NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
624125 | 6f3v | 34206 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 ARG 1 H ARG 1 1.807 0.001 0.855 2 HA ARG 1 HA ARG 1 2.301 1.026 -1.503 3 HB2 ARG 1 2HB ARG 1 3.211 -1.724 -0.649 4 HB3 ARG 1 3HB ARG 1 3.897 -0.851 -2.012 5 HG2 ARG 1 2HG ARG 1 4.256 1.030 -0.218 6 HG3 ARG 1 3HG ARG 1 4.159 -0.329 0.903 7 HD2 ARG 1 2HD ARG 1 5.849 -0.976 -1.336 8 HD3 ARG 1 3HD ARG 1 6.386 0.516 -0.567 9 HE ARG 1 HE ARG 1 6.514 -2.140 0.523 10 HH11 ARG 1 1HH1 ARG 1 6.409 1.259 1.267 11 HH12 ARG 1 2HH1 ARG 1 7.171 1.078 2.812 12 HH21 ARG 1 1HH2 ARG 1 7.518 -2.392 2.556 13 HH22 ARG 1 2HH2 ARG 1 7.803 -0.999 3.544 14 HA PRO 2 HA PRO 2 -1.001 -1.394 -3.712 15 HB2 PRO 2 2HB PRO 2 -2.067 0.758 -4.977 16 HB3 PRO 2 3HB PRO 2 -2.564 0.252 -3.358 17 HG2 PRO 2 2HG PRO 2 -0.660 2.416 -4.164 18 HG3 PRO 2 3HG PRO 2 -1.921 2.443 -2.917 19 HD2 PRO 2 2HD PRO 2 0.697 2.072 -2.334 20 HD3 PRO 2 3HD PRO 2 -0.607 1.328 -1.387 21 HA PRO 3 HA PRO 3 1.068 -1.619 -7.585 22 HB2 PRO 3 2HB PRO 3 -0.974 -1.970 -9.339 23 HB3 PRO 3 3HB PRO 3 -0.453 -3.224 -8.208 24 HG2 PRO 3 2HG PRO 3 -2.750 -1.316 -7.994 25 HG3 PRO 3 3HG PRO 3 -2.694 -3.047 -7.613 26 HD2 PRO 3 2HD PRO 3 -2.541 -1.131 -5.706 27 HD3 PRO 3 3HD PRO 3 -1.710 -2.692 -5.559 28 H GLY 4 H GLY 4 -1.594 0.683 -7.389 29 HA2 GLY 4 2HA GLY 4 -1.063 2.082 -9.783 30 HA3 GLY 4 3HA GLY 4 -1.942 2.715 -8.399 31 H PHE 5 H PHE 5 0.538 2.091 -6.732 32 HA PHE 5 HA PHE 5 1.849 4.642 -7.277 33 HB2 PHE 5 2HB PHE 5 1.391 2.979 -4.900 34 HB3 PHE 5 3HB PHE 5 3.004 3.680 -4.983 35 HD1 PHE 5 HD1 PHE 5 3.367 5.962 -4.541 36 HD2 PHE 5 HD2 PHE 5 -0.601 4.483 -4.975 37 HE1 PHE 5 HE1 PHE 5 2.482 8.099 -3.703 38 HE2 PHE 5 HE2 PHE 5 -1.492 6.619 -4.139 39 HZ PHE 5 HZ PHE 5 0.050 8.431 -3.503 40 H SER 6 H SER 6 2.470 1.214 -7.275 41 HA SER 6 HA SER 6 5.248 1.171 -7.225 42 HB2 SER 6 2HB SER 6 3.114 -0.644 -8.043 43 HB3 SER 6 3HB SER 6 4.578 -0.848 -9.005 44 HG SER 6 HG SER 6 4.123 -1.762 -6.590 45 HA PRO 7 HA PRO 7 6.680 2.828 -11.025 46 HB2 PRO 7 2HB PRO 7 8.713 1.145 -11.664 47 HB3 PRO 7 3HB PRO 7 8.810 2.309 -10.337 48 HG2 PRO 7 2HG PRO 7 8.207 -0.622 -10.246 49 HG3 PRO 7 3HG PRO 7 9.251 0.339 -9.183 50 HD2 PRO 7 2HD PRO 7 6.738 -0.390 -8.487 51 HD3 PRO 7 3HD PRO 7 7.475 1.133 -7.948 52 H PHE 8 H PHE 8 5.614 -0.471 -10.935 53 HA PHE 8 HA PHE 8 5.754 -0.915 -13.765 54 HB2 PHE 8 2HB PHE 8 4.905 -2.425 -11.392 55 HB3 PHE 8 3HB PHE 8 3.958 -2.766 -12.836 56 HD1 PHE 8 HD1 PHE 8 5.355 -3.231 -15.001 57 HD2 PHE 8 HD2 PHE 8 6.855 -3.588 -11.034 58 HE1 PHE 8 HE1 PHE 8 7.128 -4.733 -15.810 59 HE2 PHE 8 HE2 PHE 8 8.632 -5.089 -11.837 60 HZ PHE 8 HZ PHE 8 8.770 -5.663 -14.228 61 H ARG 9 H ARG 9 3.497 0.521 -11.591 62 HA ARG 9 HA ARG 9 1.735 1.134 -13.830 63 HB2 ARG 9 2HB ARG 9 1.071 -0.730 -11.696 64 HB3 ARG 9 3HB ARG 9 -0.068 0.607 -11.781 65 HG2 ARG 9 2HG ARG 9 -1.091 -0.735 -13.267 66 HG3 ARG 9 3HG ARG 9 0.078 -0.027 -14.384 67 HD2 ARG 9 2HD ARG 9 1.544 -2.054 -13.399 68 HD3 ARG 9 3HD ARG 9 -0.069 -2.751 -13.255 69 HE ARG 9 HE ARG 9 0.113 -1.701 -15.808 70 HH11 ARG 9 1HH1 ARG 9 1.714 -4.146 -13.917 71 HH12 ARG 9 2HH1 ARG 9 2.108 -5.132 -15.287 72 HH21 ARG 9 1HH2 ARG 9 0.626 -2.990 -17.619 73 HH22 ARG 9 2HH2 ARG 9 1.490 -4.473 -17.392 Start of MODEL 2 1 H1 ARG 1 H ARG 1 0.970 -0.901 0.812 2 HA ARG 1 HA ARG 1 1.831 0.319 -1.413 3 HB2 ARG 1 2HB ARG 1 2.611 -2.393 -0.358 4 HB3 ARG 1 3HB ARG 1 3.450 -1.641 -1.708 5 HG2 ARG 1 2HG ARG 1 3.128 -0.262 0.937 6 HG3 ARG 1 3HG ARG 1 4.469 -1.357 0.597 7 HD2 ARG 1 2HD ARG 1 5.165 0.027 -1.267 8 HD3 ARG 1 3HD ARG 1 3.776 1.086 -1.029 9 HE ARG 1 HE ARG 1 5.077 1.148 1.362 10 HH11 ARG 1 1HH1 ARG 1 5.998 1.758 -1.940 11 HH12 ARG 1 2HH1 ARG 1 7.206 2.929 -1.523 12 HH21 ARG 1 1HH2 ARG 1 6.664 2.687 1.923 13 HH22 ARG 1 2HH2 ARG 1 7.584 3.456 0.674 14 HA PRO 2 HA PRO 2 -1.064 -2.130 -4.125 15 HB2 PRO 2 2HB PRO 2 -2.035 0.025 -5.460 16 HB3 PRO 2 3HB PRO 2 -2.731 -0.560 -3.943 17 HG2 PRO 