.653 56 HA GLN 8 HA GLN 8 -8.187 2.791 1.347 57 HB2 GLN 8 HB1 GLN 8 -6.293 2.175 3.585 58 HB3 GLN 8 HB2 GLN 8 -6.239 3.751 2.806 59 HG2 GLN 8 HG1 GLN 8 -8.576 4.124 3.363 60 HG3 GLN 8 HG2 GLN 8 -8.661 2.530 4.111 61 HE21 GLN 8 HE21 GLN 8 -7.066 2.157 5.887 62 HE22 GLN 8 HE22 GLN 8 -6.771 3.466 6.974 63 H SER 9 H SER 9 -5.603 0.510 1.081 64 HA SER 9 HA SER 9 -3.815 0.336 -0.315 65 HB2 SER 9 HB1 SER 9 -5.805 0.861 -1.927 66 HB3 SER 9 HB2 SER 9 -5.015 2.428 -2.102 67 HG SER 9 HG SER 9 -3.710 1.486 -3.436 68 H CYS 10 H CYS 10 -2.899 1.628 1.633 69 HA CYS 10 HA CYS 10 -2.245 4.348 1.356 70 HB2 CYS 10 HB1 CYS 10 -0.828 4.061 3.215 71 HB3 CYS 10 HB2 CYS 10 -2.109 2.876 3.449 72 H PHE 11 H PHE 11 -0.257 5.349 0.808 73 HA PHE 11 HA PHE 11 0.871 4.593 -1.592 74 HB2 PHE 11 HB1 PHE 11 1.667 6.462 0.583 75 HB3 PHE 11 HB2 PHE 11 2.882 6.063 -0.628 76 HD1 PHE 11 HD1 PHE 11 -0.529 7.430 -0.178 77 HD2 PHE 11 HD2 PHE 11 2.848 7.061 -2.744 78 HE1 PHE 11 HE1 PHE 11 -1.509 9.094 -1.701 79 HE2 PHE 11 HE2 PHE 11 1.872 8.727 -4.271 80 HZ PHE 11 HZ PHE 11 -0.309 9.745 -3.751 81 HA PRO 12 HA PRO 12 3.788 1.412 -0.804 82 HB2 PRO 12 HB1 PRO 12 5.751 2.025 -2.576 83 HB3 PRO 12 HB2 PRO 12 4.184 1.371 -3.066 84 HG2 PRO 12 HG1 PRO 12 5.141 4.208 -3.083 85 HG3 PRO 12 HG2 PRO 12 4.213 3.333 -4.314 86 HD2 PRO 12 HD1 PRO 12 3.058 5.042 -2.560 87 HD3 PRO 12 HD2 PRO 12 2.220 3.608 -3.189 88 H ASP 13 H ASP 13 5.634 0.947 0.353 89 HA ASP 13 HA ASP 13 7.479 3.101 1.024 90 HB2 ASP 13 HB1 ASP 13 5.745 1.657 3.017 91 HB3 ASP 13 HB2 ASP 13 7.285 2.371 3.488 Start of MODEL 12 1 H1 GLY 1 H GLY 1 9.270 1.933 0.155 2 HA2 GLY 1 HA1 GLY 1 10.364 0.139 -0.843 3 HA3 GLY 1 HA2 GLY 1 10.382 -0.405 0.828 4 H ARG 2 H ARG 2 8.103 -1.375 1.466 5 HA ARG 2 HA ARG 2 7.671 -3.549 -0.421 6 HB2 ARG 2 HB1 ARG 2 7.033 -3.098 2.470 7 HB3 ARG 2 HB2 ARG 2 6.147 -4.323 1.571 8 HG2 ARG 2 HG1 ARG 2 9.105 -4.358 1.390 9 HG3 ARG 2 HG2 ARG 2 8.363 -4.874 2.906 10 HD2 ARG 2 HD1 ARG 2 6.867 -6.352 1.432 11 HD3 ARG 2 HD2 ARG 2 8.051 -6.045 0.161 12 HE ARG 2 HE ARG 2 9.191 -6.992 2.629 13 HH11 ARG 2 HH11 ARG 2 7.784 -7.895 -0.425 14 HH12 ARG 2 HH12 ARG 2 8.539 -9.455 -0.459 15 HH21 ARG 2 HH21 ARG 2 10.190 -9.043 2.594 16 HH22 ARG 2 HH22 ARG 2 9.906 -10.107 1.259 17 HA PRO 3 HA PRO 3 3.777 -2.230 -1.950 18 HB2 PRO 3 HB1 PRO 3 2.393 -4.562 -2.086 19 HB3 PRO 3 HB2 PRO 3 3.719 -4.165 -3.186 20 HG2 PRO 3 HG1 PRO 3 3.741 -5.886 -0.737 21 HG3 PRO 3 HG2 PRO 3 4.504 -6.172 -2.311 22 HD2 PRO 3 HD1 PRO 3 5.885 -5.259 -0.168 23 HD3 PRO 3 HD2 PRO 3 6.295 -4.801 -1.833 24 H CYS 4 H CYS 4 1.724 -1.619 -1.326 25 HA CYS 4 HA CYS 4 0.898 -2.425 1.387 26 HB2 CYS 4 HB1 CYS 4 1.637 -0.118 1.412 27 HB3 CYS 4 HB2 CYS 4 0.612 0.264 0.033 28 H TYR 5 H TYR 5 -0.547 -4.007 0.807 29 HA TYR 5 HA TYR 5 -2.710 -3.275 -1.036 30 HB2 TYR 5 HB1 TYR 5 -2.029 -5.993 0.101 31 HB3 TYR 5 HB2 TYR 5 -3.205 -5.653 -1.162 32 HD1 TYR 5 HD1 TYR 5 -1.700 -3.747 -2.849 33 HD2 TYR 5 HD2 TYR 5 -0.433 -7.335 -0.945 34 HE1 TYR 5 HE1 TYR 5 0.048 -4.029 -4.556 35 HE2 TYR 5 HE2 TYR 5 1.319 -7.627 -2.646 36 HH TYR 5 HH TYR 5 1.524 -5.523 -5.451 37 H THR 6 H THR 6 -4.342 -2.303 -0.020 38 HA THR 6 HA THR 6 -5.750 -3.709 2.066 39 HB THR 6 HB THR 6 -5.766 -1.462 3.447 40 HG1 THR 6 HG1 THR 6 -3.716 -0.442 3.349 41 HG21 THR 6 HG21 THR 6 -4.217 -2.411 4.949 42 HG22 THR 6 HG22 THR 6 -3.319 -3.200 3.653 43 HG23 THR 6 HG23 THR 6 -4.922 -3.783 4.096 44 H LEU 7 H LEU 7 -7.667 -2.256 2.835 45 HA LEU 7 HA LEU 7 -9.252 -1.686 0.599 46 HB2 LEU 7 HB1 LEU 7 -10.075 -2.282 2.870 47 HB3 LEU 7 HB2 LEU 7 -9.642 -0.660 3.406 48 HG LEU 7 HG LEU 7 -11.254 0.144 1.560 49 HD11 LEU 7 HD11 LEU 7 -11.870 -2.777 1.707 50 HD12 LEU 7 HD12 LEU 7 -11.748 -1.726 0.296 51 HD13 LEU 7 HD13 LEU 7 -13.149 -1.614 1.361 52 HD21 LEU 7 HD21 LEU 7 -12.036 -1.148 4.151 53 HD22 LEU 7 HD22 LEU 7 -13.229 -0.347 3.127 54 HD23 LEU 7 HD23 LEU 7 -11.864 0.566 3.770 55 H GLN 8 H GLN 8 -7.282 0.390 2.641 56 HA GLN 8 HA GLN 8 -8.194 2.795 1.304 57 HB2 GLN 8 HB1 GLN 8 -6.277 2.225 3.542 58 HB3 GLN 8 HB2 GLN 8 -6.295 3.802 2.764 59 HG2 GLN 8 HG1 GLN 8 -8.905 2.744 3.641 60 HG3 GLN 8 HG2 GLN 8 -7.768 3.193 4.911 61 HE21 GLN 8 HE21 GLN 8 -6.746 5.378 4.612 62 HE22 GLN 8 HE22 GLN 8 -7.776 6.654 4.067 63 H SER 9 H SER 9 -5.600 0.522 1.081 64 HA SER 9 HA SER 9 -3.809 0.334 -0.309 65 HB2 SER 9 HB1 SER 9 -5.321 2.343 -1.995 66 HB3 SER 9 HB2 SER 9 -4.018 1.292 -2.550 67 HG SER 9 HG SER 9 -6.349 0.633 -2.865 68 H CYS 10 H CYS 10 -2.918 1.639 1.650 69 HA CYS 10 HA CYS 10 -2.251 4.351 1.380 70 HB2 CYS 10 HB1 CYS 10 -0.829 4.052 3.235 71 HB3 CYS 10 HB2 CYS 10 -2.111 2.869 3.465 72 H PHE 