NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | position | program | type |
6798 | 1jjz | 5114 | cing | recoord | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H ASN 8 H ASN 8 -5.709 1.971 3.606 2 HA ASN 8 HA ASN 8 -6.099 2.269 5.716 3 1HB ASN 8 1HB ASN 8 -8.885 1.358 4.873 4 2HB ASN 8 2HB ASN 8 -8.549 1.770 6.543 5 1HD2 ASN 8 1HD2 ASN 8 -10.097 2.972 4.174 6 2HD2 ASN 8 2HD2 ASN 8 -9.680 4.652 4.185 7 H GLY 9 H GLY 9 -5.363 -0.499 4.523 8 1HA GLY 9 1HA GLY 9 -4.560 -2.058 6.348 9 2HA GLY 9 2HA GLY 9 -6.258 -2.223 6.747 10 H LEU 10 H LEU 10 -7.356 -2.132 4.061 11 HA LEU 10 HA LEU 10 -7.102 -4.833 3.384 12 1HB LEU 10 1HB LEU 10 -8.213 -2.527 1.779 13 2HB LEU 10 2HB LEU 10 -8.465 -4.227 1.435 14 HG LEU 10 HG LEU 10 -9.228 -3.536 4.172 15 1HD1 LEU 10 1HD1 LEU 10 -10.942 -2.284 2.028 16 2HD1 LEU 10 2HD1 LEU 10 -11.026 -2.081 3.794 17 3HD1 LEU 10 3HD1 LEU 10 -9.674 -1.370 2.881 18 1HD2 LEU 10 1HD2 LEU 10 -9.762 -5.577 2.576 19 2HD2 LEU 10 2HD2 LEU 10 -10.922 -5.025 3.808 20 3HD2 LEU 10 3HD2 LEU 10 -11.137 -4.548 2.107 21 HA PRO 11 HA PRO 11 -3.365 -4.413 1.141 22 1HB PRO 11 1HB PRO 11 -2.847 -7.083 0.875 23 2HB PRO 11 2HB PRO 11 -2.357 -6.146 2.273 24 1HG PRO 11 1HG PRO 11 -4.569 -8.093 2.028 25 2HG PRO 11 2HG PRO 11 -3.804 -7.478 3.479 26 1HD PRO 11 1HD PRO 11 -6.354 -6.700 2.423 27 2HD PRO 11 2HD PRO 11 -5.538 -6.004 3.808 28 H VAL 12 H VAL 12 -5.110 -3.491 -0.408 29 HA VAL 12 HA VAL 12 -4.834 -5.161 -2.787 30 HB VAL 12 HB VAL 12 -7.180 -4.684 -3.386 31 1HG1 VAL 12 1HG1 VAL 12 -8.166 -6.410 -2.023 32 2HG1 VAL 12 2HG1 VAL 12 -6.461 -6.829 -2.310 33 3HG1 VAL 12 3HG1 VAL 12 -6.960 -6.155 -0.741 34 1HG2 VAL 12 1HG2 VAL 12 -8.749 -3.752 -1.894 35 2HG2 VAL 12 2HG2 VAL 12 -7.641 -3.884 -0.507 36 3HG2 VAL 12 3HG2 VAL 12 -7.330 -2.684 -1.784 37 H CYS 13 H CYS 13 -3.593 -2.652 -1.535 38 HA CYS 13 HA CYS 13 -4.530 -0.395 -2.814 39 1HB CYS 13 1HB CYS 13 -2.977 -0.196 -1.026 40 2HB CYS 13 2HB CYS 13 -1.777 -1.168 -1.854 41 H GLY 14 H GLY 14 -2.237 -2.988 -3.835 42 1HA GLY 14 1HA GLY 14 -2.023 -3.711 -6.038 43 2HA GLY 14 2HA GLY 14 -2.640 -2.178 -6.621 44 H GLU 15 H GLU 15 -0.626 -1.153 -4.244 45 HA GLU 15 HA GLU 15 1.706 -1.254 -5.994 46 1HB GLU 15 1HB GLU 15 0.792 1.126 -4.320 47 2HB GLU 15 2HB GLU 15 2.228 1.076 -5.322 48 1HG GLU 15 1HG GLU 15 -0.619 0.699 -6.367 49 2HG GLU 15 2HG GLU 15 0.270 2.208 -6.437 50 HE2 GLU 15 HE GLU 15 1.782 1.746 -9.102 51 H THR 16 H THR 16 3.820 -1.005 -4.845 52 HA THR 16 HA THR 16 3.609 -2.096 -2.122 53 HB THR 16 HB THR 16 6.140 -2.209 -3.753 54 HG1 THR 16 1HG THR 16 5.035 -4.120 -4.817 55 1HG2 THR 16 1HG2 THR 16 4.605 -3.962 -1.808 56 2HG2 THR 16 2HG2 THR 16 5.740 -4.718 -2.951 57 3HG2 THR 16 3HG2 THR 16 6.326 -3.510 -1.783 58 H CYS 17 H CYS 17 5.800 -1.567 -0.853 59 HA CYS 17 HA CYS 17 6.658 1.132 -1.336 60 1HB CYS 17 1HB CYS 17 5.997 2.000 0.837 61 2HB CYS 17 2HB CYS 17 4.606 1.582 -0.143 62 H VAL 18 H VAL 18 8.487 -0.556 -1.677 63 HA VAL 18 HA VAL 18 9.482 -1.858 0.658 64 HB VAL 18 HB VAL 18 10.982 -1.330 -1.899 65 1HG1 VAL 18 1HG1 VAL 18 12.134 -2.414 0.047 66 2HG1 VAL 18 2HG1 VAL 18 10.966 -3.752 -0.070 67 3HG1 VAL 18 3HG1 VAL 18 12.076 -3.420 -1.421 68 1HG2 VAL 18 1HG2 VAL 18 9.270 -2.259 -3.022 69 2HG2 VAL 18 2HG2 VAL 18 9.799 -3.787 -2.278 70 3HG2 VAL 18 3HG2 VAL 18 8.485 -2.844 -1.535 71 H GLY 19 H GLY 19 9.685 1.338 -0.732 72 1HA GLY 19 1HA GLY 19 12.083 1.950 0.871 73 2HA GLY 19 2HA GLY 19 11.464 2.884 -0.476 74 H GLY 20 H GLY 20 8.675 2.000 1.034 75 1HA GLY 20 1HA GLY 20 7.509 2.806 2.871 76 2HA GLY 20 2HA GLY 20 8.779 3.969 3.193 77 H THR 21 H THR 21 7.726 3.594 -0.150 78 HA THR 21 HA THR 21 5.998 5.955 0.113 79 HB THR 21 HB THR 21 8.444 5.532 -1.657 80 HG1 THR 21 1HG THR 21 8.588 6.675 0.411 81 1HG2 THR 21 1HG2 THR 21 7.373 8.017 -2.323 82 2HG2 THR 21 2HG2 THR 21 7.285 6.569 -3.356 83 3HG2 THR 21 3HG2 THR 21 5.925 6.982 -2.283 84 H CYS 22 H CYS 22 4.269 4.355 0.068 85 HA CYS 22 HA CYS 22 3.875 2.443 -1.777 86 1HB CYS 22 1HB CYS 22 1.466 2.803 -1.494 87 2HB CYS 22 2HB CYS 22 2.339 2.790 0.025 88 H ASN 23 H ASN 23 3.799 5.979 -2.172 89 HA ASN 23 HA ASN 23 3.666 7.270 -3.909 90 1HB ASN 23 1HB ASN 23 5.345 5.495 -4.830 91 2HB ASN 23 2HB ASN 23 3.995 4.843 -5.737 92 1HD2 ASN 23 1HD2 ASN 23 5.651 7.905 -5.016 93 2HD2 ASN 23 2HD2 ASN 23 5.500 8.617 -6.589 94 H THR 24 H THR 24 1.332 5.368 -2.950 95 HA THR 24 HA THR 24 -0.376 5.687 -5.330 96 HB THR 24 HB THR 24 -1.083 3.868 -3.028 97 HG1 THR 24 1HG THR 24 1.125 3.328 -3.395 98 1HG2 THR 24 1HG2 THR 24 -1.341 2.401 -5.294 99 2HG2 THR 24 2HG2 THR 24 -2.621 3.512 -4.753 100 3HG2 THR 24 3HG2 THR 24 -1.474 4.023 -6.014 101 HA PRO 25 HA PRO 25 -2.735 8.514 -3.130 102 1HB PRO 25 1HB PRO 25 -5.120 8.357 -4.456 103 2HB PRO 25 2HB PRO 25 -3.749 9.269 -5.056 104 1HG PRO 25 1HG PRO 25 -4.787 6.660 -5.981 105 2HG PRO 25 2HG PRO 25 -3.716 7.772 -6.810 106 1HD PRO 25 1HD PRO 25 -2.975 5.330 -5.500 107 2HD PRO 25 2HD PRO 25 -1.892 6.500 -6.227 108 H GLY 26 H GLY 26 -3.982 8.789 -1.321 109 1HA GLY 26 1HA GLY 26 -4.924 7.966 0.566 110 2HA GLY 26 2HA GLY 26 -6.144 7.384 -0.550 111 H CYS 27 H CYS 27 -2.694 6.396 0.051 112 HA CYS 27 HA CYS 27 -3.697 3.663 0.321 113 1HB CYS 27 1HB CYS 27 -2.001 2.970 -0.921 114 2HB CYS 27 2HB CYS 27 -1.740 4.652 -1.337 115 H THR 28 H THR 28 -1.973 2.347 1.820 116 HA THR 28 HA THR 28 -1.153 4.004 4.079 117 HB THR 28 HB THR 28 -3.350 1.926 4.032 118 HG1 THR 28 1HG THR 28 -2.684 4.256 5.682 119 1HG2 THR 28 1HG2 THR 28 -2.323 0.818 5.790 120 2HG2 THR 28 2HG2 THR 28 -1.185 2.154 6.087 121 3HG2 THR 28 3HG2 THR 28 -2.846 2.245 6.718 122 H CYS 29 H CYS 29 0.903 3.486 2.889 123 HA CYS 29 HA CYS 29 1.952 1.107 2.386 124 1HB CYS 29 1HB CYS 29 3.201 3.123 2.065 125 2HB CYS 29 2HB CYS 29 3.271 3.434 3.789 126 H SER 30 H SER 30 1.911 -0.803 3.519 127 HA SER 30 HA SER 30 2.222 -0.579 6.412 128 1HB SER 30 1HB SER 30 -0.023 -1.318 6.031 129 2HB SER 30 2HB SER 30 0.463 -2.416 4.754 130 HG SER 30 HG SER 30 0.691 -3.936 6.231 131 H TRP 31 H TRP 31 3.503 -1.670 3.434 132 HA TRP 31 HA TRP 31 5.230 -2.940 2.887 133 1HB TRP 31 1HB TRP 31 5.895 -1.865 5.386 134 2HB TRP 31 2HB TRP 31 6.313 -3.563 5.501 135 HD1 TRP 31 HD TRP 31 7.491 -0.342 3.881 136 HE1 TRP 31 1HE TRP 31 9.737 -0.668 2.536 137 HE3 TRP 31 3HE TRP 31 7.489 -5.422 4.086 138 HZ2 TRP 31 2HZ TRP 31 11.228 -2.963 1.727 139 HZ3 TRP 31 3HZ TRP 31 9.376 -6.629 2.993 140 HH2 TRP 31 HH TRP 31 11.203 -5.482 1.843 141 HA PRO 32 HA PRO 32 6.424 -4.337 2.382 142 1HB PRO 32 1HB PRO 32 6.357 -6.207 0.390 143 2HB PRO 32 2HB PRO 32 7.368 -6.358 1.813 144 1HG PRO 32 1HG PRO 32 4.858 -7.778 1.165 145 2HG PRO 32 2HG PRO 32 6.088 -8.203 2.339 146 1HD PRO 32 1HD PRO 32 3.532 -7.019 2.881 147 2HD PRO 32 2HD PRO 32 4.806 -7.336 4.041 148 H VAL 33 H VAL 33 3.155 -5.012 1.724 149 HA VAL 33 HA VAL 33 3.305 -3.142 -0.537 150 HB VAL 33 HB VAL 33 1.032 -5.036 -0.060 151 1HG1 VAL 33 1HG1 VAL 33 2.231 -3.673 -2.488 152 2HG1 VAL 33 2HG1 VAL 33 0.977 -4.931 -2.586 153 3HG1 VAL 33 3HG1 VAL 33 0.635 -3.397 -1.751 154 1HG2 VAL 33 1HG2 VAL 33 2.414 -6.468 -1.840 155 2HG2 VAL 33 2HG2 VAL 33 3.788 -5.734 -0.978 156 3HG2 VAL 33 3HG2 VAL 33 2.594 -6.707 -0.086 157 H CYS 34 H CYS 34 1.655 -1.496 -0.676 158 HA CYS 34 HA CYS 34 0.930 -0.541 1.908 159 1HB CYS 34 1HB CYS 34 0.487 1.456 0.904 160 2HB CYS 34 2HB CYS 34 1.651 0.779 -0.218 161 H THR 35 H THR 35 -1.457 0.245 2.241 162 HA THR 35 HA THR 35 -3.346 -1.625 0.998 163 HB THR 35 HB THR 35 -4.320 -1.759 3.437 164 HG1 THR 35 1HG THR 35 -2.637 0.011 3.966 165 1HG2 THR 35 1HG2 THR 35 -2.057 -3.248 4.033 166 2HG2 THR 35 2HG2 THR 35 -3.416 -3.849 3.052 167 3HG2 THR 35 3HG2 THR 35 -1.973 -3.172 2.257 168 H ARG 36 H ARG 36 -5.697 -0.938 1.747 169 HA ARG 36 HA ARG 36 -5.726 1.961 1.466 170 1HB ARG 36 1HB ARG 36 -6.571 0.530 -0.516 171 2HB ARG 36 2HB ARG 36 -7.904 0.042 0.511 172 1HG ARG 36 1HG ARG 36 -8.155 2.691 0.876 173 2HG ARG 36 2HG ARG 36 -7.299 2.763 -0.651 174 1HD ARG 36 1HD ARG 36 -9.554 0.801 -0.559 175 2HD ARG 36 2HD ARG 36 -10.028 2.483 -0.431 176 HE ARG 36 HE ARG 36 -8.195 2.428 -2.544 177 1HH1 ARG 36 2HH2 ARG 36 -11.251 0.843 -1.822 178 2HH1 ARG 36 1HH2 ARG 36 -11.710 0.686 -3.485 179 1HH2 ARG 36 2HH1 ARG 36 -8.798 2.221 -4.738 180 2HH2 ARG 36 1HH1 ARG 36 -10.304 1.476 -5.155 Start of MODEL 2 1 H ASN 8 H ASN 8 -5.748 2.112 3.616 2 HA ASN 8 HA ASN 8 -5.508 2.155 5.840 3 1HB ASN 8 1HB ASN 8 -8.342 2.031 4.970 4 2HB ASN 8 2HB ASN 8 -8.147 1.650 6.669 5 1HD2 ASN 8 1HD2 ASN 8 -7.986 4.053 4.214 6 2HD2 ASN 8 2HD2 ASN 8 -7.655 5.435 5.206 7 H GLY 9 H GLY 9 -5.351 -0.707 4.593 8 1HA GLY 9 1HA GLY 9 -4.663 -2.306 6.534 9 2HA GLY 9 2HA GLY 9 -6.395 -2.331 6.802 10 H LEU 10 H LEU 10 -7.471 -2.275 4.224 11 HA LEU 10 HA LEU 10 -7.179 -4.946 3.455 12 1HB LEU 10 1HB LEU 10 -8.378 -2.609 1.959 13 2HB LEU 10 2HB LEU 10 -8.597 -4.299 1.552 14 HG LEU 10 HG LEU 10 -9.315 -3.686 4.333 15 1HD1 LEU 10 1HD1 LEU 10 -10.382 -2.007 2.140 16 2HD1 LEU 10 2HD1 LEU 10 -11.585 -2.704 3.250 17 3HD1 LEU 10 3HD1 LEU 10 -10.268 -1.692 3.888 18 1HD2 LEU 10 1HD2 LEU 10 -10.159 -5.408 2.123 19 2HD2 LEU 10 2HD2 LEU 10 -10.242 -5.666 3.882 20 3HD2 LEU 10 3HD2 LEU 10 -11.519 -4.740 3.056 21 HA PRO 11 HA PRO 11 -3.500 -4.358 1.146 22 1HB PRO 11 1HB PRO 11 -2.886 -7.004 0.848 23 2HB PRO 11 2HB PRO 11 -2.398 -6.058 2.241 24 1HG PRO 11 1HG PRO 11 -4.539 -8.087 2.036 25 2HG PRO 11 2HG PRO 11 -3.761 -7.453 3.472 26 1HD PRO 11 1HD PRO 11 -6.366 -6.767 2.485 27 2HD PRO 11 2HD PRO 11 -5.542 -6.049 3.855 28 H VAL 12 H VAL 12 -5.171 -3.437 -0.404 29 HA VAL 12 HA VAL 12 -4.986 -5.144 -2.764 30 HB VAL 12 HB VAL 12 -7.336 -4.588 -3.329 31 1HG1 VAL 12 1HG1 VAL 12 -7.151 -6.092 -0.703 32 2HG1 VAL 12 2HG1 VAL 12 -8.315 -6.335 -2.027 33 3HG1 VAL 12 3HG1 VAL 12 -6.601 -6.758 -2.258 34 1HG2 VAL 12 1HG2 VAL 12 -8.797 -3.501 -1.921 35 2HG2 VAL 12 2HG2 VAL 12 -7.883 -3.933 -0.455 36 3HG2 VAL 12 3HG2 VAL 12 -7.285 -2.646 -1.529 37 H CYS 13 H CYS 13 -3.668 -2.650 -1.557 38 HA CYS 13 HA CYS 13 -4.584 -0.402 -2.898 39 1HB CYS 13 1HB CYS 13 -3.111 -0.043 -1.124 40 2HB CYS 13 2HB CYS 13 -1.934 -1.195 -1.725 41 H GLY 14 H GLY 14 -2.155 -2.952 -3.752 42 1HA GLY 14 1HA GLY 14 -1.860 -3.764 -5.917 43 2HA GLY 14 2HA GLY 14 -2.543 -2.294 -6.582 44 H GLU 15 H GLU 15 -0.613 -1.114 -4.177 45 HA GLU 15 HA GLU 15 1.734 -1.114 -5.909 46 1HB GLU 15 1HB GLU 15 0.898 1.243 -4.181 47 2HB GLU 15 2HB GLU 15 2.104 1.219 -5.452 48 1HG GLU 15 1HG GLU 15 -0.808 0.565 -6.040 49 2HG GLU 15 2HG GLU 15 -0.245 2.225 -5.999 50 HE2 GLU 15 HE GLU 15 0.133 0.524 -9.346 51 H THR 16 H THR 16 3.806 -1.098 -4.843 52 HA THR 16 HA THR 16 3.629 -2.033 -2.070 53 HB THR 16 HB THR 16 6.155 -2.183 -3.695 54 HG1 THR 16 1HG THR 16 5.162 -3.762 -5.047 55 1HG2 THR 16 1HG2 THR 16 5.711 -4.690 -2.896 56 2HG2 THR 16 2HG2 THR 16 6.313 -3.489 -1.729 57 3HG2 THR 16 3HG2 THR 16 4.584 -3.912 -1.759 58 H CYS 17 H CYS 17 5.799 -1.474 -0.807 59 HA CYS 17 HA CYS 17 6.675 1.207 -1.359 60 1HB CYS 17 1HB CYS 17 6.040 2.091 0.842 61 2HB CYS 17 2HB CYS 17 4.663 1.747 -0.186 62 H VAL 18 H VAL 18 8.452 -0.588 -1.658 63 HA VAL 18 HA VAL 18 9.454 -1.809 0.704 64 HB VAL 18 HB VAL 18 10.964 -1.348 -1.860 65 1HG1 VAL 18 1HG1 VAL 18 12.089 -2.409 0.121 66 2HG1 VAL 18 2HG1 VAL 18 10.915 -3.742 0.003 67 3HG1 VAL 18 3HG1 VAL 18 12.044 -3.429 -1.337 68 1HG2 VAL 18 1HG2 VAL 18 8.471 -2.886 -1.446 69 2HG2 VAL 18 2HG2 VAL 18 9.194 -2.243 -2.941 70 3HG2 VAL 18 3HG2 VAL 18 9.785 -3.775 -2.253 71 H GLY 19 H GLY 19 9.711 1.349 -0.779 72 1HA GLY 19 1HA GLY 19 12.127 1.976 0.777 73 2HA GLY 19 2HA GLY 19 11.451 2.914 -0.540 74 H GLY 20 H GLY 20 8.719 2.025 1.053 75 1HA GLY 20 1HA GLY 20 7.641 2.809 2.963 76 2HA GLY 20 2HA GLY 20 8.903 3.999 3.211 77 H THR 21 H THR 21 7.695 3.570 -0.073 78 HA THR 21 HA THR 21 5.849 5.819 0.245 79 HB THR 21 HB THR 21 8.272 5.686 -1.623 80 HG1 THR 21 1HG THR 21 8.897 6.715 0.261 81 1HG2 THR 21 1HG2 THR 21 7.070 7.034 -3.034 82 2HG2 THR 21 2HG2 THR 21 5.707 7.113 -1.892 83 3HG2 THR 21 3HG2 THR 21 7.073 8.241 -1.726 84 H CYS 22 H CYS 22 4.061 4.521 -0.090 85 HA CYS 22 HA CYS 22 3.816 2.462 -1.820 86 1HB CYS 22 1HB CYS 22 1.384 3.097 -1.961 87 2HB CYS 22 2HB CYS 22 2.044 2.876 -0.353 88 H ASN 23 H ASN 23 3.748 5.996 -2.460 89 HA ASN 23 HA ASN 23 4.258 7.045 -4.328 90 1HB ASN 23 1HB ASN 23 5.089 4.530 -5.093 91 2HB ASN 23 2HB ASN 23 3.774 4.771 -6.227 92 1HD2 ASN 23 1HD2 ASN 23 3.728 6.907 -7.352 93 2HD2 ASN 23 2HD2 ASN 23 5.226 7.573 -7.909 94 H THR 24 H THR 24 1.512 5.381 -3.423 95 HA THR 24 HA THR 24 -0.114 6.712 -5.481 96 HB THR 24 HB THR 24 0.108 4.180 -5.802 97 HG1 THR 24 1HG THR 24 -2.313 4.066 -5.886 98 1HG2 THR 24 1HG2 THR 24 -1.915 3.569 -3.791 99 2HG2 THR 24 2HG2 THR 24 -0.363 2.750 -4.085 100 3HG2 THR 24 3HG2 THR 24 -0.434 4.154 -2.994 101 HA PRO 25 HA PRO 25 -2.117 8.439 -2.096 102 1HB PRO 25 1HB PRO 25 -4.383 9.373 -3.305 103 2HB PRO 25 2HB PRO 25 -2.849 10.218 -3.362 104 1HG PRO 25 1HG PRO 25 -4.179 8.649 -5.485 105 2HG PRO 25 2HG PRO 25 -2.893 9.829 -5.635 106 1HD PRO 25 1HD PRO 25 -2.627 6.976 -5.759 107 2HD PRO 25 2HD PRO 25 -1.328 8.152 -5.793 108 H GLY 26 H GLY 26 -4.443 8.596 -1.028 109 1HA GLY 26 1HA GLY 26 -5.807 7.309 0.243 110 2HA GLY 26 2HA GLY 26 -6.361 6.739 -1.318 111 H CYS 27 H CYS 27 -3.042 6.191 -0.081 112 HA CYS 27 HA CYS 27 -3.733 3.350 0.113 113 1HB CYS 27 1HB CYS 27 -1.886 2.766 -1.008 114 2HB CYS 27 2HB CYS 27 -2.016 4.384 -1.669 115 H THR 28 H THR 28 -2.155 2.170 1.705 116 HA THR 28 HA THR 28 -1.305 3.947 3.874 117 HB THR 28 HB THR 28 -3.250 1.592 4.050 118 HG1 THR 28 1HG THR 28 -3.155 4.423 4.824 119 1HG2 THR 28 1HG2 THR 28 -3.173 1.824 6.463 120 2HG2 THR 28 2HG2 THR 28 -1.483 1.633 5.939 121 3HG2 THR 28 3HG2 THR 28 -2.110 3.246 6.354 122 H CYS 29 H CYS 29 0.778 3.483 2.761 123 HA CYS 29 HA CYS 29 1.904 1.123 2.304 124 1HB CYS 29 1HB CYS 29 3.095 3.163 1.944 125 2HB CYS 29 2HB CYS 29 3.128 3.529 3.657 126 H SER 30 H SER 30 1.748 -0.753 3.495 127 HA SER 30 HA SER 30 2.121 -0.462 6.375 128 1HB SER 30 1HB SER 30 -0.076 -1.553 4.999 129 2HB SER 30 2HB SER 30 0.826 -2.960 5.524 130 HG SER 30 HG SER 30 -0.861 -1.816 7.024 131 H TRP 31 H TRP 31 3.402 -1.603 3.424 132 HA TRP 31 HA TRP 31 5.132 -2.878 2.901 133 1HB TRP 31 1HB TRP 31 5.785 -1.783 5.393 134 2HB TRP 31 2HB TRP 31 6.197 -3.481 5.526 135 HD1 TRP 31 HD TRP 31 7.378 -0.278 3.863 136 HE1 TRP 31 1HE TRP 31 9.638 -0.621 2.543 137 HE3 TRP 31 3HE TRP 31 7.396 -5.353 4.165 138 HZ2 TRP 31 2HZ TRP 31 11.145 -2.924 1.789 139 HZ3 TRP 31 3HZ TRP 31 9.297 -6.573 3.110 140 HH2 TRP 31 HH TRP 31 11.128 -5.441 1.953 141 HA PRO 32 HA PRO 32 6.336 -4.284 2.426 142 1HB PRO 32 1HB PRO 32 6.289 -6.175 0.453 143 2HB PRO 32 2HB PRO 32 7.283 -6.313 1.889 144 1HG PRO 32 1HG PRO 32 4.778 -7.735 1.227 145 2HG PRO 32 2HG PRO 32 5.993 -8.149 2.420 146 1HD PRO 32 1HD PRO 32 3.433 -6.956 2.919 147 2HD PRO 32 2HD PRO 32 4.692 -7.263 4.097 148 H VAL 33 H VAL 33 3.074 -4.971 1.729 149 HA VAL 33 HA VAL 33 3.253 -3.104 -0.536 150 HB VAL 33 HB VAL 33 0.992 -5.026 -0.112 151 1HG1 VAL 33 1HG1 VAL 33 0.501 -3.528 -1.831 152 2HG1 VAL 33 2HG1 VAL 33 2.179 -3.496 -2.424 153 3HG1 VAL 33 3HG1 VAL 33 1.162 -4.930 -2.705 154 1HG2 VAL 33 1HG2 VAL 33 3.672 -5.684 -1.374 155 2HG2 VAL 33 2HG2 VAL 33 2.915 -6.472 0.031 156 3HG2 VAL 33 3HG2 VAL 33 2.195 -6.654 -1.588 157 H CYS 34 H CYS 34 1.629 -1.452 -0.689 158 HA CYS 34 HA CYS 34 0.839 -0.501 1.864 159 1HB CYS 34 1HB CYS 34 0.022 1.424 0.716 160 2HB CYS 34 2HB CYS 34 1.576 0.977 0.040 161 H THR 35 H THR 35 -1.503 0.096 2.350 162 HA THR 35 HA THR 35 -3.375 -1.777 1.065 163 HB THR 35 HB THR 35 -4.325 -2.067 3.429 164 HG1 THR 35 1HG THR 35 -3.392 -0.431 4.642 165 1HG2 THR 35 1HG2 THR 35 -1.600 -3.007 2.559 166 2HG2 THR 35 2HG2 THR 35 -2.001 -3.197 4.282 167 3HG2 THR 35 3HG2 THR 35 -3.021 -3.963 3.041 168 H ARG 36 H ARG 36 -5.732 -1.112 2.094 169 HA ARG 36 HA ARG 36 -5.859 1.738 1.508 170 1HB ARG 36 1HB ARG 36 -7.369 -0.578 0.497 171 2HB ARG 36 2HB ARG 36 -8.448 0.637 1.153 172 1HG ARG 36 1HG ARG 36 -7.414 2.378 -0.278 173 2HG ARG 36 2HG ARG 36 -6.243 1.221 -0.881 174 1HD ARG 36 1HD ARG 36 -7.778 0.985 -2.586 175 2HD ARG 36 2HD ARG 36 -8.519 -0.150 -1.475 176 HE ARG 36 HE ARG 36 -9.598 2.317 -0.747 177 1HH1 ARG 36 2HH2 ARG 36 -9.453 0.438 -3.718 178 2HH1 ARG 36 1HH2 ARG 36 -10.943 1.065 -4.338 179 1HH2 ARG 36 2HH1 ARG 36 -11.565 3.145 -1.564 180 2HH2 ARG 36 1HH1 ARG 36 -12.154 2.614 -3.104 Start of MODEL 3 1 H ASN 8 H ASN 8 -6.576 2.447 3.319 2 HA ASN 8 HA ASN 8 -5.828 2.519 5.591 3 1HB ASN 8 1HB ASN 8 -8.025 2.759 6.667 4 2HB ASN 8 2HB ASN 8 -8.154 3.330 5.015 5 1HD2 ASN 8 1HD2 ASN 8 -10.446 2.809 6.021 6 2HD2 ASN 8 2HD2 ASN 8 -11.130 1.296 5.526 7 H GLY 9 H GLY 9 -5.526 -0.343 4.435 8 1HA GLY 9 1HA GLY 9 -4.771 -1.866 6.405 9 2HA GLY 9 2HA GLY 9 -6.498 -1.970 6.677 10 H LEU 10 H LEU 10 -7.624 -2.073 4.155 11 HA LEU 10 HA LEU 10 -7.238 -4.718 3.433 12 1HB LEU 10 1HB LEU 10 -8.409 -2.460 1.802 13 2HB LEU 10 2HB LEU 10 -8.624 -4.171 1.491 14 HG LEU 10 HG LEU 10 -9.410 -3.253 4.201 15 1HD1 LEU 10 1HD1 LEU 10 -11.267 -2.017 3.656 16 2HD1 LEU 10 2HD1 LEU 10 -10.114 -1.462 2.418 17 3HD1 LEU 10 3HD1 LEU 10 -11.357 -2.666 2.002 18 1HD2 LEU 10 1HD2 LEU 10 -9.707 -5.570 3.500 19 2HD2 LEU 10 2HD2 LEU 10 -11.277 -4.792 3.811 20 3HD2 LEU 10 3HD2 LEU 10 -10.724 -5.042 2.138 21 HA PRO 11 HA PRO 11 -3.517 -4.213 1.189 22 1HB PRO 11 1HB PRO 11 -2.955 -6.870 0.888 23 2HB PRO 11 2HB PRO 11 -2.485 -5.945 2.299 24 1HG PRO 11 1HG PRO 11 -4.664 -7.923 2.021 25 2HG PRO 11 2HG PRO 11 -3.912 -7.317 3.483 26 1HD PRO 11 1HD PRO 11 -6.473 -6.564 2.431 27 2HD PRO 11 2HD PRO 11 -5.671 -5.875 3.828 28 H VAL 12 H VAL 12 -5.078 -3.229 -0.413 29 HA VAL 12 HA VAL 12 -4.865 -4.913 -2.779 30 HB VAL 12 HB VAL 12 -7.214 -4.257 -3.391 31 1HG1 VAL 12 1HG1 VAL 12 -8.012 -6.241 -2.601 32 2HG1 VAL 12 2HG1 VAL 12 -6.297 -6.475 -2.186 33 3HG1 VAL 12 3HG1 VAL 12 -7.449 -5.937 -0.940 34 1HG2 VAL 12 1HG2 VAL 12 -8.585 -3.973 -1.093 35 2HG2 VAL 12 2HG2 VAL 12 -7.084 -3.133 -0.636 36 3HG2 VAL 12 3HG2 VAL 12 -8.009 -2.592 -2.057 37 H CYS 13 H CYS 13 -3.550 -2.460 -1.521 38 HA CYS 13 HA CYS 13 -4.398 -0.153 -2.748 39 1HB CYS 13 1HB CYS 13 -2.808 0.072 -1.060 40 2HB CYS 13 2HB CYS 13 -1.726 -1.109 -1.770 41 H GLY 14 H GLY 14 -2.202 -2.796 -3.877 42 1HA GLY 14 1HA GLY 14 -2.124 -3.496 -6.108 43 2HA GLY 14 2HA GLY 14 -2.669 -1.918 -6.639 44 H GLU 15 H GLU 15 -0.520 -1.110 -4.273 45 HA GLU 15 HA GLU 15 1.750 -1.285 -6.095 46 1HB