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NMR Restraints Grid |
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Result table
(Save to zip file containing files for each block)
image | mrblock_id | pdb_id | cing | stage | position | program | type |
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647151 |
6kno ![]() ![]() |
cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 11 HT1 GLY 11 -0.898 1.759 -1.778 2 H2 GLY 11 HT2 GLY 11 -1.052 0.282 -2.590 3 H3 GLY 11 HT3 GLY 11 -1.787 1.669 -3.221 4 HA2 GLY 11 HA1 GLY 11 0.181 1.150 -4.463 5 HA3 GLY 11 HA2 GLY 11 0.378 2.666 -3.593 6 H PHE 12 HN PHE 12 2.393 0.718 -4.569 7 HA PHE 12 HA PHE 12 3.488 -0.360 -2.082 8 HB2 PHE 12 HB2 PHE 12 4.515 -0.587 -4.935 9 HB3 PHE 12 HB1 PHE 12 5.274 -1.310 -3.532 10 HD1 PHE 12 HD1 PHE 12 2.171 -1.377 -5.573 11 HD2 PHE 12 HD2 PHE 12 4.570 -3.361 -2.669 12 HE1 PHE 12 HE1 PHE 12 0.795 -3.391 -5.815 13 HE2 PHE 12 HE2 PHE 12 3.188 -5.376 -2.909 14 HZ PHE 12 HZ PHE 12 1.298 -5.394 -4.484 15 H ARG 13 HN ARG 13 6.054 -0.115 -2.061 16 HA ARG 13 HA ARG 13 6.525 2.688 -1.678 17 HB2 ARG 13 HB2 ARG 13 8.705 2.022 -0.830 18 HB3 ARG 13 HB1 ARG 13 7.448 1.030 -0.117 19 HG2 ARG 13 HG2 ARG 13 7.987 -0.757 -1.770 20 HG3 ARG 13 HG1 ARG 13 9.341 0.224 -2.323 21 HD2 ARG 13 HD2 ARG 13 9.009 -0.640 0.545 22 HD3 ARG 13 HD1 ARG 13 9.875 -1.606 -0.645 23 HE ARG 13 HE ARG 13 10.929 1.017 -0.626 24 HH11 ARG 13 HH11 ARG 13 10.843 -1.870 1.358 25 HH12 ARG 13 HH12 ARG 13 12.364 -1.545 2.110 26 HH21 ARG 13 HH21 ARG 13 12.927 1.461 0.392 27 HH22 ARG 13 HH22 ARG 13 13.559 0.355 1.561 28 H SER 14 HN SER 14 8.006 3.992 -2.750 29 HA SER 14 HA SER 14 8.268 3.440 -5.552 30 HB2 SER 14 HB2 SER 14 9.375 5.757 -3.954 31 HB3 SER 14 HB1 SER 14 9.149 5.694 -5.700 32 HG SER 14 HG SER 14 6.835 5.106 -4.465 33 HA PRO 15 HA PRO 15 9.329 3.827 -7.214 34 HB2 PRO 15 HB2 PRO 15 10.969 2.296 -8.960 35 HB3 PRO 15 HB1 PRO 15 10.975 4.048 -8.759 36 HG2 PRO 15 HG2 PRO 15 13.059 2.334 -8.048 37 HG3 PRO 15 HG1 PRO 15 12.850 3.996 -7.476 38 HD2 PRO 15 HD2 PRO 15 12.161 1.421 -6.124 39 HD3 PRO 15 HD1 PRO 15 12.794 2.929 -5.428 40 H CYS 16 HN CYS 16 7.690 2.668 -8.204 41 HA CYS 16 HA CYS 16 7.804 -0.236 -7.927 42 HB2 CYS 16 HB2 CYS 16 5.187 0.110 -7.617 43 HB3 CYS 16 HB1 CYS 16 6.305 0.185 -6.259 44 H ALA 17 HN ALA 17 7.689 -1.121 -10.073 45 HA ALA 17 HA ALA 17 5.815 0.137 -11.911 46 HB1 ALA 17 HB1 ALA 17 8.616 -0.735 -12.620 47 HB2 ALA 17 HB2 ALA 17 8.054 0.930 -12.486 48 HB3 ALA 17 HB3 ALA 17 7.408 -0.119 -13.747 49 HA PRO 18 HA PRO 18 4.971 -0.141 -13.579 50 HB2 PRO 18 HB2 PRO 18 2.901 -1.178 -14.989 51 HB3 PRO 18 HB1 PRO 18 4.567 -1.206 -15.566 52 HG2 PRO 18 HG2 PRO 18 2.902 -3.400 -14.602 53 HG3 PRO 18 HG1 PRO 18 4.365 -3.480 -15.561 54 HD2 PRO 18 HD2 PRO 18 4.057 -3.911 -12.722 55 HD3 PRO 18 HD1 PRO 18 5.531 -4.049 -13.700 56 H PHE 19 HN PHE 19 3.031 -2.608 -11.952 57 HA PHE 19 HA PHE 19 0.929 -0.701 -11.333 58 HB2 PHE 19 HB2 PHE 19 1.127 -3.487 -10.200 59 HB3 PHE 19 HB1 PHE 19 -0.309 -2.502 -10.425 60 HD1 PHE 19 HD1 PHE 19 1.221 -5.330 -11.525 61 HD2 PHE 19 HD2 PHE 19 -0.515 -1.768 -13.087 62 HE1 PHE 19 HE1 PHE 19 0.797 -6.479 -13.658 63 HE2 PHE 19 HE2 PHE 19 -0.939 -2.911 -15.226 64 HZ PHE 19 HZ PHE 19 -0.283 -5.269 -15.511 65 H CYS 20 HN CYS 20 0.738 0.349 -9.452 66 HA CYS 20 HA CYS 20 2.483 -0.462 -7.269 67 HB2 CYS 20 HB2 CYS 20 3.439 1.475 -8.550 68 HB3 CYS 20 HB1 CYS 20 2.016 2.404 -8.091 69 HN1 NH2 21 H1 CYS 20 0.422 -1.451 -6.631 70 HN2 NH2 21 H2 CYS 20 -0.756 -0.480 -5.819 Start of MODEL 2 1 H1 GLY 11 HT1 GLY 11 0.044 3.009 -1.543 2 H2 GLY 11 HT2 GLY 11 -0.717 1.554 -1.137 3 H3 GLY 11 HT3 GLY 11 -1.423 2.591 -2.274 4 HA2 GLY 11 HA1 GLY 11 -0.379 0.721 -3.365 5 HA3 GLY 11 HA2 GLY 11 0.407 2.236 -3.789 6 H PHE 12 HN PHE 12 1.968 0.304 -4.311 7 HA PHE 12 HA PHE 12 3.454 -0.711 -2.069 8 HB2 PHE 12 HB2 PHE 12 3.945 -0.869 -5.058 9 HB3 PHE 12 HB1 PHE 12 5.126 -1.427 -3.893 10 HD1 PHE 12 HD1 PHE 12 1.436 -1.791 -4.398 11 HD2 PHE 12 HD2 PHE 12 5.146 -3.667 -3.510 12 HE1 PHE 12 HE1 PHE 12 0.300 -3.965 -4.237 13 HE2 PHE 12 HE2 PHE 12 4.017 -5.839 -3.348 14 HZ PHE 12 HZ PHE 12 1.590 -5.991 -3.714 15 H ARG 13 HN ARG 13 5.979 -0.494 -2.284 16 HA ARG 13 HA ARG 13 6.533 2.265 -1.704 17 HB2 ARG 13 HB2 ARG 13 8.455 -0.071 -1.866 18 HB3 ARG 13 HB1 ARG 13 8.795 1.506 -1.177 19 HG2 ARG 13 HG2 ARG 13 7.154 1.135 0.568 20 HG3 ARG 13 HG1 ARG 13 6.740 -0.429 -0.135 21 HD2 ARG 13 HD2 ARG 13 9.039 -1.196 0.241 22 HD3 ARG 13 HD1 ARG 13 9.435 0.367 0.953 23 HE ARG 13 HE ARG 13 7.237 -1.065 2.184 24 HH11 ARG 13 HH11 ARG 13 10.683 -0.368 2.227 25 HH12 ARG 13 HH12 ARG 13 10.882 -0.786 3.895 26 HH21 ARG 13 HH21 ARG 13 7.508 -1.635 4.411 27 HH22 ARG 13 HH22 ARG 13 9.070 -1.509 5.137 28 H SER 14 HN SER 14 7.336 3.757 -3.019 29 HA SER 14 HA SER 14 7.838 3.091 -5.768 30 HB2 SER 14 HB2 SER 14 6.614 5.159 -5.074 31 HB3 SER 14 HB1 SER 14 8.106 5.759 -4.354 32 HG SER 14 HG SER 14 8.753 6.343 -6.248 33 HA PRO 15 HA PRO 15 9.021 4.037 -7.534 34 HB2 PRO 15 HB2 PRO 15 11.053 2.297 -8.742 35 HB3 PRO 15 HB1 PRO 15 10.622 3.959 -9.153 36 HG2 PRO 15 HG2 PRO 15 12.961 3.341 -7.963 37 HG3 PRO 15 HG1 PRO 15 12.105 4.860 -7.637 38 HD2 PRO 15 HD2 PRO 15 12.189 2.346 -6.009 39 HD3 PRO 15 HD1 PRO 15 12.313 4.037 -5.476 40 H CYS 16 HN CYS 16 7.457 2.726 -8.395 41 HA CYS 16 HA CYS 16 7.670 -0.146 -7.901 42 HB2 CYS 16 HB2 CYS 16 5.025 0.153 -7.653 43 HB3 CYS 16 HB1 CYS 16 6.122 0.306 -6.284 44 H ALA 17 HN ALA 17 7.582 -1.186 -9.995 45 HA ALA 17 HA ALA 17 5.790 0.005 -11.964 46 HB1 ALA 17 HB1 ALA 17 8.590 -0.970 -12.501 47 HB2 ALA 17 HB2 ALA 17 8.070 0.715 -12.471 48 HB3 ALA 17 HB3 ALA 17 7.449 -0.378 -13.708 49 HA PRO 18 HA PRO 18 5.139 -0.328 -13.756 50 HB2 PRO 18 HB2 PRO 18 2.988 -1.530 -15.109 51 HB3 PRO 18 HB1 PRO 18 4.622 -1.316 -15.736 52 HG2 PRO 18 HG2 PRO 18 3.369 -3.766 -15.127 53 HG3 PRO 18 HG1 PRO 18 5.055 -3.531 -15.518 54 HD2 PRO 18 HD2 PRO 18 3.772 -3.857 -12.858 55 HD3 PRO 18 HD1 PRO 18 5.407 -4.310 -13.385 56 H PHE 19 HN PHE 19 3.386 -2.310 -11.629 57 HA PHE 19 HA PHE 19 1.222 -0.326 -11.394 58 HB2 PHE 19 HB2 PHE 19 1.109 -3.079 -10.190 59 HB3 PHE 19 HB1 PHE 19 -0.219 -2.015 -10.635 60 HD1 PHE 19 HD1 PHE 19 1.310 -4.954 -11.444 61 HD2 PHE 19 HD2 PHE 19 -0.099 -1.400 -13.304 62 HE1 PHE 19 HE1 PHE 19 1.125 -6.153 -13.577 63 HE2 PHE 19 HE2 PHE 19 -0.287 -2.591 -15.445 64 HZ PHE 19 HZ PHE 19 0.325 -4.973 -15.582 65 H CYS 20 HN CYS 20 0.627 0.306 -9.259 66 HA CYS 20 HA CYS 20 2.627 -0.338 -7.232 67 HB2 CYS 20 HB2 CYS 20 2.911 1.937 -8.418 68 HB3 CYS 20 HB1 CYS 20 1.485 2.424 -7.508 69 HN1 NH2 21 H1 CYS 20 0.801 -1.827 -6.749 70 HN2 NH2 21 H2 CYS 20 -0.465 -1.245 -5.725 Start of MODEL 3 1 H1 GLY 11 HT1 GLY 11 -0.540 1.771 -1.419 2 H2 GLY 11 HT2 GLY 11 -0.871 0.259 -2.095 3 H3 GLY 11 HT3 GLY 11 -1.549 1.650 -2.770 4 HA2 GLY 11 HA1 GLY 11 0.298 0.839 -4.098 5 HA3 GLY 11 HA2 GLY 11 0.598 2.442 -3.441 6 H PHE 12 HN PHE 12 2.659 0.849 -4.304 7 HA PHE 12 HA PHE 12 3.872 -0.118 -1.792 8 HB2 PHE 12 HB2 PHE 12 4.534 -0.776 -4.673 9 HB3 PHE 12 HB1 PHE 12 5.613 -1.153 -3.342 10 HD1 PHE 12 HD1 PHE 12 2.128 -1.728 -4.523 11 HD2 PHE 12 HD2 PHE 12 5.375 -3.098 -2.138 12 HE1 PHE 12 HE1 PHE 12 0.925 -3.819 -4.087 13 HE2 PHE 12 HE2 PHE 12 4.172 -5.192 -1.703 14 HZ PHE 12 HZ PHE 12 1.947 -5.554 -2.676 15 H ARG 13 HN ARG 13 6.416 0.076 -2.019 16 HA ARG 13 HA ARG 13 6.995 2.841 -1.735 17 HB2 ARG 13 HB2 ARG 13 8.246 1.177 -0.457 18 HB3 ARG 13 HB1 ARG 13 8.885 0.478 -1.941 19 HG2 ARG 13 HG2 ARG 13 10.003 2.641 -2.399 20 HG3 ARG 13 HG1 ARG 13 9.470 3.192 -0.808 21 HD2 ARG 13 HD2 ARG 13 10.686 1.401 0.255 22 HD3 ARG 13 HD1 ARG 13 11.150 0.748 -1.316 23 HE ARG 13 HE ARG 13 11.986 3.438 -1.082 24 HH11 ARG 13 HH11 ARG 13 12.771 0.213 0.053 25 HH12 ARG 13 HH12 ARG 13 14.439 0.567 0.327 26 HH21 ARG 13 HH21 ARG 13 14.207 3.917 -0.735 27 HH22 ARG 13 HH22 ARG 13 15.262 2.695 -0.116 28 H SER 14 HN SER 14 7.743 4.291 -3.137 29 HA SER 14 HA SER 14 7.978 3.587 -5.912 30 HB2 SER 14 HB2 SER 14 8.475 6.253 -4.559 31 HB3 SER 14 HB1 SER 14 8.183 5.981 -6.277 32 HG SER 14 HG SER 14 6.086 5.282 -5.761 33 HA PRO 15 HA PRO 15 8.932 4.252 -7.704 34 HB2 PRO 15 HB2 PRO 15 10.477 3.085 -9.550 35 HB3 PRO 15 HB1 PRO 15 10.782 4.737 -8.999 36 HG2 PRO 15 HG2 PRO 15 12.158 2.200 -8.224 37 HG3 PRO 15 HG1 PRO 15 12.855 3.796 -8.551 38 HD2 PRO 15 HD2 PRO 15 12.346 2.795 -6.028 39 HD3 PRO 15 HD1 PRO 15 12.475 4.520 -6.415 40 H CYS 16 HN CYS 16 7.401 2.801 -8.341 41 HA CYS 16 HA CYS 16 7.979 -0.037 -7.979 42 HB2 CYS 16 HB2 CYS 16 5.367 -0.021 -7.416 43 HB3 CYS 16 HB1 CYS 16 6.599 0.235 -6.182 44 H ALA 17 HN ALA 17 7.723 -1.062 -10.062 45 HA ALA 17 HA ALA 17 5.635 -0.014 -11.803 46 HB1 ALA 17 HB1 ALA 17 7.141 -0.274 -13.712 47 HB2 ALA 17 HB2 ALA 17 8.439 -0.770 -12.628 48 HB3 ALA 17 HB3 ALA 17 7.797 0.869 -12.539 49 HA PRO 18 HA PRO 18 5.135 -0.537 -13.875 50 HB2 PRO 18 HB2 PRO 18 2.897 -1.606 -14.982 51 HB3 PRO 18 HB1 PRO 18 4.522 -1.939 -15.591 52 HG2 PRO 18 HG2 PRO 18 2.756 -3.625 -13.893 53 HG3 PRO 18 HG1 PRO 18 3.875 -4.111 -15.162 54 HD2 PRO 18 HD2 PRO 18 4.384 -4.273 -12.444 55 HD3 PRO 18 HD1 PRO 18 5.630 -4.231 -13.704 56 H PHE 19 HN PHE 19 2.696 -2.461 -12.094 57 HA PHE 19 HA PHE 19 1.271 0.011 -11.472 58 HB2 PHE 19 HB2 PHE 19 0.425 -2.743 -10.573 59 HB3 PHE 19 HB1 PHE 19 -0.573 -1.311 -10.790 60 HD1 PHE 19 HD1 PHE 19 -0.407 -4.360 -11.980 61 HD2 PHE 19 HD2 PHE 19 0.133 -0.414 -13.468 62 HE1 PHE 19 HE1 PHE 19 -0.965 -5.144 -14.243 63 HE2 PHE 19 HE2 PHE 19 -0.422 -1.188 -15.730 64 HZ PHE 19 HZ PHE 19 -0.972 -3.556 -16.123 65 H CYS 20 HN CYS 20 0.691 0.470 -9.214 66 HA CYS 20 HA CYS 20 2.668 -0.609 -7.362 67 HB2 CYS 20 HB2 CYS 20 3.255 1.654 -8.321 68 HB3 CYS 20 HB1 CYS 20 1.825 2.280 -7.511 69 HN1 NH2 21 H1 CYS 20 0.974 -1.940 -6.571 70 HN2 NH2 21 H2 CYS 20 -0.287 -1.295 -5.580 Start of MODEL 4 1 H1 GLY 11 HT1 GLY 11 -0.814 -0.897 -0.856 2 H2 GLY 11 HT2 GLY 11 -0.727 -2.026 -2.110 3 H3 GLY 11 HT3 GLY 11 -1.951 -0.863 -2.105 4 HA2 GLY 11 HA1 GLY 11 -0.218 -0.317 -3.692 5 HA3 GLY 11 HA2 GLY 11 -0.362 0.888 -2.419 6 H PHE 12 HN PHE 12 1.944 0.148 -4.138 7 HA PHE 12 HA PHE 12 3.786 -0.838 -2.073 8 HB2 PHE 12 HB2 PHE 12 4.120 -0.734 -5.085 9 HB3 PHE 12 HB1 PHE 12 5.418 -1.119 -3.975 10 HD1 PHE 12 HD1 PHE 12 2.202 -2.332 -5.338 11 HD2 PHE 12 HD2 PHE 12 5.575 -3.220 -2.888 12 HE1 PHE 12 HE1 PHE 12 1.567 -4.697 -5.317 13 HE2 PHE 12 HE2 PHE 12 4.934 -5.588 -2.869 14 HZ PHE 12 HZ PHE 12 2.933 -6.329 -4.083 15 H ARG 13 HN ARG 13 6.131 0.114 -2.620 16 HA ARG 13 HA ARG 13 5.787 3.025 -2.400 17 HB2 ARG 13 HB2 ARG 13 8.006 1.208 -1.422 18 HB3 ARG 13 HB1 ARG 13 8.216 2.939 -1.559 19 HG2 ARG 13 HG2 ARG 13 7.686 2.427 0.701 20 HG3 