11 H PHE 11 -0.265 5.356 0.836 73 HA PHE 11 HA PHE 11 0.862 4.613 -1.571 74 HB2 PHE 11 HB1 PHE 11 1.655 6.473 0.613 75 HB3 PHE 11 HB2 PHE 11 2.873 6.079 -0.595 76 HD1 PHE 11 HD1 PHE 11 -0.568 7.395 -0.186 77 HD2 PHE 11 HD2 PHE 11 2.875 7.133 -2.675 78 HE1 PHE 11 HE1 PHE 11 -1.544 9.064 -1.707 79 HE2 PHE 11 HE2 PHE 11 1.905 8.803 -4.199 80 HZ PHE 11 HZ PHE 11 -0.308 9.770 -3.716 81 HA PRO 12 HA PRO 12 3.781 1.430 -0.802 82 HB2 PRO 12 HB1 PRO 12 5.740 2.052 -2.574 83 HB3 PRO 12 HB2 PRO 12 4.173 1.400 -3.065 84 HG2 PRO 12 HG1 PRO 12 5.128 4.236 -3.070 85 HG3 PRO 12 HG2 PRO 12 4.198 3.367 -4.304 86 HD2 PRO 12 HD1 PRO 12 3.045 5.067 -2.540 87 HD3 PRO 12 HD2 PRO 12 2.208 3.636 -3.174 88 H ASP 13 H ASP 13 5.667 0.953 0.306 89 HA ASP 13 HA ASP 13 7.510 3.099 0.988 90 HB2 ASP 13 HB1 ASP 13 7.306 2.361 3.461 91 HB3 ASP 13 HB2 ASP 13 6.080 3.444 2.806 Start of MODEL 13 1 H1 GLY 1 H GLY 1 9.604 1.623 1.281 2 HA2 GLY 1 HA1 GLY 1 10.216 0.754 -0.954 3 HA3 GLY 1 HA2 GLY 1 10.215 -0.535 0.241 4 H ARG 2 H ARG 2 8.272 -1.854 0.423 5 HA ARG 2 HA ARG 2 7.126 -2.332 -2.213 6 HB2 ARG 2 HB1 ARG 2 7.323 -3.915 0.323 7 HB3 ARG 2 HB2 ARG 2 6.122 -4.353 -0.885 8 HG2 ARG 2 HG1 ARG 2 8.968 -3.992 -1.700 9 HG3 ARG 2 HG2 ARG 2 8.465 -5.479 -0.893 10 HD2 ARG 2 HD1 ARG 2 6.800 -5.882 -2.605 11 HD3 ARG 2 HD2 ARG 2 7.190 -4.348 -3.380 12 HE ARG 2 HE ARG 2 9.042 -5.323 -4.326 13 HH11 ARG 2 HH11 ARG 2 7.752 -7.412 -1.858 14 HH12 ARG 2 HH12 ARG 2 8.763 -8.754 -2.282 15 HH21 ARG 2 HH21 ARG 2 10.379 -7.082 -4.894 16 HH22 ARG 2 HH22 ARG 2 10.257 -8.565 -4.009 17 HA PRO 3 HA PRO 3 3.130 -0.715 -1.398 18 HB2 PRO 3 HB1 PRO 3 1.521 -2.521 -2.629 19 HB3 PRO 3 HB2 PRO 3 2.540 -1.382 -3.517 20 HG2 PRO 3 HG1 PRO 3 3.031 -4.267 -2.886 21 HG3 PRO 3 HG2 PRO 3 3.312 -3.389 -4.401 22 HD2 PRO 3 HD1 PRO 3 5.302 -3.956 -2.654 23 HD3 PRO 3 HD2 PRO 3 5.300 -2.491 -3.658 24 H CYS 4 H CYS 4 1.074 -1.098 -0.327 25 HA CYS 4 HA CYS 4 1.229 -3.298 1.628 26 HB2 CYS 4 HB1 CYS 4 0.169 -1.895 3.245 27 HB3 CYS 4 HB2 CYS 4 1.476 -0.956 2.533 28 H TYR 5 H TYR 5 -0.589 -4.503 2.054 29 HA TYR 5 HA TYR 5 -2.663 -4.388 0.017 30 HB2 TYR 5 HB1 TYR 5 -2.272 -6.412 2.231 31 HB3 TYR 5 HB2 TYR 5 -3.337 -6.572 0.839 32 HD1 TYR 5 HD1 TYR 5 -2.313 -6.741 -1.460 33 HD2 TYR 5 HD2 TYR 5 0.000 -7.032 2.099 34 HE1 TYR 5 HE1 TYR 5 -0.497 -7.801 -2.736 35 HE2 TYR 5 HE2 TYR 5 1.824 -8.091 0.834 36 HH TYR 5 HH TYR 5 2.439 -8.964 -1.127 37 H THR 6 H THR 6 -4.260 -2.994 0.403 38 HA THR 6 HA THR 6 -5.934 -3.344 2.706 39 HB THR 6 HB THR 6 -5.738 -0.709 3.089 40 HG1 THR 6 HG1 THR 6 -4.054 -0.168 1.822 41 HG21 THR 6 HG21 THR 6 -5.117 -1.364 5.134 42 HG22 THR 6 HG22 THR 6 -3.577 -1.986 4.542 43 HG23 THR 6 HG23 THR 6 -5.019 -2.999 4.485 44 H LEU 7 H LEU 7 -7.798 -1.752 2.657 45 HA LEU 7 HA LEU 7 -8.885 -1.714 0.020 46 HB2 LEU 7 HB1 LEU 7 -10.338 -2.121 1.878 47 HB3 LEU 7 HB2 LEU 7 -9.871 -0.602 2.639 48 HG LEU 7 HG LEU 7 -10.931 0.538 0.611 49 HD11 LEU 7 HD11 LEU 7 -12.888 -1.099 -0.155 50 HD12 LEU 7 HD12 LEU 7 -11.624 -2.297 0.124 51 HD13 LEU 7 HD13 LEU 7 -11.353 -0.980 -1.017 52 HD21 LEU 7 HD21 LEU 7 -12.968 -0.960 2.194 53 HD22 LEU 7 HD22 LEU 7 -12.926 0.743 1.741 54 HD23 LEU 7 HD23 LEU 7 -11.866 0.143 3.018 55 H GLN 8 H GLN 8 -7.493 0.693 2.168 56 HA GLN 8 HA GLN 8 -8.200 2.913 0.482 57 HB2 GLN 8 HB1 GLN 8 -6.471 2.605 2.923 58 HB3 GLN 8 HB2 GLN 8 -6.522 4.116 2.025 59 HG2 GLN 8 HG1 GLN 8 -8.733 4.523 2.581 60 HG3 GLN 8 HG2 GLN 8 -9.048 2.834 2.976 61 HE21 GLN 8 HE21 GLN 8 -9.300 5.469 4.454 62 HE22 GLN 8 HE22 GLN 8 -8.529 5.170 5.971 63 H SER 9 H SER 9 -5.575 0.679 0.722 64 HA SER 9 HA SER 9 -3.708 0.359 -0.537 65 HB2 SER 9 HB1 SER 9 -5.452 0.954 -2.372 66 HB3 SER 9 HB2 SER 9 -4.614 2.504 -2.441 67 HG SER 9 HG SER 9 -2.840 1.535 -3.198 68 H CYS 10 H CYS 10 -2.837 1.527 1.447 69 HA CYS 10 HA CYS 10 -2.060 4.229 1.327 70 HB2 CYS 10 HB1 CYS 10 -0.788 3.810 3.264 71 HB3 CYS 10 HB2 CYS 10 -2.128 2.672 3.364 72 H PHE 11 H PHE 11 0.002 5.158 0.955 73 HA PHE 11 HA PHE 11 1.258 4.445 -1.394 74 HB2 PHE 11 HB1 PHE 11 2.049 6.154 0.928 75 HB3 PHE 11 HB2 PHE 11 3.251 5.799 -0.309 76 HD1 PHE 11 HD1 PHE 11 -0.221 7.077 0.090 77 HD2 PHE 11 HD2 PHE 11 3.367 7.119 -2.200 78 HE1 PHE 11 HE1 PHE 11 -1.140 8.879 -1.310 79 HE2 PHE 11 HE2 PHE 11 2.454 8.923 -3.603 80 HZ PHE 11 HZ PHE 11 0.198 9.806 -3.158 81 HA PRO 12 HA PRO 12 3.975 1.105 -0.549 82 HB2 PRO 12 HB1 PRO 12 6.082 1.701 -2.155 83 HB3 PRO 12 HB2 PRO 12 4.527 1.139 -2.779 84 HG2 PRO 12 HG1 PRO 12 5.603 3.927 -2.606 85 HG3 PRO 12 HG2 PRO 12 4.727 3.147 -3.935 86 HD2 PRO 12 HD1 PRO 12 3.526 4.834 -2.191 87 HD3 PRO 12 HD2 PRO 12 2.674 3.467 -2.937 