NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
570063 | 2mfo | 19556 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 ALA 1 HT1 ALA 1 9.685 1.985 1.895 2 H2 ALA 1 HT2 ALA 1 8.721 0.614 1.671 3 H3 ALA 1 HT3 ALA 1 8.148 2.136 1.215 4 HA ALA 1 HA ALA 1 9.783 2.330 -0.492 5 HB1 ALA 1 HB1 ALA 1 11.545 1.072 0.687 6 HB2 ALA 1 HB2 ALA 1 11.333 0.546 -0.983 7 HB3 ALA 1 HB3 ALA 1 10.681 -0.425 0.337 8 H PHE 2 HN PHE 2 8.613 -0.988 0.160 9 HA PHE 2 HA PHE 2 7.718 -1.288 -2.536 10 HB2 PHE 2 HB2 PHE 2 7.345 -3.003 -0.082 11 HB3 PHE 2 HB1 PHE 2 6.749 -3.450 -1.676 12 HD1 PHE 2 HD1 PHE 2 8.304 -4.008 -3.472 13 HD2 PHE 2 HD2 PHE 2 9.681 -3.117 0.453 14 HE1 PHE 2 HE1 PHE 2 10.489 -4.998 -4.016 15 HE2 PHE 2 HE2 PHE 2 11.869 -4.102 -0.084 16 HZ PHE 2 HZ PHE 2 12.274 -5.045 -2.321 17 H GLN 3 HN GLN 3 6.134 -0.591 0.536 18 HA GLN 3 HA GLN 3 3.532 -0.601 -0.750 19 HB2 GLN 3 HB2 GLN 3 2.586 -0.198 1.419 20 HB3 GLN 3 HB1 GLN 3 3.803 -1.448 1.585 21 HG2 GLN 3 HG2 GLN 3 4.301 1.445 2.231 22 HG3 GLN 3 HG1 GLN 3 3.740 0.267 3.409 23 HE21 GLN 3 HE21 GLN 3 5.141 -1.314 4.140 24 HE22 GLN 3 HE22 GLN 3 6.849 -1.230 3.880 25 HA HZP 4 HA HZP 4 3.693 3.724 -1.814 26 HB HZP 4 HB2 HZP 4 0.994 4.049 -2.214 27 HBA HZP 4 HB1 HZP 4 2.077 3.288 -3.397 28 HG HZP 4 HG1 HZP 4 0.556 1.561 -3.090 29 HD HZP 4 HD3 HZP 4 2.540 0.489 -2.612 30 HDA HZP 4 HD2 HZP 4 1.693 0.228 -1.072 31 HOD1 HZP 4 HG2 HZP 4 -0.689 1.390 -1.344 32 H THR 5 HN THR 5 3.813 3.168 0.886 33 HA THR 5 HA THR 5 3.524 4.003 2.943 34 HB THR 5 HB THR 5 3.321 6.447 3.161 35 HG1 THR 5 HG1 THR 5 2.276 6.183 0.619 36 HG21 THR 5 HG21 THR 5 5.479 5.383 2.588 37 HG22 THR 5 HG22 THR 5 5.333 7.019 1.948 38 HG23 THR 5 HG23 THR 5 5.119 5.632 0.879 39 H THR 6 HN THR 6 1.092 3.089 1.472 40 HA THR 6 HA THR 6 -0.791 3.844 3.558 41 HB THR 6 HB THR 6 -2.607 3.948 1.770 42 HG1 THR 6 HG1 THR 6 -0.368 4.406 0.056 43 HG21 THR 6 HG21 THR 6 -0.401 5.992 1.800 44 HG22 THR 6 HG22 THR 6 -1.826 5.961 2.848 45 HG23 THR 6 HG23 THR 6 -2.006 6.280 1.120 46 HA PRO 7 HA PRO 7 -0.412 -0.714 2.741 47 HB2 PRO 7 HB2 PRO 7 -0.378 -0.873 5.674 48 HB3 PRO 7 HB1 PRO 7 0.795 -1.489 4.505 49 HG2 PRO 7 HG2 PRO 7 1.370 0.601 6.083 50 HG3 PRO 7 HG1 PRO 7 1.953 0.515 4.408 51 HD2 PRO 7 HD2 PRO 7 -0.399 2.018 5.511 52 HD3 PRO 7 HD1 PRO 7 0.863 2.574 4.386 53 H GLY 8 HN GLY 8 -1.832 -2.499 3.417 54 HA2 GLY 8 HA2 GLY 8 -3.892 -3.353 4.051 55 HA3 GLY 8 HA1 GLY 8 -4.301 -1.791 4.747 56 H ASN 9 HN ASN 9 -3.163 -2.201 1.494 57 HA ASN 9 HA ASN 9 -3.985 -1.419 -0.474 58 HB2 ASN 9 HB2 ASN 9 -5.891 -2.735 -1.322 59 HB3 ASN 9 HB1 ASN 9 -4.661 -3.726 -0.559 60 HD21 ASN 9 HD21 ASN 9 -5.142 -4.823 1.313 61 HD22 ASN 9 HD22 ASN 9 -6.761 -5.021 1.889 62 H SER 10 HN SER 10 -4.538 0.505 1.407 63 HA SER 10 HA SER 10 -7.212 1.328 1.474 64 HB2 SER 10 HB2 SER 10 -4.783 3.128 1.584 65 HB3 SER 10 HB1 SER 10 -6.387 3.463 2.230 66 HG SER 10 HG SER 10 -4.451 2.419 3.544 67 HA HZP 11 HA HZP 11 -6.617 3.544 -2.637 68 HB HZP 11 HB2 HZP 11 -4.067 3.789 -3.691 69 HBA HZP 11 HB1 HZP 11 -4.806 4.955 -2.580 70 HG HZP 11 HG1 HZP 11 -3.373 4.384 -0.946 71 HD HZP 11 HD3 HZP 11 -3.871 2.452 0.165 72 HDA HZP 11 HD2 HZP 11 -3.684 1.455 -1.294 73 HOD1 HZP 11 HG2 HZP 11 -1.540 3.451 -1.577 74 H GLY 12 HN GLY 12 -6.241 0.545 -2.167 75 HA2 GLY 12 HA2 GLY 12 -6.826 -1.115 -3.762 76 HA3 GLY 12 HA1 GLY 12 -6.048 -0.153 -5.011 77 H VAL 13 HN VAL 13 -3.580 0.307 -3.997 78 HA VAL 13 HA VAL 13 -2.473 -2.412 -3.819 79 HB VAL 13 HB VAL 13 -1.091 0.110 -4.763 80 HG11 VAL 13 HG11 VAL 13 0.667 -1.402 -5.548 81 HG12 VAL 13 HG12 VAL 13 -0.201 -2.770 -4.852 82 HG13 VAL 13 HG13 VAL 13 0.452 -1.514 -3.802 83 HG21 VAL 13 HG21 VAL 13 -1.241 -0.871 -7.009 84 HG22 VAL 13 HG22 VAL 13 -2.832 -0.549 -6.323 85 HG23 VAL 13 HG23 VAL 13 -2.204 -2.195 -6.358 86 H GLY 14 HN GLY 14 -1.268 -2.971 -2.096 87 HA2 GLY 14 HA2 GLY 14 0.376 -1.384 -0.564 88 HA3 GLY 14 HA1 GLY 14 -1.210 -1.261 0.186 89 H HIS 15 HN HIS 15 0.268 -2.265 1.928 90 HA HIS 15 HA HIS 15 -0.504 -4.998 2.165 91 HB2 HIS 15 HB2 HIS 15 1.550 -5.208 0.762 92 HB3 HIS 15 HB1 HIS 15 2.465 -4.404 2.030 93 HD1 HIS 15 HD1 HIS 15 0.507 -7.586 1.435 94 HD2 HIS 15 HD2 HIS 15 3.409 -6.064 3.990 95 HE1 HIS 15 HE1 HIS 15 1.273 -9.537 2.822 96 HE2 HIS 15 HE2 HIS 15 3.164 -8.629 4.216 Start of MODEL 2 1 H1 ALA 1 HT1 ALA 1 8.283 2.521 1.520 2 H2 ALA 1 HT2 ALA 1 7.629 0.995 1.201 3 H3 ALA 1 HT3 ALA 1 6.773 2.386 0.773 4 HA ALA 1 HA ALA 1 8.403 2.979 -0.850 5 HB1 ALA 1 HB1 ALA 1 9.807 0.447 -0.020 6 HB2 ALA 1 HB2 ALA 1 10.354 2.089 0.316 7 HB3 ALA 1 HB3 ALA 1 10.277 1.508 -1.344 8 H PHE 2 HN PHE 2 8.053 -0.561 -0.475 9 HA PHE 2 HA PHE 2 7.209 -0.931 -3.153 10 HB2 PHE 2 HB2 PHE 2 6.918 -2.746 -0.750 11 HB3 PHE 2 HB1 PHE 2 6.606 -3.230 -2.412 12 HD1 PHE 2 HD1 PHE 2 8.484 -3.285 -4.042 13 HD2 PHE 2 HD2 PHE 2 9.105 -2.670 0.120 14 HE1 PHE 2 HE1 PHE 2 10.855 -3.877 -4.314 15 HE2 PHE 2 HE2 PHE 2 11.479 -3.261 -0.142 16 HZ PHE 2 HZ PHE 2 12.354 -3.880 -2.364 17 H GLN 3 HN GLN 3 5.481 -0.711 -0.092 18 HA GLN 3 HA GLN 3 2.923 -0.737 -1.463 19 HB2 GLN 3 HB2 GLN 3 1.954 -0.674 0.797 20 HB3 GLN 3 HB1 GLN 3 3.088 -2.000 0.617 21 HG2 GLN 3 HG2 GLN 3 3.646 0.615 2.005 22 HG3 GLN 3 HG1 GLN 3 3.256 -0.908 2.784 23 HE21 GLN 3 HE21 