NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
563972 | 2lzo | 18766 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 ILE 1 H ILE 1 0.991 2.124 2.037 2 HA ILE 1 HA ILE 1 -0.788 2.357 -0.292 3 HB ILE 1 HB ILE 1 -0.561 4.572 0.827 4 HG12 ILE 1 HG12 ILE 1 0.871 4.647 -1.818 5 HG13 ILE 1 HG13 ILE 1 -0.813 4.146 -1.714 6 HG21 ILE 1 HG21 ILE 1 2.165 5.004 -0.132 7 HG22 ILE 1 HG22 ILE 1 1.405 5.486 1.383 8 HG23 ILE 1 HG23 ILE 1 2.050 3.855 1.200 9 HD11 ILE 1 HD11 ILE 1 0.315 6.801 -0.864 10 HD12 ILE 1 HD12 ILE 1 -0.671 6.479 -2.291 11 HD13 ILE 1 HD13 ILE 1 -1.366 6.303 -0.680 12 H SER 2 H SER 2 0.126 1.906 -2.243 13 HA SER 2 HA SER 2 2.599 0.477 -2.241 14 HB2 SER 2 HB2 SER 2 0.854 -0.263 -3.725 15 HB3 SER 2 HB3 SER 2 0.754 1.326 -4.483 16 HG SER 2 HG SER 2 2.629 -0.702 -4.827 17 H ILE 3 H ILE 3 4.564 1.034 -3.106 18 HA ILE 3 HA ILE 3 4.987 3.903 -3.510 19 HB ILE 3 HB ILE 3 7.092 1.765 -3.192 20 HG12 ILE 3 HG12 ILE 3 7.161 3.015 -0.831 21 HG13 ILE 3 HG13 ILE 3 5.453 3.239 -1.190 22 HG21 ILE 3 HG21 ILE 3 8.279 3.953 -2.313 23 HG22 ILE 3 HG22 ILE 3 8.234 3.555 -4.030 24 HG23 ILE 3 HG23 ILE 3 7.100 4.732 -3.368 25 HD11 ILE 3 HD11 ILE 3 5.018 1.173 -0.545 26 HD12 ILE 3 HD12 ILE 3 6.181 0.527 -1.702 27 HD13 ILE 3 HD13 ILE 3 6.710 0.991 -0.085 28 H ASP 4 H ASP 4 6.114 4.723 -5.291 29 HA ASP 4 HA ASP 4 5.569 3.478 -7.764 30 HB2 ASP 4 HB2 ASP 4 7.144 5.307 -8.652 31 HB3 ASP 4 HB3 ASP 4 5.681 5.825 -7.818 32 HA PRO 5 HA PRO 5 9.042 0.909 -8.524 33 HB2 PRO 5 HB2 PRO 5 9.449 1.284 -11.182 34 HB3 PRO 5 HB3 PRO 5 8.075 0.376 -10.539 35 HG2 PRO 5 HG2 PRO 5 8.193 3.211 -11.494 36 HG3 PRO 5 HG3 PRO 5 6.951 1.981 -11.792 37 HD2 PRO 5 HD2 PRO 5 6.657 3.929 -9.934 38 HD3 PRO 5 HD3 PRO 5 5.955 2.310 -9.740 39 HA PRO 6 HA PRO 6 12.860 3.090 -8.462 40 HB2 PRO 6 HB2 PRO 6 14.526 1.425 -9.812 41 HB3 PRO 6 HB3 PRO 6 13.913 1.066 -8.193 42 HG2 PRO 6 HG2 PRO 6 12.953 0.065 -10.846 43 HG3 PRO 6 HG3 PRO 6 13.184 -0.826 -9.331 44 HD2 PRO 6 HD2 PRO 6 10.751 0.017 -10.168 45 HD3 PRO 6 HD3 PRO 6 11.183 -0.097 -8.450 46 H CYS 7 H CYS 7 14.734 3.827 -9.914 47 HA CYS 7 HA CYS 7 13.646 5.303 -12.084 48 HB2 CYS 7 HB2 CYS 7 16.328 5.004 -10.828 49 HB3 CYS 7 HB3 CYS 7 16.265 5.658 -12.461 50 H ARG 8 H ARG 8 15.163 5.333 -14.187 51 HA ARG 8 HA ARG 8 14.478 3.116 -15.698 52 HB2 ARG 8 HB2 ARG 8 16.456 5.331 -16.054 53 HB3 ARG 8 HB3 ARG 8 16.469 3.987 -17.188 54 HG2 ARG 8 HG2 ARG 8 14.184 4.420 -17.805 55 HG3 ARG 8 HG3 ARG 8 14.056 5.677 -16.573 56 HD2 ARG 8 HD2 ARG 8 15.318 7.169 -17.769 57 HD3 ARG 8 HD3 ARG 8 16.211 5.903 -18.610 58 HE ARG 8 HE ARG 8 13.729 7.113 -19.423 59 HH11 ARG 8 HH11 ARG 8 15.793 4.323 -19.700 60 HH12 ARG 8 HH12 ARG 8 15.150 3.837 -21.234 61 HH21 ARG 8 HH21 ARG 8 12.875 6.484 -21.442 62 HH22 ARG 8 HH22 ARG 8 13.491 5.068 -22.224 63 H PHE 9 H PHE 9 16.253 1.842 -16.986 64 HA PHE 9 HA PHE 9 17.389 -0.015 -15.247 65 HB2 PHE 9 HB2 PHE 9 16.897 -0.569 -17.562 66 HB3 PHE 9 HB3 PHE 9 18.093 0.594 -18.125 67 HD1 PHE 9 HD2 PHE 9 17.980 -2.267 -15.725 68 HD2 PHE 9 HD1 PHE 9 20.041 -0.315 -18.897 69 HE1 PHE 9 HE2 PHE 9 19.701 -4.025 -15.684 70 HE2 PHE 9 HE1 PHE 9 21.765 -2.071 -18.862 71 HZ PHE 9 HZ PHE 9 21.597 -3.928 -17.253 72 H CYS 10 H CYS 10 19.030 0.220 -13.896 73 HA CYS 10 HA CYS 10 21.038 0.812 -13.006 74 HB2 CYS 10 HB2 CYS 10 21.554 0.985 -15.936 75 HB3 CYS 10 HB3 CYS 10 22.741 1.703 -14.852 76 H TYR 11 H TYR 11 18.861 2.741 -13.278 77 HA TYR 11 HA TYR 11 20.420 5.242 -13.296 78 HB2 TYR 11 HB2 TYR 11 17.658 4.601 -14.220 79 HB3 TYR 11 HB3 TYR 11 17.954 6.199 -13.543 80 HD1 TYR 11 HD1 TYR 11 20.150 4.066 -15.670 81 HD2 TYR 11 HD2 TYR 11 17.898 7.662 -15.351 82 HE1 TYR 11 HE1 TYR 11 21.045 4.811 -17.836 83 HE2 TYR 11 HE2 TYR 11 18.787 8.417 -17.517 84 HH TYR 11 HH TYR 11 19.889 6.784 -19.724 85 H HIS 12 H HIS 12 19.260 6.982 -11.906 86 HA HIS 12 HA HIS 12 17.823 6.080 -9.608 87 HB2 HIS 12 HB2 HIS 12 19.506 6.478 -7.921 88 HB3 HIS 12 HB3 HIS 12 20.125 5.294 -9.068 89 HD1 HIS 12 HD1 HIS 12 22.488 5.700 -9.622 90 HD2 HIS 12 HD2 HIS 12 20.470 9.245 -8.830 91 HE1 HIS 12 HE1 HIS 12 24.205 7.521 -9.869 92 H ARG 13 H ARG 13 17.127 7.800 -8.264 93 HA ARG 13 HA ARG 13 16.797 10.270 -9.636 94 HB2 ARG 13 HB2 ARG 13 15.263 9.082 -7.877 95 HB3 ARG 13 HB3 ARG 13 16.241 9.960 -6.709 96 HG2 ARG 13 HG2 ARG 13 15.659 12.061 -7.958 97 HG3 ARG 13 HG3 ARG 13 14.500 11.098 -8.876 98 HD2 ARG 13 HD2 ARG 13 13.262 12.075 -7.128 99 HD3 ARG 13 HD3 ARG 13 13.527 10.402 -6.641 100 HE ARG 13 HE ARG 13 15.555 12.109 -5.617 101 HH11 ARG 13 HH11 ARG 13 12.247 11.132 -5.141 102 HH12 ARG 13 HH12 ARG 13 12.250 11.487 -3.445 103 HH21 ARG 13 HH21 ARG 13 15.571 12.580 -3.386 104 HH22 ARG 13 HH22 ARG 13 14.141 12.311 -2.448 105 H ASP 14 H ASP 14 18.190 11.889 -9.738 106 HA ASP 14 HA ASP 14 20.437 12.013 -7.914 107 HB2 ASP 14 HB2 ASP 14 21.363 13.634 -9.389 108 HB3 ASP 14 HB3 ASP 14 20.605 12.415 -10.411 109 H GLY 15 H GLY 15 20.994 14.631 -7.617 110 HA2 GLY 15 HA2 GLY 15 19.284 15.399 -5.492 111 HA3 GLY 15 HA3 GLY 15 20.578 16.371 -6.176 112 H SER 16 H SER 16 19.330 16.182 -8.882 113 HA SER 16 HA SER 16 17.713 18.533 -8.660 114 HB2 SER 16 HB2 SER 16 19.308 17.823 -10.590 115 HB3 SER 16 HB3 SER 16 17.929 16.887 -11.166 116 HG SER 16 HG SER 16 16.726 18.838 -11.190 117 H GLY 17 H GLY 17 17.107 15.135 -8.817 118 HA2 GLY 17 HA2 GLY 17 14.993 14.262 -8.096 119 HA3 GLY 17 HA3 GLY 17 14.219 15.697 -8.753 120 H ASN 18 H ASN 18 16.658 13.861 -10.473 121 HA ASN 18 HA ASN 18 14.579 12.715 -12.201 122 HB2 ASN 18 HB2 ASN 18 16.760 14.590 -12.963 123 HB3 ASN 18 HB3 ASN 18 16.415 13.265 -14.071 124 HD21 ASN 18 HD21 ASN 18 15.876 16.348 -13.767 125 HD22 ASN 18 HD22 ASN 18 14.262 16.489 -14.367 126 H CYS 19 H CYS 19 15.295 10.894 -13.477 127 HA CYS 19 HA CYS 19 17.157 9.243 -12.014 128 HB2 CYS 19 HB2 CYS 19 15.593 8.631 -14.531 129 HB3 CYS 19 HB3 CYS 19 16.445 7.460 -13.530 130 H VAL 20 H VAL 20 19.188 8.720 -12.572 131 HA VAL 20 HA VAL 20 20.141 9.307 -15.274 132 HB VAL 20 HB VAL 20 22.192 10.386 -14.370 133 HG11 VAL 20 HG11 VAL 20 19.779 11.940 -13.492 134 HG12 VAL 20 HG12 VAL 20 21.263 12.531 -14.240 135 HG13 VAL 20 HG13 VAL 20 20.101 11.609 -15.194 136 HG21 VAL 20 HG21 VAL 20 22.064 11.317 -12.062 137 HG22 VAL 20 HG22 VAL 20 20.637 10.318 -11.787 138 HG23 VAL 20 HG23 VAL 20 22.194 9.559 -12.119 139 H TYR 21 H TYR 21 21.872 8.054 -15.943 140 HA TYR 21 HA TYR 21 22.111 5.491 -14.938 141 HB2 TYR 21 HB2 TYR 21 22.823 6.009 -17.185 142 HB3 TYR 21 HB3 TYR 21 24.074 7.093 -16.587 143 HD1 TYR 21 HD1 TYR 21 23.018 3.521 -16.517 144 HD2 TYR 21 HD2 TYR 21 26.234 6.293 -16.234 145 HE1 TYR 21 HE1 TYR 21 24.619 1.654 -16.503 146 HE2 TYR 21 HE2 TYR 21 27.843 4.433 -16.221 147 HH TYR 21 HH TYR 21 27.536 1.740 -15.456 148 H ASP 22 H ASP 22 23.036 4.673 -13.189 149 HA ASP 22 HA ASP 22 24.503 6.270 -11.362 150 HB2 ASP 22 HB2 ASP 22 23.048 4.132 -10.962 151 HB3 ASP 22 HB3 ASP 22 24.553 3.273 -11.274 152 H ALA 23 H ALA 23 26.269 7.067 -12.587 153 HA ALA 23 HA ALA 23 28.157 5.404 -13.878 154 HB1 ALA 23 HB1 ALA 23 27.978 8.248 -13.125 155 HB2 ALA 23 HB2 ALA 23 29.608 7.604 -13.333 156 HB3 ALA 23 HB3 ALA 23 28.444 7.502 -14.654 157 H TYR 24 H TYR 24 27.568 6.050 -10.589 158 HA TYR 24 HA TYR 24 30.278 5.507 -9.713 159 HB2 TYR 24 HB2 TYR 24 27.733 6.321 -8.410 160 HB3 TYR 24 HB3 TYR 24 28.893 5.441 -7.423 161 HD1 TYR 24 HD2 TYR 24 28.982 8.228 -9.922 162 HD2 TYR 24 HD1 TYR 24 30.284 6.755 -6.149 163 HE1 TYR 24 HE2 TYR 24 30.234 10.312 -9.547 164 HE2 TYR 24 HE1 TYR 24 31.538 8.835 -5.763 165 HH TYR 24 HH TYR 24 32.514 10.810 -7.859 166 H GLY 25 H GLY 25 27.956 3.610 -10.937 167 HA2 GLY 25 HA2 GLY 25 28.573 1.199 -10.909 168 HA3 GLY 25 HA3 GLY 25 28.644 1.350 -9.160 169 H CYS 26 H CYS 26 26.631 0.864 -11.904 170 HA CYS 26 HA CYS 26 24.178 1.077 -10.340 171 HB2 CYS 26 HB2 CYS 26 23.000 0.886 -12.396 172 HB3 CYS 26 HB3 CYS 26 24.375 1.938 -12.718 173 H GLY 27 H GLY 27 26.249 -1.027 -9.884 174 HA2 GLY 27 HA2 GLY 27 25.750 -3.147 -8.905 175 HA3 GLY 27 HA3 GLY 27 24.404 -3.310 -10.023 176 H ALA 28 H ALA 28 26.942 -2.130 -11.761 177 HA ALA 28 HA ALA 28 27.451 -4.732 -12.942 178 HB1 ALA 28 HB1 ALA 28 28.989 -3.040 -14.380 179 HB2 ALA 28 HB2 ALA 28 27.282 -3.345 -14.706 180 HB3 ALA 28 HB3 ALA 28 27.762 -1.928 -13.772 181 H VAL 29 H VAL 29 28.581 -3.621 -10.268 182 HA VAL 29 HA VAL 29 31.435 -4.032 -10.835 183 HB VAL 29 HB VAL 29 30.808 -1.969 -9.602 184 HG11 VAL 29 HG11 VAL 29 30.368 -3.298 -7.054 185 HG12 VAL 29 HG12 VAL 29 29.488 -1.964 -7.801 186 HG13 VAL 29 HG13 VAL 29 29.090 -3.630 -8.223 187 HG21 VAL 29 HG21 VAL 29 32.929 -2.217 -8.964 188 HG22 VAL 29 HG22 VAL 29 32.305 -2.902 -7.464 189 HG23 VAL 29 HG23 VAL 29 32.751 -3.964 -8.799 Start of MODEL 2 1 H1 ILE 1 H ILE 1 1.807 0.000 0.855 2 HA ILE 1 HA ILE 1 3.141 -0.059 -0.988 3 HB ILE 1 HB ILE 1 2.229 -1.101 -3.072 4 HG12 ILE 1 HG12 ILE 1 -0.240 -1.694 -1.452 5 HG13 ILE 1 HG13 ILE 1 -0.153 -0.300 -2.522 6 HG21 ILE 1 HG21 ILE 1 2.880 -3.027 -2.179 7 HG22 ILE 1 HG22 ILE 1 2.825 -2.256 -0.595 8 HG23 ILE 1 HG23 ILE 1 1.415 -3.124 -1.201 9 HD11 ILE 1 HD11 ILE 1 -0.124 -1.594 -4.419 10 HD12 ILE 1 HD12 ILE 1 0.504 -3.009 -3.574 11 HD13 ILE 1 HD13 ILE 1 -1.179 -2.528 -3.360 12 H SER 2 H SER 2 1.812 2.354 -0.358 13 HA SER 2 HA SER 2 0.994 3.496 -2.915 14 HB2 SER 2 HB2 SER 2 1.030 4.627 -0.109 15 HB3 SER 2 HB3 SER 2 0.532 5.545 -1.530 16 HG SER 2 HG SER 2 -0.661 3.059 -1.113 17 H ILE 3 H ILE 3 3.333 2.993 -3.578 18 HA ILE 3 HA ILE 3 4.847 5.476 -3.314 19 HB ILE 3 HB ILE 3 6.198 2.800 -2.975 20 HG12 ILE 3 HG12 ILE 3 5.538 4.864 -0.862 21 HG13 ILE 3 HG13 ILE 3 4.749 3.300 -1.039 22 HG21 ILE 3 HG21 ILE 3 7.614 4.507 -3.944 23 HG22 ILE 3 HG22 ILE 3 7.182 5.632 -2.657 24 HG23 ILE 3 HG23 ILE 3 8.117 4.183 -2.286 25 HD11 ILE 3 HD11 ILE 3 7.397 2.622 -0.887 26 HD12 ILE 3 HD12 ILE 3 7.273 3.989 0.221 27 HD13 ILE 3 HD13 ILE 3 6.239 2.578 0.441 28 H ASP 4 H ASP 4 6.196 5.935 -5.062 29 HA ASP 4 HA ASP 4 5.426 4.688 -7.533 30 HB2 ASP 4 HB2 ASP 4 6.386 6.496 -8.584 31 HB3 ASP 4 HB3 ASP 4 6.064 7.198 -7.001 32 HA PRO 5 HA PRO 5 8.687 1.803 -8.069 33 HB2 PRO 5 HB2 PRO 5 9.119 1.956 -10.744 34 HB3 PRO 5 HB3 PRO 5 7.681 1.203 -10.045 35 HG2 PRO 5 HG2 PRO 5 8.012 3.945 -11.198 36 HG3 PRO 5 HG3 PRO 5 6.680 2.794 -11.414 37 HD2 PRO 5 HD2 PRO 5 6.535 4.886 -9.701 38 HD3 PRO 5 HD3 PRO 5 5.713 3.343 -9.395 39 HA PRO 6 HA PRO 6 12.658 3.689 -8.143 40 HB2 PRO 6 HB2 PRO 6 14.192 1.812 -9.364 41 HB3 PRO 6 HB3 PRO 6 13.556 1.616 -7.726 42 HG2 PRO 6 HG2 PRO 6 12.521 0.504 -10.306 43 HG3 PRO 6 HG3 PRO 6 12.685 -0.292 -8.731 44 HD2 PRO 6 HD2 PRO 6 10.323 0.671 -9.637 45 HD3 PRO 6 HD3 PRO 6 10.745 0.646 -7.913 46 H CYS 7 H CYS 7 14.580 4.181 -9.634 47 HA CYS 7 HA CYS 7 13.588 5.548 -11.929 48 HB2 CYS 7 HB2 CYS 7 16.231 5.237 -10.592 49 HB3 CYS 7 HB3 CYS 7 16.228 5.759 -12.274 50 H ARG 8 H ARG 8 15.147 5.341 -13.992 51 HA ARG 8 HA ARG 8 14.393 3.040 -15.335 52 HB2 ARG 8 HB2 ARG 8 16.452 5.147 -15.820 53 HB3 ARG 8 HB3 ARG 8 16.474 3.706 -16.828 54 HG2 ARG 8 HG2 ARG 8 14.466 4.202 -17.823 55 HG3 ARG 8 HG3 ARG 8 13.913 5.182 -16.464 56 HD2 ARG 8 HD2 ARG 8 14.449 6.543 -18.441 57 HD3 ARG 8 HD3 ARG 8 15.468 6.940 -17.058 58 HE ARG 8 HE ARG 8 16.967 5.147 -18.388 59 HH11 ARG 8 HH11 ARG 8 15.287 8.023 -19.401 60 HH12 ARG 8 HH12 ARG 8 16.408 8.388 -20.671 61 HH21 ARG 8 HH21 ARG 8 18.450 5.617 -20.057 62 HH22 ARG 8 HH22 ARG 8 18.206 7.018 -21.043 63 H PHE 9 H PHE 9 16.131 1.587 -16.473 64 HA PHE 9 HA PHE 9 17.148 -0.168 -14.564 65 HB2 PHE 9 HB2 PHE 9 16.677 -0.889 -16.836 66 HB3 PHE 9 HB3 PHE 9 17.934 0.171 -17.465 67 HD1 PHE 9 HD1 PHE 9 17.824 -2.294 -14.665 68 HD2 PHE 9 HD2 PHE 9 19.678 -1.063 -18.293 69 HE1 PHE 9 HE1 PHE 9 19.464 -4.115 -14.441 70 HE2 PHE 9 HE2 PHE 9 21.320 -2.882 -18.076 71 HZ PHE 9 HZ PHE 9 21.214 -4.412 -16.149 72 H CYS 10 H CYS 10 18.770 0.109 -13.196 73 HA CYS 10 HA CYS 10 20.786 0.684 -12.312 74 HB2 CYS 10 HB2 CYS 10 21.367 0.591 -15.234 75 HB3 CYS 10 HB3 CYS 10 22.565 1.341 -14.183 76 H TYR 11 H TYR 11 18.704 2.678 -12.795 77 HA TYR 11 HA TYR 11 20.377 5.098 -12.981 78 HB2 TYR 11 HB2 TYR 11 17.608 4.504 -13.916 79 HB3 TYR 11 HB3 TYR 11 17.963 6.138 -13.368 80 HD1 TYR 11 HD2 TYR 11 20.098 3.737 -15.258 81 HD2 TYR 11 HD1 TYR 11 18.012 7.445 -15.291 82 HE1 TYR 11 HE2 TYR 11 21.071 4.258 -17.456 83 HE2 TYR 11 HE1 TYR 11 18.978 7.976 -17.489 84 HH TYR 11 HH TYR 11 20.971 5.640 -19.233 85 H HIS 12 H HIS 12 19.273 6.997 -11.768 86 HA HIS 12 HA HIS 12 17.746 6.356 -9.440 87 HB2 HIS 12 HB2 HIS 12 19.410 6.813 -7.749 88 HB3 HIS 12 HB3 HIS 12 19.997 5.512 -8.781 89 HD1 HIS 12 HD1 HIS 12 22.388 5.764 -9.303 90 HD2 HIS 12 HD2 HIS 12 20.522 9.449 -8.858 91 HE1 HIS 12 HE1 HIS 12 24.194 7.479 -9.654 92 H ARG 13 H ARG 13 17.106 8.213 -8.259 93 HA ARG 13 HA ARG 13 16.921 10.571 -9.836 94 HB2 ARG 13 HB2 ARG 13 15.271 9.638 -8.066 95 HB3 ARG 13 HB3 ARG 13 16.291 10.471 -6.901 96 HG2 ARG 13 HG2 ARG 13 15.735 12.569 -7.722 97 HG3 ARG 13 HG3 ARG 13 15.178 11.922 -9.267 98 HD2 ARG 13 HD2 ARG 13 13.247 12.559 -8.033 99 HD3 ARG 13 HD3 ARG 13 13.319 10.797 -8.018 100 HE ARG 13 HE ARG 13 13.639 10.855 -5.745 101 HH11 ARG 13 HH11 ARG 13 14.064 14.049 -7.064 102 HH12 ARG 13 HH12 ARG 13 14.122 14.823 -5.515 103 HH21 ARG 13 HH21 ARG 13 13.713 11.862 -3.700 104 HH22 ARG 13 HH22 ARG 13 13.923 13.578 -3.602 105 H ASP 14 H ASP 14 18.418 12.084 -10.056 106 HA ASP 14 HA ASP 14 20.616 12.270 -8.178 107 HB2 ASP 14 HB2 ASP 14 21.675 13.678 -9.773 108 HB3 ASP 14 HB3 ASP 14 20.869 12.414 -10.699 109 H GLY 15 H GLY 15 21.341 14.796 -7.979 110 HA2 GLY 15 HA2 GLY 15 19.602 15.881 -6.050 111 HA3 GLY 15 HA3 GLY 15 20.971 16.713 -6.772 112 H SER 16 H SER 16 19.779 16.326 -9.492 113 HA SER 16 HA SER 16 18.307 18.782 -9.548 114 HB2 SER 16 HB2 SER 16 19.896 17.905 -11.352 115 HB3 SER 16 HB3 SER 16 18.579 16.840 -11.842 116 HG SER 16 HG SER 16 17.389 18.563 -12.444 117 H GLY 17 H GLY 17 17.495 15.434 -9.366 118 HA2 GLY 17 HA2 GLY 17 15.321 14.746 -8.651 119 HA3 GLY 17 HA3 GLY 17 14.649 16.166 -9.438 120 H ASN 18 H ASN 18 16.997 14.046 -10.948 121 HA ASN 18 HA ASN 18 14.883 12.876 -12.613 122 HB2 ASN 18 HB2 ASN 18 17.157 14.580 -13.496 123 HB3 ASN 18 HB3 ASN 18 16.756 13.190 -14.499 124 HD21 ASN 18 HD21 ASN 18 16.358 16.315 -14.426 125 HD22 ASN 18 HD22 ASN 18 14.759 16.482 -15.060 126 H CYS 19 H CYS 19 15.496 10.915 -13.696 127 HA CYS 19 HA CYS 19 17.263 9.302 -12.093 128 HB2 CYS 19 HB2 CYS 19 15.719 8.578 -14.593 129 HB3 CYS 19 HB3 CYS 19 16.496 7.445 -13.492 130 H VAL 20 H VAL 20 19.289 8.688 -12.544 131 HA VAL 20 HA VAL 20 20.321 9.004 -15.265 132 HB VAL 20 HB VAL 20 22.400 10.057 -14.392 133 HG11 VAL 20 HG11 VAL 20 20.497 11.337 -15.415 134 HG12 VAL 20 HG12 VAL 20 19.966 11.720 -13.777 135 HG13 VAL 20 HG13 VAL 20 21.541 12.274 -14.347 136 HG21 VAL 20 HG21 VAL 20 22.270 11.170 -12.171 137 HG22 VAL 20 HG22 VAL 20 20.779 10.281 -11.858 138 HG23 VAL 20 HG23 VAL 20 22.296 9.409 -12.080 139 H TYR 21 H TYR 21 22.001 7.625 -15.795 140 HA TYR 21 HA TYR 21 22.104 5.141 -14.586 141 HB2 TYR 21 HB2 TYR 21 22.880 5.446 -16.849 142 HB3 TYR 21 HB3 TYR 21 24.167 6.520 -16.313 143 HD1 TYR 21 HD2 TYR 21 22.954 3.013 -15.980 144 HD2 TYR 21 HD1 TYR 21 26.283 5.659 -15.854 145 HE1 TYR 21 HE2 TYR 21 24.470 1.087 -15.782 146 HE2 TYR 21 HE1 TYR 21 27.809 3.740 -15.657 147 HH TYR 21 HH TYR 21 27.864 1.377 -16.131 148 H ASP 22 H ASP 22 22.962 4.422 -12.761 149 HA ASP 22 HA ASP 22 24.463 6.092 -11.030 150 HB2 ASP 22 HB2 ASP 22 22.910 4.045 -10.508 151 HB3 ASP 22 HB3 ASP 22 24.392 3.114 -10.705 152 H ALA 23 H ALA 23 26.284 6.718 -12.274 153 HA ALA 23 HA ALA 23 28.122 4.883 -13.392 154 HB1 ALA 23 HB1 ALA 23 28.028 7.778 -12.893 155 HB2 ALA 23 HB2 ALA 23 29.645 7.076 -12.955 156 HB3 ALA 23 HB3 ALA 23 28.548 6.885 -14.323 157 H TYR 24 H TYR 24 27.503 5.812 -10.175 158 HA TYR 24 HA TYR 24 30.170 5.224 -9.203 159 HB2 TYR 24 HB2 TYR 24 27.641 6.248 -8.022 160 HB3 TYR 24 HB3 TYR 24 28.742 5.398 -6.945 161 HD1 TYR 24 HD2 TYR 24 28.716 8.140 -9.477 162 HD2 TYR 24 HD1 TYR 24 30.454 6.580 -5.921 163 HE1 TYR 24 HE2 TYR 24 30.053 10.190 -9.238 164 HE2 TYR 24 HE1 TYR 24 31.796 8.626 -5.671 165 HH TYR 24 HH TYR 24 32.687 10.453 -7.306 166 H GLY 25 H GLY 25 27.787 3.338 -10.323 167 HA2 GLY 25 HA2 GLY 25 28.293 0.912 -10.095 168 HA3 GLY 25 HA3 GLY 25 28.344 1.197 -8.361 169 H CYS 26 H CYS 26 26.356 0.576 -11.094 170 HA CYS 26 HA CYS 26 23.889 1.023 -9.603 171 HB2 CYS 26 HB2 CYS 26 22.738 0.713 -11.659 172 HB3 CYS 26 HB3 CYS 26 24.163 1.675 -12.039 173 H GLY 27 H GLY 27 25.856 -1.122 -8.932 174 HA2 GLY 27 HA2 GLY 27 25.485 -3.183 -7.901 175 HA3 GLY 27 HA3 GLY 27 23.903 -3.253 -8.664 176 H ALA 28 H ALA 28 26.055 -2.455 -11.027 177 HA ALA 28 HA ALA 28 27.150 -5.050 -11.580 178 HB1 ALA 28 HB1 ALA 28 25.842 -5.731 -13.367 179 HB2 ALA 28 HB2 ALA 28 24.647 -5.113 -12.225 180 HB3 ALA 28 HB3 ALA 28 25.146 -4.127 -13.600 181 H VAL 29 H VAL 29 29.011 -3.641 -11.583 182 HA VAL 29 HA VAL 29 29.237 -1.698 -13.728 183 HB VAL 29 HB VAL 29 31.294 -2.592 -11.702 184 HG11 VAL 29 HG11 VAL 29 32.675 -1.628 -13.203 185 HG12 VAL 29 HG12 VAL 29 31.373 -0.727 -13.984 186 HG13 VAL 29 HG13 VAL 29 32.078 -0.135 -12.479 187 HG21 VAL 29 HG21 VAL 29 29.019 -0.849 -11.491 188 HG22 VAL 29 HG22 VAL 29 30.158 -1.355 -10.244 189 HG23 VAL 29 HG23 VAL 29 30.510 0.058 -11.239 Start of MODEL 3 1 H1 ILE 1 H ILE 1 -2.143 1.800 -2.348 2 HA ILE 1 HA ILE 1 -0.921 4.218 -1.195 3 HB ILE 1 HB ILE 1 -1.363 1.666 0.326 4 HG12 ILE 1 HG12 ILE 1 -3.320 3.949 -0.011 5 HG13 ILE 1 HG13 ILE 1 -3.540 2.299 -0.582 6 HG21 ILE 1 HG21 ILE 1 -0.627 2.818 2.090 7 HG22 ILE 1 HG22 ILE 1 -0.063 4.018 0.929 8 HG23 ILE 1 HG23 ILE 1 -1.636 4.212 1.703 9 HD11 ILE 1 HD11 ILE 1 -3.456 3.259 2.262 10 HD12 ILE 1 HD12 ILE 1 -4.820 2.555 1.393 11 HD13 ILE 1 HD13 ILE 1 -3.425 1.557 1.801 12 H SER 2 H SER 2 0.109 2.266 -3.284 13 HA SER 2 HA SER 2 2.426 1.141 -1.907 14 HB2 SER 2 HB2 SER 2 2.805 -0.163 -3.834 15 HB3 SER 2 HB3 SER 2 1.049 -0.109 -3.689 16 HG SER 2 HG SER 2 0.949 0.932 -5.511 17 H ILE 3 H ILE 3 4.586 1.451 -2.857 18 HA ILE 3 HA ILE 3 5.002 4.263 -3.469 19 HB ILE 3 HB ILE 3 7.108 2.141 -3.069 20 HG12 ILE 3 HG12 ILE 3 5.603 2.264 -1.112 21 HG13 ILE 3 HG13 ILE 3 7.220 2.852 -0.738 22 HG21 ILE 3 HG21 ILE 3 7.105 5.106 -3.306 23 HG22 ILE 3 HG22 ILE 3 8.287 4.346 -2.242 24 HG23 ILE 3 HG23 ILE 3 8.240 3.922 -3.953 25 HD11 ILE 3 HD11 ILE 3 5.528 4.258 0.271 26 HD12 ILE 3 HD12 ILE 3 6.423 5.152 -0.958 27 HD13 ILE 3 HD13 ILE 3 4.803 4.551 -1.310 28 H ASP 4 H ASP 4 6.171 5.020 -5.259 29 HA ASP 4 HA ASP 4 5.636 3.709 -7.700 30 HB2 ASP 4 HB2 ASP 4 7.243 5.491 -8.625 31 HB3 ASP 4 HB3 ASP 4 5.779 6.052 -7.822 32 HA PRO 5 HA PRO 5 9.083 1.076 -8.348 33 HB2 PRO 5 HB2 PRO 5 9.524 1.368 -11.011 34 HB3 PRO 5 HB3 PRO 5 8.131 0.498 -10.358 35 HG2 PRO 5 HG2 PRO 5 8.297 3.302 -11.393 36 HG3 PRO 5 HG3 PRO 5 7.042 2.080 -11.669 37 HD2 PRO 5 HD2 PRO 5 6.753 4.085 -9.871 38 HD3 PRO 5 HD3 PRO 5 6.028 2.481 -9.638 39 HA PRO 6 HA PRO 6 12.927 3.209 -8.305 40 HB2 PRO 6 HB2 PRO 6 14.587 1.483 -9.584 41 HB3 PRO 6 HB3 PRO 6 13.951 1.181 -7.962 42 HG2 PRO 6 HG2 PRO 6 13.009 0.113 -10.596 43 HG3 PRO 6 HG3 PRO 6 13.210 -0.735 -9.052 44 HD2 PRO 6 HD2 PRO 6 10.799 0.114 -9.943 45 HD3 PRO 6 HD3 PRO 6 11.208 0.046 -8.217 46 H CYS 7 H CYS 7 14.829 3.876 -9.756 47 HA CYS 7 HA CYS 7 13.782 5.297 -11.985 48 HB2 CYS 7 HB2 CYS 7 16.444 5.015 -10.680 49 HB3 CYS 7 HB3 CYS 7 16.410 5.619 -12.334 50 H ARG 8 H ARG 8 15.327 5.249 -14.066 51 HA ARG 8 HA ARG 8 14.647 2.991 -15.516 52 HB2 ARG 8 HB2 ARG 8 16.631 5.188 -15.910 53 HB3 ARG 8 HB3 ARG 8 16.684 3.802 -16.991 54 HG2 ARG 8 HG2 ARG 8 14.401 4.193 -17.670 55 HG3 ARG 8 HG3 ARG 8 14.255 5.514 -16.509 56 HD2 ARG 8 HD2 ARG 8 14.686 6.649 -18.473 57 HD3 ARG 8 HD3 ARG 8 16.299 6.500 -17.775 58 HE ARG 8 HE ARG 8 16.892 5.242 -19.578 59 HH11 ARG 8 HH11 ARG 8 13.425 5.165 -19.270 60 HH12 ARG 8 HH12 ARG 8 13.184 4.269 -20.733 61 HH21 ARG 8 HH21 ARG 8 16.588 4.063 -21.507 62 HH22 ARG 8 HH22 ARG 8 14.984 3.643 -22.005 63 H PHE 9 H PHE 9 16.423 1.657 -16.735 64 HA PHE 9 HA PHE 9 17.520 -0.151 -14.921 65 HB2 PHE 9 HB2 PHE 9 17.051 -0.769 -17.228 66 HB3 PHE 9 HB3 PHE 9 18.277 0.355 -17.805 67 HD1 PHE 9 HD2 PHE 9 18.352 -2.139 -15.040 68 HD2 PHE 9 HD1 PHE 9 19.941 -0.899 -18.789 69 HE1 PHE 9 HE2 PHE 9 20.041 -3.923 -14.911 70 HE2 PHE 9 HE1 PHE 9 21.632 -2.682 -18.666 71 HZ PHE 9 HZ PHE 9 21.684 -4.196 -16.725 72 H CYS 10 H CYS 10 19.144 0.115 -13.555 73 HA CYS 10 HA CYS 10 21.146 0.717 -12.659 74 HB2 CYS 10 HB2 CYS 10 21.702 0.792 -15.585 75 HB3 CYS 10 HB3 CYS 10 22.883 1.531 -14.508 76 H TYR 11 H TYR 11 18.991 2.656 -13.024 77 HA TYR 11 HA TYR 11 20.573 5.141 -13.100 78 HB2 TYR 11 HB2 TYR 11 17.818 4.496 -14.043 79 HB3 TYR 11 HB3 TYR 11 18.121 6.112 -13.416 80 HD1 TYR 11 HD2 TYR 11 20.323 3.887 -15.439 81 HD2 TYR 11 HD1 TYR 11 18.104 7.513 -15.273 82 HE1 TYR 11 HE2 TYR 11 21.257 4.551 -17.616 83 HE2 TYR 11 HE1 TYR 11 19.030 8.187 -17.450 84 HH TYR 11 HH TYR 11 20.007 6.875 -19.519 85 H HIS 12 H HIS 12 19.410 6.936 -11.785 86 HA HIS 12 HA HIS 12 17.931 6.123 -9.481 87 HB2 HIS 12 HB2 HIS 12 19.592 6.559 -7.782 88 HB3 HIS 12 HB3 HIS 12 20.217 5.332 -8.881 89 HD1 HIS 12 HD1 HIS 12 22.592 5.699 -9.409 90 HD2 HIS 12 HD2 HIS 12 20.596 9.286 -8.768 91 HE1 HIS 12 HE1 HIS 12 24.330 7.495 -9.689 92 H ARG 13 H ARG 13 17.232 7.892 -8.204 93 HA ARG 13 HA ARG 13 16.945 10.318 -9.659 94 HB2 ARG 13 HB2 ARG 13 15.388 9.194 -7.868 95 HB3 ARG 13 HB3 ARG 13 16.350 10.131 -6.732 96 HG2 ARG 13 HG2 ARG 