GLU 15 1HB GLU 15 0.383 1.063 -5.413 47 2HB GLU 15 2HB GLU 15 1.765 1.081 -4.336 48 1HG GLU 15 1HG GLU 15 2.805 2.037 -6.156 49 2HG GLU 15 2HG GLU 15 3.048 0.363 -6.618 50 HE2 GLU 15 HE GLU 15 0.523 2.769 -6.899 51 H THR 16 H THR 16 3.869 -0.560 -4.716 52 HA THR 16 HA THR 16 3.677 -1.938 -2.119 53 HB THR 16 HB THR 16 6.191 -2.052 -3.782 54 HG1 THR 16 1HG THR 16 4.605 -2.639 -5.333 55 1HG2 THR 16 1HG2 THR 16 6.351 -3.330 -1.769 56 2HG2 THR 16 2HG2 THR 16 4.655 -3.861 -1.873 57 3HG2 THR 16 3HG2 THR 16 5.871 -4.539 -2.982 58 H CYS 17 H CYS 17 5.864 -1.453 -0.840 59 HA CYS 17 HA CYS 17 6.751 1.247 -1.284 60 1HB CYS 17 1HB CYS 17 6.134 2.046 0.944 61 2HB CYS 17 2HB CYS 17 4.738 1.716 -0.062 62 H VAL 18 H VAL 18 8.532 -0.510 -1.686 63 HA VAL 18 HA VAL 18 9.554 -1.834 0.620 64 HB VAL 18 HB VAL 18 11.017 -1.311 -1.958 65 1HG1 VAL 18 1HG1 VAL 18 12.185 -2.435 -0.046 66 2HG1 VAL 18 2HG1 VAL 18 10.987 -3.747 -0.148 67 3HG1 VAL 18 3HG1 VAL 18 12.078 -3.429 -1.518 68 1HG2 VAL 18 1HG2 VAL 18 9.787 -3.739 -2.346 69 2HG2 VAL 18 2HG2 VAL 18 8.501 -2.787 -1.563 70 3HG2 VAL 18 3HG2 VAL 18 9.264 -2.194 -3.058 71 H GLY 19 H GLY 19 9.822 1.360 -0.789 72 1HA GLY 19 1HA GLY 19 12.273 1.923 0.730 73 2HA GLY 19 2HA GLY 19 11.567 2.909 -0.534 74 H GLY 20 H GLY 20 8.836 2.072 1.007 75 1HA GLY 20 1HA GLY 20 7.876 2.763 3.054 76 2HA GLY 20 2HA GLY 20 9.106 4.001 3.217 77 H THR 21 H THR 21 7.875 3.595 -0.023 78 HA THR 21 HA THR 21 5.925 5.751 0.386 79 HB THR 21 HB THR 21 8.224 6.614 -0.365 80 HG1 THR 21 1HG THR 21 5.976 7.491 -0.880 81 1HG2 THR 21 1HG2 THR 21 9.001 6.164 -2.566 82 2HG2 THR 21 2HG2 THR 21 8.507 4.550 -2.000 83 3HG2 THR 21 3HG2 THR 21 7.437 5.483 -3.074 84 H CYS 22 H CYS 22 4.080 4.606 0.064 85 HA CYS 22 HA CYS 22 3.852 2.468 -1.671 86 1HB CYS 22 1HB CYS 22 1.424 2.807 -1.480 87 2HB CYS 22 2HB CYS 22 2.249 2.811 0.067 88 H ASN 23 H ASN 23 3.430 6.017 -2.096 89 HA ASN 23 HA ASN 23 3.449 7.263 -3.878 90 1HB ASN 23 1HB ASN 23 4.972 5.119 -4.744 91 2HB ASN 23 2HB ASN 23 3.679 5.091 -5.928 92 1HD2 ASN 23 1HD2 ASN 23 5.830 7.377 -4.248 93 2HD2 ASN 23 2HD2 ASN 23 6.162 8.405 -5.601 94 H THR 24 H THR 24 1.175 5.161 -2.984 95 HA THR 24 HA THR 24 -0.533 5.522 -5.355 96 HB THR 24 HB THR 24 -1.193 3.635 -3.090 97 HG1 THR 24 1HG THR 24 0.718 2.597 -3.492 98 1HG2 THR 24 1HG2 THR 24 -1.615 3.861 -6.062 99 2HG2 THR 24 2HG2 THR 24 -1.394 2.220 -5.408 100 3HG2 THR 24 3HG2 THR 24 -2.720 3.245 -4.810 101 HA PRO 25 HA PRO 25 -3.000 8.232 -3.123 102 1HB PRO 25 1HB PRO 25 -5.362 8.032 -4.482 103 2HB PRO 25 2HB PRO 25 -4.013 8.997 -5.044 104 1HG PRO 25 1HG PRO 25 -4.961 6.380 -6.039 105 2HG PRO 25 2HG PRO 25 -3.914 7.541 -6.830 106 1HD PRO 25 1HD PRO 25 -3.116 5.094 -5.563 107 2HD PRO 25 2HD PRO 25 -2.060 6.311 -6.252 108 H GLY 26 H GLY 26 -4.282 8.432 -1.327 109 1HA GLY 26 1HA GLY 26 -5.245 7.556 0.522 110 2HA GLY 26 2HA GLY 26 -6.405 6.917 -0.625 111 H CYS 27 H CYS 27 -2.920 6.106 0.033 112 HA CYS 27 HA CYS 27 -3.789 3.324 0.285 113 1HB CYS 27 1HB CYS 27 -1.997 2.685 -0.867 114 2HB CYS 27 2HB CYS 27 -1.918 4.355 -1.394 115 H THR 28 H THR 28 -1.922 2.124 1.772 116 HA THR 28 HA THR 28 -1.229 3.805 4.045 117 HB THR 28 HB THR 28 -3.317 1.605 4.014 118 HG1 THR 28 1HG THR 28 -3.993 3.332 5.713 119 1HG2 THR 28 1HG2 THR 28 -1.970 0.688 5.756 120 2HG2 THR 28 2HG2 THR 28 -1.364 2.288 6.247 121 3HG2 THR 28 3HG2 THR 28 -3.038 1.814 6.629 122 H CYS 29 H CYS 29 0.851 3.361 2.870 123 HA CYS 29 HA CYS 29 1.995 1.028 2.379 124 1HB CYS 29 1HB CYS 29 3.176 3.085 2.072 125 2HB CYS 29 2HB CYS 29 3.208 3.402 3.796 126 H SER 30 H SER 30 1.975 -0.885 3.508 127 HA SER 30 HA SER 30 2.284 -0.661 6.401 128 1HB SER 30 1HB SER 30 0.019 -1.426 5.844 129 2HB SER 30 2HB SER 30 0.655 -2.675 4.791 130 HG SER 30 HG SER 30 0.038 -3.474 6.923 131 H TRP 31 H TRP 31 3.572 -1.734 3.414 132 HA TRP 31 HA TRP 31 5.321 -2.971 2.861 133 1HB TRP 31 1HB TRP 31 5.988 -1.860 5.335 134 2HB TRP 31 2HB TRP 31 6.421 -3.552 5.483 135 HD1 TRP 31 HD TRP 31 7.597 -0.349 3.850 136 HE1 TRP 31 1HE TRP 31 9.832 -0.682 2.487 137 HE3 TRP 31 3HE TRP 31 7.567 -5.431 4.028 138 HZ2 TRP 31 2HZ TRP 31 11.303 -2.981 1.655 139 HZ3 TRP 31 3HZ TRP 31 9.439 -6.643 2.916 140 HH2 TRP 31 HH TRP 31 11.264 -5.501 1.758 141 HA PRO 32 HA PRO 32 6.509 -4.342 2.321 142 1HB PRO 32 1HB PRO 32 6.427 -6.211 0.330 143 2HB PRO 32 2HB PRO 32 7.476 -6.345 1.727 144 1HG PRO 32 1HG PRO 32 4.977 -7.810 1.139 145 2HG PRO 32 2HG PRO 32 6.242 -8.212 2.283 146 1HD PRO 32 1HD PRO 32 3.679 -7.076 2.889 147 2HD PRO 32 2HD PRO 32 4.988 -7.371 4.017 148 H VAL 33 H VAL 33 3.246 -5.138 1.690 149 HA VAL 33 HA VAL 33 3.306 -3.274 -0.579 150 HB VAL 33 HB VAL 33 1.028 -5.122 0.022 151 1HG1 VAL 33 1HG1 VAL 33 0.720 -3.475 -1.734 152 2HG1 VAL 33 2HG1 VAL 33 2.225 -3.993 -2.531 153 3HG1 VAL 33 3HG1 VAL 33 0.833 -5.099 -2.455 154 1HG2 VAL 33 1HG2 VAL 33 2.440 -6.592 -1.777 155 2HG2 VAL 33 2HG2 VAL 33 3.762 -5.931 -0.785 156 3HG2 VAL 33 3HG2 VAL 33 2.461 -6.874 -0.020 157 H CYS 34 H CYS 34 1.698 -1.602 -0.681 158 HA CYS 34 HA CYS 34 1.009 -0.649 1.928 159 1HB CYS 34 1HB CYS 34 0.584 1.387 0.943 160 2HB CYS 34 2HB CYS 34 1.849 0.725 -0.073 161 H THR 35 H THR 35 -1.318 0.139 2.339 162 HA THR 35 HA THR 35 -3.238 -1.704 1.073 163 HB THR 35 HB THR 35 -4.325 -1.761 3.363 164 HG1 THR 35 1HG THR 35 -3.420 -0.380 4.851 165 1HG2 THR 35 1HG2 THR 35 -1.751 -2.949 2.654 166 2HG2 THR 35 2HG2 THR 35 -1.789 -2.568 4.393 167 3HG2 THR 35 3HG2 THR 35 -3.038 -3.621 3.684 168 H ARG 36 H ARG 36 -5.591 -0.750 2.078 169 HA ARG 36 HA ARG 36 -5.521 2.053 1.315 170 1HB ARG 36 1HB ARG 36 -7.321 -0.162 0.258 171 2HB ARG 36 2HB ARG 36 -7.866 1.504 0.230 172 1HG ARG 36 1HG ARG 36 -5.769 2.130 -1.038 173 2HG ARG 36 2HG ARG 36 -5.321 0.436 -1.079 174 1HD ARG 36 1HD ARG 36 -6.413 0.899 -3.181 175 2HD ARG 36 2HD ARG 36 -7.547 -0.046 -2.237 176 HE ARG 36 HE ARG 36 -7.998 2.741 -1.714 177 1HH1 ARG 36 2HH2 ARG 36 -8.427 0.345 -4.255 178 2HH1 ARG 36 1HH2 ARG 36 -9.777 1.159 -4.972 179 1HH2 ARG 36 2HH1 ARG 36 -9.779 3.816 -2.660 180 2HH2 ARG 36 1HH1 ARG 36 -10.551 3.147 -4.059 Start of MODEL 4 1 H ASN 8 H ASN 8 -5.814 2.165 3.636 2 HA ASN 8 HA ASN 8 -5.633 2.181 5.812 3 1HB ASN 8 1HB ASN 8 -7.889 2.314 7.048 4 2HB ASN 8 2HB ASN 8 -7.699 3.434 5.713 5 1HD2 ASN 8 1HD2 ASN 8 -9.756 3.674 5.101 6 2HD2 ASN 8 2HD2 ASN 8 -10.780 2.420 4.486 7 H GLY 9 H GLY 9 -5.334 -0.491 4.637 8 1HA GLY 9 1HA GLY 9 -4.885 -2.243 6.447 9 2HA GLY 9 2HA GLY 9 -6.628 -2.247 6.620 10 H LEU 10 H LEU 10 -7.732 -2.203 4.172 11 HA LEU 10 HA LEU 10 -7.397 -4.756 3.211 12 1HB LEU 10 1HB LEU 10 -8.848 -2.343 2.488 13 2HB LEU 10 2HB LEU 10 -8.371 -3.262 1.074 14 HG LEU 10 HG LEU 10 -9.928 -4.376 3.425 15 1HD1 LEU 10 1HD1 LEU 10 -11.882 -4.315 2.010 16 2HD1 LEU 10 2HD1 LEU 10 -11.186 -2.681 2.127 17 3HD1 LEU 10 3HD1 LEU 10 -10.930 -3.654 0.658 18 1HD2 LEU 10 1HD2 LEU 10 -8.753 -6.179 2.479 19 2HD2 LEU 10 2HD2 LEU 10 -10.377 -6.250 1.752 20 3HD2 LEU 10 3HD2 LEU 10 -9.011 -5.592 0.818 21 HA PRO 11 HA PRO 11 -3.580 -4.137 1.130 22 1HB PRO 11 1HB PRO 11 -2.960 -6.781 0.823 23 2HB PRO 11 2HB PRO 11 -2.539 -5.857 2.252 24 1HG PRO 11 1HG PRO 11 -4.674 -7.875 1.910 25 2HG PRO 11 2HG PRO 11 -3.966 -7.265 3.393 26 1HD PRO 11 1HD PRO 11 -6.517 -6.556 2.289 27 2HD PRO 11 2HD PRO 11 -5.760 -5.861 3.708 28 H VAL 12 H VAL 12 -5.180 -3.191 -0.485 29 HA VAL 12 HA VAL 12 -4.891 -4.871 -2.855 30 HB VAL 12 HB VAL 12 -7.197 -4.285 -3.531 31 1HG1 VAL 12 1HG1 VAL 12 -8.219 -5.734 -1.466 32 2HG1 VAL 12 2HG1 VAL 12 -7.308 -6.432 -2.827 33 3HG1 VAL 12 3HG1 VAL 12 -6.482 -6.082 -1.288 34 1HG2 VAL 12 1HG2 VAL 12 -7.550 -2.303 -2.158 35 2HG2 VAL 12 2HG2 VAL 12 -8.801 -3.520 -1.806 36 3HG2 VAL 12 3HG2 VAL 12 -7.447 -3.282 -0.674 37 H CYS 13 H CYS 13 -3.633 -2.384 -1.526 38 HA CYS 13 HA CYS 13 -4.402 -0.089 -2.789 39 1HB CYS 13 1HB CYS 13 -2.838 0.135 -1.087 40 2HB CYS 13 2HB CYS 13 -1.769 -1.082 -1.754 41 H GLY 14 H GLY 14 -2.231 -2.763 -3.891 42 1HA GLY 14 1HA GLY 14 -2.106 -3.463 -6.111 43 2HA GLY 14 2HA GLY 14 -2.655 -1.891 -6.658 44 H GLU 15 H GLU 15 -0.514 -1.120 -4.245 45 HA GLU 15 HA GLU 15 1.768 -1.266 -6.054 46 1HB GLU 15 1HB GLU 15 0.388 1.078 -5.399 47 2HB GLU 15 2HB GLU 15 1.750 1.102 -4.297 48 1HG GLU 15 1HG GLU 15 2.850 2.036 -6.082 49 2HG GLU 15 2HG GLU 15 3.053 0.367 -6.579 50 HE2 GLU 15 HE GLU 15 2.964 0.821 -8.680 51 H THR 16 H THR 16 3.881 -0.585 -4.682 52 HA THR 16 HA THR 16 3.662 -1.947 -2.077 53 HB THR 16 HB THR 16 6.184 -2.042 -3.741 54 HG1 THR 16 1HG THR 16 5.099 -3.922 -4.813 55 1HG2 THR 16 1HG2 THR 16 4.695 -3.828 -1.777 56 2HG2 THR 16 2HG2 THR 16 5.882 -4.530 -2.903 57 3HG2 THR 16 3HG2 THR 16 6.394 -3.296 -1.725 58 H CYS 17 H CYS 17 5.912 -1.469 -0.835 59 HA CYS 17 HA CYS 17 6.757 1.241 -1.242 60 1HB CYS 17 1HB CYS 17 6.105 2.082 0.924 61 2HB CYS 17 2HB CYS 17 4.695 1.620 -0.008 62 H VAL 18 H VAL 18 8.485 -0.629 -1.647 63 HA VAL 18 HA VAL 18 9.527 -1.911 0.656 64 HB VAL 18 HB VAL 18 10.992 -1.391 -1.923 65 1HG1 VAL 18 1HG1 VAL 18 12.154 -2.522 -0.011 66 2HG1 VAL 18 2HG1 VAL 18 10.953 -3.830 -0.118 67 3HG1 VAL 18 3HG1 VAL 18 12.045 -3.511 -1.487 68 1HG2 VAL 18 1HG2 VAL 18 9.738 -3.822 -2.290 69 2HG2 VAL 18 2HG2 VAL 18 8.462 -2.834 -1.539 70 3HG2 VAL 18 3HG2 VAL 18 9.253 -2.279 -3.034 71 H GLY 19 H GLY 19 9.764 1.295 -0.699 72 1HA GLY 19 1HA GLY 19 12.183 1.840 0.903 73 2HA GLY 19 2HA GLY 19 11.623 2.775 -0.470 74 H GLY 20 H GLY 20 8.796 1.967 1.060 75 1HA GLY 20 1HA GLY 20 7.630 2.855 2.854 76 2HA GLY 20 2HA GLY 20 8.927 3.994 3.160 77 H THR 21 H THR 21 7.869 3.554 -0.178 78 HA THR 21 HA THR 21 6.287 6.029 0.018 79 HB THR 21 HB THR 21 8.443 5.270 -2.023 80 HG1 THR 21 1HG THR 21 7.993 7.269 0.072 81 1HG2 THR 21 1HG2 THR 21 7.837 7.948 -2.372 82 2HG2 THR 21 2HG2 THR 21 7.217 6.646 -3.416 83 3HG2 THR 21 3HG2 THR 21 6.221 7.263 -2.076 84 H CYS 22 H CYS 22 4.421 4.619 0.171 85 HA CYS 22 HA CYS 22 3.729 2.600 -1.423 86 1HB CYS 22 1HB CYS 22 2.355 3.571 0.393 87 2HB CYS 22 2HB CYS 22 1.898 4.887 -0.670 88 H ASN 23 H ASN 23 3.444 6.137 -2.194 89 HA ASN 23 HA ASN 23 3.521 7.198 -4.093 90 1HB ASN 23 1HB ASN 23 5.126 5.150 -4.742 91 2HB ASN 23 2HB ASN 23 3.780 4.671 -5.756 92 1HD2 ASN 23 1HD2 ASN 23 3.826 5.377 -7.738 93 2HD2 ASN 23 2HD2 ASN 23 4.567 6.828 -8.326 94 H THR 24 H THR 24 1.207 5.234 -3.005 95 HA THR 24 HA THR 24 -0.508 5.481 -5.389 96 HB THR 24 HB THR 24 -1.100 3.611 -3.085 97 HG1 THR 24 1HG THR 24 0.800 3.288 -5.302 98 1HG2 THR 24 1HG2 THR 24 -1.569 3.754 -6.074 99 2HG2 THR 24 2HG2 THR 24 -1.468 2.153 -5.303 100 3HG2 THR 24 3HG2 THR 24 -2.710 3.316 -4.781 101 HA PRO 25 HA PRO 25 -2.950 8.215 -3.157 102 1HB PRO 25 1HB PRO 25 -5.308 8.034 -4.528 103 2HB PRO 25 2HB PRO 25 -3.949 8.993 -5.081 104 1HG PRO 25 1HG PRO 25 -4.909 6.386 -6.089 105 2HG PRO 25 2HG PRO 25 -3.851 7.543 -6.872 106 1HD PRO 25 1HD PRO 25 -3.073 5.087 -5.610 107 2HD PRO 25 2HD PRO 25 -2.006 6.300 -6.289 108 H GLY 26 H GLY 26 -4.272 8.428 -1.384 109 1HA GLY 26 1HA GLY 26 -5.263 7.564 0.453 110 2HA GLY 26 2HA GLY 26 -6.392 6.892 -0.707 111 H CYS 27 H CYS 27 -2.906 6.143 0.012 112 HA CYS 27 HA CYS 27 -3.746 3.357 0.325 113 1HB CYS 27 1HB CYS 27 -2.022 2.738 -0.915 114 2HB CYS 27 2HB CYS 27 -1.845 4.424 -1.359 115 H THR 28 H THR 28 -1.858 2.207 1.820 116 HA THR 28 HA THR 28 -1.125 3.951 4.030 117 HB THR 28 HB THR 28 -3.234 1.770 4.105 118 HG1 THR 28 1HG THR 28 -3.729 4.091 4.135 119 1HG2 THR 28 1HG2 THR 28 -1.065 2.179 6.082 120 2HG2 THR 28 2HG2 THR 28 -2.685 2.445 6.768 121 3HG2 THR 28 3HG2 THR 28 -2.286 0.888 6.004 122 H CYS 29 H CYS 29 0.943 3.462 2.877 123 HA CYS 29 HA CYS 29 2.074 1.129 2.405 124 1HB CYS 29 1HB CYS 29 3.271 3.188 2.135 125 2HB CYS 29 2HB CYS 29 3.301 3.473 3.864 126 H SER 30 H SER 30 1.983 -0.789 3.523 127 HA SER 30 HA SER 30 2.272 -0.590 6.421 128 1HB SER 30 1HB SER 30 0.037 -1.342 6.002 129 2HB SER 30 2HB SER 30 0.548 -2.428 4.725 130 HG SER 30 HG SER 30 1.642 -3.732 6.342 131 H TRP 31 H TRP 31 3.554 -1.693 3.430 132 HA TRP 31 HA TRP 31 5.292 -2.953 2.889 133 1HB TRP 31 1HB TRP 31 5.972 -1.822 5.349 134 2HB TRP 31 2HB TRP 31 6.386 -3.517 5.518 135 HD1 TRP 31 HD TRP 31 7.592 -0.350 3.831 136 HE1 TRP 31 1HE TRP 31 9.827 -0.727 2.480 137 HE3 TRP 31 3HE TRP 31 7.522 -5.427 4.107 138 HZ2 TRP 31 2HZ TRP 31 11.281 -3.053 1.694 139 HZ3 TRP 31 3HZ TRP 31 9.386 -6.675 