NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | in_recoord | stage | position | program | type |
9597 | 1odp | cing | recoord | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 1H TYR 1 1H TYR 1 2.038 13.389 6.329 2 2H TYR 1 2H TYR 1 2.510 13.349 4.716 3 3H TYR 1 3H TYR 1 0.906 13.658 5.115 4 HA TYR 1 HA TYR 1 0.394 11.539 5.568 5 1HB TYR 1 2HB TYR 1 1.581 10.028 3.911 6 2HB TYR 1 1HB TYR 1 1.090 11.519 3.161 7 HD1 TYR 1 HD1 TYR 1 3.989 9.576 4.465 8 HD2 TYR 1 HD2 TYR 1 2.813 13.098 2.299 9 HE1 TYR 1 HE1 TYR 1 6.296 9.860 3.670 10 HE2 TYR 1 HE2 TYR 1 5.137 13.378 1.513 11 HH TYR 1 HH TYR 1 7.444 10.959 1.722 12 H SER 2 H SER 2 3.828 12.140 5.897 13 HA SER 2 HA SER 2 5.435 11.137 7.327 14 1HB SER 2 1HB SER 2 3.264 11.326 8.953 15 2HB SER 2 2HB SER 2 3.329 9.572 8.911 16 HG SER 2 HG SER 2 4.928 9.708 10.258 17 H ASP 3 H ASP 3 6.741 9.738 6.738 18 HA ASP 3 HA ASP 3 6.575 8.029 4.721 19 1HB ASP 3 1HB ASP 3 8.515 8.457 6.623 20 2HB ASP 3 2HB ASP 3 8.039 6.862 7.161 21 H GLU 4 H GLU 4 5.479 6.819 7.872 22 HA GLU 4 HA GLU 4 5.487 4.019 6.934 23 1HB GLU 4 1HB GLU 4 4.707 3.486 9.127 24 2HB GLU 4 2HB GLU 4 5.715 4.894 9.362 25 1HG GLU 4 1HG GLU 4 3.638 6.365 9.514 26 2HG GLU 4 2HG GLU 4 2.612 4.983 9.232 27 H LEU 5 H LEU 5 3.056 6.513 7.231 28 HA LEU 5 HA LEU 5 0.772 4.682 6.878 29 1HB LEU 5 1HB LEU 5 1.164 7.710 6.758 30 2HB LEU 5 2HB LEU 5 -0.283 7.059 6.013 31 HG LEU 5 HG LEU 5 0.433 6.423 8.928 32 1HD1 LEU 5 3HD2 LEU 5 0.272 8.970 8.561 33 2HD1 LEU 5 1HD2 LEU 5 -1.392 8.750 8.009 34 3HD1 LEU 5 2HD2 LEU 5 -0.948 8.324 9.686 35 1HD2 LEU 5 2HD1 LEU 5 -1.315 4.993 7.756 36 2HD2 LEU 5 3HD1 LEU 5 -2.000 5.914 9.118 37 3HD2 LEU 5 1HD1 LEU 5 -2.277 6.449 7.443 38 H ARG 6 H ARG 6 2.861 6.406 4.724 39 HA ARG 6 HA ARG 6 1.225 5.968 2.321 40 1HB ARG 6 2HB ARG 6 3.176 7.658 2.640 41 2HB ARG 6 1HB ARG 6 4.293 6.312 2.514 42 1HG ARG 6 1HG ARG 6 4.348 6.672 0.238 43 2HG ARG 6 2HG ARG 6 2.750 5.935 0.177 44 1HD ARG 6 1HD ARG 6 1.798 8.343 0.661 45 2HD ARG 6 2HD ARG 6 3.448 8.933 0.337 46 HE ARG 6 HE ARG 6 1.691 7.421 -1.631 47 1HH1 ARG 6 2HH2 ARG 6 4.483 9.404 -1.068 48 2HH1 ARG 6 1HH2 ARG 6 4.760 9.666 -2.874 49 1HH2 ARG 6 2HH1 ARG 6 3.444 8.765 -4.237 50 2HH2 ARG 6 1HH1 ARG 6 2.055 7.745 -3.566 51 H GLN 7 H GLN 7 3.864 4.221 3.834 52 HA GLN 7 HA GLN 7 4.100 2.162 1.762 53 1HB GLN 7 1HB GLN 7 4.914 2.451 4.694 54 2HB GLN 7 2HB GLN 7 4.994 0.847 3.967 55 1HG GLN 7 2HG GLN 7 6.404 3.238 2.602 56 2HG GLN 7 1HG GLN 7 7.163 2.442 3.959 57 1HE2 GLN 7 2HE2 GLN 7 7.891 -0.546 1.991 58 2HE2 GLN 7 1HE2 GLN 7 7.120 -0.128 3.620 59 H ARG 8 H ARG 8 1.960 2.681 4.423 60 HA ARG 8 HA ARG 8 0.887 -0.062 4.556 61 1HB ARG 8 2HB ARG 8 0.649 1.772 6.350 62 2HB ARG 8 1HB ARG 8 -0.421 2.658 5.281 63 1HG ARG 8 1HG ARG 8 -1.119 -0.232 6.165 64 2HG ARG 8 2HG ARG 8 -1.529 1.167 7.152 65 1HD ARG 8 1HD ARG 8 -2.334 1.096 4.183 66 2HD ARG 8 2HD ARG 8 -3.287 0.206 5.399 67 HE ARG 8 HE ARG 8 -3.012 3.174 5.145 68 1HH1 ARG 8 2HH2 ARG 8 -4.043 0.588 7.218 69 2HH1 ARG 8 1HH2 ARG 8 -5.116 1.710 8.216 70 1HH2 ARG 8 1HH1 ARG 8 -4.192 4.326 6.270 71 2HH2 ARG 8 2HH1 ARG 8 -5.201 3.743 7.707 72 H LEU 9 H LEU 9 0.038 2.865 2.822 73 HA LEU 9 HA LEU 9 -2.315 1.724 1.470 74 1HB LEU 9 1HB LEU 9 -0.425 4.060 0.761 75 2HB LEU 9 2HB LEU 9 -1.759 3.608 -0.282 76 HG LEU 9 HG LEU 9 -2.067 4.523 2.640 77 1HD1 LEU 9 3HD2 LEU 9 -1.258 6.355 1.017 78 2HD1 LEU 9 1HD2 LEU 9 -2.738 6.127 0.078 79 3HD1 LEU 9 2HD2 LEU 9 -2.837 6.701 1.766 80 1HD2 LEU 9 2HD1 LEU 9 -3.909 2.985 1.793 81 2HD2 LEU 9 3HD1 LEU 9 -4.508 4.625 2.141 82 3HD2 LEU 9 1HD1 LEU 9 -4.220 4.112 0.460 83 H ALA 10 H ALA 10 1.094 1.618 0.915 84 HA ALA 10 HA ALA 10 0.913 0.487 -1.789 85 1HB ALA 10 2HB ALA 10 3.002 1.578 -0.878 86 2HB ALA 10 3HB ALA 10 3.170 0.296 0.344 87 3HB ALA 10 1HB ALA 10 3.362 -0.083 -1.385 88 H ALA 11 H ALA 11 0.724 -0.812 1.416 89 HA ALA 11 HA ALA 11 1.146 -3.610 0.630 90 1HB ALA 11 2HB ALA 11 1.482 -2.764 2.987 91 2HB ALA 11 3HB ALA 11 -0.253 -2.394 3.128 92 3HB ALA 11 1HB ALA 11 0.294 -4.082 2.982 93 H ARG 12 H ARG 12 -1.586 -1.486 0.693 94 HA ARG 12 HA ARG 12 -3.588 -3.639 0.273 95 1HB ARG 12 2HB ARG 12 -4.130 -1.315 1.201 96 2HB ARG 12 1HB ARG 12 -3.686 -0.594 -0.333 97 1HG ARG 12 2HG ARG 12 -5.995 -0.670 -0.654 98 2HG ARG 12 1HG ARG 12 -5.577 -2.213 -1.394 99 1HD ARG 12 2HD ARG 12 -6.447 -3.501 0.370 100 2HD ARG 12 1HD ARG 12 -6.175 -2.238 1.599 101 HE ARG 12 HE ARG 12 -8.535 -2.542 -0.127 102 1HH1 ARG 12 2HH2 ARG 12 -6.697 -0.168 1.613 103 2HH1 ARG 12 1HH2 ARG 12 -8.110 1.019 1.646 104 1HH2 ARG 12 1HH1 ARG 12 -9.972 -1.147 -0.179 105 2HH2 ARG 12 2HH1 ARG 12 -9.892 0.495 