88 H ASP 13 H ASP 13 5.579 0.539 0.841 89 HA ASP 13 HA ASP 13 7.285 2.702 1.890 90 HB2 ASP 13 HB1 ASP 13 5.361 1.662 3.369 91 HB3 ASP 13 HB2 ASP 13 6.535 0.370 3.606 Start of MODEL 14 1 H1 GLY 1 H GLY 1 9.355 2.120 0.202 2 HA2 GLY 1 HA1 GLY 1 10.356 0.461 -1.182 3 HA3 GLY 1 HA2 GLY 1 10.613 -0.119 0.458 4 H ARG 2 H ARG 2 8.441 -1.253 1.295 5 HA ARG 2 HA ARG 2 8.082 -3.493 -0.508 6 HB2 ARG 2 HB1 ARG 2 7.503 -2.956 2.369 7 HB3 ARG 2 HB2 ARG 2 6.598 -4.226 1.558 8 HG2 ARG 2 HG1 ARG 2 9.116 -4.850 0.803 9 HG3 ARG 2 HG2 ARG 2 9.408 -4.147 2.395 10 HD2 ARG 2 HD1 ARG 2 7.155 -5.836 2.624 11 HD3 ARG 2 HD2 ARG 2 8.383 -6.727 1.725 12 HE ARG 2 HE ARG 2 9.645 -6.847 3.633 13 HH11 ARG 2 HH11 ARG 2 7.160 -4.444 4.052 14 HH12 ARG 2 HH12 ARG 2 7.481 -4.218 5.739 15 HH21 ARG 2 HH21 ARG 2 10.077 -6.558 5.854 16 HH22 ARG 2 HH22 ARG 2 9.141 -5.420 6.763 17 HA PRO 3 HA PRO 3 4.094 -2.509 -2.048 18 HB2 PRO 3 HB1 PRO 3 2.860 -4.927 -2.046 19 HB3 PRO 3 HB2 PRO 3 4.147 -4.505 -3.183 20 HG2 PRO 3 HG1 PRO 3 4.304 -6.092 -0.649 21 HG3 PRO 3 HG2 PRO 3 5.067 -6.410 -2.217 22 HD2 PRO 3 HD1 PRO 3 6.408 -5.303 -0.141 23 HD3 PRO 3 HD2 PRO 3 6.772 -4.908 -1.833 24 H CYS 4 H CYS 4 2.402 -1.533 -1.139 25 HA CYS 4 HA CYS 4 1.331 -2.630 1.378 26 HB2 CYS 4 HB1 CYS 4 2.579 -0.255 1.200 27 HB3 CYS 4 HB2 CYS 4 0.947 0.252 0.779 28 H TYR 5 H TYR 5 -0.511 -3.633 0.865 29 HA TYR 5 HA TYR 5 -2.413 -2.213 -0.882 30 HB2 TYR 5 HB1 TYR 5 -2.181 -5.203 -0.499 31 HB3 TYR 5 HB2 TYR 5 -3.280 -4.371 -1.594 32 HD1 TYR 5 HD1 TYR 5 -1.859 -2.566 -3.137 33 HD2 TYR 5 HD2 TYR 5 -0.430 -6.249 -1.556 34 HE1 TYR 5 HE1 TYR 5 -0.165 -2.667 -4.918 35 HE2 TYR 5 HE2 TYR 5 1.269 -6.359 -3.332 36 HH TYR 5 HH TYR 5 1.666 -3.724 -5.660 37 H THR 6 H THR 6 -4.175 -1.525 0.115 38 HA THR 6 HA THR 6 -5.340 -3.122 2.271 39 HB THR 6 HB THR 6 -5.693 -1.118 3.674 40 HG1 THR 6 HG1 THR 6 -4.619 0.795 3.147 41 HG21 THR 6 HG21 THR 6 -3.433 -0.950 4.539 42 HG22 THR 6 HG22 THR 6 -2.780 -1.585 3.029 43 HG23 THR 6 HG23 THR 6 -3.764 -2.616 4.066 44 H LEU 7 H LEU 7 -7.433 -1.722 3.032 45 HA LEU 7 HA LEU 7 -9.147 -1.759 0.745 46 HB2 LEU 7 HB1 LEU 7 -9.442 -1.423 3.659 47 HB3 LEU 7 HB2 LEU 7 -10.678 -0.648 2.671 48 HG LEU 7 HG LEU 7 -11.310 -2.904 3.479 49 HD11 LEU 7 HD11 LEU 7 -11.256 -2.051 0.667 50 HD12 LEU 7 HD12 LEU 7 -12.613 -2.524 1.688 51 HD13 LEU 7 HD13 LEU 7 -11.604 -3.759 0.935 52 HD21 LEU 7 HD21 LEU 7 -9.100 -3.836 1.650 53 HD22 LEU 7 HD22 LEU 7 -10.257 -4.865 2.494 54 HD23 LEU 7 HD23 LEU 7 -9.082 -3.921 3.411 55 H GLN 8 H GLN 8 -7.648 0.742 2.703 56 HA GLN 8 HA GLN 8 -9.027 2.837 1.212 57 HB2 GLN 8 HB1 GLN 8 -7.047 3.061 3.485 58 HB3 GLN 8 HB2 GLN 8 -7.977 4.383 2.793 59 HG2 GLN 8 HG1 GLN 8 -9.145 1.989 4.193 60 HG3 GLN 8 HG2 GLN 8 -8.902 3.577 4.917 61 HE21 GLN 8 HE21 GLN 8 -9.715 5.268 2.980 62 HE22 GLN 8 HE22 GLN 8 -11.391 5.035 2.636 63 H SER 9 H SER 9 -6.809 0.969 0.210 64 HA SER 9 HA SER 9 -5.068 1.087 -1.250 65 HB2 SER 9 HB1 SER 9 -6.584 2.713 -2.390 66 HB3 SER 9 HB2 SER 9 -5.802 4.015 -1.495 67 HG SER 9 HG SER 9 -4.759 2.373 -3.527 68 H CYS 10 H CYS 10 -3.458 0.668 0.254 69 HA CYS 10 HA CYS 10 -2.280 2.752 1.833 70 HB2 CYS 10 HB1 CYS 10 -2.371 0.294 2.453 71 HB3 CYS 10 HB2 CYS 10 -1.106 0.031 1.256 72 H PHE 11 H PHE 11 -0.146 3.567 1.649 73 HA PHE 11 HA PHE 11 0.711 3.857 -1.118 74 HB2 PHE 11 HB1 PHE 11 1.346 5.307 1.438 75 HB3 PHE 11 HB2 PHE 11 2.350 5.523 0.007 76 HD1 PHE 11 HD2 PHE 11 1.137 6.214 -2.162 77 HD2 PHE 11 HD1 PHE 11 -0.551 6.596 1.727 78 HE1 PHE 11 HE2 PHE 11 -0.440 7.900 -3.015 79 HE2 PHE 11 HE1 PHE 11 -2.131 8.280 0.879 80 HZ PHE 11 HZ PHE 11 -2.077 8.935 -1.494 81 HA PRO 12 HA PRO 12 4.191 1.193 -0.897 82 HB2 PRO 12 HB1 PRO 12 5.984 2.515 -2.448 83 HB3 PRO 12 HB2 PRO 12 4.568 1.689 -3.109 84 HG2 PRO 12 HG1 PRO 12 4.962 4.599 -2.524 85 HG3 PRO 12 HG2 PRO 12 4.209 3.833 -3.934 86 HD2 PRO 12 HD1 PRO 12 2.762 4.899 -1.908 87 HD3 PRO 12 HD2 PRO 12 2.210 3.491 -2.839 88 H ASP 13 H ASP 13 6.024 0.844 0.282 89 HA ASP 13 HA ASP 13 7.475 3.124 1.387 90 HB2 ASP 13 HB1 ASP 13 7.393 2.007 3.673 91 HB3 ASP 13 HB2 ASP 13 5.909 2.790 3.136 Start of MODEL 15 1 H1 GLY 1 H GLY 1 9.662 1.873 1.148 2 HA2 GLY 1 HA1 GLY 1 10.473 0.500 -0.582 3 HA3 GLY 1 HA2 GLY 1 10.302 -0.641 0.743 4 H ARG 2 H ARG 2 8.358 -1.917 0.859 5 HA ARG 2 HA ARG 2 7.376 -2.581 -1.802 6 HB2 ARG 2 HB1 ARG 2 7.384 -3.972 0.852 7 HB3 ARG 2 HB2 ARG 2 6.256 -4.484 -0.397 8 HG2 ARG 2 HG1 ARG 2 9.160 -4.223 -1.038 9 HG3 ARG 2 HG2 ARG 2 8.567 -5.643 -0.174 10 HD2 ARG 2 HD1 ARG 2 7.432 -4.665 -2.789 11 HD3 ARG 2 HD2 ARG 2 8.686 -5.899 -2.661 12 HE ARG 2 HE ARG 2 5.897 -6.259 -2.255 13 HH11 ARG 2 