2 2HG PRO 2 -0.828 1.704 -4.405 18 HG3 PRO 2 3HG PRO 2 -2.250 1.636 -3.348 19 HD2 PRO 2 2HD PRO 2 0.275 1.345 -2.414 20 HD3 PRO 2 3HD PRO 2 -1.115 0.517 -1.684 21 HA PRO 3 HA PRO 3 1.532 -2.133 -7.674 22 HB2 PRO 3 2HB PRO 3 -0.229 -2.496 -9.708 23 HB3 PRO 3 3HB PRO 3 0.182 -3.771 -8.555 24 HG2 PRO 3 2HG PRO 3 -2.202 -1.961 -8.606 25 HG3 PRO 3 3HG PRO 3 -2.125 -3.702 -8.276 26 HD2 PRO 3 2HD PRO 3 -2.322 -1.852 -6.308 27 HD3 PRO 3 3HD PRO 3 -1.452 -3.385 -6.094 28 H GLY 4 H GLY 4 -1.262 0.025 -7.847 29 HA2 GLY 4 2HA GLY 4 -0.437 1.540 -10.073 30 HA3 GLY 4 3HA GLY 4 -1.547 2.082 -8.823 31 H PHE 5 H PHE 5 0.717 1.485 -6.837 32 HA PHE 5 HA PHE 5 1.950 4.123 -7.091 33 HB2 PHE 5 2HB PHE 5 0.956 2.622 -4.910 34 HB3 PHE 5 3HB PHE 5 2.697 2.751 -4.679 35 HD1 PHE 5 HD1 PHE 5 3.586 5.247 -5.291 36 HD2 PHE 5 HD2 PHE 5 -0.297 4.226 -3.876 37 HE1 PHE 5 HE1 PHE 5 3.302 7.534 -4.429 38 HE2 PHE 5 HE2 PHE 5 -0.587 6.511 -3.012 39 HZ PHE 5 HZ PHE 5 1.214 8.169 -3.289 40 H SER 6 H SER 6 2.718 0.745 -7.216 41 HA SER 6 HA SER 6 5.473 0.835 -6.724 42 HB2 SER 6 2HB SER 6 5.411 -1.370 -7.221 43 HB3 SER 6 3HB SER 6 3.666 -1.142 -7.326 44 HG SER 6 HG SER 6 3.958 -1.836 -9.293 45 HA PRO 7 HA PRO 7 7.314 2.659 -10.262 46 HB2 PRO 7 2HB PRO 7 9.502 1.100 -10.649 47 HB3 PRO 7 3HB PRO 7 9.356 2.233 -9.300 48 HG2 PRO 7 2HG PRO 7 8.907 -0.726 -9.346 49 HG3 PRO 7 3HG PRO 7 9.743 0.259 -8.132 50 HD2 PRO 7 2HD PRO 7 7.202 -0.615 -7.799 51 HD3 PRO 7 3HD PRO 7 7.775 0.930 -7.137 52 H PHE 8 H PHE 8 6.415 -0.686 -10.379 53 HA PHE 8 HA PHE 8 6.945 -1.021 -13.187 54 HB2 PHE 8 2HB PHE 8 6.250 -2.708 -10.984 55 HB3 PHE 8 3HB PHE 8 5.089 -2.970 -12.280 56 HD1 PHE 8 HD1 PHE 8 6.260 -3.119 -14.695 57 HD2 PHE 8 HD2 PHE 8 8.101 -4.049 -10.972 58 HE1 PHE 8 HE1 PHE 8 7.884 -4.554 -15.860 59 HE2 PHE 8 HE2 PHE 8 9.728 -5.485 -12.131 60 HZ PHE 8 HZ PHE 8 9.621 -5.738 -14.578 61 H ARG 9 H ARG 9 4.344 0.144 -11.247 62 HA ARG 9 HA ARG 9 2.860 0.902 -13.593 63 HB2 ARG 9 2HB ARG 9 2.237 -1.567 -12.526 64 HB3 ARG 9 3HB ARG 9 1.060 -0.503 -11.768 65 HG2 ARG 9 2HG ARG 9 1.069 0.240 -14.450 66 HG3 ARG 9 3HG ARG 9 1.152 -1.523 -14.458 67 HD2 ARG 9 2HD ARG 9 -0.791 -1.607 -12.960 68 HD3 ARG 9 3HD ARG 9 -0.880 0.153 -12.989 69 HE ARG 9 HE ARG 9 -1.018 -0.496 -15.603 70 HH11 ARG 9 1HH1 ARG 9 -2.754 -1.591 -12.791 71 HH12 ARG 9 2HH1 ARG 9 -4.213 -1.929 -13.662 72 HH21 ARG 9 1HH2 ARG 9 -2.933 -0.938 -16.762 73 HH22 ARG 9 2HH2 ARG 9 -4.313 -1.559 -15.921 Start of MODEL 3 1 H1 ARG 1 H ARG 1 1.122 0.131 0.976 2 HA ARG 1 HA ARG 1 1.804 1.358 -1.529 3 HB2 ARG 1 2HB ARG 1 3.045 -0.832 0.124 4 HB3 ARG 1 3HB ARG 1 3.670 -0.400 -1.462 5 HG2 ARG 1 2HG ARG 1 3.292 1.743 0.569 6 HG3 ARG 1 3HG ARG 1 4.671 0.651 0.713 7 HD2 ARG 1 2HD ARG 1 4.984 1.227 -1.829 8 HD3 ARG 1 3HD ARG 1 4.039 2.654 -1.405 9 HE ARG 1 HE ARG 1 5.874 3.489 -0.336 10 HH11 ARG 1 1HH1 ARG 1 6.283 0.056 -0.742 11 HH12 ARG 1 2HH1 ARG 1 7.910 0.048 -0.148 12 HH21 ARG 1 1HH2 ARG 1 8.016 3.492 0.448 13 HH22 ARG 1 2HH2 ARG 1 8.895 2.003 0.530 14 HA PRO 2 HA PRO 2 -0.861 -2.089 -3.192 15 HB2 PRO 2 2HB PRO 2 -2.235 -0.522 -4.932 16 HB3 PRO 2 3HB PRO 2 -2.732 -0.757 -3.252 17 HG2 PRO 2 2HG PRO 2 -1.230 1.522 -4.482 18 HG3 PRO 2 3HG PRO 2 -2.553 1.561 -3.301 19 HD2 PRO 2 2HD PRO 2 0.043 1.863 -2.593 20 HD3 PRO 2 3HD PRO 2 -1.153 1.093 -1.531 21 HA PRO 3 HA PRO 3 1.466 -2.723 -6.869 22 HB2 PRO 3 2HB PRO 3 -0.350 -3.850 -8.543 23 HB3 PRO 3 3HB PRO 3 0.326 -4.698 -7.148 24 HG2 PRO 3 2HG PRO 3 -2.304 -3.294 -7.419 25 HG3 PRO 3 3HG PRO 3 -1.942 -4.854 -6.657 26 HD2 PRO 3 2HD PRO 3 -2.287 -2.580 -5.228 27 HD3 PRO 3 3HD PRO 3 -1.182 -3.872 -4.715 28 H GLY 4 H GLY 4 -1.684 -1.174 -7.402 29 HA2 GLY 4 2HA GLY 4 -1.139 -0.172 -9.982 30 HA3 GLY 4 3HA GLY 4 -2.351 0.456 -8.874 31 H PHE 5 H PHE 5 -0.056 0.847 -6.881 32 HA PHE 5 HA PHE 5 0.619 3.523 -7.822 33 HB2 PHE 5 2HB PHE 5 -0.302 3.255 -5.550 34 HB3 PHE 5 3HB PHE 5 1.068 2.236 -5.120 35 HD1 PHE 5 HD1 PHE 5 2.534 3.296 -3.723 36 