GLN 3 4.792 -2.553 2.849 24 HE22 GLN 3 HE22 GLN 3 6.464 -2.243 2.537 25 HA HZP 4 HA HZP 4 3.162 3.693 -1.693 26 HB HZP 4 HB2 HZP 4 0.740 4.101 -2.876 27 HBA HZP 4 HB1 HZP 4 2.163 3.521 -3.759 28 HG HZP 4 HG1 HZP 4 0.796 1.778 -4.273 29 HD HZP 4 HD3 HZP 4 2.206 0.377 -3.142 30 HDA HZP 4 HD2 HZP 4 0.934 0.290 -1.909 31 HOD1 HZP 4 HG2 HZP 4 -0.635 1.478 -1.958 32 H THR 5 HN THR 5 3.013 3.499 0.693 33 HA THR 5 HA THR 5 2.272 4.169 2.693 34 HB THR 5 HB THR 5 0.709 6.037 2.867 35 HG1 THR 5 HG1 THR 5 -0.124 5.135 0.442 36 HG21 THR 5 HG21 THR 5 3.080 6.406 2.227 37 HG22 THR 5 HG22 THR 5 1.990 7.664 1.644 38 HG23 THR 5 HG23 THR 5 2.582 6.426 0.536 39 H THR 6 HN THR 6 0.472 4.169 4.240 40 HA THR 6 HA THR 6 -1.047 2.927 5.369 41 HB THR 6 HB THR 6 -3.309 2.800 4.170 42 HG1 THR 6 HG1 THR 6 -1.878 3.241 2.071 43 HG21 THR 6 HG21 THR 6 -1.902 5.448 4.514 44 HG22 THR 6 HG22 THR 6 -2.767 4.551 5.762 45 HG23 THR 6 HG23 THR 6 -3.647 5.236 4.395 46 HA PRO 7 HA PRO 7 -0.016 -1.132 3.226 47 HB2 PRO 7 HB2 PRO 7 0.812 -1.634 6.043 48 HB3 PRO 7 HB1 PRO 7 1.615 -2.092 4.535 49 HG2 PRO 7 HG2 PRO 7 2.594 -0.099 5.959 50 HG3 PRO 7 HG1 PRO 7 2.466 0.056 4.191 51 HD2 PRO 7 HD2 PRO 7 0.648 1.164 6.314 52 HD3 PRO 7 HD1 PRO 7 1.320 1.973 4.880 53 H GLY 8 HN GLY 8 -1.782 -2.288 2.988 54 HA2 GLY 8 HA2 GLY 8 -3.178 -3.969 4.226 55 HA3 GLY 8 HA1 GLY 8 -3.594 -2.625 5.283 56 H ASN 9 HN ASN 9 -3.713 -0.661 3.216 57 HA ASN 9 HA ASN 9 -5.433 -1.417 1.102 58 HB2 ASN 9 HB2 ASN 9 -7.071 -1.665 2.951 59 HB3 ASN 9 HB1 ASN 9 -6.791 0.012 3.404 60 HD21 ASN 9 HD21 ASN 9 -7.682 1.649 2.181 61 HD22 ASN 9 HD22 ASN 9 -8.841 1.362 0.926 62 H SER 10 HN SER 10 -4.527 -0.105 -0.325 63 HA SER 10 HA SER 10 -4.556 2.774 0.191 64 HB2 SER 10 HB2 SER 10 -2.228 2.910 -0.822 65 HB3 SER 10 HB1 SER 10 -2.303 2.199 0.788 66 HG SER 10 HG SER 10 -2.358 0.126 -0.324 67 HA HZP 11 HA HZP 11 -5.820 3.531 -4.037 68 HB HZP 11 HB2 HZP 11 -3.322 4.574 -5.012 69 HBA HZP 11 HB1 HZP 11 -4.773 5.478 -4.547 70 HG HZP 11 HG1 HZP 11 -3.460 6.281 -2.864 71 HD HZP 11 HD3 HZP 11 -4.935 5.071 -1.527 72 HDA HZP 11 HD2 HZP 11 -3.385 4.368 -1.012 73 HOD1 HZP 11 HG2 HZP 11 -1.476 5.510 -2.529 74 H GLY 12 HN GLY 12 -2.381 2.536 -4.027 75 HA2 GLY 12 HA2 GLY 12 -2.623 0.975 -6.399 76 HA3 GLY 12 HA1 GLY 12 -1.289 0.919 -5.254 77 H VAL 13 HN VAL 13 -1.852 -0.174 -3.138 78 HA VAL 13 HA VAL 13 -4.019 -1.978 -3.020 79 HB VAL 13 HB VAL 13 -2.875 -3.357 -4.583 80 HG11 VAL 13 HG11 VAL 13 -0.605 -4.070 -4.441 81 HG12 VAL 13 HG12 VAL 13 -0.400 -3.289 -2.877 82 HG13 VAL 13 HG13 VAL 13 -0.634 -2.311 -4.325 83 HG21 VAL 13 HG21 VAL 13 -2.391 -4.417 -1.805 84 HG22 VAL 13 HG22 VAL 13 -2.405 -5.387 -3.280 85 HG23 VAL 13 HG23 VAL 13 -3.874 -4.568 -2.748 86 H GLY 14 HN GLY 14 -0.621 -2.062 -1.829 87 HA2 GLY 14 HA2 GLY 14 0.166 -1.556 0.287 88 HA3 GLY 14 HA1 GLY 14 -1.462 -1.075 0.743 89 H HIS 15 HN HIS 15 0.814 -2.994 1.742 90 HA HIS 15 HA HIS 15 -0.968 -4.866 2.970 91 HB2 HIS 15 HB2 HIS 15 -0.530 -5.857 0.675 92 HB3 HIS 15 HB1 HIS 15 1.156 -6.021 1.154 93 HD1 HIS 15 HD1 HIS 15 1.766 -8.068 2.475 94 HD2 HIS 15 HD2 HIS 15 -2.340 -7.472 2.246 95 HE1 HIS 15 HE1 HIS 15 0.726 -10.133 3.458 96 HE2 HIS 15 HE2 HIS 15 -1.746 -9.838 3.095 Start of MODEL 3 1 H1 ALA 1 HT1 ALA 1 5.658 3.160 0.742 2 H2 ALA 1 HT2 ALA 1 6.312 3.449 2.276 3 H3 ALA 1 HT3 ALA 1 6.311 1.882 1.641 4 HA ALA 1 HA ALA 1 7.807 4.190 0.547 5 HB1 ALA 1 HB1 ALA 1 9.807 3.061 1.334 6 HB2 ALA 1 HB2 ALA 1 8.830 1.756 2.005 7 HB3 ALA 1 HB3 ALA 1 8.715 3.381 2.681 8 H PHE 2 HN PHE 2 8.332 0.681 0.554 9 HA PHE 2 HA PHE 2 8.926 0.593 -2.227 10 HB2 PHE 2 HB2 PHE 2 8.166 -1.702 -0.402 11 HB3 PHE 2 HB1 PHE 2 9.004 -1.827 -1.943 12 HD1 PHE 2 HD1 PHE 2 11.342 -1.215 -2.142 13 HD2 PHE 2 HD2 PHE 2 9.314 -0.998 1.591 14 HE1 PHE 2 HE1 PHE 2 13.505 -1.046 -0.981 15 HE2 PHE 2 HE2 PHE 2 11.471 -0.829 2.756 16 HZ PHE 2 HZ PHE 2 13.570 -0.890 1.478 17 H GLN 3 HN GLN 3 6.171 -0.132 -0.239 18 HA GLN 3 HA GLN 3 4.477 -0.702 -2.538 19 HB2 GLN 3 HB2 GLN 3 2.824 -1.360 -0.834 20 HB3 GLN 3 HB1 GLN 3 4.341 -2.213 -0.615 21 HG2 GLN 3 HG2 GLN 3 3.527 0.214 0.965 22 HG3 GLN 3 HG1 GLN 3 3.260 -1.441 1.473 23 HE21 GLN 3 HE21 GLN 3 5.012 -2.725 2.062 24 HE22 GLN 3 HE22 GLN 3 6.531 -2.027 2.508 25 HA HZP 4 HA HZP 4 2.603 3.332 -2.567 26 HB HZP 4 HB2 HZP 4 -0.052 2.688 -2.914 27 HBA HZP 4 HB1 HZP 4 1.151 2.671 -4.219 28 HG HZP 4 HG1 HZP 4 0.409 0.489 -4.355 29 HD HZP 4 HD3 HZP 4 2.701 0.176 -4.054 30 HDA HZP 4 HD2 HZP 4 2.109 -0.724 -2.643 31 HOD1 HZP 4 HG2 HZP 4 0.378 -0.208 -1.712 32 H THR 5 HN THR 5 3.166 3.523 -0.312 33 HA THR 5 HA THR 5 2.815 4.208 1.782 34 HB THR 5 HB THR 5 0.661 5.240 2.407 35 HG1 THR 5 HG1 THR 5 -0.229 3.805 0.249 36 HG21 THR 5 HG21 THR 5 1.680 6.011 -0.323 37 HG22 THR 5 HG22 THR 5 2.346 6.538 1.222 38 HG23 THR 5 HG23 THR 5 0.722 7.035 0.746 39 H THR 6 HN THR 6 0.915 3.954 3.664 40 HA THR 6 HA THR 6 1.414 1.525 4.796 41 HB THR 6 HB THR 6 0.631 3.276 6.172 42 HG1 THR 6 HG1 THR 6 -0.173 1.048 6.639 43 HG21 THR 6 HG21 THR 6 -1.914 3.262 4.554 44 HG22 THR 6 HG22 THR 6 -0.678 4.520 4.561 45 HG23 THR 6 HG23 THR 6 -1.638 4.220 6.008 46 HA PRO 7 HA PRO 7 -1.026 -1.322 2.273 47 HB2 PRO 7 HB2 PRO 7 -0.047 -3.073 4.479 48 HB3 PRO 7 HB1 PRO 7 -0.033 -3.347 2.732 49 HG2 PRO 7 HG2 PRO 7 2.209 -2.690 3.945 50 HG3 PRO 7 HG1 PRO 7 1.785 -1.924 2.398 51 HD2 PRO 7 HD2 PRO 7 1.536 -0.823 5.179 52 HD3 PRO 7 HD1 PRO 7 2.134 -0.031 3.706 53 H GLY 8 HN GLY 8 -2.872 -2.604 2.603 54 HA2 GLY 8 HA2 GLY 8 -4.693 -3.418 3.881 55 HA3 GLY 8 HA1 GLY 8 -4.231 -2.332 5.183 56 H ASN 9 HN ASN 9 -3.932 -0.013 3.625 57 HA ASN 9 HA ASN 9 -6.660 0.495 2.663 58 HB2 ASN 9 HB2 ASN 9 -6.646 2.664 3.891 59 HB3 ASN 9 HB1 ASN 9 -6.628 1.269 4.964 60 HD21 ASN 9 HD21 ASN 9 -4.751 0.794 6.127 61 HD22 ASN 9 HD22 ASN 9 -3.495 1.964 6.346 62 H SER 10 HN SER 10 -4.047 0.081 1.402 63 HA SER 10 HA SER 10 -3.032 2.608 0.541 64 HB2 SER 10 HB2 SER 10 -2.503 0.006 -0.852 65 HB3 SER 10 HB1 SER 10 -1.410 1.364 -0.582 66 HG SER 10 HG SER 10 -1.547 0.814 1.700 67 HA HZP 11 HA HZP 11 -5.622 2.957 -3.076 68 HB HZP 11 HB2 HZP 11 -4.234 4.969 -4.308 69 HBA HZP 11 HB1 HZP 11 -5.294 5.226 -2.912 70 HG HZP 11 HG1 HZP 11 -3.480 5.958 -1.801 71 HD HZP 11 HD3 HZP 11 -2.898 4.216 -0.515 72 HDA HZP 11 HD2 HZP 11 -1.885 3.564 -1.817 73 HOD1 HZP 11 HG2 HZP 11 -1.329 5.013 -2.969 74 H GLY 12 HN GLY 12 -4.572 0.719 -3.596 75 HA2 GLY 12 HA2 GLY 12 -4.136 0.423 -6.243 76 HA3 GLY 12 HA1 GLY 12 -2.524 0.778 -5.641 77 H VAL 13 HN VAL 13 -1.934 -0.592 -3.637 78 HA VAL 13 HA VAL 13 -2.519 -3.377 -4.332 79 HB VAL 13 HB VAL 13 -0.364 -2.229 -2.546 80 HG11 VAL 13 HG11 VAL 13 -1.027 -4.487 -1.864 81 HG12 VAL 13 HG12 VAL 13 0.595 -4.469 -2.554 82 HG13 VAL 13 HG13 VAL 13 -0.762 -5.058 -3.511 83 HG21 VAL 13 HG21 VAL 13 -0.040 -1.682 -4.903 84 HG22 VAL 13 HG22 VAL 13 -0.207 -3.385 -5.327 85 HG23 VAL 13 HG23 VAL 13 1.162 -2.850 -4.355 86 H GLY 14 HN GLY 14 -1.819 -1.746 -1.226 87 HA2 GLY 14 HA2 GLY 14 -3.032 -1.668 0.727 88 HA3 GLY 14 HA1 GLY 14 -4.440 -2.123 -0.216 89 H HIS 15 HN HIS 15 -1.404 -3.836 0.466 90 HA HIS 15 HA HIS 15 -2.688 -5.627 2.295 91 HB2 HIS 15 HB2 HIS 15 -3.444 -6.620 0.171 92 HB3 HIS 15 HB1 HIS 15 -1.774 -6.726 -0.376 93 HD1 HIS 15 HD1 HIS 15 -4.162 -8.255 2.102 94 HD2 HIS 15 HD2 HIS 15 -0.349 -8.912 0.583 95 HE1 HIS 15 HE1 HIS 15 -3.471 -10.513 2.963 96 HE2 HIS 15 HE2 HIS 15 -1.188 -10.918 1.980 Start of MODEL 4 1 H1 ALA 1 HT1 ALA 1 8.427 2.290 0.698 2 H2 ALA 1 HT2 ALA 1 8.937 2.101 2.300 3 H3 ALA 1 HT3 ALA 1 7.548 1.304 1.756 4 HA ALA 1 HA ALA 1 10.312 0.812 0.828 5 HB1 ALA 1 HB1 ALA 1 8.498 -0.902 2.521 6 HB2 ALA 1 HB2 ALA 1 9.907 -0.011 3.095 7 HB3 ALA 1 HB3 ALA 1 10.110 -1.340 1.954 8 H PHE 2 HN PHE 2 7.259 -1.027 0.996 9 HA PHE 2 HA PHE 2 7.341 -1.264 -1.939 10 HB2 PHE 2 HB2 PHE 2 6.731 -3.481 0.030 11 HB3 PHE 2 HB1 PHE 2 6.522 -3.603 -1.712 12 HD1 PHE 2 HD1 PHE 2 8.604 -3.247 -3.167 13 HD2 PHE 2 HD2 PHE 2 8.758 -4.041 1.010 14 HE1 PHE 2 HE1 PHE 2 10.935 -3.995 -3.395 15 HE2 PHE 2 HE2 PHE 2 11.090 -4.786 0.788 16 HZ PHE 2 HZ PHE 2 12.183 -4.763 -1.415 17 H GLN 3 HN GLN 3 5.871 0.438 -0.027 18 HA GLN 3 HA GLN 3 3.157 -0.252 -0.903 19 HB2 GLN 3 HB2 GLN 3 2.209 0.250 1.179 20 HB3 GLN 3 HB1 GLN 3 3.647 -0.662 1.605 21 HG2 GLN 3 HG2 GLN 3 3.692 2.327 1.531 22 HG3 GLN 3 HG1 GLN 3 3.061 1.476 2.928 23 HE21 GLN 3 HE21 GLN 3 4.649 2.234 4.287 24 HE22 GLN 3 HE22 GLN 3 6.294 1.706 4.194 25 HA HZP 4 HA HZP 4 3.175 3.946 -2.393 26 HB HZP 4 HB2 HZP 4 0.494 4.358 -2.593 27 HBA HZP 4 HB1 HZP 4 1.380 3.300 -3.710 28 HG HZP 4 HG1 HZP 4 -0.213 1.806 -2.934 29 HD HZP 4 HD3 HZP 4 1.689 0.617 -2.442 30 HDA HZP 4 HD2 HZP 4 1.086 0.799 -0.781 31 HOD1 HZP 4 HG2 HZP 4 -0.297 2.121 -0.299 32 H THR 5 HN THR 5 3.850 4.040 0.133 33 HA THR 5 HA THR 5 3.853 5.147 2.084 34 HB THR 5 HB THR 5 3.016 7.470 2.141 35 HG1 THR 5 HG1 THR 5 1.492 6.599 0.079 36 HG21 THR 5 HG21 THR 5 5.220 6.855 1.132 37 HG22 THR 5 HG22 THR 5 4.532 8.359 0.522 38 HG23 THR 5 HG23 THR 5 4.441 6.892 -0.449 39 H THR 6 HN THR 6 1.755 3.274 1.607 40 HA THR 6 HA THR 6 0.399 3.396 3.994 41 HB THR 6 HB THR 6 -0.876 5.285 3.258 42 HG1 THR 6 HG1 THR 6 -2.058 3.619 4.345 43 HG21 THR 6 HG21 THR 6 -0.565 5.097 0.848 44 HG22 THR 6 HG22 THR 6 -2.275 5.268 1.244 45 HG23 THR 6 HG23 THR 6 -1.623 3.688 0.810 46 HA PRO 7 HA PRO 7 -0.086 -0.670 2.068 47 HB2 PRO 7 HB2 PRO 7 0.249 -1.767 4.707 48 HB3 PRO 7 HB1 PRO 7 1.353 -1.858 3.335 49 HG2 PRO 7 HG2 PRO 7 1.877 -0.459 5.629 50 HG3 PRO 7 HG1 PRO 7 2.588 -0.093 4.049 51 HD2 PRO 7 HD2 PRO 7 0.282 1.221 5.442 52 HD3 PRO 7 HD1 PRO 7 1.603 1.957 4.506 53 H GLY 8 HN GLY 8 -1.327 -2.679 3.234 54 HA2 GLY 8 HA2 GLY 8 -3.234 -3.429 4.345 55 HA3 GLY 8 HA1 GLY 8 -3.678 -1.762 4.684 56 H ASN 9 HN ASN 9 -2.901 -1.785 1.531 57 HA ASN 9 HA ASN 9 -4.028 -1.708 -0.433 58 HB2 ASN 9 HB2 ASN 9 -4.248 -4.164 0.026 59 HB3 ASN 9 HB1 ASN 9 -5.807 -3.843 0.773 60 HD21 ASN 9 HD21 ASN 9 -4.037 -4.049 -2.192 61 HD22 ASN 9 HD22 ASN 9 -5.398 -3.961 -3.255 62 H SER 10 HN SER 10 -4.659 0.446 0.447 63 HA SER 10 HA SER 10 -7.567 0.581 0.816 64 HB2 SER 10 HB2 SER 10 -5.531 2.617 1.748 65 HB3 SER 10 HB1 SER 10 -7.265 2.654 2.047 66 HG SER 10 HG SER 10 -6.864 0.498 3.058 67 HA HZP 11 HA HZP 11 -6.797 3.928 -2.380 68 HB HZP 11 HB2 HZP 11 -4.412 4.948 -2.938 69 HBA HZP 11 HB1 HZP 11 -5.169 5.282 -1.366 70 HG HZP 11 HG1 HZP 11 -3.208 4.394 -0.562 71 HD HZP 11 HD3 HZP 11 -4.292 2.694 0.443 72 HDA HZP 11 HD2 HZP 11 -3.830 1.662 -0.924 73 