0.668 106 H LEU 13 H LEU 13 -2.042 -1.215 -1.765 107 HA LEU 13 HA LEU 13 -3.003 -2.110 -4.325 108 1HB LEU 13 1HB LEU 13 -1.695 -0.109 -4.368 109 2HB LEU 13 2HB LEU 13 -0.426 -0.783 -3.363 110 HG LEU 13 HG LEU 13 0.240 -2.274 -5.373 111 1HD1 LEU 13 2HD1 LEU 13 -1.909 -2.063 -6.657 112 2HD1 LEU 13 3HD1 LEU 13 -1.623 -0.322 -6.895 113 3HD1 LEU 13 1HD1 LEU 13 -0.532 -1.519 -7.633 114 1HD2 LEU 13 2HD2 LEU 13 0.487 0.805 -5.664 115 2HD2 LEU 13 3HD2 LEU 13 1.610 -0.281 -4.807 116 3HD2 LEU 13 1HD2 LEU 13 1.463 -0.389 -6.564 117 H GLU 14 H GLU 14 -0.659 -3.520 -2.213 118 HA GLU 14 HA GLU 14 0.637 -5.203 -4.242 119 1HB GLU 14 2HB GLU 14 1.553 -4.527 -1.932 120 2HB GLU 14 1HB GLU 14 0.403 -5.615 -1.197 121 1HG GLU 14 2HG GLU 14 1.532 -7.608 -2.362 122 2HG GLU 14 1HG GLU 14 2.688 -6.520 -3.087 123 H ALA 15 H ALA 15 -2.001 -5.628 -1.976 124 HA ALA 15 HA ALA 15 -2.348 -8.496 -2.473 125 1HB ALA 15 2HB ALA 15 -3.214 -7.334 -0.407 126 2HB ALA 15 3HB ALA 15 -4.347 -6.374 -1.388 127 3HB ALA 15 1HB ALA 15 -4.553 -8.137 -1.249 128 H LEU 16 H LEU 16 -3.549 -5.594 -3.955 129 HA LEU 16 HA LEU 16 -5.622 -7.029 -5.526 130 1HB LEU 16 1HB LEU 16 -4.480 -4.162 -5.681 131 2HB LEU 16 2HB LEU 16 -5.708 -4.734 -6.792 132 HG LEU 16 HG LEU 16 -5.968 -4.274 -3.773 133 1HD1 LEU 16 3HD2 LEU 16 -6.324 -2.315 -5.410 134 2HD1 LEU 16 1HD2 LEU 16 -7.694 -3.188 -6.103 135 3HD1 LEU 16 2HD2 LEU 16 -7.742 -2.674 -4.394 136 1HD2 LEU 16 2HD1 LEU 16 -7.074 -6.483 -4.386 137 2HD2 LEU 16 3HD1 LEU 16 -8.256 -5.260 -3.859 138 3HD2 LEU 16 1HD1 LEU 16 -8.066 -5.638 -5.588 139 H LYS 17 H LYS 17 -2.330 -6.105 -6.017 140 HA LYS 17 HA LYS 17 -2.524 -6.470 -8.966 141 1HB LYS 17 1HB LYS 17 -0.223 -5.710 -9.025 142 2HB LYS 17 2HB LYS 17 -0.980 -4.779 -7.738 143 1HG LYS 17 2HG LYS 17 0.658 -5.513 -6.300 144 2HG LYS 17 1HG LYS 17 0.020 -7.150 -6.424 145 1HD LYS 17 1HD LYS 17 1.705 -6.552 -8.760 146 2HD LYS 17 2HD LYS 17 2.580 -6.326 -7.233 147 1HE LYS 17 1HE LYS 17 2.341 -8.585 -6.558 148 2HE LYS 17 2HE LYS 17 0.787 -8.798 -7.380 149 1HZ LYS 17 3HZ LYS 17 3.071 -8.236 -9.108 150 2HZ LYS 17 1HZ LYS 17 3.059 -9.733 -8.343 151 3HZ LYS 17 2HZ LYS 17 1.773 -9.283 -9.329 152 H GLU 18 H GLU 18 -2.073 -8.549 -6.352 153 HA GLU 18 HA GLU 18 -0.403 -10.605 -7.238 154 1HB GLU 18 1HB GLU 18 -1.759 -10.741 -5.179 155 2HB GLU 18 2HB GLU 18 -3.256 -10.743 -6.079 156 1HG GLU 18 1HG GLU 18 -2.938 -13.068 -6.829 157 2HG GLU 18 2HG GLU 18 -1.245 -13.078 -6.407 158 H ASN 19 H ASN 19 -3.802 -11.186 -7.883 159 HA ASN 19 HA ASN 19 -3.295 -12.787 -10.225 160 1HB ASN 19 1HB ASN 19 -5.689 -11.482 -8.942 161 2HB ASN 19 2HB ASN 19 -5.881 -11.651 -10.671 162 1HD2 ASN 19 1HD2 ASN 19 -5.663 -15.372 -10.141 163 2HD2 ASN 19 2HD2 ASN 19 -4.571 -14.173 -11.026 164 H GLY 20 H GLY 20 -4.892 -9.636 -10.354 165 1HA GLY 20 1HA GLY 20 -3.371 -9.128 -12.970 166 2HA GLY 20 2HA GLY 20 -5.123 -8.858 -12.867 No H/Q in entry = 166 Start of MODEL 2 1 1H TYR 1 1H TYR 1 4.827 12.111 4.761 2 2H TYR 1 2H TYR 1 3.990 13.284 3.891 3 3H TYR 1 3H TYR 1 4.211 13.464 5.548 4 HA TYR 1 HA TYR 1 2.038 12.826 5.354 5 1HB TYR 1 1HB TYR 1 2.402 10.174 3.992 6 2HB TYR 1 2HB TYR 1 1.316 11.413 3.441 7 HD1 TYR 1 HD2 TYR 1 4.651 9.950 2.975 8 HD2 TYR 1 HD1 TYR 1 1.989 13.089 1.733 9 HE1 TYR 1 HE2 TYR 1 6.037 10.348 0.974 10 HE2 TYR 1 HE1 TYR 1 3.381 13.481 -0.252 11 HH TYR 1 HH TYR 1 5.871 13.075 -0.857 12 H SER 2 H SER 2 4.482 12.130 6.871 13 HA SER 2 HA SER 2 4.774 10.953 8.907 14 1HB SER 2 2HB SER 2 2.033 11.130 8.787 15 2HB SER 2 1HB SER 2 2.181 9.389 8.605 16 HG SER 2 HG SER 2 2.018 10.107 10.799 17 H ASP 3 H ASP 3 5.685 10.022 6.419 18 HA ASP 3 HA ASP 3 6.832 8.159 5.579 19 1HB ASP 3 1HB ASP 3 7.763 6.656 7.696 20 2HB ASP 3 2HB ASP 3 8.385 8.248 7.324 21 H GLU 4 H GLU 4 5.634 6.316 8.305 22 HA GLU 4 HA GLU 4 5.463 3.907 6.669 23 1HB GLU 4 1HB GLU 4 4.660 2.839 8.669 24 2HB GLU 4 2HB GLU 4 5.747 4.085 9.232 25 1HG GLU 4 1HG GLU 4 3.767 5.574 9.808 26 2HG GLU 4 2HG GLU 4 2.656 4.378 9.192 27 H LEU 5 H LEU 5 3.273 6.462 7.327 28 HA LEU 5 HA LEU 5 0.771 4.955 6.967 29 1HB LEU 5 1HB LEU 5 1.535 7.924 6.831 30 2HB LEU 5 2HB LEU 5 -0.029 7.442 6.202 31 HG LEU 5 HG LEU 5 0.890 6.902 9.091 32 1HD1 LEU 5 2HD1 LEU 5 0.768 9.366 8.613 33 2HD1 LEU 5 3HD1 LEU 5 -0.895 9.187 8.001 34 3HD1 LEU 5 1HD1 LEU 5 -0.530 8.868 9.714 35 1HD2 LEU 5 2HD2 LEU 5 -1.915 6.707 7.783 36 2HD2 LEU 5 3HD2 LEU 5 -0.943 5.363 8.430 37 3HD2 LEU 5 1HD2 LEU 5 -1.592 6.579 9.534 38 H ARG 6 H ARG 6 2.965 6.553 4.809 39 HA ARG 6 HA ARG 6 1.336 6.165 2.381 40 1HB ARG 6 1HB ARG 6 3.403 7.723 2.708 41 2HB ARG 6 2HB ARG 6 4.414 6.293 2.649 42 1HG ARG 6 1HG ARG 6 3.625 5.827 