ARG 13 HG1 ARG 13 6.306 3.254 -0.010 21 HD2 ARG 13 HD2 ARG 13 5.143 1.148 -0.270 22 HD3 ARG 13 HD1 ARG 13 6.553 0.267 0.325 23 HE ARG 13 HE ARG 13 6.105 1.823 2.391 24 HH11 ARG 13 HH11 ARG 13 3.780 0.023 0.462 25 HH12 ARG 13 HH12 ARG 13 2.634 -0.110 1.744 26 HH21 ARG 13 HH21 ARG 13 4.603 1.624 4.089 27 HH22 ARG 13 HH22 ARG 13 3.112 0.793 3.827 28 H SER 14 HN SER 14 7.113 4.438 -3.584 29 HA SER 14 HA SER 14 7.722 3.455 -6.215 30 HB2 SER 14 HB2 SER 14 8.199 6.214 -5.074 31 HB3 SER 14 HB1 SER 14 8.097 5.773 -6.777 32 HG SER 14 HG SER 14 5.928 5.162 -5.104 33 HA PRO 15 HA PRO 15 8.964 4.197 -7.920 34 HB2 PRO 15 HB2 PRO 15 10.724 2.944 -9.529 35 HB3 PRO 15 HB1 PRO 15 10.986 4.597 -8.965 36 HG2 PRO 15 HG2 PRO 15 12.183 2.045 -7.983 37 HG3 PRO 15 HG1 PRO 15 12.946 3.629 -8.204 38 HD2 PRO 15 HD2 PRO 15 12.073 2.645 -5.783 39 HD3 PRO 15 HD1 PRO 15 12.268 4.367 -6.151 40 H CYS 16 HN CYS 16 7.258 2.850 -8.198 41 HA CYS 16 HA CYS 16 7.714 -0.018 -7.939 42 HB2 CYS 16 HB2 CYS 16 5.101 0.072 -7.570 43 HB3 CYS 16 HB1 CYS 16 6.219 0.431 -6.258 44 H ALA 17 HN ALA 17 7.545 -1.149 -9.972 45 HA ALA 17 HA ALA 17 5.673 -0.093 -11.938 46 HB1 ALA 17 HB1 ALA 17 8.482 -1.058 -12.484 47 HB2 ALA 17 HB2 ALA 17 7.926 0.612 -12.581 48 HB3 ALA 17 HB3 ALA 17 7.301 -0.592 -13.706 49 HA PRO 18 HA PRO 18 5.246 -0.732 -13.986 50 HB2 PRO 18 HB2 PRO 18 2.969 -1.731 -15.085 51 HB3 PRO 18 HB1 PRO 18 4.584 -2.201 -15.622 52 HG2 PRO 18 HG2 PRO 18 2.680 -3.657 -13.861 53 HG3 PRO 18 HG1 PRO 18 3.787 -4.295 -15.072 54 HD2 PRO 18 HD2 PRO 18 4.242 -4.327 -12.353 55 HD3 PRO 18 HD1 PRO 18 5.516 -4.404 -13.583 56 H PHE 19 HN PHE 19 2.956 -2.304 -11.806 57 HA PHE 19 HA PHE 19 1.558 0.269 -11.521 58 HB2 PHE 19 HB2 PHE 19 0.515 -2.364 -10.467 59 HB3 PHE 19 HB1 PHE 19 -0.380 -0.880 -10.768 60 HD1 PHE 19 HD1 PHE 19 -0.500 -3.976 -11.768 61 HD2 PHE 19 HD2 PHE 19 0.452 -0.213 -13.506 62 HE1 PHE 19 HE1 PHE 19 -1.123 -4.843 -13.978 63 HE2 PHE 19 HE2 PHE 19 -0.172 -1.074 -15.721 64 HZ PHE 19 HZ PHE 19 -0.961 -3.392 -15.958 65 H CYS 20 HN CYS 20 0.559 0.282 -9.096 66 HA CYS 20 HA CYS 20 2.788 -0.369 -7.318 67 HB2 CYS 20 HB2 CYS 20 2.508 2.110 -8.150 68 HB3 CYS 20 HB1 CYS 20 1.228 2.149 -6.941 69 HN1 NH2 21 H1 CYS 20 1.085 -2.177 -7.167 70 HN2 NH2 21 H2 CYS 20 -0.102 -1.985 -5.925 Start of MODEL 5 1 H1 GLY 11 HT1 GLY 11 -1.361 2.697 -1.375 2 H2 GLY 11 HT2 GLY 11 -1.660 1.043 -1.555 3 H3 GLY 11 HT3 GLY 11 -2.455 2.156 -2.547 4 HA2 GLY 11 HA1 GLY 11 -0.681 1.063 -3.751 5 HA3 GLY 11 HA2 GLY 11 -0.374 2.784 -3.570 6 H PHE 12 HN PHE 12 1.704 1.124 -4.141 7 HA PHE 12 HA PHE 12 3.054 0.597 -1.586 8 HB2 PHE 12 HB2 PHE 12 3.943 -0.026 -4.425 9 HB3 PHE 12 HB1 PHE 12 4.872 -0.381 -2.985 10 HD1 PHE 12 HD1 PHE 12 1.798 -1.271 -4.839 11 HD2 PHE 12 HD2 PHE 12 4.378 -2.221 -1.585 12 HE1 PHE 12 HE1 PHE 12 0.678 -3.433 -4.583 13 HE2 PHE 12 HE2 PHE 12 3.254 -4.388 -1.329 14 HZ PHE 12 HZ PHE 12 1.403 -4.997 -2.830 15 H ARG 13 HN ARG 13 5.581 1.118 -1.834 16 HA ARG 13 HA ARG 13 5.686 4.012 -2.155 17 HB2 ARG 13 HB2 ARG 13 6.635 3.037 -0.092 18 HB3 ARG 13 HB1 ARG 13 7.768 2.091 -1.050 19 HG2 ARG 13 HG2 ARG 13 8.789 4.162 -1.858 20 HG3 ARG 13 HG1 ARG 13 7.673 5.088 -0.853 21 HD2 ARG 13 HD2 ARG 13 8.570 4.073 1.141 22 HD3 ARG 13 HD1 ARG 13 9.612 3.031 0.175 23 HE ARG 13 HE ARG 13 10.315 5.539 -0.602 24 HH11 ARG 13 HH11 ARG 13 10.129 3.954 2.533 25 HH12 ARG 13 HH12 ARG 13 11.385 4.906 3.235 26 HH21 ARG 13 HH21 ARG 13 12.003 6.790 0.329 27 HH22 ARG 13 HH22 ARG 13 12.448 6.526 1.979 28 H SER 14 HN SER 14 6.999 5.065 -3.611 29 HA SER 14 HA SER 14 7.643 3.626 -5.995 30 HB2 SER 14 HB2 SER 14 8.255 6.491 -5.226 31 HB3 SER 14 HB1 SER 14 8.329 5.817 -6.853 32 HG SER 14 HG SER 14 6.095 6.386 -5.249 33 HA PRO 15 HA PRO 15 9.014 4.086 -7.731 34 HB2 PRO 15 HB2 PRO 15 10.993 2.348 -8.848 35 HB3 PRO 15 HB1 PRO 15 10.838 4.092 -9.071 36 HG2 PRO 15 HG2 PRO 15 12.906 2.835 -7.714 37 HG3 PRO 15 HG1 PRO 15 12.461 4.537 -7.534 38 HD2 PRO 15 HD2 PRO 15 11.795 2.206 -5.798 39 HD3 PRO 15 HD1 PRO 15 12.179 3.880 -5.343 40 H CYS 16 HN CYS 16 7.427 2.751 -8.426 41 HA CYS 16 HA CYS 16 7.696 -0.108 -7.904 42 HB2 CYS 16 HB2 CYS 16 5.071 0.111 -7.618 43 HB3 CYS 16 HB1 CYS 16 6.164 0.409 -6.269 44 H ALA 17 HN ALA 17 7.595 -1.182 -9.987 45 HA ALA 17 HA ALA 17 5.792 -0.017 -11.963 46 HB1 ALA 17 HB1 ALA 17 8.590 -1.018 -12.488 47 HB2 ALA 17 HB2 ALA 17 8.060 0.664 -12.533 48 HB3 ALA 17 HB3 ALA 17 7.443 -0.488 -13.717 49 HA PRO 18 HA PRO 18 5.177 -0.406 -13.787 50 HB2 PRO 18 HB2 PRO 18 3.040 -1.563 -15.150 51 HB3 PRO 18 HB1 PRO 18 4.707 -1.508 -15.722 52 HG2 PRO 18 HG2 PRO 18 3.221 -3.806 -14.936 53 HG3 PRO 18 HG1 PRO 18 4.894 -3.746 -15.429 54 HD2 PRO 18 HD2 PRO 18 3.751 -3.879 -12.709 55 HD3 PRO 18 HD1 PRO 18 5.359 -4.365 -13.280 56 H PHE 19 HN PHE 19 3.359 -2.264 -11.610 57 HA PHE 19 HA PHE 19 1.290 -0.183 -11.443 58 HB2 PHE 19 HB2 PHE 19 0.993 -2.944 -10.275 59 HB3 PHE 19 HB1 PHE 19 -0.265 -1.786 -10.680 60 HD1 PHE 19 HD1 PHE 19 0.889 -4.836 -11.534 61 HD2 PHE 19 HD2 PHE 19 0.023 -1.103 -13.386 62 HE1 PHE 19 HE1 PHE 19 0.582 -5.982 -13.684 63 HE2 PHE 19 HE2 PHE 19 -0.283 -2.244 -15.545 64 HZ PHE 19 HZ PHE 19 -0.004 -4.687 -15.695 65 H CYS 20 HN CYS 20 0.580 0.304 -9.200 66 HA CYS 20 HA CYS 20 2.652 -0.336 -7.243 67 HB2 CYS 20 HB2 CYS 20 2.721 2.023 -8.366 68 HB3 CYS 20 HB1 CYS 20 1.356 2.362 -7.309 69 HN1 NH2 21 H1 CYS 20 0.619 -1.892 -7.125 70 HN2 NH2 21 H2 CYS 20 -0.535 -1.436 -5.921 Start of MODEL 6 1 H1 GLY 11 HT1 GLY 11 -0.564 4.099 -2.313 2 H2 GLY 11 HT2 GLY 11 -1.391 2.625 -2.325 3 H3 GLY 11 HT3 GLY 11 -1.663 3.755 -3.555 4 HA2 GLY 11 HA1 GLY 11 -0.261 1.944 -4.318 5 HA3 GLY 11 HA2 GLY 11 0.584 3.486 -4.345 6 H PHE 12 HN PHE 12 2.168 1.394 -4.378 7 HA PHE 12 HA PHE 12 2.953 0.863 -1.594 8 HB2 PHE 12 HB2 PHE 12 3.804 -0.476 -4.179 9 HB3 PHE 12 HB1 PHE 12 4.612 -0.751 -2.650 10 HD1 PHE 12 HD1 PHE 12 1.282 -1.026 -4.298 11 HD2 PHE 12 HD2 PHE 12 3.822 -2.314 -1.133 12 HE1 PHE 12 HE1 PHE 12 -0.336 -2.779 -3.714 13 HE2 PHE 12 HE2 PHE 12 2.204 -4.070 -0.546 14 HZ PHE 12 HZ PHE 12 0.122 -4.305 -1.836 15 H ARG 13 HN ARG 13 5.562 0.597 -1.535 16 HA ARG 13 HA ARG 13 6.500 3.252 -1.649 17 HB2 ARG 13 HB2 ARG 13 8.698 2.324 -0.999 18 HB3 ARG 13 HB1 ARG 13 7.391 1.738 0.015 19 HG2 ARG 13 HG2 ARG 13 7.396 -0.384 -1.165 20 HG3 ARG 13 HG1 ARG 13 8.651 0.210 -2.255 21 HD2 ARG 13 HD2 ARG 13 10.186 0.446 -0.382 22 HD3 ARG 13 HD1 ARG 13 8.928 -0.082 0.734 23 HE ARG 13 HE ARG 13 9.127 -2.124 -1.061 24 HH11 ARG 13 HH11 ARG 13 11.438 -0.461 0.981 25 HH12 ARG 13 HH12 ARG 13 12.419 -1.864 1.230 26 HH21 ARG 13 HH21 ARG 13 10.441 -3.981 -0.737 27 HH22 ARG 13 HH22 ARG 13 11.859 -3.860 0.250 28 H SER 14 HN SER 14 7.172 4.368 -3.297 29 HA SER 14 HA SER 14 7.798 3.137 -5.816 30 HB2 SER 14 HB2 SER 14 7.981 6.041 -4.968 31 HB3 SER 14 HB1 SER 14 7.984 5.434 -6.624 32 HG SER 14 HG SER 14 5.856 4.425 -5.839 33 HA PRO 15 HA PRO 15 9.098 4.091 -7.725 34 HB2 PRO 15 HB2 PRO 15 11.207 2.277 -8.665 35 HB3 PRO 15 HB1 PRO 15 10.780 3.888 -9.244 36 HG2 PRO 15 HG2 PRO 15 13.053 3.435 -7.881 37 HG3 PRO 15 HG1 PRO 15 12.145 4.948 -7.711 38 HD2 PRO 15 HD2 PRO 15 12.179 2.551 -5.909 39 HD3 PRO 15 HD1 PRO 15 12.259 4.276 -5.488 40 H CYS 16 HN CYS 16 7.461 2.773 -8.331 41 HA CYS 16 HA CYS 16 7.727 -0.099 -7.852 42 HB2 CYS 16 HB2 CYS 16 5.114 0.162 -7.482 43 HB3 CYS 16 HB1 CYS 16 6.255 0.435 -6.169 44 H ALA 17 HN ALA 17 7.582 -1.122 -9.964 45 HA ALA 17 HA ALA 17 5.665 0.007 -11.846 46 HB1 ALA 17 HB1 ALA 17 8.482 -0.846 -12.515 47 HB2 ALA 17 HB2 ALA 17 7.889 0.813 -12.470 48 HB3 ALA 17 HB3 ALA 17 7.262 -0.315 -13.670 49 HA PRO 18 HA PRO 18 5.130 -0.442 -13.794 50 HB2 PRO 18 HB2 PRO 18 2.997 -1.492 -15.104 51 HB3 PRO 18 HB1 PRO 18 4.666 -1.746 -15.624 52 HG2 PRO 18 HG2 PRO 18 2.811 -3.602 -14.283 53 HG3 PRO 18 HG1 PRO 18 4.159 -3.961 -15.345 54 HD2 PRO 18 HD2 PRO 18 4.117 -4.129 -12.522 55 HD3 PRO 18 HD1 PRO 18 5.541 -4.262 -13.568 56 H PHE 19 HN PHE 19 2.925 -2.485 -11.938 57 HA PHE 19 HA PHE 19 1.188 -0.176 -11.456 58 HB2 PHE 19 HB2 PHE 19 0.693 -2.958 -10.398 59 HB3 PHE 19 HB1 PHE 19 -0.469 -1.669 -10.662 60 HD1 PHE 19 HD1 PHE 19 0.100 -4.752 -11.682 61 HD2 PHE 19 HD2 PHE 19 -0.034 -0.857 -13.395 62 HE1 PHE 19 HE1 PHE 19 -0.448 -5.733 -13.865 63 HE2 PHE 19 HE2 PHE 19 -0.581 -1.837 -15.582 64 HZ PHE 19 HZ PHE 19 -0.790 -4.277 -15.819 65 H CYS 20 HN CYS 20 0.828 0.578 -9.353 66 HA CYS 20 HA CYS 20 2.891 -0.276 -7.468 67 HB2 CYS 20 HB2 CYS 20 2.919 2.098 -8.424 68 HB3 CYS 20 HB1 CYS 20 1.470 2.378 -7.465 69 HN1 NH2 21 H1 CYS 20 1.301 -1.975 -6.959 70 HN2 NH2 21 H2 CYS 20 0.049 -1.619 -5.821 Start of MODEL 7 1 H1 GLY 11 HT1 GLY 11 1.066 2.314 -1.428 2 H2 GLY 11 HT2 GLY 11 0.170 0.892 -1.308 3 H3 GLY 11 HT3 GLY 11 -0.391 2.166 -2.271 4 HA2 GLY 11 HA1 GLY 11 0.547 0.415 -3.634 5 HA3 GLY 11 HA2 GLY 11 1.468 1.904 -3.767 6 H PHE 12 HN PHE 12 2.867 -0.053 -4.579 7 HA PHE 12 HA PHE 12 4.257 -1.450 -2.450 8 HB2 PHE 12 HB2 PHE 12 4.701 -1.420 -5.454 9 HB3 PHE 12 HB1 PHE 12 5.745 -2.271 -4.333 10 HD1 PHE 12 HD1 PHE 12 2.137 -2.019 -5.253 11 HD2 PHE 12 HD2 PHE 12 5.317 -4.450 -3.819 12 HE1 PHE 12 HE1 PHE 12 0.661 -3.984 -5.312 13 HE2 PHE 12 HE2 PHE 12 3.850 -6.415 -3.877 14 HZ PHE 12 HZ PHE 12 1.516 -6.185 -4.625 15 H ARG 13 HN ARG 13 6.815 -1.478 -2.847 16 HA ARG 13 HA ARG 13 7.696 1.050 -1.977 17 HB2 ARG 13 HB2 ARG 13 9.989 0.078 -2.140 18 HB3 ARG 13 HB1 ARG 13 8.865 -0.890 -1.204 19 HG2 ARG 13 HG2 ARG 13 8.588 -2.404 -3.105 20 HG3 ARG 13 HG1 ARG 13 9.712 -1.419 -4.044 21 HD2 ARG 13 HD2 ARG 13 11.479 -1.884 -2.416 22 HD3 ARG 13 HD1 ARG 13 10.353 -2.857 -1.472 23 HE ARG 13 HE ARG 13 10.391 -3.872 -4.061 24 HH11 ARG 13 HH11 ARG 13 12.590 -3.573 -1.334 25 HH12 ARG 13 HH12 ARG 13 13.504 -4.976 -1.766 26 HH21 ARG 13 HH21 ARG 13 11.602 -5.734 -4.607 27 HH22 ARG 13 HH22 ARG 13 12.944 -6.205 -3.622 28 H SER 14 HN SER 14 8.193 2.773 -3.069 29 HA SER 14 HA SER 14 8.243 2.731 -5.937 30 HB2 SER 14 HB2 SER 14 8.701 5.043 -4.037 31 HB3 SER 14 HB1 SER 14 8.307 5.151 -5.754 32 HG SER 14 HG SER 14 6.358 3.831 -5.048 33 HA PRO 15 HA PRO 15 9.082 3.988 -7.659 34 HB2 PRO 15 HB2 PRO 15 10.441 2.903 -9.753 35 HB3 PRO 15 HB1 PRO 15 10.783 4.513 -9.112 36 HG2 PRO 15 HG2 PRO 15 12.203 1.931 -8.600 37 HG3 PRO 15 HG1 PRO 15 12.879 3.544 -8.889 38 HD2 PRO 15 HD2 PRO 15 12.669 2.470 -6.412 39 HD3 PRO 15 HD1 PRO 15 12.541 4.214 -6.713 40 H CYS 16 HN CYS 16 7.319 2.735 -7.994 41 HA CYS 16 HA CYS 16 7.682 -0.152 -7.921 42 HB2 CYS 16 HB2 CYS 16 5.031 0.141 -7.585 43 HB3 CYS 16 HB1 CYS 16 6.185 0.202 -6.255 44 H ALA 17 HN ALA 17 7.550 -1.147 -10.017 45 HA ALA 17 HA ALA 17 5.675 0.005 -11.924 46 HB1 ALA 17 HB1 ALA 17 7.311 -0.331 -13.713 47 HB2 ALA 17 HB2 ALA 17 8.501 -0.863 -12.527 48 HB3 ALA 17 HB3 ALA 17 7.911 0.797 -12.499 49 HA PRO 18 HA PRO 18 5.144 -0.400 -13.833 50 HB2 PRO 18 HB2 PRO 18 2.983 -1.688 -15.127 51 HB3 PRO 18 HB1 PRO 18 4.600 -1.434 -15.783 52 HG2 PRO 18 HG2 PRO 18 3.452 -3.907 -15.127 53 HG3 PRO 18 HG1 PRO 18 5.138 -3.615 -15.485 54 HD2 PRO 18 HD2 PRO 18 3.801 -3.919 -12.846 55 HD3 PRO 18 HD1 PRO 18 5.457 -4.348 -13.328 56 H PHE 19 HN PHE 19 3.457 -2.249 -11.588 57 HA PHE 19 HA PHE 19 1.316 -0.238 -11.396 58 HB2 PHE 19 HB2 PHE 19 1.061 -3.023 -10.291 59 HB3 PHE 19 HB1 PHE 19 -0.210 -1.887 -10.719 60 HD1 PHE 19 HD1 PHE 19 1.107 -4.881 -11.585 61 HD2 PHE 19 HD2 PHE 19 0.086 -1.162 -13.384 62 HE1 PHE 19 HE1 PHE 19 0.918 -5.992 -13.765 63 HE2 PHE 19 HE2 PHE 19 -0.104 -2.269 -15.571 64 HZ PHE 19 HZ PHE 19 0.314 -4.688 -15.762 65 H CYS 20 HN CYS 20 0.718 0.374 -9.260 66 HA CYS 20 HA CYS 20 2.655 -0.392 -7.206 67 HB2 CYS 20 HB2 CYS 20 3.051 1.896 -8.326 68 HB3 CYS 20 HB1 CYS 20 1.600 2.412 -7.475 69 HN1 NH2 21 H1 CYS 20 0.758 -1.832 -6.804 70 HN2 NH2 21 H2 CYS 20 -0.501 -1.226 -5.787 Start of MODEL 8 1 H1 GLY 11 HT1 GLY 11 -0.623 0.869 -0.732 2 H2 GLY 11 HT2 GLY 11 -0.887 -0.471 -1.722 3 H3 GLY 11 HT3 GLY 11 -1.813 0.927 -1.930 4 HA2 GLY 11 HA1 GLY 11 -0.126 0.740 -3.643 5 HA3 GLY 11 HA2 GLY 11 0.123 2.156 -2.626 6 H PHE 12 HN PHE 12 1.884 0.088 -4.213 7 HA PHE 12 HA PHE 12 3.555 -0.964 -2.115 8 HB2 PHE 12 HB2 PHE 12 3.876 -1.006 -5.129 9 HB3 PHE 12 HB1 PHE 12 5.103 -1.606 -4.034 10 HD1 PHE 12 HD1 PHE 12 1.543 -2.089 -4.998 11 HD2 PHE 12 HD2 PHE 12 4.982 -3.734 -3.102 12 HE1 PHE 12 HE1 PHE 12 0.414 -4.263 -4.838 13 HE2 PHE 12 HE2 PHE 12 3.856 -5.912 -2.943 14 HZ PHE 12 HZ PHE 12 1.569 -6.179 -3.810 15 H ARG 13 HN ARG 13 6.079 -0.647 -2.666 16 HA ARG 13 HA ARG 13 6.501 2.124 -1.917 17 HB2 ARG 13 HB2 ARG 13 8.466 -0.177 -2.047 18 HB3 ARG 13 HB1 ARG 13 8.799 1.421 -1.405 19 HG2 ARG 13 HG2 ARG 13 7.242 1.123 0.370 20 HG3 ARG 13 HG1 ARG 13 6.673 -0.398 -0.318 21 HD2 ARG 13 HD2 ARG 13 8.774 -1.448 0.109 22 HD3 ARG 13 HD1 ARG 13 9.503 0.086 0.583 23 HE ARG 13 HE ARG 13 7.738 0.018 2.432 24 HH11 ARG 13 HH11 ARG 13 9.255 -2.849 1.091 25 HH12 ARG 13 HH12 ARG 13 9.123 -3.754 2.553 26 HH21 ARG 13 HH21 ARG 13 7.571 -1.184 4.371 27 HH22 ARG 13 HH22 ARG 13 8.158 -2.811 4.432 28 H SER 14 HN SER 14 6.992 3.644 -3.303 29 HA SER 14 HA SER 14 7.705 3.101 -6.003 30 HB2 SER 14 HB2 SER 14 7.790 5.721 -4.483 31 HB3 SER 14 HB1 SER 14 7.779 5.528 -6.236 32 HG SER 14 HG SER 14 5.701 4.275 -5.683 33 HA PRO 15 HA PRO 15 8.909 4.113 -7.728 34 HB2 PRO 15 HB2 PRO 15 11.059 2.452 -8.851 35 HB3 PRO 15 HB1 PRO 15 10.558 4.084 -9.303 36 HG2 PRO 15 HG2 PRO 15 12.883 3.615 -8.027 37 HG3 PRO 15 HG1 PRO 15 11.929 5.081 -7.738 38 HD2 PRO 15 HD2 PRO 15 12.102 2.582 -6.096 39 HD3 PRO 15 HD1 PRO 15 12.114 4.279 -5.567 40 H CYS 16 HN CYS 16 7.308 2.770 -8.353 41 HA CYS 16 HA CYS 16 7.670 -0.095 -7.931 42 HB2 CYS 16 HB2 CYS 16 5.004 0.140 -7.704 43 HB3 CYS 16 HB1 CYS 16 6.094 0.294 -6.331 44 H ALA 17 HN ALA 17 7.574 -1.185 -9.988 45 HA ALA 17 HA ALA 17 5.801 -0.043 -11.997 46 HB1 ALA 17 HB1 ALA 17 7.473 -0.489 -13.718 47 HB2 ALA 17 HB2 ALA 17 8.595 -1.070 -12.492 48 HB3 ALA 17 HB3 ALA 17 8.105 0.625 -12.507 49 HA PRO 18 HA PRO 18 5.214 -0.479 -13.861 50 HB2 PRO 18 HB2 PRO 18 2.878 -1.771 -14.913 51 HB3 PRO 18 HB1 PRO 18 4.398 -1.449 -15.746 52 HG2 PRO 18 HG2 PRO 18 3.477 -3.973 -15.101 53 HG3 PRO 18 HG1 PRO 18 5.154 -3.577 -15.417 54 HD2 PRO 18 HD2 PRO 18 3.763 -3.919 -12.797 55 HD3 PRO 18 HD1 PRO 18 5.406 -4.402 -13.268 56 H PHE 19 HN PHE 19 3.230 -2.325 -11.702 57 HA PHE 19 HA PHE 19 1.323 -0.096 -11.440 58 HB2 PHE 19 HB2 PHE 19 0.837 -2.794 -10.228 59 HB3 PHE 19 HB1 PHE 19 -0.325 -1.626 -10.844 60 HD1 PHE 19 HD1 PHE 19 1.026 -4.730 -11.413 61 HD2 PHE 19 HD2 PHE 19 0.057 -1.148 -13.497 62 HE1 PHE 19 HE1 PHE 19 0.944 -5.985 -13.520 63 HE2 PHE 19 HE2 PHE 19 -0.027 -2.398 -15.613 64 HZ PHE 19 HZ PHE 19 0.418 -4.821 -15.626 65 H CYS 20 HN CYS 20 0.581 0.316 -9.181 66 HA CYS 20 HA CYS 20 2.663 -0.353 -7.234 67 HB2 CYS 20 HB2 CYS 20 2.731 2.031 -8.295 68 HB3 CYS 20 HB1 CYS 20 1.359 2.346 -7.239 69 HN1 NH2 21 H1 CYS 20 0.668 -1.924 -7.122 70 HN2 NH2 21 H2 CYS 20 -0.494 -1.511 -5.909 Start of MODEL 9 1 H1 GLY 11 HT1 GLY 11 0.440 3.341 -1.904 2 H2 GLY 11 HT2 GLY 11 -0.501 1.958 -1.643 3 H3 GLY 11 HT3 GLY 11 -0.940 3.064 -2.843 4 HA2 GLY 11 HA1 GLY 11 0.070 1.102 -3.800 5 HA3 GLY 11 HA2 GLY 11 1.025 2.547 -4.104 6 H PHE 12 HN PHE 12 2.467 0.474 -4.433 7 HA PHE 12 HA PHE 12 3.624 -0.501 -1.949 8 HB2 PHE 12 HB2 PHE 12 4.330 -1.064 -4.851 9 HB3 PHE 12 HB1 PHE 12 5.269 -1.672 -3.501 10 HD1 PHE 12 HD1 PHE 12 1.692 -1.544 -4.567 11 HD2 PHE 12 HD2 PHE 12 4.836 -3.792 -2.794 12 HE1 PHE 12 HE1 PHE 12 0.194 -3.481 -4.374 13 HE2 PHE 12 HE2 PHE 12 3.343 -5.735 -2.598 14 HZ PHE 12 HZ PHE 12 1.017 -5.581 -3.389 15 H ARG 13 HN ARG 13 6.181 -0.578 -2.018 16 HA ARG 13 HA ARG 13 7.032 2.081 -1.621 17 HB2 ARG 13 HB2 ARG 13 9.304 1.084 -1.313 18 HB3 ARG 13 HB1 ARG 13 8.057 0.339 -0.326 19 HG2 ARG 13 HG2 ARG 13 7.942 -1.541 -1.874 20 HG3 ARG 13 HG1 ARG 13 9.163 -0.781 -2.893 21 HD2 ARG 13 HD2 ARG 13 10.784 -0.920 -1.083 22 HD3 ARG 13 HD1 ARG 13 9.563 -1.618 -0.022 23 HE ARG 13 HE ARG 13 9.603 -3.297 -2.153 24 HH11 ARG 13 HH11 ARG 13 12.094 -2.110 0.027 25 HH12 ARG 13 HH12 ARG 13 13.058 -3.539 -0.105 26 HH21 ARG 13 HH21 ARG 13 10.875 -5.185 -2.308 27 HH22 ARG 13 HH22 ARG 13 12.363 -5.299 -1.429 28 H SER 14 HN SER 14 7.693 3.533 -3.009 29 HA SER 14 HA SER 14 8.119 2.834 -5.770 30 HB2 SER 14 HB2 SER 14 8.255 5.521 -4.380 31 HB3 SER 14 HB1 SER 14 8.199 5.252 -6.122 32 HG SER 14 HG SER 14 6.147 4.092 -5.622 33 HA PRO 15 HA PRO 15 9.205 4.057 -7.567 34 HB2 PRO 15 HB2 PRO 15 11.260 2.504 -8.964 35 HB3 PRO 15 HB1 PRO 15 10.758 4.174 -9.227 36 HG2 PRO 15 HG2 PRO 15 13.154 3.547 -8.156 37 HG3 PRO 15 HG1 PRO 15 12.263 5.009 -7.699 38 HD2 PRO 15 HD2 PRO 15 12.481 2.393 -6.255 39 HD3 PRO 15 HD1 PRO 15 12.557 4.047 -5.607 40 H CYS 16 HN CYS 16 7.544 2.753 -8.168 41 HA CYS 16 HA CYS 16 7.951 -0.137 -7.971 42 HB2 CYS 16 HB2 CYS 16 5.348 -0.011 -7.495 43 HB3 CYS 16 HB1 CYS 16 6.531 0.218 -6.209 44 H ALA 17 HN ALA 17 7.779 -1.041 -10.111 45 HA ALA 17 HA ALA 17 5.703 0.054 -11.845 46 HB1 ALA 17 HB1 ALA 17 7.863 0.928 -12.590 47 HB2 ALA 17 HB2 ALA 17 7.209 -0.214 -13.765 48 HB3 ALA 17 HB3 ALA 17 8.503 -0.712 -12.675 49 HA PRO 18 HA PRO 18 5.070 -0.382 -13.759 50 HB2 PRO 18 HB2 PRO 18 2.914 -1.466 -14.989 51 HB3 PRO 18 HB1 PRO 18 4.563 -1.681 -15.581 52 HG2 PRO 18 HG2 PRO 18 2.810 -3.585 -14.162 53 HG3 PRO 18 HG1 PRO 18 4.095 -3.910 -15.309 54 HD2 PRO 18 HD2 PRO 18 4.238 -4.118 -12.494 55 HD3 PRO 18 HD1 PRO 18 5.599 -4.191 -13.625 56 H PHE 19 HN PHE 19 2.793 -2.548 -12.050 57 HA PHE 19 HA PHE 19 1.089 -0.269 -11.430 58 HB2 PHE 19 HB2 PHE 19 0.650 -3.077 -10.423 59 HB3 PHE 19 HB1 PHE 19 -0.537 -1.803 -10.645 60 HD1 PHE 19 HD1 PHE 19 0.065 -4.850 -11.747 61 HD2 PHE 19 HD2 PHE 19 -0.130 -0.920 -13.362 62 HE1 PHE 19 HE1 PHE 19 -0.479 -5.790 -13.953 63 HE2 PHE 19 HE2 PHE 19 -0.673 -1.853 -15.572 64 HZ PHE 19 HZ PHE 19 -0.847 -4.290 -15.869 65 H CYS 20 HN CYS 20 0.672 0.420 -9.310 66 HA CYS 20 HA CYS 20 2.549 -0.567 -7.310 67 HB2 CYS 20 HB2 CYS 20 3.291 1.588 -8.428 68 HB3 CYS 20 HB1 CYS 20 1.880 2.348 -7.704 69 HN1 NH2 21 H1 CYS 20 0.633 -1.754 -6.653 70 HN2 NH2 21 H2 CYS 20 -0.577 -0.965 -5.703 Start of MODEL 10 1 H1 GLY 11 HT1 GLY 11 0.593 2.825 -1.420 2 H2 GLY 11 HT2 GLY 11 -0.392 1.462 -1.582 3 H3 GLY 11 HT3 GLY 11 -0.746 2.869 -2.449 4 HA2 GLY 11 HA1 GLY 11 0.257 1.228 -3.889 5 HA3 GLY 11 HA2 GLY 11 1.288 2.643 -3.713 6 H PHE 12 HN PHE 12 2.600 0.549 -4.564 7 HA PHE 12 HA PHE 12 3.627 -0.939 -2.269 8 HB2 PHE 12 HB2 PHE 12 4.228 -1.228 -5.231 9 HB3 PHE 12 HB1 PHE 12 5.033 -2.143 -3.973 10 HD1 PHE 12 HD1 PHE 12 1.752 -1.578 -5.594 11 HD2 PHE 12 HD2 PHE 12 4.021 -3.981 -2.906 12 HE1 PHE 12 HE1 PHE 12 -0.032 -3.261 -5.598 13 HE2 PHE 12 HE2 PHE 12 2.234 -5.667 -2.908 14 HZ PHE 12 HZ PHE 12 0.204 -5.307 -4.255 15 H ARG 13 HN ARG 13 6.168 -1.352 -2.583 16 HA ARG 13 HA ARG 13 7.411 0.954 -1.616 17 HB2 ARG 13 HB2 ARG 13 8.778 -1.432 -2.885 18 HB3 ARG 13 HB1 ARG 13 9.500 -0.285 -1.770 19 HG2 ARG 13 HG2 ARG 13 8.044 -1.054 0.010 20 HG3 ARG 13 HG1 ARG 13 7.240 -2.159 -1.105 21 HD2 ARG 13 HD2 ARG 13 9.427 -3.283 -1.473 22 HD3 ARG 13 HD1 ARG 13 10.121 -2.249 -0.224 23 HE ARG 13 HE ARG 13 7.889 -3.487 0.879 24 HH11 ARG 13 HH11 ARG 13 11.040 -4.425 -0.357 25 HH12 ARG 13 HH12 ARG 13 11.144 -5.844 0.623 26 HH21 ARG 13 HH21 ARG 13 8.030 -5.375 2.179 27 HH22 ARG 13 HH22 ARG 13 9.424 -6.390 2.076 28 H SER 14 HN SER 14 8.087 2.711 -2.635 29 HA SER 14 HA SER 14 8.198 2.744 -5.530 30 HB2 SER 14 HB2 SER 14 8.541 4.990 -3.533 31 HB3 SER 14 HB1 SER 14 8.355 5.174 -5.278 32 HG SER 14 HG SER 14 6.415 3.702 -3.915 33 HA PRO 15 HA PRO 15 9.121 3.902 -7.223 34 HB2 PRO 15 HB2 PRO 15 10.577 2.803 -9.227 35 HB3 PRO 15 HB1 PRO 15 10.933 4.402 -8.563 36 HG2 PRO 15 HG2 PRO 15 12.236 1.775 -7.959 37 HG3 PRO 15 HG1 PRO 15 12.987 3.355 -8.252 38 HD2 PRO 15 HD2 PRO 15 12.630 2.360 -5.763 39 HD3 PRO 15 HD1 PRO 15 12.558 4.098 -6.110 40 H CYS 16 HN CYS 16 7.552 2.642 -8.182 41 HA CYS 16 HA CYS 16 7.871 -0.255 -7.955 42 HB2 CYS 16 HB2 CYS 16 5.223 -0.002 -7.544 43 HB3 CYS 16 HB1 CYS 16 6.404 -0.004 -6.238 44 H ALA 17 HN ALA 17 7.686 -1.136 -10.110 45 HA ALA 17 HA ALA 17 5.741 0.141 -11.858 46 HB1 ALA 17 HB1 ALA 17 7.957 0.993 -12.448 47 HB2 ALA 17 HB2 ALA 17 7.287 -0.007 -13.737 48 HB3 ALA 17 HB3 ALA 17 8.533 -0.658 -12.672 49 HA PRO 18 HA PRO 18 4.926 -0.045 -13.532 50 HB2 PRO 18 HB2 PRO 18 2.944 -1.231 -15.102 51 HB3 PRO 18 HB1 PRO 18 4.577 -0.834 -15.638 52 HG2 PRO 18 HG2 PRO 18 3.479 -3.423 -15.366 53 HG3 PRO 18 HG1 PRO 18 5.157 -3.033 -15.675 54 HD2 PRO 18 HD2 PRO 18 3.836 -3.720 -13.096 55 HD3 PRO 18 HD1 PRO 18 5.500 -4.044 -13.636 56 H PHE 19 HN PHE 19 3.511 -2.374 -11.574 57 HA PHE 19 HA PHE 19 1.017 -0.843 -11.281 58 HB2 PHE 19 HB2 PHE 19 1.449 -3.626 -10.212 59 HB3 PHE 19 HB1 PHE 19 -0.070 -2.805 -10.549 60 HD1 PHE 19 HD1 PHE 19 2.002 -5.326 -11.623 61 HD2 PHE 19 HD2 PHE 19 -0.228 -2.042 -13.154 62 HE1 PHE 19 HE1 PHE 19 1.940 -6.403 -13.829 63 HE2 PHE 19 HE2 PHE 19 -0.293 -3.112 -15.366 64 HZ PHE 19 HZ PHE 19 0.793 -5.297 -15.706 65 H CYS 20 HN CYS 20 0.937 0.406 -9.530 66 HA CYS 20 HA CYS 20 2.348 -0.487 -7.147 67 HB2 CYS 20 HB2 CYS 20 3.571 1.317 -8.425 68 HB3 CYS 20 HB1 CYS 20 2.216 2.379 -8.055 69 HN1 NH2 21 H1 CYS 20 0.253 -1.246 -6.519 70 HN2 NH2 21 H2 CYS 20 -0.934 -0.145 -5.916 Start of MODEL 11 1 H1 GLY 11 HT1 GLY 11 -0.792 2.540 -1.223 2 H2 GLY 11 HT2 GLY 11 -1.453 1.075 -1.738 3 H3 GLY 11 HT3 GLY 11 -2.023 2.534 -2.383 4 HA2 GLY 11 HA1 GLY 11 -0.583 1.412 -3.951 5 HA3 GLY 11 HA2 GLY 11 0.095 2.948 -3.426 6 H PHE 12 HN PHE 12 1.722 1.067 -4.522 7 HA PHE 12 HA PHE 12 2.986 -0.379 -2.324 8 HB2 PHE 12 HB2 PHE 12 3.497 -0.414 -5.313 9 HB3 PHE 12 HB1 PHE 12 4.611 -1.136 -4.169 10 HD1 PHE 12 HD1 PHE 12 0.918 -1.158 -4.750 11 HD2 PHE 12 HD2 PHE 12 4.438 -3.384 -3.908 12 HE1 PHE 12 HE1 PHE 12 -0.401 -3.233 -4.746 13 HE2 PHE 12 HE2 PHE 12 3.129 -5.464 -3.900 14 HZ PHE 12 HZ PHE 12 0.706 -5.390 -4.320 15 H ARG 13 HN ARG 13 5.527 -0.353 -2.571 16 HA ARG 13 HA ARG 13 6.268 2.353 -1.887 17 HB2 ARG 13 HB2 ARG 13 8.433 1.344 -1.236 18 HB3 ARG 13 HB1 ARG 13 7.060 0.592 -0.446 19 HG2 ARG 13 HG2 ARG 13 7.176 -1.292 -1.995 20 HG3 ARG 13 HG1 ARG 13 8.525 -0.529 -2.831 21 HD2 ARG 13 HD2 ARG 13 8.552 -1.284 0.084 22 HD3 ARG 13 HD1 ARG 13 9.162 -2.319 -1.205 23 HE ARG 13 HE ARG 13 10.545 -0.073 -1.627 24 HH11 ARG 13 HH11 ARG 13 9.934 -1.888 1.302 25 HH12 ARG 13 HH12 ARG 13 11.430 -1.450 2.048 26 HH21 ARG 13 HH21 ARG 13 12.537 0.522 -0.651 27 HH22 ARG 13 HH22 ARG 13 12.924 -0.064 0.930 28 H SER 14 HN SER 14 7.377 3.734 -3.109 29 HA SER 14 HA SER 14 7.994 3.013 -5.817 30 HB2 SER 14 HB2 SER 14 8.372 5.599 -4.290 31 HB3 SER 14 HB1 SER 14 8.679 5.405 -6.015 32 HG SER 14 HG SER 14 6.189 4.601 -5.026 33 HA PRO 15 HA PRO 15 9.312 3.769 -7.445 34 HB2 PRO 15 HB2 PRO 15 11.233 2.025 -8.748 35 HB3 PRO 15 HB1 PRO 15 11.032 3.768 -8.925 36 HG2 PRO 15 HG2 PRO 15 13.198 2.614 -7.723 37 HG3 PRO 15 HG1 PRO 15 12.614 4.240 -7.337 38 HD2 PRO 15 HD2 PRO 15 12.190 1.671 -5.864 39 HD3 PRO 15 HD1 PRO 15 12.517 3.297 -5.225 40 H CYS 16 HN CYS 16 7.553 2.624 -8.091 41 HA CYS 16 HA CYS 16 7.687 -0.298 -7.900 42 HB2 CYS 16 HB2 CYS 16 5.049 0.147 -7.669 43 HB3 CYS 16 HB1 CYS 16 6.134 0.129 -6.282 44 H ALA 17 HN ALA 17 7.622 -1.159 -10.078 45 HA ALA 17 HA ALA 17 5.793 0.142 -11.932 46 HB1 ALA 17 HB1 ALA 17 8.049 0.932 -12.447 47 HB2 ALA 17 HB2 ALA 17 7.418 -0.085 -13.741 48 HB3 ALA 17 HB3 ALA 17 8.600 -0.736 -12.605 49 HA PRO 18 HA PRO 18 4.938 -0.076 -13.564 50 HB2 PRO 18 HB2 PRO 18 3.003 -1.205 -15.167 51 HB3 PRO 18 HB1 PRO 18 4.681 -0.964 -15.652 52 HG2 PRO 18 HG2 PRO 18 3.319 -3.441 -15.219 53 HG3 PRO 18 HG1 PRO 18 4.988 -3.212 -15.690 54 HD2 PRO 18 HD2 PRO 18 3.865 -3.760 -13.008 55 HD3 PRO 18 HD1 PRO 18 5.498 -4.075 -13.632 56 H PHE 19 HN PHE 19 3.550 -2.354 -11.564 57 HA PHE 19 HA PHE 19 1.033 -0.854 -11.271 58 HB2 PHE 19 HB2 PHE 19 1.570 -3.561 -10.060 59 HB3 PHE 19 HB1 PHE 19 0.022 -2.794 -10.379 60 HD1 PHE 19 HD1 PHE 19 2.159 -5.300 -11.402 61 HD2 PHE 19 HD2 PHE 19 -0.320 -2.231 -12.990 62 HE1 PHE 19 HE1 PHE 19 2.023 -6.520 -13.527 63 HE2 PHE 19 HE2 PHE 19 -0.460 -3.444 -15.124 64 HZ PHE 19 HZ PHE 19 0.712 -5.593 -15.394 65 H CYS 20 HN CYS 20 0.779 0.330 -9.475 66 HA CYS 20 HA CYS 20 2.460 -0.342 -7.182 67 HB2 CYS 20 HB2 CYS 20 3.349 1.606 -8.543 68 HB3 CYS 20 HB1 CYS 20 1.909 2.490 -8.053 69 HN1 NH2 21 H1 CYS 20 0.068 -1.324 -7.141 70 HN2 NH2 21 H2 CYS 20 -1.009 -0.427 -6.131 Start of MODEL 12 1 H1 GLY 11 HT1 GLY 11 0.149 0.345 -1.033 2 H2 GLY 11 HT2 GLY 11 -0.317 -1.101 -1.769 3 H3 GLY 11 HT3 GLY 11 -1.122 0.339 -2.146 4 HA2 GLY 11 HA1 GLY 11 0.396 -0.292 -3.908 5 HA3 GLY 11 HA2 GLY 11 0.857 1.229 -3.156 6 H PHE 12 HN PHE 12 2.668 -0.270 -4.594 7 HA PHE 12 HA PHE 12 4.272 -1.758 -2.661 8 HB2 PHE 12 HB2 PHE 12 4.736 -1.247 -5.623 9 HB3 PHE 12 HB1 PHE 12 5.804 -2.171 -4.590 10 HD1 PHE 12 HD1 PHE 12 2.338 -2.116 -5.943 11 HD2 PHE 12 HD2 PHE 12 5.446 -4.436 -4.177 12 HE1 PHE 12 HE1 PHE 12 1.070 -4.165 -6.403 13 HE2 PHE 12 HE2 PHE 12 4.174 -6.487 -4.636 14 HZ PHE 12 HZ PHE 12 1.984 -6.355 -5.752 15 H ARG 13 HN ARG 13 6.763 -1.284 -2.959 16 HA ARG 13 HA ARG 13 7.094 1.415 -2.015 17 HB2 ARG 13 HB2 ARG 13 9.135 -0.783 -2.420 18 HB3 ARG 13 HB1 ARG 13 9.510 0.798 -1.774 19 HG2 ARG 13 HG2 ARG 13 7.683 -1.251 -0.546 20 HG3 ARG 13 HG1 ARG 13 9.282 -0.771 0.023 21 HD2 ARG 13 HD2 ARG 13 6.774 0.908 -0.034 22 HD3 ARG 13 HD1 ARG 13 7.630 0.317 1.388 23 HE ARG 13 HE ARG 13 8.388 2.558 -0.322 24 HH11 ARG 13 HH11 ARG 13 9.256 0.450 2.350 25 HH12 ARG 13 HH12 ARG 13 10.430 1.543 2.992 26 HH21 ARG 13 HH21 ARG 13 9.944 3.996 0.525 27 HH22 ARG 13 HH22 ARG 13 10.829 3.566 1.950 28 H SER 14 HN SER 14 7.664 3.117 -3.108 29 HA SER 14 HA SER 14 8.059 2.986 -5.921 30 HB2 SER 14 HB2 SER 14 8.436 5.497 -5.589 31 HB3 SER 14 HB1 SER 14 6.865 4.857 -5.111 32 HG SER 14 HG SER 14 7.412 5.972 -3.367 33 HA PRO 15 HA PRO 15 9.018 4.113 -7.599 34 HB2 PRO 15 HB2 PRO 15 10.583 3.061 -9.551 35 HB3 PRO 15 HB1 PRO 15 10.840 4.679 -8.891 36 HG2 PRO 15 HG2 PRO 15 12.258 2.124 -8.251 37 HG3 PRO 15 HG1 PRO 15 12.931 3.746 -8.491 38 HD2 PRO 15 HD2 PRO 15 12.519 2.668 -6.035 39 HD3 PRO 15 HD1 PRO 15 12.419 4.411 -6.351 40 H CYS 16 HN CYS 16 7.341 2.781 -8.098 41 HA CYS 16 HA CYS 16 7.823 -0.090 -7.958 42 HB2 CYS 16 HB2 CYS 16 5.169 0.069 -7.579 43 HB3 CYS 16 HB1 CYS 16 6.339 0.175 -6.267 44 H ALA 17 HN ALA 17 7.638 -1.120 -10.032 45 HA ALA 17 HA ALA 17 5.709 -0.006 -11.914 46 HB1 ALA 17 HB1 ALA 17 7.893 0.788 -12.601 47 HB2 ALA 17 HB2 ALA 17 7.323 -0.436 -13.736 48 HB3 ALA 17 HB3 ALA 17 8.540 -0.850 -12.531 49 HA PRO 18 HA PRO 18 5.163 -0.489 -13.855 50 HB2 PRO 18 HB2 PRO 18 2.995 -1.540 -15.104 51 HB3 PRO 18 HB1 PRO 18 4.650 -1.823 -15.648 52 HG2 PRO 18 HG2 PRO 18 2.799 -3.632 -14.230 53 HG3 PRO 18 HG1 PRO 18 4.122 -4.026 -15.312 54 HD2 PRO 18 HD2 PRO 18 4.138 -4.140 -12.487 55 HD3 PRO 18 HD1 PRO 18 5.540 -4.303 -13.559 56 H PHE 19 HN PHE 19 3.009 -2.426 -11.849 57 HA PHE 19 HA PHE 19 1.319 -0.063 -11.435 58 HB2 PHE 19 HB2 PHE 19 0.647 -2.836 -10.455 59 HB3 PHE 19 HB1 PHE 19 -0.437 -1.475 -10.696 60 HD1 PHE 19 HD1 PHE 19 -0.110 -4.541 -11.795 61 HD2 PHE 19 HD2 PHE 19 0.183 -0.614 -13.412 62 HE1 PHE 19 HE1 PHE 19 -0.670 -5.418 -14.025 63 HE2 PHE 19 HE2 PHE 19 -0.374 -1.487 -15.641 64 HZ PHE 19 HZ PHE 19 -0.800 -3.889 -15.949 65 H CYS 20 HN CYS 20 0.665 0.407 -9.224 66 HA CYS 20 HA CYS 20 2.642 -0.504 -7.272 67 HB2 CYS 20 HB2 CYS 20 3.100 1.794 -8.294 68 HB3 CYS 20 HB1 CYS 20 1.668 2.339 -7.429 69 HN1 NH2 21 H1 CYS 20 0.664 -1.889 -6.912 70 HN2 NH2 21 H2 CYS 20 -0.514 -1.291 -5.799 Start of MODEL 13 1 H1 GLY 11 HT1 GLY 11 0.555 3.025 -1.943 2 H2 GLY 11 HT2 GLY 11 -0.195 1.585 -1.492 3 H3 GLY 11 HT3 GLY 11 -0.881 2.545 -2.705 4 HA2 GLY 11 HA1 GLY 11 0.206 0.675 -3.703 5 HA3 GLY 11 HA2 GLY 11 1.066 2.154 -4.102 6 H PHE 12 HN PHE 12 2.597 0.154 -4.483 7 HA PHE 12 HA PHE 12 3.921 -0.794 -2.092 8 HB2 PHE 12 HB2 PHE 12 4.742 -1.098 -5.001 9 HB3 PHE 12 HB1 PHE 12 5.498 -1.893 -3.636 10 HD1 PHE 12 HD1 PHE 12 2.388 -1.741 -5.640 11 HD2 PHE 12 HD2 PHE 12 4.570 -3.809 -2.621 12 HE1 PHE 12 HE1 PHE 12 0.822 -3.619 -5.794 13 HE2 PHE 12 HE2 PHE 12 2.995 -5.690 -2.782 14 HZ PHE 12 HZ PHE 12 1.121 -5.596 -4.367 15 H ARG 13 HN ARG 13 6.500 -0.676 -2.289 16 HA ARG 13 HA ARG 13 7.133 2.034 -1.760 17 HB2 ARG 13 HB2 ARG 13 9.457 1.251 -1.494 18 HB3 ARG 13 HB1 ARG 13 8.312 0.261 -0.600 19 HG2 ARG 13 HG2 ARG 13 8.479 -1.505 -2.189 20 HG3 ARG 13 HG1 ARG 13 9.373 -0.487 -3.312 21 HD2 ARG 13 HD2 ARG 13 10.876 -2.034 -2.206 22 HD3 ARG 13 HD1 ARG 13 11.237 -0.384 -1.715 23 HE ARG 13 HE ARG 13 10.501 -0.869 0.434 24 HH11 ARG 13 HH11 ARG 13 9.953 -3.608 -1.696 25 HH12 ARG 13 HH12 ARG 13 9.730 -4.735 -0.404 26 HH21 ARG 13 HH21 ARG 13 10.210 -2.362 2.153 27 HH22 ARG 13 HH22 ARG 13 9.877 -4.019 1.798 28 H SER 14 HN SER 14 7.853 3.601 -3.041 29 HA SER 14 HA SER 14 8.155 3.116 -5.850 30 HB2 SER 14 HB2 SER 14 8.504 5.626 -4.192 31 HB3 SER 14 HB1 SER 14 8.598 5.578 -5.953 32 HG SER 14 HG SER 14 6.342 4.441 -4.768 33 HA PRO 15 HA PRO 15 9.155 3.982 -7.598 34 HB2 PRO 15 HB2 PRO 15 10.649 2.787 -9.486 35 HB3 PRO 15 HB1 PRO 15 11.025 4.401 -8.874 36 HG2 PRO 15 HG2 PRO 15 12.258 1.771 -8.167 37 HG3 PRO 15 HG1 PRO 15 13.043 3.335 -8.445 38 HD2 PRO 15 HD2 PRO 15 12.501 2.321 -5.961 39 HD3 PRO 15 HD1 PRO 15 12.636 4.055 -6.308 40 H CYS 16 HN CYS 16 7.454 2.703 -8.107 41 HA CYS 16 HA CYS 16 7.834 -0.190 -7.940 42 HB2 CYS 16 HB2 CYS 16 5.183 0.069 -7.558 43 HB3 CYS 16 HB1 CYS 16 6.353 0.120 -6.241 44 H ALA 17 HN ALA 17 7.711 -1.098 -10.086 45 HA ALA 17 HA ALA 17 5.753 0.080 -11.894 46 HB1 ALA 17 HB1 ALA 17 7.341 -0.132 -13.746 47 HB2 ALA 17 HB2 ALA 17 8.578 -0.698 -12.624 48 HB3 ALA 17 HB3 ALA 17 7.961 0.948 -12.496 49 HA PRO 18 HA PRO 18 5.039 -0.248 -13.677 50 HB2 PRO 18 HB2 PRO 18 2.892 -1.301 -14.974 51 HB3 PRO 18 HB1 PRO 18 4.541 -1.376 -15.598 52 HG2 PRO 18 HG2 PRO 18 2.883 -3.502 -14.460 53 HG3 PRO 18 HG1 PRO 18 4.282 -3.642 -15.506 54 HD2 PRO 18 HD2 PRO 18 4.153 -4.010 -12.665 55 HD3 PRO 18 HD1 PRO 18 5.584 -4.112 -13.707 56 H PHE 19 HN PHE 19 2.933 -2.580 -12.011 57 HA PHE 19 HA PHE 19 1.019 -0.492 -11.364 58 HB2 PHE 19 HB2 PHE 19 0.931 -3.304 -10.286 59 HB3 PHE 19 HB1 PHE 19 -0.399 -2.180 -10.510 60 HD1 PHE 19 HD1 PHE 19 0.733 -5.146 -11.599 61 HD2 PHE 19 HD2 PHE 19 -0.361 -1.360 -13.203 62 HE1 PHE 19 HE1 PHE 19 0.236 -6.212 -13.758 63 HE2 PHE 19 HE2 PHE 19 -0.856 -2.418 -15.369 64 HZ PHE 19 HZ PHE 19 -0.558 -4.846 -15.646 65 H CYS 20 HN CYS 20 0.756 0.412 -9.378 66 HA CYS 20 HA CYS 20 2.544 -0.494 -7.264 67 HB2 CYS 20 HB2 CYS 20 3.426 1.535 -8.453 68 HB3 CYS 20 HB1 CYS 20 1.987 2.398 -7.921 69 HN1 NH2 21 H1 CYS 20 0.569 -1.569 -6.594 70 HN2 NH2 21 H2 CYS 20 -0.634 -0.683 -5.728 Start of MODEL 14 1 H1 GLY 11 HT1 GLY 11 -0.958 0.121 -1.259 2 H2 GLY 11 HT2 GLY 11 -1.012 -1.089 -2.440 3 H3 GLY 11 HT3 GLY 11 -1.974 0.291 -2.600 4 HA2 GLY 11 HA1 GLY 11 -0.048 0.378 -4.065 5 HA3 GLY 11 HA2 GLY 11 -0.042 1.675 -2.878 6 H PHE 12 HN PHE 12 2.257 0.708 -4.256 7 HA PHE 12 HA PHE 12 3.702 -0.564 -2.019 8 HB2 PHE 12 HB2 PHE 12 4.197 -0.779 -4.995 9 HB3 PHE 12 HB1 PHE 12 5.412 -1.212 -3.806 10 HD1 PHE 12 HD1 PHE 12 1.915 -1.987 -4.830 11 HD2 PHE 12 HD2 PHE 12 5.436 -3.315 -2.840 12 HE1 PHE 12 HE1 PHE 12 0.939 -4.227 -4.605 13 HE2 PHE 12 HE2 PHE 12 4.461 -5.560 -2.612 14 HZ PHE 12 HZ PHE 12 2.208 -6.016 -3.495 15 H ARG 13 HN ARG 13 6.218 -0.090 -2.400 16 HA ARG 13 HA ARG 13 6.437 2.774 -1.987 17 HB2 ARG 13 HB2 ARG 13 8.537 0.602 -1.744 18 HB3 ARG 13 HB1 ARG 13 8.763 2.288 -1.328 19 HG2 ARG 13 HG2 ARG 13 7.184 2.148 0.457 20 HG3 ARG 13 HG1 ARG 13 6.693 0.528 -0.040 21 HD2 ARG 13 HD2 ARG 13 8.139 0.319 1.855 22 HD3 ARG 13 HD1 ARG 13 9.007 -0.250 0.434 23 HE ARG 13 HE ARG 13 9.516 2.512 1.066 24 HH11 ARG 13 HH11 ARG 13 10.456 -0.805 1.730 25 HH12 ARG 13 HH12 ARG 13 12.044 -0.384 2.272 26 HH21 ARG 13 HH21 ARG 13 11.632 3.073 1.771 27 HH22 ARG 13 HH22 ARG 13 12.715 1.829 2.288 28 H SER 14 HN SER 14 7.656 4.174 -3.166 29 HA SER 14 HA SER 14 7.960 3.544 -5.947 30 HB2 SER 14 HB2 SER 14 7.166 5.762 -5.107 31 HB3 SER 14 HB1 SER 14 8.763 6.038 -4.422 32 HG SER 14 