13 15.781 12.159 -8.137 97 HG3 ARG 13 HG3 ARG 13 14.595 11.136 -8.950 98 HD2 ARG 13 HD2 ARG 13 13.474 12.331 -7.209 99 HD3 ARG 13 HD3 ARG 13 13.598 10.642 -6.720 100 HE ARG 13 HE ARG 13 15.777 11.755 -5.586 101 HH11 ARG 13 HH11 ARG 13 12.403 12.611 -5.581 102 HH12 ARG 13 HH12 ARG 13 12.454 13.334 -4.007 103 HH21 ARG 13 HH21 ARG 13 15.858 12.704 -3.513 104 HH22 ARG 13 HH22 ARG 13 14.420 13.387 -2.833 105 H ASP 14 H ASP 14 18.378 11.899 -9.810 106 HA ASP 14 HA ASP 14 20.586 12.072 -7.943 107 HB2 ASP 14 HB2 ASP 14 21.572 13.604 -9.469 108 HB3 ASP 14 HB3 ASP 14 20.808 12.360 -10.454 109 H GLY 15 H GLY 15 21.198 14.652 -7.684 110 HA2 GLY 15 HA2 GLY 15 19.446 15.552 -5.659 111 HA3 GLY 15 HA3 GLY 15 20.772 16.473 -6.352 112 H SER 16 H SER 16 19.579 16.189 -9.076 113 HA SER 16 HA SER 16 18.002 18.576 -8.992 114 HB2 SER 16 HB2 SER 16 18.407 16.748 -11.365 115 HB3 SER 16 HB3 SER 16 17.995 18.462 -11.387 116 HG SER 16 HG SER 16 20.316 17.709 -11.706 117 H GLY 17 H GLY 17 17.331 15.198 -8.955 118 HA2 GLY 17 HA2 GLY 17 15.195 14.380 -8.274 119 HA3 GLY 17 HA3 GLY 17 14.457 15.809 -8.982 120 H ASN 18 H ASN 18 16.876 13.845 -10.597 121 HA ASN 18 HA ASN 18 14.799 12.687 -12.316 122 HB2 ASN 18 HB2 ASN 18 17.004 14.516 -13.121 123 HB3 ASN 18 HB3 ASN 18 16.649 13.162 -14.190 124 HD21 ASN 18 HD21 ASN 18 15.936 16.303 -13.510 125 HD22 ASN 18 HD22 ASN 18 14.407 16.426 -14.305 126 H CYS 19 H CYS 19 15.484 10.809 -13.505 127 HA CYS 19 HA CYS 19 17.320 9.187 -11.987 128 HB2 CYS 19 HB2 CYS 19 15.782 8.524 -14.508 129 HB3 CYS 19 HB3 CYS 19 16.609 7.370 -13.465 130 H VAL 20 H VAL 20 19.360 8.660 -12.487 131 HA VAL 20 HA VAL 20 20.356 9.148 -15.196 132 HB VAL 20 HB VAL 20 22.403 10.235 -14.291 133 HG11 VAL 20 HG11 VAL 20 20.402 11.474 -15.218 134 HG12 VAL 20 HG12 VAL 20 19.944 11.799 -13.545 135 HG13 VAL 20 HG13 VAL 20 21.476 12.406 -14.175 136 HG21 VAL 20 HG21 VAL 20 22.350 9.473 -12.015 137 HG22 VAL 20 HG22 VAL 20 22.254 11.234 -12.015 138 HG23 VAL 20 HG23 VAL 20 20.803 10.272 -11.735 139 H TYR 21 H TYR 21 22.080 7.858 -15.804 140 HA TYR 21 HA TYR 21 22.285 5.325 -14.718 141 HB2 TYR 21 HB2 TYR 21 23.031 5.769 -16.969 142 HB3 TYR 21 HB3 TYR 21 24.283 6.861 -16.387 143 HD1 TYR 21 HD1 TYR 21 23.196 3.301 -16.215 144 HD2 TYR 21 HD2 TYR 21 26.432 6.054 -15.988 145 HE1 TYR 21 HE1 TYR 21 24.780 1.422 -16.123 146 HE2 TYR 21 HE2 TYR 21 28.025 4.183 -15.896 147 HH TYR 21 HH TYR 21 27.669 1.504 -15.044 148 H ASP 22 H ASP 22 23.179 4.553 -12.933 149 HA ASP 22 HA ASP 22 24.635 6.192 -11.134 150 HB2 ASP 22 HB2 ASP 22 23.156 4.077 -10.692 151 HB3 ASP 22 HB3 ASP 22 24.660 3.199 -10.954 152 H ALA 23 H ALA 23 26.421 6.936 -12.367 153 HA ALA 23 HA ALA 23 28.313 5.220 -13.579 154 HB1 ALA 23 HB1 ALA 23 28.646 7.284 -14.416 155 HB2 ALA 23 HB2 ALA 23 28.137 8.086 -12.930 156 HB3 ALA 23 HB3 ALA 23 29.769 7.432 -13.064 157 H TYR 24 H TYR 24 27.688 5.973 -10.318 158 HA TYR 24 HA TYR 24 30.381 5.432 -9.392 159 HB2 TYR 24 HB2 TYR 24 27.827 6.310 -8.148 160 HB3 TYR 24 HB3 TYR 24 28.966 5.448 -7.119 161 HD1 TYR 24 HD2 TYR 24 31.136 6.423 -6.574 162 HD2 TYR 24 HD1 TYR 24 28.335 8.521 -8.995 163 HE1 TYR 24 HE2 TYR 24 32.408 8.500 -6.236 164 HE2 TYR 24 HE1 TYR 24 29.600 10.603 -8.664 165 HH TYR 24 HH TYR 24 31.413 11.537 -7.785 166 H GLY 25 H GLY 25 28.057 3.520 -10.587 167 HA2 GLY 25 HA2 GLY 25 28.648 1.105 -10.479 168 HA3 GLY 25 HA3 GLY 25 28.702 1.308 -8.734 169 H CYS 26 H CYS 26 26.716 0.749 -11.481 170 HA CYS 26 HA CYS 26 24.247 1.039 -9.955 171 HB2 CYS 26 HB2 CYS 26 23.091 0.782 -12.017 172 HB3 CYS 26 HB3 CYS 26 24.475 1.817 -12.356 173 H GLY 27 H GLY 27 26.287 -1.064 -9.393 174 HA2 GLY 27 HA2 GLY 27 25.974 -3.179 -8.447 175 HA3 GLY 27 HA3 GLY 27 24.411 -3.279 -9.245 176 H ALA 28 H ALA 28 26.589 -2.285 -11.515 177 HA ALA 28 HA ALA 28 27.707 -4.867 -12.173 178 HB1 ALA 28 HB1 ALA 28 25.442 -5.116 -13.032 179 HB2 ALA 28 HB2 ALA 28 25.625 -3.636 -13.975 180 HB3 ALA 28 HB3 ALA 28 26.611 -5.049 -14.352 181 H VAL 29 H VAL 29 29.614 -3.554 -11.921 182 HA VAL 29 HA VAL 29 30.068 -1.531 -13.986 183 HB VAL 29 HB VAL 29 32.165 -1.047 -12.763 184 HG11 VAL 29 HG11 VAL 29 29.658 -0.268 -12.146 185 HG12 VAL 29 HG12 VAL 29 30.165 -0.957 -10.603 186 HG13 VAL 29 HG13 VAL 29 31.103 0.342 -11.340 187 HG21 VAL 29 HG21 VAL 29 32.039 -3.533 -11.793 188 HG22 VAL 29 HG22 VAL 29 32.924 -2.239 -10.986 189 HG23 VAL 29 HG23 VAL 29 31.303 -2.669 -10.442 Start of MODEL 4 1 H1 ILE 1 H ILE 1 -1.202 4.338 -0.174 2 HA ILE 1 HA ILE 1 0.034 2.191 1.403 3 HB ILE 1 HB ILE 1 -2.347 1.836 -0.392 4 HG12 ILE 1 HG12 ILE 1 -2.356 2.771 2.486 5 HG13 ILE 1 HG13 ILE 1 -2.887 3.702 1.090 6 HG21 ILE 1 HG21 ILE 1 -0.822 0.115 1.185 7 HG22 ILE 1 HG22 ILE 1 -2.316 0.367 2.086 8 HG23 ILE 1 HG23 ILE 1 -2.377 -0.229 0.427 9 HD11 ILE 1 HD11 ILE 1 -4.314 1.742 2.666 10 HD12 ILE 1 HD12 ILE 1 -4.925 2.958 1.544 11 HD13 ILE 1 HD13 ILE 1 -4.384 1.392 0.939 12 H SER 2 H SER 2 1.288 3.532 -0.918 13 HA SER 2 HA SER 2 2.290 1.215 -2.215 14 HB2 SER 2 HB2 SER 2 1.443 1.470 -4.418 15 HB3 SER 2 HB3 SER 2 0.035 1.579 -3.361 16 HG SER 2 HG SER 2 0.166 3.227 -5.022 17 H ILE 3 H ILE 3 3.926 1.755 -3.865 18 HA ILE 3 HA ILE 3 4.875 4.527 -3.737 19 HB ILE 3 HB ILE 3 6.704 2.166 -3.311 20 HG12 ILE 3 HG12 ILE 3 5.726 4.182 -1.279 21 HG13 ILE 3 HG13 ILE 3 5.163 2.518 -1.393 22 HG21 ILE 3 HG21 ILE 3 7.123 5.145 -3.266 23 HG22 ILE 3 HG22 ILE 3 8.287 3.993 -2.612 24 HG23 ILE 3 HG23 ILE 3 7.881 3.958 -4.328 25 HD11 ILE 3 HD11 ILE 3 6.725 2.408 0.292 26 HD12 ILE 3 HD12 ILE 3 7.668 1.924 -1.118 27 HD13 ILE 3 HD13 ILE 3 7.804 3.565 -0.488 28 H ASP 4 H ASP 4 6.156 5.186 -5.485 29 HA ASP 4 HA ASP 4 5.584 3.877 -7.950 30 HB2 ASP 4 HB2 ASP 4 7.186 5.651 -8.871 31 HB3 ASP 4 HB3 ASP 4 5.731 6.228 -8.063 32 HA PRO 5 HA PRO 5 9.041 1.234 -8.495 33 HB2 PRO 5 HB2 PRO 5 9.525 1.486 -11.154 34 HB3 PRO 5 HB3 PRO 5 8.122 0.624 -10.511 35 HG2 PRO 5 HG2 PRO 5 8.303 3.412 -11.585 36 HG3 PRO 5 HG3 PRO 5 7.053 2.185 -11.863 37 HD2 PRO 5 HD2 PRO 5 6.734 4.216 -10.101 38 HD3 PRO 5 HD3 PRO 5 6.006 2.616 -9.855 39 HA PRO 6 HA PRO 6 12.883 3.371 -8.423 40 HB2 PRO 6 HB2 PRO 6 14.563 1.628 -9.652 41 HB3 PRO 6 HB3 PRO 6 13.903 1.348 -8.037 42 HG2 PRO 6 HG2 PRO 6 13.002 0.243 -10.669 43 HG3 PRO 6 HG3 PRO 6 13.181 -0.584 -9.110 44 HD2 PRO 6 HD2 PRO 6 10.783 0.250 -10.051 45 HD3 PRO 6 HD3 PRO 6 11.166 0.207 -8.318 46 H CYS 7 H CYS 7 14.809 4.014 -9.857 47 HA CYS 7 HA CYS 7 13.808 5.427 -12.102 48 HB2 CYS 7 HB2 CYS 7 16.463 5.086 -10.798 49 HB3 CYS 7 HB3 CYS 7 16.442 5.683 -12.454 50 H ARG 8 H ARG 8 15.348 5.328 -14.184 51 HA ARG 8 HA ARG 8 14.612 3.078 -15.619 52 HB2 ARG 8 HB2 ARG 8 16.636 5.233 -16.030 53 HB3 ARG 8 HB3 ARG 8 16.673 3.836 -17.097 54 HG2 ARG 8 HG2 ARG 8 14.588 4.309 -17.999 55 HG3 ARG 8 HG3 ARG 8 14.128 5.337 -16.641 56 HD2 ARG 8 HD2 ARG 8 16.089 6.832 -17.412 57 HD3 ARG 8 HD3 ARG 8 15.972 5.935 -18.925 58 HE ARG 8 HE ARG 8 14.125 7.165 -19.434 59 HH11 ARG 8 HH11 ARG 8 14.586 7.243 -15.984 60 HH12 ARG 8 HH12 ARG 8 13.289 8.358 -15.705 61 HH21 ARG 8 HH21 ARG 8 12.416 8.633 -19.079 62 HH22 ARG 8 HH22 ARG 8 12.055 9.147 -17.466 63 H PHE 9 H PHE 9 16.358 1.698 -16.834 64 HA PHE 9 HA PHE 9 17.416 -0.123 -15.010 65 HB2 PHE 9 HB2 PHE 9 16.915 -0.694 -17.346 66 HB3 PHE 9 HB3 PHE 9 18.238 0.335 -17.886 67 HD1 PHE 9 HD1 PHE 9 17.864 -2.313 -15.279 68 HD2 PHE 9 HD2 PHE 9 20.016 -0.877 -18.658 69 HE1 PHE 9 HE1 PHE 9 19.412 -4.217 -15.097 70 HE2 PHE 9 HE2 PHE 9 21.567 -2.779 -18.483 71 HZ PHE 9 HZ PHE 9 21.266 -4.452 -16.701 72 H CYS 10 H CYS 10 19.048 0.116 -13.648 73 HA CYS 10 HA CYS 10 21.065 0.679 -12.760 74 HB2 CYS 10 HB2 CYS 10 21.619 0.724 -15.688 75 HB3 CYS 10 HB3 CYS 10 22.819 1.436 -14.614 76 H TYR 11 H TYR 11 18.957 2.663 -13.123 77 HA TYR 11 HA TYR 11 20.594 5.111 -13.229 78 HB2 TYR 11 HB2 TYR 11 17.820 4.521 -14.153 79 HB3 TYR 11 HB3 TYR 11 18.161 6.135 -13.538 80 HD1 TYR 11 HD1 TYR 11 20.298 3.844 -15.561 81 HD2 TYR 11 HD2 TYR 11 18.175 7.528 -15.399 82 HE1 TYR 11 HE1 TYR 11 21.234 4.473 -17.747 83 HE2 TYR 11 HE2 TYR 11 19.104 8.166 -17.585 84 HH TYR 11 HH TYR 11 20.031 6.920 -19.626 85 H HIS 12 H HIS 12 19.483 6.941 -11.920 86 HA HIS 12 HA HIS 12 17.996 6.181 -9.603 87 HB2 HIS 12 HB2 HIS 12 19.677 6.587 -7.916 88 HB3 HIS 12 HB3 HIS 12 20.263 5.336 -9.008 89 HD1 HIS 12 HD1 HIS 12 22.645 5.636 -9.545 90 HD2 HIS 12 HD2 HIS 12 20.745 9.280 -8.933 91 HE1 HIS 12 HE1 HIS 12 24.428 7.384 -9.850 92 H ARG 13 H ARG 13 17.351 7.976 -8.332 93 HA ARG 13 HA ARG 13 17.114 10.398 -9.803 94 HB2 ARG 13 HB2 ARG 13 15.566 9.308 -7.959 95 HB3 ARG 13 HB3 ARG 13 16.541 10.289 -6.874 96 HG2 ARG 13 HG2 ARG 13 15.955 12.221 -8.501 97 HG3 ARG 13 HG3 ARG 13 14.648 11.151 -9.014 98 HD2 ARG 13 HD2 ARG 13 15.154 11.922 -6.146 99 HD3 ARG 13 HD3 ARG 13 14.046 12.789 -7.209 100 HE ARG 13 HE ARG 13 13.564 10.307 -5.891 101 HH11 ARG 13 HH11 ARG 13 12.835 12.148 -8.754 102 HH12 ARG 13 HH12 ARG 13 11.317 11.360 -9.032 103 HH21 ARG 13 HH21 ARG 13 11.568 9.262 -6.247 104 HH22 ARG 13 HH22 ARG 13 10.597 9.719 -7.605 105 H ASP 14 H ASP 14 18.594 11.932 -9.983 106 HA ASP 14 HA ASP 14 20.815 12.067 -8.128 107 HB2 ASP 14 HB2 ASP 14 21.835 13.554 -9.679 108 HB3 ASP 14 HB3 ASP 14 21.035 12.316 -10.643 109 H GLY 15 H GLY 15 21.515 14.591 -7.837 110 HA2 GLY 15 HA2 GLY 15 19.789 15.577 -5.843 111 HA3 GLY 15 HA3 GLY 15 21.141 16.452 -6.547 112 H SER 16 H SER 16 19.909 16.154 -9.266 113 HA SER 16 HA SER 16 18.423 18.600 -9.209 114 HB2 SER 16 HB2 SER 16 19.990 17.755 -11.070 115 HB3 SER 16 HB3 SER 16 18.629 16.761 -11.587 116 HG SER 16 HG SER 16 17.606 18.492 -12.272 117 H GLY 17 H GLY 17 17.634 15.237 -9.159 118 HA2 GLY 17 HA2 GLY 17 15.474 14.516 -8.420 119 HA3 GLY 17 HA3 GLY 17 14.782 15.956 -9.151 120 H ASN 18 H ASN 18 17.127 13.944 -10.791 121 HA ASN 18 HA ASN 18 14.995 12.793 -12.449 122 HB2 ASN 18 HB2 ASN 18 17.227 14.560 -13.314 123 HB3 ASN 18 HB3 ASN 18 16.824 13.201 -14.359 124 HD21 ASN 18 HD21 ASN 18 16.095 16.356 -13.531 125 HD22 ASN 18 HD22 ASN 18 14.594 16.506 -14.373 126 H CYS 19 H CYS 19 15.632 10.892 -13.640 127 HA CYS 19 HA CYS 19 17.438 9.239 -12.121 128 HB2 CYS 19 HB2 CYS 19 15.882 8.593 -14.634 129 HB3 CYS 19 HB3 CYS 19 16.682 7.429 -13.582 130 H VAL 20 H VAL 20 19.464 8.661 -12.626 131 HA VAL 20 HA VAL 20 20.462 9.117 -15.340 132 HB VAL 20 HB VAL 20 22.536 10.158 -14.446 133 HG11 VAL 20 HG11 VAL 20 20.039 11.709 -13.773 134 HG12 VAL 20 HG12 VAL 20 21.619 12.372 -14.198 135 HG13 VAL 20 HG13 VAL 20 20.678 11.490 -15.402 136 HG21 VAL 20 HG21 VAL 20 22.472 9.394 -12.168 137 HG22 VAL 20 HG22 VAL 20 22.431 11.157 -12.172 138 HG23 VAL 20 HG23 VAL 20 20.953 10.242 -11.881 139 H TYR 21 H TYR 21 22.148 7.781 -15.952 140 HA TYR 21 HA TYR 21 22.296 5.248 -14.855 141 HB2 TYR 21 HB2 TYR 21 23.038 5.658 -17.113 142 HB3 TYR 21 HB3 TYR 21 24.316 6.728 -16.549 143 HD1 TYR 21 HD1 TYR 21 23.161 3.192 -16.365 144 HD2 TYR 21 HD2 TYR 21 26.450 5.882 -16.136 145 HE1 TYR 21 HE1 TYR 21 24.708 1.283 -16.271 146 HE2 TYR 21 HE2 TYR 21 28.006 3.980 -16.043 147 HH TYR 21 HH TYR 21 28.139 1.683 -16.540 148 H ASP 22 H ASP 22 23.195 4.454 -13.081 149 HA ASP 22 HA ASP 22 24.694 6.065 -11.293 150 HB2 ASP 22 HB2 ASP 22 23.182 3.963 -10.855 151 HB3 ASP 22 HB3 ASP 22 24.683 3.076 -11.104 152 H ALA 23 H ALA 23 26.490 6.780 -12.520 153 HA ALA 23 HA ALA 23 28.340 5.030 -13.752 154 HB1 ALA 23 HB1 ALA 23 28.202 7.896 -13.122 155 HB2 ALA 23 HB2 ALA 23 29.831 7.229 -13.227 156 HB3 ALA 23 HB3 ALA 23 28.727 7.079 -14.594 157 H TYR 24 H TYR 24 27.753 5.802 -10.488 158 HA TYR 24 HA TYR 24 30.442 5.208 -9.581 159 HB2 TYR 24 HB2 TYR 24 27.917 6.142 -8.319 160 HB3 TYR 24 HB3 TYR 24 29.047 5.261 -7.297 161 HD1 TYR 24 HD1 TYR 24 31.283 6.175 -6.841 162 HD2 TYR 24 HD2 TYR 24 28.418 8.357 -9.107 163 HE1 TYR 24 HE1 TYR 24 32.601 8.227 -6.521 164 HE2 TYR 24 HE2 TYR 24 29.729 10.414 -8.794 165 HH TYR 24 HH TYR 24 32.397 10.577 -6.596 166 H GLY 25 H GLY 25 28.071 3.341 -10.753 167 HA2 GLY 25 HA2 GLY 25 28.611 0.915 -10.641 168 HA3 GLY 25 HA3 GLY 25 28.684 1.122 -8.898 169 H CYS 26 H CYS 26 26.664 0.595 -11.626 170 HA CYS 26 HA CYS 26 24.214 0.944 -10.084 171 HB2 CYS 26 HB2 CYS 26 23.038 0.706 -12.135 172 HB3 CYS 26 HB3 CYS 26 24.447 1.698 -12.496 173 H GLY 27 H GLY 27 26.221 -1.201 -9.534 174 HA2 GLY 27 HA2 GLY 27 25.547 -3.248 -8.441 175 HA3 GLY 27 HA3 GLY 27 24.331 -3.459 -9.692 176 H ALA 28 H ALA 28 27.067 -2.371 -11.181 177 HA ALA 28 HA ALA 28 28.530 -4.840 -11.327 178 HB1 ALA 28 HB1 ALA 28 26.415 -4.297 -13.243 179 HB2 ALA 28 HB2 ALA 28 27.981 -4.552 -14.014 180 HB3 ALA 28 HB3 ALA 28 27.316 -5.783 -12.941 181 H VAL 29 H VAL 29 30.202 -3.388 -10.708 182 HA VAL 29 HA VAL 29 30.958 -1.281 -12.561 183 HB VAL 29 HB VAL 29 32.704 -0.723 -10.973 184 HG11 VAL 29 HG11 VAL 29 31.318 -0.181 -9.024 185 HG12 VAL 29 HG12 VAL 29 30.470 0.142 -10.538 186 HG13 VAL 29 HG13 VAL 29 30.081 -1.299 -9.598 187 HG21 VAL 29 HG21 VAL 29 33.361 -2.967 -10.311 188 HG22 VAL 29 HG22 VAL 29 32.985 -1.993 -8.889 189 HG23 VAL 29 HG23 VAL 29 31.826 -3.188 -9.471 Start of MODEL 5 1 H1 ILE 1 H ILE 1 -2.150 1.262 -0.338 2 HA ILE 1 HA ILE 1 -0.446 3.633 -0.369 3 HB ILE 1 HB ILE 1 -0.095 1.486 1.723 4 HG12 ILE 1 HG12 ILE 1 -2.087 2.832 2.205 5 HG13 ILE 1 HG13 ILE 1 -0.799 3.187 3.351 6 HG21 ILE 1 HG21 ILE 1 1.481 3.256 2.659 7 HG22 ILE 1 HG22 ILE 1 2.011 2.389 1.218 8 HG23 ILE 1 HG23 ILE 1 1.370 4.026 1.076 9 HD11 ILE 1 HD11 ILE 1 -1.971 5.201 2.625 10 HD12 ILE 1 HD12 ILE 1 -0.272 5.227 2.152 11 HD13 ILE 1 HD13 ILE 1 -1.514 4.862 0.956 12 H SER 2 H SER 2 1.120 3.349 -1.802 13 HA SER 2 HA SER 2 2.492 0.816 -2.045 14 HB2 SER 2 HB2 SER 2 1.980 0.362 -4.311 15 HB3 SER 2 HB3 SER 2 0.426 0.718 -3.559 16 HG SER 2 HG SER 2 0.917 1.790 -5.633 17 H ILE 3 H ILE 3 4.527 1.005 -2.937 18 HA ILE 3 HA ILE 3 5.493 3.743 -3.229 19 HB ILE 3 HB ILE 3 7.138 1.215 -3.189 20 HG12 ILE 3 HG12 ILE 3 5.775 1.401 -1.137 21 HG13 ILE 3 HG13 ILE 3 7.491 1.616 -0.808 22 HG21 ILE 3 HG21 ILE 3 7.829 4.109 -2.698 23 HG22 ILE 3 HG22 ILE 3 8.936 2.753 -2.486 24 HG23 ILE 3 HG23 ILE 3 8.303 3.132 -4.088 25 HD11 ILE 3 HD11 ILE 3 7.185 4.017 -0.685 26 HD12 ILE 3 HD12 ILE 3 5.474 3.832 -1.073 27 HD13 ILE 3 HD13 ILE 3 6.109 3.190 0.441 28 H ASP 4 H ASP 4 6.665 4.471 -5.014 29 HA ASP 4 HA ASP 4 5.848 3.361 -7.526 30 HB2 ASP 4 HB2 ASP 4 7.360 5.211 -8.440 31 HB3 ASP 4 HB3 ASP 4 5.977 5.718 -7.473 32 HA PRO 5 HA PRO 5 9.264 0.795 -8.522 33 HB2 PRO 5 HB2 PRO 5 9.537 1.239 -11.186 34 HB3 PRO 5 HB3 PRO 5 8.193 0.319 -10.498 35 HG2 PRO 5 HG2 PRO 5 8.277 3.178 -11.384 36 HG3 PRO 5 HG3 PRO 5 7.015 1.961 -11.650 37 HD2 PRO 5 HD2 PRO 5 6.825 3.860 -9.730 38 HD3 PRO 5 HD3 PRO 5 6.126 2.239 -9.542 39 HA PRO 6 HA PRO 6 13.090 2.961 -8.597 40 HB2 PRO 6 HB2 PRO 6 14.677 1.325 -10.072 41 HB3 PRO 6 HB3 PRO 6 14.146 0.926 -8.434 42 HG2 PRO 6 HG2 PRO 6 13.048 -0.001 -11.060 43 HG3 PRO 6 HG3 PRO 6 13.351 -0.933 -9.582 44 HD2 PRO 6 HD2 PRO 6 10.883 -0.059 -10.273 45 HD3 PRO 6 HD3 PRO 6 11.400 -0.220 -8.582 46 H CYS 7 H CYS 7 14.880 3.751 -10.109 47 HA CYS 7 HA CYS 7 13.671 5.239 -12.219 48 HB2 CYS 7 HB2 CYS 7 16.390 5.034 -11.022 49 HB3 CYS 7 HB3 CYS 7 16.265 5.710 -12.643 50 H ARG 8 H ARG 8 15.141 5.362 -14.352 51 HA ARG 8 HA ARG 8 14.519 3.139 -15.880 52 HB2 ARG 8 HB2 ARG 8 16.382 5.447 -16.243 53 HB3 ARG 8 HB3 ARG 8 16.451 4.116 -17.391 54 HG2 ARG 8 HG2 ARG 8 14.073 4.423 -17.884 55 HG3 ARG 8 HG3 ARG 8 14.019 5.769 -16.743 56 HD2 ARG 8 HD2 ARG 8 14.249 6.734 -18.888 57 HD3 ARG 8 HD3 ARG 8 15.834 6.850 -18.126 58 HE ARG 8 HE ARG 8 15.592 4.482 -19.686 59 HH11 ARG 8 HH11 ARG 8 16.127 7.916 -19.897 60 HH12 ARG 8 HH12 ARG 8 17.010 7.818 -21.384 61 HH21 ARG 8 HH21 ARG 8 16.754 4.341 -21.643 62 HH22 ARG 8 HH22 ARG 8 17.366 5.785 -22.377 63 H PHE 9 H PHE 9 16.318 1.958 -17.223 64 HA PHE 9 HA PHE 9 17.568 0.129 -15.534 65 HB2 PHE 9 HB2 PHE 9 17.047 -0.408 -17.850 66 HB3 PHE 9 HB3 PHE 9 18.195 0.802 -18.415 67 HD1 PHE 9 HD2 PHE 9 18.448 -1.852 -15.810 68 HD2 PHE 9 HD1 PHE 9 19.926 -0.273 -19.476 69 HE1 PHE 9 HE2 PHE 9 20.227 -3.552 -15.821 70 HE2 PHE 9 HE1 PHE 9 21.706 -1.971 -19.494 71 HZ PHE 9 HZ PHE 9 21.859 -3.613 -17.665 72 H CYS 10 H CYS 10 19.228 0.415 -14.214 73 HA CYS 10 HA CYS 10 21.228 1.079 -13.360 74 HB2 CYS 10 HB2 CYS 10 21.671 1.315 -16.297 75 HB3 CYS 10 HB3 CYS 10 22.851 2.068 -15.229 76 H TYR 11 H TYR 11 18.964 2.918 -13.560 77 HA TYR 11 HA TYR 11 20.416 5.483 -13.572 78 HB2 TYR 11 HB2 TYR 11 17.664 4.738 -14.449 79 HB3 TYR 11 HB3 TYR 11 17.907 6.338 -13.756 80 HD1 TYR 11 HD1 TYR 11 20.144 4.327 -15.958 81 HD2 TYR 11 HD2 TYR 11 17.752 7.821 -15.541 82 HE1 TYR 11 HE1 TYR 11 20.961 5.138 -18.131 83 HE2 TYR 11 HE2 TYR 11 18.561 8.641 -17.713 84 HH TYR 11 HH TYR 11 20.656 8.266 -19.157 85 H HIS 12 H HIS 12 19.213 7.153 -12.134 86 HA HIS 12 HA HIS 12 17.863 6.159 -9.820 87 HB2 HIS 12 HB2 HIS 12 19.563 6.603 -8.162 88 HB3 HIS 12 HB3 HIS 12 20.208 5.463 -9.339 89 HD1 HIS 12 HD1 HIS 12 22.540 5.978 -9.931 90 HD2 HIS 12 HD2 HIS 12 20.389 9.422 -9.049 91 HE1 HIS 12 HE1 HIS 12 24.172 7.875 -10.185 92 H ARG 13 H ARG 13 17.127 7.830 -8.435 93 HA ARG 13 HA ARG 13 16.659 10.300 -9.763 94 HB2 ARG 13 HB2 ARG 13 15.265 8.994 -7.931 95 HB3 ARG 13 HB3 ARG 13 16.192 10.004 -6.829 96 HG2 ARG 13 HG2 ARG 13 15.397 11.951 -8.342 97 HG3 ARG 13 HG3 ARG 13 14.168 10.801 -8.873 98 HD2 ARG 13 HD2 ARG 13 13.083 11.813 -7.121 99 HD3 ARG 13 HD3 ARG 13 13.831 10.444 -6.301 100 HE ARG 13 HE ARG 13 15.592 12.621 -6.202 101 HH11 ARG 13 HH11 ARG 13 12.510 11.624 -4.926 102 HH12 ARG 13 HH12 ARG 13 12.662 12.559 -3.475 103 HH21 ARG 13 HH21 ARG 13 15.804 13.856 -4.296 104 HH22 ARG 13 HH22 ARG 13 14.535 13.829 -3.118 105 H ASP 14 H ASP 14 17.989 11.972 -9.884 106 HA ASP 14 HA ASP 14 20.269 12.172 -8.108 107 HB2 ASP 14 HB2 ASP 14 21.101 13.831 -9.592 108 HB3 ASP 14 HB3 ASP 14 20.358 12.600 -10.609 109 H GLY 15 H GLY 15 20.734 14.797 -7.786 110 HA2 GLY 15 HA2 GLY 15 19.045 15.485 -5.622 111 HA3 GLY 15 HA3 GLY 15 20.276 16.516 -6.334 112 H SER 16 H SER 16 18.976 16.303 -9.006 113 HA SER 16 HA SER 16 17.254 18.571 -8.719 114 HB2 SER 16 HB2 SER 16 17.756 16.886 -11.184 115 HB3 SER 16 HB3 SER 16 17.088 18.518 -11.143 116 HG SER 16 HG SER 16 19.035 19.287 -10.991 117 H GLY 17 H GLY 17 16.804 15.159 -8.842 118 HA2 GLY 17 HA2 GLY 17 14.757 14.169 -8.117 119 HA3 GLY 17 HA3 GLY 17 13.898 15.578 -8.723 120 H ASN 18 H ASN 18 16.369 13.875 -10.537 121 HA ASN 18 HA ASN 18 14.297 12.675 -12.235 122 HB2 ASN 18 HB2 ASN 18 16.377 14.653 -13.017 123 HB3 ASN 18 HB3 ASN 18 16.056 13.336 -14.140 124 HD21 ASN 18 HD21 ASN 18 15.532 16.249 -14.281 125 HD22 ASN 18 HD22 ASN 18 13.847 16.388 -14.633 126 H CYS 19 H CYS 19 15.036 10.893 -13.534 127 HA CYS 19 HA CYS 19 17.005 9.302 -12.158 128 HB2 CYS 19 HB2 CYS 19 15.414 8.674 -14.654 129 HB3 CYS 19 HB3 CYS 19 16.335 7.520 -13.695 130 H VAL 20 H VAL 20 19.049 8.897 -12.757 131 HA VAL 20 HA VAL 20 19.919 9.565 -15.469 132 HB VAL 20 HB VAL 20 21.941 10.714 -14.582 133 HG11 VAL 20 HG11 VAL 20 20.904 12.829 -14.310 134 HG12 VAL 20 HG12 VAL 20 19.866 11.898 -15.391 135 HG13 VAL 20 HG13 VAL 20 19.421 12.101 -13.697 136 HG21 VAL 20 HG21 VAL 20 20.431 10.554 -11.977 137 HG22 VAL 20 HG22 VAL 20 22.005 9.847 -12.342 138 HG23 VAL 20 HG23 VAL 20 21.822 11.600 -12.259 139 H TYR 21 H TYR 21 21.684 8.397 -16.196 140 HA TYR 21 HA TYR 21 22.057 5.831 -15.240 141 HB2 TYR 21 HB2 TYR 21 22.695 6.418 -17.492 142 HB3 TYR 21 HB3 TYR 21 23.913 7.544 -16.902 143 HD1 TYR 21 HD1 TYR 21 23.011 3.929 -16.861 144 HD2 TYR 21 HD2 TYR 21 26.112 6.832 -16.620 145 HE1 TYR 21 HE1 TYR 21 24.689 2.131 -16.914 146 HE2 TYR 21 HE2 TYR 21 27.799 5.042 -16.673 147 HH TYR 21 HH TYR 21 27.776 2.519 -17.651 148 H ASP 22 H ASP 22 23.053 5.028 -13.524 149 HA ASP 22 HA ASP 22 24.490 6.657 -11.702 150 HB2 ASP 22 HB2 ASP 22 23.137 4.452 -11.308 151 HB3 ASP 22 HB3 ASP 22 24.671 3.664 -11.665 152 H ALA 23 H ALA 23 26.191 7.548 -12.958 153 HA ALA 23 HA ALA 23 28.121 5.988 -14.313 154 HB1 ALA 23 HB1 ALA 23 28.333 8.096 -15.068 155 HB2 ALA 23 HB2 ALA 23 27.813 8.808 -13.540 156 HB3 ALA 23 HB3 ALA 23 29.477 8.255 -13.734 157 H TYR 24 H TYR 24 27.578 6.561 -11.002 158 HA TYR 24 HA TYR 24 30.327 6.122 -10.194 159 HB2 TYR 24 HB2 TYR 24 27.779 6.807 -8.824 160 HB3 TYR 24 HB3 TYR 24 28.998 5.962 -7.876 161 HD1 TYR 24 HD1 TYR 24 29.252 8.628 -10.484 162 HD2 TYR 24 HD2 TYR 24 30.022 7.473 -6.462 163 HE1 TYR 24 HE1 TYR 24 30.423 10.757 -10.103 164 HE2 TYR 24 HE2 TYR 24 31.194 9.600 -6.069 165 HH TYR 24 HH TYR 24 31.588 11.988 -8.670 166 H GLY 25 H GLY 25 28.059 4.145 -11.395 167 HA2 GLY 25 HA2 GLY 25 28.780 1.763 -11.419 168 HA3 GLY 25 HA3 GLY 25 28.884 1.891 -9.669 169 H CYS 26 H CYS 26 26.833 1.355 -12.374 170 HA CYS 26 HA CYS 26 24.409 1.441 -10.755 171 HB2 CYS 26 HB2 CYS 26 23.194 1.226 -12.787 172 HB3 CYS 26 HB3 CYS 26 24.514 2.342 -13.123 173 H GLY 27 H GLY 27 26.576 -0.577 -10.372 174 HA2 GLY 27 HA2 GLY 27 25.848 -2.719 -9.352 175 HA3 GLY 27 HA3 GLY 27 24.938 -2.995 -10.829 176 H ALA 28 H ALA 28 27.902 -3.423 -9.236 177 HA ALA 28 HA ALA 28 28.905 -5.117 -11.286 178 HB1 ALA 28 HB1 ALA 28 29.818 -2.326 -11.228 179 HB2 ALA 28 HB2 ALA 28 31.102 -3.534 -11.295 180 HB3 ALA 28 HB3 ALA 28 29.851 -3.508 -12.537 181 H VAL 29 H VAL 29 28.947 -6.529 -9.493 182 HA VAL 29 HA VAL 29 30.751 -5.908 -7.291 183 HB VAL 29 HB VAL 29 30.004 -8.082 -6.358 184 HG11 VAL 29 HG11 VAL 29 28.786 -5.797 -6.132 185 HG12 VAL 29 HG12 VAL 29 27.543 -6.566 -7.121 186 HG13 VAL 29 HG13 VAL 29 27.993 -7.266 -5.565 187 HG21 VAL 29 HG21 VAL 29 27.772 -8.364 -8.226 188 HG22 