HD2 PHE 5 HD2 PHE 5 0.671 5.535 -6.827 37 HE1 PHE 5 HE1 PHE 5 3.803 5.291 -3.041 38 HE2 PHE 5 HE2 PHE 5 1.938 7.532 -6.151 39 HZ PHE 5 HZ PHE 5 3.507 7.412 -4.256 40 H SER 6 H SER 6 2.095 0.443 -7.188 41 HA SER 6 HA SER 6 4.776 1.228 -6.950 42 HB2 SER 6 2HB SER 6 3.313 -1.244 -7.323 43 HB3 SER 6 3HB SER 6 4.795 -1.241 -8.278 44 HG SER 6 HG SER 6 5.515 -1.902 -6.367 45 HA PRO 7 HA PRO 7 6.086 2.385 -10.973 46 HB2 PRO 7 2HB PRO 7 8.554 1.266 -11.125 47 HB3 PRO 7 3HB PRO 7 8.194 2.661 -10.102 48 HG2 PRO 7 2HG PRO 7 8.407 -0.231 -9.356 49 HG3 PRO 7 3HG PRO 7 9.034 1.193 -8.505 50 HD2 PRO 7 2HD PRO 7 6.756 -0.065 -7.757 51 HD3 PRO 7 3HD PRO 7 6.990 1.683 -7.558 52 H PHE 8 H PHE 8 6.062 -1.005 -10.160 53 HA PHE 8 HA PHE 8 6.517 -1.923 -12.847 54 HB2 PHE 8 2HB PHE 8 7.185 -3.323 -10.971 55 HB3 PHE 8 3HB PHE 8 5.525 -3.375 -10.386 56 HD1 PHE 8 HD1 PHE 8 7.804 -4.500 -13.045 57 HD2 PHE 8 HD2 PHE 8 3.932 -4.869 -11.318 58 HE1 PHE 8 HE1 PHE 8 7.397 -6.516 -14.397 59 HE2 PHE 8 HE2 PHE 8 3.519 -6.885 -12.666 60 HZ PHE 8 HZ PHE 8 5.253 -7.712 -14.207 61 H ARG 9 H ARG 9 3.797 -0.946 -10.968 62 HA ARG 9 HA ARG 9 1.573 -0.785 -11.416 63 HB2 ARG 9 2HB ARG 9 2.931 -0.414 -13.920 64 HB3 ARG 9 3HB ARG 9 1.412 -1.254 -14.198 65 HG2 ARG 9 2HG ARG 9 0.288 0.637 -13.984 66 HG3 ARG 9 3HG ARG 9 0.966 0.895 -12.375 67 HD2 ARG 9 2HD ARG 9 1.625 2.787 -13.571 68 HD3 ARG 9 3HD ARG 9 3.048 1.747 -13.604 69 HE ARG 9 HE ARG 9 2.856 1.662 -15.873 70 HH11 ARG 9 1HH1 ARG 9 -0.224 2.578 -14.535 71 HH12 ARG 9 2HH1 ARG 9 -0.961 2.851 -16.079 72 HH21 ARG 9 1HH2 ARG 9 1.898 2.018 -17.912 73 HH22 ARG 9 2HH2 ARG 9 0.247 2.531 -17.999 Start of MODEL 4 1 H1 ARG 1 H ARG 1 1.009 0.594 1.077 2 HA ARG 1 HA ARG 1 1.696 1.252 -1.250 3 HB2 ARG 1 2HB ARG 1 3.250 0.068 0.362 4 HB3 ARG 1 3HB ARG 1 2.805 -1.434 -0.437 5 HG2 ARG 1 2HG ARG 1 3.731 -0.669 -2.515 6 HG3 ARG 1 3HG ARG 1 4.038 0.929 -1.833 7 HD2 ARG 1 2HD ARG 1 5.940 0.266 -0.858 8 HD3 ARG 1 3HD ARG 1 5.217 -1.233 -0.274 9 HE ARG 1 HE ARG 1 6.132 -2.316 -2.063 10 HH11 ARG 1 1HH1 ARG 1 6.091 1.103 -2.721 11 HH12 ARG 1 2HH1 ARG 1 6.995 0.963 -4.193 12 HH21 ARG 1 1HH2 ARG 1 7.323 -2.513 -3.999 13 HH22 ARG 1 2HH2 ARG 1 7.694 -1.094 -4.919 14 HA PRO 2 HA PRO 2 -1.138 -1.593 -3.586 15 HB2 PRO 2 2HB PRO 2 -2.213 0.364 -5.130 16 HB3 PRO 2 3HB PRO 2 -2.846 -0.057 -3.535 17 HG2 PRO 2 2HG PRO 2 -1.027 2.187 -4.318 18 HG3 PRO 2 3HG PRO 2 -2.415 2.205 -3.215 19 HD2 PRO 2 2HD PRO 2 0.143 2.093 -2.335 20 HD3 PRO 2 3HD PRO 2 -1.200 1.320 -1.469 21 HA PRO 3 HA PRO 3 1.354 -1.943 -7.192 22 HB2 PRO 3 2HB PRO 3 -0.454 -2.589 -9.112 23 HB3 PRO 3 3HB PRO 3 0.030 -3.708 -7.832 24 HG2 PRO 3 2HG PRO 3 -2.409 -1.981 -8.017 25 HG3 PRO 3 3HG PRO 3 -2.270 -3.668 -7.489 26 HD2 PRO 3 2HD PRO 3 -2.466 -1.607 -5.744 27 HD3 PRO 3 3HD PRO 3 -1.545 -3.080 -5.382 28 H GLY 4 H GLY 4 -1.473 0.146 -7.463 29 HA2 GLY 4 2HA GLY 4 -0.785 1.398 -9.899 30 HA3 GLY 4 3HA GLY 4 -1.854 2.061 -8.672 31 H PHE 5 H PHE 5 0.502 1.738 -6.732 32 HA PHE 5 HA PHE 5 1.675 4.344 -7.353 33 HB2 PHE 5 2HB PHE 5 0.820 3.063 -4.953 34 HB3 PHE 5 3HB PHE 5 2.548 3.371 -4.821 35 HD1 PHE 5 HD1 PHE 5 -0.700 4.998 -5.553 36 HD2 PHE 5 HD2 PHE 5 3.347 5.509 -4.338 37 HE1 PHE 5 HE1 PHE 5 -1.168 7.348 -4.994 38 HE2 PHE 5 HE2 PHE 5 2.885 7.859 -3.776 39 HZ PHE 5 HZ PHE 5 0.626 8.782 -4.104 40 H SER 6 H SER 6 2.500 0.986 -7.025 41 HA SER 6 HA SER 6 5.229 1.083 -6.600 42 HB2 SER 6 2HB SER 6 3.391 -0.831 -7.946 43 HB3 SER 6 3HB SER 6 5.117 -1.026 -8.249 44 HG SER 6 HG SER 6 5.033 -2.080 -6.422 45 HA PRO 7 HA PRO 7 7.141 2.764 -10.172 46 HB2 PRO 7 2HB PRO 7 9.324 1.177 -10.465 47 HB3 PRO 7 3HB PRO 7 9.164 2.359 -9.161 48 HG2 PRO 7 2HG PRO 7 8.693 -0.596 -9.106 49 HG3 PRO 7 3HG PRO 7 9.518 0.427 -7.916 50 HD2 PRO 7 2HD PRO 7 6.965 -0.416 -7.593 51 HD3 PRO 7 3HD PRO 7 7.539 1.147 -6.978 52 H PHE 8 H PHE 8 6.236 -0.585 -10.180 53 HA PHE 8 HA PHE 8 6.808 -1.030 -12.962 54 HB2 PHE 8 2HB PHE 8 5.218 -2.617 -10.940 55 HB3 PHE 8 3HB