HG SER 14 8.833 7.008 -6.340 33 HA PRO 15 HA PRO 15 9.047 4.047 -7.655 34 HB2 PRO 15 HB2 PRO 15 10.853 2.511 -9.264 35 HB3 PRO 15 HB1 PRO 15 10.653 4.262 -9.236 36 HG2 PRO 15 HG2 PRO 15 12.913 2.920 -8.367 37 HG3 PRO 15 HG1 PRO 15 12.459 4.562 -7.877 38 HD2 PRO 15 HD2 PRO 15 12.074 1.972 -6.430 39 HD3 PRO 15 HD1 PRO 15 12.521 3.568 -5.788 40 H CYS 16 HN CYS 16 7.337 2.775 -8.180 41 HA CYS 16 HA CYS 16 7.656 -0.119 -7.897 42 HB2 CYS 16 HB2 CYS 16 5.006 0.167 -7.634 43 HB3 CYS 16 HB1 CYS 16 6.115 0.311 -6.273 44 H ALA 17 HN ALA 17 7.536 -1.180 -9.975 45 HA ALA 17 HA ALA 17 5.743 -0.013 -11.949 46 HB1 ALA 17 HB1 ALA 17 8.544 -0.995 -12.489 47 HB2 ALA 17 HB2 ALA 17 8.026 0.692 -12.479 48 HB3 ALA 17 HB3 ALA 17 7.397 -0.417 -13.698 49 HA PRO 18 HA PRO 18 5.172 -0.415 -13.820 50 HB2 PRO 18 HB2 PRO 18 2.957 -1.663 -15.071 51 HB3 PRO 18 HB1 PRO 18 4.564 -1.438 -15.759 52 HG2 PRO 18 HG2 PRO 18 3.392 -3.890 -15.084 53 HG3 PRO 18 HG1 PRO 18 5.080 -3.623 -15.450 54 HD2 PRO 18 HD2 PRO 18 3.748 -3.892 -12.806 55 HD3 PRO 18 HD1 PRO 18 5.389 -4.364 -13.294 56 H PHE 19 HN PHE 19 3.331 -2.305 -11.654 57 HA PHE 19 HA PHE 19 1.296 -0.192 -11.413 58 HB2 PHE 19 HB2 PHE 19 0.948 -2.952 -10.275 59 HB3 PHE 19 HB1 PHE 19 -0.284 -1.792 -10.756 60 HD1 PHE 19 HD1 PHE 19 0.989 -4.840 -11.542 61 HD2 PHE 19 HD2 PHE 19 0.060 -1.139 -13.427 62 HE1 PHE 19 HE1 PHE 19 0.810 -5.990 -13.704 63 HE2 PHE 19 HE2 PHE 19 -0.121 -2.287 -15.595 64 HZ PHE 19 HZ PHE 19 0.256 -4.714 -15.734 65 H CYS 20 HN CYS 20 0.696 0.392 -9.241 66 HA CYS 20 HA CYS 20 2.722 -0.324 -7.265 67 HB2 CYS 20 HB2 CYS 20 2.862 2.020 -8.360 68 HB3 CYS 20 HB1 CYS 20 1.436 2.387 -7.396 69 HN1 NH2 21 H1 CYS 20 1.108 -1.907 -6.661 70 HN2 NH2 21 H2 CYS 20 -0.242 -1.435 -5.692 Start of MODEL 15 1 H1 GLY 11 HT1 GLY 11 -1.528 3.815 -1.994 2 H2 GLY 11 HT2 GLY 11 -1.947 2.190 -2.180 3 H3 GLY 11 HT3 GLY 11 -2.551 3.346 -3.256 4 HA2 GLY 11 HA1 GLY 11 -0.771 2.099 -4.283 5 HA3 GLY 11 HA2 GLY 11 -0.339 3.791 -4.080 6 H PHE 12 HN PHE 12 1.574 1.825 -4.426 7 HA PHE 12 HA PHE 12 2.666 1.427 -1.741 8 HB2 PHE 12 HB2 PHE 12 3.346 0.101 -4.369 9 HB3 PHE 12 HB1 PHE 12 4.456 0.058 -3.016 10 HD1 PHE 12 HD1 PHE 12 1.098 -1.014 -4.144 11 HD2 PHE 12 HD2 PHE 12 4.064 -1.269 -1.094 12 HE1 PHE 12 HE1 PHE 12 -0.103 -2.894 -3.124 13 HE2 PHE 12 HE2 PHE 12 2.859 -3.153 -0.080 14 HZ PHE 12 HZ PHE 12 0.773 -3.968 -1.094 15 H ARG 13 HN ARG 13 5.339 1.399 -2.086 16 HA ARG 13 HA ARG 13 5.748 4.286 -2.304 17 HB2 ARG 13 HB2 ARG 13 7.377 2.146 -0.905 18 HB3 ARG 13 HB1 ARG 13 7.981 3.767 -1.165 19 HG2 ARG 13 HG2 ARG 13 7.089 3.524 1.083 20 HG3 ARG 13 HG1 ARG 13 6.152 4.696 0.160 21 HD2 ARG 13 HD2 ARG 13 4.385 3.097 -0.174 22 HD3 ARG 13 HD1 ARG 13 5.355 1.810 0.544 23 HE ARG 13 HE ARG 13 5.231 3.441 2.584 24 HH11 ARG 13 HH11 ARG 13 2.646 2.684 0.328 25 HH12 ARG 13 HH12 ARG 13 1.400 2.791 1.516 26 HH21 ARG 13 HH21 ARG 13 3.574 3.575 4.168 27 HH22 ARG 13 HH22 ARG 13 1.929 3.302 3.707 28 H SER 14 HN SER 14 7.005 5.247 -3.725 29 HA SER 14 HA SER 14 7.795 3.936 -6.085 30 HB2 SER 14 HB2 SER 14 8.710 6.633 -5.061 31 HB3 SER 14 HB1 SER 14 8.711 6.087 -6.738 32 HG SER 14 HG SER 14 6.595 6.922 -5.126 33 HA PRO 15 HA PRO 15 9.119 4.074 -7.652 34 HB2 PRO 15 HB2 PRO 15 11.027 2.398 -8.874 35 HB3 PRO 15 HB1 PRO 15 11.017 4.161 -8.888 36 HG2 PRO 15 HG2 PRO 15 12.913 2.512 -7.612 37 HG3 PRO 15 HG1 PRO 15 12.724 4.259 -7.397 38 HD2 PRO 15 HD2 PRO 15 11.759 2.018 -5.690 39 HD3 PRO 15 HD1 PRO 15 12.279 3.653 -5.226 40 H CYS 16 HN CYS 16 7.482 2.753 -8.294 41 HA CYS 16 HA CYS 16 7.796 -0.121 -7.888 42 HB2 CYS 16 HB2 CYS 16 5.144 0.141 -7.529 43 HB3 CYS 16 HB1 CYS 16 6.305 0.233 -6.206 44 H ALA 17 HN ALA 17 7.633 -1.129 -9.993 45 HA ALA 17 HA ALA 17 5.734 0.049 -11.873 46 HB1 ALA 17 HB1 ALA 17 7.978 0.821 -12.463 47 HB2 ALA 17 HB2 ALA 17 7.336 -0.272 -13.690 48 HB3 ALA 17 HB3 ALA 17 8.538 -0.849 -12.536 49 HA PRO 18 HA PRO 18 5.097 -0.319 -13.716 50 HB2 PRO 18 HB2 PRO 18 3.055 -1.349 -15.162 51 HB3 PRO 18 HB1 PRO 18 4.748 -1.551 -15.622 52 HG2 PRO 18 HG2 PRO 18 2.872 -3.502 -14.481 53 HG3 PRO 18 HG1 PRO 18 4.296 -3.787 -15.462 54 HD2 PRO 18 HD2 PRO 18 4.050 -4.027 -12.630 55 HD3 PRO 18 HD1 PRO 18 5.523 -4.202 -13.597 56 H PHE 19 HN PHE 19 3.028 -2.501 -11.893 57 HA PHE 19 HA PHE 19 1.132 -0.316 -11.410 58 HB2 PHE 19 HB2 PHE 19 0.771 -3.151 -10.432 59 HB3 PHE 19 HB1 PHE 19 -0.455 -1.912 -10.654 60 HD1 PHE 19 HD1 PHE 19 0.359 -4.928 -11.810 61 HD2 PHE 19 HD2 PHE 19 -0.143 -0.986 -13.330 62 HE1 PHE 19 HE1 PHE 19 -0.139 -5.851 -14.036 63 HE2 PHE 19 HE2 PHE 19 -0.638 -1.899 -15.555 64 HZ PHE 19 HZ PHE 19 -0.636 -4.338 -15.912 65 H CYS 20 HN CYS 20 0.823 0.502 -9.374 66 HA CYS 20 HA CYS 20 2.728 -0.440 -7.363 67 HB2 CYS 20 HB2 CYS 20 3.323 1.727 -8.458 68 HB3 CYS 20 HB1 CYS 20 1.829 2.403 -7.821 69 HN1 NH2 21 H1 CYS 20 0.918 -1.765 -6.655 70 HN2 NH2 21 H2 CYS 20 -0.312 -1.068 -5.662 Start of MODEL 16 1 H1 GLY 11 HT1 GLY 11 -2.035 1.955 -1.764 2 H2 GLY 11 HT2 GLY 11 -2.090 0.719 -2.911 3 H3 GLY 11 HT3 GLY 11 -2.803 2.214 -3.247 4 HA2 GLY 11 HA1 GLY 11 -0.702 1.966 -4.404 5 HA3 GLY 11 HA2 GLY 11 -0.666 3.288 -3.243 6 H PHE 12 HN PHE 12 1.606 1.871 -4.284 7 HA PHE 12 HA PHE 12 2.558 0.634 -1.783 8 HB2 PHE 12 HB2 PHE 12 2.299 -0.908 -3.842 9 HB3 PHE 12 HB1 PHE 12 3.627 -0.010 -4.550 10 HD1 PHE 12 HD1 PHE 12 2.732 -2.194 -1.641 11 HD2 PHE 12 HD2 PHE 12 5.845 -0.589 -4.088 12 HE1 PHE 12 HE1 PHE 12 4.342 -3.700 -0.588 13 HE2 PHE 12 HE2 PHE 12 7.452 -2.110 -3.024 14 HZ PHE 12 HZ PHE 12 6.703 -3.664 -1.275 15 H ARG 13 HN ARG 13 5.117 0.694 -1.813 16 HA ARG 13 HA ARG 13 5.813 3.475 -1.913 17 HB2 ARG 13 HB2 ARG 13 8.026 2.696 -1.006 18 HB3 ARG 13 HB1 ARG 13 6.635 2.291 -0.017 19 HG2 ARG 13 HG2 ARG 13 6.680 -0.001 -0.865 20 HG3 ARG 13 HG1 ARG 13 8.055 0.401 -1.891 21 HD2 ARG 13 HD2 ARG 13 8.139 0.776 1.086 22 HD3 ARG 13 HD1 ARG 13 8.498 -0.781 0.347 23 HE ARG 13 HE ARG 13 10.065 1.122 -0.943 24 HH11 ARG 13 HH11 ARG 13 9.744 -0.181 2.300 25 HH12 ARG 13 HH12 ARG 13 11.420 0.001 2.681 26 HH21 ARG 13 HH21 ARG 13 12.281 1.381 -0.435 27 HH22 ARG 13 HH22 ARG 13 12.872 0.907 1.121 28 H SER 14 HN SER 14 7.040 4.509 -3.336 29 HA SER 14 HA SER 14 7.641 3.204 -5.827 30 HB2 SER 14 HB2 SER 14 8.434 5.612 -6.385 31 HB3 SER 14 HB1 SER 14 6.713 5.345 -6.104 32 HG SER 14 HG SER 14 6.816 6.430 -4.279 33 HA PRO 15 HA PRO 15 9.030 4.016 -7.599 34 HB2 PRO 15 HB2 PRO 15 11.029 2.224 -8.705 35 HB3 PRO 15 HB1 PRO 15 10.789 3.941 -9.030 36 HG2 PRO 15 HG2 PRO 15 12.949 2.950 -7.682 37 HG3 PRO 15 HG1 PRO 15 12.308 4.585 -7.443 38 HD2 PRO 15 HD2 PRO 15 11.917 2.129 -5.778 39 HD3 PRO 15 HD1 PRO 15 12.175 3.810 -5.264 40 H CYS 16 HN CYS 16 7.388 2.763 -8.343 41 HA CYS 16 HA CYS 16 7.579 -0.114 -7.894 42 HB2 CYS 16 HB2 CYS 16 4.945 0.206 -7.681 43 HB3 CYS 16 HB1 CYS 16 6.024 0.381 -6.300 44 H ALA 17 HN ALA 17 7.550 -1.129 -9.978 45 HA ALA 17 HA ALA 17 5.735 -0.037 -11.978 46 HB1 ALA 17 HB1 ALA 17 7.424 -0.488 -13.695 47 HB2 ALA 17 HB2 ALA 17 8.564 -0.982 -12.445 48 HB3 ALA 17 HB3 ALA 17 8.004 0.689 -12.518 49 HA PRO 18 HA PRO 18 5.204 -0.572 -13.917 50 HB2 PRO 18 HB2 PRO 18 2.990 -1.605 -15.101 51 HB3 PRO 18 HB1 PRO 18 4.628 -1.966 -15.650 52 HG2 PRO 18 HG2 PRO 18 2.769 -3.630 -14.044 53 HG3 PRO 18 HG1 PRO 18 3.956 -4.127 -15.243 54 HD2 PRO 18 HD2 PRO 18 4.290 -4.266 -12.488 55 HD3 PRO 18 HD1 PRO 18 5.600 -4.299 -13.678 56 H PHE 19 HN PHE 19 2.962 -2.413 -11.867 57 HA PHE 19 HA PHE 19 1.387 0.029 -11.479 58 HB2 PHE 19 HB2 PHE 19 0.636 -2.684 -10.387 59 HB3 PHE 19 HB1 PHE 19 -0.404 -1.295 -10.658 60 HD1 PHE 19 HD1 PHE 19 -0.214 -4.400 -11.661 61 HD2 PHE 19 HD2 PHE 19 0.222 -0.547 -13.411 62 HE1 PHE 19 HE1 PHE 19 -0.833 -5.328 -13.852 63 HE2 PHE 19 HE2 PHE 19 -0.395 -1.469 -15.605 64 HZ PHE 19 HZ PHE 19 -0.922 -3.862 -15.826 65 H CYS 20 HN CYS 20 0.577 0.288 -9.135 66 HA CYS 20 HA CYS 20 2.803 -0.293 -7.333 67 HB2 CYS 20 HB2 CYS 20 2.730 2.052 -8.371 68 HB3 CYS 20 HB1 CYS 20 1.325 2.318 -7.348 69 HN1 NH2 21 H1 CYS 20 1.398 -1.988 -6.574 70 HN2 NH2 21 H2 CYS 20 0.095 -1.620 -5.498 Start of MODEL 17 1 H1 GLY 11 HT1 GLY 11 0.302 0.384 -0.855 2 H2 GLY 11 HT2 GLY 11 -0.213 -0.939 -1.770 3 H3 GLY 11 HT3 GLY 11 -0.909 0.578 -2.019 4 HA2 GLY 11 HA1 GLY 11 0.665 0.036 -3.772 5 HA3 GLY 11 HA2 GLY 11 1.159 1.451 -2.851 6 H PHE 12 HN PHE 12 3.003 0.048 -4.334 7 HA PHE 12 HA PHE 12 4.463 -1.517 -2.308 8 HB2 PHE 12 HB2 PHE 12 4.779 -1.503 -5.325 9 HB3 PHE 12 HB1 PHE 12 5.835 -2.362 -4.222 10 HD1 PHE 12 HD1 PHE 12 2.395 -2.251 -5.580 11 HD2 PHE 12 HD2 PHE 12 5.185 -4.388 -3.159 12 HE1 PHE 12 HE1 PHE 12 0.896 -4.189 -5.560 13 HE2 PHE 12 HE2 PHE 12 3.677 -6.325 -3.142 14 HZ PHE 12 HZ PHE 12 1.532 -6.228 -4.339 15 H ARG 13 HN ARG 13 6.992 -1.387 -2.920 16 HA ARG 13 HA ARG 13 7.800 1.171 -2.005 17 HB2 ARG 13 HB2 ARG 13 9.500 -1.038 -3.193 18 HB3 ARG 13 HB1 ARG 13 10.090 0.340 -2.280 19 HG2 ARG 13 HG2 ARG 13 9.096 -0.417 -0.282 20 HG3 ARG 13 HG1 ARG 13 8.141 -1.632 -1.133 21 HD2 ARG 13 HD2 ARG 13 10.193 -2.817 -1.730 22 HD3 ARG 13 HD1 ARG 13 11.144 -1.595 -0.887 23 HE ARG 13 HE ARG 13 10.398 -2.432 1.160 24 HH11 ARG 13 HH11 ARG 13 8.971 -4.199 -1.516 25 HH12 ARG 13 HH12 ARG 13 8.525 -5.561 -0.555 26 HH21 ARG 13 HH21 ARG 13 9.798 -4.225 2.441 27 HH22 ARG 13 HH22 ARG 13 8.994 -5.577 1.711 28 H SER 14 HN SER 14 8.040 2.972 -3.105 29 HA SER 14 HA SER 14 8.050 2.925 -5.998 30 HB2 SER 14 HB2 SER 14 8.043 5.269 -4.083 31 HB3 SER 14 HB1 SER 14 7.719 5.336 -5.817 32 HG SER 14 HG SER 14 6.015 3.672 -5.206 33 HA PRO 15 HA PRO 15 8.698 4.329 -7.777 34 HB2 PRO 15 HB2 PRO 15 10.801 3.132 -9.461 35 HB3 PRO 15 HB1 PRO 15 9.964 4.675 -9.647 36 HG2 PRO 15 HG2 PRO 15 12.532 4.566 -8.889 37 HG3 PRO 15 HG1 PRO 15 11.424 5.785 -8.233 38 HD2 PRO 15 HD2 PRO 15 12.361 3.221 -6.996 39 HD3 PRO 15 HD1 PRO 15 12.205 4.831 -6.263 40 H CYS 16 HN CYS 16 7.153 2.816 -8.093 41 HA CYS 16 HA CYS 16 7.958 0.010 -8.052 42 HB2 CYS 16 HB2 CYS 16 5.344 -0.119 -7.424 43 HB3 CYS 16 HB1 CYS 16 6.622 0.078 -6.228 44 H ALA 17 HN ALA 17 7.673 -1.045 -10.106 45 HA ALA 17 HA ALA 17 5.538 -0.074 -11.835 46 HB1 ALA 17 HB1 ALA 17 8.363 -0.791 -12.630 47 HB2 ALA 17 HB2 ALA 17 7.665 0.827 -12.625 48 HB3 ALA 17 HB3 ALA 17 7.060 -0.389 -13.747 49 HA PRO 18 HA PRO 18 5.162 -0.768 -14.089 50 HB2 PRO 18 HB2 PRO 18 2.801 -1.844 -14.938 51 HB3 PRO 18 HB1 PRO 18 4.369 -2.314 -15.606 52 HG2 PRO 18 HG2 PRO 18 2.728 -3.679 -13.508 53 HG3 PRO 18 HG1 PRO 18 3.574 -4.385 -14.889 54 HD2 PRO 18 HD2 PRO 18 4.581 -4.443 -12.383 55 HD3 PRO 18 HD1 PRO 18 5.626 -4.291 -13.809 56 H PHE 19 HN PHE 19 2.830 -2.341 -11.895 57 HA PHE 19 HA PHE 19 1.658 0.312 -11.417 58 HB2 PHE 19 HB2 PHE 19 0.292 -2.285 -10.716 59 HB3 PHE 19 HB1 PHE 19 -0.425 -0.689 -10.900 