VAL 29 HG22 VAL 29 29.348 -8.713 -8.935 189 HG23 VAL 29 HG23 VAL 29 28.810 -9.594 -7.505 Start of MODEL 6 1 H1 ILE 1 H ILE 1 -0.020 3.680 2.599 2 HA ILE 1 HA ILE 1 -0.697 3.921 -0.182 3 HB ILE 1 HB ILE 1 -0.168 5.904 1.172 4 HG12 ILE 1 HG12 ILE 1 1.504 6.918 -0.437 5 HG13 ILE 1 HG13 ILE 1 1.661 5.321 -1.160 6 HG21 ILE 1 HG21 ILE 1 2.736 5.426 1.093 7 HG22 ILE 1 HG22 ILE 1 1.745 6.210 2.323 8 HG23 ILE 1 HG23 ILE 1 1.831 4.450 2.250 9 HD11 ILE 1 HD11 ILE 1 -1.100 6.213 -0.915 10 HD12 ILE 1 HD12 ILE 1 -0.103 7.253 -1.932 11 HD13 ILE 1 HD13 ILE 1 -0.240 5.533 -2.297 12 H SER 2 H SER 2 0.344 3.122 -1.902 13 HA SER 2 HA SER 2 2.468 1.226 -1.491 14 HB2 SER 2 HB2 SER 2 0.532 1.070 -3.194 15 HB3 SER 2 HB3 SER 2 1.495 2.169 -4.181 16 HG SER 2 HG SER 2 2.801 0.587 -4.647 17 H ILE 3 H ILE 3 4.429 1.266 -2.904 18 HA ILE 3 HA ILE 3 5.556 3.980 -2.916 19 HB ILE 3 HB ILE 3 7.078 1.377 -3.024 20 HG12 ILE 3 HG12 ILE 3 7.590 2.257 -0.554 21 HG13 ILE 3 HG13 ILE 3 5.973 2.930 -0.736 22 HG21 ILE 3 HG21 ILE 3 7.872 4.245 -2.601 23 HG22 ILE 3 HG22 ILE 3 8.922 2.893 -2.180 24 HG23 ILE 3 HG23 ILE 3 8.420 3.131 -3.853 25 HD11 ILE 3 HD11 ILE 3 5.099 0.967 -0.236 26 HD12 ILE 3 HD12 ILE 3 5.918 0.234 -1.617 27 HD13 ILE 3 HD13 ILE 3 6.719 0.297 -0.047 28 H ASP 4 H ASP 4 6.753 4.732 -4.681 29 HA ASP 4 HA ASP 4 5.813 3.854 -7.230 30 HB2 ASP 4 HB2 ASP 4 6.775 5.767 -8.084 31 HB3 ASP 4 HB3 ASP 4 6.576 6.239 -6.398 32 HA PRO 5 HA PRO 5 8.908 0.990 -8.440 33 HB2 PRO 5 HB2 PRO 5 9.138 1.523 -11.093 34 HB3 PRO 5 HB3 PRO 5 7.730 0.714 -10.394 35 HG2 PRO 5 HG2 PRO 5 8.077 3.587 -11.162 36 HG3 PRO 5 HG3 PRO 5 6.689 2.516 -11.431 37 HD2 PRO 5 HD2 PRO 5 6.757 4.336 -9.428 38 HD3 PRO 5 HD3 PRO 5 5.902 2.788 -9.282 39 HA PRO 6 HA PRO 6 12.931 2.759 -8.568 40 HB2 PRO 6 HB2 PRO 6 14.293 1.040 -10.169 41 HB3 PRO 6 HB3 PRO 6 13.778 0.623 -8.530 42 HG2 PRO 6 HG2 PRO 6 12.505 -0.068 -11.150 43 HG3 PRO 6 HG3 PRO 6 12.759 -1.092 -9.724 44 HD2 PRO 6 HD2 PRO 6 10.373 0.057 -10.285 45 HD3 PRO 6 HD3 PRO 6 10.926 -0.232 -8.624 46 H CYS 7 H CYS 7 14.748 3.417 -10.122 47 HA CYS 7 HA CYS 7 13.587 5.053 -12.179 48 HB2 CYS 7 HB2 CYS 7 16.274 4.754 -10.933 49 HB3 CYS 7 HB3 CYS 7 16.201 5.462 -12.543 50 H ARG 8 H ARG 8 15.103 5.182 -14.279 51 HA ARG 8 HA ARG 8 14.454 3.009 -15.868 52 HB2 ARG 8 HB2 ARG 8 16.389 5.270 -16.144 53 HB3 ARG 8 HB3 ARG 8 16.437 3.964 -17.321 54 HG2 ARG 8 HG2 ARG 8 13.871 4.405 -17.490 55 HG3 ARG 8 HG3 ARG 8 14.300 5.975 -16.807 56 HD2 ARG 8 HD2 ARG 8 15.891 4.958 -19.103 57 HD3 ARG 8 HD3 ARG 8 14.260 5.547 -19.420 58 HE ARG 8 HE ARG 8 15.608 7.440 -17.856 59 HH11 ARG 8 HH11 ARG 8 15.691 6.090 -21.064 60 HH12 ARG 8 HH12 ARG 8 16.339 7.523 -21.791 61 HH21 ARG 8 HH21 ARG 8 16.461 9.333 -18.802 62 HH22 ARG 8 HH22 ARG 8 16.777 9.367 -20.503 63 H PHE 9 H PHE 9 16.248 1.809 -17.200 64 HA PHE 9 HA PHE 9 17.413 -0.090 -15.528 65 HB2 PHE 9 HB2 PHE 9 16.932 -0.571 -17.860 66 HB3 PHE 9 HB3 PHE 9 18.106 0.632 -18.382 67 HD1 PHE 9 HD2 PHE 9 18.018 -2.344 -16.126 68 HD2 PHE 9 HD1 PHE 9 20.100 -0.183 -19.145 69 HE1 PHE 9 HE2 PHE 9 19.770 -4.070 -16.149 70 HE2 PHE 9 HE1 PHE 9 21.855 -1.907 -19.173 71 HZ PHE 9 HZ PHE 9 21.693 -3.853 -17.672 72 H CYS 10 H CYS 10 19.051 0.122 -14.167 73 HA CYS 10 HA CYS 10 21.049 0.714 -13.255 74 HB2 CYS 10 HB2 CYS 10 21.562 1.001 -16.177 75 HB3 CYS 10 HB3 CYS 10 22.738 1.697 -15.067 76 H TYR 11 H TYR 11 18.841 2.618 -13.460 77 HA TYR 11 HA TYR 11 20.361 5.142 -13.388 78 HB2 TYR 11 HB2 TYR 11 17.609 4.491 -14.337 79 HB3 TYR 11 HB3 TYR 11 17.879 6.068 -13.604 80 HD1 TYR 11 HD1 TYR 11 20.109 4.046 -15.803 81 HD2 TYR 11 HD2 TYR 11 17.801 7.592 -15.359 82 HE1 TYR 11 HE1 TYR 11 20.993 4.881 -17.941 83 HE2 TYR 11 HE2 TYR 11 18.677 8.437 -17.496 84 HH TYR 11 HH TYR 11 20.518 8.129 -18.981 85 H HIS 12 H HIS 12 19.173 6.813 -11.939 86 HA HIS 12 HA HIS 12 17.750 5.807 -9.675 87 HB2 HIS 12 HB2 HIS 12 19.427 6.174 -7.974 88 HB3 HIS 12 HB3 HIS 12 20.064 5.039 -9.160 89 HD1 HIS 12 HD1 HIS 12 22.419 5.500 -9.699 90 HD2 HIS 12 HD2 HIS 12 20.349 8.984 -8.787 91 HE1 HIS 12 HE1 HIS 12 24.109 7.353 -9.884 92 H ARG 13 H ARG 13 17.026 7.467 -8.272 93 HA ARG 13 HA ARG 13 16.658 9.978 -9.556 94 HB2 ARG 13 HB2 ARG 13 15.102 8.744 -7.893 95 HB3 ARG 13 HB3 ARG 13 16.098 9.481 -6.646 96 HG2 ARG 13 HG2 ARG 13 14.430 11.026 -6.811 97 HG3 ARG 13 HG3 ARG 13 15.579 11.681 -7.980 98 HD2 ARG 13 HD2 ARG 13 14.139 11.414 -9.656 99 HD3 ARG 13 HD3 ARG 13 13.836 9.736 -9.208 100 HE ARG 13 HE ARG 13 12.215 12.025 -8.569 101 HH11 ARG 13 HH11 ARG 13 13.072 8.773 -7.667 102 HH12 ARG 13 HH12 ARG 13 11.584 8.473 -6.832 103 HH21 ARG 13 HH21 ARG 13 10.252 11.642 -7.473 104 HH22 ARG 13 HH22 ARG 13 9.980 10.106 -6.723 105 H ASP 14 H ASP 14 18.028 11.621 -9.598 106 HA ASP 14 HA ASP 14 20.268 11.715 -7.763 107 HB2 ASP 14 HB2 ASP 14 21.173 13.398 -9.180 108 HB3 ASP 14 HB3 ASP 14 20.434 12.206 -10.246 109 H GLY 15 H GLY 15 20.796 14.307 -7.343 110 HA2 GLY 15 HA2 GLY 15 19.064 14.982 -5.210 111 HA3 GLY 15 HA3 GLY 15 20.345 15.997 -5.854 112 H SER 16 H SER 16 19.104 15.886 -8.569 113 HA SER 16 HA SER 16 17.452 18.203 -8.267 114 HB2 SER 16 HB2 SER 16 17.935 16.565 -10.766 115 HB3 SER 16 HB3 SER 16 17.355 18.229 -10.687 116 HG SER 16 HG SER 16 19.760 17.658 -11.031 117 H GLY 17 H GLY 17 16.898 14.804 -8.549 118 HA2 GLY 17 HA2 GLY 17 14.798 13.872 -7.868 119 HA3 GLY 17 HA3 GLY 17 14.003 15.319 -8.470 120 H ASN 18 H ASN 18 16.471 13.587 -10.256 121 HA ASN 18 HA ASN 18 14.411 12.479 -12.031 122 HB2 ASN 18 HB2 ASN 18 16.565 14.414 -12.715 123 HB3 ASN 18 HB3 ASN 18 16.240 13.129 -13.874 124 HD21 ASN 18 HD21 ASN 18 15.695 16.171 -13.564 125 HD22 ASN 18 HD22 ASN 18 14.065 16.319 -14.117 126 H CYS 19 H CYS 19 15.149 10.715 -13.368 127 HA CYS 19 HA CYS 19 17.037 9.039 -11.969 128 HB2 CYS 19 HB2 CYS 19 15.481 8.500 -14.508 129 HB3 CYS 19 HB3 CYS 19 16.351 7.304 -13.552 130 H VAL 20 H VAL 20 19.076 8.570 -12.544 131 HA VAL 20 HA VAL 20 20.020 9.269 -15.223 132 HB VAL 20 HB VAL 20 22.053 10.347 -14.278 133 HG11 VAL 20 HG11 VAL 20 19.930 11.559 -15.055 134 HG12 VAL 20 HG12 VAL 20 19.628 11.842 -13.340 135 HG13 VAL 20 HG13 VAL 20 21.095 12.468 -14.094 136 HG21 VAL 20 HG21 VAL 20 20.498 10.157 -11.704 137 HG22 VAL 20 HG22 VAL 20 22.072 9.446 -12.058 138 HG23 VAL 20 HG23 VAL 20 21.903 11.197 -11.937 139 H TYR 21 H TYR 21 21.768 8.066 -15.936 140 HA TYR 21 HA TYR 21 22.049 5.474 -15.021 141 HB2 TYR 21 HB2 TYR 21 22.752 6.083 -17.248 142 HB3 TYR 21 HB3 TYR 21 23.986 7.164 -16.612 143 HD1 TYR 21 HD1 TYR 21 22.986 3.576 -16.668 144 HD2 TYR 21 HD2 TYR 21 26.158 6.385 -16.287 145 HE1 TYR 21 HE1 TYR 21 24.615 1.734 -16.720 146 HE2 TYR 21 HE2 TYR 21 27.796 4.551 -16.339 147 HH TYR 21 HH TYR 21 28.051 2.305 -16.189 148 H ASP 22 H ASP 22 22.989 4.608 -13.304 149 HA ASP 22 HA ASP 22 24.430 6.163 -11.420 150 HB2 ASP 22 HB2 ASP 22 23.010 3.986 -11.099 151 HB3 ASP 22 HB3 ASP 22 24.532 3.166 -11.437 152 H ALA 23 H ALA 23 26.180 7.031 -12.624 153 HA ALA 23 HA ALA 23 28.095 5.446 -13.970 154 HB1 ALA 23 HB1 ALA 23 28.337 7.577 -14.671 155 HB2 ALA 23 HB2 ALA 23 27.878 8.259 -13.110 156 HB3 ALA 23 HB3 ALA 23 29.512 7.645 -13.357 157 H TYR 24 H TYR 24 27.499 5.968 -10.659 158 HA TYR 24 HA TYR 24 30.218 5.439 -9.805 159 HB2 TYR 24 HB2 TYR 24 27.661 6.166 -8.473 160 HB3 TYR 24 HB3 TYR 24 28.836 5.270 -7.517 161 HD1 TYR 24 HD2 TYR 24 28.579 8.275 -9.715 162 HD2 TYR 24 HD1 TYR 24 30.505 6.430 -6.401 163 HE1 TYR 24 HE2 TYR 24 29.798 10.364 -9.268 164 HE2 TYR 24 HE1 TYR 24 31.728 8.514 -5.943 165 HH TYR 24 HH TYR 24 32.456 10.543 -7.236 166 H GLY 25 H GLY 25 27.924 3.548 -11.092 167 HA2 GLY 25 HA2 GLY 25 28.578 1.148 -11.149 168 HA3 GLY 25 HA3 GLY 25 28.651 1.239 -9.396 169 H CYS 26 H CYS 26 26.641 0.814 -12.151 170 HA CYS 26 HA CYS 26 24.188 0.934 -10.578 171 HB2 CYS 26 HB2 CYS 26 23.009 0.793 -12.639 172 HB3 CYS 26 HB3 CYS 26 24.365 1.880 -12.925 173 H GLY 27 H GLY 27 26.291 -1.150 -10.194 174 HA2 GLY 27 HA2 GLY 27 25.559 -3.294 -9.235 175 HA3 GLY 27 HA3 GLY 27 24.564 -3.500 -10.668 176 H ALA 28 H ALA 28 27.385 -2.114 -11.661 177 HA ALA 28 HA ALA 28 28.352 -4.641 -12.712 178 HB1 ALA 28 HB1 ALA 28 29.510 -3.424 -14.289 179 HB2 ALA 28 HB2 ALA 28 28.133 -2.369 -13.967 180 HB3 ALA 28 HB3 ALA 28 29.698 -2.027 -13.229 181 H VAL 29 H VAL 29 28.672 -3.556 -9.816 182 HA VAL 29 HA VAL 29 31.592 -3.899 -9.635 183 HB VAL 29 HB VAL 29 29.772 -2.699 -7.546 184 HG11 VAL 29 HG11 VAL 29 31.751 -3.576 -6.550 185 HG12 VAL 29 HG12 VAL 29 32.767 -2.878 -7.814 186 HG13 VAL 29 HG13 VAL 29 31.948 -1.827 -6.659 187 HG21 VAL 29 HG21 VAL 29 29.816 -1.338 -9.599 188 HG22 VAL 29 HG22 VAL 29 30.595 -0.527 -8.240 189 HG23 VAL 29 HG23 VAL 29 31.576 -1.275 -9.500 Start of MODEL 7 1 H1 ILE 1 H ILE 1 1.318 0.021 1.817 2 HA ILE 1 HA ILE 1 0.003 1.670 -0.188 3 HB ILE 1 HB ILE 1 0.584 3.272 1.582 4 HG12 ILE 1 HG12 ILE 1 2.574 3.787 -0.591 5 HG13 ILE 1 HG13 ILE 1 0.871 3.646 -1.016 6 HG21 ILE 1 HG21 ILE 1 2.686 1.749 2.153 7 HG22 ILE 1 HG22 ILE 1 3.489 2.921 1.108 8 HG23 ILE 1 HG23 ILE 1 2.633 3.467 2.550 9 HD11 ILE 1 HD11 ILE 1 2.302 5.833 0.220 10 HD12 ILE 1 HD12 ILE 1 0.718 5.809 -0.558 11 HD13 ILE 1 HD13 ILE 1 0.873 5.366 1.142 12 H SER 2 H SER 2 0.921 1.463 -2.143 13 HA SER 2 HA SER 2 3.253 -0.260 -2.369 14 HB2 SER 2 HB2 SER 2 2.710 -0.184 -4.826 15 HB3 SER 2 HB3 SER 2 1.413 -0.817 -3.813 16 HG SER 2 HG SER 2 0.246 0.662 -4.734 17 H ILE 3 H ILE 3 5.149 0.284 -3.459 18 HA ILE 3 HA ILE 3 5.632 3.179 -3.674 19 HB ILE 3 HB ILE 3 7.700 1.003 -3.363 20 HG12 ILE 3 HG12 ILE 3 6.627 2.884 -1.251 21 HG13 ILE 3 HG13 ILE 3 6.173 1.189 -1.395 22 HG21 ILE 3 HG21 ILE 3 7.791 3.898 -3.783 23 HG22 ILE 3 HG22 ILE 3 8.797 3.325 -2.454 24 HG23 ILE 3 HG23 ILE 3 9.020 2.668 -4.075 25 HD11 ILE 3 HD11 ILE 3 8.804 2.368 -0.602 26 HD12 ILE 3 HD12 ILE 3 7.796 1.204 0.261 27 HD13 ILE 3 HD13 ILE 3 8.678 0.707 -1.183 28 H ASP 4 H ASP 4 6.775 4.011 -5.441 29 HA ASP 4 HA ASP 4 6.251 2.736 -7.926 30 HB2 ASP 4 HB2 ASP 4 7.689 4.657 -8.828 31 HB3 ASP 4 HB3 ASP 4 6.214 5.092 -7.968 32 HA PRO 5 HA PRO 5 9.880 0.388 -8.665 33 HB2 PRO 5 HB2 PRO 5 10.261 0.766 -11.326 34 HB3 PRO 5 HB3 PRO 5 8.949 -0.222 -10.675 35 HG2 PRO 5 HG2 PRO 5 8.884 2.606 -11.653 36 HG3 PRO 5 HG3 PRO 5 7.723 1.296 -11.939 37 HD2 PRO 5 HD2 PRO 5 7.305 3.236 -10.097 38 HD3 PRO 5 HD3 PRO 5 6.709 1.577 -9.888 39 HA PRO 6 HA PRO 6 13.549 2.811 -8.623 40 HB2 PRO 6 HB2 PRO 6 15.319 1.244 -9.959 41 HB3 PRO 6 HB3 PRO 6 14.731 0.861 -8.337 42 HG2 PRO 6 HG2 PRO 6 13.837 -0.223 -10.980 43 HG3 PRO 6 HG3 PRO 6 14.125 -1.084 -9.458 44 HD2 PRO 6 HD2 PRO 6 11.643 -0.406 -10.301 45 HD3 PRO 6 HD3 PRO 6 12.081 -0.478 -8.582 46 H CYS 7 H CYS 7 15.375 3.650 -10.085 47 HA CYS 7 HA CYS 7 14.197 5.045 -12.258 48 HB2 CYS 7 HB2 CYS 7 16.902 4.898 -11.021 49 HB3 CYS 7 HB3 CYS 7 16.790 5.540 -12.657 50 H ARG 8 H ARG 8 15.695 5.144 -14.372 51 HA ARG 8 HA ARG 8 15.122 2.885 -15.866 52 HB2 ARG 8 HB2 ARG 8 16.985 5.194 -16.248 53 HB3 ARG 8 HB3 ARG 8 17.049 3.848 -17.377 54 HG2 ARG 8 HG2 ARG 8 14.496 4.200 -17.575 55 HG3 ARG 8 HG3 ARG 8 14.832 5.785 -16.874 56 HD2 ARG 8 HD2 ARG 8 16.071 6.475 -18.699 57 HD3 ARG 8 HD3 ARG 8 16.438 4.825 -19.201 58 HE ARG 8 HE ARG 8 14.519 4.822 -20.441 59 HH11 ARG 8 HH11 ARG 8 14.361 7.416 -18.125 60 HH12 ARG 8 HH12 ARG 8 12.899 8.082 -18.775 61 HH21 ARG 8 HH21 ARG 8 12.595 5.689 -21.306 62 HH22 ARG 8 HH22 ARG 8 11.895 7.098 -20.584 63 H PHE 9 H PHE 9 16.945 1.689 -17.155 64 HA PHE 9 HA PHE 9 18.190 -0.090 -15.411 65 HB2 PHE 9 HB2 PHE 9 17.711 -0.690 -17.716 66 HB3 PHE 9 HB3 PHE 9 18.838 0.530 -18.299 67 HD1 PHE 9 HD1 PHE 9 19.127 -2.056 -15.631 68 HD2 PHE 9 HD2 PHE 9 20.597 -0.536 -19.325 69 HE1 PHE 9 HE1 PHE 9 20.940 -3.719 -15.591 70 HE2 PHE 9 HE2 PHE 9 22.412 -2.196 -19.291 71 HZ PHE 9 HZ PHE 9 22.585 -3.792 -17.423 72 H CYS 10 H CYS 10 19.824 0.245 -14.071 73 HA CYS 10 HA CYS 10 21.806 0.947 -13.203 74 HB2 CYS 10 HB2 CYS 10 22.293 1.123 -16.138 75 HB3 CYS 10 HB3 CYS 10 23.452 1.901 -15.065 76 H TYR 11 H TYR 11 19.532 2.760 -13.476 77 HA TYR 11 HA TYR 11 20.961 5.336 -13.529 78 HB2 TYR 11 HB2 TYR 11 18.231 4.547 -14.431 79 HB3 TYR 11 HB3 TYR 11 18.447 6.164 -13.770 80 HD1 TYR 11 HD1 TYR 11 20.732 4.121 -15.895 81 HD2 TYR 11 HD2 TYR 11 18.314 7.609 -15.587 82 HE1 TYR 11 HE1 TYR 11 21.576 4.891 -18.073 83 HE2 TYR 11 HE2 TYR 11 19.151 8.388 -17.764 84 HH TYR 11 HH TYR 11 20.396 7.901 -19.540 85 H HIS 12 H HIS 12 19.729 7.029 -12.148 86 HA HIS 12 HA HIS 12 18.348 6.081 -9.834 87 HB2 HIS 12 HB2 HIS 12 20.018 6.572 -8.159 88 HB3 HIS 12 HB3 HIS 12 20.688 5.409 -9.300 89 HD1 HIS 12 HD1 HIS 12 23.025 5.925 -9.873 90 HD2 HIS 12 HD2 HIS 12 20.844 9.374 -9.092 91 HE1 HIS 12 HE1 HIS 12 24.651 7.824 -10.143 92 H ARG 13 H ARG 13 17.568 7.776 -8.509 93 HA ARG 13 HA ARG 13 17.129 10.218 -9.900 94 HB2 ARG 13 HB2 ARG 13 15.540 9.079 -8.278 95 HB3 ARG 13 HB3 ARG 13 16.556 9.700 -6.985 96 HG2 ARG 13 HG2 ARG 13 15.993 11.918 -7.446 97 HG3 ARG 13 HG3 ARG 13 15.371 11.519 -9.048 98 HD2 ARG 13 HD2 ARG 13 13.340 11.422 -8.149 99 HD3 ARG 13 HD3 ARG 13 13.863 9.980 -7.280 100 HE ARG 13 HE ARG 13 13.492 12.626 -6.197 101 HH11 ARG 13 HH11 ARG 13 15.009 9.520 -5.782 102 HH12 ARG 13 HH12 ARG 13 15.184 9.688 -4.066 103 HH21 ARG 13 HH21 ARG 13 13.716 12.859 -3.939 104 HH22 ARG 13 HH22 ARG 13 14.447 11.588 -3.019 105 H ASP 14 H ASP 14 18.417 11.925 -9.983 106 HA ASP 14 HA ASP 14 20.663 12.152 -8.166 107 HB2 ASP 14 HB2 ASP 14 21.488 13.845 -9.629 108 HB3 ASP 14 HB3 ASP 14 20.816 12.579 -10.654 109 H GLY 15 H GLY 15 21.091 14.778 -7.827 110 HA2 GLY 15 HA2 GLY 15 19.358 15.444 -5.695 111 HA3 GLY 15 HA3 GLY 15 20.582 16.495 -6.390 112 H SER 16 H SER 16 19.299 16.226 -9.081 113 HA SER 16 HA SER 16 17.541 18.476 -8.819 114 HB2 SER 16 HB2 SER 16 18.045 16.818 -11.297 115 HB3 SER 16 HB3 SER 16 17.458 18.479 -11.222 116 HG SER 16 HG SER 16 19.449 19.162 -10.600 117 H GLY 17 H GLY 17 17.167 15.043 -9.046 118 HA2 GLY 17 HA2 GLY 17 15.121 14.019 -8.319 119 HA3 GLY 17 HA3 GLY 17 14.248 15.408 -8.949 120 H ASN 18 H ASN 18 16.795 13.738 -10.692 121 HA ASN 18 HA ASN 18 14.784 12.508 -12.443 122 HB2 ASN 18 HB2 ASN 18 16.873 14.498 -13.171 123 HB3 ASN 18 HB3 ASN 18 16.596 13.173 -14.297 124 HD21 ASN 18 HD21 ASN 18 15.627 16.214 -13.349 125 HD22 ASN 18 HD22 ASN 18 14.118 16.287 -14.188 126 H CYS 19 H CYS 19 15.537 10.698 -13.659 127 HA CYS 19 HA CYS 19 17.505 9.151 -12.234 128 HB2 CYS 19 HB2 CYS 19 15.949 8.462 -14.736 129 HB3 CYS 19 HB3 CYS 19 16.865 7.334 -13.742 130 H VAL 20 H VAL 20 19.561 8.763 -12.794 131 HA VAL 20 HA VAL 20 20.459 9.377 -15.511 132 HB VAL 20 HB VAL 20 22.463 10.556 -14.619 133 HG11 VAL 20 HG11 VAL 20 20.243 11.638 -15.411 134 HG12 VAL 20 HG12 VAL 20 20.039 12.052 -13.707 135 HG13 VAL 20 HG13 VAL 20 21.447 12.635 -14.596 136 HG21 VAL 20 HG21 VAL 20 22.288 11.500 -12.318 137 HG22 VAL 20 HG22 VAL 20 20.912 10.432 -12.036 138 HG23 VAL 20 HG23 VAL 20 22.506 9.750 -12.361 139 H TYR 21 H TYR 21 22.244 8.211 -16.192 140 HA TYR 21 HA TYR 21 22.622 5.666 -15.182 141 HB2 TYR 21 HB2 TYR 21 23.287 6.212 -17.436 142 HB3 TYR 21 HB3 TYR 21 24.486 7.362 -16.853 143 HD1 TYR 21 HD2 TYR 21 23.618 3.740 -16.750 144 HD2 TYR 21 HD1 TYR 21 26.688 6.677 -16.530 145 HE1 TYR 21 HE2 TYR 21 25.314 1.958 -16.744 146 HE2 TYR 21 HE1 TYR 21 28.393 4.904 -16.525 147 HH TYR 21 HH TYR 21 27.633 1.623 -17.221 148 H ASP 22 H ASP 22 23.602 4.902 -13.439 149 HA ASP 22 HA ASP 22 25.001 6.576 -11.628 150 HB2 ASP 22 HB2 ASP 22 23.663 4.358 -11.221 151 HB3 ASP 22 HB3 ASP 22 25.217 3.589 -11.528 152 H ALA 23 H ALA 23 26.712 7.461 -12.871 153 HA ALA 23 HA ALA 23 28.674 5.893 -14.172 154 HB1 ALA 23 HB1 ALA 23 28.840 7.999 -14.962 155 HB2 ALA 23 HB2 ALA 23 28.353 8.729 -13.431 156 HB3 ALA 23 HB3 ALA 23 30.011 8.168 -13.654 157 H TYR 24 H TYR 24 28.081 6.530 -10.881 158 HA TYR 24 HA TYR 24 30.823 6.132 -10.028 159 HB2 TYR 24 HB2 TYR 24 28.252 6.825 -8.706 160 HB3 TYR 24 HB3 TYR 24 29.464 6.011 -7.724 161 HD1 TYR 24 HD2 TYR 24 29.162 8.881 -10.099 162 HD2 TYR 24 HD1 TYR 24 31.026 7.304 -6.615 163 HE1 TYR 24 HE2 TYR 24 30.310 11.028 -9.748 164 HE2 TYR 24 HE1 TYR 24 32.179 9.446 -6.254 165 HH TYR 24 HH TYR 24 31.328 12.286 -7.877 166 H GLY 25 H GLY 25 28.589 4.111 -11.216 167 HA2 GLY 25 HA2 GLY 25 29.329 1.734 -11.178 168 HA3 GLY 25 HA3 GLY 25 29.407 1.901 -9.431 169 H CYS 26 H CYS 26 27.400 1.291 -12.152 170 HA CYS 26 HA CYS 26 24.951 1.393 -10.572 171 HB2 CYS 26 HB2 CYS 26 23.769 1.122 -12.615 172 HB3 CYS 26 HB3 CYS 26 25.089 2.235 -12.962 173 H GLY 27 H GLY 27 27.136 -0.599 -10.118 174 HA2 GLY 27 HA2 GLY 27 25.902 -3.116 -10.915 175 HA3 GLY 27 HA3 GLY 27 27.438 -2.926 -10.083 176 H ALA 28 H ALA 28 25.276 -0.987 -8.528 177 HA ALA 28 HA ALA 28 25.015 -2.885 -6.348 178 HB1 ALA 28 HB1 ALA 28 24.553 0.059 -6.630 179 HB2 ALA 28 HB2 ALA 28 23.932 -0.823 -5.233 180 HB3 ALA 28 HB3 ALA 28 25.665 -0.800 -5.563 181 H VAL 29 H VAL 29 23.386 -2.817 -8.994 182 HA VAL 29 HA VAL 29 20.677 -2.526 -7.992 183 HB VAL 29 HB VAL 29 21.283 -1.801 -10.295 184 HG11 VAL 29 HG11 VAL 29 22.505 -4.306 -10.424 185 HG12 VAL 29 HG12 VAL 29 21.129 -4.402 -11.525 186 HG13 VAL 29 HG13 VAL 29 22.337 -3.132 -11.729 187 HG21 VAL 29 HG21 VAL 29 19.227 -2.351 -11.183 188 HG22 VAL 29 HG22 VAL 29 19.281 -4.002 -10.565 189 HG23 VAL 29 HG23 VAL 29 18.961 -2.659 -9.467 Start of MODEL 8 1 H1 ILE 1 H ILE 1 -1.743 2.953 -0.471 2 HA ILE 1 HA ILE 1 0.712 4.176 0.560 3 HB ILE 1 HB ILE 1 -0.109 1.325 1.027 4 HG12 ILE 1 HG12 ILE 1 -1.010 3.758 2.584 5 HG13 ILE 1 HG13 ILE 1 -2.040 2.692 1.635 6 HG21 ILE 1 HG21 ILE 1 2.092 2.871 1.770 7 HG22 ILE 1 HG22 ILE 1 1.107 2.732 3.225 8 HG23 ILE 1 HG23 ILE 1 1.650 1.279 2.385 9 HD11 ILE 1 HD11 ILE 1 -1.038 0.870 3.258 10 HD12 ILE 1 HD12 ILE 1 -0.818 2.277 4.300 11 HD13 ILE 1 HD13 ILE 1 -2.426 1.860 3.708 12 H SER 2 H SER 2 0.178 3.535 -2.308 13 HA SER 2 HA SER 2 2.097 1.401 -2.836 14 HB2 SER 2 HB2 SER 2 1.368 1.511 -5.126 15 HB3 SER 2 HB3 SER 2 -0.069 1.558 -4.106 16 HG SER 2 HG SER 2 -0.506 3.467 -4.858 17 H ILE 3 H ILE 3 4.145 1.742 -3.419 18 HA ILE 3 HA ILE 3 5.055 4.504 -3.706 19 HB ILE 3 HB ILE 3 6.747 2.016 -3.485 20 HG12 ILE 3 HG12 ILE 3 7.019 3.134 -1.074 21 HG13 ILE 3 HG13 ILE 3 5.383 3.679 -1.425 22 HG21 ILE 3 HG21 ILE 3 8.227 4.022 -2.468 23 HG22 ILE 3 HG22 ILE 3 8.275 3.531 -4.160 24 HG23 ILE 3 HG23 ILE 3 7.287 4.906 -3.670 25 HD11 ILE 3 HD11 ILE 3 4.602 1.713 -0.800 26 HD12 ILE 3 HD12 ILE 3 5.544 0.925 -2.066 27 HD13 ILE 3 HD13 ILE 3 6.244 1.163 -0.466 28 H ASP 4 H ASP 4 6.336 5.205 -5.434 29 HA ASP 4 HA ASP 4 5.640 4.117 -7.968 30 HB2 ASP 4 HB2 ASP 4 6.629 5.990 -8.882 31 HB3 ASP 4 HB3 ASP 4 6.286 6.571 -7.255 32 HA PRO 5 HA PRO 5 8.872 1.257 -8.751 33 HB2 PRO 5 HB2 PRO 5 9.283 1.612 -11.411 34 HB3 PRO 5 HB3 PRO 5 7.845 0.818 -10.759 35 HG2 PRO 5 HG2 PRO 5 8.188 3.639 -11.700 36 HG3 PRO 5 HG3 PRO 5 6.845 2.517 -11.992 37 HD2 PRO 5 HD2 PRO 5 6.731 4.472 -10.121 38 HD3 PRO 5 HD3 PRO 5 5.899 2.915 -9.928 39 HA PRO 6 HA PRO 6 12.857 3.114 -8.716 40 HB2 PRO 6 HB2 PRO 6 14.366 1.326 -10.091 41 HB3 PRO 6 HB3 PRO 6 13.742 1.009 -8.468 42 HG2 PRO 6 HG2 PRO 6 12.677 0.107 -11.117 43 HG3 PRO 6 HG3 PRO 6 12.848 -0.810 -9.608 44 HD2 PRO 6 HD2 PRO 6 10.485 0.237 -10.417 45 HD3 PRO 6 HD3 PRO 6 10.922 0.076 -8.704 46 H CYS 7 H CYS 7 14.768 3.712 -10.178 47 HA CYS 7 HA CYS 7 13.741 5.207 -12.394 48 HB2 CYS 7 HB2 CYS 7 16.364 4.945 -11.010 49 HB3 CYS 7 HB3 CYS 7 16.375 5.563 -12.659 50 H ARG 8 H ARG 8 15.354 5.196 -14.425 51 HA ARG 8 HA ARG 8 14.745 2.943 -15.916 52 HB2 ARG 8 HB2 ARG 8 16.733 5.155 -16.231 53 HB3 ARG 8 HB3 ARG 8 16.798 3.787 -17.334 54 HG2 ARG 8 HG2 ARG 8 14.348 4.215 -17.797 55 HG3 ARG 8 HG3 ARG 8 14.554 5.739 -16.932 56 HD2 ARG 8 HD2 ARG 8 16.143 6.520 -18.510 57 HD3 ARG 8 HD3 ARG 8 16.288 4.927 -19.252 58 HE ARG 8 HE ARG 8 14.416 5.372 -20.494 59 HH11 ARG 8 HH11 ARG 8 14.645 7.680 -17.898 60 HH12 ARG 8 HH12 ARG 8 13.351 8.670 -18.489 61 HH21 ARG 8 HH21 ARG 8 12.712 6.667 -21.283 62 HH22 ARG 8 HH22 ARG 8 12.252 8.092 -20.414 63 H PHE 9 H PHE 9 16.581 1.648 -17.094 64 HA PHE 9 HA PHE 9 17.641 -0.165 -15.263 65 HB2 PHE 9 HB2 PHE 9 17.258 -0.775 -17.584 66 HB3 PHE 9 HB3 PHE 9 18.473 0.382 -18.119 67 HD1 PHE 9 HD2 PHE 9 18.501 -2.169 -15.402 68 HD2 PHE 9 HD1 PHE 9 20.222 -0.791 -19.042 69 HE1 PHE 9 HE2 PHE 9 20.226 -3.916 -15.244 70 HE2 PHE 9 HE1 PHE 9 21.950 -2.536 -18.891 71 HZ PHE 9 HZ PHE 9 21.954 -4.101 -16.989 72 H CYS 10 H CYS 10 19.219 0.105 -13.844 73 HA CYS 10 HA CYS 10 21.183 0.724 -12.877 74 HB2 CYS 10 HB2 CYS 10 21.830 0.836 -15.784 75 HB3 CYS 10 HB3 CYS 10 22.965 1.582 -14.664 76 H TYR 11 H TYR 11 19.014 2.639 -13.290 77 HA TYR 11 HA TYR 11 20.565 5.145 -13.292 78 HB2 TYR 11 HB2 TYR 11 17.850 4.473 -14.326 79 HB3 TYR 11 HB3 TYR 11 18.110 6.086 -13.672 80 HD1 TYR 11 HD1 TYR 11 20.407 3.915 -15.649 81 HD2 TYR 11 HD2 TYR 11 18.131 7.508 -15.513 82 HE1 TYR 11 HE1 TYR 11 21.397 4.617 -17.789 83 HE2 TYR 11 HE2 TYR 11 19.114 8.219 -17.652 84 HH TYR 11 HH TYR 11 20.542 7.730 -19.275 85 H HIS 12 H HIS 12 19.337 6.910 -11.995 86 HA HIS 12 HA HIS 12 17.801 6.052 -9.745 87 HB2 HIS 12 HB2 HIS 12 19.405 6.496 -7.993 88 HB3 HIS 12 HB3 HIS 12 20.078 5.288 -9.083 89 HD1 HIS 12 HD1 HIS 12 22.462 5.690 -9.540 90 HD2 HIS 12 HD2 HIS 12 20.401 9.244 -8.922 91 HE1 HIS 12 HE1 HIS 12 24.183 7.511 -9.752 92 H ARG 13 H ARG 13 17.037 7.798 -8.473 93 HA ARG 13 HA ARG 13 16.763 10.235 -9.913 94 HB2 ARG 13 HB2 ARG 13 15.139 9.091 -8.223 95 HB3 ARG 13 HB3 ARG 13 16.068 9.959 -7.008 96 HG2 ARG 13 HG2 ARG 13 15.496 12.071 -8.005 97 HG3 ARG 13 HG3 