PHE 8 5.500 -3.146 -12.595 56 HD1 PHE 8 HD1 PHE 8 6.562 -3.560 -9.355 57 HD2 PHE 8 HD2 PHE 8 8.124 -2.933 -13.265 58 HE1 PHE 8 HE1 PHE 8 8.696 -4.571 -8.662 59 HE2 PHE 8 HE2 PHE 8 10.259 -3.943 -12.578 60 HZ PHE 8 HZ PHE 8 10.547 -4.764 -10.274 61 H ARG 9 H ARG 9 4.182 0.244 -11.127 62 HA ARG 9 HA ARG 9 2.735 0.837 -13.563 63 HB2 ARG 9 2HB ARG 9 1.955 -1.446 -12.723 64 HB3 ARG 9 3HB ARG 9 1.265 -0.587 -11.352 65 HG2 ARG 9 2HG ARG 9 -0.454 0.213 -12.551 66 HG3 ARG 9 3HG ARG 9 0.539 0.492 -13.983 67 HD2 ARG 9 2HD ARG 9 0.543 -2.011 -14.315 68 HD3 ARG 9 3HD ARG 9 -0.689 -2.094 -13.056 69 HE ARG 9 HE ARG 9 -1.582 -0.252 -14.920 70 HH11 ARG 9 1HH1 ARG 9 -0.789 -3.641 -14.828 71 HH12 ARG 9 2HH1 ARG 9 -1.917 -4.072 -16.070 72 HH21 ARG 9 1HH2 ARG 9 -3.070 -0.807 -16.558 73 HH22 ARG 9 2HH2 ARG 9 -3.213 -2.460 -17.054 Start of MODEL 5 1 H1 ARG 1 H ARG 1 0.690 -1.266 0.081 2 HA ARG 1 HA ARG 1 1.693 0.706 -1.847 3 HB2 ARG 1 2HB ARG 1 2.862 -1.921 -0.914 4 HB3 ARG 1 3HB ARG 1 3.588 -0.884 -2.135 5 HG2 ARG 1 2HG ARG 1 3.671 0.931 -0.405 6 HG3 ARG 1 3HG ARG 1 3.186 -0.282 0.782 7 HD2 ARG 1 2HD ARG 1 5.394 -0.603 1.029 8 HD3 ARG 1 3HD ARG 1 5.247 -1.545 -0.454 9 HE ARG 1 HE ARG 1 5.679 0.988 -1.334 10 HH11 ARG 1 1HH1 ARG 1 7.337 -1.130 0.877 11 HH12 ARG 1 2HH1 ARG 1 8.902 -0.464 0.545 12 HH21 ARG 1 1HH2 ARG 1 7.734 1.873 -1.779 13 HH22 ARG 1 2HH2 ARG 1 9.126 1.244 -0.965 14 HA PRO 2 HA PRO 2 -0.996 -2.170 -4.341 15 HB2 PRO 2 2HB PRO 2 -2.270 -0.196 -5.702 16 HB3 PRO 2 3HB PRO 2 -2.828 -0.798 -4.136 17 HG2 PRO 2 2HG PRO 2 -1.225 1.652 -4.762 18 HG3 PRO 2 3HG PRO 2 -2.584 1.461 -3.639 19 HD2 PRO 2 2HD PRO 2 -0.006 1.502 -2.813 20 HD3 PRO 2 3HD PRO 2 -1.257 0.547 -1.991 21 HA PRO 3 HA PRO 3 1.432 -2.011 -8.003 22 HB2 PRO 3 2HB PRO 3 -0.358 -2.656 -9.940 23 HB3 PRO 3 3HB PRO 3 0.249 -3.828 -8.764 24 HG2 PRO 3 2HG PRO 3 -2.332 -2.311 -8.768 25 HG3 PRO 3 3HG PRO 3 -2.037 -4.016 -8.381 26 HD2 PRO 3 2HD PRO 3 -2.368 -2.126 -6.471 27 HD3 PRO 3 3HD PRO 3 -1.316 -3.538 -6.245 28 H GLY 4 H GLY 4 -1.425 -0.023 -7.842 29 HA2 GLY 4 2HA GLY 4 -1.026 1.423 -10.255 30 HA3 GLY 4 3HA GLY 4 -2.017 1.933 -8.896 31 H PHE 5 H PHE 5 0.503 1.570 -7.182 32 HA PHE 5 HA PHE 5 1.578 4.239 -7.759 33 HB2 PHE 5 2HB PHE 5 0.637 3.122 -5.396 34 HB3 PHE 5 3HB PHE 5 2.388 3.064 -5.219 35 HD1 PHE 5 HD1 PHE 5 3.705 5.122 -5.212 36 HD2 PHE 5 HD2 PHE 5 -0.546 5.199 -5.417 37 HE1 PHE 5 HE1 PHE 5 3.721 7.504 -4.594 38 HE2 PHE 5 HE2 PHE 5 -0.537 7.580 -4.800 39 HZ PHE 5 HZ PHE 5 1.599 8.736 -4.388 40 H SER 6 H SER 6 2.436 0.888 -7.470 41 HA SER 6 HA SER 6 5.169 1.008 -7.070 42 HB2 SER 6 2HB SER 6 3.274 -0.933 -8.114 43 HB3 SER 6 3HB SER 6 4.834 -1.045 -8.929 44 HG SER 6 HG SER 6 4.701 -2.330 -7.010 45 HA PRO 7 HA PRO 7 7.027 2.732 -10.649 46 HB2 PRO 7 2HB PRO 7 9.221 1.167 -10.977 47 HB3 PRO 7 3HB PRO 7 9.065 2.338 -9.663 48 HG2 PRO 7 2HG PRO 7 8.622 -0.622 -9.624 49 HG3 PRO 7 3HG PRO 7 9.449 0.401 -8.435 50 HD2 PRO 7 2HD PRO 7 6.908 -0.469 -8.092 51 HD3 PRO 7 3HD PRO 7 7.474 1.096 -7.472 52 H PHE 8 H PHE 8 6.202 -0.647 -10.673 53 HA PHE 8 HA PHE 8 6.707 -1.018 -13.483 54 HB2 PHE 8 2HB PHE 8 5.226 -2.732 -11.478 55 HB3 PHE 8 3HB PHE 8 5.585 -3.212 -13.133 56 HD1 PHE 8 HD1 PHE 8 8.257 -2.607 -13.655 57 HD2 PHE 8 HD2 PHE 8 6.539 -3.809 -9.951 58 HE1 PHE 8 HE1 PHE 8 10.440 -3.478 -12.929 59 HE2 PHE 8 HE2 PHE 8 8.720 -4.682 -9.219 60 HZ PHE 8 HZ PHE 8 10.674 -4.517 -10.708 61 H ARG 9 H ARG 9 4.094 0.086 -11.524 62 HA ARG 9 HA ARG 9 2.547 0.744 -13.859 63 HB2 ARG 9 2HB ARG 9 2.027 -1.720 -12.656 64 HB3 ARG 9 3HB ARG 9 0.776 -0.652 -12.033 65 HG2 ARG 9 2HG ARG 9 0.673 -0.010 -14.641 66 HG3 ARG 9 3HG ARG 9 1.201 -1.690 -14.754 67 HD2 ARG 9 2HD ARG 9 -1.210 -1.592 -14.821 68 HD3 ARG 9 3HD ARG 9 -0.690 -2.349 -13.316 69 HE ARG 9 HE ARG 9 -1.018 0.364 -12.808 70 HH11 ARG 9 1HH1 ARG 9 -2.969 -2.364 -13.743 71 HH12 ARG 9 2HH1 ARG 9 -4.409 -1.755 -12.997 72 HH21 ARG 9 1HH2 ARG 9 -2.907 1.176 -11.822 73 HH22 ARG 9 2HH2 