HH11 ARG 2 9.023 -7.323 -1.150 14 HH12 ARG 2 HH12 ARG 2 8.457 -8.877 -0.637 15 HH21 ARG 2 HH21 ARG 2 5.140 -8.303 -1.583 16 HH22 ARG 2 HH22 ARG 2 6.248 -9.435 -0.884 17 HA PRO 3 HA PRO 3 3.368 -0.852 -1.366 18 HB2 PRO 3 HB1 PRO 3 1.809 -2.720 -2.571 19 HB3 PRO 3 HB2 PRO 3 2.903 -1.659 -3.466 20 HG2 PRO 3 HG1 PRO 3 3.300 -4.498 -2.607 21 HG3 PRO 3 HG2 PRO 3 3.694 -3.733 -4.156 22 HD2 PRO 3 HD1 PRO 3 5.557 -4.202 -2.249 23 HD3 PRO 3 HD2 PRO 3 5.647 -2.812 -3.349 24 H CYS 4 H CYS 4 1.359 -1.006 -0.269 25 HA CYS 4 HA CYS 4 1.207 -3.219 1.674 26 HB2 CYS 4 HB1 CYS 4 0.041 -1.495 3.156 27 HB3 CYS 4 HB2 CYS 4 1.777 -1.308 2.939 28 H TYR 5 H TYR 5 -0.256 -4.473 0.567 29 HA TYR 5 HA TYR 5 -2.530 -3.559 -0.783 30 HB2 TYR 5 HB1 TYR 5 -2.287 -6.233 0.598 31 HB3 TYR 5 HB2 TYR 5 -3.264 -5.838 -0.812 32 HD1 TYR 5 HD1 TYR 5 -1.976 -5.074 -2.929 33 HD2 TYR 5 HD2 TYR 5 -0.165 -7.143 0.317 34 HE1 TYR 5 HE1 TYR 5 -0.133 -5.763 -4.404 35 HE2 TYR 5 HE2 TYR 5 1.684 -7.836 -1.148 36 HH TYR 5 HH TYR 5 1.671 -7.083 -4.604 37 H THR 6 H THR 6 -4.162 -2.450 0.046 38 HA THR 6 HA THR 6 -5.652 -3.452 2.281 39 HB THR 6 HB THR 6 -5.437 -1.016 3.357 40 HG1 THR 6 HG1 THR 6 -3.851 -0.103 2.188 41 HG21 THR 6 HG21 THR 6 -4.505 -2.097 5.109 42 HG22 THR 6 HG22 THR 6 -3.180 -2.741 4.139 43 HG23 THR 6 HG23 THR 6 -4.757 -3.529 4.112 44 H LEU 7 H LEU 7 -7.663 -2.346 2.588 45 HA LEU 7 HA LEU 7 -8.934 -1.550 0.254 46 HB2 LEU 7 HB1 LEU 7 -10.792 -0.934 1.608 47 HB3 LEU 7 HB2 LEU 7 -10.039 -2.356 2.327 48 HG LEU 7 HG LEU 7 -8.824 -0.492 3.786 49 HD11 LEU 7 HD11 LEU 7 -11.021 0.898 2.466 50 HD12 LEU 7 HD12 LEU 7 -9.632 1.541 3.341 51 HD13 LEU 7 HD13 LEU 7 -11.066 1.020 4.225 52 HD21 LEU 7 HD21 LEU 7 -10.135 -1.206 5.510 53 HD22 LEU 7 HD22 LEU 7 -10.543 -2.432 4.310 54 HD23 LEU 7 HD23 LEU 7 -11.628 -1.068 4.581 55 H GLN 8 H GLN 8 -7.276 0.368 2.682 56 HA GLN 8 HA GLN 8 -8.166 2.902 1.774 57 HB2 GLN 8 HB1 GLN 8 -5.654 2.188 3.297 58 HB3 GLN 8 HB2 GLN 8 -6.319 3.805 3.121 59 HG2 GLN 8 HG1 GLN 8 -8.284 3.182 4.369 60 HG3 GLN 8 HG2 GLN 8 -7.731 1.511 4.461 61 HE21 GLN 8 HE21 GLN 8 -7.240 4.762 5.599 62 HE22 GLN 8 HE22 GLN 8 -6.252 4.352 6.956 63 H SER 9 H SER 9 -5.741 0.701 0.682 64 HA SER 9 HA SER 9 -4.346 0.725 -1.117 65 HB2 SER 9 HB1 SER 9 -6.490 1.858 -2.111 66 HB3 SER 9 HB2 SER 9 -5.508 3.323 -2.064 67 HG SER 9 HG SER 9 -4.564 0.936 -3.243 68 H CYS 10 H CYS 10 -3.339 1.720 1.225 69 HA CYS 10 HA CYS 10 -2.192 4.275 1.096 70 HB2 CYS 10 HB1 CYS 10 -0.552 3.352 2.774 71 HB3 CYS 10 HB2 CYS 10 -2.248 3.144 3.200 72 H PHE 11 H PHE 11 -0.040 4.927 0.636 73 HA PHE 11 HA PHE 11 1.004 3.830 -1.761 74 HB2 PHE 11 HB1 PHE 11 1.972 5.941 0.152 75 HB3 PHE 11 HB2 PHE 11 2.950 5.438 -1.223 76 HD1 PHE 11 HD1 PHE 11 -0.571 6.456 -0.514 77 HD2 PHE 11 HD2 PHE 11 2.779 6.693 -3.128 78 HE1 PHE 11 HE1 PHE 11 -1.813 8.014 -1.959 79 HE2 PHE 11 HE2 PHE 11 1.543 8.250 -4.577 80 HZ PHE 11 HZ PHE 11 -0.756 8.912 -3.994 81 HA PRO 12 HA PRO 12 3.862 0.806 -0.369 82 HB2 PRO 12 HB1 PRO 12 5.894 1.117 -2.144 83 HB3 PRO 12 HB2 PRO 12 4.338 0.401 -2.580 84 HG2 PRO 12 HG1 PRO 12 5.327 3.192 -3.016 85 HG3 PRO 12 HG2 PRO 12 4.434 2.136 -4.125 86 HD2 PRO 12 HD1 PRO 12 3.237 4.111 -2.712 87 HD3 PRO 12 HD2 PRO 12 2.406 2.600 -3.133 88 H ASP 13 H ASP 13 5.649 0.527 0.926 89 HA ASP 13 HA ASP 13 7.372 2.856 1.403 90 HB2 ASP 13 HB1 ASP 13 7.286 2.239 3.875 91 HB3 ASP 13 HB2 ASP 13 5.848 3.009 3.208 Start of MODEL 16 1 H1 GLY 1 H GLY 1 9.707 1.755 1.337 2 HA2 GLY 1 HA1 GLY 1 10.471 0.504 -0.584 3 HA3 GLY 1 HA2 GLY 1 10.301 -0.637 0.742 4 H ARG 2 H ARG 2 8.357 -1.914 0.860 5 HA ARG 2 HA ARG 2 7.375 -2.581 -1.802 6 HB2 ARG 2 HB1 ARG 2 7.383 -3.969 0.855 7 HB3 ARG 2 HB2 ARG 2 6.258 -4.484 -0.396 8 HG2 ARG 2 HG1 ARG 2 8.359 -4.607 -1.899 9 HG3 ARG 2 HG2 ARG 2 9.242 -4.614 -0.372 10 HD2 ARG 2 HD1 ARG 2 7.058 -6.550 -1.135 11 HD3 ARG 2 HD2 ARG 2 8.787 -6.884 -1.215 12 HE ARG 2 HE ARG 2 7.884 -6.047 1.384 13 HH11 ARG 2 HH11 ARG 2 8.324 -8.749 -0.766 14 HH12 ARG 2 HH12 ARG 2 8.408 -9.917 0.510 15 HH21 ARG 2 HH21 ARG 2 7.994 -7.575 3.073 16 HH22 ARG 2 HH22 ARG 2 8.219 -9.249 2.693 17 HA PRO 3 HA PRO 3 3.366 -0.853 -1.367 18 HB2 PRO 3 HB1 PRO 3 1.809 -2.722 -2.572 19 HB3 PRO 3 HB2 PRO 3 2.902 -1.661 -3.467 20 HG2 PRO 3 HG1 PRO 3 3.301 -4.500 -2.607 21 HG3 PRO 3 HG2 PRO 3 3.696 -3.735 -4.157 22 HD2 PRO 3 HD1 PRO 3 5.558 -4.203 -2.248 23 HD3 PRO 3 HD2 PRO 3 5.648 -2.813 -3.349 24 H CYS 4 H CYS 4 1.359 -1.007 -0.268 25 HA CYS 4 HA CYS 4 1.206 -3.220 1.673 26 HB2 CYS 4 HB1 CYS 4 0.041 -1.496 3.156 27 HB3 CYS 4 HB2 CYS 4 1.777 -1.309 2.938 28 H TYR 5 H TYR 5 -0.256 -4.474 0.565 29 HA TYR 5 HA TYR 