60 HD1 PHE 19 HD1 PHE 19 -0.524 -3.725 -12.284 61 HD2 PHE 19 HD2 PHE 19 0.389 0.262 -13.449 62 HE1 PHE 19 HE1 PHE 19 -1.071 -4.286 -14.611 63 HE2 PHE 19 HE2 PHE 19 -0.160 -0.292 -15.783 64 HZ PHE 19 HZ PHE 19 -0.887 -2.571 -16.365 65 H CYS 20 HN CYS 20 0.854 0.636 -9.160 66 HA CYS 20 HA CYS 20 2.684 -0.641 -7.277 67 HB2 CYS 20 HB2 CYS 20 3.100 1.798 -8.035 68 HB3 CYS 20 HB1 CYS 20 1.710 2.180 -7.028 69 HN1 NH2 21 H1 CYS 20 0.775 -2.084 -7.035 70 HN2 NH2 21 H2 CYS 20 -0.477 -1.603 -5.944 Start of MODEL 18 1 H1 GLY 11 HT1 GLY 11 -1.237 4.275 -1.803 2 H2 GLY 11 HT2 GLY 11 -2.022 2.787 -1.681 3 H3 GLY 11 HT3 GLY 11 -2.477 3.884 -2.885 4 HA2 GLY 11 HA1 GLY 11 -1.157 2.122 -3.832 5 HA3 GLY 11 HA2 GLY 11 -0.313 3.663 -3.930 6 H PHE 12 HN PHE 12 1.259 1.578 -4.180 7 HA PHE 12 HA PHE 12 2.260 0.930 -1.511 8 HB2 PHE 12 HB2 PHE 12 2.857 -0.306 -4.207 9 HB3 PHE 12 HB1 PHE 12 3.836 -0.631 -2.788 10 HD1 PHE 12 HD1 PHE 12 0.268 -0.693 -3.888 11 HD2 PHE 12 HD2 PHE 12 3.282 -2.369 -1.396 12 HE1 PHE 12 HE1 PHE 12 -1.302 -2.439 -3.169 13 HE2 PHE 12 HE2 PHE 12 1.716 -4.117 -0.675 14 HZ PHE 12 HZ PHE 12 -0.580 -4.154 -1.563 15 H ARG 13 HN ARG 13 4.804 0.619 -1.604 16 HA ARG 13 HA ARG 13 5.810 3.265 -1.607 17 HB2 ARG 13 HB2 ARG 13 7.961 2.223 -0.986 18 HB3 ARG 13 HB1 ARG 13 6.621 1.683 0.010 19 HG2 ARG 13 HG2 ARG 13 6.495 -0.395 -1.264 20 HG3 ARG 13 HG1 ARG 13 7.834 0.147 -2.277 21 HD2 ARG 13 HD2 ARG 13 7.964 -0.257 0.704 22 HD3 ARG 13 HD1 ARG 13 8.540 -1.412 -0.496 23 HE ARG 13 HE ARG 13 9.981 0.618 -1.222 24 HH11 ARG 13 HH11 ARG 13 9.156 -0.263 2.067 25 HH12 ARG 13 HH12 ARG 13 10.608 0.378 2.743 26 HH21 ARG 13 HH21 ARG 13 11.893 1.510 -0.322 27 HH22 ARG 13 HH22 ARG 13 12.175 1.390 1.377 28 H SER 14 HN SER 14 7.177 4.304 -2.933 29 HA SER 14 HA SER 14 7.480 3.210 -5.619 30 HB2 SER 14 HB2 SER 14 8.095 5.992 -4.604 31 HB3 SER 14 HB1 SER 14 7.925 5.491 -6.286 32 HG SER 14 HG SER 14 5.732 4.797 -4.879 33 HA PRO 15 HA PRO 15 8.810 4.034 -7.389 34 HB2 PRO 15 HB2 PRO 15 10.818 2.320 -8.621 35 HB3 PRO 15 HB1 PRO 15 10.518 4.039 -8.891 36 HG2 PRO 15 HG2 PRO 15 12.749 3.115 -7.654 37 HG3 PRO 15 HG1 PRO 15 12.023 4.688 -7.281 38 HD2 PRO 15 HD2 PRO 15 11.770 2.091 -5.802 39 HD3 PRO 15 HD1 PRO 15 12.039 3.726 -5.162 40 H CYS 16 HN CYS 16 7.317 2.751 -8.395 41 HA CYS 16 HA CYS 16 7.413 -0.110 -7.822 42 HB2 CYS 16 HB2 CYS 16 4.782 0.272 -7.763 43 HB3 CYS 16 HB1 CYS 16 5.785 0.470 -6.327 44 H ALA 17 HN ALA 17 7.449 -1.195 -9.895 45 HA ALA 17 HA ALA 17 5.760 -0.056 -11.985 46 HB1 ALA 17 HB1 ALA 17 8.098 0.574 -12.413 47 HB2 ALA 17 HB2 ALA 17 7.471 -0.519 -13.647 48 HB3 ALA 17 HB3 ALA 17 8.548 -1.132 -12.394 49 HA PRO 18 HA PRO 18 5.235 -0.507 -13.835 50 HB2 PRO 18 HB2 PRO 18 3.238 -1.550 -15.345 51 HB3 PRO 18 HB1 PRO 18 4.947 -1.828 -15.691 52 HG2 PRO 18 HG2 PRO 18 2.943 -3.667 -14.606 53 HG3 PRO 18 HG1 PRO 18 4.451 -4.039 -15.411 54 HD2 PRO 18 HD2 PRO 18 3.901 -4.060 -12.598 55 HD3 PRO 18 HD1 PRO 18 5.443 -4.404 -13.404 56 H PHE 19 HN PHE 19 3.362 -2.223 -11.622 57 HA PHE 19 HA PHE 19 1.349 -0.076 -11.511 58 HB2 PHE 19 HB2 PHE 19 1.025 -2.762 -10.167 59 HB3 PHE 19 HB1 PHE 19 -0.216 -1.582 -10.551 60 HD1 PHE 19 HD1 PHE 19 0.813 -4.708 -11.320 61 HD2 PHE 19 HD2 PHE 19 -0.127 -1.055 -13.287 62 HE1 PHE 19 HE1 PHE 19 0.296 -5.952 -13.376 63 HE2 PHE 19 HE2 PHE 19 -0.640 -2.293 -15.350 64 HZ PHE 19 HZ PHE 19 -0.430 -4.746 -15.394 65 H CYS 20 HN CYS 20 0.561 0.160 -9.094 66 HA CYS 20 HA CYS 20 2.899 -0.095 -7.360 67 HB2 CYS 20 HB2 CYS 20 2.419 2.249 -8.376 68 HB3 CYS 20 HB1 CYS 20 1.099 2.294 -7.210 69 HN1 NH2 21 H1 CYS 20 1.534 -2.022 -6.874 70 HN2 NH2 21 H2 CYS 20 0.338 -1.857 -5.638 Start of MODEL 19 1 H1 GLY 11 HT1 GLY 11 -1.374 1.772 -1.425 2 H2 GLY 11 HT2 GLY 11 -1.520 0.286 -2.217 3 H3 GLY 11 HT3 GLY 11 -2.337 1.643 -2.805 4 HA2 GLY 11 HA1 GLY 11 -0.377 1.129 -4.133 5 HA3 GLY 11 HA2 GLY 11 -0.288 2.712 -3.370 6 H PHE 12 HN PHE 12 1.975 1.332 -4.268 7 HA PHE 12 HA PHE 12 3.216 0.565 -1.703 8 HB2 PHE 12 HB2 PHE 12 4.002 -0.228 -4.520 9 HB3 PHE 12 HB1 PHE 12 5.011 -0.508 -3.115 10 HD1 PHE 12 HD1 PHE 12 1.821 -1.457 -4.738 11 HD2 PHE 12 HD2 PHE 12 4.551 -2.234 -1.556 12 HE1 PHE 12 HE1 PHE 12 0.672 -3.569 -4.264 13 HE2 PHE 12 HE2 PHE 12 3.398 -4.349 -1.084 14 HZ PHE 12 HZ PHE 12 1.457 -5.020 -2.437 15 H ARG 13 HN ARG 13 5.742 0.980 -1.880 16 HA ARG 13 HA ARG 13 5.961 3.854 -2.189 17 HB2 ARG 13 HB2 ARG 13 8.087 1.893 -1.289 18 HB3 ARG 13 HB1 ARG 13 8.130 3.640 -1.121 19 HG2 ARG 13 HG2 ARG 13 6.195 1.785 0.252 20 HG3 ARG 13 HG1 ARG 13 7.591 2.569 0.990 21 HD2 ARG 13 HD2 ARG 13 6.593 4.759 0.551 22 HD3 ARG 13 HD1 ARG 13 5.207 3.979 -0.209 23 HE ARG 13 HE ARG 13 5.585 2.999 2.415 24 HH11 ARG 13 HH11 ARG 13 4.395 5.801 0.686 25 HH12 ARG 13 HH12 ARG 13 3.311 6.284 1.943 26 HH21 ARG 13 HH21 ARG 13 4.137 3.628 4.090 27 HH22 ARG 13 HH22 ARG 13 3.165 5.044 3.888 28 H SER 14 HN SER 14 6.886 4.886 -3.825 29 HA SER 14 HA SER 14 7.748 3.411 -6.126 30 HB2 SER 14 HB2 SER 14 7.813 6.392 -5.589 31 HB3 SER 14 HB1 SER 14 7.972 5.619 -7.165 32 HG SER 14 HG SER 14 5.771 4.651 -6.142 33 HA PRO 15 HA PRO 15 9.089 4.244 -8.006 34 HB2 PRO 15 HB2 PRO 15 11.003 2.831 -9.288 35 HB3 PRO 15 HB1 PRO 15 11.148 4.564 -8.979 36 HG2 PRO 15 HG2 PRO 15 12.369 2.269 -7.506 37 HG3 PRO 15 HG1 PRO 15 13.092 3.823 -7.953 38 HD2 PRO 15 HD2 PRO 15 12.136 3.258 -5.458 39 HD3 PRO 15 HD1 PRO 15 12.198 4.896 -6.135 40 H CYS 16 HN CYS 16 7.498 2.814 -8.388 41 HA CYS 16 HA CYS 16 8.043 -0.024 -7.985 42 HB2 CYS 16 HB2 CYS 16 5.467 -0.041 -7.393 43 HB3 CYS 16 HB1 CYS 16 6.675 0.346 -6.171 44 H ALA 17 HN ALA 17 7.750 -1.093 -10.050 45 HA ALA 17 HA ALA 17 5.696 0.002 -11.811 46 HB1 ALA 17 HB1 ALA 17 8.481 -0.824 -12.620 47 HB2 ALA 17 HB2 ALA 17 7.857 0.825 -12.578 48 HB3 ALA 17 HB3 ALA 17 7.194 -0.340 -13.723 49 HA PRO 18 HA PRO 18 5.125 -0.477 -13.797 50 HB2 PRO 18 HB2 PRO 18 2.882 -1.515 -14.921 51 HB3 PRO 18 HB1 PRO 18 4.503 -1.827 -15.547 52 HG2 PRO 18 HG2 PRO 18 2.738 -3.576 -13.931 53 HG3 PRO 18 HG1 PRO 18 3.895 -4.014 -15.178 54 HD2 PRO 18 HD2 PRO 18 4.299 -4.207 -12.425 55 HD3 PRO 18 HD1 PRO 18 5.578 -4.219 -13.651 56 H PHE 19 HN PHE 19 2.595 -2.459 -12.208 57 HA PHE 19 HA PHE 19 1.193 -0.039 -11.464 58 HB2 PHE 19 HB2 PHE 19 0.401 -2.833 -10.639 59 HB3 PHE 19 HB1 PHE 19 -0.626 -1.413 -10.791 60 HD1 PHE 19 HD1 PHE 19 -0.335 -4.416 -12.131 61 HD2 PHE 19 HD2 PHE 19 -0.022 -0.371 -13.402 62 HE1 PHE 19 HE1 PHE 19 -0.871 -5.094 -14.431 63 HE2 PHE 19 HE2 PHE 19 -0.560 -1.044 -15.703 64 HZ PHE 19 HZ PHE 19 -0.982 -3.410 -16.219 65 H CYS 20 HN CYS 20 0.642 0.426 -9.242 66 HA CYS 20 HA CYS 20 2.605 -0.646 -7.369 67 HB2 CYS 20 HB2 CYS 20 3.244 1.579 -8.391 68 HB3 CYS 20 HB1 CYS 20 1.838 2.258 -7.581 69 HN1 NH2 21 H1 CYS 20 0.673 -1.906 -6.788 70 HN2 NH2 21 H2 CYS 20 -0.490 -1.198 -5.724 Start of MODEL 20 1 H1 GLY 11 HT1 GLY 11 -0.544 -0.108 -1.089 2 H2 GLY 11 HT2 GLY 11 -0.710 -1.481 -2.059 3 H3 GLY 11 HT3 GLY 11 -1.661 -0.115 -2.360 4 HA2 GLY 11 HA1 GLY 11 0.129 -0.282 -3.966 5 HA3 GLY 11 HA2 GLY 11 0.285 1.155 -2.965 6 H PHE 12 HN PHE 12 2.460 0.190 -4.306 7 HA PHE 12 HA PHE 12 4.004 -1.210 -2.226 8 HB2 PHE 12 HB2 PHE 12 4.585 -0.924 -5.190 9 HB3 PHE 12 HB1 PHE 12 5.682 -1.643 -4.029 10 HD1 PHE 12 HD1 PHE 12 2.466 -2.106 -5.783 11 HD2 PHE 12 HD2 PHE 12 5.321 -3.820 -3.115 12 HE1 PHE 12 HE1 PHE 12 1.401 -4.293 -6.041 13 HE2 PHE 12 HE2 PHE 12 4.242 -6.010 -3.378 14 HZ PHE 12 HZ PHE 12 2.281 -6.250 -4.842 15 H ARG 13 HN ARG 13 6.509 -0.566 -2.587 16 HA ARG 13 HA ARG 13 6.591 2.246 -1.848 17 HB2 ARG 13 HB2 ARG 13 8.887 0.277 -1.969 18 HB3 ARG 13 HB1 ARG 13 8.873 1.820 -1.144 19 HG2 ARG 13 HG2 ARG 13 7.304 -0.645 -0.408 20 HG3 ARG 13 HG1 ARG 13 8.670 0.043 0.465 21 HD2 ARG 13 HD2 ARG 13 6.030 1.444 0.039 22 HD3 ARG 13 HD1 ARG 13 6.442 0.530 1.483 23 HE ARG 13 HE ARG 13 7.657 3.075 0.636 24 HH11 ARG 13 HH11 ARG 13 7.197 0.601 3.088 25 HH12 ARG 13 HH12 ARG 13 7.831 1.582 4.364 26 HH21 ARG 13 HH21 ARG 13 8.502 4.355 2.327 27 HH22 ARG 13 HH22 ARG 13 8.564 3.716 3.938 28 H SER 14 HN SER 14 7.398 3.833 -3.094 29 HA SER 14 HA SER 14 7.865 3.286 -5.860 30 HB2 SER 14 HB2 SER 14 8.230 5.893 -4.373 31 HB3 SER 14 HB1 SER 14 7.971 5.679 -6.106 32 HG SER 14 HG SER 14 5.928 4.577 -5.343 33 HA PRO 15 HA PRO 15 8.907 4.159 -7.611 34 HB2 PRO 15 HB2 PRO 15 10.524 2.944 -9.388 35 HB3 PRO 15 HB1 PRO 15 10.809 4.600 -8.837 36 HG2 PRO 15 HG2 PRO 15 12.106 2.059 -7.939 37 HG3 PRO 15 HG1 PRO 15 12.850 3.629 -8.297 38 HD2 PRO 15 HD2 PRO 15 12.293 2.786 -5.770 39 HD3 PRO 15 HD1 PRO 15 12.303 4.496 -6.242 40 H CYS 16 HN CYS 16 7.357 2.773 -8.335 41 HA CYS 16 HA CYS 16 7.827 -0.078 -7.956 42 HB2 CYS 16 HB2 CYS 16 5.185 0.053 -7.475 43 HB3 CYS 16 HB1 CYS 16 6.404 0.187 -6.210 44 H ALA 17 HN ALA 17 7.609 -1.102 -10.024 45 HA ALA 17 HA ALA 17 5.613 -0.018 -11.848 46 HB1 ALA 17 HB1 ALA 17 8.445 -0.799 -12.541 47 HB2 ALA 17 HB2 ALA 17 7.786 0.836 -12.538 48 HB3 ALA 17 HB3 ALA 17 7.198 -0.350 -13.702 49 HA PRO 18 HA PRO 18 5.181 -0.508 -13.879 50 HB2 PRO 18 HB2 PRO 18 3.048 -1.567 -15.174 51 HB3 PRO 18 HB1 PRO 18 4.716 -1.867 -15.670 52 HG2 PRO 18 HG2 PRO 18 2.832 -3.632 -14.227 53 HG3 PRO 18 HG1 PRO 18 4.121 -4.059 -15.340 54 HD2 PRO 18 HD2 PRO 18 4.228 -4.214 -12.545 55 HD3 PRO 18 HD1 PRO 18 5.619 -4.273 -13.641 56 H PHE 19 HN PHE 19 3.060 -2.408 -11.836 57 HA PHE 19 HA PHE 19 1.356 -0.038 -11.453 58 HB2 PHE 19 HB2 PHE 19 0.668 -2.803 -10.459 59 HB3 PHE 19 HB1 PHE 19 -0.411 -1.441 -10.717 60 HD1 PHE 19 HD1 PHE 19 -0.052 -4.527 -11.776 61 HD2 PHE 19 HD2 PHE 19 0.182 -0.615 -13.438 62 HE1 PHE 19 HE1 PHE 19 -0.611 -5.438 -13.991 63 HE2 PHE 19 HE2 PHE 19 -0.375 -1.519 -15.655 64 HZ PHE 19 HZ PHE 19 -0.772 -3.933 -15.933 65 H CYS 20 HN CYS 20 0.724 0.447 -9.218 66 HA CYS 20 HA CYS 20 2.714 -0.497 -7.294 67 HB2 CYS 20 HB2 CYS 20 3.158 1.815 -8.267 68 HB3 CYS 20 HB1 CYS 20 1.706 2.339 -7.420 69 HN1 NH2 21 H1 CYS 20 0.703 -1.898 -7.001 70 HN2 NH2 21 H2 CYS 20 -0.456 -1.335 -5.850 Start of MODEL 21 1 H1 GLY 11 HT1 GLY 11 -0.541 2.609 -1.247 2 H2 GLY 11 HT2 GLY 11 -1.230 1.224 -1.933 3 H3 GLY 11 HT3 GLY 11 -1.624 2.753 -2.536 4 HA2 GLY 11 HA1 GLY 11 -0.068 1.570 -3.972 5 HA3 GLY 11 HA2 GLY 11 0.567 3.088 -3.352 6 H PHE 12 HN PHE 12 2.148 0.968 -4.316 7 HA PHE 12 HA PHE 12 3.317 -0.243 -1.925 8 HB2 PHE 12 HB2 PHE 12 3.952 -0.588 -4.877 9 HB3 PHE 12 HB1 PHE 12 4.976 -1.230 -3.611 10 HD1 PHE 12 HD1 PHE 12 1.443 -1.323 -4.797 11 HD2 PHE 12 HD2 PHE 12 4.578 -3.310 -2.723 12 HE1 PHE 12 HE1 PHE 12 0.059 -3.346 -4.647 13 HE2 PHE 12 HE2 PHE 12 3.197 -5.339 -2.569 14 HZ PHE 12 HZ PHE 12 0.933 -5.358 -3.531 15 H ARG 13 HN ARG 13 5.951 -0.231 -2.204 16 HA ARG 13 HA ARG 13 6.568 2.553 -1.707 17 HB2 ARG 13 HB2 ARG 13 8.260 