3.022 140 HH2 TRP 31 HH TRP 31 11.222 -5.570 1.846 141 HA PRO 32 HA PRO 32 6.481 -4.342 2.378 142 1HB PRO 32 1HB PRO 32 6.398 -6.235 0.409 143 2HB PRO 32 2HB PRO 32 7.434 -6.361 1.816 144 1HG PRO 32 1HG PRO 32 4.926 -7.810 1.225 145 2HG PRO 32 2HG PRO 32 6.178 -8.210 2.384 146 1HD PRO 32 1HD PRO 32 3.620 -7.043 2.954 147 2HD PRO 32 2HD PRO 32 4.917 -7.337 4.096 148 H VAL 33 H VAL 33 3.212 -5.090 1.750 149 HA VAL 33 HA VAL 33 3.309 -3.230 -0.523 150 HB VAL 33 HB VAL 33 1.008 -5.065 -0.040 151 1HG1 VAL 33 1HG1 VAL 33 0.729 -3.575 -1.857 152 2HG1 VAL 33 2HG1 VAL 33 2.383 -3.857 -2.451 153 3HG1 VAL 33 3HG1 VAL 33 1.156 -5.140 -2.589 154 1HG2 VAL 33 1HG2 VAL 33 2.457 -6.644 -1.666 155 2HG2 VAL 33 2HG2 VAL 33 3.777 -5.939 -0.703 156 3HG2 VAL 33 3HG2 VAL 33 2.457 -6.817 0.105 157 H CYS 34 H CYS 34 1.735 -1.546 -0.619 158 HA CYS 34 HA CYS 34 0.961 -0.643 1.972 159 1HB CYS 34 1HB CYS 34 0.525 1.392 0.997 160 2HB CYS 34 2HB CYS 34 1.798 0.752 -0.023 161 H THR 35 H THR 35 -1.377 0.071 2.388 162 HA THR 35 HA THR 35 -3.275 -1.708 1.010 163 HB THR 35 HB THR 35 -4.337 -1.949 3.335 164 HG1 THR 35 1HG THR 35 -3.322 -0.716 4.868 165 1HG2 THR 35 1HG2 THR 35 -1.803 -3.015 4.117 166 2HG2 THR 35 2HG2 THR 35 -3.155 -3.904 3.377 167 3HG2 THR 35 3HG2 THR 35 -1.887 -3.195 2.349 168 H ARG 36 H ARG 36 -5.638 -0.928 2.002 169 HA ARG 36 HA ARG 36 -5.612 1.945 1.538 170 1HB ARG 36 1HB ARG 36 -6.887 -0.140 -0.008 171 2HB ARG 36 2HB ARG 36 -8.152 0.804 0.751 172 1HG ARG 36 1HG ARG 36 -5.967 2.459 -0.390 173 2HG ARG 36 2HG ARG 36 -6.816 1.500 -1.586 174 1HD ARG 36 1HD ARG 36 -8.637 2.812 0.353 175 2HD ARG 36 2HD ARG 36 -7.680 3.952 -0.569 176 HE ARG 36 HE ARG 36 -8.754 1.932 -2.327 177 1HH1 ARG 36 2HH2 ARG 36 -9.701 4.785 -0.497 178 2HH1 ARG 36 1HH2 ARG 36 -11.021 5.177 -1.548 179 1HH2 ARG 36 2HH1 ARG 36 -10.495 2.448 -3.713 180 2HH2 ARG 36 1HH1 ARG 36 -11.476 3.839 -3.390 Start of MODEL 5 1 H ASN 8 H ASN 8 -5.963 2.159 3.648 2 HA ASN 8 HA ASN 8 -5.734 2.253 5.842 3 1HB ASN 8 1HB ASN 8 -8.557 1.978 5.072 4 2HB ASN 8 2HB ASN 8 -8.319 1.435 6.721 5 1HD2 ASN 8 1HD2 ASN 8 -9.731 3.756 5.762 6 2HD2 ASN 8 2HD2 ASN 8 -8.999 5.160 6.465 7 H GLY 9 H GLY 9 -5.320 -0.555 4.587 8 1HA GLY 9 1HA GLY 9 -4.400 -2.113 6.423 9 2HA GLY 9 2HA GLY 9 -6.092 -2.271 6.849 10 H LEU 10 H LEU 10 -7.413 -2.316 4.396 11 HA LEU 10 HA LEU 10 -7.095 -4.942 3.607 12 1HB LEU 10 1HB LEU 10 -8.321 -2.637 2.086 13 2HB LEU 10 2HB LEU 10 -8.564 -4.337 1.735 14 HG LEU 10 HG LEU 10 -9.199 -3.712 4.513 15 1HD1 LEU 10 1HD1 LEU 10 -11.451 -2.592 3.466 16 2HD1 LEU 10 2HD1 LEU 10 -10.101 -1.682 4.188 17 3HD1 LEU 10 3HD1 LEU 10 -10.193 -1.887 2.422 18 1HD2 LEU 10 1HD2 LEU 10 -9.895 -5.781 3.581 19 2HD2 LEU 10 2HD2 LEU 10 -11.364 -4.806 3.822 20 3HD2 LEU 10 3HD2 LEU 10 -10.668 -4.979 2.192 21 HA PRO 11 HA PRO 11 -3.486 -4.451 1.178 22 1HB PRO 11 1HB PRO 11 -2.963 -7.112 0.835 23 2HB PRO 11 2HB PRO 11 -2.411 -6.198 2.225 24 1HG PRO 11 1HG PRO 11 -4.619 -8.157 2.053 25 2HG PRO 11 2HG PRO 11 -3.785 -7.564 3.476 26 1HD PRO 11 1HD PRO 11 -6.392 -6.787 2.565 27 2HD PRO 11 2HD PRO 11 -5.511 -6.111 3.921 28 H VAL 12 H VAL 12 -5.104 -3.443 -0.341 29 HA VAL 12 HA VAL 12 -5.041 -5.124 -2.718 30 HB VAL 12 HB VAL 12 -7.418 -4.373 -3.190 31 1HG1 VAL 12 1HG1 VAL 12 -7.363 -6.221 -0.817 32 2HG1 VAL 12 2HG1 VAL 12 -8.285 -6.347 -2.335 33 3HG1 VAL 12 3HG1 VAL 12 -6.537 -6.684 -2.325 34 1HG2 VAL 12 1HG2 VAL 12 -7.619 -2.643 -1.483 35 2HG2 VAL 12 2HG2 VAL 12 -8.840 -3.911 -1.222 36 3HG2 VAL 12 3HG2 VAL 12 -7.385 -3.852 -0.198 37 H CYS 13 H CYS 13 -3.612 -2.705 -1.537 38 HA CYS 13 HA CYS 13 -4.535 -0.414 -2.835 39 1HB CYS 13 1HB CYS 13 -3.051 -0.143 -1.027 40 2HB CYS 13 2HB CYS 13 -1.860 -1.228 -1.716 41 H GLY 14 H GLY 14 -2.144 -2.994 -3.702 42 1HA GLY 14 1HA GLY 14 -1.824 -3.794 -5.858 43 2HA GLY 14 2HA GLY 14 -2.525 -2.333 -6.527 44 H GLU 15 H GLU 15 -0.613 -1.098 -4.148 45 HA GLU 15 HA GLU 15 1.726 -1.075 -5.892 46 1HB GLU 15 1HB GLU 15 0.866 1.255 -4.135 47 2HB GLU 15 2HB GLU 15 2.076 1.260 -5.403 48 1HG GLU 15 1HG GLU 15 -0.815 0.556 -6.025 49 2HG GLU 15 2HG GLU 15 -0.304 2.230 -5.932 50 HE2 GLU 15 HE GLU 15 -0.027 2.837 -8.060 51 H THR 16 H THR 16 3.802 -1.091 -4.859 52 HA THR 16 HA THR 16 3.671 -2.063 -2.101 53 HB THR 16 HB THR 16 6.206 -2.093 -3.709 54 HG1 THR 16 1HG THR 16 5.075 -2.979 -5.392 55 1HG2 THR 16 1HG2 THR 16 6.379 -3.501 -1.826 56 2HG2 THR 16 2HG2 THR 16 4.651 -3.924 -1.865 57 3HG2 THR 16 3HG2 THR 16 5.771 -4.651 -3.042 58 H CYS 17 H CYS 17 5.806 -1.468 -0.814 59 HA CYS 17 HA CYS 17 6.623 1.243 -1.301 60 1HB CYS 17 1HB CYS 17 5.921 2.108 0.860 61 2HB CYS 17 2HB CYS 17 4.551 1.663 -0.137 62 H VAL 18 H VAL 18 8.449 -0.497 -1.611 63 HA VAL 18 HA VAL 18 9.446 -1.746 0.736 64 HB VAL 18 HB VAL 18 10.978 -1.184 -1.795 65 1HG1 VAL 18 1HG1 VAL 18 12.130 -3.222 -1.301 66 2HG1 VAL 18 2HG1 VAL 18 12.093 -2.261 0.197 67 3HG1 VAL 18 3HG1 VAL 18 10.979 -3.633 -0.007 68 1HG2 VAL 18 1HG2 VAL 18 9.867 -3.644 -2.236 69 2HG2 VAL 18 2HG2 VAL 18 8.519 -2.782 -1.456 70 3HG2 VAL 18 3HG2 VAL 18 9.266 -2.118 -2.928 71 H GLY 19 H GLY 19 9.650 1.452 -0.672 72 1HA GLY 19 1HA GLY 19 12.010 2.100 0.962 73 2HA GLY 19 2HA GLY 19 11.365 3.040 -0.369 74 H GLY 20 H GLY 20 8.590 2.096 1.104 75 1HA GLY 20 1HA GLY 20 7.436 2.838 2.992 76 2HA GLY 20 2HA GLY 20 8.663 4.055 3.284 77 H THR 21 H THR 21 7.591 3.627 -0.042 78 HA THR 21 HA THR 21 5.696 5.845 0.230 79 HB THR 21 HB THR 21 8.065 5.718 -1.712 80 HG1 THR 21 1HG THR 21 8.769 7.454 -0.310 81 1HG2 THR 21 1HG2 THR 21 5.870 7.801 -1.235 82 2HG2 THR 21 2HG2 THR 21 7.366 8.126 -2.142 83 3HG2 THR 21 3HG2 THR 21 6.196 6.933 -2.755 84 H CYS 22 H CYS 22 3.918 4.547 -0.129 85 HA CYS 22 HA CYS 22 3.701 2.461 -1.822 86 1HB CYS 22 1HB CYS 22 1.494 4.494 -1.595 87 2HB CYS 22 2HB CYS 22 1.368 2.757 -1.781 88 H ASN 23 H ASN 23 3.652 5.981 -2.547 89 HA ASN 23 HA ASN 23 4.248 6.971 -4.430 90 1HB ASN 23 1HB ASN 23 5.076 4.458 -5.121 91 2HB ASN 23 2HB ASN 23 3.741 4.620 -6.244 92 1HD2 ASN 23 1HD2 ASN 23 6.888 4.829 -6.137 93 2HD2 ASN 23 2HD2 ASN 23 7.239 6.135 -7.218 94 H THR 24 H THR 24 1.447 5.397 -3.532 95 HA THR 24 HA THR 24 -0.111 6.721 -5.648 