ARG 13 14.687 11.258 -9.346 98 HD2 ARG 13 HD2 ARG 13 13.124 12.120 -7.624 99 HD3 ARG 13 HD3 ARG 13 13.008 10.378 -7.871 100 HE ARG 13 HE ARG 13 13.665 10.073 -5.705 101 HH11 ARG 13 HH11 ARG 13 14.498 13.307 -6.690 102 HH12 ARG 13 HH12 ARG 13 15.003 13.799 -5.107 103 HH21 ARG 13 HH21 ARG 13 14.327 10.709 -3.617 104 HH22 ARG 13 HH22 ARG 13 14.907 12.320 -3.360 105 H ASP 14 H ASP 14 18.158 11.856 -9.984 106 HA ASP 14 HA ASP 14 20.313 12.029 -8.056 107 HB2 ASP 14 HB2 ASP 14 21.304 13.620 -9.522 108 HB3 ASP 14 HB3 ASP 14 20.600 12.377 -10.551 109 H GLY 15 H GLY 15 20.849 14.652 -7.787 110 HA2 GLY 15 HA2 GLY 15 19.033 15.462 -5.768 111 HA3 GLY 15 HA3 GLY 15 20.359 16.423 -6.407 112 H SER 16 H SER 16 19.247 16.172 -9.167 113 HA SER 16 HA SER 16 17.617 18.523 -9.078 114 HB2 SER 16 HB2 SER 16 19.309 17.766 -10.910 115 HB3 SER 16 HB3 SER 16 17.954 16.828 -11.537 116 HG SER 16 HG SER 16 17.046 18.603 -12.218 117 H GLY 17 H GLY 17 17.024 15.123 -9.172 118 HA2 GLY 17 HA2 GLY 17 14.881 14.257 -8.548 119 HA3 GLY 17 HA3 GLY 17 14.137 15.677 -9.267 120 H ASN 18 H ASN 18 16.655 13.796 -10.823 121 HA ASN 18 HA ASN 18 14.665 12.618 -12.630 122 HB2 ASN 18 HB2 ASN 18 16.876 14.485 -13.323 123 HB3 ASN 18 HB3 ASN 18 16.586 13.138 -14.420 124 HD21 ASN 18 HD21 ASN 18 16.063 16.204 -14.295 125 HD22 ASN 18 HD22 ASN 18 14.465 16.336 -14.938 126 H CYS 19 H CYS 19 15.441 10.773 -13.831 127 HA CYS 19 HA CYS 19 17.238 9.159 -12.250 128 HB2 CYS 19 HB2 CYS 19 15.789 8.490 -14.821 129 HB3 CYS 19 HB3 CYS 19 16.598 7.342 -13.759 130 H VAL 20 H VAL 20 19.293 8.632 -12.704 131 HA VAL 20 HA VAL 20 20.366 9.162 -15.373 132 HB VAL 20 HB VAL 20 22.370 10.269 -14.402 133 HG11 VAL 20 HG11 VAL 20 19.938 11.853 -13.652 134 HG12 VAL 20 HG12 VAL 20 21.439 12.406 -14.399 135 HG13 VAL 20 HG13 VAL 20 20.286 11.453 -15.334 136 HG21 VAL 20 HG21 VAL 20 20.700 10.246 -11.894 137 HG22 VAL 20 HG22 VAL 20 22.280 9.499 -12.135 138 HG23 VAL 20 HG23 VAL 20 22.128 11.256 -12.122 139 H TYR 21 H TYR 21 22.127 7.899 -15.935 140 HA TYR 21 HA TYR 21 22.329 5.361 -14.861 141 HB2 TYR 21 HB2 TYR 21 23.140 5.831 -17.084 142 HB3 TYR 21 HB3 TYR 21 24.360 6.933 -16.456 143 HD1 TYR 21 HD1 TYR 21 23.313 3.360 -16.357 144 HD2 TYR 21 HD2 TYR 21 26.503 6.150 -15.981 145 HE1 TYR 21 HE1 TYR 21 24.917 1.499 -16.228 146 HE2 TYR 21 HE2 TYR 21 28.116 4.297 -15.853 147 HH TYR 21 HH TYR 21 27.988 1.677 -16.791 148 H ASP 22 H ASP 22 23.181 4.584 -13.057 149 HA ASP 22 HA ASP 22 24.556 6.228 -11.200 150 HB2 ASP 22 HB2 ASP 22 23.094 4.087 -10.824 151 HB3 ASP 22 HB3 ASP 22 24.621 3.235 -11.042 152 H ALA 23 H ALA 23 26.368 7.007 -12.374 153 HA ALA 23 HA ALA 23 28.321 5.328 -13.538 154 HB1 ALA 23 HB1 ALA 23 28.100 8.187 -12.851 155 HB2 ALA 23 HB2 ALA 23 29.737 7.545 -12.983 156 HB3 ALA 23 HB3 ALA 23 28.627 7.413 -14.346 157 H TYR 24 H TYR 24 27.585 6.044 -10.293 158 HA TYR 24 HA TYR 24 30.255 5.534 -9.287 159 HB2 TYR 24 HB2 TYR 24 27.651 6.364 -8.117 160 HB3 TYR 24 HB3 TYR 24 28.770 5.510 -7.059 161 HD1 TYR 24 HD2 TYR 24 28.213 8.568 -9.009 162 HD2 TYR 24 HD1 TYR 24 30.845 6.532 -6.357 163 HE1 TYR 24 HE2 TYR 24 29.437 10.666 -8.622 164 HE2 TYR 24 HE1 TYR 24 32.076 8.625 -5.963 165 HH TYR 24 HH TYR 24 31.086 11.660 -7.524 166 H GLY 25 H GLY 25 27.996 3.599 -10.569 167 HA2 GLY 25 HA2 GLY 25 28.620 1.192 -10.462 168 HA3 GLY 25 HA3 GLY 25 28.616 1.381 -8.715 169 H CYS 26 H CYS 26 26.724 0.823 -11.529 170 HA CYS 26 HA CYS 26 24.206 1.059 -10.077 171 HB2 CYS 26 HB2 CYS 26 23.117 0.816 -12.176 172 HB3 CYS 26 HB3 CYS 26 24.499 1.868 -12.462 173 H GLY 27 H GLY 27 26.264 -1.024 -9.485 174 HA2 GLY 27 HA2 GLY 27 25.894 -3.145 -8.542 175 HA3 GLY 27 HA3 GLY 27 24.415 -3.281 -9.482 176 H ALA 28 H ALA 28 26.753 -2.202 -11.540 177 HA ALA 28 HA ALA 28 27.033 -4.834 -12.732 178 HB1 ALA 28 HB1 ALA 28 26.515 -2.642 -13.977 179 HB2 ALA 28 HB2 ALA 28 28.244 -2.323 -13.831 180 HB3 ALA 28 HB3 ALA 28 27.682 -3.757 -14.690 181 H VAL 29 H VAL 29 28.518 -3.726 -10.236 182 HA VAL 29 HA VAL 29 31.285 -4.051 -11.113 183 HB VAL 29 HB VAL 29 30.227 -3.431 -8.352 184 HG11 VAL 29 HG11 VAL 29 32.954 -3.702 -9.517 185 HG12 VAL 29 HG12 VAL 29 32.684 -2.503 -8.251 186 HG13 VAL 29 HG13 VAL 29 32.345 -4.206 -7.941 187 HG21 VAL 29 HG21 VAL 29 31.598 -1.245 -9.557 188 HG22 VAL 29 HG22 VAL 29 30.333 -1.793 -10.658 189 HG23 VAL 29 HG23 VAL 29 29.925 -1.331 -9.006 Start of MODEL 9 1 H1 ILE 1 H ILE 1 -1.489 4.419 -1.169 2 HA ILE 1 HA ILE 1 0.001 3.097 1.004 3 HB ILE 1 HB ILE 1 -2.275 1.822 -0.492 4 HG12 ILE 1 HG12 ILE 1 -3.157 3.863 0.519 5 HG13 ILE 1 HG13 ILE 1 -3.739 2.451 1.394 6 HG21 ILE 1 HG21 ILE 1 -0.701 1.225 1.974 7 HG22 ILE 1 HG22 ILE 1 -2.353 0.627 1.823 8 HG23 ILE 1 HG23 ILE 1 -1.135 0.164 0.634 9 HD11 ILE 1 HD11 ILE 1 -2.147 4.687 2.317 10 HD12 ILE 1 HD12 ILE 1 -3.088 3.509 3.231 11 HD13 ILE 1 HD13 ILE 1 -1.438 3.129 2.741 12 H SER 2 H SER 2 1.359 3.854 -1.274 13 HA SER 2 HA SER 2 2.526 1.427 -2.095 14 HB2 SER 2 HB2 SER 2 0.846 0.910 -3.592 15 HB3 SER 2 HB3 SER 2 0.449 2.601 -3.894 16 HG SER 2 HG SER 2 1.490 1.889 -5.697 17 H ILE 3 H ILE 3 4.500 1.764 -3.024 18 HA ILE 3 HA ILE 3 5.301 4.569 -3.333 19 HB ILE 3 HB ILE 3 7.118 2.171 -3.126 20 HG12 ILE 3 HG12 ILE 3 6.175 4.033 -0.934 21 HG13 ILE 3 HG13 ILE 3 5.719 2.342 -1.111 22 HG21 ILE 3 HG21 ILE 3 8.790 3.862 -2.480 23 HG22 ILE 3 HG22 ILE 3 8.161 4.119 -4.107 24 HG23 ILE 3 HG23 ILE 3 7.596 5.127 -2.774 25 HD11 ILE 3 HD11 ILE 3 8.446 2.208 -1.088 26 HD12 ILE 3 HD12 ILE 3 8.116 3.527 0.036 27 HD13 ILE 3 HD13 ILE 3 7.391 1.942 0.300 28 H ASP 4 H ASP 4 6.464 5.283 -5.130 29 HA ASP 4 HA ASP 4 5.723 4.122 -7.607 30 HB2 ASP 4 HB2 ASP 4 7.395 5.839 -8.527 31 HB3 ASP 4 HB3 ASP 4 6.013 6.459 -7.628 32 HA PRO 5 HA PRO 5 8.970 1.306 -8.481 33 HB2 PRO 5 HB2 PRO 5 9.328 1.670 -11.147 34 HB3 PRO 5 HB3 PRO 5 7.908 0.863 -10.470 35 HG2 PRO 5 HG2 PRO 5 8.211 3.689 -11.411 36 HG3 PRO 5 HG3 PRO 5 6.872 2.558 -11.679 37 HD2 PRO 5 HD2 PRO 5 6.778 4.507 -9.802 38 HD3 PRO 5 HD3 PRO 5 5.963 2.944 -9.597 39 HA PRO 6 HA PRO 6 12.940 3.195 -8.516 40 HB2 PRO 6 HB2 PRO 6 14.437 1.420 -9.922 41 HB3 PRO 6 HB3 PRO 6 13.846 1.096 -8.289 42 HG2 PRO 6 HG2 PRO 6 12.739 0.190 -10.918 43 HG3 PRO 6 HG3 PRO 6 12.945 -0.728 -9.415 44 HD2 PRO 6 HD2 PRO 6 10.560 0.301 -10.178 45 HD3 PRO 6 HD3 PRO 6 11.030 0.142 -8.473 46 H CYS 7 H CYS 7 14.819 3.809 -10.013 47 HA CYS 7 HA CYS 7 13.743 5.306 -12.202 48 HB2 CYS 7 HB2 CYS 7 16.396 5.043 -10.877 49 HB3 CYS 7 HB3 CYS 7 16.370 5.665 -12.524 50 H ARG 8 H ARG 8 15.313 5.304 -14.268 51 HA ARG 8 HA ARG 8 14.672 3.059 -15.756 52 HB2 ARG 8 HB2 ARG 8 16.653 5.271 -16.102 53 HB3 ARG 8 HB3 ARG 8 16.696 3.908 -17.212 54 HG2 ARG 8 HG2 ARG 8 14.129 4.404 -17.422 55 HG3 ARG 8 HG3 ARG 8 14.617 6.004 -16.860 56 HD2 ARG 8 HD2 ARG 8 14.770 6.232 -19.153 57 HD3 ARG 8 HD3 ARG 8 16.426 5.816 -18.712 58 HE ARG 8 HE ARG 8 15.044 3.453 -19.287 59 HH11 ARG 8 HH11 ARG 8 16.201 6.311 -20.903 60 HH12 ARG 8 HH12 ARG 8 16.410 5.521 -22.430 61 HH21 ARG 8 HH21 ARG 8 15.316 2.401 -21.293 62 HH22 ARG 8 HH22 ARG 8 15.906 3.298 -22.651 63 H PHE 9 H PHE 9 16.483 1.768 -16.978 64 HA PHE 9 HA PHE 9 17.579 -0.055 -15.178 65 HB2 PHE 9 HB2 PHE 9 17.149 -0.653 -17.493 66 HB3 PHE 9 HB3 PHE 9 18.352 0.507 -18.048 67 HD1 PHE 9 HD2 PHE 9 18.242 -2.264 -15.544 68 HD2 PHE 9 HD1 PHE 9 20.277 -0.453 -18.814 69 HE1 PHE 9 HE2 PHE 9 19.971 -4.011 -15.431 70 HE2 PHE 9 HE1 PHE 9 22.009 -2.197 -18.707 71 HZ PHE 9 HZ PHE 9 21.858 -3.978 -17.013 72 H CYS 10 H CYS 10 19.186 0.207 -13.790 73 HA CYS 10 HA CYS 10 21.168 0.821 -12.860 74 HB2 CYS 10 HB2 CYS 10 21.758 0.944 -15.778 75 HB3 CYS 10 HB3 CYS 10 22.916 1.684 -14.677 76 H TYR 11 H TYR 11 18.994 2.740 -13.224 77 HA TYR 11 HA TYR 11 20.547 5.244 -13.245 78 HB2 TYR 11 HB2 TYR 11 17.811 4.579 -14.230 79 HB3 TYR 11 HB3 TYR 11 18.085 6.190 -13.574 80 HD1 TYR 11 HD2 TYR 11 20.343 4.026 -15.603 81 HD2 TYR 11 HD1 TYR 11 18.069 7.617 -15.411 82 HE1 TYR 11 HE2 TYR 11 21.293 4.737 -17.758 83 HE2 TYR 11 HE1 TYR 11 19.011 8.337 -17.566 84 HH TYR 11 HH TYR 11 21.125 6.222 -19.443 85 H HIS 12 H HIS 12 19.347 7.005 -11.918 86 HA HIS 12 HA HIS 12 17.853 6.141 -9.642 87 HB2 HIS 12 HB2 HIS 12 19.491 6.574 -7.919 88 HB3 HIS 12 HB3 HIS 12 20.141 5.370 -9.027 89 HD1 HIS 12 HD1 HIS 12 22.516 5.771 -9.532 90 HD2 HIS 12 HD2 HIS 12 20.475 9.325 -8.849 91 HE1 HIS 12 HE1 HIS 12 24.236 7.590 -9.767 92 H ARG 13 H ARG 13 17.116 7.883 -8.349 93 HA ARG 13 HA ARG 13 16.816 10.326 -9.772 94 HB2 ARG 13 HB2 ARG 13 15.253 9.156 -8.015 95 HB3 ARG 13 HB3 ARG 13 16.189 10.090 -6.856 96 HG2 ARG 13 HG2 ARG 13 15.576 12.150 -8.035 97 HG3 ARG 13 HG3 ARG 13 14.609 11.200 -9.165 98 HD2 ARG 13 HD2 ARG 13 13.117 12.080 -7.539 99 HD3 ARG 13 HD3 ARG 13 13.306 10.362 -7.193 100 HE ARG 13 HE ARG 13 15.108 12.040 -5.713 101 HH11 ARG 13 HH11 ARG 13 11.922 10.640 -5.801 102 HH12 ARG 13 HH12 ARG 13 11.699 10.716 -4.085 103 HH21 ARG 13 HH21 ARG 13 14.826 12.147 -3.452 104 HH22 ARG 13 HH22 ARG 13 13.351 11.575 -2.749 105 H ASP 14 H ASP 14 18.215 11.942 -9.872 106 HA ASP 14 HA ASP 14 20.411 12.107 -7.991 107 HB2 ASP 14 HB2 ASP 14 21.376 13.696 -9.475 108 HB3 ASP 14 HB3 ASP 14 20.643 12.459 -10.492 109 H GLY 15 H GLY 15 20.972 14.703 -7.688 110 HA2 GLY 15 HA2 GLY 15 19.199 15.520 -5.643 111 HA3 GLY 15 HA3 GLY 15 20.511 16.481 -6.309 112 H SER 16 H SER 16 19.333 16.239 -9.044 113 HA SER 16 HA SER 16 17.712 18.594 -8.910 114 HB2 SER 16 HB2 SER 16 18.169 16.828 -11.321 115 HB3 SER 16 HB3 SER 16 17.711 18.531 -11.310 116 HG SER 16 HG SER 16 20.084 17.769 -10.036 117 H GLY 17 H GLY 17 17.110 15.191 -9.027 118 HA2 GLY 17 HA2 GLY 17 14.979 14.331 -8.343 119 HA3 GLY 17 HA3 GLY 17 14.222 15.754 -9.043 120 H ASN 18 H ASN 18 16.703 13.894 -10.673 121 HA ASN 18 HA ASN 18 14.669 12.715 -12.432 122 HB2 ASN 18 HB2 ASN 18 16.864 14.582 -13.171 123 HB3 ASN 18 HB3 ASN 18 16.547 13.239 -14.266 124 HD21 ASN 18 HD21 ASN 18 16.117 16.219 -14.397 125 HD22 ASN 18 HD22 ASN 18 14.471 16.389 -14.892 126 H CYS 19 H CYS 19 15.414 10.873 -13.655 127 HA CYS 19 HA CYS 19 17.243 9.251 -12.123 128 HB2 CYS 19 HB2 CYS 19 15.744 8.597 -14.668 129 HB3 CYS 19 HB3 CYS 19 16.573 7.442 -13.629 130 H VAL 20 H VAL 20 19.290 8.727 -12.619 131 HA VAL 20 HA VAL 20 20.311 9.270 -15.305 132 HB VAL 20 HB VAL 20 22.334 10.372 -14.367 133 HG11 VAL 20 HG11 VAL 20 20.265 11.574 -15.269 134 HG12 VAL 20 HG12 VAL 20 19.893 11.933 -13.582 135 HG13 VAL 20 HG13 VAL 20 21.396 12.516 -14.298 136 HG21 VAL 20 HG21 VAL 20 22.284 9.589 -12.104 137 HG22 VAL 20 HG22 VAL 20 22.140 11.346 -12.078 138 HG23 VAL 20 HG23 VAL 20 20.713 10.341 -11.825 139 H TYR 21 H TYR 21 22.060 8.010 -15.908 140 HA TYR 21 HA TYR 21 22.282 5.466 -14.850 141 HB2 TYR 21 HB2 TYR 21 23.049 5.949 -17.087 142 HB3 TYR 21 HB3 TYR 21 24.283 7.045 -16.477 143 HD1 TYR 21 HD1 TYR 21 23.231 3.473 -16.372 144 HD2 TYR 21 HD2 TYR 21 26.434 6.256 -16.054 145 HE1 TYR 21 HE1 TYR 21 24.834 1.609 -16.285 146 HE2 TYR 21 HE2 TYR 21 28.046 4.400 -15.967 147 HH TYR 21 HH TYR 21 28.322 2.201 -15.943 148 H ASP 22 H ASP 22 23.164 4.684 -13.064 149 HA ASP 22 HA ASP 22 24.581 6.318 -11.230 150 HB2 ASP 22 HB2 ASP 22 23.120 4.184 -10.827 151 HB3 ASP 22 HB3 ASP 22 24.636 3.324 -11.084 152 H ALA 23 H ALA 23 26.374 7.097 -12.427 153 HA ALA 23 HA ALA 23 28.298 5.415 -13.638 154 HB1 ALA 23 HB1 ALA 23 29.733 7.625 -13.102 155 HB2 ALA 23 HB2 ALA 23 28.594 7.503 -14.444 156 HB3 ALA 23 HB3 ALA 23 28.101 8.273 -12.936 157 H TYR 24 H TYR 24 27.625 6.120 -10.377 158 HA TYR 24 HA TYR 24 30.313 5.600 -9.423 159 HB2 TYR 24 HB2 TYR 24 27.733 6.430 -8.201 160 HB3 TYR 24 HB3 TYR 24 28.870 5.570 -7.168 161 HD1 TYR 24 HD2 TYR 24 29.206 8.216 -9.795 162 HD2 TYR 24 HD1 TYR 24 30.035 7.007 -5.801 163 HE1 TYR 24 HE2 TYR 24 30.445 10.308 -9.424 164 HE2 TYR 24 HE1 TYR 24 31.275 9.096 -5.419 165 HH TYR 24 HH TYR 24 32.551 10.869 -7.416 166 H GLY 25 H GLY 25 28.026 3.675 -10.670 167 HA2 GLY 25 HA2 GLY 25 28.646 1.267 -10.586 168 HA3 GLY 25 HA3 GLY 25 28.676 1.448 -8.838 169 H CYS 26 H CYS 26 26.730 0.905 -11.618 170 HA CYS 26 HA CYS 26 24.240 1.141 -10.118 171 HB2 CYS 26 HB2 CYS 26 23.112 0.906 -12.198 172 HB3 CYS 26 HB3 CYS 26 24.490 1.958 -12.506 173 H GLY 27 H GLY 27 26.302 -0.947 -9.569 174 HA2 GLY 27 HA2 GLY 27 26.083 -3.095 -8.710 175 HA3 GLY 27 HA3 GLY 27 24.460 -3.166 -9.380 176 H ALA 28 H ALA 28 26.443 -2.143 -11.806 177 HA ALA 28 HA ALA 28 26.397 -4.754 -13.062 178 HB1 ALA 28 HB1 ALA 28 25.715 -2.805 -14.351 179 HB2 ALA 28 HB2 ALA 28 27.309 -2.084 -14.129 180 HB3 ALA 28 HB3 ALA 28 27.135 -3.565 -15.071 181 H VAL 29 H VAL 29 28.402 -3.508 -10.898 182 HA VAL 29 HA VAL 29 30.833 -4.558 -12.194 183 HB VAL 29 HB VAL 29 30.998 -2.178 -11.586 184 HG11 VAL 29 HG11 VAL 29 31.288 -2.270 -8.799 185 HG12 VAL 29 HG12 VAL 29 30.023 -1.457 -9.723 186 HG13 VAL 29 HG13 VAL 29 29.779 -3.110 -9.158 187 HG21 VAL 29 HG21 VAL 29 33.142 -2.296 -10.653 188 HG22 VAL 29 HG22 VAL 29 32.752 -3.735 -9.711 189 HG23 VAL 29 HG23 VAL 29 32.935 -3.850 -11.461 Start of MODEL 10 1 H1 ILE 1 H ILE 1 -1.570 0.609 0.266 2 HA ILE 1 HA ILE 1 -0.552 3.204 -0.681 3 HB ILE 1 HB ILE 1 -0.491 3.116 1.790 4 HG12 ILE 1 HG12 ILE 1 2.027 3.534 1.982 5 HG13 ILE 1 HG13 ILE 1 2.116 3.121 0.274 6 HG21 ILE 1 HG21 ILE 1 1.619 1.006 1.625 7 HG22 ILE 1 HG22 ILE 1 0.643 1.508 3.004 8 HG23 ILE 1 HG23 ILE 1 -0.083 0.553 1.711 9 HD11 ILE 1 HD11 ILE 1 2.016 5.553 0.731 10 HD12 ILE 1 HD12 ILE 1 0.714 4.968 -0.305 11 HD13 ILE 1 HD13 ILE 1 0.399 5.320 1.394 12 H SER 2 H SER 2 1.204 3.140 -1.982 13 HA SER 2 HA SER 2 2.881 0.792 -2.135 14 HB2 SER 2 HB2 SER 2 1.400 1.637 -4.629 15 HB3 SER 2 HB3 SER 2 2.433 0.224 -4.413 16 HG SER 2 HG SER 2 0.463 -0.607 -4.157 17 H ILE 3 H ILE 3 4.902 1.303 -2.754 18 HA ILE 3 HA ILE 3 5.484 4.087 -3.299 19 HB ILE 3 HB ILE 3 7.868 3.350 -3.199 20 HG12 ILE 3 HG12 ILE 3 6.948 0.719 -2.122 21 HG13 ILE 3 HG13 ILE 3 7.072 0.917 -3.866 22 HG21 ILE 3 HG21 ILE 3 7.141 4.191 -1.185 23 HG22 ILE 3 HG22 ILE 3 5.939 2.920 -0.966 24 HG23 ILE 3 HG23 ILE 3 7.649 2.569 -0.717 25 HD11 ILE 3 HD11 ILE 3 9.074 -0.024 -2.521 26 HD12 ILE 3 HD12 ILE 3 9.359 1.150 -3.807 27 HD13 ILE 3 HD13 ILE 3 9.370 1.667 -2.121 28 H ASP 4 H ASP 4 6.491 4.896 -5.126 29 HA ASP 4 HA ASP 4 5.815 3.692 -7.588 30 HB2 ASP 4 HB2 ASP 4 7.379 5.508 -8.523 31 HB3 ASP 4 HB3 ASP 4 5.964 6.038 -7.618 32 HA PRO 5 HA PRO 5 9.207 1.079 -8.535 33 HB2 PRO 5 HB2 PRO 5 9.502 1.482 -11.204 34 HB3 PRO 5 HB3 PRO 5 8.143 0.589 -10.512 35 HG2 PRO 5 HG2 PRO 5 8.266 3.434 -11.435 36 HG3 PRO 5 HG3 PRO 5 6.991 2.228 -11.693 37 HD2 PRO 5 HD2 PRO 5 6.813 4.156 -9.799 38 HD3 PRO 5 HD3 PRO 5 6.093 2.546 -9.594 39 HA PRO 6 HA PRO 6 13.060 3.197 -8.617 40 HB2 PRO 6 HB2 PRO 6 14.636 1.523 -10.060 41 HB3 PRO 6 HB3 PRO 6 14.090 1.153 -8.420 42 HG2 PRO 6 HG2 PRO 6 12.997 0.203 -11.039 43 HG3 PRO 6 HG3 PRO 6 13.280 -0.712 -9.547 44 HD2 PRO 6 HD2 PRO 6 10.827 0.181 -10.265 45 HD3 PRO 6 HD3 PRO 6 11.332 0.037 -8.569 46 H CYS 7 H CYS 7 14.878 3.926 -10.139 47 HA CYS 7 HA CYS 7 13.701 5.414 -12.267 48 HB2 CYS 7 HB2 CYS 7 16.414 5.166 -11.066 49 HB3 CYS 7 HB3 CYS 7 16.305 5.822 -12.697 50 H ARG 8 H ARG 8 15.174 5.479 -14.401 51 HA ARG 8 HA ARG 8 14.502 3.254 -15.904 52 HB2 ARG 8 HB2 ARG 8 16.392 5.530 -16.286 53 HB3 ARG 8 HB3 ARG 8 16.486 4.176 -17.405 54 HG2 ARG 8 HG2 ARG 8 14.245 4.500 -18.119 55 HG3 ARG 8 HG3 ARG 8 13.938 5.662 -16.826 56 HD2 ARG 8 HD2 ARG 8 15.065 7.344 -17.883 57 HD3 ARG 8 HD3 ARG 8 16.156 6.237 -18.715 58 HE ARG 8 HE ARG 8 14.666 6.120 -20.455 59 HH11 ARG 8 HH11 ARG 8 13.121 7.590 -17.703 60 HH12 ARG 8 HH12 ARG 8 11.705 8.059 -18.584 61 HH21 ARG 8 HH21 ARG 8 12.807 6.733 -21.626 62 HH22 ARG 8 HH22 ARG 8 11.527 7.571 -20.815 63 H PHE 9 H PHE 9 16.268 2.008 -17.227 64 HA PHE 9 HA PHE 9 17.474 0.172 -15.515 65 HB2 PHE 9 HB2 PHE 9 16.944 -0.384 -17.823 66 HB3 PHE 9 HB3 PHE 9 18.114 0.796 -18.405 67 HD1 PHE 9 HD1 PHE 9 18.341 -1.808 -15.750 68 HD2 PHE 9 HD2 PHE 9 19.802 -0.347 -19.471 69 HE1 PHE 9 HE1 PHE 9 20.086 -3.542 -15.741 70 HE2 PHE 9 HE2 PHE 9 21.549 -2.080 -19.469 71 HZ PHE 9 HZ PHE 9 21.692 -3.680 -17.603 72 H CYS 10 H CYS 10 19.136 0.439 -14.194 73 HA CYS 10 HA CYS 10 21.151 1.066 -13.345 74 HB2 CYS 10 HB2 CYS 10 21.606 1.248 -16.284 75 HB3 CYS 10 HB3 CYS 10 22.802 1.984 -15.223 76 H TYR 11 H TYR 11 18.935 2.958 -13.576 77 HA TYR 11 HA TYR 11 20.450 5.485 -13.624 78 HB2 TYR 11 HB2 TYR 11 17.683 4.797 -14.497 79 HB3 TYR 11 HB3 TYR 11 17.964 6.400 -13.827 80 HD1 TYR 11 HD1 TYR 11 20.154 4.299 -15.994 81 HD2 TYR 11 HD2 TYR 11 17.854 7.860 -15.634 82 HE1 TYR 11 HE1 TYR 11 20.996 5.057 -18.177 83 HE2 TYR 11 HE2 TYR 11 18.689 8.628 -17.816 84 HH TYR 11 HH TYR 11 21.055 7.968 -19.215 85 H HIS 12 H HIS 12 19.289 7.206 -12.214 86 HA HIS 12 HA HIS 12 17.907 6.283 -9.891 87 HB2 HIS 12 HB2 HIS 12 19.612 6.703 -8.233 88 HB3 HIS 12 HB3 HIS 12 20.231 5.531 -9.393 89 HD1 HIS 12 HD1 HIS 12 22.579 5.977 -9.979 90 HD2 HIS 12 HD2 HIS 12 20.513 9.487 -9.159 91 HE1 HIS 12 HE1 HIS 12 24.261 7.827 -10.253 92 H ARG 13 H ARG 13 17.212 7.993 -8.531 93 HA ARG 13 HA ARG 13 16.817 10.456 -9.897 94 HB2 ARG 13 HB2 ARG 13 15.317 9.268 -8.133 95 HB3 ARG 13 HB3 ARG 13 16.327 10.099 -6.958 96 HG2 ARG 13 HG2 ARG 13 15.714 12.247 -7.941 97 HG3 ARG 13 HG3 ARG 13 14.706 11.415 -9.127 98 HD2 ARG 13 HD2 ARG 13 13.273 12.199 -7.393 99 HD3 ARG 13 HD3 ARG 13 13.408 10.450 -7.220 100 HE ARG 13 HE ARG 13 15.352 11.505 -5.588 101 HH11 ARG 13 HH11 ARG 13 11.891 11.751 -5.864 102 HH12 ARG 13 HH12 ARG 13 11.645 12.029 -4.172 103 HH21 ARG 13 HH21 ARG 13 15.041 11.870 -3.358 104 HH22 ARG 13 HH22 ARG 13 13.438 12.097 -2.747 105 H ASP 14 H ASP 14 18.205 12.077 -10.045 106 HA ASP 14 HA ASP 14 20.472 12.246 -8.250 107 HB2 ASP 14 HB2 ASP 14 21.366 13.852 -9.759 108 HB3 ASP 14 HB3 ASP 14 20.604 12.615 -10.756 109 H GLY 15 H GLY 15 21.034 14.826 -7.922 110 HA2 GLY 15 HA2 GLY 15 19.331 15.621 -5.816 111 HA3 GLY 15 HA3 GLY 15 20.611 16.595 -6.522 112 H SER 16 H SER 16 19.324 16.357 -9.213 113 HA SER 16 HA SER 16 17.703 18.707 -9.003 114 HB2 SER 16 HB2 SER 16 19.243 18.143 -10.936 115 HB3 SER 16 HB3 SER 16 18.041 16.957 -11.444 116 HG SER 16 HG SER 16 17.018 18.542 -12.343 117 H GLY 17 H GLY 17 17.104 15.311 -9.061 118 HA2 GLY 17 HA2 GLY 17 15.012 14.431 -8.315 119 HA3 GLY 17 HA3 GLY 17 14.219 15.862 -8.958 120 H ASN 18 H ASN 18 16.620 14.010 -10.720 121 HA ASN 18 HA ASN 18 14.508 12.842 -12.388 122 HB2 ASN 18 HB2 ASN 18 16.630 14.753 -13.224 123 HB3 ASN 18 HB3 ASN 18 16.272 13.419 -14.318 124 HD21 ASN 18 HD21 ASN 18 15.594 16.522 -13.740 125 HD22 ASN 18 HD22 ASN 18 13.996 16.622 -14.388 126 H CYS 19 H CYS 19 15.201 11.021 -13.664 127 HA CYS 19 HA CYS 19 17.129 9.403 -12.262 128 HB2 CYS 19 HB2 CYS 19 15.524 8.779 -14.750 129 HB3 CYS 19 HB3 CYS 19 16.418 7.616 -13.777 130 H VAL 20 H VAL 20 19.166 8.955 -12.841 131 HA VAL 20 HA VAL 20 20.058 9.557 -15.564 132 HB VAL 20 HB VAL 20 22.107 10.663 -14.685 133 HG11 VAL 20 HG11 VAL 20 20.106 11.908 -15.531 134 HG12 VAL 20 HG12 VAL 20 19.596 12.104 -13.853 135 HG13 VAL 20 HG13 VAL 20 21.114 12.813 -14.403 136 HG21 VAL 20 HG21 VAL 20 20.587 10.572 -12.084 137 HG22 VAL 20 HG22 VAL 20 22.145 9.825 -12.435 138 HG23 VAL 20 HG23 VAL 20 22.004 11.582 -12.374 139 H TYR 21 H TYR 21 21.795 8.335 -16.271 140 HA TYR 21 HA TYR 21 22.097 5.772 -15.283 141 HB2 TYR 21 HB2 TYR 21 22.756 6.311 -17.540 142 HB3 TYR 21 HB3 TYR 21 23.999 7.415 -16.963 143 HD1 TYR 21 HD2 TYR 21 23.011 3.824 -16.881 144 HD2 TYR 21 HD1 TYR 21 26.180 6.655 -16.664 145 HE1 TYR 21 HE2 TYR 21 24.645 1.987 -16.905 146 HE2 TYR 21 HE1 TYR 21 27.824 4.825 -16.688 147 HH TYR 21 HH TYR 21 26.805 1.445 -17.024 148 H ASP 22 H ASP 22 23.074 4.961 -13.559 149 HA ASP 22 HA ASP 22 24.546 6.575 -11.751 150 HB2 ASP 22 HB2 ASP 22 23.140 4.402 -11.341 151 HB3 ASP 22 HB3 ASP 22 24.661 3.581 -11.678 152 H ALA 23 H ALA 23 26.270 7.412 -13.009 153 HA ALA 23 HA ALA 23 28.165 5.793 -14.345 154 HB1 ALA 23 HB1 ALA 23 28.427 7.888 -15.121 155 HB2 ALA 23 HB2 ALA 23 27.923 8.628 -13.601 156 HB3 ALA 23 HB3 ALA 23 29.573 8.033 -13.789 157 H TYR 24 H TYR 24 27.631 6.417 -11.041 158 HA TYR 24 HA TYR 24 30.367 5.920 -10.224 159 HB2 TYR 24 HB2 TYR 24 27.835 6.684 -8.866 160 HB3 TYR 24 HB3 TYR 24 29.031 5.821 -7.906 161 HD1 TYR 24 HD1 TYR 24 28.393 8.888 -9.853 162 HD2 TYR 24 HD2 TYR 24 31.050 6.885 -7.201 163 HE1 TYR 24 HE1 TYR 24 29.613 10.994 -9.494 164 HE2 TYR 24 HE2 TYR 24 32.276 8.985 -6.834 165 HH TYR 24 HH TYR 24 31.452 11.667 -7.091 166 H GLY 25 H GLY 25 28.053 3.986 -11.405 167 HA2 GLY 25 HA2 GLY 25 28.714 1.586 -11.399 168 HA3 GLY 25 HA3 GLY 25 28.820 1.732 -9.651 169 H CYS 26 H CYS 26 26.760 1.212 -12.352 170 HA CYS 26 HA CYS 26 24.336 1.380 -10.739 171 HB2 CYS 26 HB2 CYS 26 23.120 1.167 -12.770 172 HB3 CYS 26 HB3 CYS 26 24.468 2.244 -13.120 173 H GLY 27 H GLY 27 26.453 -0.685 -10.324 174 HA2 GLY 27 HA2 GLY 27 25.576 -2.793 -9.278 175 HA3 GLY 27 HA3 GLY 27 24.805 -3.085 -10.830 176 H ALA 28 H ALA 28 27.604 -3.508 -8.962 177 HA ALA 28 HA ALA 28 28.781 -5.235 -10.892 178 HB1 ALA 28 HB1 ALA 28 29.814 -3.601 -12.060 179 HB2 ALA 28 HB2 ALA 28 29.753 -2.454 -10.721 180 HB3 ALA 28 HB3 ALA 28 30.987 -3.713 -10.748 181 H VAL 29 H VAL 29 28.412 -6.464 -8.895 182 HA VAL 29 HA VAL 29 30.545 -6.035 -6.906 183 HB VAL 29 HB VAL 29 27.935 -7.509 -6.521 184 HG11 VAL 29 HG11 VAL 29 29.327 -8.500 -4.989 185 HG12 VAL 29 HG12 VAL 29 30.332 -7.060 -4.807 186 HG13 VAL 29 HG13 VAL 29 28.739 -7.127 -4.051 187 HG21 VAL 29 HG21 VAL 29 28.809 -4.742 -5.720 188 HG22 VAL 29 HG22 VAL 29 27.416 -5.202 -6.699 189 HG23 VAL 