0.257 43 2HG ARG 6 2HG ARG 6 2.523 7.197 0.348 44 1HD ARG 6 1HD ARG 6 4.471 7.996 -0.833 45 2HD ARG 6 2HD ARG 6 4.622 8.691 0.802 46 HE ARG 6 HE ARG 6 6.135 6.686 1.364 47 1HH1 ARG 6 2HH2 ARG 6 5.794 7.655 -1.952 48 2HH1 ARG 6 1HH2 ARG 6 7.430 6.936 -2.413 49 1HH2 ARG 6 1HH1 ARG 6 7.892 5.932 0.791 50 2HH2 ARG 6 2HH1 ARG 6 8.575 5.998 -0.927 51 H GLN 7 H GLN 7 3.780 4.278 4.037 52 HA GLN 7 HA GLN 7 4.111 2.278 1.925 53 1HB GLN 7 1HB GLN 7 4.708 2.430 4.923 54 2HB GLN 7 2HB GLN 7 4.841 0.868 4.118 55 1HG GLN 7 1HG GLN 7 6.327 3.198 2.800 56 2HG GLN 7 2HG GLN 7 6.942 2.673 4.349 57 1HE2 GLN 7 2HE2 GLN 7 7.435 0.184 1.120 58 2HE2 GLN 7 1HE2 GLN 7 5.939 1.266 1.212 59 H ARG 8 H ARG 8 1.758 2.796 4.381 60 HA ARG 8 HA ARG 8 0.717 0.034 4.462 61 1HB ARG 8 2HB ARG 8 0.378 1.862 6.249 62 2HB ARG 8 1HB ARG 8 -0.656 2.735 5.134 63 1HG ARG 8 1HG ARG 8 -1.409 -0.174 5.836 64 2HG ARG 8 2HG ARG 8 -1.733 1.110 6.997 65 1HD ARG 8 1HD ARG 8 -2.606 1.554 4.099 66 2HD ARG 8 2HD ARG 8 -3.524 0.390 5.090 67 HE ARG 8 HE ARG 8 -3.060 3.314 5.817 68 1HH1 ARG 8 2HH2 ARG 8 -4.958 0.426 6.146 69 2HH1 ARG 8 1HH2 ARG 8 -6.258 1.297 7.124 70 1HH2 ARG 8 1HH1 ARG 8 -4.506 4.188 6.878 71 2HH2 ARG 8 2HH1 ARG 8 -6.019 3.342 7.525 72 H LEU 9 H LEU 9 -0.068 2.966 2.706 73 HA LEU 9 HA LEU 9 -2.393 1.825 1.299 74 1HB LEU 9 1HB LEU 9 -0.539 4.224 0.734 75 2HB LEU 9 2HB LEU 9 -1.796 3.772 -0.400 76 HG LEU 9 HG LEU 9 -2.090 4.912 2.420 77 1HD1 LEU 9 2HD1 LEU 9 -1.887 6.493 0.474 78 2HD1 LEU 9 3HD1 LEU 9 -3.285 5.729 -0.321 79 3HD1 LEU 9 1HD1 LEU 9 -3.494 6.603 1.215 80 1HD2 LEU 9 2HD2 LEU 9 -4.356 3.536 0.810 81 2HD2 LEU 9 3HD2 LEU 9 -3.728 3.048 2.404 82 3HD2 LEU 9 1HD2 LEU 9 -4.603 4.574 2.242 83 H ALA 10 H ALA 10 1.029 1.820 0.764 84 HA ALA 10 HA ALA 10 0.875 0.668 -1.932 85 1HB ALA 10 2HB ALA 10 2.938 1.815 -1.031 86 2HB ALA 10 3HB ALA 10 3.137 0.545 0.200 87 3HB ALA 10 1HB ALA 10 3.337 0.159 -1.526 88 H ALA 11 H ALA 11 0.829 -0.624 1.291 89 HA ALA 11 HA ALA 11 1.322 -3.408 0.504 90 1HB ALA 11 2HB ALA 11 1.716 -2.536 2.842 91 2HB ALA 11 3HB ALA 11 -0.025 -2.228 3.048 92 3HB ALA 11 1HB ALA 11 0.577 -3.896 2.890 93 H ARG 12 H ARG 12 -1.487 -1.391 0.704 94 HA ARG 12 HA ARG 12 -3.433 -3.615 0.433 95 1HB ARG 12 2HB ARG 12 -3.951 -1.288 1.397 96 2HB ARG 12 1HB ARG 12 -3.682 -0.580 -0.183 97 1HG ARG 12 1HG ARG 12 -6.058 -0.729 -0.129 98 2HG ARG 12 2HG ARG 12 -5.616 -2.138 -1.087 99 1HD ARG 12 2HD ARG 12 -6.025 -3.661 0.775 100 2HD ARG 12 1HD ARG 12 -6.026 -2.332 1.966 101 HE ARG 12 HE ARG 12 -8.228 -1.706 1.293 102 1HH1 ARG 12 2HH2 ARG 12 -7.049 -4.174 -0.844 103 2HH1 ARG 12 1HH2 ARG 12 -8.673 -4.311 -1.711 104 1HH2 ARG 12 1HH1 ARG 12 -9.984 -1.991 0.384 105 2HH2 ARG 12 2HH1 ARG 12 -10.286 -3.163 -1.015 106 H LEU 13 H LEU 13 -2.101 -1.164 -1.721 107 HA LEU 13 HA LEU 13 -3.420 -2.047 -4.124 108 1HB LEU 13 1HB LEU 13 -2.277 0.047 -4.296 109 2HB LEU 13 2HB LEU 13 -0.815 -0.562 -3.545 110 HG LEU 13 HG LEU 13 -0.303 -1.875 -5.668 111 1HD1 LEU 13 3HD2 LEU 13 -2.718 -1.903 -6.569 112 2HD1 LEU 13 1HD2 LEU 13 -2.553 -0.188 -6.963 113 3HD1 LEU 13 2HD2 LEU 13 -1.506 -1.389 -7.768 114 1HD2 LEU 13 2HD1 LEU 13 0.687 0.408 -5.138 115 2HD2 LEU 13 3HD1 LEU 13 0.535 0.129 -6.890 116 3HD2 LEU 13 1HD1 LEU 13 -0.630 1.175 -6.043 117 H GLU 14 H GLU 14 -0.643 -3.329 -2.498 118 HA GLU 14 HA GLU 14 0.360 -4.901 -4.784 119 1HB GLU 14 2HB GLU 14 1.623 -4.131 -2.666 120 2HB GLU 14 1HB GLU 14 0.769 -5.368 -1.777 121 1HG GLU 14 1HG GLU 14 3.272 -5.754 -2.919 122 2HG GLU 14 2HG GLU 14 2.164 -7.097 -2.643 123 H ALA 15 H ALA 15 -1.762 -5.524 -2.062 124 HA ALA 15 HA ALA 15 -1.969 -8.413 -2.492 125 1HB ALA 15 2HB ALA 15 -2.583 -7.288 -0.318 126 2HB ALA 15 3HB ALA 15 -3.926 -6.430 -1.110 127 3HB ALA 15 1HB ALA 15 -3.974 -8.201 -0.934 128 H LEU 16 H LEU 16 -3.597 -5.630 -3.780 129 HA LEU 16 HA LEU 16 -5.812 -7.192 -4.965 130 1HB LEU 16 1HB LEU 16 -4.785 -4.319 -5.432 131 2HB LEU 16 2HB LEU 16 -6.126 -4.975 -6.350 132 HG LEU 16 HG LEU 16 -6.007 -4.108 -3.454 133 1HD1 LEU 16 2HD1 LEU 16 -6.973 -2.625 -5.237 134 2HD1 LEU 16 3HD1 LEU 16 -8.172 -3.873 -5.656 135 3HD1 LEU 16 1HD1 LEU 16 -8.214 -3.089 -4.059 136 1HD2 LEU 16 2HD2 LEU 16 -7.996 -6.270 -4.447 137 2HD2 LEU 16 3HD2 LEU 16 -6.791 -6.444 -3.147 138 3HD2 LEU 16 1HD2 LEU 16 -8.161 -5.351 -2.925 139 H LYS 17 H LYS 17 -2.783 -5.899 -6.165 140 HA LYS 17 HA LYS 17 -3.445 -6.850 -8.919 141 1HB LYS 17 1HB LYS 17 -1.407 -5.684 -9.604 142 2HB LYS 17 2HB LYS 17 -2.198 -4.659 -8.414 143 1HG LYS 17 2HG LYS 17 -0.246 -4.637 -7.197 144 2HG LYS 17 1HG LYS 17 -0.449 -6.354 -6.859 145 1HD LYS 17 1HD LYS 17 0.675 -6.054 -9.541 146 2HD LYS 17 