NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
612571 | 5ui7 | 30230 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 H GLY 1 1.811 -0.001 0.854 2 HA2 GLY 1 2HA GLY 1 1.383 0.164 -2.063 3 HA3 GLY 1 3HA GLY 1 2.787 0.810 -1.226 4 H SER 2 H SER 2 3.679 -1.174 0.314 5 HA SER 2 HA SER 2 3.753 -3.686 -1.088 6 HB2 SER 2 2HB SER 2 6.032 -1.742 -1.249 7 HB3 SER 2 3HB SER 2 6.363 -3.474 -1.223 8 HG SER 2 HG SER 2 5.262 -1.913 -3.209 9 H ASP 3 H ASP 3 6.197 -2.062 0.912 10 HA ASP 3 HA ASP 3 5.396 -3.255 3.352 11 HB2 ASP 3 2HB ASP 3 6.205 -5.299 2.231 12 HB3 ASP 3 3HB ASP 3 7.774 -4.536 1.987 13 H GLY 4 H GLY 4 5.796 -0.791 3.316 14 HA2 GLY 4 2HA GLY 4 8.614 -0.107 3.703 15 HA3 GLY 4 3HA GLY 4 7.276 1.028 3.592 16 HA PRO 5 HA PRO 5 8.599 0.492 8.054 17 HB2 PRO 5 2HB PRO 5 9.115 3.118 8.509 18 HB3 PRO 5 3HB PRO 5 10.330 1.994 7.889 19 HG2 PRO 5 2HG PRO 5 8.644 3.972 6.402 20 HG3 PRO 5 3HG PRO 5 10.367 3.600 6.208 21 HD2 PRO 5 2HD PRO 5 8.468 2.613 4.550 22 HD3 PRO 5 3HD PRO 5 9.947 1.716 4.947 23 H ILE 6 H ILE 6 6.419 2.542 6.285 24 HA ILE 6 HA ILE 6 4.762 2.858 8.701 25 HB ILE 6 HB ILE 6 3.644 4.720 7.350 26 HG12 ILE 6 2HG1 ILE 6 6.191 4.362 5.759 27 HG13 ILE 6 3HG1 ILE 6 4.542 4.214 5.162 28 HG21 ILE 6 1HG2 ILE 6 4.992 6.293 8.349 29 HG22 ILE 6 2HG2 ILE 6 5.428 4.844 9.255 30 HG23 ILE 6 3HG2 ILE 6 6.477 5.424 7.961 31 HD11 ILE 6 1HD1 ILE 6 4.660 6.762 6.245 32 HD12 ILE 6 2HD1 ILE 6 6.206 6.550 5.422 33 HD13 ILE 6 3HD1 ILE 6 4.697 6.330 4.536 34 H ILE 7 H ILE 7 2.502 2.572 8.510 35 HA ILE 7 HA ILE 7 1.771 0.574 6.538 36 HB ILE 7 HB ILE 7 0.208 1.710 8.858 37 HG12 ILE 7 2HG1 ILE 7 1.283 -1.085 8.647 38 HG13 ILE 7 3HG1 ILE 7 2.323 0.223 9.201 39 HG21 ILE 7 1HG2 ILE 7 -0.438 -0.580 7.007 40 HG22 ILE 7 2HG2 ILE 7 -1.323 -0.187 8.480 41 HG23 ILE 7 3HG2 ILE 7 -1.305 0.951 7.133 42 HD11 ILE 7 1HD1 ILE 7 0.037 -1.082 10.534 43 HD12 ILE 7 2HD1 ILE 7 1.547 -0.464 11.204 44 HD13 ILE 7 3HD1 ILE 7 0.240 0.650 10.801 45 H GLU 8 H GLU 8 0.186 0.774 4.992 46 HA GLU 8 HA GLU 8 -0.269 3.393 3.961 47 HB2 GLU 8 2HB GLU 8 -1.283 0.665 3.182 48 HB3 GLU 8 3HB GLU 8 -1.792 2.125 2.346 49 HG2 GLU 8 2HG GLU 8 0.525 2.603 1.756 50 HG3 GLU 8 3HG GLU 8 1.043 1.146 2.603 51 H PHE 9 H PHE 9 -1.502 4.678 5.235 52 HA PHE 9 HA PHE 9 -4.145 3.670 6.044 53 HB2 PHE 9 2HB PHE 9 -4.077 5.724 7.590 54 HB3 PHE 9 3HB PHE 9 -3.030 4.367 7.993 55 HD1 PHE 9 HD1 PHE 9 -0.773 4.720 8.351 56 HD2 PHE 9 HD2 PHE 9 -3.022 7.627 6.204 57 HE1 PHE 9 HE1 PHE 9 1.174 6.224 8.355 58 HE2 PHE 9 HE2 PHE 9 -1.078 9.135 6.203 59 HZ PHE 9 HZ PHE 9 1.024 8.435 7.279 60 H PHE 10 H PHE 10 -3.534 4.603 3.380 61 HA PHE 10 HA PHE 10 -5.272 6.981 3.287 62 HB2 PHE 10 2HB PHE 10 -4.105 7.532 1.124 63 HB3 PHE 10 3HB PHE 10 -3.097 7.667 2.561 64 HD1 PHE 10 HD1 PHE 10 -3.830 5.613 -0.406 65 HD2 PHE 10 HD2 PHE 10 -1.186 6.295 2.859 66 HE1 PHE 10 HE1 PHE 10 -2.182 4.099 -1.429 67 HE2 PHE 10 HE2 PHE 10 0.467 4.783 1.841 68 HZ PHE 10 HZ PHE 10 -0.030 3.684 -0.306 69 H ASN 11 H ASN 11 -5.973 4.123 3.231 70 HA ASN 11 HA ASN 11 -7.417 2.740 2.148 71 HB2 ASN 11 2HB ASN 11 -8.687 4.928 1.954 72 HB3 ASN 11 3HB ASN 11 -8.029 5.069 0.326 73 HD21 ASN 11 1HD2 ASN 11 -10.498 5.115 0.088 74 HD22 ASN 11 2HD2 ASN 11 -11.240 3.595 -0.264 75 HA PRO 12 HA PRO 12 -4.218 2.235 -1.229 76 HB2 PRO 12 2HB PRO 12 -3.249 -0.132 -0.320 77 HB3 PRO 12 3HB PRO 12 -2.623 1.432 0.216 78 HG2 PRO 12 2HG PRO 12 -4.577 -0.391 1.566 79 HG3 PRO 12 3HG PRO 12 -3.218 0.508 2.266 80 HD2 PRO 12 2HD PRO 12 -5.782 1.360 2.457 81 HD3 PRO 12 3HD PRO 12 -4.408 2.480 2.359 82 H ASN 13 H ASN 13 -3.822 -0.150 -2.300 83 HA ASN 13 HA ASN 13 -6.429 -0.869 -3.310 84 HB2 ASN 13 2HB ASN 13 -3.845 -0.842 -4.363 85 HB3 ASN 13 3HB ASN 13 -4.247 -2.552 -4.234 86 HD21 ASN 13 1HD2 ASN 13 -4.870 -3.245 -6.143 87 HD22 ASN 13 2HD2 ASN 13 -5.970 -2.443 -7.207 88 H GLY 14 H GLY 14 -4.200 -2.073 -0.983 89 HA2 GLY 14 2HA GLY 14 -5.994 -4.334 -0.477 90 HA3 GLY 14 3HA GLY 14 -4.292 -4.681 -0.744 91 H VAL 15 H VAL 15 -3.205 -4.994 1.068 92 HA VAL 15 HA VAL 15 -3.550 -3.173 3.306 93 HB VAL 15 HB VAL 15 -3.942 -6.151 3.636 94 HG11 VAL 15 1HG1 VAL 15 -2.780 -5.500 5.545 95 HG12 VAL 15 2HG1 VAL 15 -3.568 -3.922 5.605 96 HG13 VAL 15 3HG1 VAL 15 -4.469 -5.376 6.035 97 HG21 VAL 15 1HG2 VAL 15 -5.817 -3.809 3.844 98 HG22 VAL 15 2HG2 VAL 15 -5.965 -5.240 2.824 99 HG23 VAL 15 3HG2 VAL 15 -6.168 -5.377 4.571 100 H MET 16 H MET 16 -1.419 -2.541 2.832 101 HA MET 16 HA MET 16 0.588 -4.203 4.066 102 HB2 MET 16 2HB MET 16 0.529 -3.713 1.115 103 HB3 MET 16 3HB MET 16 2.081 -3.797 1.938 104 HG2 MET 16 2HG MET 16 1.976 -5.989 1.624 105 HG3 MET 16 3HG MET 16 0.750 -6.005 2.890 106 HE1 MET 16 1HE MET 16 1.315 -4.963 -0.588 107 HE2 MET 16 2HE MET 16 0.607 -6.290 -1.508 108 HE3 MET 16 3HE MET 16 -0.335 -4.832 -1.197 109 H HIS 17 H HIS 17 2.758 -3.051 4.055 110 HA HIS 17 HA HIS 17 2.319 -0.328 4.866 111 HB2 HIS 17 2HB HIS 17 4.831 -2.005 4.719 112 HB3 HIS 17 3HB HIS 17 4.770 -0.371 5.375 113 HD1 HIS 17 HD1 HIS 17 2.895 -3.635 5.994 114 HD2 HIS 17 HD2 HIS 17 4.506 -0.407 8.055 115 HE1 HIS 17 HE1 HIS 17 2.493 -4.123 8.427 116 H TYR 18 H TYR 18 4.463 1.098 4.170 117 HA TYR 18 HA TYR 18 5.222 0.948 1.449 118 HB2 TYR 18 2HB TYR 18 3.887 2.568 0.412 119 HB3 TYR 18 3HB TYR 18 2.735 1.638 1.363 120 HD1 TYR 18 HD1 TYR 18 3.641 4.855 0.459 121 HD2 TYR 18 HD2 TYR 18 2.477 2.606 3.878 122 HE1 TYR 18 HE1 TYR 18 2.888 6.923 1.556 123 HE2 TYR 18 HE2 TYR 18 1.719 4.668 4.984 124 HH TYR 18 HH TYR 18 1.184 7.514 3.400 125 H GLY 19 H GLY 19 6.211 3.118 0.721 126 HA2 GLY 19 2HA GLY 19 8.034 3.937 2.769 127 HA3 GLY 19 3HA GLY 19 7.971 4.553 1.124 Start of MODEL 2 1 H1 GLY 1 H GLY 1 1.900 0.050 0.857 2 HA2 GLY 1 2HA GLY 1 1.601 0.288 -2.072 3 HA3 GLY 1 3HA GLY 1 2.996 0.870 -1.175 4 H SER 2 H SER 2 3.749 -1.152 0.383 5 HA SER 2 HA SER 2 3.764 -3.668 -1.007 6 HB2 SER 2 2HB SER 2 6.121 -1.817 -1.140 7 HB3 SER 2 3HB SER 2 6.381 -3.561 -1.099 8 HG SER 2 HG SER 2 5.578 -2.004 -3.150 9 H ASP 3 H ASP 3 6.243 -2.134 1.019 10 HA ASP 3 HA ASP 3 5.348 -3.293 3.450 11 HB2 ASP 3 2HB ASP 3 7.362 -4.840 3.699 12 HB3 ASP 3 3HB ASP 3 6.070 -5.393 2.636 13 H GLY 4 H GLY 4 5.802 -0.837 3.420 14 HA2 GLY 4 2HA GLY 4 8.624 -0.212 3.869 15 HA3 GLY 4 3HA GLY 4 7.313 0.950 3.729 16 HA PRO 5 HA PRO 5 8.528 0.388 8.219 17 HB2 PRO 5 2HB PRO 5 9.089 3.003 8.685 18 HB3 PRO 5 3HB PRO 5 10.293 1.854 8.090 19 HG2 PRO 5 2HG PRO 5 8.681 3.866 6.568 20 HG3 PRO 5 3HG PRO 5 10.400 3.459 6.410 21 HD2 PRO 5 2HD PRO 5 8.516 2.510 4.712 22 HD3 PRO 5 3HD PRO 5 9.968 1.584 5.141 23 H ILE 6 H ILE 6 6.433 2.489 6.405 24 HA ILE 6 HA ILE 6 4.733 2.845 8.785 25 HB ILE 6 HB ILE 6 3.677 4.718 7.399 26 HG12 ILE 6 2HG1 ILE 6 6.251 4.302 5.867 27 HG13 ILE 6 3HG1 ILE 6 4.613 4.182 5.234 28 HG21 ILE 6 1HG2 ILE 6 6.429 5.578 7.956 29 HG22 ILE 6 2HG2 ILE 6 4.900 6.173 8.599 30 HG23 ILE 6 3HG2 ILE 6 5.632 4.717 9.272 31 HD11 ILE 6 1HD1 ILE 6 6.315 6.487 5.513 