29 HG23 VAL 29 27.443 -5.574 -4.976 Start of MODEL 11 1 H1 ILE 1 H ILE 1 1.414 0.731 1.292 2 HA ILE 1 HA ILE 1 3.620 0.269 -0.409 3 HB ILE 1 HB ILE 1 1.878 -1.427 0.330 4 HG12 ILE 1 HG12 ILE 1 2.251 -1.498 -2.648 5 HG13 ILE 1 HG13 ILE 1 3.646 -1.603 -1.579 6 HG21 ILE 1 HG21 ILE 1 -0.169 -1.607 -0.754 7 HG22 ILE 1 HG22 ILE 1 -0.004 0.130 -0.499 8 HG23 ILE 1 HG23 ILE 1 0.333 -0.564 -2.085 9 HD11 ILE 1 HD11 ILE 1 3.244 -3.804 -1.745 10 HD12 ILE 1 HD12 ILE 1 2.068 -3.472 -0.473 11 HD13 ILE 1 HD13 ILE 1 1.544 -3.574 -2.153 12 H SER 2 H SER 2 1.884 2.880 -0.530 13 HA SER 2 HA SER 2 1.290 2.902 -3.391 14 HB2 SER 2 HB2 SER 2 0.866 5.155 -1.423 15 HB3 SER 2 HB3 SER 2 0.110 4.943 -3.002 16 HG SER 2 HG SER 2 -0.753 4.084 -0.650 17 H ILE 3 H ILE 3 3.982 2.646 -2.859 18 HA ILE 3 HA ILE 3 5.154 5.306 -3.156 19 HB ILE 3 HB ILE 3 6.613 2.669 -3.029 20 HG12 ILE 3 HG12 ILE 3 5.212 2.998 -1.016 21 HG13 ILE 3 HG13 ILE 3 6.932 3.077 -0.649 22 HG21 ILE 3 HG21 ILE 3 7.434 5.545 -2.791 23 HG22 ILE 3 HG22 ILE 3 8.427 4.239 -2.148 24 HG23 ILE 3 HG23 ILE 3 8.063 4.302 -3.872 25 HD11 ILE 3 HD11 ILE 3 6.731 5.120 0.177 26 HD12 ILE 3 HD12 ILE 3 5.872 5.688 -1.255 27 HD13 ILE 3 HD13 ILE 3 4.984 4.915 0.057 28 H ASP 4 H ASP 4 6.448 5.892 -4.918 29 HA ASP 4 HA ASP 4 5.584 4.843 -7.434 30 HB2 ASP 4 HB2 ASP 4 6.613 6.674 -8.390 31 HB3 ASP 4 HB3 ASP 4 6.340 7.276 -6.757 32 HA PRO 5 HA PRO 5 8.685 1.863 -8.297 33 HB2 PRO 5 HB2 PRO 5 9.025 2.189 -10.970 34 HB3 PRO 5 HB3 PRO 5 7.580 1.450 -10.269 35 HG2 PRO 5 HG2 PRO 5 7.995 4.252 -11.239 36 HG3 PRO 5 HG3 PRO 5 6.605 3.178 -11.481 37 HD2 PRO 5 HD2 PRO 5 6.619 5.146 -9.621 38 HD3 PRO 5 HD3 PRO 5 5.739 3.621 -9.392 39 HA PRO 6 HA PRO 6 12.734 3.574 -8.399 40 HB2 PRO 6 HB2 PRO 6 14.133 1.726 -9.814 41 HB3 PRO 6 HB3 PRO 6 13.550 1.438 -8.170 42 HG2 PRO 6 HG2 PRO 6 12.369 0.566 -10.779 43 HG3 PRO 6 HG3 PRO 6 12.555 -0.351 -9.273 44 HD2 PRO 6 HD2 PRO 6 10.207 0.778 -10.011 45 HD3 PRO 6 HD3 PRO 6 10.692 0.608 -8.312 46 H CYS 7 H CYS 7 14.620 4.089 -9.928 47 HA CYS 7 HA CYS 7 13.578 5.618 -12.115 48 HB2 CYS 7 HB2 CYS 7 16.233 5.259 -10.816 49 HB3 CYS 7 HB3 CYS 7 16.214 5.868 -12.468 50 H ARG 8 H ARG 8 15.125 5.538 -14.197 51 HA ARG 8 HA ARG 8 14.376 3.310 -15.661 52 HB2 ARG 8 HB2 ARG 8 16.421 5.452 -16.041 53 HB3 ARG 8 HB3 ARG 8 16.444 4.069 -17.127 54 HG2 ARG 8 HG2 ARG 8 14.167 4.519 -17.805 55 HG3 ARG 8 HG3 ARG 8 14.064 5.850 -16.651 56 HD2 ARG 8 HD2 ARG 8 14.478 6.633 -18.945 57 HD3 ARG 8 HD3 ARG 8 15.788 7.060 -17.845 58 HE ARG 8 HE ARG 8 17.195 5.795 -19.117 59 HH11 ARG 8 HH11 ARG 8 13.919 4.815 -19.769 60 HH12 ARG 8 HH12 ARG 8 14.359 3.731 -21.047 61 HH21 ARG 8 HH21 ARG 8 17.788 4.371 -20.798 62 HH22 ARG 8 HH22 ARG 8 16.560 3.479 -21.631 63 H PHE 9 H PHE 9 16.112 1.930 -16.887 64 HA PHE 9 HA PHE 9 17.152 0.079 -15.084 65 HB2 PHE 9 HB2 PHE 9 16.664 -0.504 -17.399 66 HB3 PHE 9 HB3 PHE 9 17.935 0.577 -17.963 67 HD1 PHE 9 HD1 PHE 9 17.937 -1.902 -15.188 68 HD2 PHE 9 HD2 PHE 9 19.520 -0.766 -18.972 69 HE1 PHE 9 HE1 PHE 9 19.557 -3.749 -15.061 70 HE2 PHE 9 HE2 PHE 9 21.142 -2.612 -18.852 71 HZ PHE 9 HZ PHE 9 21.161 -4.107 -16.895 72 H CYS 10 H CYS 10 18.782 0.291 -13.713 73 HA CYS 10 HA CYS 10 20.800 0.827 -12.812 74 HB2 CYS 10 HB2 CYS 10 21.363 0.898 -15.739 75 HB3 CYS 10 HB3 CYS 10 22.564 1.593 -14.655 76 H TYR 11 H TYR 11 18.706 2.834 -13.171 77 HA TYR 11 HA TYR 11 20.366 5.269 -13.238 78 HB2 TYR 11 HB2 TYR 11 17.594 4.712 -14.188 79 HB3 TYR 11 HB3 TYR 11 17.943 6.315 -13.552 80 HD1 TYR 11 HD2 TYR 11 20.076 4.032 -15.586 81 HD2 TYR 11 HD1 TYR 11 17.979 7.729 -15.397 82 HE1 TYR 11 HE2 TYR 11 21.034 4.680 -17.757 83 HE2 TYR 11 HE1 TYR 11 18.930 8.387 -17.568 84 HH TYR 11 HH TYR 11 20.857 7.853 -18.972 85 H HIS 12 H HIS 12 19.259 7.093 -11.917 86 HA HIS 12 HA HIS 12 17.750 6.320 -9.618 87 HB2 HIS 12 HB2 HIS 12 19.423 6.696 -7.915 88 HB3 HIS 12 HB3 HIS 12 20.008 5.453 -9.017 89 HD1 HIS 12 HD1 HIS 12 22.394 5.743 -9.544 90 HD2 HIS 12 HD2 HIS 12 20.518 9.391 -8.888 91 HE1 HIS 12 HE1 HIS 12 24.191 7.481 -9.816 92 H ARG 13 H ARG 13 17.102 8.105 -8.339 93 HA ARG 13 HA ARG 13 16.900 10.545 -9.784 94 HB2 ARG 13 HB2 ARG 13 15.294 9.470 -8.014 95 HB3 ARG 13 HB3 ARG 13 16.286 10.351 -6.860 96 HG2 ARG 13 HG2 ARG 13 15.792 12.351 -8.522 97 HG3 ARG 13 HG3 ARG 13 14.376 11.363 -8.886 98 HD2 ARG 13 HD2 ARG 13 15.075 11.829 -6.034 99 HD3 ARG 13 HD3 ARG 13 14.364 13.161 -6.944 100 HE ARG 13 HE ARG 13 12.865 10.784 -7.307 101 HH11 ARG 13 HH11 ARG 13 13.510 13.304 -4.994 102 HH12 ARG 13 HH12 ARG 13 11.972 13.158 -4.210 103 HH21 ARG 13 HH21 ARG 13 10.837 10.582 -6.283 104 HH22 ARG 13 HH22 ARG 13 10.453 11.609 -4.943 105 H ASP 14 H ASP 14 18.360 12.103 -9.907 106 HA ASP 14 HA ASP 14 20.582 12.185 -8.050 107 HB2 ASP 14 HB2 ASP 14 21.599 13.721 -9.554 108 HB3 ASP 14 HB3 ASP 14 20.803 12.510 -10.555 109 H GLY 15 H GLY 15 21.250 14.772 -7.795 110 HA2 GLY 15 HA2 GLY 15 19.544 15.674 -5.726 111 HA3 GLY 15 HA3 GLY 15 20.882 16.576 -6.422 112 H SER 16 H SER 16 19.660 16.361 -9.136 113 HA SER 16 HA SER 16 18.126 18.774 -8.997 114 HB2 SER 16 HB2 SER 16 19.721 17.860 -10.893 115 HB3 SER 16 HB3 SER 16 18.237 17.110 -11.482 116 HG SER 16 HG SER 16 18.068 19.023 -12.400 117 H GLY 17 H GLY 17 17.400 15.399 -9.062 118 HA2 GLY 17 HA2 GLY 17 15.249 14.616 -8.358 119 HA3 GLY 17 HA3 GLY 17 14.535 16.063 -9.055 120 H ASN 18 H ASN 18 16.925 14.094 -10.699 121 HA ASN 18 HA ASN 18 14.826 12.991 -12.431 122 HB2 ASN 18 HB2 ASN 18 17.091 14.760 -13.203 123 HB3 ASN 18 HB3 ASN 18 16.706 13.425 -14.286 124 HD21 ASN 18 HD21 ASN 18 16.422 16.382 -14.522 125 HD22 ASN 18 HD22 ASN 18 14.771 16.633 -14.967 126 H CYS 19 H CYS 19 15.455 11.096 -13.616 127 HA CYS 19 HA CYS 19 17.240 9.416 -12.101 128 HB2 CYS 19 HB2 CYS 19 15.687 8.806 -14.625 129 HB3 CYS 19 HB3 CYS 19 16.477 7.625 -13.585 130 H VAL 20 H VAL 20 19.263 8.825 -12.603 131 HA VAL 20 HA VAL 20 20.276 9.297 -15.308 132 HB VAL 20 HB VAL 20 22.358 10.307 -14.389 133 HG11 VAL 20 HG11 VAL 20 21.507 12.506 -14.276 134 HG12 VAL 20 HG12 VAL 20 20.395 11.615 -15.316 135 HG13 VAL 20 HG13 VAL 20 19.957 11.956 -13.641 136 HG21 VAL 20 HG21 VAL 20 22.277 9.543 -12.118 137 HG22 VAL 20 HG22 VAL 20 22.226 11.306 -12.109 138 HG23 VAL 20 HG23 VAL 20 20.749 10.379 -11.841 139 H TYR 21 H TYR 21 21.963 7.959 -15.922 140 HA TYR 21 HA TYR 21 22.082 5.412 -14.853 141 HB2 TYR 21 HB2 TYR 21 22.843 5.843 -17.101 142 HB3 TYR 21 HB3 TYR 21 24.128 6.894 -16.514 143 HD1 TYR 21 HD1 TYR 21 22.934 3.368 -16.367 144 HD2 TYR 21 HD2 TYR 21 26.251 6.020 -16.112 145 HE1 TYR 21 HE1 TYR 21 24.461 1.441 -16.285 146 HE2 TYR 21 HE2 TYR 21 27.787 4.101 -16.030 147 HH TYR 21 HH TYR 21 27.957 1.864 -16.351 148 H ASP 22 H ASP 22 22.958 4.593 -13.079 149 HA ASP 22 HA ASP 22 24.460 6.173 -11.265 150 HB2 ASP 22 HB2 ASP 22 22.923 4.086 -10.855 151 HB3 ASP 22 HB3 ASP 22 24.414 3.182 -11.105 152 H ALA 23 H ALA 23 26.266 6.878 -12.493 153 HA ALA 23 HA ALA 23 28.109 5.119 -13.719 154 HB1 ALA 23 HB1 ALA 23 29.629 7.281 -13.197 155 HB2 ALA 23 HB2 ALA 23 28.490 7.183 -14.541 156 HB3 ALA 23 HB3 ALA 23 28.019 7.984 -13.042 157 H TYR 24 H TYR 24 27.508 5.869 -10.453 158 HA TYR 24 HA TYR 24 30.185 5.244 -9.533 159 HB2 TYR 24 HB2 TYR 24 27.659 6.188 -8.280 160 HB3 TYR 24 HB3 TYR 24 28.774 5.288 -7.258 161 HD1 TYR 24 HD2 TYR 24 28.282 8.367 -9.189 162 HD2 TYR 24 HD1 TYR 24 30.918 6.217 -6.633 163 HE1 TYR 24 HE2 TYR 24 29.608 10.410 -8.849 164 HE2 TYR 24 HE1 TYR 24 32.251 8.254 -6.285 165 HH TYR 24 HH TYR 24 31.335 11.141 -6.682 166 H GLY 25 H GLY 25 27.805 3.407 -10.737 167 HA2 GLY 25 HA2 GLY 25 28.325 0.976 -10.644 168 HA3 GLY 25 HA3 GLY 25 28.388 1.167 -8.898 169 H CYS 26 H CYS 26 26.381 0.686 -11.646 170 HA CYS 26 HA CYS 26 23.925 1.038 -10.114 171 HB2 CYS 26 HB2 CYS 26 22.758 0.832 -12.174 172 HB3 CYS 26 HB3 CYS 26 24.176 1.819 -12.514 173 H GLY 27 H GLY 27 25.908 -1.130 -9.575 174 HA2 GLY 27 HA2 GLY 27 25.403 -3.213 -8.570 175 HA3 GLY 27 HA3 GLY 27 23.966 -3.322 -9.576 176 H ALA 28 H ALA 28 26.422 -2.329 -11.537 177 HA ALA 28 HA ALA 28 26.673 -4.969 -12.704 178 HB1 ALA 28 HB1 ALA 28 27.007 -3.891 -14.626 179 HB2 ALA 28 HB2 ALA 28 26.588 -2.419 -13.750 180 HB3 ALA 28 HB3 ALA 28 28.279 -2.884 -13.935 181 H VAL 29 H VAL 29 28.147 -3.645 -10.188 182 HA VAL 29 HA VAL 29 30.897 -4.284 -10.904 183 HB VAL 29 HB VAL 29 29.844 -3.383 -8.222 184 HG11 VAL 29 HG11 VAL 29 32.108 -2.795 -7.731 185 HG12 VAL 29 HG12 VAL 29 32.096 -4.463 -8.307 186 HG13 VAL 29 HG13 VAL 29 32.617 -3.163 -9.379 187 HG21 VAL 29 HG21 VAL 29 29.431 -1.407 -9.159 188 HG22 VAL 29 HG22 VAL 29 31.166 -1.254 -9.438 189 HG23 VAL 29 HG23 VAL 29 30.125 -1.920 -10.697 Start of MODEL 12 1 H1 ILE 1 H ILE 1 -2.409 1.514 -0.377 2 HA ILE 1 HA ILE 1 -1.331 3.829 -1.803 3 HB ILE 1 HB ILE 1 0.087 4.394 0.193 4 HG12 ILE 1 HG12 ILE 1 -1.975 2.840 1.756 5 HG13 ILE 1 HG13 ILE 1 -0.401 2.174 1.334 6 HG21 ILE 1 HG21 ILE 1 -2.897 4.732 0.448 7 HG22 ILE 1 HG22 ILE 1 -1.693 5.668 1.332 8 HG23 ILE 1 HG23 ILE 1 -1.786 5.788 -0.425 9 HD11 ILE 1 HD11 ILE 1 -1.109 3.843 3.519 10 HD12 ILE 1 HD12 ILE 1 0.449 3.108 3.143 11 HD13 ILE 1 HD13 ILE 1 0.048 4.701 2.502 12 H SER 2 H SER 2 0.853 3.661 -2.357 13 HA SER 2 HA SER 2 2.431 1.410 -1.503 14 HB2 SER 2 HB2 SER 2 1.537 1.551 -4.393 15 HB3 SER 2 HB3 SER 2 2.681 0.392 -3.718 16 HG SER 2 HG SER 2 1.000 -0.774 -3.284 17 H ILE 3 H ILE 3 4.586 1.397 -2.586 18 HA ILE 3 HA ILE 3 5.490 4.142 -2.922 19 HB ILE 3 HB ILE 3 7.183 1.646 -2.867 20 HG12 ILE 3 HG12 ILE 3 5.810 1.811 -0.822 21 HG13 ILE 3 HG13 ILE 3 7.518 2.067 -0.485 22 HG21 ILE 3 HG21 ILE 3 7.733 4.581 -2.687 23 HG22 ILE 3 HG22 ILE 3 8.832 3.419 -1.946 24 HG23 ILE 3 HG23 ILE 3 8.520 3.354 -3.680 25 HD11 ILE 3 HD11 ILE 3 5.308 3.749 0.101 26 HD12 ILE 3 HD12 ILE 3 7.010 3.970 0.509 27 HD13 ILE 3 HD13 ILE 3 6.380 4.593 -1.016 28 H ASP 4 H ASP 4 6.667 4.890 -4.697 29 HA ASP 4 HA ASP 4 5.852 3.850 -7.219 30 HB2 ASP 4 HB2 ASP 4 6.772 5.756 -8.141 31 HB3 ASP 4 HB3 ASP 4 6.491 6.298 -6.488 32 HA PRO 5 HA PRO 5 9.083 1.059 -8.224 33 HB2 PRO 5 HB2 PRO 5 9.352 1.476 -10.893 34 HB3 PRO 5 HB3 PRO 5 7.962 0.644 -10.186 35 HG2 PRO 5 HG2 PRO 5 8.213 3.489 -11.083 36 HG3 PRO 5 HG3 PRO 5 6.874 2.352 -11.330 37 HD2 PRO 5 HD2 PRO 5 6.826 4.266 -9.415 38 HD3 PRO 5 HD3 PRO 5 6.029 2.692 -9.213 39 HA PRO 6 HA PRO 6 13.035 2.981 -8.351 40 HB2 PRO 6 HB2 PRO 6 14.500 1.245 -9.838 41 HB3 PRO 6 HB3 PRO 6 13.964 0.885 -8.192 42 HG2 PRO 6 HG2 PRO 6 12.780 0.020 -10.802 43 HG3 PRO 6 HG3 PRO 6 13.042 -0.925 -9.324 44 HD2 PRO 6 HD2 PRO 6 10.625 0.099 -9.990 45 HD3 PRO 6 HD3 PRO 6 11.151 -0.088 -8.305 46 H CYS 7 H CYS 7 14.861 3.635 -9.897 47 HA CYS 7 HA CYS 7 13.702 5.162 -12.024 48 HB2 CYS 7 HB2 CYS 7 16.398 4.905 -10.787 49 HB3 CYS 7 HB3 CYS 7 16.312 5.560 -12.418 50 H ARG 8 H ARG 8 15.198 5.216 -14.138 51 HA ARG 8 HA ARG 8 14.540 2.993 -15.647 52 HB2 ARG 8 HB2 ARG 8 16.514 5.213 -16.010 53 HB3 ARG 8 HB3 ARG 8 16.498 3.879 -17.155 54 HG2 ARG 8 HG2 ARG 8 13.973 4.366 -17.344 55 HG3 ARG 8 HG3 ARG 8 14.382 5.917 -16.607 56 HD2 ARG 8 HD2 ARG 8 15.969 4.959 -18.941 57 HD3 ARG 8 HD3 ARG 8 14.357 5.619 -19.218 58 HE ARG 8 HE ARG 8 15.873 7.352 -17.571 59 HH11 ARG 8 HH11 ARG 8 15.543 6.290 -20.870 60 HH12 ARG 8 HH12 ARG 8 16.153 7.765 -21.543 61 HH21 ARG 8 HH21 ARG 8 16.679 9.299 -18.445 62 HH22 ARG 8 HH22 ARG 8 16.800 9.475 -20.162 63 H PHE 9 H PHE 9 16.289 1.706 -16.926 64 HA PHE 9 HA PHE 9 17.463 -0.124 -15.190 65 HB2 PHE 9 HB2 PHE 9 16.954 -0.702 -17.493 66 HB3 PHE 9 HB3 PHE 9 18.128 0.471 -18.079 67 HD1 PHE 9 HD2 PHE 9 18.200 -2.253 -15.526 68 HD2 PHE 9 HD1 PHE 9 19.959 -0.541 -19.003 69 HE1 PHE 9 HE2 PHE 9 19.943 -3.989 -15.495 70 HE2 PHE 9 HE1 PHE 9 21.704 -2.275 -18.978 71 HZ PHE 9 HZ PHE 9 21.699 -4.001 -17.222 72 H CYS 10 H CYS 10 19.103 0.153 -13.844 73 HA CYS 10 HA CYS 10 21.115 0.766 -12.977 74 HB2 CYS 10 HB2 CYS 10 21.619 0.919 -15.914 75 HB3 CYS 10 HB3 CYS 10 22.815 1.620 -14.829 76 H TYR 11 H TYR 11 18.929 2.680 -13.261 77 HA TYR 11 HA TYR 11 20.479 5.187 -13.322 78 HB2 TYR 11 HB2 TYR 11 17.718 4.525 -14.238 79 HB3 TYR 11 HB3 TYR 11 18.013 6.135 -13.590 80 HD1 TYR 11 HD1 TYR 11 20.193 3.954 -15.688 81 HD2 TYR 11 HD2 TYR 11 17.974 7.574 -15.413 82 HE1 TYR 11 HE1 TYR 11 21.087 4.661 -17.867 83 HE2 TYR 11 HE2 TYR 11 18.862 8.291 -17.592 84 HH TYR 11 HH TYR 11 21.486 6.944 -19.040 85 H HIS 12 H HIS 12 19.346 6.941 -11.951 86 HA HIS 12 HA HIS 12 17.875 6.096 -9.657 87 HB2 HIS 12 HB2 HIS 12 19.551 6.448 -7.956 88 HB3 HIS 12 HB3 HIS 12 20.155 5.249 -9.096 89 HD1 HIS 12 HD1 HIS 12 22.533 5.599 -9.620 90 HD2 HIS 12 HD2 HIS 12 20.589 9.191 -8.859 91 HE1 HIS 12 HE1 HIS 12 24.295 7.379 -9.850 92 H ARG 13 H ARG 13 17.226 7.845 -8.323 93 HA ARG 13 HA ARG 13 16.988 10.317 -9.717 94 HB2 ARG 13 HB2 ARG 13 16.032 9.208 -7.132 95 HB3 ARG 13 HB3 ARG 13 16.097 10.960 -7.272 96 HG2 ARG 13 HG2 ARG 13 14.701 10.816 -9.303 97 HG3 ARG 13 HG3 ARG 13 14.580 9.072 -9.060 98 HD2 ARG 13 HD2 ARG 13 13.702 9.668 -6.719 99 HD3 ARG 13 HD3 ARG 13 13.474 11.291 -7.371 100 HE ARG 13 HE ARG 13 11.897 8.957 -7.938 101 HH11 ARG 13 HH11 ARG 13 12.917 12.074 -9.105 102 HH12 ARG 13 HH12 ARG 13 11.541 12.284 -10.137 103 HH21 ARG 13 HH21 ARG 13 10.080 9.221 -9.292 104 HH22 ARG 13 HH22 ARG 13 9.928 10.661 -10.242 105 H ASP 14 H ASP 14 18.382 11.941 -9.759 106 HA ASP 14 HA ASP 14 20.632 11.978 -7.934 107 HB2 ASP 14 HB2 ASP 14 21.551 13.682 -9.355 108 HB3 ASP 14 HB3 ASP 14 20.865 12.433 -10.390 109 H GLY 15 H GLY 15 21.285 14.444 -7.381 110 HA2 GLY 15 HA2 GLY 15 19.628 15.221 -5.278 111 HA3 GLY 15 HA3 GLY 15 20.869 16.232 -6.004 112 H SER 16 H SER 16 19.365 15.924 -8.642 113 HA SER 16 HA SER 16 17.697 18.259 -8.253 114 HB2 SER 16 HB2 SER 16 19.308 17.847 -10.224 115 HB3 SER 16 HB3 SER 16 18.052 16.781 -10.855 116 HG SER 16 HG SER 16 18.161 19.508 -10.800 117 H GLY 17 H GLY 17 17.315 14.843 -8.692 118 HA2 GLY 17 HA2 GLY 17 15.284 13.761 -8.034 119 HA3 GLY 17 HA3 GLY 17 14.401 15.201 -8.519 120 H ASN 18 H ASN 18 16.897 13.602 -10.420 121 HA ASN 18 HA ASN 18 14.832 12.617 -12.262 122 HB2 ASN 18 HB2 ASN 18 17.157 14.412 -12.895 123 HB3 ASN 18 HB3 ASN 18 16.509 13.326 -14.121 124 HD21 ASN 18 HD21 ASN 18 16.214 16.313 -12.615 125 HD22 ASN 18 HD22 ASN 18 14.694 16.787 -13.286 126 H CYS 19 H CYS 19 15.216 10.643 -13.112 127 HA CYS 19 HA CYS 19 17.190 8.990 -11.972 128 HB2 CYS 19 HB2 CYS 19 15.575 8.517 -14.487 129 HB3 CYS 19 HB3 CYS 19 16.416 7.287 -13.548 130 H VAL 20 H VAL 20 19.259 8.712 -12.467 131 HA VAL 20 HA VAL 20 20.167 9.280 -15.202 132 HB VAL 20 HB VAL 20 22.219 10.350 -14.287 133 HG11 VAL 20 HG11 VAL 20 20.199 11.612 -15.113 134 HG12 VAL 20 HG12 VAL 20 19.741 11.824 -13.422 135 HG13 VAL 20 HG13 VAL 20 21.257 12.500 -14.017 136 HG21 VAL 20 HG21 VAL 20 20.678 10.219 -11.700 137 HG22 VAL 20 HG22 VAL 20 22.239 9.479 -12.053 138 HG23 VAL 20 HG23 VAL 20 22.096 11.234 -11.959 139 H TYR 21 H TYR 21 21.880 8.040 -15.921 140 HA TYR 21 HA TYR 21 22.153 5.463 -14.965 141 HB2 TYR 21 HB2 TYR 21 22.826 6.027 -17.212 142 HB3 TYR 21 HB3 TYR 21 24.082 7.106 -16.614 143 HD1 TYR 21 HD1 TYR 21 23.041 3.525 -16.532 144 HD2 TYR 21 HD2 TYR 21 26.252 6.311 -16.371 145 HE1 TYR 21 HE1 TYR 21 24.649 1.665 -16.578 146 HE2 TYR 21 HE2 TYR 21 27.870 4.459 -16.417 147 HH TYR 21 HH TYR 21 26.838 1.114 -16.197 148 H ASP 22 H ASP 22 23.086 4.637 -13.225 149 HA ASP 22 HA ASP 22 24.588 6.209 -11.407 150 HB2 ASP 22 HB2 ASP 22 23.134 4.051 -11.030 151 HB3 ASP 22 HB3 ASP 22 24.656 3.216 -11.332 152 H ALA 23 H ALA 23 26.346 7.015 -12.625 153 HA ALA 23 HA ALA 23 28.211 5.349 -13.959 154 HB1 ALA 23 HB1 ALA 23 28.068 8.197 -13.181 155 HB2 ALA 23 HB2 ALA 23 29.676 7.534 -13.478 156 HB3 ALA 23 HB3 ALA 23 28.445 7.461 -14.739 157 H TYR 24 H TYR 24 27.671 6.011 -10.663 158 HA TYR 24 HA TYR 24 30.393 5.465 -9.828 159 HB2 TYR 24 HB2 TYR 24 27.873 6.300 -8.490 160 HB3 TYR 24 HB3 TYR 24 29.046 5.420 -7.515 161 HD1 TYR 24 HD2 TYR 24 28.572 8.445 -9.598 162 HD2 TYR 24 HD1 TYR 24 30.999 6.481 -6.708 163 HE1 TYR 24 HE2 TYR 24 29.839 10.526 -9.257 164 HE2 TYR 24 HE1 TYR 24 32.272 8.556 -6.358 165 HH TYR 24 HH TYR 24 31.614 11.461 -8.279 166 H GLY 25 H GLY 25 28.040 3.571 -10.998 167 HA2 GLY 25 HA2 GLY 25 28.654 1.156 -10.960 168 HA3 GLY 25 HA3 GLY 25 28.741 1.321 -9.213 169 H CYS 26 H CYS 26 26.706 0.806 -11.931 170 HA CYS 26 HA CYS 26 24.264 1.057 -10.358 171 HB2 CYS 26 HB2 CYS 26 23.073 0.829 -12.401 172 HB3 CYS 26 HB3 CYS 26 24.453 1.863 -12.757 173 H GLY 27 H GLY 27 26.335 -1.046 -9.875 174 HA2 GLY 27 HA2 GLY 27 25.815 -3.139 -8.837 175 HA3 GLY 27 HA3 GLY 27 24.482 -3.328 -9.967 176 H ALA 28 H ALA 28 27.039 -2.186 -11.703 177 HA ALA 28 HA ALA 28 27.561 -4.815 -12.817 178 HB1 ALA 28 HB1 ALA 28 27.167 -3.112 -14.421 179 HB2 ALA 28 HB2 ALA 28 28.353 -2.041 -13.674 180 HB3 ALA 28 HB3 ALA 28 28.885 -3.502 -14.506 181 H VAL 29 H VAL 29 28.662 -3.642 -10.158 182 HA VAL 29 HA VAL 29 31.464 -4.406 -10.663 183 HB VAL 29 HB VAL 29 32.194 -2.894 -8.921 184 HG11 VAL 29 HG11 VAL 29 31.723 -0.757 -10.000 185 HG12 VAL 29 HG12 VAL 29 32.028 -2.016 -11.198 186 HG13 VAL 29 HG13 VAL 29 30.376 -1.486 -10.874 187 HG21 VAL 29 HG21 VAL 29 30.625 -2.647 -7.299 188 HG22 VAL 29 HG22 VAL 29 30.263 -1.187 -8.219 189 HG23 VAL 29 HG23 VAL 29 29.283 -2.636 -8.443 Start of MODEL 13 1 H1 ILE 1 H ILE 1 -0.832 0.494 1.653 2 HA ILE 1 HA ILE 1 1.386 2.123 1.208 3 HB ILE 1 HB ILE 1 1.416 -0.863 1.660 4 HG12 ILE 1 HG12 ILE 1 0.093 0.269 3.376 5 HG13 ILE 1 HG13 ILE 1 1.618 -0.292 4.051 6 HG21 ILE 1 HG21 ILE 1 3.605 0.010 2.898 7 HG22 ILE 1 HG22 ILE 1 3.600 -0.455 1.198 8 HG23 ILE 1 HG23 ILE 1 3.493 1.247 1.647 9 HD11 ILE 1 HD11 ILE 1 2.498 2.033 3.705 10 HD12 ILE 1 HD12 ILE 1 0.844 2.515 3.326 11 HD13 ILE 1 HD13 ILE 1 1.230 1.865 4.919 12 H SER 2 H SER 2 2.392 2.599 -0.619 13 HA SER 2 HA SER 2 3.164 0.549 -2.481 14 HB2 SER 2 HB2 SER 2 2.091 1.855 -4.432 15 HB3 SER 2 HB3 SER 2 1.041 0.822 -3.461 16 HG SER 2 HG SER 2 0.742 2.910 -2.202 17 H ILE 3 H ILE 3 4.841 1.182 -3.827 18 HA ILE 3 HA ILE 3 5.760 3.964 -3.577 19 HB ILE 3 HB ILE 3 7.616 1.590 -3.432 20 HG12 ILE 3 HG12 ILE 3 6.645 3.372 -1.187 21 HG13 ILE 3 HG13 ILE 3 6.170 1.695 -1.433 22 HG21 ILE 3 HG21 ILE 3 9.249 3.292 -2.699 23 HG22 ILE 3 HG22 ILE 3 8.651 3.575 -4.333 24 HG23 ILE 3 HG23 ILE 3 8.040 4.542 -2.991 25 HD11 ILE 3 HD11 ILE 3 8.624 2.819 -0.290 26 HD12 ILE 3 HD12 ILE 3 7.809 1.289 0.036 27 HD13 ILE 3 HD13 ILE 3 8.855 1.448 -1.374 28 H ASP 4 H ASP 4 6.947 4.769 -5.323 29 HA ASP 4 HA ASP 4 6.267 3.688 -7.857 30 HB2 ASP 4 HB2 ASP 4 7.160 5.616 -8.758 31 HB3 ASP 4 HB3 ASP 4 6.816 6.155 -7.117 32 HA PRO 5 HA PRO 5 9.605 0.986 -8.754 33 HB2 PRO 5 HB2 PRO 5 9.944 1.404 -11.415 34 HB3 PRO 5 HB3 PRO 5 8.556 0.536 -10.748 35 HG2 PRO 5 HG2 PRO 5 8.754 3.384 -11.647 36 HG3 PRO 5 HG3 PRO 5 7.457 2.209 -11.931 37 HD2 PRO 5 HD2 PRO 5 7.296 4.126 -10.024 38 HD3 PRO 5 HD3 PRO 5 6.538 2.531 -9.841 39 HA PRO 6 HA PRO 6 13.504 3.019 -8.768 40 HB2 PRO 6 HB2 PRO 6 15.062 1.321 -10.204 41 HB3 PRO 6 HB3 PRO 6 14.486 0.951 -8.574 42 HG2 PRO 6 HG2 PRO 6 13.407 0.046 -11.216 43 HG3 PRO 6 HG3 PRO 6 13.650 -0.887 -9.728 44 HD2 PRO 6 HD2 PRO 6 11.227 0.067 -10.470 45 HD3 PRO 6 HD3 PRO 6 11.706 -0.102 -8.769 46 H CYS 7 H CYS 7 15.356 3.724 -10.258 47 HA CYS 7 HA CYS 7 14.223 5.218 -12.419 48 HB2 CYS 7 HB2 CYS 7 16.891 5.018 -11.112 49 HB3 CYS 7 HB3 CYS 7 16.834 5.669 -12.747 50 H ARG 8 H ARG 8 15.772 5.302 -14.494 51 HA ARG 8 HA ARG 8 15.198 3.068 -16.019 52 HB2 ARG 8 HB2 ARG 8 17.135 5.328 -16.330 53 HB3 ARG 8 HB3 ARG 8 17.180 3.992 -17.473 54 HG2 ARG 8 HG2 ARG 8 14.982 4.423 -18.215 55 HG3 ARG 8 HG3 ARG 8 14.668 5.523 -16.871 56 HD2 ARG 8 HD2 ARG 8 15.861 7.235 -17.814 57 HD3 ARG 8 HD3 ARG 8 16.921 6.147 -18.708 58 HE ARG 8 HE ARG 8 14.463 7.281 -19.617 59 HH11 ARG 8 HH11 ARG 8 16.555 4.511 -19.889 60 HH12 ARG 8 HH12 ARG 8 16.009 4.092 -21.479 61 HH21 ARG 8 HH21 ARG 8 13.737 6.739 -21.710 62 HH22 ARG 8 HH22 ARG 8 14.407 5.361 -22.514 63 H PHE 9 H PHE 9 17.002 1.813 -17.250 64 HA PHE 9 HA PHE 9 18.166 0.007 -15.483 65 HB2 PHE 9 HB2 PHE 9 17.729 -0.582 -17.798 66 HB3 PHE 9 HB3 PHE 9 18.895 0.614 -18.355 67 HD1 PHE 9 HD1 PHE 9 18.906 -2.156 -15.849 68 HD2 PHE 9 HD2 PHE 9 20.814 -0.314 -19.178 69 HE1 PHE 9 HE1 PHE 9 20.681 -3.859 -15.771 70 HE2 PHE 9 HE2 PHE 9 22.591 -2.014 -19.105 71 HZ PHE 9 HZ PHE 9 22.525 -3.790 -17.401 72 H CYS 10 H CYS 10 19.764 0.317 -14.094 73 HA CYS 10 HA CYS 10 21.740 0.968 -13.176 74 HB2 CYS 10 HB2 CYS 10 22.318 1.129 -16.099 75 HB3 CYS 10 HB3 CYS 10 23.472 1.853 -14.983 76 H TYR 11 H TYR 11 19.528 2.840 -13.516 77 HA TYR 11 HA TYR 11 21.030 5.376 -13.541 78 HB2 TYR 11 HB2 TYR 11 18.307 4.662 -14.528 79 HB3 TYR 11 HB3 TYR 11 18.555 6.277 -13.875 80 HD1 TYR 11 HD2 TYR 11 20.826 4.135 -15.915 81 HD2 TYR 11 HD1 TYR 11 18.537 7.715 -15.700 82 HE1 TYR 11 HE2 TYR 11 21.765 4.857 -18.070 83 HE2 TYR 11 HE1 TYR 11 19.468 8.447 -17.856 84 HH TYR 11 HH TYR 11 20.504 7.510 -19.826 85 H HIS 12 H HIS 12 19.828 7.110 -12.203 86 HA HIS 12 HA HIS 12 18.315 6.238 -9.947 87 HB2 HIS 12 HB2 HIS 12 19.939 6.626 -8.204 88 HB3 HIS 12 HB3 HIS 12 20.594 5.435 -9.324 89 HD1 HIS 12 HD1 HIS 12 22.978 5.829 -9.788 90 HD2 HIS 12 HD2 HIS 12 20.949 9.385 -9.086 91 HE1 HIS 12 HE1 HIS 12 24.712 7.640 -9.976 92 H ARG 13 H ARG 13 17.596 7.976 -8.633 93 HA ARG 13 HA ARG 13 17.349 10.442 -10.036 94 HB2 ARG 13 HB2 ARG 13 16.344 9.316 -7.478 95 HB3 ARG 13 HB3 ARG 13 16.379 11.068 -7.617 96 HG2 ARG 13 HG2 ARG 13 15.042 10.899 -9.684 97 HG3 ARG 13 HG3 ARG 13 14.948 9.153 -9.445 98 HD2 ARG 13 HD2 ARG 