96 HB THR 24 HB THR 24 0.037 4.191 -5.936 97 HG1 THR 24 1HG THR 24 -1.933 4.846 -6.723 98 1HG2 THR 24 1HG2 THR 24 -1.878 3.301 -4.126 99 2HG2 THR 24 2HG2 THR 24 -0.133 2.976 -3.985 100 3HG2 THR 24 3HG2 THR 24 -0.858 4.341 -3.102 101 HA PRO 25 HA PRO 25 -2.133 8.567 -2.340 102 1HB PRO 25 1HB PRO 25 -4.365 9.511 -3.604 103 2HB PRO 25 2HB PRO 25 -2.814 10.326 -3.661 104 1HG PRO 25 1HG PRO 25 -4.146 8.727 -5.760 105 2HG PRO 25 2HG PRO 25 -2.836 9.879 -5.923 106 1HD PRO 25 1HD PRO 25 -2.622 7.019 -5.969 107 2HD PRO 25 2HD PRO 25 -1.301 8.169 -6.016 108 H GLY 26 H GLY 26 -4.144 8.639 -0.999 109 1HA GLY 26 1HA GLY 26 -5.607 7.435 0.215 110 2HA GLY 26 2HA GLY 26 -6.237 6.899 -1.331 111 H CYS 27 H CYS 27 -3.047 6.281 0.297 112 HA CYS 27 HA CYS 27 -3.759 3.442 0.274 113 1HB CYS 27 1HB CYS 27 -2.051 2.898 -1.016 114 2HB CYS 27 2HB CYS 27 -1.847 4.602 -1.366 115 H THR 28 H THR 28 -1.953 2.268 1.783 116 HA THR 28 HA THR 28 -1.171 3.987 3.996 117 HB THR 28 HB THR 28 -3.326 1.849 4.069 118 HG1 THR 28 1HG THR 28 -3.884 4.116 4.098 119 1HG2 THR 28 1HG2 THR 28 -3.067 2.063 6.635 120 2HG2 THR 28 2HG2 THR 28 -1.867 1.028 5.823 121 3HG2 THR 28 3HG2 THR 28 -1.429 2.681 6.316 122 H CYS 29 H CYS 29 0.946 3.541 3.133 123 HA CYS 29 HA CYS 29 2.068 1.230 2.499 124 1HB CYS 29 1HB CYS 29 3.197 3.444 2.666 125 2HB CYS 29 2HB CYS 29 3.340 3.214 4.398 126 H SER 30 H SER 30 1.929 -0.789 3.413 127 HA SER 30 HA SER 30 1.923 -0.872 6.330 128 1HB SER 30 1HB SER 30 -0.252 -1.549 5.220 129 2HB SER 30 2HB SER 30 0.601 -2.865 4.438 130 HG SER 30 HG SER 30 1.269 -3.459 6.755 131 H TRP 31 H TRP 31 3.398 -1.820 3.322 132 HA TRP 31 HA TRP 31 5.179 -3.036 2.828 133 1HB TRP 31 1HB TRP 31 5.737 -1.940 5.339 134 2HB TRP 31 2HB TRP 31 6.192 -3.627 5.480 135 HD1 TRP 31 HD TRP 31 7.380 -0.384 3.943 136 HE1 TRP 31 1HE TRP 31 9.663 -0.663 2.651 137 HE3 TRP 31 3HE TRP 31 7.410 -5.468 4.026 138 HZ2 TRP 31 2HZ TRP 31 11.193 -2.927 1.828 139 HZ3 TRP 31 3HZ TRP 31 9.335 -6.635 2.956 140 HH2 TRP 31 HH TRP 31 11.183 -5.449 1.884 141 HA PRO 32 HA PRO 32 6.394 -4.389 2.316 142 1HB PRO 32 1HB PRO 32 6.395 -6.242 0.307 143 2HB PRO 32 2HB PRO 32 7.398 -6.377 1.737 144 1HG PRO 32 1HG PRO 32 4.935 -7.861 1.056 145 2HG PRO 32 2HG PRO 32 6.165 -8.261 2.237 146 1HD PRO 32 1HD PRO 32 3.572 -7.155 2.767 147 2HD PRO 32 2HD PRO 32 4.846 -7.447 3.935 148 H VAL 33 H VAL 33 3.141 -5.092 1.674 149 HA VAL 33 HA VAL 33 3.263 -3.244 -0.609 150 HB VAL 33 HB VAL 33 0.993 -5.132 -0.103 151 1HG1 VAL 33 1HG1 VAL 33 1.549 -4.996 -2.820 152 2HG1 VAL 33 2HG1 VAL 33 0.305 -4.067 -1.951 153 3HG1 VAL 33 3HG1 VAL 33 1.910 -3.354 -2.236 154 1HG2 VAL 33 1HG2 VAL 33 2.550 -6.808 -0.088 155 2HG2 VAL 33 2HG2 VAL 33 2.373 -6.604 -1.848 156 3HG2 VAL 33 3HG2 VAL 33 3.749 -5.859 -0.999 157 H CYS 34 H CYS 34 1.642 -1.584 -0.733 158 HA CYS 34 HA CYS 34 0.901 -0.642 1.854 159 1HB CYS 34 1HB CYS 34 0.218 1.345 0.775 160 2HB CYS 34 2HB CYS 34 1.705 0.822 0.010 161 H THR 35 H THR 35 -1.458 0.106 2.236 162 HA THR 35 HA THR 35 -3.362 -1.705 0.921 163 HB THR 35 HB THR 35 -4.290 -2.279 3.121 164 HG1 THR 35 1HG THR 35 -2.108 -0.581 4.097 165 1HG2 THR 35 1HG2 THR 35 -2.413 -3.743 2.712 166 2HG2 THR 35 2HG2 THR 35 -1.241 -2.434 2.998 167 3HG2 THR 35 3HG2 THR 35 -2.166 -3.116 4.359 168 H ARG 36 H ARG 36 -5.708 -0.978 1.943 169 HA ARG 36 HA ARG 36 -5.715 1.904 1.523 170 1HB ARG 36 1HB ARG 36 -7.970 1.605 0.459 171 2HB ARG 36 2HB ARG 36 -6.711 0.755 -0.415 172 1HG ARG 36 1HG ARG 36 -7.395 -1.376 0.415 173 2HG ARG 36 2HG ARG 36 -8.300 -0.674 1.742 174 1HD ARG 36 1HD ARG 36 -9.201 0.164 -0.984 175 2HD ARG 36 2HD ARG 36 -9.438 -1.532 -0.613 176 HE ARG 36 HE ARG 36 -10.328 -0.019 1.636 177 1HH1 ARG 36 2HH2 ARG 36 -11.225 -0.593 -1.718 178 2HH1 ARG 36 1HH2 ARG 36 -12.910 -0.291 -1.453 179 1HH2 ARG 36 2HH1 ARG 36 -12.550 0.378 1.987 180 2HH2 ARG 36 1HH1 ARG 36 -13.669 0.266 0.669 Start of MODEL 6 1 H ASN 8 H ASN 8 -6.130 2.072 3.394 2 HA ASN 8 HA ASN 8 -6.116 2.267 5.612 3 1HB ASN 8 1HB ASN 8 -8.975 1.260 5.158 4 2HB ASN 8 2HB ASN 8 -8.455 2.286 6.479 5 1HD2 ASN 8 1HD2 ASN 8 -10.483 2.870 4.597 6 2HD2 ASN 8 2HD2 ASN 8 -10.032 4.278 3.696 7 H GLY 9 H GLY 9 -5.446 -0.568 4.632 8 1HA GLY 9 1HA GLY 9 -4.747 -2.042 6.565 9 2HA GLY 9 2HA GLY 9 -6.460 -2.138 6.919 10 H LEU 10 H LEU 10 -7.384 -2.111 4.116 11 HA LEU 10 HA LEU 10 -7.063 -4.897 3.608 12 1HB LEU 10 1HB LEU 10 -8.676 -2.646 2.536 13 2HB LEU 10 2HB LEU 10 -8.406 -4.009 1.468 14 HG LEU 10 HG LEU 10 -9.647 -4.154 4.230 15 1HD1 LEU 10 1HD1 LEU 10 -11.751 -4.474 3.169 16 2HD1 LEU 10 2HD1 LEU 10 -11.015 -3.022 2.447 17 3HD1 LEU 10 3HD1 LEU 10 -11.002 -4.564 1.556 18 1HD2 LEU 10 1HD2 LEU 10 -8.620 -6.216 2.398 19 2HD2 LEU 10 2HD2 LEU 10 -8.951 -6.282 4.146 20 3HD2 LEU 10 3HD2 LEU 10 -10.278 -6.498 2.980 21 HA PRO 11 HA PRO 11 -3.541 -4.284 1.096 22 1HB PRO 11 1HB PRO 11 -2.922 -6.921 0.740 23 2HB PRO 11 2HB PRO 11 -2.386 -5.989 2.124 24 1HG PRO 11 1HG PRO 11 -4.520 -8.030 1.978 25 2HG PRO 11 2HG PRO 11 -3.690 -7.408 3.391 26 1HD PRO 11 1HD PRO 11 -6.336 -6.729 2.517 27 2HD PRO 11 2HD PRO 11 -5.463 -6.023 3.862 28 H VAL 12 H VAL 12 -5.314 -3.368 -0.361 29 HA VAL 12 HA VAL 12 -5.290 -5.111 -2.717 30 HB VAL 12 HB VAL 12 -7.598 -4.280 -3.201 31 1HG1 VAL 12 1HG1 VAL 12 -6.904 -6.136 -0.954 32 2HG1 VAL 12 2HG1 VAL 12 -8.617 -5.741 -1.231 33 3HG1 VAL 12 3HG1 VAL 12 -7.652 -6.478 -2.533 34 1HG2 VAL 12 1HG2 VAL 12 -8.486 -2.661 -1.955 35 2HG2 VAL 12 2HG2 VAL 12 -8.499 -3.765 -0.559 36 3HG2 VAL 12 3HG2 VAL 12 -7.095 -2.710 -0.846 37 H CYS 13 H CYS 13 -3.798 -2.627 -1.527 38 HA CYS 13 HA CYS 13 -4.539 -0.430 -3.077 39 1HB CYS 13 1HB CYS 13 -3.216 -0.029 -1.177 40 2HB CYS 13 2HB CYS 13 -2.008 -1.208 -1.647 41 H GLY 14 H GLY 14 -2.094 -3.076 -3.503 42 1HA GLY 14 1HA GLY 14 -1.512 -4.060 -5.502 43 2HA GLY 14 2HA GLY 14 -2.288 -2.764 -6.393 44 H GLU 15 H GLU 15 -0.481 -1.331 -3.910 45 HA GLU 15 HA GLU 15 1.828 -1.112 -5.681 46 1HB GLU 15 1HB GLU 15 0.755 1.103 -3.885 47 2HB GLU 15 2HB GLU 15 2.048 1.237 -5.060 48 1HG GLU 15 1HG GLU 15 -0.867 0.593 -5.711 49 2HG GLU 15 2HG GLU 15 -0.100 2.151 -5.940 50 HE2 GLU 15 HE GLU 15 -1.200 0.485 -7.919 51 H THR 16 