32 HD12 ILE 6 2HD1 ILE 6 4.816 6.293 4.604 33 HD13 ILE 6 3HD1 ILE 6 4.762 6.735 6.311 34 H ILE 7 H ILE 7 2.471 2.604 8.551 35 HA ILE 7 HA ILE 7 1.739 0.606 6.578 36 HB ILE 7 HB ILE 7 0.145 1.789 8.855 37 HG12 ILE 7 2HG1 ILE 7 1.168 -1.026 8.721 38 HG13 ILE 7 3HG1 ILE 7 2.244 0.266 9.239 39 HG21 ILE 7 1HG2 ILE 7 -1.404 -0.084 8.467 40 HG22 ILE 7 2HG2 ILE 7 -1.328 1.019 7.094 41 HG23 ILE 7 3HG2 ILE 7 -0.484 -0.527 7.030 42 HD11 ILE 7 1HD1 ILE 7 0.213 0.814 10.838 43 HD12 ILE 7 2HD1 ILE 7 -0.112 -0.903 10.594 44 HD13 ILE 7 3HD1 ILE 7 1.439 -0.384 11.253 45 H GLU 8 H GLU 8 0.128 0.814 5.040 46 HA GLU 8 HA GLU 8 -0.264 3.464 4.011 47 HB2 GLU 8 2HB GLU 8 -1.223 0.746 3.126 48 HB3 GLU 8 3HB GLU 8 -1.678 2.226 2.293 49 HG2 GLU 8 2HG GLU 8 0.705 2.704 1.898 50 HG3 GLU 8 3HG GLU 8 1.116 1.170 2.663 51 H PHE 9 H PHE 9 -1.608 4.736 5.151 52 HA PHE 9 HA PHE 9 -4.228 3.645 5.927 53 HB2 PHE 9 2HB PHE 9 -4.292 5.764 7.384 54 HB3 PHE 9 3HB PHE 9 -3.198 4.474 7.871 55 HD1 PHE 9 HD1 PHE 9 -3.413 7.809 6.340 56 HD2 PHE 9 HD2 PHE 9 -0.840 4.786 7.873 57 HE1 PHE 9 HE1 PHE 9 -1.538 9.402 6.323 58 HE2 PHE 9 HE2 PHE 9 1.039 6.374 7.859 59 HZ PHE 9 HZ PHE 9 0.692 8.685 7.084 60 H PHE 10 H PHE 10 -3.880 4.292 3.264 61 HA PHE 10 HA PHE 10 -5.687 6.590 3.016 62 HB2 PHE 10 2HB PHE 10 -4.437 7.185 0.877 63 HB3 PHE 10 3HB PHE 10 -3.615 7.554 2.390 64 HD1 PHE 10 HD1 PHE 10 -3.552 5.615 -0.663 65 HD2 PHE 10 HD2 PHE 10 -1.739 6.142 3.152 66 HE1 PHE 10 HE1 PHE 10 -1.602 4.315 -1.414 67 HE2 PHE 10 HE2 PHE 10 0.214 4.845 2.407 68 HZ PHE 10 HZ PHE 10 0.285 3.930 0.121 69 H ASN 11 H ASN 11 -5.824 3.558 2.876 70 HA ASN 11 HA ASN 11 -6.830 1.933 1.633 71 HB2 ASN 11 2HB ASN 11 -8.324 4.257 0.402 72 HB3 ASN 11 3HB ASN 11 -8.865 2.584 0.500 73 HD21 ASN 11 1HD2 ASN 11 -10.423 4.630 1.430 74 HD22 ASN 11 2HD2 ASN 11 -10.522 4.547 3.153 75 HA PRO 12 HA PRO 12 -4.132 2.860 -2.057 76 HB2 PRO 12 2HB PRO 12 -2.522 0.697 -1.738 77 HB3 PRO 12 3HB PRO 12 -2.215 2.248 -0.947 78 HG2 PRO 12 2HG PRO 12 -3.490 -0.223 0.161 79 HG3 PRO 12 3HG PRO 12 -2.300 0.855 0.913 80 HD2 PRO 12 2HD PRO 12 -4.942 0.974 1.490 81 HD3 PRO 12 3HD PRO 12 -3.895 2.408 1.508 82 H ASN 13 H ASN 13 -5.098 -0.376 -0.898 83 HA ASN 13 HA ASN 13 -6.862 -0.925 -2.987 84 HB2 ASN 13 2HB ASN 13 -4.256 -0.998 -3.919 85 HB3 ASN 13 3HB ASN 13 -4.613 -2.691 -3.589 86 HD21 ASN 13 1HD2 ASN 13 -5.500 -3.769 -5.184 87 HD22 ASN 13 2HD2 ASN 13 -6.427 -3.099 -6.479 88 H GLY 14 H GLY 14 -4.533 -2.175 -0.676 89 HA2 GLY 14 2HA GLY 14 -6.526 -4.163 0.153 90 HA3 GLY 14 3HA GLY 14 -4.904 -4.718 -0.233 91 H VAL 15 H VAL 15 -3.499 -4.835 1.387 92 HA VAL 15 HA VAL 15 -3.589 -2.948 3.583 93 HB VAL 15 HB VAL 15 -3.555 -4.867 5.269 94 HG11 VAL 15 1HG1 VAL 15 -5.517 -3.232 4.500 95 HG12 VAL 15 2HG1 VAL 15 -6.258 -4.772 4.061 96 HG13 VAL 15 3HG1 VAL 15 -5.745 -4.480 5.724 97 HG21 VAL 15 1HG2 VAL 15 -3.547 -6.451 3.057 98 HG22 VAL 15 2HG2 VAL 15 -4.032 -6.979 4.668 99 HG23 VAL 15 3HG2 VAL 15 -5.254 -6.476 3.501 100 H MET 16 H MET 16 -1.512 -2.360 2.960 101 HA MET 16 HA MET 16 0.579 -4.096 3.942 102 HB2 MET 16 2HB MET 16 0.333 -3.369 1.034 103 HB3 MET 16 3HB MET 16 1.896 -3.722 1.757 104 HG2 MET 16 2HG MET 16 0.933 -5.922 2.499 105 HG3 MET 16 3HG MET 16 -0.467 -5.556 1.493 106 HE1 MET 16 1HE MET 16 1.684 -4.139 -1.225 107 HE2 MET 16 2HE MET 16 0.772 -5.428 -2.011 108 HE3 MET 16 3HE MET 16 0.002 -4.428 -0.779 109 H HIS 17 H HIS 17 2.632 -3.002 4.158 110 HA HIS 17 HA HIS 17 2.309 -0.261 4.902 111 HB2 HIS 17 2HB HIS 17 4.760 -2.029 4.787 112 HB3 HIS 17 3HB HIS 17 4.747 -0.397 5.450 113 HD1 HIS 17 HD1 HIS 17 2.782 -3.614 6.026 114 HD2 HIS 17 HD2 HIS 17 4.408 -0.417 8.123 115 HE1 HIS 17 HE1 HIS 17 2.317 -4.094 8.450 116 H TYR 18 H TYR 18 4.509 1.088 4.239 117 HA TYR 18 HA TYR 18 5.320 0.912 1.540 118 HB2 TYR 18 2HB TYR 18 4.051 2.562 0.463 119 HB3 TYR 18 3HB TYR 18 2.855 1.657 1.384 120 HD1 TYR 18 HD1 TYR 18 3.830 4.851 0.493 121 HD2 TYR 18 HD2 TYR 18 2.567 2.635 3.898 122 HE1 TYR 18 HE1 TYR 18 3.089 6.936 1.567 123 HE2 TYR 18 HE2 TYR 18 1.821 4.714 4.981 124 HH TYR 18 HH TYR 18 2.691 7.772 3.884 125 H GLY 19 H GLY 19 6.367 3.064 0.824 126 HA2 GLY 19 2HA GLY 19 8.141 3.864 2.934 127 HA3 GLY 19 3HA GLY 19 8.173 4.433 1.272 Start of MODEL 3 1 H1 GLY 1 H GLY 1 1.279 -0.194 0.932 2 HA2 GLY 1 2HA GLY 1 -0.313 -1.727 -0.087 3 HA3 GLY 1 3HA GLY 1 -0.119 -0.833 -1.588 4 H SER 2 H SER 2 2.766 -1.338 0.158 5 HA SER 2 HA SER 2 3.403 -3.775 -1.340 6 HB2 SER 2 2HB SER 2 5.058 -1.241 -1.383 7 HB3 SER 2 3HB SER 2 5.596 -2.798 -2.011 8 HG SER 2 HG SER 2 4.615 -1.259 -3.553 9 H ASP 3 H ASP 3 5.359 -1.480 0.540 10 HA ASP 3 HA ASP 3 5.396 -2.923 2.940 11 HB2 ASP 3 2HB ASP 3 6.895 -4.196 0.941 12 HB3 ASP 3 3HB ASP 3 8.080 -3.386 1.962 13 H GLY 4 H GLY 4 6.791 -2.001 4.515 14 HA2 GLY 4 2HA GLY 4 8.841 -0.227 4.209 15 HA3 GLY 4 3HA GLY 4 7.403 0.758 3.986 16 HA PRO 5 HA PRO 5 8.530 0.324 8.546 17 HB2 PRO 5 2HB PRO 5 9.093 2.943 8.988 18 HB3 PRO 5 3HB PRO 5 10.312 1.772 8.472 19 HG2 PRO 5 2HG PRO 5 8.792 3.767 6.838 20 HG3 PRO 5 3HG PRO 5 10.512 3.342 6.769 21 HD2 PRO 5 2HD PRO 5 8.701 2.377 5.003 22 HD3 PRO 5 3HD PRO 5 10.123 1.446 5.517 23 H ILE 6 H ILE 6 6.516 2.354 6.584 24 HA ILE 6 HA ILE 6 4.705 2.758 8.875 25 HB ILE 6 HB ILE 6 3.757 4.649 7.410 26 HG12 ILE 6 2HG1 ILE 6 6.462 4.234 6.122 27 HG13 ILE 6 3HG1 ILE 6 4.889 4.135 5.337 28 HG21 ILE 6 1HG2 ILE 6 5.104 4.871 9.520 29 HG22 ILE 6 2HG2 ILE 6 6.529 5.072 8.502 30 HG23 ILE 6 3HG2 ILE 6 5.211 6.239 8.412 31 HD11 ILE 6 1HD1 ILE 6 6.516 6.481 6.033 32 HD12 ILE 6 2HD1 ILE 6 5.398 6.223 4.693 33 HD13 ILE 6 3HD1 ILE 6 4.779 6.643 6.290 34 H ILE 7 H ILE 7 2.437 2.623 8.463 35 HA ILE 7 HA ILE 7 1.809 0.681 6.374 36 HB ILE 7 HB ILE 7 0.153 1.657 8.704 37 HG12 ILE 7 2HG1 ILE 7 1.136 -1.145 8.409 38 HG13 ILE 7 3HG1 ILE 7 2.284 0.085 8.926 39 HG21 ILE 7 1HG2 ILE 7 -1.280 1.018 6.862 40 HG22 ILE 7 2HG2 ILE 7 -0.410 -0.505 6.680 41 HG23 ILE 7 3HG2 ILE 7 -1.361 -0.202 8.134 42 HD11 ILE 7 1HD1 ILE 7 1.517 -0.675 10.936 43 HD12 ILE 7 2HD1 ILE 7 0.405 0.664 10.653 44 HD13 ILE 7 3HD1 ILE 7 -0.106 -0.991 10.325 45 H GLU 8 H GLU 8 0.344 1.018 4.753 46 HA GLU 8 HA GLU 8 -0.132 3.736 3.985 47 HB2 GLU 8 2HB GLU 8 -1.014 1.112 2.774 48 HB3 GLU 8 3HB GLU 8 -1.339 2.681 2.051 49 HG2 GLU 8 2HG GLU 8 1.098 3.090 1.947 50 HG3 GLU 8 3HG GLU 8 1.363 1.457 2.554 51 H PHE 9 H PHE 9 -1.590 4.838 5.155 52 HA PHE 9 HA PHE 9 -4.184 3.568 5.707 53 HB2 PHE 9 2HB PHE 9 -4.418 5.567 7.317 54 HB3 PHE 9 3HB PHE 9 -3.298 4.282 7.759 55 HD1 PHE 9 HD1 PHE 9 -3.548 7.703 6.412 56 HD2 PHE 9 HD2 PHE 9 -0.980 4.693 7.980 57 HE1 PHE 9 HE1 PHE 9 -1.739 9.359 6.618 58 HE2 PHE 9 HE2 PHE 9 0.833 6.344 8.190 59 HZ PHE 9 HZ PHE 9 0.454 8.680 7.509 60 H PHE 10 H PHE 10 -3.749 4.448 3.123 61 HA PHE 10 HA PHE 10 -5.562 6.763 2.988 62 HB2 PHE 10 2HB PHE 10 -4.345 7.316 0.801 63 HB3 PHE 10 3HB PHE 10 -3.500 7.677 2.303 64 HD1 PHE 10 HD1 PHE 10 -1.581 6.358 