0.051 -1.443 18 HB3 ARG 13 HB1 ARG 13 8.958 1.647 -1.369 19 HG2 ARG 13 HG2 ARG 13 8.632 0.982 0.857 20 HG3 ARG 13 HG1 ARG 13 7.385 2.174 0.513 21 HD2 ARG 13 HD2 ARG 13 6.503 0.309 1.808 22 HD3 ARG 13 HD1 ARG 13 5.746 0.378 0.223 23 HE ARG 13 HE ARG 13 6.738 -1.638 -0.318 24 HH11 ARG 13 HH11 ARG 13 8.120 -0.455 2.690 25 HH12 ARG 13 HH12 ARG 13 8.852 -1.964 3.097 26 HH21 ARG 13 HH21 ARG 13 7.726 -3.633 0.212 27 HH22 ARG 13 HH22 ARG 13 8.633 -3.780 1.680 28 H SER 14 HN SER 14 7.135 3.923 -3.200 29 HA SER 14 HA SER 14 7.833 3.076 -5.835 30 HB2 SER 14 HB2 SER 14 7.926 5.831 -4.579 31 HB3 SER 14 HB1 SER 14 8.017 5.482 -6.306 32 HG SER 14 HG SER 14 5.882 4.238 -5.458 33 HA PRO 15 HA PRO 15 9.028 4.080 -7.611 34 HB2 PRO 15 HB2 PRO 15 10.782 2.777 -9.198 35 HB3 PRO 15 HB1 PRO 15 11.021 4.454 -8.692 36 HG2 PRO 15 HG2 PRO 15 12.236 1.952 -7.585 37 HG3 PRO 15 HG1 PRO 15 13.003 3.514 -7.925 38 HD2 PRO 15 HD2 PRO 15 12.226 2.747 -5.435 39 HD3 PRO 15 HD1 PRO 15 12.271 4.440 -5.959 40 H CYS 16 HN CYS 16 7.425 2.739 -8.249 41 HA CYS 16 HA CYS 16 7.801 -0.140 -7.912 42 HB2 CYS 16 HB2 CYS 16 5.154 0.094 -7.539 43 HB3 CYS 16 HB1 CYS 16 6.317 0.206 -6.219 44 H ALA 17 HN ALA 17 7.643 -1.120 -10.038 45 HA ALA 17 HA ALA 17 5.692 0.034 -11.873 46 HB1 ALA 17 HB1 ALA 17 8.503 -0.809 -12.581 47 HB2 ALA 17 HB2 ALA 17 7.897 0.847 -12.527 48 HB3 ALA 17 HB3 ALA 17 7.269 -0.283 -13.726 49 HA PRO 18 HA PRO 18 5.118 -0.341 -13.754 50 HB2 PRO 18 HB2 PRO 18 3.103 -1.398 -15.230 51 HB3 PRO 18 HB1 PRO 18 4.804 -1.562 -15.669 52 HG2 PRO 18 HG2 PRO 18 2.952 -3.566 -14.605 53 HG3 PRO 18 HG1 PRO 18 4.433 -3.808 -15.508 54 HD2 PRO 18 HD2 PRO 18 4.037 -4.035 -12.677 55 HD3 PRO 18 HD1 PRO 18 5.552 -4.231 -13.576 56 H PHE 19 HN PHE 19 3.213 -2.420 -11.758 57 HA PHE 19 HA PHE 19 1.193 -0.308 -11.410 58 HB2 PHE 19 HB2 PHE 19 0.926 -3.114 -10.333 59 HB3 PHE 19 HB1 PHE 19 -0.339 -1.927 -10.603 60 HD1 PHE 19 HD1 PHE 19 0.682 -4.949 -11.658 61 HD2 PHE 19 HD2 PHE 19 -0.169 -1.113 -13.295 62 HE1 PHE 19 HE1 PHE 19 0.201 -5.990 -13.831 63 HE2 PHE 19 HE2 PHE 19 -0.646 -2.148 -15.475 64 HZ PHE 19 HZ PHE 19 -0.461 -4.589 -15.742 65 H CYS 20 HN CYS 20 0.707 0.394 -9.282 66 HA CYS 20 HA CYS 20 2.639 -0.454 -7.262 67 HB2 CYS 20 HB2 CYS 20 3.224 1.741 -8.401 68 HB3 CYS 20 HB1 CYS 20 1.766 2.403 -7.674 69 HN1 NH2 21 H1 CYS 20 0.394 -1.675 -7.118 70 HN2 NH2 21 H2 CYS 20 -0.695 -1.003 -5.959 Start of MODEL 22 1 H1 GLY 11 HT1 GLY 11 -0.332 -3.114 -1.528 2 H2 GLY 11 HT2 GLY 11 -0.549 -3.729 -3.090 3 H3 GLY 11 HT3 GLY 11 -1.656 -2.621 -2.451 4 HA2 GLY 11 HA1 GLY 11 -0.167 -1.573 -4.047 5 HA3 GLY 11 HA2 GLY 11 -0.027 -0.891 -2.433 6 H PHE 12 HN PHE 12 1.956 -0.771 -4.500 7 HA PHE 12 HA PHE 12 4.058 -2.441 -3.285 8 HB2 PHE 12 HB2 PHE 12 3.973 -1.156 -6.034 9 HB3 PHE 12 HB1 PHE 12 5.386 -1.935 -5.353 10 HD1 PHE 12 HD1 PHE 12 1.944 -2.554 -6.581 11 HD2 PHE 12 HD2 PHE 12 5.624 -4.287 -5.304 12 HE1 PHE 12 HE1 PHE 12 1.215 -4.732 -7.440 13 HE2 PHE 12 HE2 PHE 12 4.890 -6.469 -6.163 14 HZ PHE 12 HZ PHE 12 2.686 -6.694 -7.234 15 H ARG 13 HN ARG 13 6.323 -1.199 -3.699 16 HA ARG 13 HA ARG 13 5.930 1.449 -2.461 17 HB2 ARG 13 HB2 ARG 13 8.176 -0.538 -2.011 18 HB3 ARG 13 HB1 ARG 13 8.221 1.121 -1.450 19 HG2 ARG 13 HG2 ARG 13 7.602 -0.199 0.408 20 HG3 ARG 13 HG1 ARG 13 6.131 0.613 -0.124 21 HD2 ARG 13 HD2 ARG 13 5.390 -1.393 -1.248 22 HD3 ARG 13 HD1 ARG 13 6.908 -2.203 -0.863 23 HE ARG 13 HE ARG 13 5.471 -1.282 1.448 24 HH11 ARG 13 HH11 ARG 13 5.824 -3.877 -0.876 25 HH12 ARG 13 HH12 ARG 13 5.158 -5.087 0.166 26 HH21 ARG 13 HH21 ARG 13 4.562 -2.881 2.836 27 HH22 ARG 13 HH22 ARG 13 4.419 -4.513 2.286 28 H SER 14 HN SER 14 6.898 3.177 -3.355 29 HA SER 14 HA SER 14 7.891 2.976 -5.998 30 HB2 SER 14 HB2 SER 14 8.012 5.317 -4.083 31 HB3 SER 14 HB1 SER 14 8.226 5.394 -5.830 32 HG SER 14 HG SER 14 5.959 4.162 -5.492 33 HA PRO 15 HA PRO 15 9.268 3.831 -7.517 34 HB2 PRO 15 HB2 PRO 15 11.347 2.066 -8.601 35 HB3 PRO 15 HB1 PRO 15 11.027 3.765 -8.962 36 HG2 PRO 15 HG2 PRO 15 13.200 2.982 -7.573 37 HG3 PRO 15 HG1 PRO 15 12.379 4.520 -7.255 38 HD2 PRO 15 HD2 PRO 15 12.185 1.927 -5.765 39 HD3 PRO 15 HD1 PRO 15 12.322 3.582 -5.130 40 H CYS 16 HN CYS 16 7.523 2.662 -8.123 41 HA CYS 16 HA CYS 16 7.685 -0.250 -7.915 42 HB2 CYS 16 HB2 CYS 16 5.053 0.153 -7.738 43 HB3 CYS 16 HB1 CYS 16 6.114 0.199 -6.332 44 H ALA 17 HN ALA 17 7.645 -1.176 -10.061 45 HA ALA 17 HA ALA 17 5.860 0.102 -11.974 46 HB1 ALA 17 HB1 ALA 17 7.494 -0.187 -13.756 47 HB2 ALA 17 HB2 ALA 17 8.652 -0.849 -12.603 48 HB3 ALA 17 HB3 ALA 17 8.142 0.834 -12.473 49 HA PRO 18 HA PRO 18 5.016 -0.136 -13.591 50 HB2 PRO 18 HB2 PRO 18 3.014 -1.156 -15.123 51 HB3 PRO 18 HB1 PRO 18 4.706 -1.125 -15.625 52 HG2 PRO 18 HG2 PRO 18 3.059 -3.400 -14.930 53 HG3 PRO 18 HG1 PRO 18 4.653 -3.398 -15.651 54 HD2 PRO 18 HD2 PRO 18 3.897 -3.821 -12.858 55 HD3 PRO 18 HD1 PRO 18 5.459 -4.120 -13.645 56 H PHE 19 HN PHE 19 3.373 -2.447 -11.658 57 HA PHE 19 HA PHE 19 1.067 -0.673 -11.304 58 HB2 PHE 19 HB2 PHE 19 1.317 -3.430 -10.110 59 HB3 PHE 19 HB1 PHE 19 -0.141 -2.494 -10.391 60 HD1 PHE 19 HD1 PHE 19 1.653 -5.229 -11.462 61 HD2 PHE 19 HD2 PHE 19 -0.442 -1.864 -13.008 62 HE1 PHE 19 HE1 PHE 19 1.325 -6.418 -13.588 63 HE2 PHE 19 HE2 PHE 19 -0.772 -3.045 -15.141 64 HZ PHE 19 HZ PHE 19 0.113 -5.326 -15.432 65 H CYS 20 HN CYS 20 0.682 0.299 -9.390 66 HA CYS 20 HA CYS 20 2.463 -0.350 -7.178 67 HB2 CYS 20 HB2 CYS 20 3.159 1.723 -8.530 68 HB3 CYS 20 HB1 CYS 20 1.733 2.490 -7.841 69 HN1 NH2 21 H1 CYS 20 0.624 -1.506 -6.409 70 HN2 NH2 21 H2 CYS 20 -0.708 -0.675 -5.689 Start of MODEL 23 1 H1 GLY 11 HT1 GLY 11 0.043 -1.848 -1.365 2 H2 GLY 11 HT2 GLY 11 -0.352 -2.693 -2.773 3 H3 GLY 11 HT3 GLY 11 -1.188 -1.276 -2.370 4 HA2 GLY 11 HA1 GLY 11 0.422 -0.882 -4.129 5 HA3 GLY 11 HA2 GLY 11 0.778 0.039 -2.676 6 H PHE 12 HN PHE 12 2.662 -0.640 -4.714 7 HA PHE 12 HA PHE 12 4.326 -2.653 -3.365 8 HB2 PHE 12 HB2 PHE 12 4.590 -1.504 -6.165 9 HB3 PHE 12 HB1 PHE 12 5.662 -2.692 -5.451 10 HD1 PHE 12 HD1 PHE 12 2.155 -2.158 -6.549 11 HD2 PHE 12 HD2 PHE 12 5.161 -4.966 -5.483 12 HE1 PHE 12 HE1 PHE 12 0.729 -3.980 -7.362 13 HE2 PHE 12 HE2 PHE 12 3.738 -6.798 -6.294 14 HZ PHE 12 HZ PHE 12 1.517 -6.306 -7.235 15 H ARG 13 HN ARG 13 6.717 -2.170 -3.338 16 HA ARG 13 HA ARG 13 7.146 0.364 -2.103 17 HB2 ARG 13 HB2 ARG 13 9.212 -1.655 -3.019 18 HB3 ARG 13 HB1 ARG 13 9.497 -0.315 -1.931 19 HG2 ARG 13 HG2 ARG 13 7.770 -2.733 -1.405 20 HG3 ARG 13 HG1 ARG 13 9.326 -2.360 -0.667 21 HD2 ARG 13 HD2 ARG 13 6.838 -0.674 -0.370 22 HD3 ARG 13 HD1 ARG 13 7.362 -1.886 0.793 23 HE ARG 13 HE ARG 13 9.521 -0.241 0.551 24 HH11 ARG 13 HH11 ARG 13 6.147 0.244 1.367 25 HH12 ARG 13 HH12 ARG 13 6.456 1.640 2.345 26 HH21 ARG 13 HH21 ARG 13 9.925 1.605 1.839 27 HH22 ARG 13 HH22 ARG 13 8.607 2.406 2.626 28 H SER 14 HN SER 14 8.137 2.163 -2.850 29 HA SER 14 HA SER 14 8.213 2.452 -5.729 30 HB2 SER 14 HB2 SER 14 8.583 4.503 -3.540 31 HB3 SER 14 HB1 SER 14 8.367 4.843 -5.256 32 HG SER 14 HG SER 14 6.346 3.398 -4.791 33 HA PRO 15 HA PRO 15 9.142 3.795 -7.320 34 HB2 PRO 15 HB2 PRO 15 10.571 2.827 -9.418 35 HB3 PRO 15 HB1 PRO 15 10.925 4.376 -8.647 36 HG2 PRO 15 HG2 PRO 15 12.245 1.720 -8.247 37 HG3 PRO 15 HG1 PRO 15 12.986 3.321 -8.412 38 HD2 PRO 15 HD2 PRO 15 12.647 2.125 -6.016 39 HD3 PRO 15 HD1 PRO 15 12.554 3.885 -6.220 40 H CYS 16 HN CYS 16 7.391 2.640 -7.937 41 HA CYS 16 HA CYS 16 7.596 -0.273 -7.896 42 HB2 CYS 16 HB2 CYS 16 4.950 0.194 -7.752 43 HB3 CYS 16 HB1 CYS 16 6.006 0.166 -6.338 44 H ALA 17 HN ALA 17 7.566 -1.204 -10.040 45 HA ALA 17 HA ALA 17 5.857 0.105 -11.999 46 HB1 ALA 17 HB1 ALA 17 8.148 0.825 -12.425 47 HB2 ALA 17 HB2 ALA 17 7.563 -0.220 -13.719 48 HB3 ALA 17 HB3 ALA 17 8.667 -0.859 -12.504 49 HA PRO 18 HA PRO 18 4.995 -0.120 -13.619 50 HB2 PRO 18 HB2 PRO 18 2.941 -1.258 -15.104 51 HB3 PRO 18 HB1 PRO 18 4.589 -1.007 -15.681 52 HG2 PRO 18 HG2 PRO 18 3.290 -3.493 -15.202 53 HG3 PRO 18 HG1 PRO 18 4.957 -3.251 -15.677 54 HD2 PRO 18 HD2 PRO 18 3.832 -3.772 -12.985 55 HD3 PRO 18 HD1 PRO 18 5.454 -4.128 -13.618 56 H PHE 19 HN PHE 19 3.512 -2.381 -11.608 57 HA PHE 19 HA PHE 19 1.075 -0.773 -11.282 58 HB2 PHE 19 HB2 PHE 19 1.552 -3.454 -9.996 59 HB3 PHE 19 HB1 PHE 19 0.022 -2.664 -10.346 60 HD1 PHE 19 HD1 PHE 19 2.132 -5.235 -11.289 61 HD2 PHE 19 HD2 PHE 19 -0.321 -2.189 -12.968 62 HE1 PHE 19 HE1 PHE 19 1.982 -6.518 -13.379 63 HE2 PHE 19 HE2 PHE 19 -0.474 -3.467 -15.065 64 HZ PHE 19 HZ PHE 19 0.678 -5.635 -15.271 65 H CYS 20 HN CYS 20 0.720 0.288 -9.401 66 HA CYS 20 HA CYS 20 2.533 -0.271 -7.184 67 HB2 CYS 20 HB2 CYS 20 3.158 1.809 -8.548 68 HB3 CYS 20 HB1 CYS 20 1.698 2.533 -7.879 69 HN1 NH2 21 H1 CYS 20 0.612 -1.515 -6.580 70 HN2 NH2 21 H2 CYS 20 -0.673 -0.703 -5.765 Start of MODEL 24 1 H1 GLY 11 HT1 GLY 11 0.322 0.135 -0.854 2 H2 GLY 11 HT2 GLY 11 -0.221 -1.465 -0.916 3 H3 GLY 11 HT3 GLY 11 -1.201 -0.214 -1.495 4 HA2 GLY 11 HA1 GLY 11 -0.184 -1.429 -3.309 5 HA3 GLY 11 HA2 GLY 11 0.343 0.248 -3.258 6 H PHE 12 HN PHE 12 1.960 -1.141 -4.651 7 HA PHE 12 HA PHE 12 3.951 -2.585 -3.198 8 HB2 PHE 12 HB2 PHE 12 4.103 -1.399 -5.993 9 HB3 PHE 12 HB1 PHE 12 5.283 -2.478 -5.284 10 HD1 PHE 12 HD1 PHE 12 1.848 -2.283 -6.635 11 HD2 PHE 12 HD2 PHE 12 4.901 -4.824 -5.072 12 HE1 PHE 12 HE1 PHE 12 0.630 -4.248 -7.445 13 HE2 PHE 12 HE2 PHE 12 3.673 -6.790 -5.883 14 HZ PHE 12 HZ PHE 12 1.538 -6.503 -7.071 15 H ARG 13 HN ARG 13 6.295 -1.919 -3.328 16 HA ARG 13 HA ARG 13 6.540 0.658 -2.053 17 HB2 ARG 13 HB2 ARG 13 8.688 -1.374 -2.703 18 HB3 ARG 13 HB1 ARG 13 8.858 0.017 -1.652 19 HG2 ARG 13 HG2 ARG 13 7.278 -0.905 -0.091 20 HG3 ARG 13 HG1 ARG 13 6.983 -2.278 -1.157 21 HD2 ARG 13 HD2 ARG 13 9.327 -2.941 -0.936 22 HD3 ARG 13 HD1 ARG 13 9.608 -1.569 0.134 23 HE ARG 13 HE ARG 13 7.498 -3.302 1.008 24 HH11 ARG 13 HH11 ARG 13 10.963 -2.740 1.082 25 HH12 ARG 13 HH12 ARG 13 11.208 -3.634 2.540 26 HH21 ARG 13 HH21 ARG 13 7.821 -4.498 2.932 27 HH22 ARG 13 HH22 ARG 13 9.407 -4.634 3.603 28 H SER 14 HN SER 14 7.418 2.463 -2.886 29 HA SER 14 HA SER 14 7.900 2.542 -5.730 30 HB2 SER 14 HB2 SER 14 8.042 4.746 -3.660 31 HB3 SER 14 HB1 SER 14 8.040 4.964 -5.411 32 HG SER 14 HG SER 14 5.950 3.623 -5.154 33 HA PRO 15 HA PRO 15 9.062 3.822 -7.295 34 HB2 PRO 15 HB2 PRO 15 11.105 2.282 -8.752 35 HB3 PRO 15 HB1 PRO 15 10.635 3.973 -8.942 36 HG2 PRO 15 HG2 PRO 15 12.989 3.290 -7.856 37 HG3 PRO 15 HG1 PRO 15 12.076 4.699 -7.286 38 HD2 PRO 15 HD2 PRO 15 12.275 1.959 -6.087 39 HD3 PRO 15 HD1 PRO 15 12.344 3.545 -5.286 40 H CYS 16 HN CYS 16 7.368 2.672 -8.065 41 HA CYS 16 HA CYS 16 7.516 -0.245 -7.885 42 HB2 CYS 16 HB2 CYS 16 4.876 0.228 -7.822 43 HB3 CYS 16 HB1 CYS 16 5.884 0.235 -6.375 44 H ALA 17 HN ALA 17 7.574 -1.182 -10.036 45 HA ALA 17 