ARG 9 -4.373 0.258 -11.905 Start of MODEL 6 1 H1 ARG 1 H ARG 1 1.901 1.173 0.648 2 HA ARG 1 HA ARG 1 2.242 1.274 -1.767 3 HB2 ARG 1 2HB ARG 1 3.499 -1.165 -0.498 4 HB3 ARG 1 3HB ARG 1 4.005 -0.464 -2.029 5 HG2 ARG 1 2HG ARG 1 4.439 1.677 -0.768 6 HG3 ARG 1 3HG ARG 1 4.204 0.745 0.712 7 HD2 ARG 1 2HD ARG 1 6.315 0.069 0.608 8 HD3 ARG 1 3HD ARG 1 5.980 -0.714 -0.936 9 HE ARG 1 HE ARG 1 6.375 1.915 -1.566 10 HH11 ARG 1 1HH1 ARG 1 8.216 -0.533 0.089 11 HH12 ARG 1 2HH1 ARG 1 9.751 0.119 -0.381 12 HH21 ARG 1 1HH2 ARG 1 8.390 2.783 -2.190 13 HH22 ARG 1 2HH2 ARG 1 9.849 2.005 -1.677 14 HA PRO 2 HA PRO 2 -0.952 -1.887 -3.011 15 HB2 PRO 2 2HB PRO 2 -2.424 -0.171 -4.514 16 HB3 PRO 2 3HB PRO 2 -2.677 -0.388 -2.778 17 HG2 PRO 2 2HG PRO 2 -1.176 1.764 -4.220 18 HG3 PRO 2 3HG PRO 2 -2.292 1.905 -2.849 19 HD2 PRO 2 2HD PRO 2 0.398 1.955 -2.548 20 HD3 PRO 2 3HD PRO 2 -0.688 1.280 -1.316 21 HA PRO 3 HA PRO 3 0.715 -2.669 -7.005 22 HB2 PRO 3 2HB PRO 3 -1.433 -3.596 -8.382 23 HB3 PRO 3 3HB PRO 3 -0.633 -4.526 -7.110 24 HG2 PRO 3 2HG PRO 3 -3.131 -2.883 -6.968 25 HG3 PRO 3 3HG PRO 3 -2.804 -4.482 -6.276 26 HD2 PRO 3 2HD PRO 3 -2.713 -2.210 -4.804 27 HD3 PRO 3 3HD PRO 3 -1.668 -3.606 -4.471 28 H GLY 4 H GLY 4 -2.179 -0.665 -6.890 29 HA2 GLY 4 2HA GLY 4 -2.057 0.266 -9.568 30 HA3 GLY 4 3HA GLY 4 -2.928 1.031 -8.248 31 H PHE 5 H PHE 5 -0.389 1.195 -6.665 32 HA PHE 5 HA PHE 5 0.581 3.656 -7.914 33 HB2 PHE 5 2HB PHE 5 -0.209 3.271 -5.387 34 HB3 PHE 5 3HB PHE 5 1.489 2.844 -5.200 35 HD1 PHE 5 HD1 PHE 5 -0.841 5.534 -6.139 36 HD2 PHE 5 HD2 PHE 5 3.192 4.496 -5.256 37 HE1 PHE 5 HE1 PHE 5 -0.263 7.921 -5.990 38 HE2 PHE 5 HE2 PHE 5 3.776 6.881 -5.105 39 HZ PHE 5 HZ PHE 5 2.048 8.597 -5.471 40 H SER 6 H SER 6 1.625 0.476 -6.941 41 HA SER 6 HA SER 6 4.373 0.759 -6.889 42 HB2 SER 6 2HB SER 6 2.487 -1.428 -7.233 43 HB3 SER 6 3HB SER 6 3.967 -1.692 -8.154 44 HG SER 6 HG SER 6 4.041 -0.875 -5.454 45 HA PRO 7 HA PRO 7 5.772 1.613 -10.958 46 HB2 PRO 7 2HB PRO 7 8.001 0.074 -11.142 47 HB3 PRO 7 3HB PRO 7 7.915 1.525 -10.135 48 HG2 PRO 7 2HG PRO 7 7.634 -1.349 -9.344 49 HG3 PRO 7 3HG PRO 7 8.521 -0.046 -8.531 50 HD2 PRO 7 2HD PRO 7 6.076 -0.874 -7.714 51 HD3 PRO 7 3HD PRO 7 6.618 0.809 -7.551 52 H PHE 8 H PHE 8 5.031 -1.653 -10.085 53 HA PHE 8 HA PHE 8 5.366 -2.771 -12.703 54 HB2 PHE 8 2HB PHE 8 4.612 -3.719 -10.054 55 HB3 PHE 8 3HB PHE 8 3.628 -4.443 -11.321 56 HD1 PHE 8 HD1 PHE 8 4.813 -5.575 -13.255 57 HD2 PHE 8 HD2 PHE 8 6.781 -4.469 -9.647 58 HE1 PHE 8 HE1 PHE 8 6.629 -7.155 -13.766 59 HE2 PHE 8 HE2 PHE 8 8.600 -6.046 -10.152 60 HZ PHE 8 HZ PHE 8 8.527 -7.391 -12.214 61 H ARG 9 H ARG 9 2.871 -1.060 -11.049 62 HA ARG 9 HA ARG 9 0.773 -0.406 -11.635 63 HB2 ARG 9 2HB ARG 9 2.024 -0.891 -14.327 64 HB3 ARG 9 3HB ARG 9 0.356 -0.354 -14.180 65 HG2 ARG 9 2HG ARG 9 1.170 1.602 -12.874 66 HG3 ARG 9 3HG ARG 9 2.819 1.087 -13.231 67 HD2 ARG 9 2HD ARG 9 1.631 1.072 -15.705 68 HD3 ARG 9 3HD ARG 9 0.868 2.454 -14.920 69 HE ARG 9 HE ARG 9 3.668 2.525 -14.533 70 HH11 ARG 9 1HH1 ARG 9 1.226 3.038 -16.961 71 HH12 ARG 9 2HH1 ARG 9 2.171 4.182 -17.856 72 HH21 ARG 9 1HH2 ARG 9 4.922 4.030 -15.703 73 HH22 ARG 9 2HH2 ARG 9 4.273 4.745 -17.140 Start of MODEL 7 1 H1 ARG 1 H ARG 1 0.301 -1.114 0.246 2 HA ARG 1 HA ARG 1 1.399 0.806 -1.665 3 HB2 ARG 1 2HB ARG 1 2.395 -1.682 -0.361 4 HB3 ARG 1 3HB ARG 1 3.048 -1.262 -1.939 5 HG2 ARG 1 2HG ARG 1 2.980 0.836 0.164 6 HG3 ARG 1 3HG ARG 1 4.189 -0.445 0.281 7 HD2 ARG 1 2HD ARG 1 3.799 1.020 -2.295 8 HD3 ARG 1 3HD ARG 1 4.743 1.753 -1.000 9 HE ARG 1 HE ARG 1 5.515 -0.448 -2.675 10 HH11 ARG 1 1HH1 ARG 1 5.992 1.104 0.404 11 HH12 ARG 1 2HH1 ARG 1 7.584 0.460 0.629 12 HH21 ARG 1 1HH2 ARG 1 7.611 -1.302 -2.390 13 HH22 ARG 1 2HH2 ARG 1 8.504 -0.908 -0.961 14 HA PRO 2 HA PRO 2 -1.324 -1.878 -4.324 15 HB2 PRO 2 2HB PRO 2 -2.420 0.184 -5.708 16 HB3 PRO 2 3HB PRO 2 -3.081 -0.405 -4.178 17 HG2 PRO 2 2HG PRO 2 -1.315 1.956 -4.694 18 HG3 PRO 2 3HG PRO 2 -2.731 1.829 -3.635 19 HD2 