3.000 65 HD2 PHE 10 HD2 PHE 10 -3.577 5.588 -0.680 66 HE1 PHE 10 HE1 PHE 10 0.336 5.012 2.245 67 HE2 PHE 10 HE2 PHE 10 -1.664 4.241 -1.440 68 HZ PHE 10 HZ PHE 10 0.296 3.951 0.024 69 H ASN 11 H ASN 11 -5.967 3.810 2.854 70 HA ASN 11 HA ASN 11 -7.084 2.249 1.622 71 HB2 ASN 11 2HB ASN 11 -8.702 4.300 1.877 72 HB3 ASN 11 3HB ASN 11 -8.446 4.472 0.143 73 HD21 ASN 11 1HD2 ASN 11 -10.338 3.837 -0.671 74 HD22 ASN 11 2HD2 ASN 11 -11.066 2.294 -0.400 75 HA PRO 12 HA PRO 12 -4.330 2.957 -2.088 76 HB2 PRO 12 2HB PRO 12 -2.823 0.729 -1.718 77 HB3 PRO 12 3HB PRO 12 -2.439 2.284 -0.969 78 HG2 PRO 12 2HG PRO 12 -3.824 -0.095 0.208 79 HG3 PRO 12 3HG PRO 12 -2.580 0.945 0.927 80 HD2 PRO 12 2HD PRO 12 -5.211 1.204 1.511 81 HD3 PRO 12 3HD PRO 12 -4.097 2.587 1.487 82 H ASN 13 H ASN 13 -5.416 -0.212 -0.847 83 HA ASN 13 HA ASN 13 -7.240 -0.737 -2.881 84 HB2 ASN 13 2HB ASN 13 -5.548 -0.851 -4.513 85 HB3 ASN 13 3HB ASN 13 -4.441 -1.693 -3.433 86 HD21 ASN 13 1HD2 ASN 13 -4.069 -3.592 -4.335 87 HD22 ASN 13 2HD2 ASN 13 -5.275 -4.697 -4.892 88 H GLY 14 H GLY 14 -4.679 -2.389 -1.032 89 HA2 GLY 14 2HA GLY 14 -6.762 -4.225 -0.020 90 HA3 GLY 14 3HA GLY 14 -5.136 -4.766 -0.410 91 H VAL 15 H VAL 15 -3.418 -4.237 0.969 92 HA VAL 15 HA VAL 15 -3.572 -2.564 3.204 93 HB VAL 15 HB VAL 15 -5.205 -4.017 4.157 94 HG11 VAL 15 1HG1 VAL 15 -3.754 -6.048 2.770 95 HG12 VAL 15 2HG1 VAL 15 -3.892 -6.494 4.472 96 HG13 VAL 15 3HG1 VAL 15 -5.342 -6.142 3.530 97 HG21 VAL 15 1HG2 VAL 15 -3.361 -3.211 5.629 98 HG22 VAL 15 2HG2 VAL 15 -4.135 -4.691 6.195 99 HG23 VAL 15 3HG2 VAL 15 -2.563 -4.767 5.401 100 H MET 16 H MET 16 -1.480 -2.031 3.072 101 HA MET 16 HA MET 16 0.509 -3.965 3.823 102 HB2 MET 16 2HB MET 16 0.095 -3.315 1.025 103 HB3 MET 16 3HB MET 16 1.719 -2.891 1.550 104 HG2 MET 16 2HG MET 16 2.195 -5.112 2.195 105 HG3 MET 16 3HG MET 16 0.504 -5.588 2.055 106 HE1 MET 16 1HE MET 16 0.382 -7.480 -0.515 107 HE2 MET 16 2HE MET 16 -0.577 -6.358 0.450 108 HE3 MET 16 3HE MET 16 -0.386 -6.091 -1.283 109 H HIS 17 H HIS 17 2.808 -2.746 3.379 110 HA HIS 17 HA HIS 17 2.485 -0.161 4.731 111 HB2 HIS 17 2HB HIS 17 4.850 -2.037 4.558 112 HB3 HIS 17 3HB HIS 17 4.896 -0.461 5.343 113 HD1 HIS 17 HD1 HIS 17 2.812 -3.640 5.613 114 HD2 HIS 17 HD2 HIS 17 4.400 -0.624 7.989 115 HE1 HIS 17 HE1 HIS 17 2.220 -4.264 7.977 116 H TYR 18 H TYR 18 4.737 1.154 4.258 117 HA TYR 18 HA TYR 18 5.617 1.147 1.559 118 HB2 TYR 18 2HB TYR 18 4.510 3.022 0.657 119 HB3 TYR 18 3HB TYR 18 3.233 2.075 1.413 120 HD1 TYR 18 HD1 TYR 18 4.578 5.293 1.072 121 HD2 TYR 18 HD2 TYR 18 2.724 2.741 3.928 122 HE1 TYR 18 HE1 TYR 18 3.903 7.261 2.383 123 HE2 TYR 18 HE2 TYR 18 2.044 4.703 5.247 124 HH TYR 18 HH TYR 18 1.675 7.478 4.361 125 H GLY 19 H GLY 19 6.880 3.216 1.066 126 HA2 GLY 19 2HA GLY 19 8.044 5.136 1.955 127 HA3 GLY 19 3HA GLY 19 7.957 4.392 3.544 Start of MODEL 4 1 H1 GLY 1 H GLY 1 1.999 0.307 0.675 2 HA2 GLY 1 2HA GLY 1 1.920 0.763 -2.244 3 HA3 GLY 1 3HA GLY 1 3.270 1.221 -1.217 4 H SER 2 H SER 2 3.863 -0.911 0.235 5 HA SER 2 HA SER 2 3.840 -3.352 -1.269 6 HB2 SER 2 2HB SER 2 5.558 -2.356 -2.575 7 HB3 SER 2 3HB SER 2 6.350 -1.679 -1.153 8 HG SER 2 HG SER 2 6.229 -4.382 -1.976 9 H ASP 3 H ASP 3 6.318 -1.990 0.880 10 HA ASP 3 HA ASP 3 5.324 -3.234 3.232 11 HB2 ASP 3 2HB ASP 3 6.168 -5.222 1.931 12 HB3 ASP 3 3HB ASP 3 7.785 -4.532 2.053 13 H GLY 4 H GLY 4 5.827 -0.789 3.330 14 HA2 GLY 4 2HA GLY 4 8.648 -0.250 3.891 15 HA3 GLY 4 3HA GLY 4 7.369 0.948 3.761 16 HA PRO 5 HA PRO 5 8.423 0.171 8.257 17 HB2 PRO 5 2HB PRO 5 9.014 2.752 8.854 18 HB3 PRO 5 3HB PRO 5 10.216 1.607 8.249 19 HG2 PRO 5 2HG PRO 5 8.690 3.712 6.765 20 HG3 PRO 5 3HG PRO 5 10.406 3.279 6.644 21 HD2 PRO 5 2HD PRO 5 8.562 2.440 4.847 22 HD3 PRO 5 3HD PRO 5 9.982 1.468 5.282 23 H ILE 6 H ILE 6 6.428 2.392 6.472 24 HA ILE 6 HA ILE 6 4.659 2.681 8.811 25 HB ILE 6 HB ILE 6 3.678 4.624 7.465 26 HG12 ILE 6 2HG1 ILE 6 6.294 4.223 6.003 27 HG13 ILE 6 3HG1 ILE 6 4.676 4.158 5.313 28 HG21 ILE 6 1HG2 ILE 6 6.485 5.245 8.229 29 HG22 ILE 6 2HG2 ILE 6 4.992 6.096 8.622 30 HG23 ILE 6 3HG2 ILE 6 5.398 4.597 9.457 31 HD11 ILE 6 1HD1 ILE 6 6.408 6.418 5.743 32 HD12 ILE 6 2HD1 ILE 6 4.940 6.287 4.773 33 HD13 ILE 6 3HD1 ILE 6 4.831 6.663 6.493 34 H ILE 7 H ILE 7 2.403 2.483 8.504 35 HA ILE 7 HA ILE 7 1.698 0.574 6.438 36 HB ILE 7 HB ILE 7 0.046 1.717 8.694 37 HG12 ILE 7 2HG1 ILE 7 1.020 -1.112 8.517 38 HG13 ILE 7 3HG1 ILE 7 2.106 0.144 9.101 39 HG21 ILE 7 1HG2 ILE 7 -0.554 -0.537 6.784 40 HG22 ILE 7 2HG2 ILE 7 -1.520 -0.113 8.197 41 HG23 ILE 7 3HG2 ILE 7 -1.373 1.023 6.856 42 HD11 ILE 7 1HD1 ILE 7 -0.307 -1.017 10.355 43 HD12 ILE 7 2HD1 ILE 7 1.226 -0.524 11.075 44 HD13 ILE 7 3HD1 ILE 7 0.023 0.691 10.644 45 H GLU 8 H GLU 8 0.126 0.860 4.866 46 HA GLU 8 HA GLU 8 -0.185 3.562 3.926 47 HB2 GLU 8 2HB GLU 8 -1.042 0.873 2.880 48 HB3 GLU 8 3HB GLU 8 -1.568 2.366 2.115 49 HG2 GLU 8 2HG GLU 8 0.819 2.990 1.827 50 HG3 GLU 8 3HG GLU 8 1.261 1.400 2.447 51 H PHE 9 H PHE 9 -1.585 4.795 5.033 52 HA PHE 9 HA PHE 9 -4.218 3.673 5.701 53 HB2 PHE 9 2HB PHE 9 -4.354 5.826 7.125 54 HB3 PHE 9 3HB PHE 9 -3.295 4.532 7.675 55 HD1 PHE 9 HD1 PHE 9 -3.442 7.885 6.212 56 HD2 PHE 9 HD2 PHE 9 -0.905 4.791 7.666 57 HE1 PHE 9 HE1 PHE 9 -1.553 9.461 6.262 58 HE2 PHE 9 HE2 PHE 9 0.987 6.363 7.719 59 HZ PHE 9 HZ PHE 9 0.664 8.701 7.017 60 H PHE 10 H PHE 10 -4.035 4.174 3.091 61 HA PHE 10 HA PHE 10 -5.854 6.415 2.749 62 HB2 PHE 10 2HB PHE 10 -4.523 7.177 0.715 63 HB3 PHE 10 3HB PHE 10 -3.836 7.569 2.289 64 HD1 PHE 10 HD1 PHE 10 -1.806 6.528 3.056 65 HD2 PHE 10 HD2 PHE 10 -3.500 5.505 -0.712 66 HE1 PHE 10 HE1 PHE 10 0.297 5.423 2.415 67 HE2 PHE 10 HE2 PHE 10 -1.400 4.398 -1.359 68 HZ PHE 10 HZ PHE 10 0.501 4.355 0.206 69 H ASN 11 H ASN 11 -6.379 3.687 2.670 70 HA ASN 11 HA ASN 11 -7.301 2.036 1.397 71 HB2 ASN 11 2HB ASN 11 -7.943 4.260 -0.544 72 HB3 ASN 11 3HB ASN 11 -8.823 2.752 -0.313 73 HD21 ASN 11 1HD2 ASN 11 -9.604 2.435 2.002 74 HD22 ASN 11 2HD2 ASN 11 -10.333 3.812 2.748 75 HA PRO 12 HA PRO 12 -3.576 1.988 -1.438 76 HB2 PRO 12 2HB PRO 12 -2.422 -0.200 -0.320 77 HB3 PRO 12 3HB PRO 12 -2.122 1.444 0.255 78 HG2 PRO 12 2HG PRO 12 -3.971 -0.639 1.352 79 HG3 PRO 12 3HG PRO 12 -2.883 0.460 2.220 80 HD2 PRO 12 2HD PRO 12 -5.542 0.920 1.996 81 HD3 PRO 12 3HD PRO 12 -4.349 2.232 2.071 82 H ASN 13 H ASN 13 -6.123 -0.104 -0.511 83 HA ASN 13 HA ASN 13 -7.249 -1.754 -1.600 84 HB2 ASN 13 2HB ASN 13 -6.864 -0.075 -3.526 85 HB3 ASN 13 3HB ASN 13 -5.616 -1.195 -4.065 86 HD21 ASN 13 1HD2 ASN 13 -8.603 -0.315 -4.712 87 HD22 ASN 13 2HD2 ASN 13 -9.297 -1.815 -5.216 88 H GLY 14 H GLY 14 -5.729 -2.980 -0.058 89 HA2 GLY 14 2HA GLY 14 -5.090 -5.427 -0.944 90 HA3 GLY 14 3HA GLY 14 -3.652 -4.517 -1.382 91 H VAL 15 H VAL 15 -4.254 -2.803 1.102 92 HA VAL 15 HA VAL 15 -3.587 -2.706 3.278 93 HB VAL 15 HB VAL 15 -3.915 -5.704 3.361 94 HG11 VAL 15 1HG1 VAL 15 -2.815 -4.921 5.309 95 HG12 VAL 15 2HG1 VAL 15 -3.909 -3.545 5.459 