HA ALA 17 5.840 0.054 -12.025 46 HB1 ALA 17 HB1 ALA 17 7.536 -0.324 -13.743 47 HB2 ALA 17 HB2 ALA 17 8.643 -0.951 -12.522 48 HB3 ALA 17 HB3 ALA 17 8.150 0.741 -12.478 49 HA PRO 18 HA PRO 18 5.065 -0.250 -13.710 50 HB2 PRO 18 HB2 PRO 18 3.055 -1.424 -15.211 51 HB3 PRO 18 HB1 PRO 18 4.733 -1.261 -15.727 52 HG2 PRO 18 HG2 PRO 18 3.324 -3.668 -15.131 53 HG3 PRO 18 HG1 PRO 18 5.004 -3.509 -15.584 54 HD2 PRO 18 HD2 PRO 18 3.823 -3.841 -12.891 55 HD3 PRO 18 HD1 PRO 18 5.452 -4.253 -13.466 56 H PHE 19 HN PHE 19 3.569 -2.235 -11.511 57 HA PHE 19 HA PHE 19 1.181 -0.518 -11.338 58 HB2 PHE 19 HB2 PHE 19 1.399 -3.230 -10.039 59 HB3 PHE 19 HB1 PHE 19 -0.050 -2.312 -10.423 60 HD1 PHE 19 HD1 PHE 19 1.782 -5.088 -11.286 61 HD2 PHE 19 HD2 PHE 19 -0.228 -1.796 -13.080 62 HE1 PHE 19 HE1 PHE 19 1.567 -6.365 -13.371 63 HE2 PHE 19 HE2 PHE 19 -0.448 -3.067 -15.176 64 HZ PHE 19 HZ PHE 19 0.451 -5.358 -15.322 65 H CYS 20 HN CYS 20 0.631 0.263 -9.290 66 HA CYS 20 HA CYS 20 2.608 -0.228 -7.200 67 HB2 CYS 20 HB2 CYS 20 2.879 2.001 -8.486 68 HB3 CYS 20 HB1 CYS 20 1.445 2.505 -7.600 69 HN1 NH2 21 H1 CYS 20 -0.327 1.749 -7.510 70 HN2 NH2 21 H2 CYS 20 -1.172 0.986 -6.212 Start of MODEL 25 1 H1 GLY 11 HT1 GLY 11 0.040 1.257 -1.262 2 H2 GLY 11 HT2 GLY 11 -0.346 -0.087 -2.207 3 H3 GLY 11 HT3 GLY 11 -1.022 1.421 -2.567 4 HA2 GLY 11 HA1 GLY 11 0.739 0.867 -4.107 5 HA3 GLY 11 HA2 GLY 11 1.115 2.301 -3.158 6 H PHE 12 HN PHE 12 2.808 0.157 -4.507 7 HA PHE 12 HA PHE 12 4.145 -1.017 -2.205 8 HB2 PHE 12 HB2 PHE 12 4.752 -1.302 -5.169 9 HB3 PHE 12 HB1 PHE 12 5.645 -2.087 -3.884 10 HD1 PHE 12 HD1 PHE 12 2.396 -2.017 -5.645 11 HD2 PHE 12 HD2 PHE 12 4.792 -3.976 -2.710 12 HE1 PHE 12 HE1 PHE 12 0.843 -3.912 -5.636 13 HE2 PHE 12 HE2 PHE 12 3.229 -5.871 -2.705 14 HZ PHE 12 HZ PHE 12 1.254 -5.842 -4.169 15 H ARG 13 HN ARG 13 6.652 -0.964 -2.345 16 HA ARG 13 HA ARG 13 7.475 1.658 -1.801 17 HB2 ARG 13 HB2 ARG 13 8.648 -0.223 -0.841 18 HB3 ARG 13 HB1 ARG 13 9.114 -0.798 -2.434 19 HG2 ARG 13 HG2 ARG 13 10.525 1.161 -2.732 20 HG3 ARG 13 HG1 ARG 13 10.021 1.766 -1.152 21 HD2 ARG 13 HD2 ARG 13 12.072 0.734 -0.730 22 HD3 ARG 13 HD1 ARG 13 10.854 -0.448 -0.242 23 HE ARG 13 HE ARG 13 11.488 -1.045 -2.871 24 HH11 ARG 13 HH11 ARG 13 13.198 -0.900 0.189 25 HH12 ARG 13 HH12 ARG 13 14.331 -2.133 -0.242 26 HH21 ARG 13 HH21 ARG 13 12.974 -2.693 -3.437 27 HH22 ARG 13 HH22 ARG 13 14.198 -3.162 -2.308 28 H SER 14 HN SER 14 7.865 3.282 -3.103 29 HA SER 14 HA SER 14 8.063 2.909 -5.940 30 HB2 SER 14 HB2 SER 14 8.330 5.466 -4.344 31 HB3 SER 14 HB1 SER 14 7.921 5.313 -6.054 32 HG SER 14 HG SER 14 5.988 4.246 -5.417 33 HA PRO 15 HA PRO 15 8.885 4.140 -7.719 34 HB2 PRO 15 HB2 PRO 15 10.400 3.070 -9.709 35 HB3 PRO 15 HB1 PRO 15 10.587 4.731 -9.139 36 HG2 PRO 15 HG2 PRO 15 12.205 2.309 -8.479 37 HG3 PRO 15 HG1 PRO 15 12.743 3.968 -8.788 38 HD2 PRO 15 HD2 PRO 15 12.512 2.921 -6.288 39 HD3 PRO 15 HD1 PRO 15 12.302 4.646 -6.640 40 H CYS 16 HN CYS 16 7.262 2.759 -8.151 41 HA CYS 16 HA CYS 16 7.784 -0.104 -7.937 42 HB2 CYS 16 HB2 CYS 16 5.123 0.070 -7.562 43 HB3 CYS 16 HB1 CYS 16 6.292 0.217 -6.250 44 H ALA 17 HN ALA 17 7.631 -1.156 -10.025 45 HA ALA 17 HA ALA 17 5.733 -0.009 -11.922 46 HB1 ALA 17 HB1 ALA 17 7.347 -0.354 -13.723 47 HB2 ALA 17 HB2 ALA 17 8.538 -0.925 -12.554 48 HB3 ALA 17 HB3 ALA 17 7.986 0.748 -12.503 49 HA PRO 18 HA PRO 18 5.157 -0.378 -13.807 50 HB2 PRO 18 HB2 PRO 18 2.921 -1.672 -15.010 51 HB3 PRO 18 HB1 PRO 18 4.491 -1.352 -15.746 52 HG2 PRO 18 HG2 PRO 18 3.484 -3.874 -15.152 53 HG3 PRO 18 HG1 PRO 18 5.165 -3.503 -15.465 54 HD2 PRO 18 HD2 PRO 18 3.777 -3.881 -12.849 55 HD3 PRO 18 HD1 PRO 18 5.429 -4.334 -13.326 56 H PHE 19 HN PHE 19 3.309 -2.324 -11.683 57 HA PHE 19 HA PHE 19 1.266 -0.227 -11.401 58 HB2 PHE 19 HB2 PHE 19 0.939 -3.000 -10.299 59 HB3 PHE 19 HB1 PHE 19 -0.299 -1.853 -10.800 60 HD1 PHE 19 HD1 PHE 19 1.089 -4.866 -11.590 61 HD2 PHE 19 HD2 PHE 19 0.047 -1.182 -13.445 62 HE1 PHE 19 HE1 PHE 19 0.979 -5.999 -13.766 63 HE2 PHE 19 HE2 PHE 19 -0.064 -2.308 -15.627 64 HZ PHE 19 HZ PHE 19 0.402 -4.722 -15.790 65 H CYS 20 HN CYS 20 0.683 0.367 -9.251 66 HA CYS 20 HA CYS 20 2.618 -0.441 -7.224 67 HB2 CYS 20 HB2 CYS 20 3.071 1.822 -8.347 68 HB3 CYS 20 HB1 CYS 20 1.635 2.385 -7.499 69 HN1 NH2 21 H1 CYS 20 0.737 -1.829 -6.714 70 HN2 NH2 21 H2 CYS 20 -0.518 -1.175 -5.721 Start of MODEL 26 1 H1 GLY 11 HT1 GLY 11 -0.480 -2.519 -1.497 2 H2 GLY 11 HT2 GLY 11 -0.479 -3.137 -3.067 3 H3 GLY 11 HT3 GLY 11 -1.711 -2.090 -2.573 4 HA2 GLY 11 HA1 GLY 11 -0.136 -0.936 -3.968 5 HA3 GLY 11 HA2 GLY 11 -0.137 -0.292 -2.332 6 H PHE 12 HN PHE 12 1.975 -0.336 -4.468 7 HA PHE 12 HA PHE 12 3.978 -1.941 -3.036 8 HB2 PHE 12 HB2 PHE 12 4.005 -0.905 -5.882 9 HB3 PHE 12 HB1 PHE 12 5.386 -1.647 -5.098 10 HD1 PHE 12 HD1 PHE 12 1.847 -2.326 -6.057 11 HD2 PHE 12 HD2 PHE 12 5.670 -3.941 -5.098 12 HE1 PHE 12 HE1 PHE 12 1.072 -4.558 -6.724 13 HE2 PHE 12 HE2 PHE 12 4.895 -6.173 -5.764 14 HZ PHE 12 HZ PHE 12 2.594 -6.485 -6.580 15 H ARG 13 HN ARG 13 6.226 -1.002 -3.110 16 HA ARG 13 HA ARG 13 6.088 1.775 -2.183 17 HB2 ARG 13 HB2 ARG 13 7.094 0.273 -0.581 18 HB3 ARG 13 HB1 ARG 13 8.186 -0.385 -1.789 19 HG2 ARG 13 HG2 ARG 13 9.283 1.819 -1.942 20 HG3 ARG 13 HG1 ARG 13 8.239 2.389 -0.637 21 HD2 ARG 13 HD2 ARG 13 9.154 0.800 0.884 22 HD3 ARG 13 HD1 ARG 13 10.025 -0.017 -0.412 23 HE ARG 13 HE ARG 13 11.137 2.371 -0.569 24 HH11 ARG 13 HH11 ARG 13 10.341 0.560 2.336 25 HH12 ARG 13 HH12 ARG 13 11.666 1.191 3.246 26 HH21 ARG 13 HH21 ARG 13 12.887 3.202 0.627 27 HH22 ARG 13 HH22 ARG 13 13.132 2.709 2.270 28 H SER 14 HN SER 14 7.154 3.406 -3.178 29 HA SER 14 HA SER 14 8.060 3.005 -5.843 30 HB2 SER 14 HB2 SER 14 8.267 5.437 -4.054 31 HB3 SER 14 HB1 SER 14 8.554 5.420 -5.794 32 HG SER 14 HG SER 14 6.121 4.411 -4.834 33 HA PRO 15 HA PRO 15 9.407 3.797 -7.360 34 HB2 PRO 15 HB2 PRO 15 11.119 2.416 -8.923 35 HB3 PRO 15 HB1 PRO 15 11.490 4.034 -8.316 36 HG2 PRO 15 HG2 PRO 15 12.391 1.374 -7.288 37 HG3 PRO 15 HG1 PRO 15 13.324 2.865 -7.502 38 HD2 PRO 15 HD2 PRO 15 12.340 2.060 -5.098 39 HD3 PRO 15 HD1 PRO 15 12.573 3.767 -5.527 40 H CYS 16 HN CYS 16 7.749 2.626 -8.201 41 HA CYS 16 HA CYS 16 7.874 -0.285 -7.952 42 HB2 CYS 16 HB2 CYS 16 5.279 0.028 -7.601 43 HB3 CYS 16 HB1 CYS 16 6.403 0.170 -6.253 44 H ALA 17 HN ALA 17 7.737 -1.128 -10.124 45 HA ALA 17 HA ALA 17 5.852 0.187 -11.900 46 HB1 ALA 17 HB1 ALA 17 8.125 0.962 -12.445 47 HB2 ALA 17 HB2 ALA 17 7.407 0.024 -13.753 48 HB3 ALA 17 HB3 ALA 17 8.617 -0.711 -12.703 49 HA PRO 18 HA PRO 18 4.907 -0.022 -13.465 50 HB2 PRO 18 HB2 PRO 18 2.892 -1.050 -14.976 51 HB3 PRO 18 HB1 PRO 18 4.564 -0.938 -15.530 52 HG2 PRO 18 HG2 PRO 18 3.017 -3.293 -14.862 53 HG3 PRO 18 HG1 PRO 18 4.574 -3.210 -15.659 54 HD2 PRO 18 HD2 PRO 18 3.976 -3.796 -12.859 55 HD3 PRO 18 HD1 PRO 18 5.513 -3.970 -13.728 56 H PHE 19 HN PHE 19 3.186 -2.599 -11.832 57 HA PHE 19 HA PHE 19 0.869 -0.917 -11.288 58 HB2 PHE 19 HB2 PHE 19 1.324 -3.664 -10.135 59 HB3 PHE 19 HB1 PHE 19 -0.198 -2.835 -10.418 60 HD1 PHE 19 HD1 PHE 19 1.864 -5.386 -11.524 61 HD2 PHE 19 HD2 PHE 19 -0.604 -2.250 -13.005 62 HE1 PHE 19 HE1 PHE 19 1.628 -6.588 -13.654 63 HE2 PHE 19 HE2 PHE 19 -0.841 -3.444 -15.144 64 HZ PHE 19 HZ PHE 19 0.275 -5.617 -15.469 65 H CYS 20 HN CYS 20 0.800 0.340 -9.547 66 HA CYS 20 HA CYS 20 2.318 -0.465 -7.196 67 HB2 CYS 20 HB2 CYS 20 3.475 1.331 -8.562 68 HB3 CYS 20 HB1 CYS 20 2.125 2.383 -8.159 69 HN1 NH2 21 H1 CYS 20 0.233 -1.246 -6.520 70 HN2 NH2 21 H2 CYS 20 -0.948 -0.143 -5.906 Start of MODEL 27 1 H1 GLY 11 HT1 GLY 11 -0.645 3.832 -1.771 2 H2 GLY 11 HT2 GLY 11 -1.483 2.434 -2.210 3 H3 GLY 11 HT3 GLY 11 -1.682 3.858 -3.106 4 HA2 GLY 11 HA1 GLY 11 -0.264 2.292 -4.262 5 HA3 GLY 11 HA2 GLY 11 0.584 3.776 -3.842 6 H PHE 12 HN PHE 12 2.106 1.673 -4.393 7 HA PHE 12 HA PHE 12 2.860 0.603 -1.758 8 HB2 PHE 12 HB2 PHE 12 3.325 -0.513 -4.526 9 HB3 PHE 12 HB1 PHE 12 4.259 -1.039 -3.138 10 HD1 PHE 12 HD1 PHE 12 0.728 -0.680 -4.278 11 HD2 PHE 12 HD2 PHE 12 3.496 -2.747 -1.795 12 HE1 PHE 12 HE1 PHE 12 -1.022 -2.287 -3.667 13 HE2 PHE 12 HE2 PHE 12 1.748 -4.357 -1.181 14 HZ PHE 12 HZ PHE 12 -0.516 -4.131 -2.118 15 H ARG 13 HN ARG 13 5.362 -0.042 -1.902 16 HA ARG 13 HA ARG 13 6.723 2.387 -1.538 17 HB2 ARG 13 HB2 ARG 13 7.385 0.254 -0.424 18 HB3 ARG 13 HB1 ARG 13 7.972 -0.342 -1.972 19 HG2 ARG 13 HG2 ARG 13 9.801 0.423 -0.632 20 HG3 ARG 13 HG1 ARG 13 9.600 1.493 -2.022 21 HD2 ARG 13 HD2 ARG 13 8.514 3.144 -0.674 22 HD3 ARG 13 HD1 ARG 13 8.462 2.052 0.706 23 HE ARG 13 HE ARG 13 11.133 2.463 -0.130 24 HH11 ARG 13 HH11 ARG 13 8.491 4.053 1.544 25 HH12 ARG 13 HH12 ARG 13 9.528 5.060 2.490 26 HH21 ARG 13 HH21 ARG 13 12.509 3.795 1.151 27 HH22 ARG 13 HH22 ARG 13 11.813 4.916 2.272 28 H SER 14 HN SER 14 7.387 3.758 -2.991 29 HA SER 14 HA SER 14 7.831 2.945 -5.730 30 HB2 SER 14 HB2 SER 14 8.086 5.676 -4.447 31 HB3 SER 14 HB1 SER 14 8.006 5.334 -6.176 32 HG SER 14 HG SER 14 5.910 4.179 -5.052 33 HA PRO 15 HA PRO 15 9.025 3.993 -7.496 34 HB2 PRO 15 HB2 PRO 15 10.719 2.661 -9.145 35 HB3 PRO 15 HB1 PRO 15 10.993 4.331 -8.640 36 HG2 PRO 15 HG2 PRO 15 12.188 1.808 -7.568 37 HG3 PRO 15 HG1 PRO 15 12.978 3.356 -7.925 38 HD2 PRO 15 HD2 PRO 15 12.268 2.621 -5.417 39 HD3 PRO 15 HD1 PRO 15 12.272 4.312 -5.955 40 H CYS 16 HN CYS 16 7.465 2.695 -8.324 41 HA CYS 16 HA CYS 16 7.689 -0.191 -7.902 42 HB2 CYS 16 HB2 CYS 16 5.057 0.120 -7.634 43 HB3 CYS 16 HB1 CYS 16 6.156 0.299 -6.268 44 H ALA 17 HN ALA 17 7.595 -1.179 -10.029 45 HA ALA 17 HA ALA 17 5.758 0.035 -11.939 46 HB1 ALA 17 HB1 ALA 17 8.569 -0.861 -12.556 47 HB2 ALA 17 HB2 ALA 17 8.004 0.809 -12.487 48 HB3 ALA 17 HB3 ALA 17 7.387 -0.280 -13.728 49 HA PRO 18 HA PRO 18 5.092 -0.270 -13.728 50 HB2 PRO 18 HB2 PRO 18 3.013 -1.481 -15.159 51 HB3 PRO 18 HB1 PRO 18 4.663 -1.245 -15.738 52 HG2 PRO 18 HG2 PRO 18 3.398 -3.715 -15.171 53 HG3 PRO 18 HG1 PRO 18 5.081 -3.470 -15.572 54 HD2 PRO 18 HD2 PRO 18 3.819 -3.854 -12.916 55 HD3 PRO 18 HD1 PRO 18 5.464 -4.257 -13.452 56 H PHE 19 HN PHE 19 3.477 -2.292 -11.570 57 HA PHE 19 HA PHE 19 1.211 -0.423 -11.358 58 HB2 PHE 19 HB2 PHE 19 1.207 -3.212 -10.221 59 HB3 PHE 19 HB1 PHE 19 -0.166 -2.177 -10.591 60 HD1 PHE 19 HD1 PHE 19 1.322 -5.068 -11.538 61 HD2 PHE 19 HD2 PHE 19 -0.018 -1.416 -13.265 62 HE1 PHE 19 HE1 PHE 19 1.111 -6.183 -13.717 63 HE2 PHE 19 HE2 PHE 19 -0.229 -2.525 -15.452 64 HZ PHE 19 HZ PHE 19 0.337 -4.911 -15.679 65 H CYS 20 HN CYS 20 0.688 0.351 -9.293 66 HA CYS 20 HA CYS 20 2.572 -0.338 -7.178 67 HB2 CYS 20 HB2 CYS 20 2.969 1.892 -8.450 68 HB3 CYS 20 HB1 CYS 20 1.548 2.456 -7.580 69 HN1 NH2 21 H1 CYS 20 0.475 -1.708 -6.974 70 HN2 NH2 21 H2 CYS 20 -0.744 -1.041 -5.945
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