5 -2.531 -3.559 -0.784 30 HB2 TYR 5 HB1 TYR 5 -2.257 -6.233 0.596 31 HB3 TYR 5 HB2 TYR 5 -3.279 -5.844 -0.783 32 HD1 TYR 5 HD1 TYR 5 -2.156 -5.230 -2.976 33 HD2 TYR 5 HD2 TYR 5 -0.045 -6.966 0.285 34 HE1 TYR 5 HE1 TYR 5 -0.353 -5.903 -4.509 35 HE2 TYR 5 HE2 TYR 5 1.763 -7.643 -1.238 36 HH TYR 5 HH TYR 5 1.487 -7.837 -4.447 37 H THR 6 H THR 6 -4.163 -2.448 0.046 38 HA THR 6 HA THR 6 -5.653 -3.452 2.282 39 HB THR 6 HB THR 6 -5.436 -1.015 3.356 40 HG1 THR 6 HG1 THR 6 -3.819 -0.373 1.823 41 HG21 THR 6 HG21 THR 6 -4.717 -2.229 5.084 42 HG22 THR 6 HG22 THR 6 -3.174 -2.539 4.289 43 HG23 THR 6 HG23 THR 6 -4.552 -3.598 3.985 44 H LEU 7 H LEU 7 -7.663 -2.346 2.589 45 HA LEU 7 HA LEU 7 -8.934 -1.550 0.255 46 HB2 LEU 7 HB1 LEU 7 -9.573 -1.275 3.156 47 HB3 LEU 7 HB2 LEU 7 -10.590 -0.463 1.969 48 HG LEU 7 HG LEU 7 -10.054 -3.430 1.990 49 HD11 LEU 7 HD11 LEU 7 -11.271 -2.615 4.013 50 HD12 LEU 7 HD12 LEU 7 -12.192 -3.728 3.002 51 HD13 LEU 7 HD13 LEU 7 -12.528 -1.999 2.940 52 HD21 LEU 7 HD21 LEU 7 -10.757 -3.066 -0.139 53 HD22 LEU 7 HD22 LEU 7 -11.605 -1.576 0.275 54 HD23 LEU 7 HD23 LEU 7 -12.334 -3.139 0.647 55 H GLN 8 H GLN 8 -7.276 0.369 2.683 56 HA GLN 8 HA GLN 8 -8.165 2.903 1.772 57 HB2 GLN 8 HB1 GLN 8 -5.816 2.022 3.439 58 HB3 GLN 8 HB2 GLN 8 -6.082 3.710 3.024 59 HG2 GLN 8 HG1 GLN 8 -8.246 3.659 4.133 60 HG3 GLN 8 HG2 GLN 8 -8.015 1.955 4.522 61 HE21 GLN 8 HE21 GLN 8 -8.292 4.511 6.131 62 HE22 GLN 8 HE22 GLN 8 -6.982 4.438 7.256 63 H SER 9 H SER 9 -5.740 0.701 0.683 64 HA SER 9 HA SER 9 -4.346 0.723 -1.116 65 HB2 SER 9 HB1 SER 9 -6.505 1.906 -2.080 66 HB3 SER 9 HB2 SER 9 -5.455 3.322 -2.097 67 HG SER 9 HG SER 9 -4.544 2.536 -3.806 68 H CYS 10 H CYS 10 -3.338 1.719 1.225 69 HA CYS 10 HA CYS 10 -2.190 4.274 1.096 70 HB2 CYS 10 HB1 CYS 10 -0.551 3.351 2.774 71 HB3 CYS 10 HB2 CYS 10 -2.246 3.144 3.200 72 H PHE 11 H PHE 11 -0.039 4.926 0.635 73 HA PHE 11 HA PHE 11 1.005 3.828 -1.761 74 HB2 PHE 11 HB1 PHE 11 1.946 5.952 0.147 75 HB3 PHE 11 HB2 PHE 11 2.961 5.432 -1.194 76 HD1 PHE 11 HD1 PHE 11 -0.184 7.081 -0.269 77 HD2 PHE 11 HD2 PHE 11 2.447 6.036 -3.446 78 HE1 PHE 11 HE1 PHE 11 -1.387 8.620 -1.766 79 HE2 PHE 11 HE2 PHE 11 1.249 7.572 -4.949 80 HZ PHE 11 HZ PHE 11 -0.669 8.868 -4.110 81 HA PRO 12 HA PRO 12 3.863 0.804 -0.370 82 HB2 PRO 12 HB1 PRO 12 5.895 1.115 -2.144 83 HB3 PRO 12 HB2 PRO 12 4.339 0.399 -2.581 84 HG2 PRO 12 HG1 PRO 12 5.329 3.190 -3.016 85 HG3 PRO 12 HG2 PRO 12 4.435 2.134 -4.125 86 HD2 PRO 12 HD1 PRO 12 3.238 4.109 -2.712 87 HD3 PRO 12 HD2 PRO 12 2.407 2.598 -3.133 88 H ASP 13 H ASP 13 5.645 0.526 0.931 89 HA ASP 13 HA ASP 13 7.368 2.856 1.409 90 HB2 ASP 13 HB1 ASP 13 5.581 2.743 3.151 91 HB3 ASP 13 HB2 ASP 13 6.182 1.152 3.608 Start of MODEL 17 1 H1 GLY 1 H GLY 1 9.696 1.585 1.538 2 HA2 GLY 1 HA1 GLY 1 10.475 0.497 -0.585 3 HA3 GLY 1 HA2 GLY 1 10.305 -0.640 0.745 4 H ARG 2 H ARG 2 8.360 -1.915 0.866 5 HA ARG 2 HA ARG 2 7.379 -2.590 -1.792 6 HB2 ARG 2 HB1 ARG 2 7.370 -3.968 0.870 7 HB3 ARG 2 HB2 ARG 2 6.265 -4.492 -0.393 8 HG2 ARG 2 HG1 ARG 2 9.185 -4.224 -0.965 9 HG3 ARG 2 HG2 ARG 2 8.559 -5.654 -0.143 10 HD2 ARG 2 HD1 ARG 2 7.159 -6.201 -1.982 11 HD3 ARG 2 HD2 ARG 2 7.448 -4.640 -2.748 12 HE ARG 2 HE ARG 2 9.343 -5.508 -3.673 13 HH11 ARG 2 HH11 ARG 2 8.437 -7.470 -0.943 14 HH12 ARG 2 HH12 ARG 2 9.660 -8.662 -1.227 15 HH21 ARG 2 HH21 ARG 2 10.958 -7.071 -4.058 16 HH22 ARG 2 HH22 ARG 2 11.095 -8.434 -2.999 17 HA PRO 3 HA PRO 3 3.373 -0.854 -1.364 18 HB2 PRO 3 HB1 PRO 3 1.815 -2.720 -2.572 19 HB3 PRO 3 HB2 PRO 3 2.911 -1.660 -3.464 20 HG2 PRO 3 HG1 PRO 3 3.305 -4.500 -2.604 21 HG3 PRO 3 HG2 PRO 3 3.703 -3.735 -4.154 22 HD2 PRO 3 HD1 PRO 3 5.561 -4.206 -2.242 23 HD3 PRO 3 HD2 PRO 3 5.654 -2.815 -3.342 24 H CYS 4 H CYS 4 1.362 -1.006 -0.269 25 HA CYS 4 HA CYS 4 1.204 -3.219 1.671 26 HB2 CYS 4 HB1 CYS 4 0.039 -1.496 3.154 27 HB3 CYS 4 HB2 CYS 4 1.776 -1.309 2.938 28 H TYR 5 H TYR 5 -0.259 -4.472 0.563 29 HA TYR 5 HA TYR 5 -2.531 -3.551 -0.788 30 HB2 TYR 5 HB1 TYR 5 -2.079 -6.227 0.548 31 HB3 TYR 5 HB2 TYR 5 -3.338 -5.879 -0.632 32 HD1 TYR 5 HD2 TYR 5 0.274 -6.349 -0.137 33 HD2 TYR 5 HD1 TYR 5 -2.827 -5.708 -2.979 34 HE1 TYR 5 HE2 TYR 5 1.825 -6.935 -1.953 35 HE2 TYR 5 HE1 TYR 5 -1.284 -6.294 -4.803 36 HH TYR 5 HH TYR 5 1.322 -7.931 -4.553 37 H THR 6 H THR 6 -4.163 -2.443 0.044 38 HA THR 6 HA THR 6 -5.654 -3.455 2.275 39 HB THR 6 HB THR 6 -5.440 -1.023 3.359 40 HG1 THR 6 HG1 THR 6 -3.861 -0.120 2.156 41 HG21 THR 6 HG21 THR 6 -3.271 -3.003 3.971 42 HG22 THR 6 HG22 THR 6 -4.961 -3.388 4.295 43 HG23 THR 6 HG23 THR 6 -4.207 -2.000 5.079 44 H LEU 7 H LEU 7 -7.664 -2.348 2.588 45 HA LEU 7 