96 HG13 VAL 15 3HG1 VAL 15 -4.500 -5.180 5.757 97 HG21 VAL 15 1HG2 VAL 15 -5.986 -5.008 2.555 98 HG22 VAL 15 2HG2 VAL 15 -6.222 -5.049 4.302 99 HG23 VAL 15 3HG2 VAL 15 -5.953 -3.509 3.485 100 H MET 16 H MET 16 -1.480 -2.095 2.552 101 HA MET 16 HA MET 16 0.564 -3.929 3.453 102 HB2 MET 16 2HB MET 16 0.350 -3.048 0.584 103 HB3 MET 16 3HB MET 16 1.895 -3.498 1.293 104 HG2 MET 16 2HG MET 16 0.689 -5.674 1.972 105 HG3 MET 16 3HG MET 16 -0.502 -5.199 0.764 106 HE1 MET 16 1HE MET 16 2.454 -7.825 0.636 107 HE2 MET 16 2HE MET 16 3.720 -6.626 0.376 108 HE3 MET 16 3HE MET 16 2.651 -6.490 1.772 109 H HIS 17 H HIS 17 2.530 -2.906 3.953 110 HA HIS 17 HA HIS 17 2.303 -0.191 4.730 111 HB2 HIS 17 2HB HIS 17 4.707 -2.020 4.599 112 HB3 HIS 17 3HB HIS 17 4.720 -0.420 5.335 113 HD1 HIS 17 HD1 HIS 17 2.678 -3.617 5.715 114 HD2 HIS 17 HD2 HIS 17 4.283 -0.534 7.992 115 HE1 HIS 17 HE1 HIS 17 2.128 -4.187 8.102 116 H TYR 18 H TYR 18 4.566 1.115 4.185 117 HA TYR 18 HA TYR 18 5.447 1.038 1.506 118 HB2 TYR 18 2HB TYR 18 4.250 2.760 0.461 119 HB3 TYR 18 3HB TYR 18 3.005 1.846 1.307 120 HD1 TYR 18 HD1 TYR 18 2.641 2.726 3.840 121 HD2 TYR 18 HD2 TYR 18 4.098 5.051 0.589 122 HE1 TYR 18 HE1 TYR 18 1.909 4.775 4.986 123 HE2 TYR 18 HE2 TYR 18 3.371 7.107 1.726 124 HH TYR 18 HH TYR 18 2.085 7.919 3.419 125 H GLY 19 H GLY 19 6.574 3.181 0.912 126 HA2 GLY 19 2HA GLY 19 8.344 3.827 3.054 127 HA3 GLY 19 3HA GLY 19 8.346 4.549 1.452 Start of MODEL 5 1 H1 GLY 1 H GLY 1 1.953 0.422 0.605 2 HA2 GLY 1 2HA GLY 1 1.644 0.830 -2.302 3 HA3 GLY 1 3HA GLY 1 3.048 1.328 -1.370 4 H SER 2 H SER 2 3.625 -0.906 0.089 5 HA SER 2 HA SER 2 3.655 -3.277 -1.500 6 HB2 SER 2 2HB SER 2 5.322 -2.207 -2.817 7 HB3 SER 2 3HB SER 2 6.137 -1.562 -1.393 8 HG SER 2 HG SER 2 7.042 -3.526 -2.469 9 H ASP 3 H ASP 3 6.181 -1.953 0.611 10 HA ASP 3 HA ASP 3 5.264 -3.259 2.961 11 HB2 ASP 3 2HB ASP 3 5.997 -5.260 1.747 12 HB3 ASP 3 3HB ASP 3 7.591 -4.547 1.518 13 H GLY 4 H GLY 4 5.757 -0.828 3.135 14 HA2 GLY 4 2HA GLY 4 8.595 -0.285 3.603 15 HA3 GLY 4 3HA GLY 4 7.305 0.908 3.559 16 HA PRO 5 HA PRO 5 8.532 -0.021 7.986 17 HB2 PRO 5 2HB PRO 5 9.164 2.536 8.644 18 HB3 PRO 5 3HB PRO 5 10.335 1.403 7.957 19 HG2 PRO 5 2HG PRO 5 8.771 3.566 6.601 20 HG3 PRO 5 3HG PRO 5 10.477 3.126 6.403 21 HD2 PRO 5 2HD PRO 5 8.562 2.359 4.650 22 HD3 PRO 5 3HD PRO 5 9.990 1.365 4.999 23 H ILE 6 H ILE 6 6.476 2.246 6.342 24 HA ILE 6 HA ILE 6 4.807 2.487 8.759 25 HB ILE 6 HB ILE 6 3.773 4.456 7.465 26 HG12 ILE 6 2HG1 ILE 6 6.382 4.112 5.974 27 HG13 ILE 6 3HG1 ILE 6 4.760 4.034 5.294 28 HG21 ILE 6 1HG2 ILE 6 6.570 5.119 8.192 29 HG22 ILE 6 2HG2 ILE 6 5.060 5.882 8.685 30 HG23 ILE 6 3HG2 ILE 6 5.562 4.362 9.425 31 HD11 ILE 6 1HD1 ILE 6 6.460 6.307 5.719 32 HD12 ILE 6 2HD1 ILE 6 4.954 6.182 4.809 33 HD13 ILE 6 3HD1 ILE 6 4.914 6.522 6.539 34 H ILE 7 H ILE 7 2.504 2.423 8.479 35 HA ILE 7 HA ILE 7 1.717 0.517 6.426 36 HB ILE 7 HB ILE 7 0.172 1.629 8.772 37 HG12 ILE 7 2HG1 ILE 7 1.065 -1.216 8.481 38 HG13 ILE 7 3HG1 ILE 7 2.216 -0.005 9.035 39 HG21 ILE 7 1HG2 ILE 7 -0.552 -0.530 6.796 40 HG22 ILE 7 2HG2 ILE 7 -1.434 -0.189 8.284 41 HG23 ILE 7 3HG2 ILE 7 -1.355 1.026 7.008 42 HD11 ILE 7 1HD1 ILE 7 1.423 -0.680 11.039 43 HD12 ILE 7 2HD1 ILE 7 0.217 0.559 10.690 44 HD13 ILE 7 3HD1 ILE 7 -0.151 -1.139 10.389 45 H GLU 8 H GLU 8 0.113 0.856 4.905 46 HA GLU 8 HA GLU 8 -0.219 3.585 4.052 47 HB2 GLU 8 2HB GLU 8 -1.157 0.944 2.943 48 HB3 GLU 8 3HB GLU 8 -1.603 2.481 2.217 49 HG2 GLU 8 2HG GLU 8 0.796 2.994 1.922 50 HG3 GLU 8 3HG GLU 8 1.182 1.391 2.546 51 H PHE 9 H PHE 9 -1.601 4.790 5.207 52 HA PHE 9 HA PHE 9 -4.195 3.636 5.957 53 HB2 PHE 9 2HB PHE 9 -4.317 5.814 7.353 54 HB3 PHE 9 3HB PHE 9 -3.230 4.536 7.887 55 HD1 PHE 9 HD1 PHE 9 -0.835 4.800 7.754 56 HD2 PHE 9 HD2 PHE 9 -3.459 7.880 6.434 57 HE1 PHE 9 HE1 PHE 9 1.046 6.387 7.729 58 HE2 PHE 9 HE2 PHE 9 -1.583 9.471 6.406 59 HZ PHE 9 HZ PHE 9 0.673 8.725 7.053 60 H PHE 10 H PHE 10 -4.265 4.032 3.385 61 HA PHE 10 HA PHE 10 -6.115 6.225 3.065 62 HB2 PHE 10 2HB PHE 10 -4.897 7.123 1.053 63 HB3 PHE 10 3HB PHE 10 -4.108 7.444 2.594 64 HD1 PHE 10 HD1 PHE 10 -3.944 5.573 -0.541 65 HD2 PHE 10 HD2 PHE 10 -2.020 6.381 3.169 66 HE1 PHE 10 HE1 PHE 10 -1.878 4.544 -1.392 67 HE2 PHE 10 HE2 PHE 10 0.050 5.354 2.323 68 HZ PHE 10 HZ PHE 10 0.123 4.435 0.039 69 H ASN 11 H ASN 11 -6.124 3.302 2.916 70 HA ASN 11 HA ASN 11 -6.896 1.598 1.613 71 HB2 ASN 11 2HB ASN 11 -8.305 3.981 0.412 72 HB3 ASN 11 3HB ASN 11 -8.642 2.330 -0.098 73 HD21 ASN 11 1HD2 ASN 11 -8.917 0.828 1.928 74 HD22 ASN 11 2HD2 ASN 11 -10.039 1.422 3.099 75 HA PRO 12 HA PRO 12 -3.715 2.397 -1.677 76 HB2 PRO 12 2HB PRO 12 -2.246 0.182 -1.123 77 HB3 PRO 12 3HB PRO 12 -2.006 1.726 -0.295 78 HG2 PRO 12 2HG PRO 12 -3.515 -0.696 0.611 79 HG3 PRO 12 3HG PRO 12 -2.413 0.345 1.531 80 HD2 PRO 12 2HD PRO 12 -5.106 0.557 1.710 81 HD3 PRO 12 3HD PRO 12 -4.025 1.954 1.884 82 H ASN 13 H ASN 13 -4.916 -0.815 -0.679 83 HA ASN 13 HA ASN 13 -6.408 -1.324 -2.971 84 HB2 ASN 13 2HB ASN 13 -3.684 -1.437 -3.555 85 HB3 ASN 13 3HB ASN 13 -4.158 -3.123 -3.364 86 HD21 ASN 13 1HD2 ASN 13 -5.112 -0.123 -4.973 87 HD22 ASN 13 2HD2 ASN 13 -5.736 -0.879 -6.396 88 H GLY 14 H GLY 14 -4.036 -3.137 -1.007 89 HA2 GLY 14 2HA GLY 14 -6.272 -4.814 -0.063 90 HA3 GLY 14 3HA GLY 14 -4.771 -5.543 -0.614 91 H VAL 15 H VAL 15 -4.714 -2.547 1.140 92 HA VAL 15 HA VAL 15 -3.939 -1.974 3.203 93 HB VAL 15 HB VAL 15 -4.597 -4.792 4.062 94 HG11 VAL 15 1HG1 VAL 15 -3.893 -2.269 5.446 95 HG12 VAL 15 2HG1 VAL 15 -5.136 -3.278 6.189 96 HG13 VAL 15 3HG1 VAL 15 -3.531 -3.940 5.878 97 HG21 VAL 15 1HG2 VAL 15 -6.662 -3.104 4.860 98 HG22 VAL 15 2HG2 VAL 15 -6.349 -2.670 3.180 99 HG23 VAL 15 3HG2 VAL 15 -6.729 -4.339 3.604 100 H MET 16 H MET 16 -1.798 -1.652 2.907 101 HA MET 16 HA MET 16 0.000 -3.714 3.839 102 HB2 MET 16 2HB MET 16 0.032 -2.724 0.998 103 HB3 MET 16 3HB MET 16 1.483 -3.353 1.768 104 HG2 MET 16 2HG MET 16 0.099 -5.431 2.283 105 HG3 MET 16 3HG MET 16 -1.065 -4.791 1.124 106 HE1 MET 16 1HE MET 16 2.241 -6.286 1.892 107 HE2 MET 16 2HE MET 16 1.371 -7.601 1.102 108 HE3 MET 16 3HE MET 16 2.823 -6.931 0.356 109 H HIS 17 H HIS 17 2.402 -2.729 3.364 110 HA HIS 17 HA HIS 17 2.326 -0.115 4.675 111 HB2 HIS 17 2HB HIS 17 4.564 -2.120 4.333 112 HB3 HIS 17 3HB HIS 17 4.743 -0.563 5.137 113 HD1 HIS 17 HD1 HIS 17 2.593 -3.684 5.491 114 HD2 HIS 17 HD2 HIS 17 4.313 -0.691 7.803 115 HE1 HIS 17 HE1 HIS 17 2.089 -4.303 7.876 116 H TYR 18 H TYR 18 4.482 1.186 4.078 117 HA TYR 18 HA TYR 18 5.330 1.119 1.374 118 HB2 TYR 18 2HB TYR 18 4.170 2.931 0.417 119 HB3 TYR 18 3HB TYR 18 2.921 1.988 1.222 120 HD1 TYR 18 HD1 TYR 18 3.978 5.211 0.629 121 HD2 TYR 18 HD2 TYR 18 2.645 2.746 3.830 122 HE1 TYR 18 HE1 TYR 18 3.278 7.214 1.873 123 HE2 TYR 18 HE2 TYR 18 1.940 4.742 5.082 124 HH TYR 18 HH TYR 18 1.597 7.752 3.701 125 H GLY 19 H GLY 19 6.458 3.293 0.805 126 HA2 GLY 19 2HA GLY 19 7.943 4.107 3.214 127 HA3 GLY 