13 13.997 9.732 -7.128 99 HD3 ARG 13 HD3 ARG 13 13.752 11.349 -7.788 100 HE ARG 13 HE ARG 13 12.660 9.368 -9.503 101 HH11 ARG 13 HH11 ARG 13 12.085 11.067 -6.519 102 HH12 ARG 13 HH12 ARG 13 10.362 10.904 -6.607 103 HH21 ARG 13 HH21 ARG 13 10.393 9.146 -9.629 104 HH22 ARG 13 HH22 ARG 13 9.401 9.810 -8.376 105 H ASP 14 H ASP 14 18.712 12.092 -10.042 106 HA ASP 14 HA ASP 14 20.910 12.174 -8.157 107 HB2 ASP 14 HB2 ASP 14 21.834 13.896 -9.554 108 HB3 ASP 14 HB3 ASP 14 21.203 12.631 -10.605 109 H GLY 15 H GLY 15 21.500 14.655 -7.593 110 HA2 GLY 15 HA2 GLY 15 19.771 15.400 -5.536 111 HA3 GLY 15 HA3 GLY 15 21.013 16.434 -6.228 112 H SER 16 H SER 16 19.585 16.092 -8.906 113 HA SER 16 HA SER 16 17.864 18.397 -8.566 114 HB2 SER 16 HB2 SER 16 19.535 18.011 -10.493 115 HB3 SER 16 HB3 SER 16 18.316 16.923 -11.155 116 HG SER 16 HG SER 16 18.404 19.448 -11.551 117 H GLY 17 H GLY 17 17.558 14.974 -9.004 118 HA2 GLY 17 HA2 GLY 17 15.530 13.855 -8.401 119 HA3 GLY 17 HA3 GLY 17 14.634 15.278 -8.912 120 H ASN 18 H ASN 18 17.209 13.724 -10.743 121 HA ASN 18 HA ASN 18 15.214 12.697 -12.638 122 HB2 ASN 18 HB2 ASN 18 17.517 14.539 -13.211 123 HB3 ASN 18 HB3 ASN 18 16.929 13.436 -14.452 124 HD21 ASN 18 HD21 ASN 18 16.897 16.375 -14.283 125 HD22 ASN 18 HD22 ASN 18 15.243 16.831 -14.488 126 H CYS 19 H CYS 19 15.661 10.732 -13.480 127 HA CYS 19 HA CYS 19 17.635 9.118 -12.283 128 HB2 CYS 19 HB2 CYS 19 16.098 8.610 -14.839 129 HB3 CYS 19 HB3 CYS 19 16.937 7.399 -13.876 130 H VAL 20 H VAL 20 19.721 8.877 -12.725 131 HA VAL 20 HA VAL 20 20.690 9.462 -15.434 132 HB VAL 20 HB VAL 20 22.695 10.572 -14.468 133 HG11 VAL 20 HG11 VAL 20 20.168 11.996 -13.666 134 HG12 VAL 20 HG12 VAL 20 21.686 12.703 -14.223 135 HG13 VAL 20 HG13 VAL 20 20.671 11.794 -15.344 136 HG21 VAL 20 HG21 VAL 20 22.498 11.453 -12.145 137 HG22 VAL 20 HG22 VAL 20 21.092 10.411 -11.920 138 HG23 VAL 20 HG23 VAL 20 22.675 9.700 -12.234 139 H TYR 21 H TYR 21 22.443 8.254 -16.108 140 HA TYR 21 HA TYR 21 22.740 5.682 -15.142 141 HB2 TYR 21 HB2 TYR 21 23.460 6.258 -17.372 142 HB3 TYR 21 HB3 TYR 21 24.679 7.361 -16.743 143 HD1 TYR 21 HD1 TYR 21 23.705 3.761 -16.686 144 HD2 TYR 21 HD2 TYR 21 26.857 6.609 -16.441 145 HE1 TYR 21 HE1 TYR 21 25.350 1.932 -16.688 146 HE2 TYR 21 HE2 TYR 21 28.511 4.788 -16.444 147 HH TYR 21 HH TYR 21 28.159 1.984 -15.662 148 H ASP 22 H ASP 22 23.643 4.876 -13.379 149 HA ASP 22 HA ASP 22 25.068 6.476 -11.523 150 HB2 ASP 22 HB2 ASP 22 23.646 4.289 -11.184 151 HB3 ASP 22 HB3 ASP 22 25.192 3.486 -11.443 152 H ALA 23 H ALA 23 26.841 7.316 -12.694 153 HA ALA 23 HA ALA 23 28.772 5.686 -13.979 154 HB1 ALA 23 HB1 ALA 23 28.545 8.530 -13.217 155 HB2 ALA 23 HB2 ALA 23 30.178 7.905 -13.450 156 HB3 ALA 23 HB3 ALA 23 28.998 7.797 -14.756 157 H TYR 24 H TYR 24 28.134 6.338 -10.699 158 HA TYR 24 HA TYR 24 30.844 5.843 -9.793 159 HB2 TYR 24 HB2 TYR 24 28.275 6.633 -8.521 160 HB3 TYR 24 HB3 TYR 24 29.438 5.775 -7.516 161 HD1 TYR 24 HD1 TYR 24 29.600 8.502 -10.079 162 HD2 TYR 24 HD2 TYR 24 30.714 7.159 -6.198 163 HE1 TYR 24 HE1 TYR 24 30.820 10.605 -9.708 164 HE2 TYR 24 HE2 TYR 24 31.936 9.259 -5.816 165 HH TYR 24 HH TYR 24 31.513 11.964 -7.490 166 H GLY 25 H GLY 25 28.559 3.905 -11.023 167 HA2 GLY 25 HA2 GLY 25 29.214 1.502 -10.967 168 HA3 GLY 25 HA3 GLY 25 29.255 1.669 -9.218 169 H CYS 26 H CYS 26 27.298 1.114 -11.985 170 HA CYS 26 HA CYS 26 24.813 1.322 -10.474 171 HB2 CYS 26 HB2 CYS 26 23.679 1.067 -12.547 172 HB3 CYS 26 HB3 CYS 26 25.047 2.128 -12.869 173 H GLY 27 H GLY 27 26.908 -0.740 -9.931 174 HA2 GLY 27 HA2 GLY 27 25.694 -3.234 -10.776 175 HA3 GLY 27 HA3 GLY 27 27.120 -3.055 -9.765 176 H ALA 28 H ALA 28 24.813 -1.062 -8.514 177 HA ALA 28 HA ALA 28 24.260 -2.922 -6.355 178 HB1 ALA 28 HB1 ALA 28 22.923 -0.435 -5.989 179 HB2 ALA 28 HB2 ALA 28 24.310 -1.086 -5.114 180 HB3 ALA 28 HB3 ALA 28 24.559 -0.119 -6.568 181 H VAL 29 H VAL 29 22.969 -2.877 -9.182 182 HA VAL 29 HA VAL 29 20.302 -3.532 -8.217 183 HB VAL 29 HB VAL 29 20.076 -1.179 -8.825 184 HG11 VAL 29 HG11 VAL 29 21.619 -2.046 -11.162 185 HG12 VAL 29 HG12 VAL 29 20.265 -0.977 -11.532 186 HG13 VAL 29 HG13 VAL 29 21.512 -0.462 -10.395 187 HG21 VAL 29 HG21 VAL 29 18.232 -1.388 -10.395 188 HG22 VAL 29 HG22 VAL 29 18.796 -2.989 -10.872 189 HG23 VAL 29 HG23 VAL 29 18.203 -2.716 -9.234 Start of MODEL 14 1 H1 ILE 1 H ILE 1 0.539 2.308 1.806 2 HA ILE 1 HA ILE 1 -0.265 2.740 -0.933 3 HB ILE 1 HB ILE 1 -0.269 5.038 -0.044 4 HG12 ILE 1 HG12 ILE 1 1.435 5.969 -1.685 5 HG13 ILE 1 HG13 ILE 1 1.912 4.304 -1.998 6 HG21 ILE 1 HG21 ILE 1 2.692 4.831 0.356 7 HG22 ILE 1 HG22 ILE 1 1.572 6.060 0.942 8 HG23 ILE 1 HG23 ILE 1 1.570 4.451 1.663 9 HD11 ILE 1 HD11 ILE 1 -0.912 5.260 -2.321 10 HD12 ILE 1 HD12 ILE 1 0.281 5.336 -3.618 11 HD13 ILE 1 HD13 ILE 1 -0.180 3.778 -2.934 12 H SER 2 H SER 2 1.159 1.851 -2.309 13 HA SER 2 HA SER 2 3.471 0.518 -1.218 14 HB2 SER 2 HB2 SER 2 1.991 -0.534 -2.931 15 HB3 SER 2 HB3 SER 2 2.551 0.663 -4.099 16 HG SER 2 HG SER 2 3.908 -0.985 -4.421 17 H ILE 3 H ILE 3 5.582 0.621 -2.419 18 HA ILE 3 HA ILE 3 6.348 3.415 -2.692 19 HB ILE 3 HB ILE 3 8.147 0.996 -2.791 20 HG12 ILE 3 HG12 ILE 3 6.862 1.052 -0.682 21 HG13 ILE 3 HG13 ILE 3 8.573 1.364 -0.417 22 HG21 ILE 3 HG21 ILE 3 9.366 2.786 -3.620 23 HG22 ILE 3 HG22 ILE 3 8.585 3.945 -2.545 24 HG23 ILE 3 HG23 ILE 3 9.768 2.806 -1.903 25 HD11 ILE 3 HD11 ILE 3 7.222 2.835 0.936 26 HD12 ILE 3 HD12 ILE 3 8.094 3.764 -0.283 27 HD13 ILE 3 HD13 ILE 3 6.379 3.419 -0.498 28 H ASP 4 H ASP 4 7.429 4.267 -4.487 29 HA ASP 4 HA ASP 4 6.535 3.299 -7.007 30 HB2 ASP 4 HB2 ASP 4 7.371 5.258 -7.895 31 HB3 ASP 4 HB3 ASP 4 7.158 5.732 -6.211 32 HA PRO 5 HA PRO 5 9.774 0.619 -8.259 33 HB2 PRO 5 HB2 PRO 5 9.916 1.141 -10.919 34 HB3 PRO 5 HB3 PRO 5 8.575 0.254 -10.185 35 HG2 PRO 5 HG2 PRO 5 8.728 3.135 -10.982 36 HG3 PRO 5 HG3 PRO 5 7.404 1.979 -11.214 37 HD2 PRO 5 HD2 PRO 5 7.402 3.818 -9.226 38 HD3 PRO 5 HD3 PRO 5 6.647 2.221 -9.050 39 HA PRO 6 HA PRO 6 13.677 2.630 -8.484 40 HB2 PRO 6 HB2 PRO 6 15.109 0.984 -10.100 41 HB3 PRO 6 HB3 PRO 6 14.654 0.551 -8.448 42 HG2 PRO 6 HG2 PRO 6 13.373 -0.241 -11.035 43 HG3 PRO 6 HG3 PRO 6 13.719 -1.235 -9.607 44 HD2 PRO 6 HD2 PRO 6 11.255 -0.239 -10.127 45 HD3 PRO 6 HD3 PRO 6 11.859 -0.479 -8.475 46 H CYS 7 H CYS 7 15.417 3.388 -10.079 47 HA CYS 7 HA CYS 7 14.113 4.925 -12.128 48 HB2 CYS 7 HB2 CYS 7 16.838 4.814 -10.931 49 HB3 CYS 7 HB3 CYS 7 16.686 5.505 -12.543 50 H ARG 8 H ARG 8 15.572 5.133 -14.259 51 HA ARG 8 HA ARG 8 15.039 2.912 -15.819 52 HB2 ARG 8 HB2 ARG 8 16.862 5.265 -16.146 53 HB3 ARG 8 HB3 ARG 8 16.912 3.963 -17.327 54 HG2 ARG 8 HG2 ARG 8 14.464 4.267 -17.665 55 HG3 ARG 8 HG3 ARG 8 14.549 5.682 -16.614 56 HD2 ARG 8 HD2 ARG 8 14.646 6.312 -18.975 57 HD3 ARG 8 HD3 ARG 8 16.137 6.731 -18.133 58 HE ARG 8 HE ARG 8 17.257 5.322 -19.532 59 HH11 ARG 8 HH11 ARG 8 13.881 4.470 -19.563 60 HH12 ARG 8 HH12 ARG 8 14.057 3.286 -20.816 61 HH21 ARG 8 HH21 ARG 8 17.501 3.766 -21.182 62 HH22 ARG 8 HH22 ARG 8 16.117 2.886 -21.736 63 H PHE 9 H PHE 9 16.848 1.774 -17.153 64 HA PHE 9 HA PHE 9 18.164 -0.018 -15.480 65 HB2 PHE 9 HB2 PHE 9 17.659 -0.571 -17.790 66 HB3 PHE 9 HB3 PHE 9 18.745 0.690 -18.362 67 HD1 PHE 9 HD1 PHE 9 19.162 -1.939 -15.755 68 HD2 PHE 9 HD2 PHE 9 20.494 -0.322 -19.460 69 HE1 PHE 9 HE1 PHE 9 21.015 -3.558 -15.792 70 HE2 PHE 9 HE2 PHE 9 22.348 -1.939 -19.503 71 HZ PHE 9 HZ PHE 9 22.610 -3.560 -17.668 72 H CYS 10 H CYS 10 19.802 0.333 -14.148 73 HA CYS 10 HA CYS 10 21.784 1.053 -13.294 74 HB2 CYS 10 HB2 CYS 10 22.232 1.311 -16.233 75 HB3 CYS 10 HB3 CYS 10 23.396 2.062 -15.147 76 H TYR 11 H TYR 11 19.476 2.827 -13.493 77 HA TYR 11 HA TYR 11 20.858 5.430 -13.514 78 HB2 TYR 11 HB2 TYR 11 18.131 4.613 -14.406 79 HB3 TYR 11 HB3 TYR 11 18.332 6.222 -13.722 80 HD1 TYR 11 HD1 TYR 11 20.611 4.237 -15.908 81 HD2 TYR 11 HD2 TYR 11 18.174 7.702 -15.507 82 HE1 TYR 11 HE1 TYR 11 21.424 5.053 -18.082 83 HE2 TYR 11 HE2 TYR 11 18.979 8.527 -17.679 84 HH TYR 11 HH TYR 11 20.781 8.255 -19.198 85 H HIS 12 H HIS 12 19.633 7.073 -12.083 86 HA HIS 12 HA HIS 12 18.258 6.077 -9.790 87 HB2 HIS 12 HB2 HIS 12 19.935 6.497 -8.105 88 HB3 HIS 12 HB3 HIS 12 20.595 5.365 -9.282 89 HD1 HIS 12 HD1 HIS 12 22.938 5.879 -9.832 90 HD2 HIS 12 HD2 HIS 12 20.782 9.321 -8.956 91 HE1 HIS 12 HE1 HIS 12 24.579 7.773 -10.044 92 H ARG 13 H ARG 13 17.519 7.747 -8.402 93 HA ARG 13 HA ARG 13 17.101 10.232 -9.729 94 HB2 ARG 13 HB2 ARG 13 16.256 8.999 -7.162 95 HB3 ARG 13 HB3 ARG 13 16.205 10.754 -7.257 96 HG2 ARG 13 HG2 ARG 13 14.792 10.571 -9.272 97 HG3 ARG 13 HG3 ARG 13 14.789 8.817 -9.076 98 HD2 ARG 13 HD2 ARG 13 13.630 10.892 -7.229 99 HD3 ARG 13 HD3 ARG 13 12.774 9.631 -8.115 100 HE ARG 13 HE ARG 13 14.139 9.362 -5.603 101 HH11 ARG 13 HH11 ARG 13 13.034 7.689 -8.449 102 HH12 ARG 13 HH12 ARG 13 12.959 6.143 -7.670 103 HH21 ARG 13 HH21 ARG 13 14.043 7.333 -4.566 104 HH22 ARG 13 HH22 ARG 13 13.532 5.942 -5.461 105 H ASP 14 H ASP 14 18.388 11.942 -9.746 106 HA ASP 14 HA ASP 14 20.655 12.080 -7.948 107 HB2 ASP 14 HB2 ASP 14 21.442 13.877 -9.335 108 HB3 ASP 14 HB3 ASP 14 20.831 12.608 -10.393 109 H GLY 15 H GLY 15 21.154 14.575 -7.350 110 HA2 GLY 15 HA2 GLY 15 19.480 15.191 -5.205 111 HA3 GLY 15 HA3 GLY 15 20.644 16.296 -5.921 112 H SER 16 H SER 16 19.120 15.945 -8.546 113 HA SER 16 HA SER 16 17.313 18.161 -8.081 114 HB2 SER 16 HB2 SER 16 17.822 16.744 -10.700 115 HB3 SER 16 HB3 SER 16 17.207 18.379 -10.458 116 HG SER 16 HG SER 16 19.209 18.979 -10.542 117 H GLY 17 H GLY 17 17.145 14.739 -8.583 118 HA2 GLY 17 HA2 GLY 17 15.198 13.513 -7.930 119 HA3 GLY 17 HA3 GLY 17 14.217 14.904 -8.366 120 H ASN 18 H ASN 18 16.779 13.518 -10.343 121 HA ASN 18 HA ASN 18 14.754 12.444 -12.179 122 HB2 ASN 18 HB2 ASN 18 16.942 14.406 -12.799 123 HB3 ASN 18 HB3 ASN 18 16.353 13.308 -14.043 124 HD21 ASN 18 HD21 ASN 18 16.180 16.291 -13.557 125 HD22 ASN 18 HD22 ASN 18 14.504 16.651 -13.773 126 H CYS 19 H CYS 19 15.254 10.524 -13.090 127 HA CYS 19 HA CYS 19 17.349 8.974 -12.020 128 HB2 CYS 19 HB2 CYS 19 15.731 8.461 -14.524 129 HB3 CYS 19 HB3 CYS 19 16.665 7.266 -13.631 130 H VAL 20 H VAL 20 19.423 8.846 -12.551 131 HA VAL 20 HA VAL 20 20.251 9.544 -15.281 132 HB VAL 20 HB VAL 20 22.241 10.723 -14.367 133 HG11 VAL 20 HG11 VAL 20 19.685 12.000 -13.422 134 HG12 VAL 20 HG12 VAL 20 21.145 12.797 -14.014 135 HG13 VAL 20 HG13 VAL 20 20.131 11.873 -15.123 136 HG21 VAL 20 HG21 VAL 20 22.103 11.531 -12.013 137 HG22 VAL 20 HG22 VAL 20 20.759 10.417 -11.759 138 HG23 VAL 20 HG23 VAL 20 22.359 9.792 -12.161 139 H TYR 21 H TYR 21 22.027 8.436 -16.058 140 HA TYR 21 HA TYR 21 22.482 5.858 -15.175 141 HB2 TYR 21 HB2 TYR 21 23.079 6.523 -17.417 142 HB3 TYR 21 HB3 TYR 21 24.272 7.665 -16.810 143 HD1 TYR 21 HD2 TYR 21 23.467 4.023 -16.808 144 HD2 TYR 21 HD1 TYR 21 26.493 7.009 -16.624 145 HE1 TYR 21 HE2 TYR 21 25.192 2.274 -16.927 146 HE2 TYR 21 HE1 TYR 21 28.226 5.268 -16.744 147 HH TYR 21 HH TYR 21 28.436 2.933 -17.568 148 H ASP 22 H ASP 22 23.496 5.051 -13.473 149 HA ASP 22 HA ASP 22 24.924 6.670 -11.637 150 HB2 ASP 22 HB2 ASP 22 23.620 4.410 -11.299 151 HB3 ASP 22 HB3 ASP 22 25.191 3.688 -11.641 152 H ALA 23 H ALA 23 26.605 7.620 -12.859 153 HA ALA 23 HA ALA 23 28.552 6.114 -14.266 154 HB1 ALA 23 HB1 ALA 23 29.877 8.382 -13.741 155 HB2 ALA 23 HB2 ALA 23 28.644 8.252 -14.997 156 HB3 ALA 23 HB3 ALA 23 28.230 8.926 -13.420 157 H TYR 24 H TYR 24 28.026 6.660 -10.945 158 HA TYR 24 HA TYR 24 30.792 6.272 -10.167 159 HB2 TYR 24 HB2 TYR 24 28.246 6.907 -8.768 160 HB3 TYR 24 HB3 TYR 24 29.491 6.083 -7.835 161 HD1 TYR 24 HD1 TYR 24 29.450 8.857 -10.351 162 HD2 TYR 24 HD2 TYR 24 30.719 7.513 -6.519 163 HE1 TYR 24 HE1 TYR 24 30.584 11.007 -9.980 164 HE2 TYR 24 HE2 TYR 24 31.856 9.660 -6.136 165 HH TYR 24 HH TYR 24 31.368 12.381 -8.138 166 H GLY 25 H GLY 25 28.547 4.257 -11.348 167 HA2 GLY 25 HA2 GLY 25 29.317 1.887 -11.382 168 HA3 GLY 25 HA3 GLY 25 29.423 2.015 -9.632 169 H CYS 26 H CYS 26 27.379 1.435 -12.330 170 HA CYS 26 HA CYS 26 24.953 1.488 -10.714 171 HB2 CYS 26 HB2 CYS 26 23.746 1.230 -12.745 172 HB3 CYS 26 HB3 CYS 26 25.049 2.361 -13.096 173 H GLY 27 H GLY 27 27.163 -0.486 -10.314 174 HA2 GLY 27 HA2 GLY 27 26.024 -3.013 -11.169 175 HA3 GLY 27 HA3 GLY 27 27.490 -2.793 -10.225 176 H ALA 28 H ALA 28 25.163 -0.938 -8.809 177 HA ALA 28 HA ALA 28 24.802 -2.874 -6.676 178 HB1 ALA 28 HB1 ALA 28 25.376 -0.704 -5.935 179 HB2 ALA 28 HB2 ALA 28 24.129 0.047 -6.931 180 HB3 ALA 28 HB3 ALA 28 23.673 -0.926 -5.532 181 H VAL 29 H VAL 29 23.369 -2.816 -9.435 182 HA VAL 29 HA VAL 29 20.586 -2.618 -8.632 183 HB VAL 29 HB VAL 29 20.073 -3.191 -10.966 184 HG11 VAL 29 HG11 VAL 29 20.264 -1.018 -11.371 185 HG12 VAL 29 HG12 VAL 29 21.404 -0.876 -10.031 186 HG13 VAL 29 HG13 VAL 29 21.994 -1.205 -11.661 187 HG21 VAL 29 HG21 VAL 29 23.046 -3.241 -11.443 188 HG22 VAL 29 HG22 VAL 29 22.066 -4.694 -11.252 189 HG23 VAL 29 HG23 VAL 29 21.760 -3.595 -12.597 Start of MODEL 15 1 H1 ILE 1 H ILE 1 0.263 1.553 2.460 2 HA ILE 1 HA ILE 1 -0.285 3.282 0.240 3 HB ILE 1 HB ILE 1 1.980 3.381 2.236 4 HG12 ILE 1 HG12 ILE 1 -0.515 5.072 2.216 5 HG13 ILE 1 HG13 ILE 1 -0.430 3.548 3.091 6 HG21 ILE 1 HG21 ILE 1 2.828 4.970 0.936 7 HG22 ILE 1 HG22 ILE 1 1.437 4.900 -0.144 8 HG23 ILE 1 HG23 ILE 1 1.396 5.940 1.279 9 HD11 ILE 1 HD11 ILE 1 0.687 4.473 4.771 10 HD12 ILE 1 HD12 ILE 1 1.810 5.291 3.683 11 HD13 ILE 1 HD13 ILE 1 0.252 6.026 4.059 12 H SER 2 H SER 2 0.310 2.679 -1.743 13 HA SER 2 HA SER 2 2.667 1.071 -2.194 14 HB2 SER 2 HB2 SER 2 0.776 0.567 -3.572 15 HB3 SER 2 HB3 SER 2 0.598 2.254 -4.054 16 HG SER 2 HG SER 2 2.611 0.412 -4.794 17 H ILE 3 H ILE 3 4.403 1.680 -3.602 18 HA ILE 3 HA ILE 3 4.875 4.590 -3.668 19 HB ILE 3 HB ILE 3 7.375 3.763 -3.714 20 HG12 ILE 3 HG12 ILE 3 7.708 1.785 -2.281 21 HG13 ILE 3 HG13 ILE 3 5.967 1.538 -2.220 22 HG21 ILE 3 HG21 ILE 3 6.681 3.520 -0.976 23 HG22 ILE 3 HG22 ILE 3 7.333 4.921 -1.824 24 HG23 ILE 3 HG23 ILE 3 5.588 4.692 -1.713 25 HD11 ILE 3 HD11 ILE 3 7.165 1.672 -4.907 26 HD12 ILE 3 HD12 ILE 3 7.581 0.266 -3.925 27 HD13 ILE 3 HD13 ILE 3 5.891 0.628 -4.276 28 H ASP 4 H ASP 4 6.318 5.337 -5.385 29 HA ASP 4 HA ASP 4 5.555 4.300 -7.912 30 HB2 ASP 4 HB2 ASP 4 7.332 5.951 -8.748 31 HB3 ASP 4 HB3 ASP 4 5.970 6.617 -7.850 32 HA PRO 5 HA PRO 5 8.661 1.340 -8.824 33 HB2 PRO 5 HB2 PRO 5 9.087 1.770 -11.470 34 HB3 PRO 5 HB3 PRO 5 7.614 1.020 -10.844 35 HG2 PRO 5 HG2 PRO 5 8.086 3.854 -11.686 36 HG3 PRO 5 HG3 PRO 5 6.693 2.806 -12.014 37 HD2 PRO 5 HD2 PRO 5 6.670 4.697 -10.076 38 HD3 PRO 5 HD3 PRO 5 5.768 3.174 -9.935 39 HA PRO 6 HA PRO 6 12.727 3.012 -8.731 40 HB2 PRO 6 HB2 PRO 6 14.153 1.203 -10.168 41 HB3 PRO 6 HB3 PRO 6 13.515 0.861 -8.556 42 HG2 PRO 6 HG2 PRO 6 12.410 0.099 -11.232 43 HG3 PRO 6 HG3 PRO 6 12.538 -0.875 -9.756 44 HD2 PRO 6 HD2 PRO 6 10.226 0.306 -10.525 45 HD3 PRO 6 HD3 PRO 6 10.655 0.067 -8.819 46 H CYS 7 H CYS 7 14.662 3.573 -10.174 47 HA CYS 7 HA CYS 7 13.688 5.152 -12.367 48 HB2 CYS 7 HB2 CYS 7 16.274 4.844 -10.924 49 HB3 CYS 7 HB3 CYS 7 16.329 5.495 -12.559 50 H ARG 8 H ARG 8 15.352 5.169 -14.357 51 HA ARG 8 HA ARG 8 14.765 2.952 -15.908 52 HB2 ARG 8 HB2 ARG 8 16.745 5.174 -16.125 53 HB3 ARG 8 HB3 ARG 8 16.891 3.815 -17.231 54 HG2 ARG 8 HG2 ARG 8 14.438 4.205 -17.782 55 HG3 ARG 8 HG3 ARG 8 14.617 5.747 -16.941 56 HD2 ARG 8 HD2 ARG 8 16.431 6.364 -18.461 57 HD3 ARG 8 HD3 ARG 8 16.259 4.821 -19.295 58 HE ARG 8 HE ARG 8 14.486 5.692 -20.438 59 HH11 ARG 8 HH11 ARG 8 15.061 7.638 -17.609 60 HH12 ARG 8 HH12 ARG 8 13.894 8.843 -18.040 61 HH21 ARG 8 HH21 ARG 8 12.947 7.273 -21.018 62 HH22 ARG 8 HH22 ARG 8 12.691 8.634 -19.979 63 H PHE 9 H PHE 9 16.617 1.660 -17.061 64 HA PHE 9 HA PHE 9 17.615 -0.196 -15.241 65 HB2 PHE 9 HB2 PHE 9 17.287 -0.756 -17.583 66 HB3 PHE 9 HB3 PHE 9 18.526 0.399 -18.063 67 HD1 PHE 9 HD2 PHE 9 18.330 -2.342 -15.533 68 HD2 PHE 9 HD1 PHE 9 20.417 -0.635 -18.827 69 HE1 PHE 9 HE2 PHE 9 20.034 -4.108 -15.365 70 HE2 PHE 9 HE1 PHE 9 22.124 -2.399 -18.664 71 HZ PHE 9 HZ PHE 9 21.935 -4.138 -16.931 72 H CYS 10 H CYS 10 19.156 0.036 -13.774 73 HA CYS 10 HA CYS 10 21.099 0.619 -12.745 74 HB2 CYS 10 HB2 CYS 10 21.825 0.776 -15.631 75 HB3 CYS 10 HB3 CYS 10 22.936 1.490 -14.467 76 H TYR 11 H TYR 11 18.959 2.561 -13.180 77 HA TYR 11 HA TYR 11 20.532 5.052 -13.095 78 HB2 TYR 11 HB2 TYR 11 17.842 4.425 -14.217 79 HB3 TYR 11 HB3 TYR 11 18.097 6.023 -13.526 80 HD1 TYR 11 HD2 TYR 11 20.426 3.865 -15.481 81 HD2 TYR 11 HD1 TYR 11 18.185 7.479 -15.338 82 HE1 TYR 11 HE2 TYR 11 21.483 4.596 -17.577 83 HE2 TYR 11 HE1 TYR 11 19.235 8.220 -17.435 84 HH TYR 11 HH TYR 11 20.419 7.461 -19.270 85 H HIS 12 H HIS 12 19.289 6.805 -11.800 86 HA HIS 12 HA HIS 12 17.679 5.925 -9.611 87 HB2 HIS 12 HB2 HIS 12 19.235 6.313 -7.805 88 HB3 HIS 12 HB3 HIS 12 19.929 5.121 -8.901 89 HD1 HIS 12 HD1 HIS 12 22.330 5.508 -9.273 90 HD2 HIS 12 HD2 HIS 12 20.284 9.070 -8.651 91 HE1 HIS 12 HE1 HIS 12 24.074 7.316 -9.397 92 H ARG 13 H ARG 13 16.901 7.656 -8.326 93 HA ARG 13 HA ARG 13 16.693 10.122 -9.727 94 HB2 ARG 13 HB2 ARG 13 15.015 8.969 -8.098 95 HB3 ARG 13 HB3 ARG 13 15.925 9.803 -6.845 96 HG2 ARG 13 HG2 ARG 13 14.256 11.311 -7.248 97 HG3 ARG 13 HG3 ARG 13 15.502 11.898 -8.352 98 HD2 ARG 13 HD2 ARG 13 14.085 11.664 -10.044 99 HD3 ARG 13 HD3 ARG 13 14.028 9.929 -9.735 100 HE ARG 13 HE ARG 13 12.292 11.128 -7.936 101 HH11 ARG 13 HH11 ARG 13 12.608 10.783 -11.386 102 HH12 ARG 13 HH12 ARG 13 10.902 10.855 -11.681 103 HH21 ARG 13 HH21 ARG 13 10.044 11.224 -8.311 104 HH22 ARG 13 HH22 ARG 13 9.445 11.107 -9.931 105 H ASP 14 H ASP 14 18.136 11.701 -9.754 106 HA ASP 14 HA ASP 14 20.223 11.828 -7.748 107 HB2 ASP 14 HB2 ASP 14 21.304 13.391 -9.175 108 HB3 ASP 14 HB3 ASP 14 20.604 12.170 -10.234 109 H GLY 15 H GLY 15 20.828 14.365 -7.339 110 HA2 GLY 15 HA2 GLY 15 18.950 15.234 -5.429 111 HA3 GLY 15 HA3 GLY 15 20.316 16.170 -6.017 112 H SER 16 H SER 16 19.282 15.940 -8.817 113 HA SER 16 HA SER 16 17.710 18.332 -8.775 114 HB2 SER 16 HB2 SER 16 18.323 16.527 -11.126 115 HB3 SER 16 HB3 SER 16 17.785 18.204 -11.198 116 HG SER 16 HG SER 16 20.096 17.874 -11.448 117 H GLY 17 H GLY 17 17.029 14.955 -8.853 118 HA2 GLY 17 HA2 GLY 17 14.857 14.130 -8.310 119 HA3 GLY 17 HA3 GLY 17 14.163 15.577 -9.027 120 H ASN 18 H ASN 18 16.673 13.693 -10.578 121 HA ASN 18 HA ASN 18 14.692 12.558 -12.423 122 HB2 ASN 18 HB2 ASN 18 16.928 14.413 -13.063 123 HB3 ASN 18 HB3 ASN 18 16.636 13.087 -14.185 124 HD21 ASN 18 HD21 ASN 18 15.693 16.166 -13.185 125 HD22 ASN 18 HD22 ASN 18 14.278 16.321 -14.164 126 H CYS 19 H CYS 19 15.448 10.715 -13.625 127 HA CYS 19 HA CYS 19 17.201 9.054 -12.053 128 HB2 CYS 19 HB2 CYS 19 15.817 8.462 -14.678 129 HB3 CYS 19 HB3 CYS 19 16.585 7.280 -13.623 130 H VAL 20 H VAL 20 19.270 8.551 -12.447 131 HA VAL 20 HA VAL 20 20.420 9.121 -15.077 132 HB VAL 20 HB VAL 20 22.406 10.184 -14.021 133 HG11 VAL 20 HG11 VAL 20 20.479 11.454 -15.034 134 HG12 VAL 20 HG12 VAL 20 19.888 11.708 -13.391 135 HG13 VAL 20 HG13 VAL 20 21.458 12.352 -13.874 136 HG21 VAL 20 HG21 VAL 20 22.121 11.114 -11.732 137 HG22 VAL 20 HG22 VAL 20 20.657 10.144 -11.564 138 HG23 VAL 20 HG23 VAL 20 22.220 9.354 -11.774 139 H TYR 21 H TYR 21 22.183 7.854 -15.621 140 HA TYR 21 HA TYR 21 22.334 5.290 -14.601 141 HB2 TYR 21 HB2 TYR 21 23.209 5.803 -16.790 142 HB3 TYR 21 HB3 TYR 21 24.420 6.879 -16.103 143 HD1 TYR 21 HD1 TYR 21 23.340 3.314 -16.103 144 HD2 TYR 21 HD2 TYR 21 26.545 6.066 -15.602 145 HE1 TYR 21 HE1 TYR 21 24.923 1.436 -15.974 146 HE2 TYR 21 HE2 TYR 21 28.138 4.197 -15.472 147 HH TYR 21 HH TYR 21 28.360 1.975 -15.316 148 H ASP 22 H ASP 22 23.126 4.466 -12.791 149 HA ASP 22 HA ASP 22 24.467 6.054 -10.861 150 HB2 ASP 22 HB2 ASP 22 22.975 3.922 -10.571 151 HB3 ASP 22 HB3 ASP 22 24.496 3.057 -10.770 152 H ALA 23 H ALA 23 26.319 6.840 -11.962 153 HA ALA 23 HA ALA 23 28.287 5.167 -13.111 154 HB1 ALA 23 HB1 ALA 23 29.692 7.377 -12.430 155 HB2 ALA 23 HB2 ALA 23 28.678 7.248 -13.867 156 HB3 ALA 23 HB3 ALA 23 28.046 8.010 -12.408 157 H TYR 24 H TYR 24 27.468 5.822 -9.873 158 HA TYR 24 HA TYR 24 30.105 5.262 -8.806 159 HB2 TYR 24 HB2 TYR 24 27.479 6.097 -7.689 160 HB3 TYR 24 HB3 TYR 24 28.560 5.209 -6.620 161 HD1 TYR 24 HD1 TYR 24 28.058 8.323 -8.483 162 HD2 TYR 24 HD2 TYR 24 30.658 6.184 -5.882 163 HE1 TYR 24 HE1 TYR 24 29.293 10.399 -8.020 164 HE2 TYR 24 HE2 TYR 24 31.900 8.254 -5.411 165 HH TYR 24 HH TYR 24 32.103 10.686 -7.035 166 H GLY 25 H GLY 25 27.864 3.379 -10.190 167 HA2 GLY 25 HA2 GLY 25 28.458 0.964 -10.116 168 HA3 GLY 25 HA3 GLY 25 28.408 1.117 -8.366 169 H CYS 26 H CYS 26 26.591 0.632 -11.241 170 HA CYS 26 HA CYS 26 24.035 0.870 -9.856 171 HB2 CYS 26 HB2 CYS 26 23.004 0.673 -11.990 172 HB3 CYS 26 HB3 CYS 26 24.402 1.718 -12.217 173 H GLY 27 H GLY 27 26.046 -1.242 -9.233 174 HA2 GLY 27 HA2 GLY 27 25.565 -3.366 -8.315 175 HA3 GLY 27 HA3 GLY 27 24.183 -3.493 -9.394 176 H ALA 28 H ALA 28 26.701 -2.382 -11.206 177 HA ALA 28 HA ALA 28 28.045 -4.889 -11.675 178 HB1 ALA 28 HB1 ALA 28 27.351 -4.870 -14.133 179 HB2 ALA 28 HB2 ALA 28 26.172 -5.459 -12.960 180 HB3 ALA 28 HB3 ALA 28 26.020 -3.832 -13.622 181 H VAL 29 H VAL 29 29.771 -3.413 -11.080 182 HA VAL 29 HA VAL 29 30.440 -1.334 -13.010 183 HB VAL 29 HB VAL 29 30.725 -0.823 -10.635 184 HG11 VAL 29 HG11 VAL 29 31.721 -3.422 -10.477 185 HG12 VAL 29 HG12 VAL 29 33.103 -2.378 -10.141 186 HG13 VAL 29 HG13 VAL 29 31.634 -2.235 -9.177 187 HG21 VAL 29 HG21 VAL 29 33.084 -0.046 -10.732 188 HG22 VAL 29 HG22 VAL 29 33.297 -0.999 -12.201 189 HG23 VAL 29 HG23 VAL 29 32.153 0.343 -12.179 Start of MODEL 16 