2HD LYS 17 1.652 -5.177 -8.348 147 1HE LYS 17 1HE LYS 17 1.561 -7.266 -6.814 148 2HE LYS 17 2HE LYS 17 0.773 -8.152 -8.129 149 1HZ LYS 17 3HZ LYS 17 3.217 -6.684 -8.801 150 2HZ LYS 17 1HZ LYS 17 3.374 -8.078 -7.874 151 3HZ LYS 17 2HZ LYS 17 2.640 -8.151 -9.385 152 H GLU 18 H GLU 18 -2.572 -8.545 -6.353 153 HA GLU 18 HA GLU 18 -0.586 -10.286 -7.774 154 1HB GLU 18 1HB GLU 18 -0.647 -9.721 -5.236 155 2HB GLU 18 2HB GLU 18 -2.104 -10.672 -5.106 156 1HG GLU 18 1HG GLU 18 -0.446 -12.626 -6.192 157 2HG GLU 18 2HG GLU 18 0.792 -11.630 -5.472 158 H ASN 19 H ASN 19 -2.457 -10.259 -9.451 159 HA ASN 19 HA ASN 19 -3.528 -12.988 -9.497 160 1HB ASN 19 2HB ASN 19 -5.160 -11.891 -7.821 161 2HB ASN 19 1HB ASN 19 -5.596 -10.718 -9.040 162 1HD2 ASN 19 1HD2 ASN 19 -8.285 -13.100 -9.339 163 2HD2 ASN 19 2HD2 ASN 19 -7.734 -11.643 -8.347 164 H GLY 20 H GLY 20 -4.573 -9.793 -10.610 165 1HA GLY 20 1HA GLY 20 -4.048 -10.716 -13.477 166 2HA GLY 20 2HA GLY 20 -5.674 -10.144 -13.049 No H/Q in entry = 166 Start of MODEL 3 1 1H TYR 1 3H TYR 1 2.961 14.605 6.034 2 2H TYR 1 1H TYR 1 2.363 14.854 4.482 3 3H TYR 1 2H TYR 1 1.433 14.036 5.621 4 HA TYR 1 HA TYR 1 2.196 12.312 4.380 5 1HB TYR 1 2HB TYR 1 3.999 14.168 3.349 6 2HB TYR 1 1HB TYR 1 5.090 13.327 4.412 7 HD1 TYR 1 HD1 TYR 1 2.672 10.935 3.226 8 HD2 TYR 1 HD2 TYR 1 6.152 13.134 1.984 9 HE1 TYR 1 HE1 TYR 1 3.038 9.332 1.400 10 HE2 TYR 1 HE2 TYR 1 6.514 11.510 0.159 11 HH TYR 1 HH TYR 1 4.492 9.715 -1.119 12 H SER 2 H SER 2 3.097 10.466 5.061 13 HA SER 2 HA SER 2 4.869 10.471 7.467 14 1HB SER 2 2HB SER 2 2.449 10.813 8.383 15 2HB SER 2 1HB SER 2 2.062 9.224 7.743 16 HG SER 2 HG SER 2 2.856 9.502 10.044 17 H ASP 3 H ASP 3 6.319 9.218 6.835 18 HA ASP 3 HA ASP 3 6.584 7.204 5.127 19 1HB ASP 3 1HB ASP 3 7.851 7.835 7.632 20 2HB ASP 3 2HB ASP 3 7.469 6.135 7.787 21 H GLU 4 H GLU 4 5.087 6.394 8.243 22 HA GLU 4 HA GLU 4 4.853 3.549 7.497 23 1HB GLU 4 1HB GLU 4 3.892 3.265 9.666 24 2HB GLU 4 2HB GLU 4 5.020 4.583 9.871 25 1HG GLU 4 1HG GLU 4 3.100 6.255 9.765 26 2HG GLU 4 2HG GLU 4 1.959 4.961 9.507 27 H LEU 5 H LEU 5 2.723 6.313 7.370 28 HA LEU 5 HA LEU 5 0.268 4.670 7.031 29 1HB LEU 5 1HB LEU 5 -0.753 6.661 7.444 30 2HB LEU 5 2HB LEU 5 0.834 7.390 7.599 31 HG LEU 5 HG LEU 5 0.547 7.514 4.867 32 1HD1 LEU 5 2HD1 LEU 5 -1.763 6.527 4.931 33 2HD1 LEU 5 3HD1 LEU 5 -2.321 7.836 6.001 34 3HD1 LEU 5 1HD1 LEU 5 -1.810 8.196 4.334 35 1HD2 LEU 5 2HD2 LEU 5 -0.506 9.602 6.911 36 2HD2 LEU 5 3HD2 LEU 5 1.147 9.485 6.258 37 3HD2 LEU 5 1HD2 LEU 5 -0.183 9.936 5.187 38 H ARG 6 H ARG 6 2.550 6.186 4.903 39 HA ARG 6 HA ARG 6 0.869 5.756 2.492 40 1HB ARG 6 2HB ARG 6 2.717 7.578 2.915 41 2HB ARG 6 1HB ARG 6 3.903 6.319 2.637 42 1HG ARG 6 1HG ARG 6 1.843 6.536 0.419 43 2HG ARG 6 2HG ARG 6 2.864 7.957 0.624 44 1HD ARG 6 1HD ARG 6 4.910 6.651 0.266 45 2HD ARG 6 2HD ARG 6 4.039 5.106 0.447 46 HE ARG 6 HE ARG 6 2.821 6.751 -1.665 47 1HH1 ARG 6 2HH2 ARG 6 5.522 4.647 -1.095 48 2HH1 ARG 6 1HH2 ARG 6 5.670 4.221 -2.885 49 1HH2 ARG 6 1HH1 ARG 6 3.042 6.245 -3.583 50 2HH2 ARG 6 2HH1 ARG 6 4.325 5.087 -4.243 51 H GLN 7 H GLN 7 3.538 4.157 4.077 52 HA GLN 7 HA GLN 7 3.939 2.095 2.028 53 1HB GLN 7 1HB GLN 7 4.526 2.245 5.049 54 2HB GLN 7 2HB GLN 7 4.928 0.814 4.102 55 1HG GLN 7 1HG GLN 7 6.422 2.316 2.591 56 2HG GLN 7 2HG GLN 7 6.077 3.666 3.645 57 1HE2 GLN 7 2HE2 GLN 7 9.368 1.879 4.437 58 2HE2 GLN 7 1HE2 GLN 7 8.567 2.357 2.839 59 H ARG 8 H ARG 8 1.709 2.530 4.647 60 HA ARG 8 HA ARG 8 0.701 -0.238 4.698 61 1HB ARG 8 2HB ARG 8 0.334 1.556 6.506 62 2HB ARG 8 1HB ARG 8 -0.703 2.440 5.403 63 1HG ARG 8 1HG ARG 8 -2.443 0.676 5.404 64 2HG ARG 8 2HG ARG 8 -1.376 -0.470 6.210 65 1HD ARG 8 1HD ARG 8 -2.556 0.246 8.082 66 2HD ARG 8 2HD ARG 8 -1.328 1.538 8.100 67 HE ARG 8 HE ARG 8 -3.134 2.668 6.389 68 1HH1 ARG 8 2HH2 ARG 8 -3.775 1.013 9.373 69 2HH1 ARG 8 1HH2 ARG 8 -5.303 2.000 9.684 70 1HH2 ARG 8 1HH1 ARG 8 -4.797 3.695 6.793 71 2HH2 ARG 8 2HH1 ARG 8 -5.863 3.460 8.286 72 H LEU 9 H LEU 9 -0.149 2.690 2.968 73 HA LEU 9 HA LEU 9 -2.420 1.494 1.513 74 1HB LEU 9 1HB LEU 9 -0.640 3.962 1.057 75 2HB LEU 9 2HB LEU 9 -1.774 3.465 -0.184 76 HG LEU 9 HG LEU 9 -2.397 4.478 2.640 77 1HD1 LEU 9 3HD2 LEU 9 -2.043 6.157 0.717 78 2HD1 LEU 9 1HD2 LEU 9 -3.448 5.464 -0.100 79 3HD1 LEU 9 2HD2 LEU 9 -3.647 6.265 1.483 80 1HD2 LEU 9 2HD1 LEU 9 -3.859 2.458 2.132 81 2HD2 LEU 9 3HD1 LEU 9 -4.805 3.962 2.254 82 3HD2 LEU 9 1HD1 LEU 9 -4.435 3.262 0.660 83 H ALA 10 H ALA 10 1.007 1.513 1.078 84 HA ALA 10 HA ALA 10 0.923 0.603 -1.715 85 1HB ALA 10 2HB ALA 10 2.928 1.751 -0.691 86 2HB ALA 10 3HB ALA 10 3.170 0.387 0.425 87 3HB ALA 10 1HB ALA 10 3.401 