HA LEU 7 -8.936 -1.549 0.256 46 HB2 LEU 7 HB1 LEU 7 -9.580 -1.232 3.158 47 HB3 LEU 7 HB2 LEU 7 -10.612 -0.488 1.939 48 HG LEU 7 HG LEU 7 -10.905 -2.779 0.941 49 HD11 LEU 7 HD11 LEU 7 -9.269 -4.177 1.673 50 HD12 LEU 7 HD12 LEU 7 -10.508 -4.550 2.872 51 HD13 LEU 7 HD13 LEU 7 -9.198 -3.440 3.274 52 HD21 LEU 7 HD21 LEU 7 -12.348 -3.545 2.970 53 HD22 LEU 7 HD22 LEU 7 -12.755 -2.058 2.113 54 HD23 LEU 7 HD23 LEU 7 -11.887 -1.983 3.647 55 H GLN 8 H GLN 8 -7.278 0.367 2.685 56 HA GLN 8 HA GLN 8 -8.166 2.902 1.778 57 HB2 GLN 8 HB1 GLN 8 -5.768 2.059 3.402 58 HB3 GLN 8 HB2 GLN 8 -6.146 3.741 3.053 59 HG2 GLN 8 HG1 GLN 8 -7.855 1.798 4.587 60 HG3 GLN 8 HG2 GLN 8 -6.940 3.152 5.247 61 HE21 GLN 8 HE21 GLN 8 -7.703 5.232 4.987 62 HE22 GLN 8 HE22 GLN 8 -9.309 5.575 4.450 63 H SER 9 H SER 9 -5.743 0.701 0.684 64 HA SER 9 HA SER 9 -4.349 0.725 -1.116 65 HB2 SER 9 HB1 SER 9 -6.502 1.887 -2.090 66 HB3 SER 9 HB2 SER 9 -5.482 3.324 -2.079 67 HG SER 9 HG SER 9 -4.724 2.574 -3.882 68 H CYS 10 H CYS 10 -3.340 1.718 1.227 69 HA CYS 10 HA CYS 10 -2.192 4.273 1.099 70 HB2 CYS 10 HB1 CYS 10 -0.551 3.348 2.774 71 HB3 CYS 10 HB2 CYS 10 -2.246 3.141 3.202 72 H PHE 11 H PHE 11 -0.041 4.926 0.636 73 HA PHE 11 HA PHE 11 1.001 3.829 -1.761 74 HB2 PHE 11 HB1 PHE 11 1.909 5.968 0.140 75 HB3 PHE 11 HB2 PHE 11 2.968 5.431 -1.160 76 HD1 PHE 11 HD2 PHE 11 2.312 5.762 -3.508 77 HD2 PHE 11 HD1 PHE 11 0.004 7.324 -0.291 78 HE1 PHE 11 HE2 PHE 11 1.160 7.274 -5.072 79 HE2 PHE 11 HE1 PHE 11 -1.151 8.837 -1.849 80 HZ PHE 11 HZ PHE 11 -0.575 8.813 -4.243 81 HA PRO 12 HA PRO 12 3.862 0.808 -0.370 82 HB2 PRO 12 HB1 PRO 12 5.893 1.118 -2.146 83 HB3 PRO 12 HB2 PRO 12 4.337 0.401 -2.582 84 HG2 PRO 12 HG1 PRO 12 5.324 3.193 -3.020 85 HG3 PRO 12 HG2 PRO 12 4.430 2.136 -4.127 86 HD2 PRO 12 HD1 PRO 12 3.233 4.111 -2.714 87 HD3 PRO 12 HD2 PRO 12 2.402 2.599 -3.133 88 H ASP 13 H ASP 13 5.652 0.529 0.921 89 HA ASP 13 HA ASP 13 7.374 2.859 1.397 90 HB2 ASP 13 HB1 ASP 13 5.826 1.288 3.446 91 HB3 ASP 13 HB2 ASP 13 7.288 2.171 3.879 Start of MODEL 18 1 H1 GLY 1 H GLY 1 9.287 2.011 0.289 2 HA2 GLY 1 HA1 GLY 1 9.955 0.314 -1.352 3 HA3 GLY 1 HA2 GLY 1 10.337 -0.250 0.268 4 H ARG 2 H ARG 2 8.255 -1.276 1.352 5 HA ARG 2 HA ARG 2 7.625 -3.555 -0.277 6 HB2 ARG 2 HB1 ARG 2 6.419 -2.914 2.408 7 HB3 ARG 2 HB2 ARG 2 6.651 -4.492 1.671 8 HG2 ARG 2 HG1 ARG 2 9.161 -3.952 1.803 9 HG3 ARG 2 HG2 ARG 2 8.675 -2.695 2.942 10 HD2 ARG 2 HD1 ARG 2 8.050 -5.635 3.191 11 HD3 ARG 2 HD2 ARG 2 9.306 -4.775 4.081 12 HE ARG 2 HE ARG 2 6.899 -3.462 4.553 13 HH11 ARG 2 HH11 ARG 2 8.342 -6.569 5.172 14 HH12 ARG 2 HH12 ARG 2 7.439 -6.844 6.625 15 HH21 ARG 2 HH21 ARG 2 5.705 -3.812 6.465 16 HH22 ARG 2 HH22 ARG 2 5.940 -5.276 7.359 17 HA PRO 3 HA PRO 3 3.736 -2.340 -1.910 18 HB2 PRO 3 HB1 PRO 3 2.421 -4.715 -1.948 19 HB3 PRO 3 HB2 PRO 3 3.737 -4.327 -3.063 20 HG2 PRO 3 HG1 PRO 3 3.803 -5.940 -0.543 21 HG3 PRO 3 HG2 PRO 3 4.578 -6.270 -2.104 22 HD2 PRO 3 HD1 PRO 3 5.926 -5.229 0.001 23 HD3 PRO 3 HD2 PRO 3 6.328 -4.830 -1.682 24 H CYS 4 H CYS 4 1.688 -1.728 -1.300 25 HA CYS 4 HA CYS 4 0.861 -2.471 1.430 26 HB2 CYS 4 HB1 CYS 4 1.602 -0.135 1.317 27 HB3 CYS 4 HB2 CYS 4 0.460 0.172 0.012 28 H TYR 5 H TYR 5 -0.580 -4.069 0.924 29 HA TYR 5 HA TYR 5 -2.724 -3.443 -0.978 30 HB2 TYR 5 HB1 TYR 5 -2.062 -6.093 0.318 31 HB3 TYR 5 HB2 TYR 5 -3.210 -5.822 -0.988 32 HD1 TYR 5 HD1 TYR 5 -1.947 -4.320 -2.976 33 HD2 TYR 5 HD2 TYR 5 -0.164 -7.184 -0.383 34 HE1 TYR 5 HE1 TYR 5 -0.162 -4.695 -4.627 35 HE2 TYR 5 HE2 TYR 5 1.626 -7.567 -2.027 36 HH TYR 5 HH TYR 5 1.612 -7.120 -4.898 37 H THR 6 H THR 6 -4.370 -2.419 -0.038 38 HA THR 6 HA THR 6 -5.818 -3.712 2.087 39 HB THR 6 HB THR 6 -5.819 -1.386 3.357 40 HG1 THR 6 HG1 THR 6 -4.167 -0.692 1.655 41 HG21 THR 6 HG21 THR 6 -4.381 -2.323 4.964 42 HG22 THR 6 HG22 THR 6 -3.448 -3.193 3.744 43 HG23 THR 6 HG23 THR 6 -5.087 -3.711 4.137 44 H LEU 7 H LEU 7 -7.702 -2.143 2.789 45 HA LEU 7 HA LEU 7 -9.235 -1.641 0.480 46 HB2 LEU 7 HB1 LEU 7 -9.554 -1.198 3.393 47 HB3 LEU 7 HB2 LEU 7 -10.605 -0.278 2.318 48 HG LEU 7 HG LEU 7 -11.160 -2.596 1.289 49 HD11 LEU 7 HD11 LEU 7 -9.283 -3.444 3.093 50 HD12 LEU 7 HD12 LEU 7 -10.503 -4.460 2.327 51 HD13 LEU 7 HD13 LEU 7 -10.798 -3.783 3.929 52 HD21 LEU 7 HD21 LEU 7 -12.228 -2.240 4.055 53 HD22 LEU 7 HD22 LEU 7 -13.075 -2.662 2.567 54 HD23 LEU 7 HD23 LEU 7 -12.534 -1.004 2.834 55 H GLN 8 H GLN 8 -7.308 0.444 2.553 56 HA GLN 8 HA GLN 8 -8.164 2.839 1.158 57 HB2 GLN 8 HB1 GLN 8 -6.127 2.408 3.347 58 HB3 GLN 8 HB2 GLN 8 -6.547 3.979 2.679 59 HG2 GLN 8 HG1 GLN 8 -8.738 3.872 3.542 60 HG3 GLN 8 HG2 GLN 8 -8.582 2.158 3.923 61 HE21 GLN 8 