19 3HA GLY 19 8.565 4.162 1.572 Start of MODEL 6 1 H1 GLY 1 H GLY 1 1.781 -0.000 0.774 2 HA2 GLY 1 2HA GLY 1 0.492 -2.058 0.464 3 HA3 GLY 1 3HA GLY 1 0.183 -1.531 -1.184 4 H SER 2 H SER 2 2.970 -2.156 0.953 5 HA SER 2 HA SER 2 4.075 -4.006 -0.968 6 HB2 SER 2 2HB SER 2 5.105 -1.242 -0.679 7 HB3 SER 2 3HB SER 2 6.319 -2.522 -0.699 8 HG SER 2 HG SER 2 4.291 -2.565 -2.627 9 H ASP 3 H ASP 3 5.829 -2.042 1.383 10 HA ASP 3 HA ASP 3 5.630 -3.616 3.637 11 HB2 ASP 3 2HB ASP 3 7.941 -4.801 3.397 12 HB3 ASP 3 3HB ASP 3 6.514 -5.538 2.674 13 H GLY 4 H GLY 4 5.877 -0.948 3.222 14 HA2 GLY 4 2HA GLY 4 8.621 -0.125 3.682 15 HA3 GLY 4 3HA GLY 4 7.218 0.927 3.575 16 HA PRO 5 HA PRO 5 8.644 0.466 8.029 17 HB2 PRO 5 2HB PRO 5 9.168 3.097 8.446 18 HB3 PRO 5 3HB PRO 5 10.375 1.964 7.827 19 HG2 PRO 5 2HG PRO 5 8.677 3.925 6.333 20 HG3 PRO 5 3HG PRO 5 10.397 3.549 6.126 21 HD2 PRO 5 2HD PRO 5 8.479 2.544 4.500 22 HD3 PRO 5 3HD PRO 5 9.962 1.650 4.893 23 H ILE 6 H ILE 6 6.447 2.493 6.256 24 HA ILE 6 HA ILE 6 4.805 2.821 8.682 25 HB ILE 6 HB ILE 6 3.701 4.704 7.349 26 HG12 ILE 6 2HG1 ILE 6 6.243 4.337 5.753 27 HG13 ILE 6 3HG1 ILE 6 4.591 4.215 5.156 28 HG21 ILE 6 1HG2 ILE 6 6.574 5.185 8.101 29 HG22 ILE 6 2HG2 ILE 6 5.223 6.314 8.192 30 HG23 ILE 6 3HG2 ILE 6 5.294 4.934 9.288 31 HD11 ILE 6 1HD1 ILE 6 6.283 6.522 5.410 32 HD12 ILE 6 2HD1 ILE 6 4.743 6.341 4.570 33 HD13 ILE 6 3HD1 ILE 6 4.770 6.754 6.284 34 H ILE 7 H ILE 7 2.525 2.606 8.465 35 HA ILE 7 HA ILE 7 1.779 0.611 6.489 36 HB ILE 7 HB ILE 7 0.222 1.756 8.810 37 HG12 ILE 7 2HG1 ILE 7 1.272 -1.049 8.592 38 HG13 ILE 7 3HG1 ILE 7 2.320 0.248 9.158 39 HG21 ILE 7 1HG2 ILE 7 -1.330 -0.119 8.421 40 HG22 ILE 7 2HG2 ILE 7 -1.289 1.016 7.073 41 HG23 ILE 7 3HG2 ILE 7 -0.441 -0.525 6.953 42 HD11 ILE 7 1HD1 ILE 7 1.524 -0.469 11.149 43 HD12 ILE 7 2HD1 ILE 7 0.254 0.691 10.759 44 HD13 ILE 7 3HD1 ILE 7 -0.002 -1.029 10.467 45 H GLU 8 H GLU 8 0.218 0.845 4.930 46 HA GLU 8 HA GLU 8 -0.237 3.502 3.967 47 HB2 GLU 8 2HB GLU 8 -1.151 0.784 3.040 48 HB3 GLU 8 3HB GLU 8 -1.660 2.266 2.243 49 HG2 GLU 8 2HG GLU 8 0.730 2.816 1.864 50 HG3 GLU 8 3HG GLU 8 1.153 1.238 2.527 51 H PHE 9 H PHE 9 -1.583 4.731 5.153 52 HA PHE 9 HA PHE 9 -4.195 3.600 5.899 53 HB2 PHE 9 2HB PHE 9 -4.270 5.651 7.442 54 HB3 PHE 9 3HB PHE 9 -3.155 4.357 7.871 55 HD1 PHE 9 HD1 PHE 9 -0.839 4.741 8.015 56 HD2 PHE 9 HD2 PHE 9 -3.387 7.709 6.336 57 HE1 PHE 9 HE1 PHE 9 1.018 6.354 8.056 58 HE2 PHE 9 HE2 PHE 9 -1.533 9.326 6.373 59 HZ PHE 9 HZ PHE 9 0.673 8.649 7.233 60 H PHE 10 H PHE 10 -3.686 4.460 3.248 61 HA PHE 10 HA PHE 10 -5.447 6.818 3.102 62 HB2 PHE 10 2HB PHE 10 -4.305 7.253 0.866 63 HB3 PHE 10 3HB PHE 10 -3.344 7.565 2.307 64 HD1 PHE 10 HD1 PHE 10 -3.966 5.056 -0.349 65 HD2 PHE 10 HD2 PHE 10 -1.285 6.513 2.619 66 HE1 PHE 10 HE1 PHE 10 -2.210 3.560 -1.205 67 HE2 PHE 10 HE2 PHE 10 0.475 5.021 1.767 68 HZ PHE 10 HZ PHE 10 0.014 3.542 -0.148 69 H ASN 11 H ASN 11 -6.131 3.967 3.155 70 HA ASN 11 HA ASN 11 -7.431 2.443 2.070 71 HB2 ASN 11 2HB ASN 11 -8.398 5.094 1.075 72 HB3 ASN 11 3HB ASN 11 -9.058 3.625 0.363 73 HD21 ASN 11 1HD2 ASN 11 -11.067 4.452 1.268 74 HD22 ASN 11 2HD2 ASN 11 -11.449 4.096 2.915 75 HA PRO 12 HA PRO 12 -4.577 2.463 -1.637 76 HB2 PRO 12 2HB PRO 12 -3.310 0.147 -1.003 77 HB3 PRO 12 3HB PRO 12 -2.774 1.726 -0.418 78 HG2 PRO 12 2HG PRO 12 -4.405 -0.358 0.981 79 HG3 PRO 12 3HG PRO 12 -3.066 0.621 1.607 80 HD2 PRO 12 2HD PRO 12 -5.660 1.209 2.112 81 HD3 PRO 12 3HD PRO 12 -4.410 2.460 1.961 82 H ASN 13 H ASN 13 -4.082 0.194 -2.908 83 HA ASN 13 HA ASN 13 -6.700 -0.692 -3.729 84 HB2 ASN 13 2HB ASN 13 -3.924 -0.947 -4.763 85 HB3 ASN 13 3HB ASN 13 -5.071 -2.197 -5.235 86 HD21 ASN 13 1HD2 ASN 13 -4.997 -1.535 -7.383 87 HD22 ASN 13 2HD2 ASN 13 -5.782 -0.094 -7.923 88 H GLY 14 H GLY 14 -4.143 -1.864 -1.722 89 HA2 GLY 14 2HA GLY 14 -5.622 -4.400 -1.399 90 HA3 GLY 14 3HA GLY 14 -3.866 -4.356 -1.443 91 H VAL 15 H VAL 15 -2.805 -4.160 0.425 92 HA VAL 15 HA VAL 15 -3.581 -2.626 2.624 93 HB VAL 15 HB VAL 15 -5.407 -4.094 3.025 94 HG11 VAL 15 1HG1 VAL 15 -5.323 -6.113 2.080 95 HG12 VAL 15 2HG1 VAL 15 -3.558 -6.118 2.060 96 HG13 VAL 15 3HG1 VAL 15 -4.427 -6.627 3.509 97 HG21 VAL 15 1HG2 VAL 15 -3.637 -5.393 4.963 98 HG22 VAL 15 2HG2 VAL 15 -3.455 -3.641 4.876 99 HG23 VAL 15 3HG2 VAL 15 -5.033 -4.348 5.224 100 H MET 16 H MET 16 -1.363 -2.173 2.513 101 HA MET 16 HA MET 16 0.278 -3.930 4.088 102 HB2 MET 16 2HB MET 16 0.497 -3.913 1.179 103 HB3 MET 16 3HB MET 16 2.015 -3.510 1.971 104 HG2 MET 16 2HG MET 16 0.418 -5.906 2.790 105 HG3 MET 16 3HG MET 16 1.537 -5.962 1.430 106 HE1 MET 16 1HE MET 16 1.294 -7.182 4.802 107 HE2 MET 16 2HE MET 16 2.497 -6.363 5.797 108 HE3 MET 16 3HE MET 16 1.071 -5.488 5.239 109 H HIS 17 H HIS 17 2.705 -2.931 3.883 110 HA HIS 17 HA HIS 17 2.387 -0.215 4.814 111 HB2 HIS 17 2HB HIS 17 4.812 -2.009 4.607 112 HB3 HIS 17 3HB HIS 17 4.842 -0.386 5.291 113 HD1 HIS 17 HD1 HIS 17 2.937 -3.632 5.884 114 HD2 HIS 17 HD2 HIS 17 4.481 -0.385 7.966 115 HE1 HIS 17 HE1 HIS 17 2.506 -4.124 8.312 116 H TYR 18 H TYR 18 4.554 1.150 4.126 117 HA TYR 18 HA TYR 18 5.333 1.019 1.418 118 HB2 TYR 18 2HB TYR 18 4.035 2.677 0.377 119 HB3 TYR 18 3HB TYR 18 2.862 1.723 1.278 120 HD1 TYR 18 HD1 TYR 18 3.702 4.949 0.432 121 HD2 TYR 18 HD2 TYR 18 2.619 2.646 3.842 122 HE1 TYR 18 HE1 TYR 18 2.915 6.992 1.555 123 HE2 TYR 18 HE2 TYR 18 1.828 4.682 4.973 124 HH TYR 18 HH TYR 18 1.400 7.646 3.338 125 H GLY 19 H GLY 19 6.283 3.250 0.714 126 HA2 GLY 19 2HA GLY 19 7.323 5.294 1.397 127 HA3 GLY 19 3HA GLY 19 7.324 4.700 3.051 Start of MODEL 7 1 H1 GLY 1 H GLY 1 1.973 0.265 0.671 2 HA2 GLY 1 2HA GLY 1 1.812 0.663 -2.248 3 HA3 GLY 1 3HA GLY 1 3.126 1.232 -1.230 4 H SER 2 H SER 2 3.442 -1.179 0.279 5 HA SER 2 HA SER 2 3.779 -3.467 -1.290 6 HB2 SER 2 2HB SER 2 5.964 -1.472 -1.465 7 HB3 SER 2 3HB SER 2 6.460 -3.144 -1.204 8 HG SER 2 HG SER 2 5.045 -3.639 -3.042 9 H ASP 3 H ASP 3 6.204 -1.975 0.829 10 HA ASP 3 HA ASP 3 5.327 -3.249 3.201 11 HB2 ASP 3 2HB ASP 3 6.326 -5.142 1.684 12 HB3 ASP 3 3HB ASP 3 7.872 -4.475 2.203 13 H GLY 4 H GLY 4 5.774 -0.799 3.290 14 HA2 GLY 4 2HA GLY 4 8.597 -0.189 3.755 15 HA3 GLY 4 3HA GLY 4 7.285 0.977 3.668 16 HA PRO 5 HA PRO 5 8.509 0.215 8.127 17 HB2 PRO 5 2HB PRO 5 9.084 2.804 8.707 18 HB3 PRO 5 3HB PRO 5 10.281 1.675 8.061 19 HG2 PRO 5 2HG PRO 5 8.678 3.760 6.630 20 HG3 PRO 5 3HG PRO 5 10.395 3.351 6.452 21 HD2 PRO 5 2HD PRO 5 8.504 2.488 4.717 22 HD3 PRO 5 3HD PRO 5 9.951 1.536 5.103 23 H ILE 6 H ILE 6 6.415 2.388 6.405 24 HA ILE 6 HA ILE 6 4.725 2.660 8.805 25 HB ILE 6 HB ILE 6 3.667 4.581 7.469 26 HG12 ILE 6 2HG1 ILE 6 6.276 4.240 5.977 27 HG13 ILE 6 3HG1 ILE 6 4.653 4.127 5.305 28 HG21 ILE 6 1HG2 ILE 6 5.099 6.141 8.471 29 HG22 ILE 6 2HG2 ILE 6 5.243 4.697 9.472 30 HG23 ILE 6 3HG2 ILE 6 6.505 5.088 8.304 31 HD11 ILE 6 1HD1 ILE 6 4.772 6.643 6.488 32 HD12 ILE 6 2HD1 ILE 6 6.325 6.430 5.679 33 HD13 ILE 6 3HD1 ILE 6 4.826 