HOD1 HZP 11 HG2 HZP 11 -1.831 3.255 -1.800 74 H GLY 12 HN GLY 12 -5.840 0.971 -2.713 75 HA2 GLY 12 HA2 GLY 12 -6.200 0.328 -5.198 76 HA3 GLY 12 HA1 GLY 12 -4.679 1.184 -5.399 77 H VAL 13 HN VAL 13 -3.044 0.404 -3.536 78 HA VAL 13 HA VAL 13 -3.170 -2.504 -3.274 79 HB VAL 13 HB VAL 13 -1.950 -1.899 -5.412 80 HG11 VAL 13 HG11 VAL 13 -0.810 0.096 -4.620 81 HG12 VAL 13 HG12 VAL 13 0.340 -1.087 -5.239 82 HG13 VAL 13 HG13 VAL 13 0.141 -0.877 -3.500 83 HG21 VAL 13 HG21 VAL 13 -0.394 -3.399 -3.311 84 HG22 VAL 13 HG22 VAL 13 -0.130 -3.498 -5.051 85 HG23 VAL 13 HG23 VAL 13 -1.648 -4.064 -4.356 86 H GLY 14 HN GLY 14 -1.437 -3.319 -1.790 87 HA2 GLY 14 HA2 GLY 14 0.387 -2.166 -0.290 88 HA3 GLY 14 HA1 GLY 14 -1.046 -1.401 0.383 89 H HIS 15 HN HIS 15 0.816 -3.180 1.743 90 HA HIS 15 HA HIS 15 -1.125 -5.047 2.792 91 HB2 HIS 15 HB2 HIS 15 -0.062 -6.252 0.855 92 HB3 HIS 15 HB1 HIS 15 1.482 -6.114 1.686 93 HD1 HIS 15 HD1 HIS 15 1.868 -7.645 3.734 94 HD2 HIS 15 HD2 HIS 15 -1.825 -8.157 1.900 95 HE1 HIS 15 HE1 HIS 15 0.924 -9.763 4.696 96 HE2 HIS 15 HE2 HIS 15 -1.227 -10.141 3.441 Start of MODEL 5 1 H1 ALA 1 HT1 ALA 1 7.786 3.921 -2.014 2 H2 ALA 1 HT2 ALA 1 8.179 4.810 -0.631 3 H3 ALA 1 HT3 ALA 1 7.135 3.482 -0.517 4 HA ALA 1 HA ALA 1 10.001 3.399 -1.243 5 HB1 ALA 1 HB1 ALA 1 10.355 2.314 0.876 6 HB2 ALA 1 HB2 ALA 1 8.629 2.354 1.228 7 HB3 ALA 1 HB3 ALA 1 9.546 3.857 1.145 8 H PHE 2 HN PHE 2 7.537 1.176 0.077 9 HA PHE 2 HA PHE 2 8.333 -0.749 -2.010 10 HB2 PHE 2 HB2 PHE 2 7.217 -1.319 0.749 11 HB3 PHE 2 HB1 PHE 2 7.634 -2.531 -0.456 12 HD1 PHE 2 HD1 PHE 2 10.005 -2.885 -1.077 13 HD2 PHE 2 HD2 PHE 2 8.861 -0.332 2.129 14 HE1 PHE 2 HE1 PHE 2 12.301 -2.965 -0.198 15 HE2 PHE 2 HE2 PHE 2 11.156 -0.411 3.014 16 HZ PHE 2 HZ PHE 2 12.871 -1.744 1.860 17 H GLN 3 HN GLN 3 5.581 -0.510 0.208 18 HA GLN 3 HA GLN 3 3.759 -0.835 -2.046 19 HB2 GLN 3 HB2 GLN 3 2.048 -1.213 -0.302 20 HB3 GLN 3 HB1 GLN 3 3.386 -2.341 -0.177 21 HG2 GLN 3 HG2 GLN 3 3.025 0.112 1.533 22 HG3 GLN 3 HG1 GLN 3 2.557 -1.514 1.982 23 HE21 GLN 3 HE21 GLN 3 4.167 -3.053 2.434 24 HE22 GLN 3 HE22 GLN 3 5.782 -2.570 2.825 25 HA HZP 4 HA HZP 4 2.674 3.445 -2.118 26 HB HZP 4 HB2 HZP 4 -0.029 3.184 -2.708 27 HBA HZP 4 HB1 HZP 4 1.283 3.160 -3.900 28 HG HZP 4 HG1 HZP 4 0.440 1.083 -4.353 29 HD HZP 4 HD3 HZP 4 2.526 0.375 -3.729 30 HDA HZP 4 HD2 HZP 4 1.597 -0.471 -2.474 31 HOD1 HZP 4 HG2 HZP 4 -0.289 -0.038 -2.094 32 H THR 5 HN THR 5 3.018 3.675 0.112 33 HA THR 5 HA THR 5 2.539 4.612 2.089 34 HB THR 5 HB THR 5 0.457 5.655 2.588 35 HG1 THR 5 HG1 THR 5 -0.565 3.808 0.773 36 HG21 THR 5 HG21 THR 5 0.995 5.887 -0.370 37 HG22 THR 5 HG22 THR 5 1.820 6.778 0.909 38 HG23 THR 5 HG23 THR 5 0.104 7.052 0.610 39 H THR 6 HN THR 6 0.543 4.298 3.929 40 HA THR 6 HA THR 6 1.245 1.961 5.187 41 HB THR 6 HB THR 6 -0.895 2.288 6.530 42 HG1 THR 6 HG1 THR 6 -2.334 3.551 5.645 43 HG21 THR 6 HG21 THR 6 0.983 4.629 6.193 44 HG22 THR 6 HG22 THR 6 1.237 3.231 7.238 45 HG23 THR 6 HG23 THR 6 -0.075 4.359 7.576 46 HA PRO 7 HA PRO 7 -0.862 -1.272 2.884 47 HB2 PRO 7 HB2 PRO 7 -0.331 -2.680 5.452 48 HB3 PRO 7 HB1 PRO 7 0.010 -3.192 3.795 49 HG2 PRO 7 HG2 PRO 7 1.974 -2.341 5.360 50 HG3 PRO 7 HG1 PRO 7 1.918 -1.890 3.645 51 HD2 PRO 7 HD2 PRO 7 1.219 -0.263 6.056 52 HD3 PRO 7 HD1 PRO 7 2.041 0.231 4.562 53 H GLY 8 HN GLY 8 -2.793 -2.481 3.096 54 HA2 GLY 8 HA2 GLY 8 -4.821 -3.075 4.149 55 HA3 GLY 8 HA1 GLY 8 -4.496 -1.874 5.393 56 H ASN 9 HN ASN 9 -5.473 -2.334 2.048 57 HA ASN 9 HA ASN 9 -6.923 -1.195 0.721 58 HB2 ASN 9 HB2 ASN 9 -7.567 0.294 3.275 59 HB3 ASN 9 HB1 ASN 9 -8.387 0.590 1.746 60 HD21 ASN 9 HD21 ASN 9 -7.984 -1.584 4.410 61 HD22 ASN 9 HD22 ASN 9 -9.308 -2.626 4.024 62 H SER 10 HN SER 10 -4.287 -0.610 0.689 63 HA SER 10 HA SER 10 -3.771 2.199 0.820 64 HB2 SER 10 HB2 SER 10 -2.143 0.121 -0.649 65 HB3 SER 10 HB1 SER 10 -1.583 1.628 0.074 66 HG SER 10 HG SER 10 -1.757 0.764 2.068 67 HA HZP 11 HA HZP 11 -5.141 3.486 -3.239 68 HB HZP 11 HB2 HZP 11 -3.007 5.197 -3.772 69 HBA HZP 11 HB1 HZP 11 -4.475 5.647 -2.883 70 HG HZP 11 HG1 HZP 11 -2.924 6.107 -1.252 71 HD HZP 11 HD3 HZP 11 -4.200 4.505 -0.140 72 HDA HZP 11 HD2 HZP 11 -2.609 3.719 -0.057 73 HOD1 HZP 11 HG2 HZP 11 -1.198 4.047 -1.453 74 H GLY 12 HN GLY 12 -4.816 1.528 -4.344 75 HA2 GLY 12 HA2 GLY 12 -3.649 0.956 -6.482 76 HA3 GLY 12 HA1 GLY 12 -2.155 1.194 -5.583 77 H VAL 13 HN VAL 13 -1.933 -0.175 -3.590 78 HA VAL 13 HA VAL 13 -3.464 -2.566 -3.361 79 HB VAL 13 HB VAL 13 -2.208 -3.259 -5.318 80 HG11 VAL 13 HG11 VAL 13 -0.287 -1.788 -5.141 81 HG12 VAL 13 HG12 VAL 13 0.236 -3.466 -5.293 82 HG13 VAL 13 HG13 VAL 13 0.281 -2.667 -3.721 83 HG21 VAL 13 HG21 VAL 13 -1.197 -4.604 -2.815 84 HG22 VAL 13 HG22 VAL 13 -1.159 -5.295 -4.436 85 HG23 VAL 13 HG23 VAL 13 -2.705 -4.960 -3.657 86 H GLY 14 HN GLY 14 -3.467 -3.011 -1.253 87 HA2 GLY 14 HA2 GLY 14 -1.017 -2.943 0.289 88 HA3 GLY 14 HA1 GLY 14 -2.181 -1.694 0.710 89 H HIS 15 HN HIS 15 -1.071 -4.331 1.932 90 HA HIS 15 HA HIS 15 -3.617 -5.010 3.180 91 HB2 HIS 15 HB2 HIS 15 -1.800 -7.040 1.870 92 HB3 HIS 15 HB1 HIS 15 -3.005 -7.471 3.077 93 HD1 HIS 15 HD1 HIS 15 -2.601 -6.593 -0.495 94 HD2 HIS 15 HD2 HIS 15 -5.701 -7.228 2.195 95 HE1 HIS 15 HE1 HIS 15 -4.671 -6.844 -1.899 96 HE2 HIS 15 