1 H1 ILE 1 H ILE 1 3.000 -1.671 -1.169 2 HA ILE 1 HA ILE 1 1.831 0.735 0.015 3 HB ILE 1 HB ILE 1 4.609 0.422 -1.116 4 HG12 ILE 1 HG12 ILE 1 4.304 -1.220 0.660 5 HG13 ILE 1 HG13 ILE 1 5.343 0.085 1.222 6 HG21 ILE 1 HG21 ILE 1 5.067 2.336 0.428 7 HG22 ILE 1 HG22 ILE 1 3.980 2.712 -0.908 8 HG23 ILE 1 HG23 ILE 1 3.329 2.446 0.709 9 HD11 ILE 1 HD11 ILE 1 2.822 0.913 1.954 10 HD12 ILE 1 HD12 ILE 1 2.792 -0.828 2.237 11 HD13 ILE 1 HD13 ILE 1 4.028 0.168 3.004 12 H SER 2 H SER 2 1.598 2.671 -1.120 13 HA SER 2 HA SER 2 1.224 2.320 -3.995 14 HB2 SER 2 HB2 SER 2 -0.550 3.320 -2.434 15 HB3 SER 2 HB3 SER 2 0.468 4.760 -2.390 16 HG SER 2 HG SER 2 -0.837 5.147 -4.067 17 H ILE 3 H ILE 3 3.883 2.398 -3.263 18 HA ILE 3 HA ILE 3 4.842 5.107 -3.743 19 HB ILE 3 HB ILE 3 7.111 4.069 -3.486 20 HG12 ILE 3 HG12 ILE 3 5.781 1.649 -2.344 21 HG13 ILE 3 HG13 ILE 3 6.025 1.732 -4.085 22 HG21 ILE 3 HG21 ILE 3 6.342 3.290 -0.966 23 HG22 ILE 3 HG22 ILE 3 6.703 4.940 -1.472 24 HG23 ILE 3 HG23 ILE 3 5.036 4.365 -1.465 25 HD11 ILE 3 HD11 ILE 3 8.321 2.289 -2.279 26 HD12 ILE 3 HD12 ILE 3 7.804 0.622 -2.536 27 HD13 ILE 3 HD13 ILE 3 8.302 1.613 -3.907 28 H ASP 4 H ASP 4 5.952 5.762 -5.548 29 HA ASP 4 HA ASP 4 5.334 4.506 -7.998 30 HB2 ASP 4 HB2 ASP 4 7.072 6.169 -8.906 31 HB3 ASP 4 HB3 ASP 4 5.651 6.833 -8.104 32 HA PRO 5 HA PRO 5 8.579 1.627 -8.643 33 HB2 PRO 5 HB2 PRO 5 9.051 1.896 -11.302 34 HB3 PRO 5 HB3 PRO 5 7.595 1.128 -10.658 35 HG2 PRO 5 HG2 PRO 5 7.972 3.917 -11.681 36 HG3 PRO 5 HG3 PRO 5 6.631 2.792 -11.966 37 HD2 PRO 5 HD2 PRO 5 6.484 4.805 -10.162 38 HD3 PRO 5 HD3 PRO 5 5.642 3.259 -9.938 39 HA PRO 6 HA PRO 6 12.573 3.466 -8.582 40 HB2 PRO 6 HB2 PRO 6 14.102 1.634 -9.877 41 HB3 PRO 6 HB3 PRO 6 13.443 1.365 -8.258 42 HG2 PRO 6 HG2 PRO 6 12.428 0.395 -10.902 43 HG3 PRO 6 HG3 PRO 6 12.564 -0.481 -9.366 44 HD2 PRO 6 HD2 PRO 6 10.223 0.552 -10.251 45 HD3 PRO 6 HD3 PRO 6 10.625 0.438 -8.525 46 H CYS 7 H CYS 7 14.519 4.008 -10.024 47 HA CYS 7 HA CYS 7 13.551 5.464 -12.288 48 HB2 CYS 7 HB2 CYS 7 16.153 5.178 -10.871 49 HB3 CYS 7 HB3 CYS 7 16.194 5.757 -12.533 50 H ARG 8 H ARG 8 15.187 5.374 -14.300 51 HA ARG 8 HA ARG 8 14.542 3.108 -15.752 52 HB2 ARG 8 HB2 ARG 8 16.559 5.283 -16.083 53 HB3 ARG 8 HB3 ARG 8 16.664 3.878 -17.137 54 HG2 ARG 8 HG2 ARG 8 14.126 4.348 -17.531 55 HG3 ARG 8 HG3 ARG 8 14.547 5.965 -16.966 56 HD2 ARG 8 HD2 ARG 8 15.948 6.370 -18.759 57 HD3 ARG 8 HD3 ARG 8 16.210 4.655 -19.072 58 HE ARG 8 HE ARG 8 13.514 5.217 -19.531 59 HH11 ARG 8 HH11 ARG 8 16.635 5.997 -20.860 60 HH12 ARG 8 HH12 ARG 8 16.039 6.215 -22.472 61 HH21 ARG 8 HH21 ARG 8 12.717 5.502 -21.649 62 HH22 ARG 8 HH22 ARG 8 13.810 5.934 -22.920 63 H PHE 9 H PHE 9 16.347 1.731 -16.873 64 HA PHE 9 HA PHE 9 17.340 -0.065 -14.991 65 HB2 PHE 9 HB2 PHE 9 16.959 -0.695 -17.317 66 HB3 PHE 9 HB3 PHE 9 18.243 0.389 -17.843 67 HD1 PHE 9 HD2 PHE 9 18.006 -2.177 -15.144 68 HD2 PHE 9 HD1 PHE 9 20.026 -0.813 -18.633 69 HE1 PHE 9 HE2 PHE 9 19.638 -4.003 -14.908 70 HE2 PHE 9 HE1 PHE 9 21.661 -2.637 -18.404 71 HZ PHE 9 HZ PHE 9 21.469 -4.234 -16.539 72 H CYS 10 H CYS 10 18.906 0.200 -13.558 73 HA CYS 10 HA CYS 10 20.875 0.788 -12.583 74 HB2 CYS 10 HB2 CYS 10 21.559 0.810 -15.483 75 HB3 CYS 10 HB3 CYS 10 22.701 1.552 -14.368 76 H TYR 11 H TYR 11 18.765 2.751 -13.072 77 HA TYR 11 HA TYR 11 20.385 5.212 -13.112 78 HB2 TYR 11 HB2 TYR 11 17.668 4.591 -14.171 79 HB3 TYR 11 HB3 TYR 11 17.963 6.212 -13.551 80 HD1 TYR 11 HD2 TYR 11 20.217 3.926 -15.448 81 HD2 TYR 11 HD1 TYR 11 18.058 7.592 -15.420 82 HE1 TYR 11 HE2 TYR 11 21.258 4.549 -17.587 83 HE2 TYR 11 HE1 TYR 11 19.091 8.224 -17.560 84 HH TYR 11 HH TYR 11 20.901 5.996 -19.455 85 H HIS 12 H HIS 12 19.193 7.041 -11.875 86 HA HIS 12 HA HIS 12 17.598 6.284 -9.630 87 HB2 HIS 12 HB2 HIS 12 19.187 6.719 -7.863 88 HB3 HIS 12 HB3 HIS 12 19.841 5.467 -8.915 89 HD1 HIS 12 HD1 HIS 12 22.243 5.789 -9.340 90 HD2 HIS 12 HD2 HIS 12 20.278 9.416 -8.840 91 HE1 HIS 12 HE1 HIS 12 24.021 7.554 -9.566 92 H ARG 13 H ARG 13 16.866 8.081 -8.413 93 HA ARG 13 HA ARG 13 16.687 10.490 -9.912 94 HB2 ARG 13 HB2 ARG 13 15.010 9.433 -8.213 95 HB3 ARG 13 HB3 ARG 13 15.947 10.312 -7.012 96 HG2 ARG 13 HG2 ARG 13 15.388 12.400 -7.961 97 HG3 ARG 13 HG3 ARG 13 14.739 11.643 -9.417 98 HD2 ARG 13 HD2 ARG 13 12.981 12.441 -7.874 99 HD3 ARG 13 HD3 ARG 13 12.906 10.704 -8.167 100 HE ARG 13 HE ARG 13 13.336 10.350 -5.949 101 HH11 ARG 13 HH11 ARG 13 14.156 13.636 -6.754 102 HH12 ARG 13 HH12 ARG 13 14.447 14.104 -5.112 103 HH21 ARG 13 HH21 ARG 13 13.716 10.954 -3.782 104 HH22 ARG 13 HH22 ARG 13 14.197 12.577 -3.422 105 H ASP 14 H ASP 14 18.123 12.073 -9.999 106 HA ASP 14 HA ASP 14 20.262 12.226 -8.050 107 HB2 ASP 14 HB2 ASP 14 21.315 13.756 -9.538 108 HB3 ASP 14 HB3 ASP 14 20.589 12.509 -10.548 109 H GLY 15 H GLY 15 20.872 14.834 -7.826 110 HA2 GLY 15 HA2 GLY 15 19.064 15.742 -5.846 111 HA3 GLY 15 HA3 GLY 15 20.416 16.655 -6.502 112 H SER 16 H SER 16 19.316 16.368 -9.260 113 HA SER 16 HA SER 16 17.735 18.755 -9.233 114 HB2 SER 16 HB2 SER 16 19.429 17.896 -11.036 115 HB3 SER 16 HB3 SER 16 18.033 17.020 -11.664 116 HG SER 16 HG SER 16 18.651 19.521 -12.104 117 H GLY 17 H GLY 17 17.073 15.369 -9.254 118 HA2 GLY 17 HA2 GLY 17 14.908 14.557 -8.638 119 HA3 GLY 17 HA3 GLY 17 14.199 15.978 -9.390 120 H ASN 18 H ASN 18 16.690 14.012 -10.885 121 HA ASN 18 HA ASN 18 14.689 12.849 -12.691 122 HB2 ASN 18 HB2 ASN 18 16.956 14.643 -13.394 123 HB3 ASN 18 HB3 ASN 18 16.644 13.283 -14.468 124 HD21 ASN 18 HD21 ASN 18 16.133 16.401 -14.251 125 HD22 ASN 18 HD22 ASN 18 14.572 16.546 -14.977 126 H CYS 19 H CYS 19 15.398 10.944 -13.809 127 HA CYS 19 HA CYS 19 17.141 9.320 -12.188 128 HB2 CYS 19 HB2 CYS 19 15.713 8.640 -14.767 129 HB3 CYS 19 HB3 CYS 19 16.474 7.492 -13.671 130 H VAL 20 H VAL 20 19.196 8.763 -12.585 131 HA VAL 20 HA VAL 20 20.321 9.203 -15.252 132 HB VAL 20 HB VAL 20 22.344 10.262 -14.257 133 HG11 VAL 20 HG11 VAL 20 21.452 12.451 -14.216 134 HG12 VAL 20 HG12 VAL 20 20.413 11.524 -15.300 135 HG13 VAL 20 HG13 VAL 20 19.880 11.880 -13.657 136 HG21 VAL 20 HG21 VAL 20 22.168 9.538 -11.978 137 HG22 VAL 20 HG22 VAL 20 22.089 11.299 -12.004 138 HG23 VAL 20 HG23 VAL 20 20.616 10.354 -11.788 139 H TYR 21 H TYR 21 22.053 7.882 -15.767 140 HA TYR 21 HA TYR 21 22.166 5.357 -14.647 141 HB2 TYR 21 HB2 TYR 21 23.015 5.761 -16.868 142 HB3 TYR 21 HB3 TYR 21 24.258 6.842 -16.247 143 HD1 TYR 21 HD1 TYR 21 23.113 3.300 -16.088 144 HD2 TYR 21 HD2 TYR 21 26.374 6.010 -15.737 145 HE1 TYR 21 HE1 TYR 21 24.664 1.400 -15.905 146 HE2 TYR 21 HE2 TYR 21 27.934 4.118 -15.555 147 HH TYR 21 HH TYR 21 27.842 1.717 -14.862 148 H ASP 22 H ASP 22 22.976 4.587 -12.821 149 HA ASP 22 HA ASP 22 24.375 6.223 -10.976 150 HB2 ASP 22 HB2 ASP 22 22.853 4.120 -10.591 151 HB3 ASP 22 HB3 ASP 22 24.366 3.235 -10.760 152 H ALA 23 H ALA 23 26.222 6.934 -12.133 153 HA ALA 23 HA ALA 23 28.142 5.182 -13.247 154 HB1 ALA 23 HB1 ALA 23 27.983 8.058 -12.624 155 HB2 ALA 23 HB2 ALA 23 29.607 7.375 -12.710 156 HB3 ALA 23 HB3 ALA 23 28.520 7.239 -14.091 157 H TYR 24 H TYR 24 27.389 5.983 -10.025 158 HA TYR 24 HA TYR 24 30.033 5.420 -8.978 159 HB2 TYR 24 HB2 TYR 24 27.440 6.345 -7.854 160 HB3 TYR 24 HB3 TYR 24 28.524 5.483 -6.768 161 HD1 TYR 24 HD1 TYR 24 29.307 7.878 -9.516 162 HD2 TYR 24 HD2 TYR 24 29.385 7.099 -5.334 163 HE1 TYR 24 HE1 TYR 24 30.588 9.947 -9.161 164 HE2 TYR 24 HE2 TYR 24 30.665 9.167 -4.967 165 HH TYR 24 HH TYR 24 32.357 10.630 -6.790 166 H GLY 25 H GLY 25 27.739 3.522 -10.249 167 HA2 GLY 25 HA2 GLY 25 28.294 1.102 -10.085 168 HA3 GLY 25 HA3 GLY 25 28.274 1.327 -8.342 169 H CYS 26 H CYS 26 26.401 0.764 -11.169 170 HA CYS 26 HA CYS 26 23.873 1.099 -9.754 171 HB2 CYS 26 HB2 CYS 26 22.804 0.842 -11.861 172 HB3 CYS 26 HB3 CYS 26 24.220 1.847 -12.153 173 H GLY 27 H GLY 27 25.866 -1.027 -9.093 174 HA2 GLY 27 HA2 GLY 27 25.516 -3.134 -8.158 175 HA3 GLY 27 HA3 GLY 27 23.956 -3.206 -8.964 176 H ALA 28 H ALA 28 26.153 -2.276 -11.236 177 HA ALA 28 HA ALA 28 26.198 -4.934 -12.400 178 HB1 ALA 28 HB1 ALA 28 25.643 -2.820 -13.682 179 HB2 ALA 28 HB2 ALA 28 27.363 -2.437 -13.602 180 HB3 ALA 28 HB3 ALA 28 26.823 -3.900 -14.425 181 H VAL 29 H VAL 29 27.951 -3.868 -10.065 182 HA VAL 29 HA VAL 29 30.446 -5.029 -11.098 183 HB VAL 29 HB VAL 29 31.723 -3.415 -9.671 184 HG11 VAL 29 HG11 VAL 29 31.934 -1.898 -11.376 185 HG12 VAL 29 HG12 VAL 29 31.099 -3.206 -12.217 186 HG13 VAL 29 HG13 VAL 29 30.196 -1.800 -11.653 187 HG21 VAL 29 HG21 VAL 29 29.665 -1.377 -9.679 188 HG22 VAL 29 HG22 VAL 29 29.210 -2.765 -8.690 189 HG23 VAL 29 HG23 VAL 29 30.718 -1.910 -8.368 Start of MODEL 17 1 H1 ILE 1 H ILE 1 -0.449 4.594 0.967 2 HA ILE 1 HA ILE 1 1.092 2.304 1.289 3 HB ILE 1 HB ILE 1 -0.949 1.019 0.799 4 HG12 ILE 1 HG12 ILE 1 -3.016 2.681 0.467 5 HG13 ILE 1 HG13 ILE 1 -1.784 3.636 -0.352 6 HG21 ILE 1 HG21 ILE 1 -2.235 1.805 2.639 7 HG22 ILE 1 HG22 ILE 1 -0.545 2.155 2.999 8 HG23 ILE 1 HG23 ILE 1 -1.614 3.445 2.452 9 HD11 ILE 1 HD11 ILE 1 -1.584 2.158 -2.065 10 HD12 ILE 1 HD12 ILE 1 -2.021 0.770 -1.068 11 HD13 ILE 1 HD13 ILE 1 -3.271 1.879 -1.631 12 H SER 2 H SER 2 1.543 4.041 -1.215 13 HA SER 2 HA SER 2 2.098 1.795 -2.971 14 HB2 SER 2 HB2 SER 2 -0.001 2.273 -3.898 15 HB3 SER 2 HB3 SER 2 0.186 4.010 -3.663 16 HG SER 2 HG SER 2 1.646 4.063 -5.344 17 H ILE 3 H ILE 3 4.230 2.070 -3.160 18 HA ILE 3 HA ILE 3 5.349 4.749 -3.427 19 HB ILE 3 HB ILE 3 6.825 2.119 -3.321 20 HG12 ILE 3 HG12 ILE 3 6.267 4.047 -1.058 21 HG13 ILE 3 HG13 ILE 3 5.412 2.528 -1.303 22 HG21 ILE 3 HG21 ILE 3 8.504 3.460 -3.958 23 HG22 ILE 3 HG22 ILE 3 7.617 4.927 -3.548 24 HG23 ILE 3 HG23 ILE 3 8.468 4.032 -2.290 25 HD11 ILE 3 HD11 ILE 3 8.302 2.213 -1.255 26 HD12 ILE 3 HD12 ILE 3 7.642 2.884 0.237 27 HD13 ILE 3 HD13 ILE 3 7.047 1.341 -0.376 28 H ASP 4 H ASP 4 6.641 5.403 -5.165 29 HA ASP 4 HA ASP 4 5.811 4.417 -7.713 30 HB2 ASP 4 HB2 ASP 4 6.837 6.277 -8.606 31 HB3 ASP 4 HB3 ASP 4 6.566 6.830 -6.956 32 HA PRO 5 HA PRO 5 8.920 1.466 -8.639 33 HB2 PRO 5 HB2 PRO 5 9.285 1.873 -11.299 34 HB3 PRO 5 HB3 PRO 5 7.834 1.113 -10.633 35 HG2 PRO 5 HG2 PRO 5 8.257 3.943 -11.514 36 HG3 PRO 5 HG3 PRO 5 6.869 2.877 -11.801 37 HD2 PRO 5 HD2 PRO 5 6.866 4.787 -9.882 38 HD3 PRO 5 HD3 PRO 5 5.984 3.257 -9.707 39 HA PRO 6 HA PRO 6 12.969 3.182 -8.651 40 HB2 PRO 6 HB2 PRO 6 14.383 1.373 -10.099 41 HB3 PRO 6 HB3 PRO 6 13.784 1.041 -8.470 42 HG2 PRO 6 HG2 PRO 6 12.630 0.239 -11.114 43 HG3 PRO 6 HG3 PRO 6 12.801 -0.718 -9.631 44 HD2 PRO 6 HD2 PRO 6 10.460 0.430 -10.362 45 HD3 PRO 6 HD3 PRO 6 10.928 0.214 -8.663 46 H CYS 7 H CYS 7 14.866 3.750 -10.139 47 HA CYS 7 HA CYS 7 13.836 5.310 -12.315 48 HB2 CYS 7 HB2 CYS 7 16.461 4.996 -10.948 49 HB3 CYS 7 HB3 CYS 7 16.477 5.627 -12.592 50 H ARG 8 H ARG 8 15.435 5.308 -14.358 51 HA ARG 8 HA ARG 8 14.785 3.085 -15.876 52 HB2 ARG 8 HB2 ARG 8 17.106 4.979 -16.284 53 HB3 ARG 8 HB3 ARG 8 16.439 3.905 -17.505 54 HG2 ARG 8 HG2 ARG 8 14.582 5.804 -16.191 55 HG3 ARG 8 HG3 ARG 8 15.757 6.457 -17.334 56 HD2 ARG 8 HD2 ARG 8 13.999 5.988 -18.735 57 HD3 ARG 8 HD3 ARG 8 14.926 4.493 -18.848 58 HE ARG 8 HE ARG 8 12.939 4.423 -16.786 59 HH11 ARG 8 HH11 ARG 8 13.505 4.003 -20.195 60 HH12 ARG 8 HH12 ARG 8 12.155 2.941 -20.421 61 HH21 ARG 8 HH21 ARG 8 11.159 3.025 -17.070 62 HH22 ARG 8 HH22 ARG 8 10.821 2.386 -18.643 63 H PHE 9 H PHE 9 16.613 1.802 -17.096 64 HA PHE 9 HA PHE 9 17.661 -0.059 -15.305 65 HB2 PHE 9 HB2 PHE 9 17.259 -0.607 -17.643 66 HB3 PHE 9 HB3 PHE 9 18.501 0.533 -18.150 67 HD1 PHE 9 HD1 PHE 9 18.215 -2.325 -15.761 68 HD2 PHE 9 HD2 PHE 9 20.474 -0.407 -18.817 69 HE1 PHE 9 HE1 PHE 9 19.900 -4.114 -15.634 70 HE2 PHE 9 HE2 PHE 9 22.162 -2.193 -18.695 71 HZ PHE 9 HZ PHE 9 21.876 -4.050 -17.103 72 H CYS 10 H CYS 10 19.267 0.136 -13.905 73 HA CYS 10 HA CYS 10 21.239 0.722 -12.935 74 HB2 CYS 10 HB2 CYS 10 21.865 0.916 -15.843 75 HB3 CYS 10 HB3 CYS 10 23.017 1.610 -14.706 76 H TYR 11 H TYR 11 19.082 2.664 -13.278 77 HA TYR 11 HA TYR 11 20.656 5.155 -13.205 78 HB2 TYR 11 HB2 TYR 11 17.949 4.541 -14.294 79 HB3 TYR 11 HB3 TYR 11 18.211 6.130 -13.583 80 HD1 TYR 11 HD1 TYR 11 20.518 4.008 -15.602 81 HD2 TYR 11 HD2 TYR 11 18.271 7.614 -15.372 82 HE1 TYR 11 HE1 TYR 11 21.542 4.773 -17.703 83 HE2 TYR 11 HE2 TYR 11 19.288 8.389 -17.473 84 HH TYR 11 HH TYR 11 21.998 7.135 -18.775 85 H HIS 12 H HIS 12 19.454 6.893 -11.864 86 HA HIS 12 HA HIS 12 17.871 5.994 -9.662 87 HB2 HIS 12 HB2 HIS 12 19.460 6.350 -7.877 88 HB3 HIS 12 HB3 HIS 12 20.125 5.165 -8.997 89 HD1 HIS 12 HD1 HIS 12 22.522 5.538 -9.411 90 HD2 HIS 12 HD2 HIS 12 20.518 9.108 -8.703 91 HE1 HIS 12 HE1 HIS 12 24.279 7.332 -9.542 92 H ARG 13 H ARG 13 17.138 7.715 -8.331 93 HA ARG 13 HA ARG 13 16.910 10.197 -9.697 94 HB2 ARG 13 HB2 ARG 13 15.273 9.028 -8.029 95 HB3 ARG 13 HB3 ARG 13 16.213 9.866 -6.801 96 HG2 ARG 13 HG2 ARG 13 15.743 11.991 -8.110 97 HG3 ARG 13 HG3 ARG 13 14.548 11.046 -8.999 98 HD2 ARG 13 HD2 ARG 13 13.867 10.411 -6.473 99 HD3 ARG 13 HD3 ARG 13 14.508 12.034 -6.218 100 HE ARG 13 HE ARG 13 12.628 11.842 -8.389 101 HH11 ARG 13 HH11 ARG 13 13.027 12.326 -4.965 102 HH12 ARG 13 HH12 ARG 13 11.525 13.168 -4.777 103 HH21 ARG 13 HH21 ARG 13 10.648 12.950 -8.155 104 HH22 ARG 13 HH22 ARG 13 10.172 13.522 -6.592 105 H ASP 14 H ASP 14 18.343 11.785 -9.730 106 HA ASP 14 HA ASP 14 20.494 11.869 -7.791 107 HB2 ASP 14 HB2 ASP 14 21.532 13.458 -9.219 108 HB3 ASP 14 HB3 ASP 14 20.791 12.265 -10.282 109 H GLY 15 H GLY 15 21.103 14.431 -7.398 110 HA2 GLY 15 HA2 GLY 15 19.296 15.249 -5.390 111 HA3 GLY 15 HA3 GLY 15 20.638 16.199 -6.010 112 H SER 16 H SER 16 19.526 16.039 -8.772 113 HA SER 16 HA SER 16 17.931 18.412 -8.623 114 HB2 SER 16 HB2 SER 16 18.468 16.690 -11.053 115 HB3 SER 16 HB3 SER 16 17.971 18.382 -11.037 116 HG SER 16 HG SER 16 19.962 18.924 -10.154 117 H GLY 17 H GLY 17 17.285 15.031 -8.778 118 HA2 GLY 17 HA2 GLY 17 15.134 14.170 -8.202 119 HA3 GLY 17 HA3 GLY 17 14.409 15.626 -8.868 120 H ASN 18 H ASN 18 16.896 13.766 -10.498 121 HA ASN 18 HA ASN 18 14.884 12.684 -12.340 122 HB2 ASN 18 HB2 ASN 18 17.122 14.539 -12.972 123 HB3 ASN 18 HB3 ASN 18 16.809 13.237 -14.116 124 HD21 ASN 18 HD21 ASN 18 16.134 16.351 -13.432 125 HD22 ASN 18 HD22 ASN 18 14.614 16.513 -14.239 126 H CYS 19 H CYS 19 15.617 10.864 -13.594 127 HA CYS 19 HA CYS 19 17.383 9.163 -12.080 128 HB2 CYS 19 HB2 CYS 19 15.958 8.622 -14.693 129 HB3 CYS 19 HB3 CYS 19 16.727 7.420 -13.663 130 H VAL 20 H VAL 20 19.437 8.628 -12.532 131 HA VAL 20 HA VAL 20 20.546 9.242 -15.167 132 HB VAL 20 HB VAL 20 22.551 10.290 -14.139 133 HG11 VAL 20 HG11 VAL 20 20.612 11.582 -15.089 134 HG12 VAL 20 HG12 VAL 20 20.046 11.802 -13.432 135 HG13 VAL 20 HG13 VAL 20 21.608 12.457 -13.926 136 HG21 VAL 20 HG21 VAL 20 20.862 10.182 -11.646 137 HG22 VAL 20 HG22 VAL 20 22.441 9.440 -11.905 138 HG23 VAL 20 HG23 VAL 20 22.295 11.195 -11.823 139 H TYR 21 H TYR 21 22.296 7.978 -15.756 140 HA TYR 21 HA TYR 21 22.455 5.400 -14.772 141 HB2 TYR 21 HB2 TYR 21 23.293 5.947 -16.970 142 HB3 TYR 21 HB3 TYR 21 24.527 6.999 -16.286 143 HD1 TYR 21 HD1 TYR 21 23.405 3.443 -16.286 144 HD2 TYR 21 HD2 TYR 21 26.656 6.157 -15.875 145 HE1 TYR 21 HE1 TYR 21 24.971 1.547 -16.215 146 HE2 TYR 21 HE2 TYR 21 28.230 4.269 -15.805 147 HH TYR 21 HH TYR 21 28.065 1.696 -16.789 148 H ASP 22 H ASP 22 23.253 4.568 -12.970 149 HA ASP 22 HA ASP 22 24.651 6.127 -11.058 150 HB2 ASP 22 HB2 ASP 22 23.129 4.032 -10.733 151 HB3 ASP 22 HB3 ASP 22 24.617 3.127 -10.992 152 H ALA 23 H ALA 23 26.496 6.889 -12.188 153 HA ALA 23 HA ALA 23 28.418 5.190 -13.377 154 HB1 ALA 23 HB1 ALA 23 29.871 7.371 -12.713 155 HB2 ALA 23 HB2 ALA 23 28.825 7.271 -14.129 156 HB3 ALA 23 HB3 ALA 23 28.238 8.034 -12.652 157 H TYR 24 H TYR 24 27.660 5.831 -10.124 158 HA TYR 24 HA TYR 24 30.305 5.234 -9.100 159 HB2 TYR 24 HB2 TYR 24 27.705 6.086 -7.938 160 HB3 TYR 24 HB3 TYR 24 28.791 5.178 -6.893 161 HD1 TYR 24 HD2 TYR 24 29.382 7.815 -9.477 162 HD2 TYR 24 HD1 TYR 24 29.820 6.622 -5.417 163 HE1 TYR 24 HE2 TYR 24 30.649 9.872 -9.016 164 HE2 TYR 24 HE1 TYR 24 31.088 8.677 -4.944 165 HH TYR 24 HH TYR 24 31.774 11.041 -7.506 166 H GLY 25 H GLY 25 28.021 3.386 -10.465 167 HA2 GLY 25 HA2 GLY 25 28.598 0.964 -10.418 168 HA3 GLY 25 HA3 GLY 25 28.565 1.104 -8.666 169 H CYS 26 H CYS 26 26.713 0.672 -11.531 170 HA CYS 26 HA CYS 26 24.176 0.912 -10.112 171 HB2 CYS 26 HB2 CYS 26 23.118 0.758 -12.238 172 HB3 CYS 26 HB3 CYS 26 24.518 1.803 -12.458 173 H GLY 27 H GLY 27 26.168 -1.228 -9.543 174 HA2 GLY 27 HA2 GLY 27 25.657 -3.362 -8.654 175 HA3 GLY 27 HA3 GLY 27 24.287 -3.463 -9.750 176 H ALA 28 H ALA 28 26.810 -2.336 -11.532 177 HA ALA 28 HA ALA 28 28.171 -4.829 -12.017 178 HB1 ALA 28 HB1 ALA 28 25.909 -4.918 -13.244 179 HB2 ALA 28 HB2 ALA 28 26.632 -3.749 -14.350 180 HB3 ALA 28 HB3 ALA 28 27.368 -5.338 -14.140 181 H VAL 29 H VAL 29 29.950 -3.459 -11.492 182 HA VAL 29 HA VAL 29 30.564 -1.263 -13.299 183 HB VAL 29 HB VAL 29 32.553 -0.922 -11.878 184 HG11 VAL 29 HG11 VAL 29 29.784 -0.801 -10.980 185 HG12 VAL 29 HG12 VAL 29 30.945 -0.826 -9.651 186 HG13 VAL 29 HG13 VAL 29 31.057 0.417 -10.897 187 HG21 VAL 29 HG21 VAL 29 32.957 -2.232 -9.923 188 HG22 VAL 29 HG22 VAL 29 31.472 -3.153 -10.164 189 HG23 VAL 29 HG23 VAL 29 32.819 -3.341 -11.287 Start of MODEL 18 1 H1 ILE 1 H ILE 1 -0.528 0.478 0.982 2 HA ILE 1 HA ILE 1 -0.302 3.217 -0.054 3 HB ILE 1 HB ILE 1 1.963 3.414 0.880 4 HG12 ILE 1 HG12 ILE 1 2.274 1.698 2.906 5 HG13 ILE 1 HG13 ILE 1 1.330 0.666 1.837 6 HG21 ILE 1 HG21 ILE 1 -0.352 3.935 2.122 7 HG22 ILE 1 HG22 ILE 1 0.357 2.818 3.287 8 HG23 ILE 1 HG23 ILE 1 1.223 4.285 2.834 9 HD11 ILE 1 HD11 ILE 1 3.513 2.018 0.474 10 HD12 ILE 1 HD12 ILE 1 4.048 0.973 1.791 11 HD13 ILE 1 HD13 ILE 1 3.060 0.314 0.488 12 H SER 2 H SER 2 1.355 3.516 -1.643 13 HA SER 2 HA SER 2 2.737 1.199 -2.682 14 HB2 SER 2 HB2 SER 2 0.687 2.610 -4.407 15 HB3 SER 2 HB3 SER 2 1.739 1.285 -4.905 16 HG SER 2 HG SER 2 0.652 -0.073 -3.500 17 H ILE 3 H ILE 3 4.710 1.963 -3.003 18 HA ILE 3 HA ILE 3 5.151 4.761 -3.603 19 HB ILE 3 HB ILE 3 7.569 4.145 -3.507 20 HG12 ILE 3 HG12 ILE 3 6.609 1.452 -2.540 21 HG13 ILE 3 HG13 ILE 3 7.110 1.734 -4.204 22 HG21 ILE 3 HG21 ILE 3 5.630 3.845 -1.307 23 HG22 ILE 3 HG22 ILE 3 7.261 3.259 -0.987 24 HG23 ILE 3 HG23 ILE 3 7.006 4.935 -1.469 25 HD11 ILE 3 HD11 ILE 3 9.148 2.750 -2.548 26 HD12 ILE 3 HD12 ILE 3 8.707 1.159 -1.925 27 HD13 ILE 3 HD13 ILE 3 9.198 1.342 -3.609 28 H ASP 4 H ASP 4 6.469 5.486 -5.382 29 HA ASP 4 HA ASP 4 5.672 4.368 -7.862 30 HB2 ASP 4 HB2 ASP 4 7.381 6.045 -8.783 31 HB3 ASP 4 HB3 ASP 4 6.026 6.696 -7.866 32 HA PRO 5 HA PRO 5 8.832 1.470 -8.786 33 HB2 PRO 5 HB2 PRO 5 9.178 1.846 -11.452 34 HB3 PRO 5 HB3 PRO 5 7.742 1.073 -10.769 35 HG2 PRO 5 HG2 PRO 5 8.116 3.897 -11.690 36 HG3 PRO 5 HG3 PRO 5 6.744 2.805 -11.957 37 HD2 PRO 5 HD2 PRO 5 6.719 4.741 -10.064 38 HD3 PRO 5 HD3 PRO 5 5.862 3.199 -9.864 39 HA PRO 6 HA PRO 6 12.852 3.248 -8.839 40 HB2 PRO 6 HB2 PRO 6 14.288 1.445 -10.273 41 HB3 PRO 6 HB3 PRO 6 13.702 1.123 -8.637 42 HG2 PRO 6 HG2 PRO 6 12.549 0.270 -11.264 43 HG3 PRO 6 HG3 PRO 6 12.742 -0.666 -9.771 44 HD2 PRO 6 HD2 PRO 6 10.379 0.436 -10.505 45 HD3 PRO 6 HD3 PRO 6 10.859 0.249 -8.805 46 H CYS 7 H CYS 7 14.742 3.807 -10.355 47 HA CYS 7 HA CYS 7 13.680 5.342 -12.533 48 HB2 CYS 7 HB2 CYS 7 16.322 5.050 -11.197 49 HB3 CYS 7 HB3 CYS 7 16.316 5.664 -12.846 50 H ARG 8 H ARG 8 15.253 5.326 -14.596 51 HA ARG 8 HA ARG 8 14.590 3.091 -16.089 52 HB2 ARG 8 HB2 ARG 8 16.804 5.107 -16.478 53 HB3 ARG 8 HB3 ARG 8 16.390 3.887 -17.675 54 HG2 ARG 8 HG2 ARG 8 15.156 5.610 -18.475 55 HG3 ARG 8 HG3 ARG 8 13.975 4.925 -17.356 56 HD2 ARG 8 HD2 ARG 8 14.264 6.612 -15.810 57 HD3 ARG 8 HD3 ARG 8 15.884 7.003 -16.385 58 HE ARG 8 HE ARG 8 14.960 8.453 -17.895 59 HH11 ARG 8 HH11 ARG 8 12.476 6.342 -16.672 60 HH12 ARG 8 HH12 ARG 8 11.183 7.210 -17.430 61 HH21 ARG 8 HH21 ARG 8 13.266 9.605 -18.898 62 HH22 ARG 8 HH22 ARG 8 11.633 9.065 -18.697 63 H PHE 9 H PHE 9 16.394 1.787 -17.312 64 HA PHE 9 HA PHE 9 17.463 -0.055 -15.514 65 HB2 PHE 9 HB2 PHE 9 17.033 -0.633 -17.838 66 HB3 PHE 9 HB3 PHE 9 18.262 0.507 -18.377 67 HD1 PHE 9 HD1 PHE 9 18.075 -2.275 -15.890 68 HD2 PHE 9 HD2 PHE 9 20.180 -0.482 -19.126 69 HE1 PHE 9 HE1 PHE 9 19.769 -4.055 -15.769 70 HE2 PHE 9 HE2 PHE 9 21.877 -2.260 -19.011 71 HZ PHE 9 HZ PHE 9 21.673 -4.050 -17.332 72 H CYS 10 H CYS 10 19.079 0.161 -14.131 73 HA CYS 10 HA CYS 10 21.063 0.753 -13.189 74 HB2 CYS 10 HB2 CYS 10 21.661 0.905 -16.106 75 HB3 CYS 10 HB3 CYS 10 22.826 1.610 -14.990 76 H TYR 11 H TYR 11 18.909 2.696 -13.533 77 HA TYR 11 HA TYR 11 20.491 5.183 -13.516 78 HB2 TYR 11 HB2 TYR 11 17.767 4.561 -14.556 79 HB3 TYR 11 HB3 TYR 11 18.043 6.159 -13.872 80 HD1 TYR 11 HD1 TYR 11 20.311 4.000 -15.897 81 HD2 TYR 11 HD2 TYR 11 18.084 7.619 -15.681 82 HE1 TYR 11 HE1 TYR 11 21.307 4.732 -18.023 83 HE2 TYR 11 HE2 TYR 11 19.072 8.360 -17.808 84 HH TYR 11 HH TYR 11 21.421 7.720 -19.067 85 H HIS 12 H HIS 12 19.306 6.943 -12.184 86 HA HIS 12 HA HIS 12 17.756 6.077 -9.946 87 HB2 HIS 12 HB2 HIS 12 19.371 6.460 -8.190 88 HB3 HIS 12 HB3 HIS 12 20.019 5.257 -9.301 89 HD1 HIS 12 HD1 HIS 12 22.408 5.621 -9.762 90 HD2 HIS 12 HD2 HIS 12 20.421 9.203 -9.069 91 HE1 HIS 12 HE1 HIS 12 24.165 7.411 -9.946 92 H ARG 13 H ARG 13 17.035 7.816 -8.636 93 HA ARG 13 HA ARG 13 16.797 10.281 -10.035 94 HB2 ARG 13 HB2 ARG 13 15.183 9.124 -8.323 95 HB3 ARG 13 HB3 ARG 13 16.124 10.009 -7.130 96 HG2 ARG 13 HG2 ARG 13 15.622 12.068 -8.610 97 HG3 ARG 13 HG3 ARG 13 14.340 11.059 -9.282 98 HD2 ARG 13 HD2 ARG 13 14.422 10.998 -6.374 99 HD3 ARG 13 HD3 ARG 13 