6.263 4.767 34 H ILE 7 H ILE 7 2.438 2.508 8.531 35 HA ILE 7 HA ILE 7 1.698 0.547 6.521 36 HB ILE 7 HB ILE 7 0.113 1.711 8.812 37 HG12 ILE 7 2HG1 ILE 7 1.050 -1.129 8.611 38 HG13 ILE 7 3HG1 ILE 7 2.170 0.116 9.154 39 HG21 ILE 7 1HG2 ILE 7 -1.379 1.034 7.036 40 HG22 ILE 7 2HG2 ILE 7 -0.567 -0.526 6.909 41 HG23 ILE 7 3HG2 ILE 7 -1.477 -0.123 8.364 42 HD11 ILE 7 1HD1 ILE 7 0.113 0.680 10.751 43 HD12 ILE 7 2HD1 ILE 7 -0.181 -1.042 10.504 44 HD13 ILE 7 3HD1 ILE 7 1.360 -0.496 11.164 45 H GLU 8 H GLU 8 0.138 0.816 4.951 46 HA GLU 8 HA GLU 8 -0.220 3.496 3.989 47 HB2 GLU 8 2HB GLU 8 -1.181 0.811 3.008 48 HB3 GLU 8 3HB GLU 8 -1.598 2.318 2.205 49 HG2 GLU 8 2HG GLU 8 0.799 2.778 1.881 50 HG3 GLU 8 3HG GLU 8 1.174 1.219 2.615 51 H PHE 9 H PHE 9 -1.600 4.759 5.080 52 HA PHE 9 HA PHE 9 -4.213 3.650 5.847 53 HB2 PHE 9 2HB PHE 9 -4.309 5.837 7.227 54 HB3 PHE 9 3HB PHE 9 -3.248 4.546 7.781 55 HD1 PHE 9 HD1 PHE 9 -3.384 7.849 6.186 56 HD2 PHE 9 HD2 PHE 9 -0.874 4.805 7.783 57 HE1 PHE 9 HE1 PHE 9 -1.483 9.411 6.164 58 HE2 PHE 9 HE2 PHE 9 1.031 6.362 7.764 59 HZ PHE 9 HZ PHE 9 0.728 8.668 6.955 60 H PHE 10 H PHE 10 -4.058 4.118 3.213 61 HA PHE 10 HA PHE 10 -5.861 6.387 2.880 62 HB2 PHE 10 2HB PHE 10 -4.595 6.980 0.733 63 HB3 PHE 10 3HB PHE 10 -3.855 7.460 2.256 64 HD1 PHE 10 HD1 PHE 10 -3.564 5.391 -0.702 65 HD2 PHE 10 HD2 PHE 10 -1.911 6.229 3.130 66 HE1 PHE 10 HE1 PHE 10 -1.507 4.196 -1.332 67 HE2 PHE 10 HE2 PHE 10 0.149 5.037 2.506 68 HZ PHE 10 HZ PHE 10 0.353 4.019 0.272 69 H ASN 11 H ASN 11 -5.851 3.350 2.784 70 HA ASN 11 HA ASN 11 -6.745 1.658 1.544 71 HB2 ASN 11 2HB ASN 11 -8.386 4.065 0.946 72 HB3 ASN 11 3HB ASN 11 -8.639 2.650 -0.072 73 HD21 ASN 11 1HD2 ASN 11 -8.617 3.790 3.253 74 HD22 ASN 11 2HD2 ASN 11 -9.721 2.608 3.859 75 HA PRO 12 HA PRO 12 -4.084 2.706 -2.140 76 HB2 PRO 12 2HB PRO 12 -2.365 0.631 -1.802 77 HB3 PRO 12 3HB PRO 12 -2.144 2.200 -1.017 78 HG2 PRO 12 2HG PRO 12 -3.294 -0.330 0.096 79 HG3 PRO 12 3HG PRO 12 -2.165 0.812 0.849 80 HD2 PRO 12 2HD PRO 12 -4.814 0.797 1.412 81 HD3 PRO 12 3HD PRO 12 -3.843 2.283 1.428 82 H ASN 13 H ASN 13 -4.830 -0.591 -0.985 83 HA ASN 13 HA ASN 13 -6.596 -1.257 -3.026 84 HB2 ASN 13 2HB ASN 13 -4.026 -1.095 -4.048 85 HB3 ASN 13 3HB ASN 13 -4.235 -2.817 -3.747 86 HD21 ASN 13 1HD2 ASN 13 -4.488 -3.574 -5.757 87 HD22 ASN 13 2HD2 ASN 13 -5.745 -3.091 -6.840 88 H GLY 14 H GLY 14 -6.154 -1.675 -0.215 89 HA2 GLY 14 2HA GLY 14 -7.259 -3.957 0.445 90 HA3 GLY 14 3HA GLY 14 -5.670 -4.558 -0.005 91 H VAL 15 H VAL 15 -3.872 -4.051 1.285 92 HA VAL 15 HA VAL 15 -3.879 -2.347 3.501 93 HB VAL 15 HB VAL 15 -5.515 -3.744 4.540 94 HG11 VAL 15 1HG1 VAL 15 -4.990 -5.726 3.038 95 HG12 VAL 15 2HG1 VAL 15 -3.729 -6.138 4.202 96 HG13 VAL 15 3HG1 VAL 15 -5.418 -6.090 4.710 97 HG21 VAL 15 1HG2 VAL 15 -3.117 -3.156 5.677 98 HG22 VAL 15 2HG2 VAL 15 -4.494 -3.839 6.541 99 HG23 VAL 15 3HG2 VAL 15 -3.212 -4.896 5.948 100 H MET 16 H MET 16 -1.780 -1.880 3.283 101 HA MET 16 HA MET 16 0.184 -3.848 3.989 102 HB2 MET 16 2HB MET 16 -0.171 -2.997 1.158 103 HB3 MET 16 3HB MET 16 1.473 -3.162 1.759 104 HG2 MET 16 2HG MET 16 0.720 -5.483 2.565 105 HG3 MET 16 3HG MET 16 -0.643 -5.255 1.472 106 HE1 MET 16 1HE MET 16 0.547 -5.068 -1.887 107 HE2 MET 16 2HE MET 16 -0.101 -3.954 -0.683 108 HE3 MET 16 3HE MET 16 1.542 -3.741 -1.287 109 H HIS 17 H HIS 17 2.488 -2.775 3.562 110 HA HIS 17 HA HIS 17 2.310 -0.124 4.784 111 HB2 HIS 17 2HB HIS 17 4.615 -2.064 4.537 112 HB3 HIS 17 3HB HIS 17 4.733 -0.478 5.292 113 HD1 HIS 17 HD1 HIS 17 2.649 -3.637 5.716 114 HD2 HIS 17 HD2 HIS 17 4.300 -0.553 7.957 115 HE1 HIS 17 HE1 HIS 17 2.140 -4.201 8.114 116 H TYR 18 H TYR 18 4.477 1.190 4.173 117 HA TYR 18 HA TYR 18 5.356 1.076 1.490 118 HB2 TYR 18 2HB TYR 18 4.151 2.808 0.444 119 HB3 TYR 18 3HB TYR 18 2.920 1.850 1.262 120 HD1 TYR 18 HD1 TYR 18 2.634 2.702 3.866 121 HD2 TYR 18 HD2 TYR 18 3.804 5.077 0.535 122 HE1 TYR 18 HE1 TYR 18 1.835 4.716 5.029 123 HE2 TYR 18 HE2 TYR 18 3.009 7.098 1.690 124 HH TYR 18 HH TYR 18 1.478 6.905 4.887 125 H GLY 19 H GLY 19 6.376 3.309 0.863 126 HA2 GLY 19 2HA GLY 19 7.385 5.341 1.700 127 HA3 GLY 19 3HA GLY 19 7.455 4.593 3.288 Start of MODEL 8 1 H1 GLY 1 H GLY 1 1.837 -0.023 0.677 2 HA2 GLY 1 2HA GLY 1 0.537 -2.045 0.210 3 HA3 GLY 1 3HA GLY 1 0.335 -1.448 -1.430 4 H SER 2 H SER 2 3.034 -2.098 0.813 5 HA SER 2 HA SER 2 4.201 -3.957 -1.067 6 HB2 SER 2 2HB SER 2 5.141 -2.023 -2.057 7 HB3 SER 2 3HB SER 2 5.460 -1.277 -0.491 8 HG SER 2 HG SER 2 7.175 -2.572 -1.865 9 H ASP 3 H ASP 3 5.912 -2.012 1.322 10 HA ASP 3 HA ASP 3 5.619 -3.606 3.568 11 HB2 ASP 3 2HB ASP 3 7.049 -4.993 1.612 12 HB3 ASP 3 3HB ASP 3 8.279 -4.402 2.725 13 H GLY 4 H GLY 4 6.000 -0.874 2.838 14 HA2 GLY 4 2HA GLY 4 8.635 -0.005 3.486 15 HA3 GLY 4 3HA GLY 4 7.197 1.002 3.427 16 HA PRO 5 HA PRO 5 8.694 0.433 7.850 17 HB2 PRO 5 2HB PRO 5 9.194 3.056 8.341 18 HB3 PRO 5 3HB PRO 5 10.406 1.955 7.676 19 HG2 PRO 5 2HG PRO 5 8.672 3.941 6.260 20 HG3 PRO 5 3HG PRO 5 10.394 3.591 6.023 21 HD2 PRO 5 2HD PRO 5 8.470 2.614 4.387 22 HD3 PRO 5 3HD PRO 5 9.967 1.725 4.739 23 H ILE 6 H ILE 6 6.464 2.503 6.165 24 HA ILE 6 HA ILE 6 4.842 2.733 8.615 25 HB ILE 6 HB ILE 6 3.704 4.644 7.349 26 HG12 ILE 6 2HG1 ILE 6 6.238 4.357 5.724 27 HG13 ILE 6 3HG1 ILE 6 4.584 4.230 5.135 28 HG21 ILE 6 1HG2 ILE 6 6.473 5.502 7.879 29 HG22 ILE 6 2HG2 ILE 6 4.952 6.091 8.547 30 HG23 ILE 6 3HG2 ILE 6 5.679 4.614 9.179 31 HD11 ILE 6 1HD1 ILE 6 4.696 6.374 4.614 32 HD12 ILE 6 2HD1 ILE 6 4.745 6.737 6.340 33 HD13 ILE 6 3HD1 ILE 6 6.247 6.548 5.435 34 H ILE 7 H ILE 7 2.551 2.529 8.399 35 HA ILE 7 HA ILE 7 1.808 0.567 6.391 36 HB ILE 7 HB ILE 7 0.232 1.675 8.718 37 HG12 ILE 7 2HG1 ILE 7 1.307 -1.118 8.512 38 HG13 ILE 7 3HG1 ILE 7 2.360 0.186 9.051 39 HG21 ILE 7 1HG2 ILE 7 -0.378 -0.625 6.866 40 HG22 ILE 7 2HG2 ILE 7 -1.294 -0.207 8.313 41 HG23 ILE 7 3HG2 ILE 7 -1.242 0.910 6.949 42 HD11 ILE 7 1HD1 ILE 7 1.592 -0.480 11.064 43 HD12 ILE 7 2HD1 ILE 7 0.287 0.635 10.660 44 HD13 ILE 7 3HD1 ILE 7 0.076 -1.097 10.408 45 H GLU 8 H GLU 8 0.204 0.811 4.863 46 HA GLU 8 HA GLU 8 -0.251 3.492 3.944 47 HB2 GLU 8 2HB GLU 8 -1.157 0.794 2.946 48 HB3 GLU 8 3HB GLU 8 -1.627 2.301 2.171 49 HG2 GLU 8 2HG GLU 8 0.755 2.825 1.815 50 HG3 GLU 8 3HG GLU 8 1.176 1.261 2.511 51 H PHE 9 H PHE 9 -1.619 4.676 5.152 52 HA PHE 9 HA PHE 9 -4.215 3.492 5.869 53 HB2 PHE 9 2HB PHE 9 -4.328 5.526 7.434 54 HB3 PHE 9 3HB PHE 9 -3.196 4.244 7.852 55 HD1 PHE 9 HD1 PHE 9 -3.510 7.645 6.490 56 HD2 PHE 9 HD2 PHE 9 -0.849 4.625 7.871 57 HE1 PHE 9 HE1 PHE 9 -1.681 9.290 6.551 58 HE2 PHE 9 HE2 PHE 9 0.984 6.265 7.936 59 HZ PHE 9 HZ PHE 9 0.569 8.601 7.276 60 H PHE 10 H PHE 10 -3.856 4.295 3.240 61 HA PHE 10 HA PHE 10 -5.650 6.623 3.114 62 HB2 PHE 10 2HB PHE 10 -4.481 7.174 0.911 63 HB3 PHE 10 3HB PHE 10 -3.584 7.516 2.386 64 HD1 PHE 10 HD1 PHE 10 -1.615 6.261 2.966 65 HD2 PHE 10 HD2 PHE 10 -3.828 5.353 -0.555 66 HE1 PHE 10 HE1 PHE 10 0.261 