HE2 HIS 15 -6.492 -7.423 -0.261 Start of MODEL 6 1 H1 ALA 1 HT1 ALA 1 8.914 2.137 1.531 2 H2 ALA 1 HT2 ALA 1 8.132 0.646 1.678 3 H3 ALA 1 HT3 ALA 1 7.267 2.007 1.187 4 HA ALA 1 HA ALA 1 8.483 2.138 -0.848 5 HB1 ALA 1 HB1 ALA 1 9.923 -0.321 0.140 6 HB2 ALA 1 HB2 ALA 1 10.614 1.296 0.010 7 HB3 ALA 1 HB3 ALA 1 10.117 0.430 -1.444 8 H PHE 2 HN PHE 2 8.070 0.726 -2.717 9 HA PHE 2 HA PHE 2 6.801 -0.635 -3.988 10 HB2 PHE 2 HB2 PHE 2 6.373 -2.219 -1.450 11 HB3 PHE 2 HB1 PHE 2 5.954 -2.757 -3.072 12 HD1 PHE 2 HD1 PHE 2 7.910 -2.820 -4.787 13 HD2 PHE 2 HD2 PHE 2 8.430 -2.763 -0.563 14 HE1 PHE 2 HE1 PHE 2 10.165 -3.765 -5.055 15 HE2 PHE 2 HE2 PHE 2 10.686 -3.706 -0.826 16 HZ PHE 2 HZ PHE 2 11.556 -4.208 -3.073 17 H GLN 3 HN GLN 3 4.969 -0.924 -0.961 18 HA GLN 3 HA GLN 3 2.551 -0.163 -2.329 19 HB2 GLN 3 HB2 GLN 3 1.524 -0.448 -0.043 20 HB3 GLN 3 HB1 GLN 3 2.301 -1.878 -0.703 21 HG2 GLN 3 HG2 GLN 3 4.285 -1.396 0.685 22 HG3 GLN 3 HG1 GLN 3 3.424 -0.028 1.391 23 HE21 GLN 3 HE21 GLN 3 4.471 -2.495 2.616 24 HE22 GLN 3 HE22 GLN 3 3.116 -3.223 3.411 25 HA HZP 4 HA HZP 4 3.111 4.159 -1.464 26 HB HZP 4 HB2 HZP 4 0.645 4.974 -2.332 27 HBA HZP 4 HB1 HZP 4 1.994 4.600 -3.421 28 HG HZP 4 HG1 HZP 4 0.463 3.123 -4.275 29 HD HZP 4 HD3 HZP 4 2.032 1.533 -3.721 30 HDA HZP 4 HD2 HZP 4 0.784 0.989 -2.582 31 HOD1 HZP 4 HG2 HZP 4 -0.726 2.133 -2.036 32 H THR 5 HN THR 5 3.083 3.457 0.818 33 HA THR 5 HA THR 5 2.525 3.775 2.963 34 HB THR 5 HB THR 5 1.102 5.726 3.555 35 HG1 THR 5 HG1 THR 5 0.291 5.468 0.991 36 HG21 THR 5 HG21 THR 5 3.227 6.244 1.480 37 HG22 THR 5 HG22 THR 5 3.496 5.990 3.204 38 HG23 THR 5 HG23 THR 5 2.622 7.417 2.650 39 H THR 6 HN THR 6 0.420 4.258 4.438 40 HA THR 6 HA THR 6 -1.141 3.020 5.530 41 HB THR 6 HB THR 6 -2.505 4.691 4.588 42 HG1 THR 6 HG1 THR 6 -3.658 2.121 4.193 43 HG21 THR 6 HG21 THR 6 -1.701 4.479 2.246 44 HG22 THR 6 HG22 THR 6 -3.445 4.686 2.385 45 HG23 THR 6 HG23 THR 6 -2.773 3.092 2.048 46 HA PRO 7 HA PRO 7 -0.404 -1.101 3.391 47 HB2 PRO 7 HB2 PRO 7 0.475 -1.629 6.188 48 HB3 PRO 7 HB1 PRO 7 1.190 -2.168 4.661 49 HG2 PRO 7 HG2 PRO 7 2.361 -0.236 6.025 50 HG3 PRO 7 HG1 PRO 7 2.199 -0.096 4.256 51 HD2 PRO 7 HD2 PRO 7 0.529 1.177 6.415 52 HD3 PRO 7 HD1 PRO 7 1.216 1.914 4.949 53 H GLY 8 HN GLY 8 -1.970 -2.567 3.405 54 HA2 GLY 8 HA2 GLY 8 -3.673 -3.825 4.695 55 HA3 GLY 8 HA1 GLY 8 -4.043 -2.295 5.486 56 H ASN 9 HN ASN 9 -4.060 -0.526 3.473 57 HA ASN 9 HA ASN 9 -5.392 -1.443 1.120 58 HB2 ASN 9 HB2 ASN 9 -7.261 -1.476 2.811 59 HB3 ASN 9 HB1 ASN 9 -7.037 0.258 3.009 60 HD21 ASN 9 HD21 ASN 9 -9.368 -1.190 2.093 61 HD22 ASN 9 HD22 ASN 9 -9.731 -0.588 0.514 62 H SER 10 HN SER 10 -4.126 -0.271 -0.188 63 HA SER 10 HA SER 10 -4.274 2.650 0.103 64 HB2 SER 10 HB2 SER 10 -1.957 2.887 -0.596 65 HB3 SER 10 HB1 SER 10 -2.011 1.808 0.795 66 HG SER 10 HG SER 10 -1.736 0.066 -0.564 67 HA HZP 11 HA HZP 11 -5.759 2.937 -4.039 68 HB HZP 11 HB2 HZP 11 -3.554 4.350 -5.206 69 HBA HZP 11 HB1 HZP 11 -5.110 5.013 -4.679 70 HG HZP 11 HG1 HZP 11 -3.896 6.106 -3.118 71 HD HZP 11 HD3 HZP 11 -4.856 4.718 -1.530 72 HDA HZP 11 HD2 HZP 11 -3.165 4.242 -1.285 73 HOD1 HZP 11 HG2 HZP 11 -1.772 4.514 -2.692 74 H GLY 12 HN GLY 12 -2.218 2.452 -4.057 75 HA2 GLY 12 HA2 GLY 12 -2.231 0.874 -6.432 76 HA3 GLY 12 HA1 GLY 12 -0.901 1.020 -5.290 77 H VAL 13 HN VAL 13 -1.123 -0.238 -3.253 78 HA VAL 13 HA VAL 13 -2.828 -2.607 -3.520 79 HB VAL 13 HB VAL 13 0.078 -2.772 -2.695 80 HG11 VAL 13 HG11 VAL 13 -1.332 -4.431 -1.612 81 HG12 VAL 13 HG12 VAL 13 -0.283 -5.197 -2.804 82 HG13 VAL 13 HG13 VAL 13 -1.984 -4.922 -3.175 83 HG21 VAL 13 HG21 VAL 13 0.474 -3.936 -4.795 84 HG22 VAL 13 HG22 VAL 13 -0.125 -2.304 -5.090 85 HG23 VAL 13 HG23 VAL 13 -1.206 -3.684 -5.265 86 H GLY 14 HN GLY 14 -0.258 -2.032 -1.173 87 HA2 GLY 14 HA2 GLY 14 -0.380 -1.416 1.063 88 HA3 GLY 14 HA1 GLY 14 -2.104 -1.131 0.865 89 H HIS 15 HN HIS 15 0.222 -3.157 2.170 90 HA HIS 15 HA HIS 15 -1.798 -4.983 3.114 91 HB2 HIS 15 HB2 HIS 15 -0.826 -7.026 2.293 92 HB3 HIS 15 HB1 HIS 15 -1.122 -5.979 0.913 93 HD1 HIS 15 HD1 HIS 15 1.300 -8.221 2.101 94 HD2 HIS 15 HD2 HIS 15 1.501 -4.464 0.338 95 HE1 HIS 15 HE1 HIS 15 3.626 -8.032 1.178 96 HE2 HIS 15 HE2 HIS 15 3.781 -5.683 0.290 Start of MODEL 7 1 H1 ALA 1 HT1 ALA 1 8.456 4.311 1.093 2 H2 ALA 1 HT2 ALA 1 8.238 2.709 1.581 3 H3 ALA 1 HT3 ALA 1 7.264 3.360 0.360 4 HA ALA 1 HA ALA 1 9.169 3.609 -1.077 5 HB1 ALA 1 HB1 ALA 1 10.828 3.899 0.723 6 HB2 ALA 1 HB2 ALA 1 11.320 2.700 -0.471 7 HB3 ALA 1 HB3 ALA 1 10.696 2.180 1.094 8 H PHE 2 HN PHE 2 9.267 0.687 0.992 9 HA PHE 2 HA PHE 2 9.209 -1.074 -1.223 10 HB2 PHE 2 HB2 PHE 2 8.631 -1.554 1.705 11 HB3 PHE 2 HB1 PHE 2 8.732 -2.836 0.504 12 HD1 PHE 2 HD1 PHE 2 10.888 -3.304 -0.615 13 HD2 PHE 2 HD2 PHE 2 10.580 -0.558 2.619 14 HE1 PHE 2 HE1 PHE 2 13.318 -3.442 -0.274 15 HE2 PHE 2 HE2 PHE 2 13.012 -0.688 2.964 16 HZ PHE 2 HZ PHE 2 14.383 -2.131 1.518 17 H GLN 3 HN GLN 3 6.725 -0.294 1.202 18 HA GLN 3 HA GLN 3 4.658 -1.467 -0.429 19 HB2 GLN 3 HB2 GLN 3 3.178 -0.910 1.391 20 HB3 GLN 3 HB1 GLN 3 4.644 -1.605 2.058 21 HG2 GLN 3 HG2 GLN 3 4.024 1.341 1.946 22 HG3 GLN 3 HG1 GLN 3 3.804 0.306 3.344 23 HE21 GLN 3 HE21 GLN 3 5.439 2.683 3.007 24 HE22 GLN 3 HE22 GLN 3 7.049 2.202 3.424 25 HA