0.164 -1.326 88 H ALA 11 H ALA 11 0.901 -0.971 1.381 89 HA ALA 11 HA ALA 11 1.415 -3.673 0.353 90 1HB ALA 11 2HB ALA 11 1.752 -3.020 2.771 91 2HB ALA 11 3HB ALA 11 0.007 -2.728 2.961 92 3HB ALA 11 1HB ALA 11 0.611 -4.376 2.665 93 H ARG 12 H ARG 12 -1.398 -1.672 0.660 94 HA ARG 12 HA ARG 12 -3.341 -3.878 0.260 95 1HB ARG 12 2HB ARG 12 -3.836 -1.618 1.390 96 2HB ARG 12 1HB ARG 12 -3.611 -0.811 -0.149 97 1HG ARG 12 1HG ARG 12 -6.002 -0.996 0.019 98 2HG ARG 12 2HG ARG 12 -5.557 -2.262 -1.121 99 1HD ARG 12 2HD ARG 12 -6.137 -3.987 0.359 100 2HD ARG 12 1HD ARG 12 -5.624 -3.086 1.809 101 HE ARG 12 HE ARG 12 -8.285 -3.046 0.548 102 1HH1 ARG 12 2HH2 ARG 12 -6.151 -1.169 2.537 103 2HH1 ARG 12 1HH2 ARG 12 -7.534 -0.133 3.186 104 1HH2 ARG 12 1HH1 ARG 12 -9.723 -1.837 1.238 105 2HH2 ARG 12 2HH1 ARG 12 -9.476 -0.481 2.472 106 H LEU 13 H LEU 13 -2.025 -1.293 -1.739 107 HA LEU 13 HA LEU 13 -3.215 -2.128 -4.253 108 1HB LEU 13 1HB LEU 13 -2.130 0.002 -4.307 109 2HB LEU 13 2HB LEU 13 -0.704 -0.577 -3.468 110 HG LEU 13 HG LEU 13 -0.012 -1.836 -5.573 111 1HD1 LEU 13 2HD1 LEU 13 -2.288 -2.050 -6.616 112 2HD1 LEU 13 3HD1 LEU 13 -2.364 -0.288 -6.864 113 3HD1 LEU 13 1HD1 LEU 13 -1.152 -1.265 -7.728 114 1HD2 LEU 13 2HD2 LEU 13 -0.385 1.230 -5.856 115 2HD2 LEU 13 3HD2 LEU 13 1.008 0.385 -5.136 116 3HD2 LEU 13 1HD2 LEU 13 0.697 0.233 -6.868 117 H GLU 14 H GLU 14 -0.534 -3.367 -2.456 118 HA GLU 14 HA GLU 14 0.589 -4.958 -4.657 119 1HB GLU 14 2HB GLU 14 1.762 -4.234 -2.483 120 2HB GLU 14 1HB GLU 14 0.785 -5.388 -1.611 121 1HG GLU 14 2HG GLU 14 1.859 -7.278 -3.098 122 2HG GLU 14 1HG GLU 14 2.961 -6.067 -3.703 123 H ALA 15 H ALA 15 -1.685 -5.562 -2.060 124 HA ALA 15 HA ALA 15 -1.849 -8.458 -2.486 125 1HB ALA 15 2HB ALA 15 -2.524 -7.335 -0.328 126 2HB ALA 15 3HB ALA 15 -3.856 -6.491 -1.152 127 3HB ALA 15 1HB ALA 15 -3.892 -8.262 -0.976 128 H LEU 16 H LEU 16 -3.491 -5.692 -3.801 129 HA LEU 16 HA LEU 16 -5.595 -7.357 -5.094 130 1HB LEU 16 1HB LEU 16 -4.859 -4.391 -5.575 131 2HB LEU 16 2HB LEU 16 -6.303 -5.182 -6.175 132 HG LEU 16 HG LEU 16 -5.937 -5.268 -3.180 133 1HD1 LEU 16 3HD2 LEU 16 -5.197 -2.886 -3.830 134 2HD1 LEU 16 1HD2 LEU 16 -6.789 -2.627 -4.551 135 3HD1 LEU 16 2HD2 LEU 16 -6.647 -2.935 -2.798 136 1HD2 LEU 16 2HD1 LEU 16 -7.969 -6.200 -4.395 137 2HD2 LEU 16 3HD1 LEU 16 -8.405 -4.925 -3.231 138 3HD2 LEU 16 1HD1 LEU 16 -8.354 -4.569 -4.974 139 H LYS 17 H LYS 17 -2.577 -5.913 -6.011 140 HA LYS 17 HA LYS 17 -3.089 -6.353 -8.909 141 1HB LYS 17 1HB LYS 17 -1.055 -5.167 -9.265 142 2HB LYS 17 2HB LYS 17 -1.603 -4.487 -7.738 143 1HG LYS 17 1HG LYS 17 -0.045 -6.058 -6.472 144 2HG LYS 17 2HG LYS 17 0.449 -6.803 -7.991 145 1HD LYS 17 1HD LYS 17 1.586 -4.726 -8.674 146 2HD LYS 17 2HD LYS 17 0.817 -3.801 -7.370 147 1HE LYS 17 1HE LYS 17 2.725 -4.290 -6.131 148 2HE LYS 17 2HE LYS 17 1.984 -5.878 -5.879 149 1HZ LYS 17 2HZ LYS 17 3.077 -6.174 -8.323 150 2HZ LYS 17 3HZ LYS 17 4.189 -5.145 -7.593 151 3HZ LYS 17 1HZ LYS 17 3.814 -6.620 -6.878 152 H GLU 18 H GLU 18 -2.418 -8.487 -6.542 153 HA GLU 18 HA GLU 18 -0.452 -10.252 -7.503 154 1HB GLU 18 2HB GLU 18 -1.834 -10.691 -5.501 155 2HB GLU 18 1HB GLU 18 -3.289 -10.833 -6.457 156 1HG GLU 18 1HG GLU 18 -1.664 -12.899 -7.555 157 2HG GLU 18 2HG GLU 18 -1.204 -12.928 -5.871 158 H ASN 19 H ASN 19 -3.725 -11.231 -8.286 159 HA ASN 19 HA ASN 19 -3.074 -12.480 -10.769 160 1HB ASN 19 1HB ASN 19 -5.635 -11.231 -9.631 161 2HB ASN 19 2HB ASN 19 -5.659 -11.690 -11.317 162 1HD2 ASN 19 1HD2 ASN 19 -5.305 -15.247 -10.229 163 2HD2 ASN 19 2HD2 ASN 19 -4.291 -14.123 -11.288 164 H GLY 20 H GLY 20 -4.658 -9.323 -10.492 165 1HA GLY 20 2HA GLY 20 -3.560 -7.308 -11.568 166 2HA GLY 20 1HA GLY 20 -2.893 -8.382 -12.814 No H/Q in entry = 166 Start of MODEL 4 1 1H TYR 1 3H TYR 1 -0.095 11.672 6.341 2 2H TYR 1 1H TYR 1 -1.006 11.047 5.073 3 3H TYR 1 2H TYR 1 -0.297 10.010 6.190 4 HA TYR 1 HA TYR 1 1.195 9.765 4.562 5 1HB TYR 1 2HB TYR 1 -0.096 11.459 3.067 6 2HB TYR 1 1HB TYR 1 0.743 12.759 3.864 7 HD1 TYR 1 HD2 TYR 1 2.701 9.679 3.188 8 HD2 TYR 1 HD1 TYR 1 1.466 13.467 1.573 9 HE1 TYR 1 HE2 TYR 1 4.487 9.549 1.489 10 HE2 TYR 1 HE1 TYR 1 3.245 13.324 -0.116 11 HH TYR 1 HH TYR 1 5.625 12.037 -0.167 12 H SER 2 H SER 2 2.746 9.383 5.884 13 HA SER 2 HA SER 2 4.802 11.448 6.278 14 1HB SER 2 1HB SER 2 4.772 11.562 8.783 15 2HB SER 2 2HB SER 2 3.291 12.234 8.120 16 HG SER 2 HG SER 2 2.754 10.874 9.781 17 H ASP 3 H ASP 3 4.893 9.165 5.019 18 HA ASP 3 HA ASP 3 6.735 7.717 4.755 19 1HB ASP 3 1HB ASP 3 7.699 8.943 7.038 20 2HB ASP 3 2HB ASP 3 7.279 7.399 7.744 21 H GLU 4 H GLU 4 5.452 6.868 7.934 22 HA GLU 4 HA GLU 4 5.320 4.018 7.186 