4.898 2.143 67 HE2 PHE 10 HE2 PHE 10 -1.956 3.987 -1.383 68 HZ PHE 10 HZ PHE 10 0.091 3.758 -0.033 69 H ASN 11 H ASN 11 -6.546 4.007 3.172 70 HA ASN 11 HA ASN 11 -7.806 2.468 2.058 71 HB2 ASN 11 2HB ASN 11 -8.366 5.004 0.531 72 HB3 ASN 11 3HB ASN 11 -9.170 3.490 0.129 73 HD21 ASN 11 1HD2 ASN 11 -8.559 5.728 2.787 74 HD22 ASN 11 2HD2 ASN 11 -10.045 5.429 3.615 75 HA PRO 12 HA PRO 12 -4.478 1.892 -1.182 76 HB2 PRO 12 2HB PRO 12 -3.497 -0.417 -0.144 77 HB3 PRO 12 3HB PRO 12 -2.920 1.180 0.349 78 HG2 PRO 12 2HG PRO 12 -4.885 -0.626 1.704 79 HG3 PRO 12 3HG PRO 12 -3.569 0.327 2.413 80 HD2 PRO 12 2HD PRO 12 -6.153 1.134 2.481 81 HD3 PRO 12 3HD PRO 12 -4.798 2.277 2.385 82 H ASN 13 H ASN 13 -4.000 -0.525 -2.141 83 HA ASN 13 HA ASN 13 -6.659 -1.675 -2.685 84 HB2 ASN 13 2HB ASN 13 -4.517 -0.779 -4.480 85 HB3 ASN 13 3HB ASN 13 -5.128 -2.388 -4.853 86 HD21 ASN 13 1HD2 ASN 13 -5.855 -1.375 -6.831 87 HD22 ASN 13 2HD2 ASN 13 -7.363 -0.532 -6.845 88 H GLY 14 H GLY 14 -3.305 -2.281 -1.957 89 HA2 GLY 14 2HA GLY 14 -3.774 -5.184 -2.059 90 HA3 GLY 14 3HA GLY 14 -2.198 -4.406 -2.012 91 H VAL 15 H VAL 15 -3.500 -2.589 0.145 92 HA VAL 15 HA VAL 15 -3.569 -2.487 2.419 93 HB VAL 15 HB VAL 15 -4.059 -5.464 2.385 94 HG11 VAL 15 1HG1 VAL 15 -5.328 -4.916 4.473 95 HG12 VAL 15 2HG1 VAL 15 -3.584 -4.671 4.585 96 HG13 VAL 15 3HG1 VAL 15 -4.660 -3.287 4.379 97 HG21 VAL 15 1HG2 VAL 15 -6.500 -4.182 2.696 98 HG22 VAL 15 2HG2 VAL 15 -5.705 -3.295 1.397 99 HG23 VAL 15 3HG2 VAL 15 -5.937 -5.038 1.261 100 H MET 16 H MET 16 -1.240 -2.052 2.177 101 HA MET 16 HA MET 16 0.275 -3.808 3.889 102 HB2 MET 16 2HB MET 16 0.622 -3.860 0.996 103 HB3 MET 16 3HB MET 16 2.112 -3.461 1.840 104 HG2 MET 16 2HG MET 16 0.461 -5.799 2.698 105 HG3 MET 16 3HG MET 16 1.565 -5.927 1.330 106 HE1 MET 16 1HE MET 16 2.312 -5.698 5.730 107 HE2 MET 16 2HE MET 16 0.825 -5.856 4.795 108 HE3 MET 16 3HE MET 16 1.903 -7.240 4.977 109 H HIS 17 H HIS 17 2.741 -2.867 3.754 110 HA HIS 17 HA HIS 17 2.462 -0.159 4.688 111 HB2 HIS 17 2HB HIS 17 4.873 -1.965 4.433 112 HB3 HIS 17 3HB HIS 17 4.917 -0.356 5.147 113 HD1 HIS 17 HD1 HIS 17 3.096 -3.651 5.699 114 HD2 HIS 17 HD2 HIS 17 4.473 -0.353 7.817 115 HE1 HIS 17 HE1 HIS 17 2.652 -4.173 8.118 116 H TYR 18 H TYR 18 4.542 1.268 4.011 117 HA TYR 18 HA TYR 18 5.343 1.156 1.297 118 HB2 TYR 18 2HB TYR 18 4.036 2.829 0.287 119 HB3 TYR 18 3HB TYR 18 2.871 1.845 1.167 120 HD1 TYR 18 HD1 TYR 18 2.652 2.717 3.764 121 HD2 TYR 18 HD2 TYR 18 3.640 5.091 0.374 122 HE1 TYR 18 HE1 TYR 18 1.840 4.720 4.938 123 HE2 TYR 18 HE2 TYR 18 2.832 7.101 1.539 124 HH TYR 18 HH TYR 18 2.578 7.624 4.346 125 H GLY 19 H GLY 19 6.257 3.421 0.622 126 HA2 GLY 19 2HA GLY 19 7.297 5.453 1.327 127 HA3 GLY 19 3HA GLY 19 7.304 4.840 2.974 Start of MODEL 9 1 H1 GLY 1 H GLY 1 1.825 -0.049 0.713 2 HA2 GLY 1 2HA GLY 1 0.507 -2.067 0.269 3 HA3 GLY 1 3HA GLY 1 0.306 -1.482 -1.377 4 H SER 2 H SER 2 3.005 -2.128 0.866 5 HA SER 2 HA SER 2 4.158 -4.009 -0.999 6 HB2 SER 2 2HB SER 2 5.092 -2.065 -1.998 7 HB3 SER 2 3HB SER 2 5.455 -1.343 -0.430 8 HG SER 2 HG SER 2 7.345 -2.185 -1.240 9 H ASP 3 H ASP 3 5.886 -2.054 1.369 10 HA ASP 3 HA ASP 3 5.587 -3.627 3.630 11 HB2 ASP 3 2HB ASP 3 7.004 -5.041 1.682 12 HB3 ASP 3 3HB ASP 3 8.240 -4.449 2.788 13 H GLY 4 H GLY 4 5.984 -0.904 2.876 14 HA2 GLY 4 2HA GLY 4 8.627 -0.048 3.511 15 HA3 GLY 4 3HA GLY 4 7.195 0.969 3.445 16 HA PRO 5 HA PRO 5 8.696 0.430 7.871 17 HB2 PRO 5 2HB PRO 5 9.212 3.054 8.338 18 HB3 PRO 5 3HB PRO 5 10.417 1.940 7.681 19 HG2 PRO 5 2HG PRO 5 8.692 3.924 6.250 20 HG3 PRO 5 3HG PRO 5 10.411 3.561 6.013 21 HD2 PRO 5 2HD PRO 5 8.479 2.581 4.389 22 HD3 PRO 5 3HD PRO 5 9.971 1.687 4.746 23 H ILE 6 H ILE 6 6.476 2.500 6.172 24 HA ILE 6 HA ILE 6 4.859 2.761 8.622 25 HB ILE 6 HB ILE 6 3.731 4.667 7.342 26 HG12 ILE 6 2HG1 ILE 6 6.257 4.348 5.711 27 HG13 ILE 6 3HG1 ILE 6 4.600 4.229 5.129 28 HG21 ILE 6 1HG2 ILE 6 5.551 4.718 9.226 29 HG22 ILE 6 2HG2 ILE 6 6.569 5.354 7.935 30 HG23 ILE 6 3HG2 ILE 6 5.088 6.198 8.386 31 HD11 ILE 6 1HD1 ILE 6 4.780 6.744 6.309 32 HD12 ILE 6 2HD1 ILE 6 6.281 6.537 5.407 33 HD13 ILE 6 3HD1 ILE 6 4.729 6.367 4.588 34 H ILE 7 H ILE 7 2.567 2.570 8.412 35 HA ILE 7 HA ILE 7 1.808 0.593 6.423 36 HB ILE 7 HB ILE 7 0.243 1.732 8.742 37 HG12 ILE 7 2HG1 ILE 7 1.301 -1.068 8.564 38 HG13 ILE 7 3HG1 ILE 7 2.364 0.234 9.085 39 HG21 ILE 7 1HG2 ILE 7 -1.239 0.959 6.983 40 HG22 ILE 7 2HG2 ILE 7 -0.382 -0.580 6.912 41 HG23 ILE 7 3HG2 ILE 7 -1.295 -0.146 8.357 42 HD11 ILE 7 1HD1 ILE 7 0.064 -1.007 10.460 43 HD12 ILE 7 2HD1 ILE 7 1.596 -0.417 11.105 44 HD13 ILE 7 3HD1 ILE 7 0.312 0.722 10.700 45 H GLU 8 H GLU 8 0.203 0.833 4.896 46 HA GLU 8 HA GLU 8 -0.238 3.509 3.953 47 HB2 GLU 8 2HB GLU 8 -1.162 0.808 2.981 48 HB3 GLU 8 3HB GLU 8 -1.624 2.310 2.193 49 HG2 GLU 8 2HG GLU 8 0.761 2.817 1.829 50 HG3 GLU 8 3HG GLU 8 1.173 1.256 2.538 51 H PHE 9 H PHE 9 -1.596 4.711 5.155 52 HA PHE 9 HA PHE 9 -4.198 3.550 5.887 53 HB2 PHE 9 2HB PHE 9 -4.296 5.598 7.434 54 HB3 PHE 9 3HB PHE 9 -3.170 4.313 7.861 55 HD1 PHE 9 HD1 PHE 9 -3.467 7.704 6.469 56 HD2 PHE 9 HD2 PHE 9 -0.821 4.680 7.872 57 HE1 PHE 9 HE1 PHE 9 -1.628 9.338 6.513 58 HE2 PHE 9 HE2 PHE 9 1.022 6.309 7.919 59 HZ PHE 9 HZ PHE 9 0.620 8.642 7.239 60 H PHE 10 H PHE 10 -3.841 4.326 3.250 61 HA PHE 10 HA PHE 10 -5.620 6.664 3.107 62 HB2 PHE 10 2HB PHE 10 -4.453 7.187 0.896 63 HB3 PHE 10 3HB PHE 10 -3.551 7.538 2.367 64 HD1 PHE 10 HD1 PHE 10 -3.812 5.350 -0.553 65 HD2 PHE 10 HD2 PHE 10 -1.588 6.276 2.955 66 HE1 PHE 10 HE1 PHE 10 -1.951 3.965 -1.372 67 HE2 PHE 10 HE2 PHE 10 0.277 4.894 2.142 68 HZ PHE 10 HZ PHE 10 0.098 3.737 -0.025 69 H ASN 11 H ASN 11 -6.532 4.053 3.190 70 HA ASN 11 HA ASN 11 -7.803 2.511 2.093 71 HB2 ASN 11 2HB ASN 11 -8.347 5.017 0.504 72 HB3 ASN 11 3HB ASN 11 -9.191 3.504 0.190 73 HD21 ASN 11 1HD2 ASN 11 -9.742 6.306 1.470 74 HD22 ASN 11 2HD2 ASN 11 -10.719 5.897 2.835 75 HA PRO 12 HA PRO 12 -4.485 1.889 -1.150 76 HB2 PRO 12 2HB PRO 12 -3.515 -0.417 -0.095 77 HB3 PRO 12 3HB PRO 12 -2.928 1.180 0.384 78 HG2 PRO 12 2HG PRO 12 -4.901 -0.603 1.759 79 HG3 PRO 12 3HG PRO 12 -3.577 0.349 2.456 80 HD2 PRO 12 2HD PRO 12 -6.156 1.172 2.523 81 HD3 PRO 12 3HD PRO 12 -4.795 2.306 2.414 82 H ASN 13 H ASN 13 -4.024 -0.537 -2.092 83 HA ASN 13 HA ASN 13 -6.690 -1.678 -2.618 84 HB2 ASN 13 2HB ASN 13 -4.362 -1.178 -4.457 85 HB3 ASN 13 3HB ASN 13 -5.580 -2.388 -4.847 86 HD21 ASN 13 1HD2 ASN 13 -7.472 -1.757 -5.689 87 HD22 ASN 13 2HD2 ASN 13 -7.933 -0.112 -5.949 88 H GLY 14 H GLY 14 -3.342 -2.293 -1.882 89 HA2 GLY 14 2HA GLY 14 -3.824 -5.195 -1.964 90 HA3 GLY 14 3HA GLY 14 -2.245 -4.425 -1.927 91 H VAL 15 H VAL 15 -3.532 -2.584 0.218 92 HA VAL 15 HA VAL 15 -3.596 -2.463 2.491 93 HB VAL 15 HB VAL 15 -4.103 -5.438 2.482 94 HG11 VAL 15 1HG1 VAL 15 -5.574 -4.274 4.494 95 HG12 VAL 15 2HG1 VAL 15 -4.031 -5.108 4.691 96 HG13 VAL 15 3HG1 VAL 15 -4.071 -3.353 4.515 97 HG21 VAL 15 1HG2 VAL 15 -5.812 -3.183 