HZP 4 HA HZP 4 3.653 2.312 -2.599 26 HB HZP 4 HB2 HZP 4 1.085 1.696 -3.277 27 HBA HZP 4 HB1 HZP 4 2.487 0.971 -4.091 28 HG HZP 4 HG1 HZP 4 1.362 -0.941 -3.384 29 HD HZP 4 HD3 HZP 4 3.518 -1.247 -2.540 30 HDA HZP 4 HD2 HZP 4 2.596 -1.329 -1.021 31 HOD1 HZP 4 HG2 HZP 4 0.855 -0.333 -0.790 32 H THR 5 HN THR 5 3.797 3.432 -0.508 33 HA THR 5 HA THR 5 3.079 4.689 1.224 34 HB THR 5 HB THR 5 1.010 5.993 0.945 35 HG1 THR 5 HG1 THR 5 0.419 3.988 -0.830 36 HG21 THR 5 HG21 THR 5 2.652 5.775 -1.572 37 HG22 THR 5 HG22 THR 5 3.041 6.750 -0.155 38 HG23 THR 5 HG23 THR 5 1.625 7.139 -1.129 39 H THR 6 HN THR 6 0.548 5.020 2.382 40 HA THR 6 HA THR 6 0.312 3.121 4.268 41 HB THR 6 HB THR 6 -1.001 5.081 4.470 42 HG1 THR 6 HG1 THR 6 -3.176 4.120 4.759 43 HG21 THR 6 HG21 THR 6 -1.423 5.591 2.148 44 HG22 THR 6 HG22 THR 6 -2.956 5.546 3.021 45 HG23 THR 6 HG23 THR 6 -2.483 4.190 1.998 46 HA PRO 7 HA PRO 7 -0.809 -0.447 1.750 47 HB2 PRO 7 HB2 PRO 7 -0.299 -2.045 4.109 48 HB3 PRO 7 HB1 PRO 7 0.619 -1.969 2.606 49 HG2 PRO 7 HG2 PRO 7 1.557 -1.034 4.986 50 HG3 PRO 7 HG1 PRO 7 2.053 -0.393 3.411 51 HD2 PRO 7 HD2 PRO 7 0.077 0.711 5.370 52 HD3 PRO 7 HD1 PRO 7 1.288 1.559 4.384 53 H GLY 8 HN GLY 8 -1.946 -2.681 2.743 54 HA2 GLY 8 HA2 GLY 8 -3.894 -3.589 3.579 55 HA3 GLY 8 HA1 GLY 8 -4.200 -2.077 4.420 56 H ASN 9 HN ASN 9 -3.509 -2.048 1.047 57 HA ASN 9 HA ASN 9 -4.691 -1.469 -0.793 58 HB2 ASN 9 HB2 ASN 9 -6.871 -2.889 0.737 59 HB3 ASN 9 HB1 ASN 9 -7.100 -2.260 -0.891 60 HD21 ASN 9 HD21 ASN 9 -7.071 -5.004 0.274 61 HD22 ASN 9 HD22 ASN 9 -5.962 -5.886 -0.717 62 H SER 10 HN SER 10 -4.501 0.380 1.493 63 HA SER 10 HA SER 10 -6.908 1.824 1.749 64 HB2 SER 10 HB2 SER 10 -4.101 2.887 2.127 65 HB3 SER 10 HB1 SER 10 -5.586 3.561 2.790 66 HG SER 10 HG SER 10 -4.053 1.476 3.679 67 HA HZP 11 HA HZP 11 -5.551 4.538 -1.854 68 HB HZP 11 HB2 HZP 11 -3.142 4.219 -3.068 69 HBA HZP 11 HB1 HZP 11 -3.340 5.160 -1.579 70 HG HZP 11 HG1 HZP 11 -1.920 3.703 -0.599 71 HD HZP 11 HD3 HZP 11 -3.259 2.348 0.585 72 HDA HZP 11 HD2 HZP 11 -3.512 1.308 -0.828 73 HOD1 HZP 11 HG2 HZP 11 -1.031 2.072 -1.738 74 H GLY 12 HN GLY 12 -5.975 1.442 -1.848 75 HA2 GLY 12 HA2 GLY 12 -7.264 0.535 -3.745 76 HA3 GLY 12 HA1 GLY 12 -5.982 1.141 -4.785 77 H VAL 13 HN VAL 13 -3.809 0.361 -3.104 78 HA VAL 13 HA VAL 13 -4.004 -2.562 -3.109 79 HB VAL 13 HB VAL 13 -3.128 -1.738 -5.326 80 HG11 VAL 13 HG11 VAL 13 -1.874 0.180 -4.568 81 HG12 VAL 13 HG12 VAL 13 -0.812 -0.938 -5.426 82 HG13 VAL 13 HG13 VAL 13 -0.776 -0.863 -3.665 83 HG21 VAL 13 HG21 VAL 13 -1.233 -3.420 -3.694 84 HG22 VAL 13 HG22 VAL 13 -1.295 -3.345 -5.456 85 HG23 VAL 13 HG23 VAL 13 -2.663 -3.996 -4.552 86 H GLY 14 HN GLY 14 -2.019 -3.548 -2.041 87 HA2 GLY 14 HA2 GLY 14 0.009 -2.898 -0.704 88 HA3 GLY 14 HA1 GLY 14 -1.056 -1.750 0.094 89 H HIS 15 HN HIS 15 0.396 -3.723 1.477 90 HA HIS 15 HA HIS 15 -1.802 -5.419 2.427 91 HB2 HIS 15 HB2 HIS 15 -0.200 -7.245 2.867 92 HB3 HIS 15 HB1 HIS 15 -0.302 -6.856 1.157 93 HD1 HIS 15 HD1 HIS 15 2.085 -7.474 3.768 94 HD2 HIS 15 HD2 HIS 15 2.012 -5.144 0.328 95 HE1 HIS 15 HE1 HIS 15 4.489 -6.995 3.221 96 HE2 HIS 15 HE2 HIS 15 4.429 -5.714 1.057 Start of MODEL 8 1 H1 ALA 1 HT1 ALA 1 8.390 4.035 -1.492 2 H2 ALA 1 HT2 ALA 1 8.936 4.137 0.104 3 H3 ALA 1 HT3 ALA 1 7.404 3.504 -0.224 4 HA ALA 1 HA ALA 1 9.997 2.307 -0.999 5 HB1 ALA 1 HB1 ALA 1 7.939 1.391 1.010 6 HB2 ALA 1 HB2 ALA 1 9.505 2.106 1.391 7 HB3 ALA 1 HB3 ALA 1 9.426 0.542 0.583 8 H PHE 2 HN PHE 2 9.049 -0.313 -1.088 9 HA PHE 2 HA PHE 2 7.951 -0.417 -3.666 10 HB2 PHE 2 HB2 PHE 2 7.704 -2.846 -3.286 11 HB3 PHE 2 HB1 PHE 2 9.290 -2.252 -2.821 12 HD1 PHE 2 HD2 PHE 2 9.971 -2.214 -0.492 13 HD2 PHE 2 HD1 PHE 2 6.142 -3.670 -1.643 14 HE1 PHE 2 HE2 PHE 2 9.710 -3.268 1.716 15 HE2 PHE 2 HE1 PHE 2 5.877 -4.728 0.560 16 HZ PHE 2 HZ PHE 2 7.664 -4.529 2.243 17 H GLN 3 HN GLN 3 6.443 -0.421 -0.518 18 HA GLN 3 HA GLN 3 3.824 -0.691 -1.803 19 HB2 GLN 3 HB2 GLN 3 2.907 -1.270 0.267 20 HB3 GLN 3 HB1 GLN 3 4.489 -2.030 0.320 21 HG2 GLN 3 HG2 GLN 3 3.866 0.640 1.551 22 HG3 GLN 3 HG1 GLN 3 3.793 -0.878 2.422 23 HE21 GLN 3 HE21 GLN 3 5.451 1.442 2.913 24 HE22 GLN 3 HE22 GLN 3 7.090 0.895 2.838 25 HA HZP 4 HA HZP 4 3.154 3.714 -1.232 26 HB HZP 4 HB2 HZP 4 0.421 3.667 -1.462 27 HBA HZP 4 HB1 HZP 4 1.517 3.602 -2.858 28 HG HZP 4 HG1 HZP 4 0.325 1.655 -3.224 29 HD HZP 4 HD3 HZP 4 2.461 0.769 -3.160 30 HDA HZP 4 HD2 HZP 4 1.791 -0.107 -1.770 31 HOD1 HZP 4 HG2 HZP 4 0.227 0.539 -0.781 32 H THR 5 HN THR 5 3.863 2.838 1.038 33 HA THR 5 HA THR 5 3.807 3.390 3.206 34 HB THR 5 HB THR 5 2.260 5.017 4.097 35 HG1 THR 5 HG1 THR 5 0.693 4.204 1.960 36 HG21 THR 5 HG21 THR 5 4.112 5.736 2.593 37 HG22 THR 5 HG22 THR 5 2.752 6.860 2.643 38 HG23 THR 5 HG23 THR 5 2.954 5.777 1.263 39 H THR 6 HN THR 6 1.922 3.488 5.145 40 HA THR 6 HA THR 6 1.609 0.958 5.984 41 HB THR 6 HB THR 6 1.163 2.748 7.482 42 HG1 THR 6 HG1 THR 6 -1.417 1.727 7.444 43 HG21 THR 6 HG21 THR 6 0.180 4.354 5.937 44 HG22 THR 6 HG22 THR 6 -0.849 4.148 7.354 45 HG23 THR 6 HG23 THR 6 -1.284 3.375 5.829 46 HA PRO 7 HA PRO 7 -1.030 -0.536 2.727 47 HB2 PRO 7 HB2 PRO 7 -0.561 -3.189 3.879 48 HB3 PRO 7 HB1 PRO 7 -0.094 -2.547 2.299 49 HG2 PRO 7 HG2 PRO 7 1.727 -3.020 4.211 50 HG3 PRO 7 HG1 PRO 