PRO 2 2HD PRO 2 -0.195 1.709 -2.695 20 HD3 PRO 2 3HD PRO 2 -1.534 0.817 -1.945 21 HA PRO 3 HA PRO 3 1.271 -1.811 -7.873 22 HB2 PRO 3 2HB PRO 3 -0.463 -2.324 -9.897 23 HB3 PRO 3 3HB PRO 3 0.022 -3.545 -8.714 24 HG2 PRO 3 2HG PRO 3 -2.465 -1.881 -8.807 25 HG3 PRO 3 3HG PRO 3 -2.286 -3.606 -8.436 26 HD2 PRO 3 2HD PRO 3 -2.594 -1.726 -6.512 27 HD3 PRO 3 3HD PRO 3 -1.635 -3.200 -6.263 28 H GLY 4 H GLY 4 -1.495 0.319 -7.838 29 HA2 GLY 4 2HA GLY 4 -0.807 1.789 -10.190 30 HA3 GLY 4 3HA GLY 4 -1.951 2.285 -8.951 31 H PHE 5 H PHE 5 0.288 1.865 -6.922 32 HA PHE 5 HA PHE 5 1.374 4.557 -7.192 33 HB2 PHE 5 2HB PHE 5 0.293 3.740 -5.058 34 HB3 PHE 5 3HB PHE 5 1.677 2.672 -4.852 35 HD1 PHE 5 HD1 PHE 5 3.877 3.568 -4.334 36 HD2 PHE 5 HD2 PHE 5 0.484 6.110 -4.718 37 HE1 PHE 5 HE1 PHE 5 5.116 5.383 -3.228 38 HE2 PHE 5 HE2 PHE 5 1.718 7.930 -3.614 39 HZ PHE 5 HZ PHE 5 4.038 7.568 -2.868 40 H SER 6 H SER 6 2.380 1.227 -7.258 41 HA SER 6 HA SER 6 5.137 1.568 -6.849 42 HB2 SER 6 2HB SER 6 3.376 -0.543 -7.900 43 HB3 SER 6 3HB SER 6 5.016 -0.577 -8.546 44 HG SER 6 HG SER 6 4.671 -1.777 -6.548 45 HA PRO 7 HA PRO 7 6.707 3.312 -10.555 46 HB2 PRO 7 2HB PRO 7 9.004 1.915 -10.928 47 HB3 PRO 7 3HB PRO 7 8.807 3.114 -9.645 48 HG2 PRO 7 2HG PRO 7 8.605 0.131 -9.498 49 HG3 PRO 7 3HG PRO 7 9.394 1.255 -8.377 50 HD2 PRO 7 2HD PRO 7 6.947 0.200 -7.899 51 HD3 PRO 7 3HD PRO 7 7.410 1.824 -7.351 52 H PHE 8 H PHE 8 6.073 -0.091 -10.438 53 HA PHE 8 HA PHE 8 6.575 -0.599 -13.216 54 HB2 PHE 8 2HB PHE 8 5.585 -2.133 -10.892 55 HB3 PHE 8 3HB PHE 8 4.976 -2.656 -12.459 56 HD1 PHE 8 HD1 PHE 8 6.579 -3.364 -14.223 57 HD2 PHE 8 HD2 PHE 8 7.803 -2.577 -10.224 58 HE1 PHE 8 HE1 PHE 8 8.667 -4.601 -14.623 59 HE2 PHE 8 HE2 PHE 8 9.894 -3.812 -10.617 60 HZ PHE 8 HZ PHE 8 10.329 -4.826 -12.819 61 H ARG 9 H ARG 9 3.932 0.604 -11.358 62 HA ARG 9 HA ARG 9 2.391 1.013 -13.779 63 HB2 ARG 9 2HB ARG 9 1.796 -1.146 -12.016 64 HB3 ARG 9 3HB ARG 9 0.521 0.054 -11.854 65 HG2 ARG 9 2HG ARG 9 -0.188 -0.202 -14.017 66 HG3 ARG 9 3HG ARG 9 1.388 -0.758 -14.582 67 HD2 ARG 9 2HD ARG 9 0.494 -2.807 -14.530 68 HD3 ARG 9 3HD ARG 9 0.683 -2.698 -12.780 69 HE ARG 9 HE ARG 9 -1.738 -1.534 -13.297 70 HH11 ARG 9 1HH1 ARG 9 -0.287 -4.632 -13.942 71 HH12 ARG 9 2HH1 ARG 9 -1.790 -5.493 -13.889 72 HH21 ARG 9 1HH2 ARG 9 -3.723 -2.655 -13.224 73 HH22 ARG 9 2HH2 ARG 9 -3.744 -4.367 -13.482 Start of MODEL 8 1 H1 ARG 1 H ARG 1 0.337 1.878 -0.253 2 HA ARG 1 HA ARG 1 1.883 2.204 -2.024 3 HB2 ARG 1 2HB ARG 1 3.939 0.723 -2.073 4 HB3 ARG 1 3HB ARG 1 3.891 1.930 -0.795 5 HG2 ARG 1 2HG ARG 1 4.008 0.383 0.794 6 HG3 ARG 1 3HG ARG 1 2.729 -0.582 0.053 7 HD2 ARG 1 2HD ARG 1 4.404 -2.063 -0.252 8 HD3 ARG 1 3HD ARG 1 4.734 -1.069 -1.671 9 HE ARG 1 HE ARG 1 6.106 -0.074 0.602 10 HH11 ARG 1 1HH1 ARG 1 6.178 -2.624 -1.766 11 HH12 ARG 1 2HH1 ARG 1 7.893 -2.848 -1.665 12 HH21 ARG 1 1HH2 ARG 1 8.365 -0.358 0.744 13 HH22 ARG 1 2HH2 ARG 1 9.136 -1.558 -0.236 14 HA PRO 2 HA PRO 2 -0.577 -1.550 -3.230 15 HB2 PRO 2 2HB PRO 2 -2.154 -0.236 -5.006 16 HB3 PRO 2 3HB PRO 2 -2.535 -0.348 -3.284 17 HG2 PRO 2 2HG PRO 2 -1.266 1.899 -4.802 18 HG3 PRO 2 3HG PRO 2 -2.516 1.963 -3.546 19 HD2 PRO 2 2HD PRO 2 0.090 2.489 -3.035 20 HD3 PRO 2 3HD PRO 2 -0.987 1.745 -1.835 21 HA PRO 3 HA PRO 3 1.567 -2.369 -6.980 22 HB2 PRO 3 2HB PRO 3 -0.264 -3.754 -8.430 23 HB3 PRO 3 3HB PRO 3 0.549 -4.428 -7.012 24 HG2 PRO 3 2HG PRO 3 -2.182 -3.221 -7.234 25 HG3 PRO 3 3HG PRO 3 -1.670 -4.680 -6.365 26 HD2 PRO 3 2HD PRO 3 -2.084 -2.312 -5.119 27 HD3 PRO 3 3HD PRO 3 -0.866 -3.480 -4.568 28 H GLY 4 H GLY 4 -1.582 -0.835 -7.266 29 HA2 GLY 4 2HA GLY 4 -1.395 -0.145 -10.011 30 HA3 GLY 4 3HA GLY 4 -2.458 0.604 -8.829 31 H PHE 5 H PHE 5 0.052 1.182 -7.183 32 HA PHE 5 HA PHE 5 0.630 3.721 -8.505 33 HB2 PHE 5 2HB PHE 5 -0.091 3.608 -6.086 34 HB3 PHE 5 3HB PHE 5 1.460 2.852 -5.734 35 HD1 PHE 5 HD1 PHE 5 3.042 4.245 -4.855 36 HD2 PHE 5 HD2 PHE 5 0.235 5.824 -7.638 37 HE1 PHE 5 HE1 PHE 5 4.075 6.467 -4.631 