1.660 98 HG22 VAL 15 2HG2 VAL 15 -5.885 -4.887 1.209 99 HG23 VAL 15 3HG2 VAL 15 -6.557 -4.353 2.749 100 H MET 16 H MET 16 -1.264 -2.045 2.238 101 HA MET 16 HA MET 16 0.243 -3.795 3.963 102 HB2 MET 16 2HB MET 16 0.584 -3.874 1.070 103 HB3 MET 16 3HB MET 16 2.078 -3.477 1.908 104 HG2 MET 16 2HG MET 16 0.412 -5.799 2.783 105 HG3 MET 16 3HG MET 16 1.521 -5.943 1.422 106 HE1 MET 16 1HE MET 16 2.787 -8.059 3.454 107 HE2 MET 16 2HE MET 16 3.095 -7.372 1.859 108 HE3 MET 16 3HE MET 16 4.353 -7.332 3.095 109 H HIS 17 H HIS 17 2.713 -2.870 3.818 110 HA HIS 17 HA HIS 17 2.454 -0.152 4.727 111 HB2 HIS 17 2HB HIS 17 4.853 -1.975 4.483 112 HB3 HIS 17 3HB HIS 17 4.908 -0.360 5.182 113 HD1 HIS 17 HD1 HIS 17 3.070 -3.639 5.768 114 HD2 HIS 17 HD2 HIS 17 4.469 -0.329 7.853 115 HE1 HIS 17 HE1 HIS 17 2.628 -4.136 8.193 116 H TYR 18 H TYR 18 4.543 1.254 4.033 117 HA TYR 18 HA TYR 18 5.337 1.113 1.318 118 HB2 TYR 18 2HB TYR 18 4.038 2.786 0.295 119 HB3 TYR 18 3HB TYR 18 2.869 1.817 1.186 120 HD1 TYR 18 HD1 TYR 18 3.658 5.051 0.364 121 HD2 TYR 18 HD2 TYR 18 2.661 2.713 3.776 122 HE1 TYR 18 HE1 TYR 18 2.864 7.076 1.511 123 HE2 TYR 18 HE2 TYR 18 1.863 4.732 4.933 124 HH TYR 18 HH TYR 18 2.467 7.369 4.659 125 H GLY 19 H GLY 19 6.265 3.366 0.621 126 HA2 GLY 19 2HA GLY 19 8.230 4.063 2.530 127 HA3 GLY 19 3HA GLY 19 7.921 4.906 1.020 Start of MODEL 10 1 H1 GLY 1 H GLY 1 1.975 0.217 0.683 2 HA2 GLY 1 2HA GLY 1 0.768 -1.712 -0.170 3 HA3 GLY 1 3HA GLY 1 0.713 -0.912 -1.734 4 H SER 2 H SER 2 3.063 -2.125 0.650 5 HA SER 2 HA SER 2 4.407 -3.722 -1.276 6 HB2 SER 2 2HB SER 2 5.438 -0.989 -0.738 7 HB3 SER 2 3HB SER 2 6.628 -2.289 -0.780 8 HG SER 2 HG SER 2 6.380 -1.493 -2.851 9 H ASP 3 H ASP 3 6.013 -1.902 1.278 10 HA ASP 3 HA ASP 3 5.611 -3.554 3.448 11 HB2 ASP 3 2HB ASP 3 7.910 -4.786 3.323 12 HB3 ASP 3 3HB ASP 3 6.517 -5.462 2.483 13 H GLY 4 H GLY 4 5.927 -0.894 3.217 14 HA2 GLY 4 2HA GLY 4 8.653 -0.140 3.860 15 HA3 GLY 4 3HA GLY 4 7.270 0.938 3.744 16 HA PRO 5 HA PRO 5 8.459 0.205 8.230 17 HB2 PRO 5 2HB PRO 5 8.982 2.802 8.825 18 HB3 PRO 5 3HB PRO 5 10.210 1.693 8.203 19 HG2 PRO 5 2HG PRO 5 8.606 3.755 6.741 20 HG3 PRO 5 3HG PRO 5 10.331 3.373 6.599 21 HD2 PRO 5 2HD PRO 5 8.491 2.483 4.823 22 HD3 PRO 5 3HD PRO 5 9.945 1.553 5.239 23 H ILE 6 H ILE 6 6.371 2.353 6.468 24 HA ILE 6 HA ILE 6 4.613 2.565 8.825 25 HB ILE 6 HB ILE 6 3.586 4.521 7.522 26 HG12 ILE 6 2HG1 ILE 6 6.229 4.231 6.082 27 HG13 ILE 6 3HG1 ILE 6 4.622 4.138 5.370 28 HG21 ILE 6 1HG2 ILE 6 5.028 6.069 8.568 29 HG22 ILE 6 2HG2 ILE 6 5.069 4.619 9.569 30 HG23 ILE 6 3HG2 ILE 6 6.403 4.969 8.470 31 HD11 ILE 6 1HD1 ILE 6 4.793 6.292 4.908 32 HD12 ILE 6 2HD1 ILE 6 4.726 6.617 6.640 33 HD13 ILE 6 3HD1 ILE 6 6.285 6.426 5.838 34 H ILE 7 H ILE 7 2.306 2.522 8.410 35 HA ILE 7 HA ILE 7 1.655 0.589 6.325 36 HB ILE 7 HB ILE 7 -0.020 1.639 8.609 37 HG12 ILE 7 2HG1 ILE 7 0.978 -1.174 8.358 38 HG13 ILE 7 3HG1 ILE 7 2.066 0.072 8.960 39 HG21 ILE 7 1HG2 ILE 7 -0.581 -0.566 6.630 40 HG22 ILE 7 2HG2 ILE 7 -1.559 -0.196 8.050 41 HG23 ILE 7 3HG2 ILE 7 -1.421 0.981 6.743 42 HD11 ILE 7 1HD1 ILE 7 1.201 -0.674 10.921 43 HD12 ILE 7 2HD1 ILE 7 0.023 0.585 10.547 44 HD13 ILE 7 3HD1 ILE 7 -0.352 -1.103 10.203 45 H GLU 8 H GLU 8 0.146 0.921 4.721 46 HA GLU 8 HA GLU 8 -0.224 3.645 3.891 47 HB2 GLU 8 2HB GLU 8 -1.092 1.003 2.723 48 HB3 GLU 8 3HB GLU 8 -1.502 2.547 1.989 49 HG2 GLU 8 2HG GLU 8 0.913 3.057 1.818 50 HG3 GLU 8 3HG GLU 8 1.261 1.444 2.438 51 H PHE 9 H PHE 9 -1.658 4.800 5.044 52 HA PHE 9 HA PHE 9 -4.290 3.608 5.592 53 HB2 PHE 9 2HB PHE 9 -4.484 5.636 7.168 54 HB3 PHE 9 3HB PHE 9 -3.396 4.334 7.637 55 HD1 PHE 9 HD1 PHE 9 -3.582 7.753 6.297 56 HD2 PHE 9 HD2 PHE 9 -1.049 4.681 7.802 57 HE1 PHE 9 HE1 PHE 9 -1.737 9.371 6.486 58 HE2 PHE 9 HE2 PHE 9 0.799 6.293 7.994 59 HZ PHE 9 HZ PHE 9 0.456 8.642 7.337 60 H PHE 10 H PHE 10 -3.851 4.410 2.999 61 HA PHE 10 HA PHE 10 -5.619 6.751 2.809 62 HB2 PHE 10 2HB PHE 10 -4.352 7.332 0.675 63 HB3 PHE 10 3HB PHE 10 -3.513 7.642 2.191 64 HD1 PHE 10 HD1 PHE 10 -1.529 6.460 2.774 65 HD2 PHE 10 HD2 PHE 10 -3.698 5.437 -0.743 66 HE1 PHE 10 HE1 PHE 10 0.370 5.099 2.002 67 HE2 PHE 10 HE2 PHE 10 -1.803 4.074 -1.519 68 HZ PHE 10 HZ PHE 10 0.234 3.903 -0.147 69 H ASN 11 H ASN 11 -6.062 3.821 2.685 70 HA ASN 11 HA ASN 11 -7.173 2.266 1.443 71 HB2 ASN 11 2HB ASN 11 -8.357 4.890 0.687 72 HB3 ASN 11 3HB ASN 11 -8.799 3.493 -0.290 73 HD21 ASN 11 1HD2 ASN 11 -8.176 3.888 3.177 74 HD22 ASN 11 2HD2 ASN 11 -9.705 3.272 3.696 75 HA PRO 12 HA PRO 12 -4.202 2.792 -2.128 76 HB2 PRO 12 2HB PRO 12 -2.776 0.539 -1.612 77 HB3 PRO 12 3HB PRO 12 -2.392 2.106 -0.889 78 HG2 PRO 12 2HG PRO 12 -3.901 -0.200 0.280 79 HG3 PRO 12 3HG PRO 12 -2.670 0.830 1.035 80 HD2 PRO 12 2HD PRO 12 -5.321 1.172 1.467 81 HD3 PRO 12 3HD PRO 12 -4.172 2.525 1.463 82 H ASN 13 H ASN 13 -5.456 -0.300 -0.854 83 HA ASN 13 HA ASN 13 -7.161 -0.837 -2.991 84 HB2 ASN 13 2HB ASN 13 -4.460 -1.222 -3.701 85 HB3 ASN 13 3HB ASN 13 -5.139 -2.832 -3.476 86 HD21 ASN 13 1HD2 ASN 13 -6.078 -3.691 -5.173 87 HD22 ASN 13 2HD2 ASN 13 -6.740 -2.831 -6.517 88 H GLY 14 H GLY 14 -4.932 -2.251 -0.639 89 HA2 GLY 14 2HA GLY 14 -7.132 -3.955 0.300 90 HA3 GLY 14 3HA GLY 14 -5.597 -4.710 -0.102 91 H VAL 15 H VAL 15 -3.718 -4.129 1.143 92 HA VAL 15 HA VAL 15 -3.742 -2.460 3.386 93 HB VAL 15 HB VAL 15 -5.348 -3.894 4.414 94 HG11 VAL 15 1HG1 VAL 15 -4.069 -6.387 4.673 95 HG12 VAL 15 2HG1 VAL 15 -5.541 -6.011 3.774 96 HG13 VAL 15 3HG1 VAL 15 -3.973 -5.946 2.968 97 HG21 VAL 15 1HG2 VAL 15 -2.698 -4.746 5.559 98 HG22 VAL 15 2HG2 VAL 15 -3.353 -3.121 5.757 99 HG23 VAL 15 3HG2 VAL 15 -4.225 -4.509 6.409 100 H MET 16 H MET 16 -1.652 -1.956 3.167 101 HA MET 16 HA MET 16 0.341 -3.933 3.798 102 HB2 MET 16 2HB MET 16 -0.194 -3.231 1.040 103 HB3 MET 16 3HB MET 16 1.450 -2.802 1.492 104 HG2 MET 16 2HG MET 16 1.715 -5.139 2.362 105 HG3 MET 16 3HG MET 16 0.157 -5.509 1.626 106 HE1 MET 16 1HE MET 16 2.516 -7.172 1.115 107 HE2 MET 16 2HE MET 16 1.292 -7.495 -0.113 108 HE3 MET 16 3HE MET 16 2.966 -7.207 -0.591 109 H HIS 17 H HIS 17 2.634 -2.717 3.246 110 HA HIS 17 HA HIS 17 2.398 -0.146 4.651 111 HB2 HIS 17 2HB HIS 17 4.706 -2.087 4.445 112 HB3 HIS 17 3HB HIS 17 4.813 -0.510 5.222 113 HD1 HIS 17 HD1 HIS 17 2.776 -3.704 5.557 114 HD2 HIS 17 HD2 HIS 17 4.218 -0.563 7.863 115 HE1 HIS 17 HE1 HIS 17 2.171 -4.279 7.929 116 H TYR 18 H TYR 18 4.477 1.266 4.148 117 HA TYR 18 HA TYR 18 5.466 1.196 1.480 118 HB2 TYR 18 2HB TYR 18 4.296 2.971 0.474 119 HB3 TYR 18 3HB TYR 18 3.041 2.005 1.241 120 HD1 TYR 18 HD1 TYR 18 2.674 2.771 3.842 121 HD2 TYR 18 HD2 TYR 18 4.027 5.246 0.656 122 HE1 TYR 18 HE1 TYR 18 1.882 4.757 5.057 123 HE2 TYR 18 HE2 TYR 18 3.239 7.239 1.863 124 HH TYR 18 HH TYR 18 2.634 7.388 4.971 125 H GLY 19 H GLY 19 6.538 3.422 0.955 126 HA2 GLY 19 2HA GLY 19 7.733 5.309 1.701 127 HA3 GLY 19 3HA GLY 19 7.410 4.830 3.360
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