HE21 GLN 8 -9.236 4.524 5.592 62 HE22 GLN 8 HE22 GLN 8 -8.113 4.473 6.903 63 H SER 9 H SER 9 -5.577 0.549 1.055 64 HA SER 9 HA SER 9 -3.744 0.331 -0.274 65 HB2 SER 9 HB1 SER 9 -4.834 2.417 -2.135 66 HB3 SER 9 HB2 SER 9 -3.980 0.922 -2.515 67 HG SER 9 HG SER 9 -5.797 -0.208 -2.257 68 H CYS 10 H CYS 10 -2.849 1.600 1.673 69 HA CYS 10 HA CYS 10 -2.176 4.314 1.456 70 HB2 CYS 10 HB1 CYS 10 -0.764 3.979 3.312 71 HB3 CYS 10 HB2 CYS 10 -2.046 2.790 3.513 72 H PHE 11 H PHE 11 -0.188 5.327 0.938 73 HA PHE 11 HA PHE 11 0.946 4.631 -1.478 74 HB2 PHE 11 HB1 PHE 11 1.776 6.425 0.757 75 HB3 PHE 11 HB2 PHE 11 2.948 6.082 -0.512 76 HD1 PHE 11 HD1 PHE 11 -0.713 6.817 -0.417 77 HD2 PHE 11 HD2 PHE 11 3.101 7.765 -2.051 78 HE1 PHE 11 HE1 PHE 11 -1.753 8.540 -1.833 79 HE2 PHE 11 HE2 PHE 11 2.068 9.489 -3.470 80 HZ PHE 11 HZ PHE 11 -0.362 9.878 -3.363 81 HA PRO 12 HA PRO 12 3.858 1.427 -0.763 82 HB2 PRO 12 HB1 PRO 12 5.825 2.084 -2.514 83 HB3 PRO 12 HB2 PRO 12 4.259 1.444 -3.026 84 HG2 PRO 12 HG1 PRO 12 5.219 4.278 -2.968 85 HG3 PRO 12 HG2 PRO 12 4.293 3.436 -4.223 86 HD2 PRO 12 HD1 PRO 12 3.135 5.101 -2.430 87 HD3 PRO 12 HD2 PRO 12 2.298 3.685 -3.095 88 H ASP 13 H ASP 13 5.620 0.946 0.475 89 HA ASP 13 HA ASP 13 7.383 3.154 1.283 90 HB2 ASP 13 HB1 ASP 13 5.763 1.345 3.029 91 HB3 ASP 13 HB2 ASP 13 7.334 1.900 3.601 Start of MODEL 19 1 H1 GLY 1 H GLY 1 9.496 2.006 0.875 2 HA2 GLY 1 HA1 GLY 1 10.455 0.527 -0.608 3 HA3 GLY 1 HA2 GLY 1 10.304 -0.609 0.723 4 H ARG 2 H ARG 2 8.358 -1.891 0.865 5 HA ARG 2 HA ARG 2 7.376 -2.591 -1.787 6 HB2 ARG 2 HB1 ARG 2 7.351 -3.948 0.890 7 HB3 ARG 2 HB2 ARG 2 6.281 -4.494 -0.394 8 HG2 ARG 2 HG1 ARG 2 8.363 -4.679 -1.840 9 HG3 ARG 2 HG2 ARG 2 9.279 -4.495 -0.342 10 HD2 ARG 2 HD1 ARG 2 7.617 -6.410 0.450 11 HD3 ARG 2 HD2 ARG 2 7.586 -6.747 -1.279 12 HE ARG 2 HE ARG 2 9.663 -7.649 -1.064 13 HH11 ARG 2 HH11 ARG 2 9.151 -5.434 1.572 14 HH12 ARG 2 HH12 ARG 2 10.658 -5.800 2.344 15 HH21 ARG 2 HH21 ARG 2 11.651 -8.139 -0.057 16 HH22 ARG 2 HH22 ARG 2 12.079 -7.337 1.416 17 HA PRO 3 HA PRO 3 3.367 -0.859 -1.366 18 HB2 PRO 3 HB1 PRO 3 1.816 -2.732 -2.574 19 HB3 PRO 3 HB2 PRO 3 2.910 -1.669 -3.467 20 HG2 PRO 3 HG1 PRO 3 3.312 -4.508 -2.602 21 HG3 PRO 3 HG2 PRO 3 3.709 -3.744 -4.152 22 HD2 PRO 3 HD1 PRO 3 5.566 -4.206 -2.236 23 HD3 PRO 3 HD2 PRO 3 5.657 -2.817 -3.339 24 H CYS 4 H CYS 4 1.361 -1.011 -0.268 25 HA CYS 4 HA CYS 4 1.202 -3.226 1.670 26 HB2 CYS 4 HB1 CYS 4 0.037 -1.503 3.155 27 HB3 CYS 4 HB2 CYS 4 1.775 -1.319 2.940 28 H TYR 5 H TYR 5 -0.261 -4.477 0.561 29 HA TYR 5 HA TYR 5 -2.533 -3.554 -0.789 30 HB2 TYR 5 HB1 TYR 5 -2.291 -6.233 0.583 31 HB3 TYR 5 HB2 TYR 5 -3.272 -5.832 -0.822 32 HD1 TYR 5 HD1 TYR 5 -2.093 -5.237 -2.985 33 HD2 TYR 5 HD2 TYR 5 -0.070 -6.966 0.334 34 HE1 TYR 5 HE1 TYR 5 -0.256 -5.922 -4.470 35 HE2 TYR 5 HE2 TYR 5 1.774 -7.655 -1.141 36 HH TYR 5 HH TYR 5 2.739 -7.032 -3.294 37 H THR 6 H THR 6 -4.165 -2.445 0.043 38 HA THR 6 HA THR 6 -5.656 -3.454 2.275 39 HB THR 6 HB THR 6 -5.440 -1.020 3.357 40 HG1 THR 6 HG1 THR 6 -3.780 -0.009 2.532 41 HG21 THR 6 HG21 THR 6 -4.916 -3.435 4.240 42 HG22 THR 6 HG22 THR 6 -4.298 -2.022 5.093 43 HG23 THR 6 HG23 THR 6 -3.242 -2.933 4.014 44 H LEU 7 H LEU 7 -7.665 -2.342 2.589 45 HA LEU 7 HA LEU 7 -8.938 -1.543 0.256 46 HB2 LEU 7 HB1 LEU 7 -9.580 -1.222 3.160 47 HB3 LEU 7 HB2 LEU 7 -10.612 -0.480 1.938 48 HG LEU 7 HG LEU 7 -10.660 -2.919 0.958 49 HD11 LEU 7 HD11 LEU 7 -9.499 -4.367 2.193 50 HD12 LEU 7 HD12 LEU 7 -10.817 -4.245 3.357 51 HD13 LEU 7 HD13 LEU 7 -9.377 -3.247 3.550 52 HD21 LEU 7 HD21 LEU 7 -12.746 -3.202 1.939 53 HD22 LEU 7 HD22 LEU 7 -12.498 -1.457 2.026 54 HD23 LEU 7 HD23 LEU 7 -12.244 -2.457 3.457 55 H GLN 8 H GLN 8 -7.275 0.372 2.685 56 HA GLN 8 HA GLN 8 -8.160 2.907 1.774 57 HB2 GLN 8 HB1 GLN 8 -5.664 2.172 3.312 58 HB3 GLN 8 HB2 GLN 8 -6.290 3.802 3.112 59 HG2 GLN 8 HG1 GLN 8 -7.143 3.324 5.156 60 HG3 GLN 8 HG2 GLN 8 -8.459 2.720 4.151 61 HE21 GLN 8 HE21 GLN 8 -9.045 1.379 5.929 62 HE22 GLN 8 HE22 GLN 8 -8.198 -0.095 6.230 63 H SER 9 H SER 9 -5.740 0.702 0.684 64 HA SER 9 HA SER 9 -4.344 0.723 -1.114 65 HB2 SER 9 HB1 SER 9 -6.507 1.921 -2.070 66 HB3 SER 9 HB2 SER 9 -5.437 3.324 -2.103 67 HG SER 9 HG SER 9 -5.386 1.009 -3.627 68 H CYS 10 H CYS 10 -3.335 1.717 1.227 69 HA CYS 10 HA CYS 10 -2.185 4.270 1.098 70 HB2 CYS 10 HB1 CYS 10 -0.544 3.344 2.775 71 HB3 CYS 10 HB2 CYS 10 -2.241 3.139 3.202 72 H PHE 11 H PHE 11 -0.033 4.920 0.636 73 HA PHE 11 HA PHE 11 1.010 3.820 -1.761 74 HB2 PHE 11 HB1 PHE 11 1.860 5.985 0.123 75 HB3 PHE 11 HB2 PHE 11 2.995 5.417 -1.096 76 HD1 PHE 11 HD1 PHE 11 -0.669 6.129 -1.091 77 HD2 PHE 11 HD2 