38 HE2 PHE 5 HE2 PHE 5 1.264 8.048 -7.419 39 HZ PHE 5 HZ PHE 5 3.187 8.372 -5.915 40 H SER 6 H SER 6 2.182 0.759 -7.495 41 HA SER 6 HA SER 6 4.861 1.545 -7.672 42 HB2 SER 6 2HB SER 6 5.311 -0.638 -7.273 43 HB3 SER 6 3HB SER 6 3.568 -0.782 -7.046 44 HG SER 6 HG SER 6 3.578 -2.066 -8.694 45 HA PRO 7 HA PRO 7 5.765 1.989 -11.941 46 HB2 PRO 7 2HB PRO 7 8.216 0.839 -12.139 47 HB3 PRO 7 3HB PRO 7 7.946 2.391 -11.338 48 HG2 PRO 7 2HG PRO 7 8.253 -0.333 -10.136 49 HG3 PRO 7 3HG PRO 7 8.948 1.209 -9.604 50 HD2 PRO 7 2HD PRO 7 6.765 0.116 -8.435 51 HD3 PRO 7 3HD PRO 7 7.003 1.871 -8.560 52 H PHE 8 H PHE 8 5.827 -1.209 -10.563 53 HA PHE 8 HA PHE 8 6.038 -2.578 -13.084 54 HB2 PHE 8 2HB PHE 8 5.149 -3.691 -10.417 55 HB3 PHE 8 3HB PHE 8 5.727 -4.606 -11.805 56 HD1 PHE 8 HD1 PHE 8 8.131 -4.230 -12.555 57 HD2 PHE 8 HD2 PHE 8 6.628 -2.938 -8.788 58 HE1 PHE 8 HE1 PHE 8 10.430 -4.091 -11.689 59 HE2 PHE 8 HE2 PHE 8 8.924 -2.797 -7.916 60 HZ PHE 8 HZ PHE 8 10.829 -3.373 -9.367 61 H ARG 9 H ARG 9 3.501 -1.263 -11.156 62 HA ARG 9 HA ARG 9 1.239 -1.192 -11.387 63 HB2 ARG 9 2HB ARG 9 2.333 -1.300 -14.092 64 HB3 ARG 9 3HB ARG 9 0.689 -1.918 -13.998 65 HG2 ARG 9 2HG ARG 9 1.191 0.627 -12.601 66 HG3 ARG 9 3HG ARG 9 1.293 0.668 -14.362 67 HD2 ARG 9 2HD ARG 9 -0.986 -0.835 -13.807 68 HD3 ARG 9 3HD ARG 9 -1.028 0.495 -12.650 69 HE ARG 9 HE ARG 9 -1.377 0.661 -15.502 70 HH11 ARG 9 1HH1 ARG 9 -0.503 2.388 -12.608 71 HH12 ARG 9 2HH1 ARG 9 -0.901 3.943 -13.259 72 HH21 ARG 9 1HH2 ARG 9 -1.904 2.703 -16.371 73 HH22 ARG 9 2HH2 ARG 9 -1.699 4.121 -15.399 Start of MODEL 9 1 H1 ARG 1 H ARG 1 0.942 -0.523 0.244 2 HA ARG 1 HA ARG 1 2.118 1.393 -1.657 3 HB2 ARG 1 2HB ARG 1 3.377 -1.185 -0.698 4 HB3 ARG 1 3HB ARG 1 4.038 -0.120 -1.931 5 HG2 ARG 1 2HG ARG 1 4.467 1.592 -0.356 6 HG3 ARG 1 3HG ARG 1 3.516 0.778 0.888 7 HD2 ARG 1 2HD ARG 1 5.560 -0.984 -0.071 8 HD3 ARG 1 3HD ARG 1 6.279 0.557 0.392 9 HE ARG 1 HE ARG 1 4.613 -0.081 2.462 10 HH11 ARG 1 1HH1 ARG 1 7.280 -1.643 0.860 11 HH12 ARG 1 2HH1 ARG 1 7.797 -2.500 2.274 12 HH21 ARG 1 1HH2 ARG 1 5.284 -1.204 4.331 13 HH22 ARG 1 2HH2 ARG 1 6.660 -2.251 4.248 14 HA PRO 2 HA PRO 2 -0.684 -1.626 -3.815 15 HB2 PRO 2 2HB PRO 2 -1.962 0.256 -5.296 16 HB3 PRO 2 3HB PRO 2 -2.475 -0.195 -3.666 17 HG2 PRO 2 2HG PRO 2 -0.843 2.151 -4.557 18 HG3 PRO 2 3HG PRO 2 -2.164 2.091 -3.375 19 HD2 PRO 2 2HD PRO 2 0.444 2.137 -2.645 20 HD3 PRO 2 3HD PRO 2 -0.797 1.287 -1.701 21 HA PRO 3 HA PRO 3 1.612 -1.842 -7.559 22 HB2 PRO 3 2HB PRO 3 -0.262 -2.604 -9.370 23 HB3 PRO 3 3HB PRO 3 0.361 -3.686 -8.119 24 HG2 PRO 3 2HG PRO 3 -2.183 -2.110 -8.164 25 HG3 PRO 3 3HG PRO 3 -1.913 -3.784 -7.643 26 HD2 PRO 3 2HD PRO 3 -2.131 -1.730 -5.892 27 HD3 PRO 3 3HD PRO 3 -1.103 -3.143 -5.582 28 H GLY 4 H GLY 4 -1.273 0.150 -7.566 29 HA2 GLY 4 2HA GLY 4 -0.835 1.407 -10.076 30 HA3 GLY 4 3HA GLY 4 -1.862 2.010 -8.784 31 H PHE 5 H PHE 5 0.623 1.818 -6.992 32 HA PHE 5 HA PHE 5 1.579 4.499 -7.633 33 HB2 PHE 5 2HB PHE 5 0.991 3.140 -5.228 34 HB3 PHE 5 3HB PHE 5 2.729 3.422 -5.227 35 HD1 PHE 5 HD1 PHE 5 -0.478 5.205 -5.871 36 HD2 PHE 5 HD2 PHE 5 3.533 5.440 -4.466 37 HE1 PHE 5 HE1 PHE 5 -0.862 7.533 -5.175 38 HE2 PHE 5 HE2 PHE 5 3.155 7.768 -3.767 39 HZ PHE 5 HZ PHE 5 0.955 8.818 -4.120 40 H SER 6 H SER 6 2.692 1.198 -7.428 41 HA SER 6 HA SER 6 5.447 1.583 -7.346 42 HB2 SER 6 2HB SER 6 3.634 -0.589 -8.209 43 HB3 SER 6 3HB SER 6 5.259 -0.641 -8.891 44 HG SER 6 HG SER 6 4.435 -0.856 -6.221 45 HA PRO 7 HA PRO 7 6.675 3.166 -11.247 46 HB2 PRO 7 2HB PRO 7 8.950 1.772 -11.751 47 HB3 PRO 7 3HB PRO 7 8.847 3.028 -10.511 48 HG2 PRO 7 2HG PRO 7 8.694 0.053 -10.212 49 HG3 PRO 7 3HG PRO 7 9.562 1.235 -9.215 50 HD2 PRO 7 2HD PRO 7 7.177 0.183 -8.483 51 HD3 PRO 7 3HD PRO 7 7.665 1.834 -8.051 52 H PHE 8 H PHE 8 6.064 -0.221 -10.920 53 HA PHE 8 HA PHE 8 6.328 -0.837 -13.719 54 HB2 PHE 8 2HB PHE 8 5.752 -2.300 -11.248 55 HB3 PHE 8 3HB PHE 8 4.823 -2.872 -12.630 56 HD1 PHE 8 HD1 PHE 8 6.338 -3.048 -14.859 57 