23 1HB GLU 4 1HB GLU 4 4.037 5.559 9.543 24 2HB GLU 4 2HB GLU 4 4.098 3.816 9.430 25 1HG GLU 4 2HG GLU 4 6.861 4.796 9.171 26 2HG GLU 4 1HG GLU 4 6.123 5.666 10.492 27 H LEU 5 H LEU 5 3.108 6.680 7.066 28 HA LEU 5 HA LEU 5 0.732 4.893 6.808 29 1HB LEU 5 1HB LEU 5 1.030 7.940 6.361 30 2HB LEU 5 2HB LEU 5 -0.499 7.085 6.307 31 HG LEU 5 HG LEU 5 0.875 6.551 8.865 32 1HD1 LEU 5 2HD1 LEU 5 1.949 8.781 8.432 33 2HD1 LEU 5 3HD1 LEU 5 0.352 9.527 8.179 34 3HD1 LEU 5 1HD1 LEU 5 0.799 8.885 9.778 35 1HD2 LEU 5 2HD2 LEU 5 -1.816 7.934 8.173 36 2HD2 LEU 5 3HD2 LEU 5 -1.573 6.222 8.600 37 3HD2 LEU 5 1HD2 LEU 5 -1.299 7.471 9.818 38 H ARG 6 H ARG 6 2.888 6.577 4.685 39 HA ARG 6 HA ARG 6 1.257 6.150 2.262 40 1HB ARG 6 1HB ARG 6 3.197 7.857 2.610 41 2HB ARG 6 2HB ARG 6 4.317 6.514 2.504 42 1HG ARG 6 1HG ARG 6 2.308 6.968 0.194 43 2HG ARG 6 2HG ARG 6 3.708 8.027 0.333 44 1HD ARG 6 1HD ARG 6 5.230 6.315 -0.220 45 2HD ARG 6 2HD ARG 6 4.244 5.035 0.533 46 HE ARG 6 HE ARG 6 2.593 5.345 -1.412 47 1HH1 ARG 6 2HH2 ARG 6 5.893 6.328 -1.854 48 2HH1 ARG 6 1HH2 ARG 6 5.792 6.126 -3.686 49 1HH2 ARG 6 1HH1 ARG 6 2.559 5.148 -3.398 50 2HH2 ARG 6 2HH1 ARG 6 3.982 5.484 -4.531 51 H GLN 7 H GLN 7 3.875 4.434 3.844 52 HA GLN 7 HA GLN 7 4.100 2.321 1.818 53 1HB GLN 7 1HB GLN 7 5.686 1.387 3.256 54 2HB GLN 7 2HB GLN 7 5.700 3.057 3.819 55 1HG GLN 7 1HG GLN 7 4.694 2.513 5.915 56 2HG GLN 7 2HG GLN 7 3.785 1.161 5.283 57 1HE2 GLN 7 2HE2 GLN 7 7.073 -0.765 5.731 58 2HE2 GLN 7 1HE2 GLN 7 6.148 -0.234 4.219 59 H ARG 8 H ARG 8 1.986 2.910 4.488 60 HA ARG 8 HA ARG 8 0.858 0.198 4.667 61 1HB ARG 8 2HB ARG 8 0.574 2.086 6.389 62 2HB ARG 8 1HB ARG 8 -0.425 2.965 5.248 63 1HG ARG 8 1HG ARG 8 -2.075 0.912 5.235 64 2HG ARG 8 2HG ARG 8 -1.148 0.272 6.589 65 1HD ARG 8 1HD ARG 8 -2.337 1.604 8.021 66 2HD ARG 8 2HD ARG 8 -1.731 3.065 7.198 67 HE ARG 8 HE ARG 8 -3.617 2.547 5.426 68 1HH1 ARG 8 2HH2 ARG 8 -3.958 1.783 8.795 69 2HH1 ARG 8 1HH2 ARG 8 -5.798 1.911 8.719 70 1HH2 ARG 8 2HH1 ARG 8 -6.701 2.396 6.889 71 2HH2 ARG 8 1HH1 ARG 8 -5.608 2.674 5.423 72 H LEU 9 H LEU 9 0.127 3.075 2.804 73 HA LEU 9 HA LEU 9 -2.138 1.875 1.339 74 1HB LEU 9 1HB LEU 9 -0.326 4.309 0.944 75 2HB LEU 9 2HB LEU 9 -1.255 3.754 -0.435 76 HG LEU 9 HG LEU 9 -2.077 5.532 1.621 77 1HD1 LEU 9 2HD1 LEU 9 -2.766 5.576 -0.794 78 2HD1 LEU 9 3HD1 LEU 9 -3.774 4.127 -0.556 79 3HD1 LEU 9 1HD1 LEU 9 -4.183 5.650 0.270 80 1HD2 LEU 9 2HD2 LEU 9 -3.683 2.886 1.829 81 2HD2 LEU 9 3HD2 LEU 9 -2.750 3.674 3.126 82 3HD2 LEU 9 1HD2 LEU 9 -4.206 4.455 2.501 83 H ALA 10 H ALA 10 1.294 1.741 1.033 84 HA ALA 10 HA ALA 10 1.290 0.641 -1.690 85 1HB ALA 10 2HB ALA 10 3.313 1.727 -0.638 86 2HB ALA 10 3HB ALA 10 3.406 0.434 0.581 87 3HB ALA 10 1HB ALA 10 3.709 0.071 -1.136 88 H ALA 11 H ALA 11 0.961 -0.698 1.495 89 HA ALA 11 HA ALA 11 1.397 -3.484 0.678 90 1HB ALA 11 2HB ALA 11 1.664 -2.678 3.058 91 2HB ALA 11 3HB ALA 11 -0.073 -2.302 3.151 92 3HB ALA 11 1HB ALA 11 0.470 -3.990 2.995 93 H ARG 12 H ARG 12 -1.340 -1.357 0.744 94 HA ARG 12 HA ARG 12 -3.351 -3.476 0.233 95 1HB ARG 12 2HB ARG 12 -3.825 -1.131 1.191 96 2HB ARG 12 1HB ARG 12 -3.396 -0.427 -0.354 97 1HG ARG 12 1HG ARG 12 -5.749 -0.471 -0.586 98 2HG ARG 12 2HG ARG 12 -5.335 -1.991 -1.373 99 1HD ARG 12 2HD ARG 12 -5.976 -3.296 0.596 100 2HD ARG 12 1HD ARG 12 -6.015 -1.848 1.636 101 HE ARG 12 HE ARG 12 -8.114 -1.208 0.699 102 1HH1 ARG 12 2HH2 ARG 12 -6.834 -3.861 -1.137 103 2HH1 ARG 12 1HH2 ARG 12 -8.416 -4.090 -2.059 104 1HH2 ARG 12 1HH1 ARG 12 -9.817 -1.569 -0.278 105 2HH2 ARG 12 2HH1 ARG 12 -10.033 -2.825 -1.620 106 H LEU 13 H LEU 13 -1.672 -1.081 -1.729 107 HA LEU 13 HA LEU 13 -2.569 -1.956 -4.317 108 1HB LEU 13 1HB LEU 13 -1.247 0.037 -4.315 109 2HB LEU 13 2HB LEU 13 -0.012 -0.649 -3.278 110 HG LEU 13 HG LEU 13 0.718 -2.126 -5.269 111 1HD1 LEU 13 3HD2 LEU 13 -1.435 -1.774 -6.644 112 2HD1 LEU 13 1HD2 LEU 13 -0.928 -0.109 -6.946 113 3HD1 LEU 13 2HD2 LEU 13 0.063 -1.463 -7.556 114 1HD2 LEU 13 2HD1 LEU 13 1.920 -0.026 -4.482 115 2HD2 LEU 13 3HD1 LEU 13 2.090 -0.283 -6.236 116 3HD2 LEU 13 1HD1 LEU 13 0.952 0.937 -5.615 117 H GLU 14 H GLU 14 -0.292 -3.395 -2.153 118 HA GLU 14 HA GLU 14 0.974 -5.120 -4.163 119 1HB GLU 14 2HB GLU 14 1.913 -4.411 -1.873 120 2HB GLU 14 1HB GLU 14 0.764 -5.481 -1.110 121 1HG GLU 14 1HG GLU 14 1.864 -7.491 -2.287 122 2HG GLU 14 2HG GLU 14 3.051 -6.420 -2.989 123 H ALA 15 H ALA 15 -1.652 -5.485 -1.876 124 HA ALA 15 HA ALA 15 -2.082 -8.335 -2.404 125 1HB ALA 15 2HB ALA 15 -2.888 -7.177 -0.310 126 2HB ALA 15 3HB ALA 15 -4.008 -6.176 -1.263 127 3HB ALA 15 1HB ALA 15 -4.259 -7.934 -1.143 128 H LEU 16 H LEU 16 -3.222 -5.385 -3.835 129 HA LEU 16 HA LEU 16 -5.348 -6.754 -5.399 130 1HB LEU 16 1HB LEU 16 -4.159 -3.904 -5.598 131 2HB LEU 16 2HB LEU 16 -5.498 -4.459 -6.584 132 HG LEU 16 HG LEU 16 -5.507 -4.142 -3.524 133 1HD1 LEU 16 2HD1 LEU 16 -5.551 -1.981 -4.805 134 2HD1 LEU 16 3HD1 LEU 16 -6.960 -2.538 -5.741 135 3HD1 LEU 16 1HD1 LEU 16 -7.099 -2.264 -3.987 136 1HD2 LEU 16 2HD2 LEU 16 -7.808 -5.067 -5.387 137 2HD2 LEU 16 3HD2 LEU 16 -7.029 -6.018 -4.099 138 3HD2 LEU 16 1HD2 LEU 16 -8.002 -4.607 -3.673 139 H LYS 17 H LYS 17 -2.043 -5.903 -5.906 140 HA LYS 17 HA LYS 17 -2.208 -5.950 -8.860 141 1HB LYS 17 1HB LYS 17 0.198 -5.641 -8.815 142 2HB LYS 17 2HB LYS 17 -0.412 -4.736 -7.437 143 1HG LYS 17 2HG LYS 17 1.066 -5.904 -6.115 144 2HG LYS 17 1HG LYS 17 0.079 -7.346 -6.352 145 1HD LYS 17 1HD LYS 17 1.996 -6.822 -8.587 146 2HD LYS 17 2HD LYS 17 2.726 -7.218 -7.019 147 1HE LYS 17 1HE LYS 17 0.375 -8.960 -7.434 148 2HE LYS 17 2HE LYS 17 1.421 -9.074 -8.858 149 1HZ LYS 17 3HZ LYS 17 3.323 -9.306 -7.223 150 2HZ LYS 17 1HZ LYS 17 2.164 -9.552 -6.030 151 3HZ LYS 17 2HZ LYS 17 2.261 -10.605 -7.337 152 H GLU 18 H GLU 18 -1.975 -8.354 -6.434 153 HA GLU 18 HA GLU 18 -1.124 -10.452 -8.393 154 1HB GLU 18 2HB GLU 18 -0.560 -10.353 -5.872 155 2HB GLU 18 1HB GLU 18 -2.241 -10.676 -5.527 156 1HG GLU 18 2HG GLU 18 -2.118 -12.986 -6.343 157 2HG GLU 18 1HG GLU 18 -0.644 -12.694 -7.231 158 H ASN 19 H ASN 19 -3.047 -9.467 -9.670 159 HA ASN 19 HA ASN 19 -5.021 -11.739 -9.599 160 1HB ASN 19 2HB ASN 19 -6.222 -10.006 -8.240 161 2HB ASN 19 1HB ASN 19 -5.804 -8.749 -9.379 162 1HD2 ASN 19 1HD2 ASN 19 -9.003 -11.066 -10.314 163 2HD2 ASN 19 2HD2 ASN 19 -7.789 -11.684 -9.066 164 H GLY 20 H GLY 20 -5.078 -8.602 -11.195 165 1HA GLY 20 2HA GLY 20 -3.808 -9.545 -13.689 166 2HA GLY 20 1HA GLY 20 -5.573 -9.646 -13.850 No H/Q in entry = 166 Start of MODEL 5 1 1H TYR 1 3H TYR 1 2.213 13.484 7.223 2 2H TYR 1 1H TYR 1 3.538 14.309 6.598 3 3H TYR 1 2H TYR 1 2.007 14.568 5.953 4 HA TYR 1 HA TYR 1 1.935 12.615 4.830 5 1HB TYR 1 2HB TYR 1 3.789 14.079 3.907 6 2HB TYR 1 1HB TYR 1 4.932 13.421 5.038 7 HD1 TYR 1 HD1 TYR 1 2.825 10.741 3.878 8 HD2 TYR 1 HD2 TYR 1 6.158 13.190 2.704 9 HE1 TYR 1 HE1 TYR 1 3.509 9.031 2.252 10 HE2 TYR 1 HE2 TYR 1 6.841 11.459 1.078 11 HH TYR 1 HH TYR 1 5.272 9.425 -0.209 12 H SER 2 H SER 2 5.032 12.210 6.479 13 HA SER 2 HA SER 2 5.775 10.495 7.940 14 1HB SER 2 2HB SER 2 3.216 10.995 8.877 15 2HB SER 2 1HB SER 2 3.006 9.329 8.359 16 HG SER 2 HG SER 2 4.893 8.800 9.636 17 H ASP 3 H ASP 3 6.941 9.275 6.793 18 HA ASP 3 HA ASP 3 6.587 7.522 4.819 19 1HB ASP 3 1HB ASP 3 8.060 7.101 7.499 20 2HB ASP 3 2HB ASP 3 8.059 5.787 6.344 21 H GLU 4 H GLU 4 5.214 6.649 7.975 22 HA GLU 4 HA GLU 4 4.858 3.825 7.196 23 1HB GLU 4 1HB GLU 4 3.534 5.486 9.446 24 2HB GLU 4 2HB GLU 4 3.454 3.745 9.328 25 1HG GLU 4 1HG GLU 4 6.273 4.268 9.307 26 2HG GLU 4 2HG GLU 4 5.660 5.481 10.403 27 H LEU 5 H LEU 5 2.900 6.682 6.983 28 HA LEU 5 HA LEU 5 0.389 5.183 6.538 29 1HB LEU 5 1HB LEU 5 1.161 8.123 5.973 30 2HB LEU 5 2HB LEU 5 -0.443 7.496 5.650 31 HG LEU 5 HG LEU 5 0.584 7.090 8.464 32 1HD1 LEU 5 2HD1 LEU 5 1.420 9.399 7.931 33 2HD1 LEU 5 3HD1 LEU 5 -0.209 9.892 7.406 34 3HD1 LEU 5 1HD1 LEU 5 0.093 9.461 9.107 35 1HD2 LEU 5 2HD2 LEU 5 -2.138 8.019 7.302 36 2HD2 LEU 5 3HD2 LEU 5 -1.742 6.401 7.934 37 3HD2 LEU 5 1HD2 LEU 5 -1.796 7.780 9.038 38 H ARG 6 H ARG 6 2.892 6.418 4.489 39 HA ARG 6 HA ARG 6 1.323 5.982 2.005 40 1HB ARG 6 2HB ARG 6 3.307 7.639 2.352 41 2HB ARG 6 1HB ARG 6 4.387 6.258 2.329 42 1HG ARG 6 1HG ARG 6 4.564 6.589 0.053 43 2HG ARG 6 2HG ARG 6 2.993 5.801 -0.058 44 1HD ARG 6 1HD ARG 6 2.013 8.263 0.356 45 2HD ARG 6 2HD ARG 6 3.651 8.798 -0.101 46 HE ARG 6 HE ARG 6 2.382 6.756 -1.904 47 1HH1 ARG 6 2HH2 ARG 6 3.069 10.123 -1.418 48 2HH1 ARG 6 1HH2 ARG 6 2.801 10.518 -3.201 49 1HH2 ARG 6 1HH1 ARG 6 2.112 7.257 -3.818 50 2HH2 ARG 6 2HH1 ARG 6 2.282 8.963 -4.511 51 H GLN 7 H GLN 7 3.822 4.256 3.758 52 HA GLN 7 HA GLN 7 3.980 2.060 1.810 53 1HB GLN 7 1HB GLN 7 5.552 1.103 3.292 54 2HB GLN 7 2HB GLN 7 5.700 2.825 3.641 55 1HG GLN 7 2HG GLN 7 4.225 2.524 5.707 56 2HG GLN 7 1HG GLN 7 4.053 0.821 5.360 57 1HE2 GLN 7 2HE2 GLN 7 7.612 0.302 6.401 58 2HE2 GLN 7 1HE2 GLN 7 6.738 0.155 4.776 59 H ARG 8 H ARG 8 1.916 2.788 4.475 60 HA ARG 8 HA ARG 8 0.829 0.062 4.797 61 1HB ARG 8 2HB ARG 8 0.650 1.994 6.490 62 2HB ARG 8 1HB ARG 8 -0.440 2.829 5.401 63 1HG ARG 8 1HG ARG 8 -1.494 0.089 5.872 64 2HG ARG 8 2HG ARG 8 -1.153 0.874 7.411 65 1HD ARG 8 1HD ARG 8 -3.293 1.723 7.085 66 2HD ARG 8 2HD ARG 8 -2.429 2.970 6.149 67 HE ARG 8 HE ARG 8 -2.880 1.643 4.065 68 1HH1 ARG 8 2HH2 ARG 8 -4.757 0.748 6.844 69 2HH1 ARG 8 1HH2 ARG 8 -6.071 -0.028 5.806 70 1HH2 ARG 8 1HH1 ARG 8 -4.341 0.787 3.008 71 2HH2 ARG 8 2HH1 ARG 8 -5.851 -0.010 3.720 72 H LEU 9 H LEU 9 -0.049 2.899 2.929 73 HA LEU 9 HA LEU 9 -2.517 1.731 1.815 74 1HB LEU 9 1HB LEU 9 -2.763 3.792 0.828 75 2HB LEU 9 2HB LEU 9 -1.406 4.273 1.827 76 HG LEU 9 HG LEU 9 0.140 3.643 -0.158 77 1HD1 LEU 9 3HD2 LEU 9 -1.649 2.310 -1.446 78 2HD1 LEU 9 1HD2 LEU 9 -2.478 3.829 -1.800 79 3HD1 LEU 9 2HD2 LEU 9 -0.830 3.550 -2.428 80 1HD2 LEU 9 2HD1 LEU 9 -0.487 6.013 0.534 81 2HD2 LEU 9 3HD1 LEU 9 -0.215 5.875 -1.220 82 3HD2 LEU 9 1HD1 LEU 9 -1.871 5.957 -0.572 83 H ALA 10 H ALA 10 0.829 1.747 0.887 84 HA ALA 10 HA ALA 10 0.384 0.541 -1.756 85 1HB ALA 10 2HB ALA 10 2.479 1.816 -1.145 86 2HB ALA 10 3HB ALA 10 2.910 0.579 0.060 87 3HB ALA 10 1HB ALA 10 2.902 0.177 -1.674 88 H ALA 11 H ALA 11 0.605 -0.690 1.459 89 HA ALA 11 HA ALA 11 1.228 -3.454 0.694 90 1HB ALA 11 2HB ALA 11 1.650 -2.527 3.006 91 2HB ALA 11 3HB ALA 11 -0.097 -2.312 3.266 92 3HB ALA 11 1HB ALA 11 0.591 -3.946 3.110 93 H ARG 12 H ARG 12 -1.694 -1.604 1.030 94 HA ARG 12 HA ARG 12 -3.493 -3.961 0.801 95 1HB ARG 12 2HB ARG 12 -4.085 -1.700 1.885 96 2HB ARG 12 1HB ARG 12 -4.007 -0.941 0.309 97 1HG ARG 12 2HG ARG 12 -6.078 -3.042 1.247 98 2HG ARG 12 1HG ARG 12 -6.388 -1.352 0.863 99 1HD ARG 12 1HD ARG 12 -5.459 -2.028 -1.596 100 2HD ARG 12 2HD ARG 12 -5.899 -3.669 -1.053 101 HE ARG 12 HE ARG 12 -8.198 -2.967 -0.776 102 1HH1 ARG 12 2HH2 ARG 12 -6.254 -0.332 -1.919 103 2HH1 ARG 12 1HH2 ARG 12 -7.709 0.540 -2.648 104 1HH2 ARG 12 1HH1 ARG 12 -9.750 -1.909 -1.492 105 2HH2 ARG 12 2HH1 ARG 12 -9.625 -0.261 -2.322 106 H LEU 13 H LEU 13 -2.482 -1.347 -1.337 107 HA LEU 13 HA LEU 13 -3.651 -2.326 -3.780 108 1HB LEU 13 1HB LEU 13 -2.625 -0.171 -3.939 109 2HB LEU 13 2HB LEU 13 -1.171 -0.677 -3.103 110 HG LEU 13 HG LEU 13 -0.462 -1.983 -5.165 111 1HD1 LEU 13 2HD1 LEU 13 -2.743 -2.342 -6.156 112 2HD1 LEU 13 3HD1 LEU 13 -2.899 -0.599 -6.485 113 3HD1 LEU 13 1HD1 LEU 13 -1.659 -1.563 -7.323 114 1HD2 LEU 13 2HD2 LEU 13 -0.972 1.048 -5.583 115 2HD2 LEU 13 3HD2 LEU 13 0.467 0.298 -4.849 116 3HD2 LEU 13 1HD2 LEU 13 0.136 0.051 -6.567 117 H GLU 14 H GLU 14 -0.922 -3.458 -2.007 118 HA GLU 14 HA GLU 14 0.219 -5.051 -4.196 119 1HB GLU 14 2HB GLU 14 1.394 -4.235 -2.053 120 2HB GLU 14 1HB GLU 14 0.483 -5.416 -1.146 121 1HG GLU 14 1HG GLU 14 1.618 -7.302 -2.489 122 2HG GLU 14 2HG GLU 14 2.582 -6.110 -3.326 123 H ALA 15 H ALA 15 -1.994 -5.685 -1.557 124 HA ALA 15 HA ALA 15 -2.081 -8.591 -1.937 125 1HB ALA 15 2HB ALA 15 -2.773 -7.455 0.208 126 2HB ALA 15 3HB ALA 15 -4.133 -6.659 -0.620 127 3HB ALA 15 1HB ALA 15 -4.119 -8.428 -0.416 128 H LEU 16 H LEU 16 -3.816 -5.892 -3.275 129 HA LEU 16 HA LEU 16 -5.853 -7.658 -4.552 130 1HB LEU 16 1HB LEU 16 -5.266 -4.634 -4.677 131 2HB LEU 16 2HB LEU 16 -6.448 -5.363 -5.747 132 HG LEU 16 HG LEU 16 -6.583 -4.923 -2.742 133 1HD1 LEU 16 3HD2 LEU 16 -7.673 -3.319 -4.439 134 2HD1 LEU 16 1HD2 LEU 16 -8.766 -4.623 -4.916 135 3HD1 LEU 16 2HD2 LEU 16 -8.812 -3.991 -3.246 136 1HD2 LEU 16 2HD1 LEU 16 -7.007 -7.408 -3.090 137 2HD2 LEU 16 3HD1 LEU 16 -8.455 -6.552 -2.503 138 3HD2 LEU 16 1HD1 LEU 16 -8.318 -7.013 -4.217 139 H LYS 17 H LYS 17 -2.900 -6.103 -5.463 140 HA LYS 17 HA LYS 17 -3.443 -6.557 -8.370 141 1HB LYS 17 1HB LYS 17 -1.485 -5.213 -8.772 142 2HB LYS 17 2HB LYS 17 -2.203 -4.496 -7.335 143 1HG LYS 17 2HG LYS 17 -0.077 -4.683 -6.430 144 2HG LYS 17 1HG LYS 17 -0.490 -6.372 -6.145 145 1HD LYS 17 1HD LYS 17 0.914 -7.209 -7.702 146 2HD LYS 17 2HD LYS 17 0.573 -5.931 -8.885 147 1HE LYS 17 1HE LYS 17 2.172 -4.418 -7.973 148 2HE LYS 17 2HE LYS 17 2.059 -5.088 -6.338 149 1HZ LYS 17 2HZ LYS 17 3.090 -6.777 -8.530 150 2HZ LYS 17 3HZ LYS 17 4.089 -5.648 -7.784 151 3HZ LYS 17 1HZ LYS 17 3.384 -6.876 -6.877 152 H GLU 18 H GLU 18 -2.697 -8.659 -6.104 153 HA GLU 18 HA GLU 18 -0.485 -10.185 -6.933 154 1HB GLU 18 2HB GLU 18 -1.999 -10.844 -5.093 155 2HB GLU 18 1HB GLU 18 -3.336 -11.079 -6.191 156 1HG GLU 18 2HG GLU 18 -1.717 -12.999 -7.280 157 2HG GLU 18 1HG GLU 18 -0.924 -12.921 -5.727 158 H ASN 19 H ASN 19 -3.559 -11.431 -8.067 159 HA ASN 19 HA ASN 19 -2.565 -12.499 -10.519 160 1HB ASN 19 1HB ASN 19 -5.351 -11.437 -9.715 161 2HB ASN 19 2HB ASN 19 -5.101 -12.058 -11.330 162 1HD2 ASN 19 1HD2 ASN 19 -5.183 -15.441 -10.164 163 2HD2 ASN 19 2HD2 ASN 19 -4.633 -14.352 -11.551 164 H GLY 20 H GLY 20 -4.150 -9.375 -10.045 165 1HA GLY 20 2HA GLY 20 -2.457 -8.145 -12.203 166 2HA GLY 20 1HA GLY 20 -4.158 -8.351 -12.668
Contact the webmaster for help, if required. Friday, July 5, 2024 2:47:36 AM GMT (wattos1)