PHE 11 3.132 6.877 -2.852 78 HE1 PHE 11 HE1 PHE 11 -1.734 7.594 -2.756 79 HE2 PHE 11 HE2 PHE 11 2.074 8.344 -4.521 80 HZ PHE 11 HZ PHE 11 -0.362 8.705 -4.473 81 HA PRO 12 HA PRO 12 3.868 0.798 -0.368 82 HB2 PRO 12 HB1 PRO 12 5.900 1.106 -2.142 83 HB3 PRO 12 HB2 PRO 12 4.343 0.390 -2.579 84 HG2 PRO 12 HG1 PRO 12 5.333 3.181 -3.016 85 HG3 PRO 12 HG2 PRO 12 4.439 2.125 -4.125 86 HD2 PRO 12 HD1 PRO 12 3.243 4.101 -2.712 87 HD3 PRO 12 HD2 PRO 12 2.411 2.589 -3.132 88 H ASP 13 H ASP 13 5.630 0.526 0.951 89 HA ASP 13 HA ASP 13 7.347 2.863 1.432 90 HB2 ASP 13 HB1 ASP 13 5.729 2.887 3.220 91 HB3 ASP 13 HB2 ASP 13 5.973 1.169 3.524 Start of MODEL 20 1 H1 GLY 1 H GLY 1 9.393 2.231 0.476 2 HA2 GLY 1 HA1 GLY 1 10.603 0.625 -0.675 3 HA3 GLY 1 HA2 GLY 1 10.489 -0.198 0.874 4 H ARG 2 H ARG 2 8.578 -1.587 1.210 5 HA ARG 2 HA ARG 2 8.044 -3.099 -1.222 6 HB2 ARG 2 HB1 ARG 2 7.489 -3.697 1.687 7 HB3 ARG 2 HB2 ARG 2 7.067 -4.774 0.362 8 HG2 ARG 2 HG1 ARG 2 9.351 -5.131 -0.183 9 HG3 ARG 2 HG2 ARG 2 9.875 -3.847 0.907 10 HD2 ARG 2 HD1 ARG 2 9.238 -5.113 2.824 11 HD3 ARG 2 HD2 ARG 2 8.420 -6.316 1.829 12 HE ARG 2 HE ARG 2 10.975 -6.423 0.950 13 HH11 ARG 2 HH11 ARG 2 9.521 -6.603 4.109 14 HH12 ARG 2 HH12 ARG 2 10.753 -7.633 4.760 15 HH21 ARG 2 HH21 ARG 2 12.601 -7.780 1.796 16 HH22 ARG 2 HH22 ARG 2 12.504 -8.302 3.444 17 HA PRO 3 HA PRO 3 3.914 -1.727 -1.791 18 HB2 PRO 3 HB1 PRO 3 2.733 -3.984 -2.731 19 HB3 PRO 3 HB2 PRO 3 3.871 -3.025 -3.686 20 HG2 PRO 3 HG1 PRO 3 4.349 -5.539 -2.134 21 HG3 PRO 3 HG2 PRO 3 4.930 -5.093 -3.748 22 HD2 PRO 3 HD1 PRO 3 6.483 -4.910 -1.537 23 HD3 PRO 3 HD2 PRO 3 6.641 -3.796 -2.910 24 H CYS 4 H CYS 4 1.841 -1.763 -0.896 25 HA CYS 4 HA CYS 4 1.489 -3.585 1.395 26 HB2 CYS 4 HB1 CYS 4 0.097 -1.684 2.374 27 HB3 CYS 4 HB2 CYS 4 1.841 -1.442 2.332 28 H TYR 5 H TYR 5 -0.656 -4.241 1.888 29 HA TYR 5 HA TYR 5 -2.505 -4.021 -0.397 30 HB2 TYR 5 HB1 TYR 5 -2.414 -6.313 1.564 31 HB3 TYR 5 HB2 TYR 5 -3.260 -6.242 0.022 32 HD1 TYR 5 HD1 TYR 5 -1.544 -5.622 -2.012 33 HD2 TYR 5 HD2 TYR 5 -0.536 -7.636 1.598 34 HE1 TYR 5 HE1 TYR 5 0.399 -6.637 -3.127 35 HE2 TYR 5 HE2 TYR 5 1.411 -8.656 0.493 36 HH TYR 5 HH TYR 5 1.868 -9.140 -2.348 37 H THR 6 H THR 6 -4.082 -2.651 0.104 38 HA THR 6 HA THR 6 -5.782 -3.156 2.357 39 HB THR 6 HB THR 6 -5.489 -0.576 2.994 40 HG1 THR 6 HG1 THR 6 -3.628 -0.599 1.399 41 HG21 THR 6 HG21 THR 6 -3.401 -2.019 4.364 42 HG22 THR 6 HG22 THR 6 -4.822 -3.040 4.144 43 HG23 THR 6 HG23 THR 6 -4.971 -1.486 4.964 44 H LEU 7 H LEU 7 -7.791 -2.171 2.167 45 HA LEU 7 HA LEU 7 -8.402 -1.167 -0.480 46 HB2 LEU 7 HB1 LEU 7 -10.036 -1.988 1.894 47 HB3 LEU 7 HB2 LEU 7 -10.771 -1.120 0.547 48 HG LEU 7 HG LEU 7 -9.318 -3.743 0.247 49 HD11 LEU 7 HD11 LEU 7 -11.255 -4.029 1.706 50 HD12 LEU 7 HD12 LEU 7 -11.516 -4.786 0.135 51 HD13 LEU 7 HD13 LEU 7 -12.280 -3.240 0.506 52 HD21 LEU 7 HD21 LEU 7 -10.492 -1.819 -1.577 53 HD22 LEU 7 HD22 LEU 7 -11.193 -3.427 -1.763 54 HD23 LEU 7 HD23 LEU 7 -9.450 -3.201 -1.910 55 H GLN 8 H GLN 8 -7.309 0.234 2.274 56 HA GLN 8 HA GLN 8 -8.950 2.640 2.094 57 HB2 GLN 8 HB1 GLN 8 -6.997 1.548 4.057 58 HB3 GLN 8 HB2 GLN 8 -7.176 3.296 3.972 59 HG2 GLN 8 HG1 GLN 8 -9.647 2.948 4.269 60 HG3 GLN 8 HG2 GLN 8 -9.287 1.258 4.616 61 HE21 GLN 8 HE21 GLN 8 -7.100 1.347 6.147 62 HE22 GLN 8 HE22 GLN 8 -7.401 2.209 7.613 63 H SER 9 H SER 9 -6.852 1.653 0.084 64 HA SER 9 HA SER 9 -5.315 2.566 -1.322 65 HB2 SER 9 HB1 SER 9 -7.134 4.350 -1.369 66 HB3 SER 9 HB2 SER 9 -6.141 5.257 -0.227 67 HG SER 9 HG SER 9 -5.672 4.657 -2.921 68 H CYS 10 H CYS 10 -3.494 1.738 -0.297 69 HA CYS 10 HA CYS 10 -2.101 3.574 1.536 70 HB2 CYS 10 HB1 CYS 10 -2.411 1.532 2.674 71 HB3 CYS 10 HB2 CYS 10 -2.021 0.579 1.245 72 H PHE 11 H PHE 11 -0.019 4.202 1.117 73 HA PHE 11 HA PHE 11 0.892 3.795 -1.621 74 HB2 PHE 11 HB1 PHE 11 1.673 5.721 0.560 75 HB3 PHE 11 HB2 PHE 11 2.613 5.562 -0.920 76 HD1 PHE 11 HD2 PHE 11 1.041 5.600 -3.118 77 HD2 PHE 11 HD1 PHE 11 0.165 7.435 0.621 78 HE1 PHE 11 HE2 PHE 11 -0.475 7.173 -4.249 79 HE2 PHE 11 HE1 PHE 11 -1.353 9.010 -0.503 80 HZ PHE 11 HZ PHE 11 -1.676 8.879 -2.942 81 HA PRO 12 HA PRO 12 4.145 1.003 -0.683 82 HB2 PRO 12 HB1 PRO 12 6.067 1.803 -2.426 83 HB3 PRO 12 HB2 PRO 12 4.601 0.956 -2.934 84 HG2 PRO 12 HG1 PRO 12 5.217 3.885 -3.004 85 HG3 PRO 12 HG2 PRO 12 4.430 2.878 -4.234 86 HD2 PRO 12 HD1 PRO 12 3.037 4.479 -2.553 87 HD3 PRO 12 HD2 PRO 12 2.392 2.941 -3.161 88 H ASP 13 H ASP 13 5.878 0.804 0.653 89 HA ASP 13 HA ASP 13 7.445 3.197 1.299 90 HB2 ASP 13 HB1 ASP 13 5.594 2.908 2.977 91 HB3 ASP 13 HB2 ASP 13 6.315 1.363 3.420
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