HD2 PHE 8 HD2 PHE 8 7.732 -3.367 -10.850 58 HE1 PHE 8 HE1 PHE 8 8.289 -4.327 -15.643 59 HE2 PHE 8 HE2 PHE 8 9.685 -4.646 -11.628 60 HZ PHE 8 HZ PHE 8 9.966 -5.127 -14.027 61 H ARG 9 H ARG 9 3.855 0.364 -11.638 62 HA ARG 9 HA ARG 9 2.050 0.600 -13.902 63 HB2 ARG 9 2HB ARG 9 1.701 -1.407 -11.879 64 HB3 ARG 9 3HB ARG 9 0.394 -0.235 -11.768 65 HG2 ARG 9 2HG ARG 9 0.787 -0.861 -14.508 66 HG3 ARG 9 3HG ARG 9 0.703 -2.370 -13.597 67 HD2 ARG 9 2HD ARG 9 -1.419 -1.799 -12.691 68 HD3 ARG 9 3HD ARG 9 -1.297 -0.143 -13.285 69 HE ARG 9 HE ARG 9 -2.079 -0.860 -15.308 70 HH11 ARG 9 1HH1 ARG 9 -0.948 -3.611 -13.499 71 HH12 ARG 9 2HH1 ARG 9 -1.529 -4.770 -14.648 72 HH21 ARG 9 1HH2 ARG 9 -2.849 -2.376 -16.828 73 HH22 ARG 9 2HH2 ARG 9 -2.609 -4.066 -16.542 Start of MODEL 10 1 H1 ARG 1 H ARG 1 0.665 2.136 0.089 2 HA ARG 1 HA ARG 1 2.064 2.378 -1.765 3 HB2 ARG 1 2HB ARG 1 4.140 0.939 -1.911 4 HB3 ARG 1 3HB ARG 1 4.120 2.122 -0.611 5 HG2 ARG 1 2HG ARG 1 4.378 0.545 0.923 6 HG3 ARG 1 3HG ARG 1 3.024 -0.386 0.279 7 HD2 ARG 1 2HD ARG 1 4.721 -1.876 -0.062 8 HD3 ARG 1 3HD ARG 1 4.779 -0.997 -1.590 9 HE ARG 1 HE ARG 1 6.505 0.377 -0.034 10 HH11 ARG 1 1HH1 ARG 1 6.168 -3.000 -0.807 11 HH12 ARG 1 2HH1 ARG 1 7.860 -3.338 -0.656 12 HH21 ARG 1 1HH2 ARG 1 8.735 -0.054 0.168 13 HH22 ARG 1 2HH2 ARG 1 9.320 -1.661 -0.100 14 HA PRO 2 HA PRO 2 -0.381 -1.414 -2.897 15 HB2 PRO 2 2HB PRO 2 -2.076 -0.113 -4.572 16 HB3 PRO 2 3HB PRO 2 -2.366 -0.258 -2.834 17 HG2 PRO 2 2HG PRO 2 -1.228 2.040 -4.379 18 HG3 PRO 2 3HG PRO 2 -2.414 2.056 -3.062 19 HD2 PRO 2 2HD PRO 2 0.202 2.637 -2.674 20 HD3 PRO 2 3HD PRO 2 -0.795 1.851 -1.433 21 HA PRO 3 HA PRO 3 1.589 -2.128 -6.763 22 HB2 PRO 3 2HB PRO 3 -0.280 -3.536 -8.139 23 HB3 PRO 3 3HB PRO 3 0.618 -4.211 -6.775 24 HG2 PRO 3 2HG PRO 3 -2.147 -3.066 -6.841 25 HG3 PRO 3 3HG PRO 3 -1.559 -4.524 -6.021 26 HD2 PRO 3 2HD PRO 3 -1.964 -2.184 -4.720 27 HD3 PRO 3 3HD PRO 3 -0.693 -3.331 -4.249 28 H GLY 4 H GLY 4 -1.603 -0.662 -6.863 29 HA2 GLY 4 2HA GLY 4 -1.631 0.050 -9.594 30 HA3 GLY 4 3HA GLY 4 -2.566 0.824 -8.323 31 H PHE 5 H PHE 5 0.115 1.346 -6.931 32 HA PHE 5 HA PHE 5 0.665 3.831 -8.387 33 HB2 PHE 5 2HB PHE 5 0.143 3.412 -5.727 34 HB3 PHE 5 3HB PHE 5 1.902 3.491 -5.745 35 HD1 PHE 5 HD1 PHE 5 2.784 5.548 -5.290 36 HD2 PHE 5 HD2 PHE 5 -0.932 5.318 -7.354 37 HE1 PHE 5 HE1 PHE 5 2.674 8.005 -5.358 38 HE2 PHE 5 HE2 PHE 5 -1.047 7.775 -7.425 39 HZ PHE 5 HZ PHE 5 0.757 9.122 -6.427 40 H SER 6 H SER 6 2.158 0.901 -7.209 41 HA SER 6 HA SER 6 4.851 1.583 -7.443 42 HB2 SER 6 2HB SER 6 3.314 -0.972 -7.523 43 HB3 SER 6 3HB SER 6 4.993 -1.004 -8.062 44 HG SER 6 HG SER 6 4.146 -1.104 -5.602 45 HA PRO 7 HA PRO 7 5.757 1.863 -11.725 46 HB2 PRO 7 2HB PRO 7 8.168 0.627 -11.892 47 HB3 PRO 7 3HB PRO 7 7.951 2.212 -11.139 48 HG2 PRO 7 2HG PRO 7 8.173 -0.482 -9.853 49 HG3 PRO 7 3HG PRO 7 8.919 1.053 -9.371 50 HD2 PRO 7 2HD PRO 7 6.704 0.069 -8.164 51 HD3 PRO 7 3HD PRO 7 7.000 1.810 -8.345 52 H PHE 8 H PHE 8 5.682 -1.282 -10.245 53 HA PHE 8 HA PHE 8 5.888 -2.762 -12.695 54 HB2 PHE 8 2HB PHE 8 5.630 -3.362 -9.844 55 HB3 PHE 8 3HB PHE 8 4.714 -4.464 -10.865 56 HD1 PHE 8 HD1 PHE 8 5.886 -5.775 -12.619 57 HD2 PHE 8 HD2 PHE 8 7.986 -3.460 -9.729 58 HE1 PHE 8 HE1 PHE 8 7.945 -7.028 -13.116 59 HE2 PHE 8 HE2 PHE 8 10.047 -4.709 -10.221 60 HZ PHE 8 HZ PHE 8 10.029 -6.495 -11.917 61 H ARG 9 H ARG 9 3.356 -1.228 -10.929 62 HA ARG 9 HA ARG 9 1.118 -1.018 -11.278 63 HB2 ARG 9 2HB ARG 9 2.324 -0.982 -13.792 64 HB3 ARG 9 3HB ARG 9 0.990 -2.115 -13.964 65 HG2 ARG 9 2HG ARG 9 -0.588 -0.511 -13.725 66 HG3 ARG 9 3HG ARG 9 0.393 0.443 -12.611 67 HD2 ARG 9 2HD ARG 9 1.878 0.819 -14.741 68 HD3 ARG 9 3HD ARG 9 0.391 0.405 -15.593 69 HE ARG 9 HE ARG 9 -0.004 2.403 -13.583 70 HH11 ARG 9 1HH1 ARG 9 1.036 1.852 -16.859 71 HH12 ARG 9 2HH1 ARG 9 0.658 3.458 -17.387 72 HH21 ARG 9 1HH2 ARG 9 -0.506 4.521 -14.266 73 HH22 ARG 9 2HH2 ARG 9 -0.218 4.976 -15.912
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