14.168 12.620 -7.015 100 HE ARG 13 HE ARG 13 12.413 11.069 -8.405 101 HH11 ARG 13 HH11 ARG 13 13.032 11.642 -5.027 102 HH12 ARG 13 HH12 ARG 13 11.390 11.369 -4.546 103 HH21 ARG 13 HH21 ARG 13 10.248 10.708 -7.784 104 HH22 ARG 13 HH22 ARG 13 9.807 10.838 -6.115 105 H ASP 14 H ASP 14 18.224 11.873 -10.096 106 HA ASP 14 HA ASP 14 20.397 11.977 -8.183 107 HB2 ASP 14 HB2 ASP 14 21.411 13.564 -9.634 108 HB3 ASP 14 HB3 ASP 14 20.668 12.354 -10.677 109 H GLY 15 H GLY 15 21.007 14.538 -7.809 110 HA2 GLY 15 HA2 GLY 15 19.215 15.369 -5.791 111 HA3 GLY 15 HA3 GLY 15 20.556 16.313 -6.424 112 H SER 16 H SER 16 19.410 16.125 -9.180 113 HA SER 16 HA SER 16 17.834 18.511 -9.038 114 HB2 SER 16 HB2 SER 16 18.328 16.758 -11.454 115 HB3 SER 16 HB3 SER 16 17.843 18.453 -11.451 116 HG SER 16 HG SER 16 19.857 18.960 -10.525 117 H GLY 17 H GLY 17 17.171 15.120 -9.219 118 HA2 GLY 17 HA2 GLY 17 15.014 14.290 -8.577 119 HA3 GLY 17 HA3 GLY 17 14.294 15.739 -9.264 120 H ASN 18 H ASN 18 16.762 13.849 -10.884 121 HA ASN 18 HA ASN 18 14.732 12.737 -12.689 122 HB2 ASN 18 HB2 ASN 18 16.966 14.579 -13.372 123 HB3 ASN 18 HB3 ASN 18 16.640 13.259 -14.492 124 HD21 ASN 18 HD21 ASN 18 15.774 16.351 -13.511 125 HD22 ASN 18 HD22 ASN 18 14.324 16.515 -14.438 126 H CYS 19 H CYS 19 15.461 10.901 -13.930 127 HA CYS 19 HA CYS 19 17.243 9.225 -12.401 128 HB2 CYS 19 HB2 CYS 19 15.776 8.635 -14.981 129 HB3 CYS 19 HB3 CYS 19 16.565 7.452 -13.943 130 H VAL 20 H VAL 20 19.287 8.670 -12.879 131 HA VAL 20 HA VAL 20 20.356 9.241 -15.540 132 HB VAL 20 HB VAL 20 22.381 10.299 -14.559 133 HG11 VAL 20 HG11 VAL 20 19.939 11.870 -13.789 134 HG12 VAL 20 HG12 VAL 20 21.467 12.460 -14.446 135 HG13 VAL 20 HG13 VAL 20 20.356 11.552 -15.472 136 HG21 VAL 20 HG21 VAL 20 22.159 11.244 -12.256 137 HG22 VAL 20 HG22 VAL 20 20.729 10.235 -12.038 138 HG23 VAL 20 HG23 VAL 20 22.303 9.487 -12.311 139 H TYR 21 H TYR 21 22.098 7.965 -16.134 140 HA TYR 21 HA TYR 21 22.265 5.402 -15.114 141 HB2 TYR 21 HB2 TYR 21 23.073 5.911 -17.332 142 HB3 TYR 21 HB3 TYR 21 24.317 6.973 -16.682 143 HD1 TYR 21 HD2 TYR 21 23.195 3.419 -16.618 144 HD2 TYR 21 HD1 TYR 21 26.451 6.137 -16.283 145 HE1 TYR 21 HE2 TYR 21 24.761 1.524 -16.538 146 HE2 TYR 21 HE1 TYR 21 28.026 4.250 -16.203 147 HH TYR 21 HH TYR 21 27.358 1.327 -15.443 148 H ASP 22 H ASP 22 23.087 4.594 -13.311 149 HA ASP 22 HA ASP 22 24.514 6.178 -11.443 150 HB2 ASP 22 HB2 ASP 22 22.994 4.089 -11.068 151 HB3 ASP 22 HB3 ASP 22 24.479 3.180 -11.331 152 H ALA 23 H ALA 23 26.347 6.922 -12.596 153 HA ALA 23 HA ALA 23 28.249 5.203 -13.792 154 HB1 ALA 23 HB1 ALA 23 29.728 7.372 -13.215 155 HB2 ALA 23 HB2 ALA 23 28.608 7.289 -14.576 156 HB3 ALA 23 HB3 ALA 23 28.110 8.059 -13.070 157 H TYR 24 H TYR 24 27.535 5.890 -10.538 158 HA TYR 24 HA TYR 24 30.194 5.304 -9.542 159 HB2 TYR 24 HB2 TYR 24 27.611 6.178 -8.357 160 HB3 TYR 24 HB3 TYR 24 28.710 5.283 -7.313 161 HD1 TYR 24 HD2 TYR 24 28.574 8.237 -9.577 162 HD2 TYR 24 HD1 TYR 24 30.459 6.390 -6.240 163 HE1 TYR 24 HE2 TYR 24 29.849 10.300 -9.164 164 HE2 TYR 24 HE1 TYR 24 31.739 8.448 -5.817 165 HH TYR 24 HH TYR 24 32.299 10.466 -6.616 166 H GLY 25 H GLY 25 27.890 3.441 -10.850 167 HA2 GLY 25 HA2 GLY 25 28.461 1.018 -10.775 168 HA3 GLY 25 HA3 GLY 25 28.453 1.184 -9.025 169 H CYS 26 H CYS 26 26.561 0.714 -11.857 170 HA CYS 26 HA CYS 26 24.043 0.982 -10.408 171 HB2 CYS 26 HB2 CYS 26 22.956 0.796 -12.517 172 HB3 CYS 26 HB3 CYS 26 24.356 1.832 -12.774 173 H GLY 27 H GLY 27 26.039 -1.153 -9.831 174 HA2 GLY 27 HA2 GLY 27 25.235 -3.236 -8.836 175 HA3 GLY 27 HA3 GLY 27 24.233 -3.451 -10.264 176 H ALA 28 H ALA 28 27.115 -2.227 -11.297 177 HA ALA 28 HA ALA 28 27.970 -4.831 -12.254 178 HB1 ALA 28 HB1 ALA 28 29.740 -2.715 -13.024 179 HB2 ALA 28 HB2 ALA 28 28.663 -3.690 -14.025 180 HB3 ALA 28 HB3 ALA 28 28.067 -2.213 -13.268 181 H VAL 29 H VAL 29 28.333 -3.659 -9.398 182 HA VAL 29 HA VAL 29 31.241 -4.059 -9.192 183 HB VAL 29 HB VAL 29 30.335 -1.927 -8.280 184 HG11 VAL 29 HG11 VAL 29 28.214 -3.223 -7.442 185 HG12 VAL 29 HG12 VAL 29 29.180 -3.433 -5.981 186 HG13 VAL 29 HG13 VAL 29 28.809 -1.812 -6.568 187 HG21 VAL 29 HG21 VAL 29 32.409 -3.083 -7.428 188 HG22 VAL 29 HG22 VAL 29 31.657 -1.945 -6.309 189 HG23 VAL 29 HG23 VAL 29 31.428 -3.680 -6.089 Start of MODEL 19 1 H1 ILE 1 H ILE 1 -0.427 4.214 -0.714 2 HA ILE 1 HA ILE 1 0.775 2.448 1.285 3 HB ILE 1 HB ILE 1 -1.547 1.722 -0.476 4 HG12 ILE 1 HG12 ILE 1 -2.131 3.859 0.535 5 HG13 ILE 1 HG13 ILE 1 -3.043 2.566 1.306 6 HG21 ILE 1 HG21 ILE 1 -0.104 0.420 1.562 7 HG22 ILE 1 HG22 ILE 1 -1.692 0.803 2.225 8 HG23 ILE 1 HG23 ILE 1 -1.560 -0.135 0.737 9 HD11 ILE 1 HD11 ILE 1 -0.785 2.775 2.867 10 HD12 ILE 1 HD12 ILE 1 -1.158 4.446 2.442 11 HD13 ILE 1 HD13 ILE 1 -2.376 3.443 3.230 12 H SER 2 H SER 2 2.251 3.182 -1.094 13 HA SER 2 HA SER 2 3.215 0.645 -1.847 14 HB2 SER 2 HB2 SER 2 0.996 0.849 -3.161 15 HB3 SER 2 HB3 SER 2 1.858 2.025 -4.153 16 HG SER 2 HG SER 2 2.004 -0.098 -5.003 17 H ILE 3 H ILE 3 5.283 0.910 -2.369 18 HA ILE 3 HA ILE 3 6.293 3.582 -2.846 19 HB ILE 3 HB ILE 3 8.532 2.474 -2.797 20 HG12 ILE 3 HG12 ILE 3 6.992 0.004 -1.988 21 HG13 ILE 3 HG13 ILE 3 7.648 0.249 -3.602 22 HG21 ILE 3 HG21 ILE 3 8.603 2.487 -0.514 23 HG22 ILE 3 HG22 ILE 3 7.048 3.279 -0.769 24 HG23 ILE 3 HG23 ILE 3 7.107 1.567 -0.352 25 HD11 ILE 3 HD11 ILE 3 9.898 0.562 -2.437 26 HD12 ILE 3 HD12 ILE 3 9.113 -0.144 -1.024 27 HD13 ILE 3 HD13 ILE 3 9.229 -1.067 -2.522 28 H ASP 4 H ASP 4 7.277 4.320 -4.685 29 HA ASP 4 HA ASP 4 6.511 3.094 -7.148 30 HB2 ASP 4 HB2 ASP 4 7.949 4.971 -8.130 31 HB3 ASP 4 HB3 ASP 4 6.553 5.453 -7.170 32 HA PRO 5 HA PRO 5 10.007 0.627 -8.111 33 HB2 PRO 5 HB2 PRO 5 10.238 1.004 -10.790 34 HB3 PRO 5 HB3 PRO 5 8.935 0.057 -10.061 35 HG2 PRO 5 HG2 PRO 5 8.905 2.891 -11.027 36 HG3 PRO 5 HG3 PRO 5 7.686 1.622 -11.245 37 HD2 PRO 5 HD2 PRO 5 7.447 3.567 -9.376 38 HD3 PRO 5 HD3 PRO 5 6.809 1.928 -9.135 39 HA PRO 6 HA PRO 6 13.750 2.929 -8.284 40 HB2 PRO 6 HB2 PRO 6 15.385 1.305 -9.718 41 HB3 PRO 6 HB3 PRO 6 14.880 0.941 -8.063 42 HG2 PRO 6 HG2 PRO 6 13.799 -0.112 -10.648 43 HG3 PRO 6 HG3 PRO 6 14.146 -0.983 -9.143 44 HD2 PRO 6 HD2 PRO 6 11.643 -0.222 -9.842 45 HD3 PRO 6 HD3 PRO 6 12.177 -0.308 -8.151 46 H CYS 7 H CYS 7 15.514 3.707 -9.850 47 HA CYS 7 HA CYS 7 14.248 5.121 -11.970 48 HB2 CYS 7 HB2 CYS 7 17.002 4.950 -10.851 49 HB3 CYS 7 HB3 CYS 7 16.828 5.581 -12.485 50 H ARG 8 H ARG 8 15.657 5.190 -14.147 51 HA ARG 8 HA ARG 8 14.989 2.929 -15.600 52 HB2 ARG 8 HB2 ARG 8 16.854 5.217 -16.078 53 HB3 ARG 8 HB3 ARG 8 16.862 3.862 -17.199 54 HG2 ARG 8 HG2 ARG 8 14.562 4.205 -17.742 55 HG3 ARG 8 HG3 ARG 8 14.393 5.416 -16.470 56 HD2 ARG 8 HD2 ARG 8 14.626 6.346 -18.782 57 HD3 ARG 8 HD3 ARG 8 15.815 6.939 -17.623 58 HE ARG 8 HE ARG 8 16.867 4.709 -18.973 59 HH11 ARG 8 HH11 ARG 8 16.010 8.037 -19.531 60 HH12 ARG 8 HH12 ARG 8 17.182 8.264 -20.786 61 HH21 ARG 8 HH21 ARG 8 18.414 4.996 -20.625 62 HH22 ARG 8 HH22 ARG 8 18.548 6.533 -21.408 63 H PHE 9 H PHE 9 16.749 1.714 -16.966 64 HA PHE 9 HA PHE 9 18.046 -0.074 -15.269 65 HB2 PHE 9 HB2 PHE 9 17.464 -0.677 -17.550 66 HB3 PHE 9 HB3 PHE 9 18.578 0.530 -18.184 67 HD1 PHE 9 HD2 PHE 9 18.888 -2.122 -15.576 68 HD2 PHE 9 HD1 PHE 9 20.346 -0.487 -19.226 69 HE1 PHE 9 HE2 PHE 9 20.684 -3.803 -15.608 70 HE2 PHE 9 HE1 PHE 9 22.144 -2.166 -19.263 71 HZ PHE 9 HZ PHE 9 22.316 -3.826 -17.452 72 H CYS 10 H CYS 10 19.742 0.242 -14.004 73 HA CYS 10 HA CYS 10 21.766 0.926 -13.222 74 HB2 CYS 10 HB2 CYS 10 22.126 1.090 -16.176 75 HB3 CYS 10 HB3 CYS 10 23.336 1.865 -15.159 76 H TYR 11 H TYR 11 19.500 2.761 -13.398 77 HA TYR 11 HA TYR 11 20.950 5.324 -13.520 78 HB2 TYR 11 HB2 TYR 11 18.173 4.559 -14.295 79 HB3 TYR 11 HB3 TYR 11 18.436 6.175 -13.648 80 HD1 TYR 11 HD1 TYR 11 20.608 4.111 -15.866 81 HD2 TYR 11 HD2 TYR 11 18.227 7.614 -15.464 82 HE1 TYR 11 HE1 TYR 11 21.359 4.868 -18.082 83 HE2 TYR 11 HE2 TYR 11 18.971 8.381 -17.679 84 HH TYR 11 HH TYR 11 20.801 8.042 -19.225 85 H HIS 12 H HIS 12 19.791 7.030 -12.088 86 HA HIS 12 HA HIS 12 18.513 6.094 -9.710 87 HB2 HIS 12 HB2 HIS 12 20.263 6.588 -8.117 88 HB3 HIS 12 HB3 HIS 12 20.870 5.413 -9.280 89 HD1 HIS 12 HD1 HIS 12 23.182 5.908 -9.963 90 HD2 HIS 12 HD2 HIS 12 21.062 9.378 -9.110 91 HE1 HIS 12 HE1 HIS 12 24.806 7.793 -10.323 92 H ARG 13 H ARG 13 17.809 7.797 -8.351 93 HA ARG 13 HA ARG 13 17.308 10.236 -9.727 94 HB2 ARG 13 HB2 ARG 13 15.922 8.992 -7.875 95 HB3 ARG 13 HB3 ARG 13 16.901 9.954 -6.776 96 HG2 ARG 13 HG2 ARG 13 16.143 11.960 -8.196 97 HG3 ARG 13 HG3 ARG 13 14.896 10.867 -8.798 98 HD2 ARG 13 HD2 ARG 13 15.212 10.880 -5.881 99 HD3 ARG 13 HD3 ARG 13 14.674 12.412 -6.567 100 HE ARG 13 HE ARG 13 13.174 9.970 -6.392 101 HH11 ARG 13 HH11 ARG 13 13.557 12.969 -8.119 102 HH12 ARG 13 HH12 ARG 13 11.920 13.003 -8.684 103 HH21 ARG 13 HH21 ARG 13 11.016 10.004 -7.130 104 HH22 ARG 13 HH22 ARG 13 10.475 11.317 -8.120 105 H ASP 14 H ASP 14 18.628 11.909 -9.909 106 HA ASP 14 HA ASP 14 20.946 12.148 -8.188 107 HB2 ASP 14 HB2 ASP 14 21.739 13.784 -9.721 108 HB3 ASP 14 HB3 ASP 14 20.983 12.527 -10.696 109 H GLY 15 H GLY 15 21.435 14.746 -7.874 110 HA2 GLY 15 HA2 GLY 15 19.778 15.481 -5.709 111 HA3 GLY 15 HA3 GLY 15 21.000 16.499 -6.457 112 H SER 16 H SER 16 19.638 16.232 -9.102 113 HA SER 16 HA SER 16 17.937 18.517 -8.824 114 HB2 SER 16 HB2 SER 16 19.464 17.939 -10.811 115 HB3 SER 16 HB3 SER 16 18.185 16.832 -11.312 116 HG SER 16 HG SER 16 18.180 19.116 -12.133 117 H GLY 17 H GLY 17 17.468 15.097 -8.922 118 HA2 GLY 17 HA2 GLY 17 15.430 14.136 -8.114 119 HA3 GLY 17 HA3 GLY 17 14.567 15.537 -8.732 120 H ASN 18 H ASN 18 16.995 13.793 -10.563 121 HA ASN 18 HA ASN 18 14.885 12.565 -12.194 122 HB2 ASN 18 HB2 ASN 18 16.955 14.521 -13.055 123 HB3 ASN 18 HB3 ASN 18 16.609 13.183 -14.146 124 HD21 ASN 18 HD21 ASN 18 15.949 16.252 -13.760 125 HD22 ASN 18 HD22 ASN 18 14.311 16.327 -14.305 126 H CYS 19 H CYS 19 15.593 10.757 -13.474 127 HA CYS 19 HA CYS 19 17.596 9.193 -12.108 128 HB2 CYS 19 HB2 CYS 19 15.931 8.500 -14.538 129 HB3 CYS 19 HB3 CYS 19 16.874 7.371 -13.570 130 H VAL 20 H VAL 20 19.617 8.757 -12.764 131 HA VAL 20 HA VAL 20 20.403 9.351 -15.518 132 HB VAL 20 HB VAL 20 22.453 10.520 -14.728 133 HG11 VAL 20 HG11 VAL 20 20.072 12.029 -13.720 134 HG12 VAL 20 HG12 VAL 20 21.453 12.613 -14.650 135 HG13 VAL 20 HG13 VAL 20 20.219 11.622 -15.429 136 HG21 VAL 20 HG21 VAL 20 22.598 9.728 -12.472 137 HG22 VAL 20 HG22 VAL 20 22.396 11.479 -12.426 138 HG23 VAL 20 HG23 VAL 20 21.027 10.424 -12.073 139 H TYR 21 H TYR 21 22.145 8.161 -16.266 140 HA TYR 21 HA TYR 21 22.544 5.621 -15.251 141 HB2 TYR 21 HB2 TYR 21 23.116 6.143 -17.536 142 HB3 TYR 21 HB3 TYR 21 24.350 7.285 -17.015 143 HD1 TYR 21 HD2 TYR 21 23.452 3.674 -16.864 144 HD2 TYR 21 HD1 TYR 21 26.557 6.581 -16.763 145 HE1 TYR 21 HE2 TYR 21 25.130 1.876 -16.916 146 HE2 TYR 21 HE1 TYR 21 28.243 4.791 -16.816 147 HH TYR 21 HH TYR 21 27.548 1.592 -16.196 148 H ASP 22 H ASP 22 23.598 4.858 -13.551 149 HA ASP 22 HA ASP 22 25.085 6.534 -11.813 150 HB2 ASP 22 HB2 ASP 22 23.749 4.331 -11.332 151 HB3 ASP 22 HB3 ASP 22 25.282 3.546 -11.703 152 H ALA 23 H ALA 23 26.746 7.396 -13.139 153 HA ALA 23 HA ALA 23 28.637 5.806 -14.514 154 HB1 ALA 23 HB1 ALA 23 28.790 7.906 -15.321 155 HB2 ALA 23 HB2 ALA 23 28.371 8.647 -13.776 156 HB3 ALA 23 HB3 ALA 23 30.014 8.073 -14.062 157 H TYR 24 H TYR 24 28.194 6.462 -11.203 158 HA TYR 24 HA TYR 24 30.967 6.044 -10.469 159 HB2 TYR 24 HB2 TYR 24 28.462 6.764 -9.040 160 HB3 TYR 24 HB3 TYR 24 29.708 5.943 -8.108 161 HD1 TYR 24 HD2 TYR 24 28.846 9.000 -9.941 162 HD2 TYR 24 HD1 TYR 24 31.811 7.032 -7.609 163 HE1 TYR 24 HE2 TYR 24 30.025 11.138 -9.647 164 HE2 TYR 24 HE1 TYR 24 32.999 9.165 -7.308 165 HH TYR 24 HH TYR 24 32.077 11.814 -7.410 166 H GLY 25 H GLY 25 28.668 4.037 -11.551 167 HA2 GLY 25 HA2 GLY 25 29.389 1.655 -11.536 168 HA3 GLY 25 HA3 GLY 25 29.546 1.827 -9.794 169 H CYS 26 H CYS 26 27.414 1.225 -12.422 170 HA CYS 26 HA CYS 26 25.040 1.349 -10.732 171 HB2 CYS 26 HB2 CYS 26 23.764 1.091 -12.719 172 HB3 CYS 26 HB3 CYS 26 25.077 2.192 -13.126 173 H GLY 27 H GLY 27 27.225 -0.661 -10.376 174 HA2 GLY 27 HA2 GLY 27 25.986 -3.173 -11.150 175 HA3 GLY 27 HA3 GLY 27 27.512 -2.978 -10.299 176 H ALA 28 H ALA 28 25.326 -1.049 -8.766 177 HA ALA 28 HA ALA 28 25.048 -2.952 -6.592 178 HB1 ALA 28 HB1 ALA 28 25.539 -1.001 -5.580 179 HB2 ALA 28 HB2 ALA 28 24.869 -0.028 -6.890 180 HB3 ALA 28 HB3 ALA 28 23.798 -0.743 -5.685 181 H VAL 29 H VAL 29 23.448 -2.886 -9.256 182 HA VAL 29 HA VAL 29 20.747 -2.861 -8.097 183 HB VAL 29 HB VAL 29 21.147 -1.460 -10.122 184 HG11 VAL 29 HG11 VAL 29 22.716 -3.306 -11.084 185 HG12 VAL 29 HG12 VAL 29 21.220 -3.960 -11.755 186 HG13 VAL 29 HG13 VAL 29 21.737 -2.327 -12.175 187 HG21 VAL 29 HG21 VAL 29 19.244 -2.989 -11.422 188 HG22 VAL 29 HG22 VAL 29 19.068 -3.449 -9.729 189 HG23 VAL 29 HG23 VAL 29 18.936 -1.754 -10.201 Start of MODEL 20 1 H1 ILE 1 H ILE 1 1.930 -2.392 -2.584 2 HA ILE 1 HA ILE 1 2.253 -0.242 -0.788 3 HB ILE 1 HB ILE 1 4.121 -1.659 -1.587 4 HG12 ILE 1 HG12 ILE 1 5.609 0.465 -2.232 5 HG13 ILE 1 HG13 ILE 1 4.169 1.317 -1.684 6 HG21 ILE 1 HG21 ILE 1 4.134 -0.044 -4.112 7 HG22 ILE 1 HG22 ILE 1 5.007 -1.530 -3.742 8 HG23 ILE 1 HG23 ILE 1 3.263 -1.573 -4.002 9 HD11 ILE 1 HD11 ILE 1 4.548 0.823 0.467 10 HD12 ILE 1 HD12 ILE 1 5.112 -0.809 0.103 11 HD13 ILE 1 HD13 ILE 1 6.203 0.563 -0.084 12 H SER 2 H SER 2 1.962 1.892 -0.993 13 HA SER 2 HA SER 2 0.885 2.883 -3.524 14 HB2 SER 2 HB2 SER 2 0.822 3.903 -0.693 15 HB3 SER 2 HB3 SER 2 0.411 4.955 -2.047 16 HG SER 2 HG SER 2 -0.805 2.433 -1.602 17 H ILE 3 H ILE 3 3.712 2.341 -3.273 18 HA ILE 3 HA ILE 3 4.841 5.056 -3.372 19 HB ILE 3 HB ILE 3 6.327 2.437 -3.147 20 HG12 ILE 3 HG12 ILE 3 4.883 3.080 -1.160 21 HG13 ILE 3 HG13 ILE 3 6.598 2.871 -0.823 22 HG21 ILE 3 HG21 ILE 3 8.184 4.022 -2.427 23 HG22 ILE 3 HG22 ILE 3 7.766 4.006 -4.140 24 HG23 ILE 3 HG23 ILE 3 7.192 5.313 -3.105 25 HD11 ILE 3 HD11 ILE 3 5.425 4.862 0.229 26 HD12 ILE 3 HD12 ILE 3 6.946 5.172 -0.608 27 HD13 ILE 3 HD13 ILE 3 5.414 5.564 -1.388 28 H ASP 4 H ASP 4 6.138 5.688 -5.113 29 HA ASP 4 HA ASP 4 5.344 4.659 -7.645 30 HB2 ASP 4 HB2 ASP 4 6.438 6.473 -8.565 31 HB3 ASP 4 HB3 ASP 4 6.127 7.069 -6.937 32 HA PRO 5 HA PRO 5 8.399 1.624 -8.482 33 HB2 PRO 5 HB2 PRO 5 8.790 1.966 -11.146 34 HB3 PRO 5 HB3 PRO 5 7.319 1.250 -10.475 35 HG2 PRO 5 HG2 PRO 5 7.805 4.051 -11.413 36 HG3 PRO 5 HG3 PRO 5 6.398 3.008 -11.688 37 HD2 PRO 5 HD2 PRO 5 6.420 4.958 -9.810 38 HD3 PRO 5 HD3 PRO 5 5.506 3.450 -9.609 39 HA PRO 6 HA PRO 6 12.482 3.255 -8.503 40 HB2 PRO 6 HB2 PRO 6 13.867 1.393 -9.911 41 HB3 PRO 6 HB3 PRO 6 13.252 1.102 -8.280 42 HG2 PRO 6 HG2 PRO 6 12.097 0.276 -10.915 43 HG3 PRO 6 HG3 PRO 6 12.240 -0.658 -9.415 44 HD2 PRO 6 HD2 PRO 6 9.927 0.524 -10.180 45 HD3 PRO 6 HD3 PRO 6 10.381 0.330 -8.475 46 H CYS 7 H CYS 7 14.403 3.746 -9.996 47 HA CYS 7 HA CYS 7 13.414 5.289 -12.206 48 HB2 CYS 7 HB2 CYS 7 16.026 4.952 -10.818 49 HB3 CYS 7 HB3 CYS 7 16.059 5.559 -12.470 50 H ARG 8 H ARG 8 15.028 5.219 -14.236 51 HA ARG 8 HA ARG 8 14.348 2.983 -15.719 52 HB2 ARG 8 HB2 ARG 8 16.359 5.161 -16.036 53 HB3 ARG 8 HB3 ARG 8 16.478 3.767 -17.102 54 HG2 ARG 8 HG2 ARG 8 14.067 4.151 -17.699 55 HG3 ARG 8 HG3 ARG 8 14.174 5.676 -16.817 56 HD2 ARG 8 HD2 ARG 8 16.167 5.016 -18.948 57 HD3 ARG 8 HD3 ARG 8 14.579 5.645 -19.382 58 HE ARG 8 HE ARG 8 16.758 7.117 -18.301 59 HH11 ARG 8 HH11 ARG 8 13.284 6.899 -18.315 60 HH12 ARG 8 HH12 ARG 8 13.047 8.578 -17.958 61 HH21 ARG 8 HH21 ARG 8 16.459 9.329 -17.830 62 HH22 ARG 8 HH22 ARG 8 14.854 9.960 -17.683 63 H PHE 9 H PHE 9 16.140 1.621 -16.889 64 HA PHE 9 HA PHE 9 17.137 -0.219 -15.050 65 HB2 PHE 9 HB2 PHE 9 16.737 -0.823 -17.370 66 HB3 PHE 9 HB3 PHE 9 17.992 0.289 -17.906 67 HD1 PHE 9 HD2 PHE 9 17.989 -2.189 -15.130 68 HD2 PHE 9 HD1 PHE 9 19.639 -1.008 -18.872 69 HE1 PHE 9 HE2 PHE 9 19.653 -3.993 -14.962 70 HE2 PHE 9 HE1 PHE 9 21.305 -2.811 -18.710 71 HZ PHE 9 HZ PHE 9 21.314 -4.306 -16.753 72 H CYS 10 H CYS 10 18.718 0.007 -13.627 73 HA CYS 10 HA CYS 10 20.700 0.563 -12.660 74 HB2 CYS 10 HB2 CYS 10 21.355 0.635 -15.565 75 HB3 CYS 10 HB3 CYS 10 22.512 1.357 -14.450 76 H TYR 11 H TYR 11 18.598 2.547 -13.084 77 HA TYR 11 HA TYR 11 20.232 5.000 -13.094 78 HB2 TYR 11 HB2 TYR 11 17.496 4.416 -14.129 79 HB3 TYR 11 HB3 TYR 11 17.810 6.022 -13.482 80 HD1 TYR 11 HD2 TYR 11 20.031 3.763 -15.448 81 HD2 TYR 11 HD1 TYR 11 17.883 7.434 -15.329 82 HE1 TYR 11 HE2 TYR 11 21.047 4.420 -17.589 83 HE2 TYR 11 HE1 TYR 11 18.892 8.101 -17.471 84 HH TYR 11 HH TYR 11 21.493 6.328 -18.908 85 H HIS 12 H HIS 12 19.050 6.811 -11.810 86 HA HIS 12 HA HIS 12 17.490 6.010 -9.556 87 HB2 HIS 12 HB2 HIS 12 19.103 6.417 -7.805 88 HB3 HIS 12 HB3 HIS 12 19.748 5.188 -8.890 89 HD1 HIS 12 HD1 HIS 12 22.144 5.529 -9.331 90 HD2 HIS 12 HD2 HIS 12 20.166 9.137 -8.757 91 HE1 HIS 12 HE1 HIS 12 23.909 7.306 -9.552 92 H ARG 13 H ARG 13 16.791 7.786 -8.279 93 HA ARG 13 HA ARG 13 16.564 10.218 -9.737 94 HB2 ARG 13 HB2 ARG 13 14.988 9.083 -7.933 95 HB3 ARG 13 HB3 ARG 13 15.907 10.097 -6.829 96 HG2 ARG 13 HG2 ARG 13 14.773 11.364 -9.260 97 HG3 ARG 13 HG3 ARG 13 13.671 10.925 -7.954 98 HD2 ARG 13 HD2 ARG 13 15.618 12.118 -6.536 99 HD3 ARG 13 HD3 ARG 13 15.774 12.996 -8.056 100 HE ARG 13 HE ARG 13 13.106 13.058 -7.530 101 HH11 ARG 13 HH11 ARG 13 15.963 13.959 -5.755 102 HH12 ARG 13 HH12 ARG 13 15.175 15.226 -4.875 103 HH21 ARG 13 HH21 ARG 13 12.057 14.724 -6.377 104 HH22 ARG 13 HH22 ARG 13 12.953 15.660 -5.228 105 H ASP 14 H ASP 14 18.095 11.705 -9.897 106 HA ASP 14 HA ASP 14 20.207 11.887 -7.922 107 HB2 ASP 14 HB2 ASP 14 21.348 13.267 -9.461 108 HB3 ASP 14 HB3 ASP 14 20.526 12.067 -10.455 109 H GLY 15 H GLY 15 20.902 14.433 -7.702 110 HA2 GLY 15 HA2 GLY 15 19.006 15.488 -5.871 111 HA3 GLY 15 HA3 GLY 15 20.470 16.291 -6.419 112 H SER 16 H SER 16 19.530 15.977 -9.263 113 HA SER 16 HA SER 16 18.201 18.502 -9.432 114 HB2 SER 16 HB2 SER 16 18.671 16.487 -11.640 115 HB3 SER 16 HB3 SER 16 18.327 18.205 -11.834 116 HG SER 16 HG SER 16 20.642 17.031 -10.689 117 H GLY 17 H GLY 17 17.192 15.188 -9.401 118 HA2 GLY 17 HA2 GLY 17 14.937 14.610 -8.855 119 HA3 GLY 17 HA3 GLY 17 14.404 16.090 -9.639 120 H ASN 18 H ASN 18 16.712 13.825 -11.015 121 HA ASN 18 HA ASN 18 14.680 12.740 -12.804 122 HB2 ASN 18 HB2 ASN 18 16.870 14.584 -13.613 123 HB3 ASN 18 HB3 ASN 18 16.534 13.219 -14.674 124 HD21 ASN 18 HD21 ASN 18 16.081 16.238 -14.754 125 HD22 ASN 18 HD22 ASN 18 14.440 16.385 -15.273 126 H CYS 19 H CYS 19 15.101 10.692 -13.472 127 HA CYS 19 HA CYS 19 17.000 9.157 -12.089 128 HB2 CYS 19 HB2 CYS 19 15.558 8.471 -14.659 129 HB3 CYS 19 HB3 CYS 19 16.342 7.325 -13.578 130 H VAL 20 H VAL 20 19.039 8.537 -12.528 131 HA VAL 20 HA VAL 20 20.155 9.026 -15.186 132 HB VAL 20 HB VAL 20 22.186 10.066 -14.196 133 HG11 VAL 20 HG11 VAL 20 20.541 11.473 -15.255 134 HG12 VAL 20 HG12 VAL 20 19.579 11.522 -13.776 135 HG13 VAL 20 HG13 VAL 20 21.166 12.291 -13.823 136 HG21 VAL 20 HG21 VAL 20 20.485 10.123 -11.708 137 HG22 VAL 20 HG22 VAL 20 22.032 9.304 -11.926 138 HG23 VAL 20 HG23 VAL 20 21.959 11.066 -11.924 139 H TYR 21 H TYR 21 21.879 7.705 -15.728 140 HA TYR 21 HA TYR 21 21.987 5.164 -14.641 141 HB2 TYR 21 HB2 TYR 21 22.824 5.592 -16.862 142 HB3 TYR 21 HB3 TYR 21 24.075 6.660 -16.236 143 HD1 TYR 21 HD1 TYR 21 22.918 3.122 -16.132 144 HD2 TYR 21 HD2 TYR 21 26.189 5.813 -15.730 145 HE1 TYR 21 HE1 TYR 21 24.462 1.213 -15.983 146 HE2 TYR 21 HE2 TYR 21 27.742 3.911 -15.581 147 HH TYR 21 HH TYR 21 27.298 1.090 -16.573 148 H ASP 22 H ASP 22 22.811 4.363 -12.834 149 HA ASP 22 HA ASP 22 24.224 5.971 -10.974 150 HB2 ASP 22 HB2 ASP 22 22.699 3.879 -10.595 151 HB3 ASP 22 HB3 ASP 22 24.196 2.977 -10.814 152 H ALA 23 H ALA 23 26.066 6.696 -12.130 153 HA ALA 23 HA ALA 23 27.975 4.960 -13.286 154 HB1 ALA 23 HB1 ALA 23 28.407 7.008 -14.096 155 HB2 ALA 23 HB2 ALA 23 27.793 7.820 -12.655 156 HB3 ALA 23 HB3 ALA 23 29.431 7.165 -12.668 157 H TYR 24 H TYR 24 27.241 5.697 -10.046 158 HA TYR 24 HA TYR 24 29.890 5.110 -9.025 159 HB2 TYR 24 HB2 TYR 24 27.305 6.015 -7.868 160 HB3 TYR 24 HB3 TYR 24 28.394 5.130 -6.805 161 HD1 TYR 24 HD1 TYR 24 28.705 7.839 -9.374 162 HD2 TYR 24 HD2 TYR 24 29.724 6.456 -5.481 163 HE1 TYR 24 HE1 TYR 24 29.988 9.900 -8.984 164 HE2 TYR 24 HE2 TYR 24 31.008 8.515 -5.079 165 HH TYR 24 HH TYR 24 30.748 11.117 -6.314 166 H GLY 25 H GLY 25 27.583 3.241 -10.319 167 HA2 GLY 25 HA2 GLY 25 28.135 0.818 -10.209 168 HA3 GLY 25 HA3 GLY 25 28.128 1.007 -8.462 169 H CYS 26 H CYS 26 26.236 0.503 -11.286 170 HA CYS 26 HA CYS 26 23.718 0.813 -9.847 171 HB2 CYS 26 HB2 CYS 26 22.633 0.601 -11.951 172 HB3 CYS 26 HB3 CYS 26 24.049 1.610 -12.233 173 H GLY 27 H GLY 27 25.712 -1.329 -9.244 174 HA2 GLY 27 HA2 GLY 27 25.063 -3.404 -8.226 175 HA3 GLY 27 HA3 GLY 27 23.830 -3.581 -9.467 176 H ALA 28 H ALA 28 26.546 -2.481 -10.976 177 HA ALA 28 HA ALA 28 27.973 -4.974 -11.197 178 HB1 ALA 28 HB1 ALA 28 25.847 -5.053 -12.708 179 HB2 ALA 28 HB2 ALA 28 26.805 -4.024 -13.773 180 HB3 ALA 28 HB3 ALA 28 27.396 -5.625 -13.327 181 H VAL 29 H VAL 29 29.629 -3.508 -10.480 182 HA VAL 29 HA VAL 29 30.447 -1.371 -12.257 183 HB VAL 29 HB VAL 29 31.827 -2.423 -9.783 184 HG11 VAL 29 HG11 VAL 29 33.358 -1.207 -11.184 185 HG12 VAL 29 HG12 VAL 29 32.200 0.111 -11.374 186 HG13 VAL 29 HG13 VAL 29 32.931 -0.201 -9.800 187 HG21 VAL 29 HG21 VAL 29 30.130 -1.507 -8.666 188 HG22 VAL 29 HG22 VAL 29 30.732 0.058 -9.214 189 HG23 VAL 29 HG23 VAL 29 29.469 -0.770 -10.126
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