7 1.874 -1.653 3.088 51 HD2 PRO 7 HD2 PRO 7 0.864 -1.667 5.917 52 HD3 PRO 7 HD1 PRO 7 2.008 -0.555 5.132 53 H GLY 8 HN GLY 8 -2.890 0.470 3.892 54 HA2 GLY 8 HA2 GLY 8 -4.619 -1.460 5.213 55 HA3 GLY 8 HA1 GLY 8 -5.034 0.193 4.772 56 H ASN 9 HN ASN 9 -3.928 -0.290 2.072 57 HA ASN 9 HA ASN 9 -4.384 -1.125 0.024 58 HB2 ASN 9 HB2 ASN 9 -5.916 -3.172 1.607 59 HB3 ASN 9 HB1 ASN 9 -5.933 -3.156 -0.153 60 HD21 ASN 9 HD21 ASN 9 -4.096 -3.726 -1.279 61 HD22 ASN 9 HD22 ASN 9 -2.736 -4.482 -0.524 62 H SER 10 HN SER 10 -5.351 0.777 -0.595 63 HA SER 10 HA SER 10 -8.187 0.417 -1.134 64 HB2 SER 10 HB2 SER 10 -7.069 2.939 0.100 65 HB3 SER 10 HB1 SER 10 -8.702 2.769 -0.539 66 HG SER 10 HG SER 10 -8.207 0.735 1.116 67 HA HZP 11 HA HZP 11 -6.482 3.206 -4.550 68 HB HZP 11 HB2 HZP 11 -4.141 4.471 -4.412 69 HBA HZP 11 HB1 HZP 11 -5.536 5.076 -3.493 70 HG HZP 11 HG1 HZP 11 -4.025 4.864 -1.760 71 HD HZP 11 HD3 HZP 11 -5.581 3.505 -0.803 72 HDA HZP 11 HD2 HZP 11 -4.459 2.182 -1.171 73 HOD1 HZP 11 HG2 HZP 11 -2.244 3.690 -1.921 74 H GLY 12 HN GLY 12 -4.790 0.736 -3.160 75 HA2 GLY 12 HA2 GLY 12 -4.014 -0.594 -5.433 76 HA3 GLY 12 HA1 GLY 12 -2.633 0.405 -4.997 77 H VAL 13 HN VAL 13 -1.197 -1.063 -4.235 78 HA VAL 13 HA VAL 13 -2.098 -3.235 -2.547 79 HB VAL 13 HB VAL 13 0.279 -3.948 -2.539 80 HG11 VAL 13 HG11 VAL 13 -0.903 -3.379 -5.251 81 HG12 VAL 13 HG12 VAL 13 -1.251 -4.775 -4.230 82 HG13 VAL 13 HG13 VAL 13 0.360 -4.559 -4.913 83 HG21 VAL 13 HG21 VAL 13 1.856 -2.837 -4.079 84 HG22 VAL 13 HG22 VAL 13 1.386 -1.800 -2.734 85 HG23 VAL 13 HG23 VAL 13 0.679 -1.551 -4.327 86 H GLY 14 HN GLY 14 -2.681 -0.920 -1.265 87 HA2 GLY 14 HA2 GLY 14 -2.003 -1.273 1.280 88 HA3 GLY 14 HA1 GLY 14 -0.585 -0.419 0.690 89 H HIS 15 HN HIS 15 -1.115 1.200 2.235 90 HA HIS 15 HA HIS 15 -1.920 3.184 2.934 91 HB2 HIS 15 HB2 HIS 15 -1.371 3.839 0.586 92 HB3 HIS 15 HB1 HIS 15 -3.043 3.503 0.148 93 HD1 HIS 15 HD1 HIS 15 -4.780 5.272 0.707 94 HD2 HIS 15 HD2 HIS 15 -1.025 6.116 2.274 95 HE1 HIS 15 HE1 HIS 15 -4.912 7.638 1.539 96 HE2 HIS 15 HE2 HIS 15 -2.585 8.177 2.333 Start of MODEL 9 1 H1 ALA 1 HT1 ALA 1 8.043 3.887 2.268 2 H2 ALA 1 HT2 ALA 1 8.043 2.199 2.224 3 H3 ALA 1 HT3 ALA 1 6.898 3.067 1.335 4 HA ALA 1 HA ALA 1 8.588 3.975 -0.075 5 HB1 ALA 1 HB1 ALA 1 10.367 4.036 1.613 6 HB2 ALA 1 HB2 ALA 1 10.899 3.269 0.118 7 HB3 ALA 1 HB3 ALA 1 10.501 2.280 1.524 8 H PHE 2 HN PHE 2 9.286 0.663 1.064 9 HA PHE 2 HA PHE 2 9.281 -0.473 -1.515 10 HB2 PHE 2 HB2 PHE 2 8.833 -1.776 1.180 11 HB3 PHE 2 HB1 PHE 2 9.144 -2.647 -0.315 12 HD1 PHE 2 HD1 PHE 2 11.352 -2.603 -1.343 13 HD2 PHE 2 HD2 PHE 2 10.594 -0.616 2.343 14 HE1 PHE 2 HE1 PHE 2 13.771 -2.431 -0.943 15 HE2 PHE 2 HE2 PHE 2 13.013 -0.443 2.750 16 HZ PHE 2 HZ PHE 2 14.606 -1.349 1.105 17 H GLN 3 HN GLN 3 6.841 -0.568 1.067 18 HA GLN 3 HA GLN 3 4.812 -1.556 -0.709 19 HB2 GLN 3 HB2 GLN 3 3.292 -1.182 1.226 20 HB3 GLN 3 HB1 GLN 3 4.689 -2.171 1.626 21 HG2 GLN 3 HG2 GLN 3 5.729 0.041 2.426 22 HG3 GLN 3 HG1 GLN 3 4.081 0.647 2.416 23 HE21 GLN 3 HE21 GLN 3 4.080 0.919 4.651 24 HE22 GLN 3 HE22 GLN 3 3.982 -0.424 5.736 25 HA HZP 4 HA HZP 4 3.802 2.278 -2.577 26 HB HZP 4 HB2 HZP 4 1.224 1.701 -3.332 27 HBA HZP 4 HB1 HZP 4 2.669 1.130 -4.188 28 HG HZP 4 HG1 HZP 4 1.707 -0.908 -3.728 29 HD HZP 4 HD3 HZP 4 3.740 -1.233 -2.692 30 HDA HZP 4 HD2 HZP 4 2.694 -1.427 -1.268 31 HOD1 HZP 4 HG2 HZP 4 0.161 -1.147 -2.298 32 H THR 5 HN THR 5 3.824 3.103 -0.233 33 HA THR 5 HA THR 5 3.068 4.665 1.196 34 HB THR 5 HB THR 5 1.425 6.326 0.272 35 HG1 THR 5 HG1 THR 5 0.764 4.399 -1.328 36 HG21 THR 5 HG21 THR 5 3.923 6.410 -0.010 37 HG22 THR 5 HG22 THR 5 3.003 7.274 -1.243 38 HG23 THR 5 HG23 THR 5 3.697 5.694 -1.606 39 H THR 6 HN THR 6 2.204 3.732 2.922 40 HA THR 6 HA THR 6 0.734 2.761 4.344 41 HB THR 6 HB THR 6 -1.465 3.951 4.537 42 HG1 THR 6 HG1 THR 6 -0.992 4.597 2.026 43 HG21 THR 6 HG21 THR 6 0.778 4.712 5.510 44 HG22 THR 6 HG22 THR 6 -0.518 5.905 5.423 45 HG23 THR 6 HG23 THR 6 0.781 5.922 4.229 46 HA PRO 7 HA PRO 7 -1.242 -0.086 1.359 47 HB2 PRO 7 HB2 PRO 7 -0.171 -2.353 2.279 48 HB3 PRO 7 HB1 PRO 7 0.792 -1.234 1.297 49 HG2 PRO 7 HG2 PRO 7 0.737 -1.567 4.270 50 HG3 PRO 7 HG1 PRO 7 2.128 -1.426 3.177 51 HD2 PRO 7 HD2 PRO 7 1.109 0.673 4.611 52 HD3 PRO 7 HD1 PRO 7 1.964 0.862 3.067 53 H GLY 8 HN GLY 8 -1.950 -2.620 2.433 54 HA2 GLY 8 HA2 GLY 8 -3.560 -3.619 3.741 55 HA3 GLY 8 HA1 GLY 8 -3.372 -2.294 4.882 56 H ASN 9 HN ASN 9 -4.504 -2.646 1.539 57 HA ASN 9 HA ASN 9 -6.260 -1.746 0.418 58 HB2 ASN 9 HB2 ASN 9 -7.394 -3.493 1.750 59 HB3 ASN 9 HB1 ASN 9 -7.701 -2.311 3.017 60 HD21 ASN 9 HD21 ASN 9 -9.915 -2.577 2.857 61 HD22 ASN 9 HD22 ASN 9 -10.829 -1.953 1.528 62 H SER 10 HN SER 10 -4.898 0.327 0.805 63 HA SER 10 HA SER 10 -6.826 2.299 1.766 64 HB2 SER 10 HB2 SER 10 -3.840 2.500 2.222 65 HB3 SER 10 HB1 SER 10 -5.028 3.733 2.628 66 HG SER 10 HG SER 10 -5.042 1.082 3.655 67 HA HZP 11 HA HZP 11 -4.915 4.093 -2.098 68 HB HZP 11 HB2 HZP 11 -2.438 3.458 -2.947 69 HBA HZP 11 HB1 HZP 11 -2.696 4.528 -1.556 70 HG HZP 11 HG1 HZP 11 -1.553 3.041 -0.325 71 HD HZP 11 HD3 HZP 11 -3.161 1.797 0.753 72 HDA HZP 11 HD2 HZP 11 -3.430 0.792 -0.683 73 HOD1 HZP 11 HG2 HZP 11 -0.549 1.523 -1.371 74 H GLY 12 HN GLY 12 -6.132 1.424 -2.007 75 HA2 GLY 12 HA2 GLY 12 -7.033 0.066 -3.662 76 HA3 GLY 12 HA1 GLY 12 -5.906 0.769 -4.815 77 H VAL 13 HN VAL 13 -3.739 -0.016 -4.863 78 HA VAL 13 HA VAL 13 -3.662 -2.875 -4.441 79 HB VAL 13 HB VAL 13 -1.463 -2.739 -5.633 80 HG11 VAL 13 HG11 VAL 13 -3.807 -1.444 -7.019 81 HG12 VAL 13 HG12 VAL 13 -3.549 -3.178 -6.826 82 HG13 VAL 13 HG13 VAL 13 -2.439 -2.225 -7.812 83 HG21 VAL 13 HG21 VAL 13 -0.820 -0.477 -4.998 84 HG22 VAL 13 HG22 VAL 13 -2.195 0.178 -5.885 85 HG23 VAL 13 HG23 VAL 13 -0.889 -0.625 -6.753 86 H GLY 14 HN GLY 14 -3.730 -1.725 -2.001 87 HA2 GLY 14 HA2 GLY 14 -0.940 -1.834 -1.035 88 HA3 GLY 14 HA1 GLY 14 -2.239 -0.975 -0.224 89 H HIS 15 HN HIS 15 -0.329 -3.418 0.300 90 HA HIS 15 HA HIS 15 -2.351 -4.958 1.747 91 HB2 HIS 15 HB2 HIS 15 -0.387 -6.142 -0.225 92 HB3 HIS 15 HB1 HIS 15 -1.168 -7.096 1.027 93 HD1 HIS 15 HD1 HIS 15 -3.639 -7.700 0.688 94 HD2 HIS 15 HD2 HIS 15 -2.038 -5.390 -2.377 95 HE1 HIS 15 HE1 HIS 15 -5.323 -7.784 -1.176 96 HE2 HIS 15 HE2 HIS 15 -4.266 -6.504 -3.070 Start of MODEL 10 1 H1 ALA 1 HT1 ALA 1 5.948 1.789 -0.324 2 H2 ALA 1 HT2 ALA 1 5.284 3.013 -1.278 3 H3 ALA 1 HT3 ALA 1 6.881 3.127 -0.750 4 HA ALA 1 HA ALA 1 6.666 2.488 -3.104 5 HB1 ALA 1 HB1 ALA 1 7.922 0.398 -1.329 6 HB2 ALA 1 HB2 ALA 1 8.670 1.918 -1.813 7 HB3 ALA 1 HB3 ALA 1 8.300 0.695 -3.025 8 H PHE 2 HN PHE 2 6.579 -0.735 -1.735 9 HA PHE 2 HA PHE 2 4.424 -1.542 -3.421 10 HB2 PHE 2 HB2 PHE 2 4.497 -3.670 -2.104 11 HB3 PHE 2 HB1 PHE 2 6.056 -3.204 -2.771 12 HD1 PHE 2 HD1 PHE 2 7.814 -2.310 -1.285 13 HD2 PHE 2 HD2 PHE 2 4.146 -3.833 0.240 14 HE1 PHE 2 HE1 PHE 2 8.824 -2.498 0.947 15 HE2 PHE 2 HE2 PHE 2 5.152 -4.016 2.475 16 HZ PHE 2 HZ PHE 2 7.491 -3.348 2.831 17 H GLN 3 HN GLN 3 4.769 -0.514 -0.120 18 HA GLN 3 HA GLN 3 1.862 -0.137 -0.032 19 HB2 GLN 3 HB2 GLN 3 2.077 -0.099 2.446 20 HB3 GLN 3 HB1 GLN 3 2.545 -1.642 1.749 21 HG2 GLN 3 HG2 GLN 3 4.929 -0.862 1.896 22 HG3 GLN 3 HG1 GLN 3 4.339 0.509 2.828 23 HE21 GLN 3 HE21 GLN 3 3.045 -2.752 3.029 24 HE22 GLN 3 HE22 GLN 3 3.571 -3.043 4.647 25 HA HZP 4 HA HZP 4 3.355 4.023 -0.718 26 HB HZP 4 HB2 HZP 4 0.891 5.195 -0.924 27 HBA HZP 4 HB1 HZP 4 1.624 4.233 -2.225 28 HG HZP 4 HG1 HZP 4 -0.363 3.085 -1.950 29 HD HZP 4 HD3 HZP 4 1.147 1.352 -1.659 30 HDA HZP 4 HD2 HZP 4 0.376 1.288 -0.060 31 HOD1 HZP 4 HG2 HZP 4 -0.548 2.861 0.741 32 H THR 5 HN THR 5 3.952 3.622 1.687 33 HA THR 5 HA THR 5 4.088 4.269 3.825 34 HB THR 5 HB THR 5 3.588 6.732 4.287 35 HG1 THR 5 HG1 THR 5 2.559 6.491 1.777 36 HG21 THR 5 HG21 THR 5 5.523 5.960 2.106 37 HG22 THR 5 HG22 THR 5 5.826 5.931 3.844 38 HG23 THR 5 HG23 THR 5 5.572 7.469 3.017 39 H THR 6 HN THR 6 1.697 3.012 3.054 40 HA THR 6 HA THR 6 0.354 2.953 5.455 41 HB THR 6 HB THR 6 -0.620 5.109 5.042 42 HG1 THR 6 HG1 THR 6 -2.729 4.549 5.258 43 HG21 THR 6 HG21 THR 6 -1.168 4.036 2.301 44 HG22 THR 6 HG22 THR 6 -0.397 5.552 2.771 45 HG23 THR 6 HG23 THR 6 -2.139 5.350 2.965 46 HA PRO 7 HA PRO 7 -0.809 -0.519 2.786 47 HB2 PRO 7 HB2 PRO 7 -0.137 -2.349 4.806 48 HB3 PRO 7 HB1 PRO 7 0.894 -1.838 3.470 49 HG2 PRO 7 HG2 PRO 7 1.353 -1.324 6.182 50 HG3 PRO 7 HG1 PRO 7 2.147 -0.515 4.818 51 HD2 PRO 7 HD2 PRO 7 -0.198 0.389 6.456 52 HD3 PRO 7 HD1 PRO 7 1.166 1.333 5.809 53 H GLY 8 HN GLY 8 -2.279 -2.395 3.067 54 HA2 GLY 8 HA2 GLY 8 -3.844 -3.667 4.291 55 HA3 GLY 8 HA1 GLY 8 -3.926 -2.383 5.483 56 H ASN 9 HN ASN 9 -4.115 -1.000 2.477 57 HA ASN 9 HA ASN 9 -6.692 -1.312 1.559 58 HB2 ASN 9 HB2 ASN 9 -7.904 0.609 2.607 59 HB3 ASN 9 HB1 ASN 9 -7.588 -0.698 3.738 60 HD21 ASN 9 HD21 ASN 9 -6.217 -0.362 5.448 61 HD22 ASN 9 HD22 ASN 9 -5.610 1.198 5.880 62 H SER 10 HN SER 10 -4.286 -0.778 0.499 63 HA SER 10 HA SER 10 -3.908 2.103 0.305 64 HB2 SER 10 HB2 SER 10 -2.013 0.043 -0.741 65 HB3 SER 10 HB1 SER 10 -1.671 1.630 -0.050 66 HG SER 10 HG SER 10 -2.258 0.830 1.980 67 HA HZP 11 HA HZP 11 -5.048 2.370 -4.033 68 HB HZP 11 HB2 HZP 11 -3.146 4.370 -4.558 69 HBA HZP 11 HB1 HZP 11 -4.830 4.642 -4.077 70 HG HZP 11 HG1 HZP 11 -3.898 5.656 -2.261 71 HD HZP 11 HD3 HZP 11 -4.885 4.008 -1.050 72 HDA HZP 11 HD2 HZP 11 -3.199 3.635 -0.638 73 HOD1 HZP 11 HG2 HZP 11 -1.686 4.555 -1.562 74 H GLY 12 HN GLY 12 -4.278 1.215 -5.708 75 HA2 GLY 12 HA2 GLY 12 -2.675 0.391 -7.199 76 HA3 GLY 12 HA1 GLY 12 -1.409 0.951 -6.116 77 H VAL 13 HN VAL 13 -0.868 -0.334 -4.277 78 HA VAL 13 HA VAL 13 -1.693 -3.149 -4.572 79 HB VAL 13 HB VAL 13 1.030 -2.217 -3.647 80 HG11 VAL 13 HG11 VAL 13 0.010 -4.944 -4.438 81 HG12 VAL 13 HG12 VAL 13 0.360 -4.401 -2.796 82 HG13 VAL 13 HG13 VAL 13 1.665 -4.556 -3.972 83 HG21 VAL 13 HG21 VAL 13 1.878 -2.902 -5.823 84 HG22 VAL 13 HG22 VAL 13 0.678 -1.622 -6.000 85 HG23 VAL 13 HG23 VAL 13 0.243 -3.293 -6.353 86 H GLY 14 HN GLY 14 0.409 -1.722 -2.117 87 HA2 GLY 14 HA2 GLY 14 0.016 -1.314 0.133 88 HA3 GLY 14 HA1 GLY 14 -1.669 -1.767 -0.090 89 H HIS 15 HN HIS 15 -0.289 -2.560 2.104 90 HA HIS 15 HA HIS 15 0.047 -4.351 3.435 91 HB2 HIS 15 HB2 HIS 15 -2.041 -5.174 2.254 92 HB3 HIS 15 HB1 HIS 15 -0.983 -6.079 1.178 93 HD1 HIS 15 HD1 HIS 15 0.706 -7.801 2.570 94 HD2 HIS 15 HD2 HIS 15 -2.803 -6.571 4.430 95 HE1 HIS 15 HE1 HIS 15 0.278 -9.482 4.389 96 HE2 HIS 15 HE2 HIS 15 -1.772 -8.641 5.586
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