H THR 16 3.915 -0.973 -4.660 52 HA THR 16 HA THR 16 3.859 -1.880 -1.862 53 HB THR 16 HB THR 16 6.399 -2.232 -3.246 54 HG1 THR 16 1HG THR 16 3.907 -3.248 -4.423 55 1HG2 THR 16 1HG2 THR 16 5.223 -4.734 -3.118 56 2HG2 THR 16 2HG2 THR 16 6.114 -3.988 -1.770 57 3HG2 THR 16 3HG2 THR 16 4.339 -3.870 -1.836 58 H CYS 17 H CYS 17 5.737 -1.183 -0.497 59 HA CYS 17 HA CYS 17 6.656 1.475 -1.282 60 1HB CYS 17 1HB CYS 17 6.334 2.033 1.248 61 2HB CYS 17 2HB CYS 17 5.018 2.222 0.107 62 H VAL 18 H VAL 18 8.266 -0.638 -1.722 63 HA VAL 18 HA VAL 18 9.660 -1.579 0.541 64 HB VAL 18 HB VAL 18 10.819 -1.428 -2.222 65 1HG1 VAL 18 1HG1 VAL 18 10.768 -3.771 -0.312 66 2HG1 VAL 18 2HG1 VAL 18 11.877 -3.459 -1.667 67 3HG1 VAL 18 3HG1 VAL 18 11.983 -2.478 -0.187 68 1HG2 VAL 18 1HG2 VAL 18 8.288 -2.756 -1.420 69 2HG2 VAL 18 2HG2 VAL 18 8.840 -2.198 -3.017 70 3HG2 VAL 18 3HG2 VAL 18 9.427 -3.745 -2.362 71 H GLY 19 H GLY 19 9.682 1.420 -1.239 72 1HA GLY 19 1HA GLY 19 12.364 2.120 -0.286 73 2HA GLY 19 2HA GLY 19 11.381 3.005 -1.435 74 H GLY 20 H GLY 20 9.197 2.109 0.907 75 1HA GLY 20 1HA GLY 20 8.628 2.994 2.979 76 2HA GLY 20 2HA GLY 20 9.861 4.230 2.812 77 H THR 21 H THR 21 7.760 3.514 0.051 78 HA THR 21 HA THR 21 5.805 5.503 0.717 79 HB THR 21 HB THR 21 7.788 6.912 0.080 80 HG1 THR 21 1HG THR 21 6.154 8.077 -0.849 81 1HG2 THR 21 1HG2 THR 21 9.053 6.456 -1.768 82 2HG2 THR 21 2HG2 THR 21 8.165 4.923 -1.930 83 3HG2 THR 21 3HG2 THR 21 7.597 6.376 -2.787 84 H CYS 22 H CYS 22 3.972 4.601 0.045 85 HA CYS 22 HA CYS 22 3.867 2.442 -1.647 86 1HB CYS 22 1HB CYS 22 1.424 3.041 -1.875 87 2HB CYS 22 2HB CYS 22 2.032 2.791 -0.251 88 H ASN 23 H ASN 23 3.796 5.972 -2.264 89 HA ASN 23 HA ASN 23 4.357 7.034 -4.111 90 1HB ASN 23 1HB ASN 23 5.243 4.564 -4.873 91 2HB ASN 23 2HB ASN 23 3.910 4.727 -5.998 92 1HD2 ASN 23 1HD2 ASN 23 4.630 5.323 -7.888 93 2HD2 ASN 23 2HD2 ASN 23 5.796 6.558 -8.229 94 H THR 24 H THR 24 1.583 5.378 -3.282 95 HA THR 24 HA THR 24 0.012 6.724 -5.375 96 HB THR 24 HB THR 24 0.216 4.194 -5.695 97 HG1 THR 24 1HG THR 24 -1.766 4.751 -6.508 98 1HG2 THR 24 1HG2 THR 24 -0.276 4.119 -2.910 99 2HG2 THR 24 2HG2 THR 24 -1.830 3.661 -3.649 100 3HG2 THR 24 3HG2 THR 24 -0.358 2.735 -4.027 101 HA PRO 25 HA PRO 25 -2.055 8.472 -2.040 102 1HB PRO 25 1HB PRO 25 -4.291 9.411 -3.300 103 2HB PRO 25 2HB PRO 25 -2.752 10.249 -3.328 104 1HG PRO 25 1HG PRO 25 -4.047 8.677 -5.471 105 2HG PRO 25 2HG PRO 25 -2.751 9.850 -5.599 106 1HD PRO 25 1HD PRO 25 -2.496 6.996 -5.706 107 2HD PRO 25 2HD PRO 25 -1.192 8.166 -5.718 108 H GLY 26 H GLY 26 -4.364 8.629 -0.979 109 1HA GLY 26 1HA GLY 26 -5.739 7.338 0.279 110 2HA GLY 26 2HA GLY 26 -6.316 6.820 -1.294 111 H CYS 27 H CYS 27 -3.032 6.180 0.035 112 HA CYS 27 HA CYS 27 -3.777 3.346 0.126 113 1HB CYS 27 1HB CYS 27 -1.981 2.746 -1.054 114 2HB CYS 27 2HB CYS 27 -2.030 4.397 -1.640 115 H THR 28 H THR 28 -2.495 2.082 1.781 116 HA THR 28 HA THR 28 -1.537 3.816 3.960 117 HB THR 28 HB THR 28 -3.626 1.632 3.907 118 HG1 THR 28 1HG THR 28 -4.428 3.694 4.316 119 1HG2 THR 28 1HG2 THR 28 -3.267 1.761 6.539 120 2HG2 THR 28 2HG2 THR 28 -2.318 0.593 5.588 121 3HG2 THR 28 3HG2 THR 28 -1.584 2.134 6.096 122 H CYS 29 H CYS 29 0.538 3.390 2.742 123 HA CYS 29 HA CYS 29 1.689 1.031 2.299 124 1HB CYS 29 1HB CYS 29 2.876 3.005 1.800 125 2HB CYS 29 2HB CYS 29 2.861 3.547 3.467 126 H SER 30 H SER 30 1.773 -0.816 3.529 127 HA SER 30 HA SER 30 2.241 -0.430 6.382 128 1HB SER 30 1HB SER 30 0.832 -2.435 6.808 129 2HB SER 30 2HB SER 30 -0.080 -1.142 6.055 130 HG SER 30 HG SER 30 1.108 -2.887 4.208 131 H TRP 31 H TRP 31 3.379 -1.593 3.419 132 HA TRP 31 HA TRP 31 5.056 -2.908 2.821 133 1HB TRP 31 1HB TRP 31 5.816 -1.849 5.308 134 2HB TRP 31 2HB TRP 31 6.221 -3.553 5.386 135 HD1 TRP 31 HD TRP 31 7.327 -0.324 3.700 136 HE1 TRP 31 1HE TRP 31 9.535 -0.653 2.292 137 HE3 TRP 31 3HE TRP 31 7.384 -5.400 3.993 138 HZ2 TRP 31 2HZ TRP 31 11.023 -2.948 1.477 139 HZ3 TRP 31 3HZ TRP 31 9.249 -6.608 2.863 140 HH2 TRP 31 HH TRP 31 11.027 -5.464 1.637 141 HA PRO 32 HA PRO 32 6.243 -4.339 2.327 142 1HB PRO 32 1HB PRO 32 6.123 -6.231 0.359 143 2HB PRO 32 2HB PRO 32 7.145 -6.384 1.774 144 1HG PRO 32 1HG PRO 32 4.603 -7.766 1.167 145 2HG PRO 32 2HG PRO 32 5.836 -8.198 2.334 146 1HD PRO 32 1HD PRO 32 3.307 -6.963 2.886 147 2HD PRO 32 2HD PRO 32 4.587 -7.290 4.037 148 H VAL 33 H VAL 33 2.959 -4.992 1.684 149 HA VAL 33 HA VAL 33 3.115 -3.062 -0.529 150 HB VAL 33 HB VAL 33 0.877 -5.025 -0.259 151 1HG1 VAL 33 1HG1 VAL 33 0.940 -4.866 -2.745 152 2HG1 VAL 33 2HG1 VAL 33 0.680 -3.297 -1.944 153 3HG1 VAL 33 3HG1 VAL 33 2.282 -3.704 -2.605 154 1HG2 VAL 33 1HG2 VAL 33 2.462 -6.677 -0.169 155 2HG2 VAL 33 2HG2 VAL 33 2.403 -6.431 -1.930 156 3HG2 VAL 33 3HG2 VAL 33 3.705 -5.688 -0.971 157 H CYS 34 H CYS 34 1.558 -1.386 -0.570 158 HA CYS 34 HA CYS 34 0.654 -0.620 1.992 159 1HB CYS 34 1HB CYS 34 -0.208 1.342 0.916 160 2HB CYS 34 2HB CYS 34 1.392 0.987 0.297 161 H THR 35 H THR 35 -1.753 0.009 2.348 162 HA THR 35 HA THR 35 -3.538 -1.870 0.965 163 HB THR 35 HB THR 35 -4.559 -2.233 3.314 164 HG1 THR 35 1HG THR 35 -3.514 -0.518 4.431 165 1HG2 THR 35 1HG2 THR 35 -2.124 -3.384 2.176 166 2HG2 THR 35 2HG2 THR 35 -1.994 -3.310 3.950 167 3HG2 THR 35 3HG2 THR 35 -3.355 -4.172 3.192 168 H ARG 36 H ARG 36 -5.937 -1.308 1.769 169 HA ARG 36 HA ARG 36 -6.091 1.570 1.380 170 1HB ARG 36 1HB ARG 36 -7.087 0.063 -0.411 171 2HB ARG 36 2HB ARG 36 -8.216 -0.550 0.781 172 1HG ARG 36 1HG ARG 36 -9.466 1.403 0.820 173 2HG ARG 36 2HG ARG 36 -8.074 2.432 0.546 174 1HD ARG 36 1HD ARG 36 -9.351 2.568 -1.477 175 2HD ARG 36 2HD ARG 36 -8.010 1.509 -1.862 176 HE ARG 36 HE ARG 36 -10.110 -0.143 -0.905 177 1HH1 ARG 36 2HH2 ARG 36 -9.482 1.994 -3.630 178 2HH1 ARG 36 1HH2 ARG 36 -10.532 1.136 -4.708 179 1HH2 ARG 36 2HH1 ARG 36 -11.496 -1.273 -2.328 180 2HH2 ARG 36 1HH1 ARG 36 -11.686 -0.734 -3.963 Start of MODEL 7 1 H ASN 8 H ASN 8 -6.553 2.184 3.272 2 HA ASN 8 HA ASN 8 -7.240 2.399 5.364 3 1HB ASN 8 1HB ASN 8 -9.302 2.336 3.679 4 2HB ASN 8 2HB ASN 8 -9.712 0.848 4.506 5 1HD2 ASN 8 1HD2 ASN 8 -11.306 1.234 5.839 6 2HD2 ASN 8 2HD2 ASN 8 -11.430 2.534 6.977 7 H GLY 9 H GLY 9 -5.865 -0.286 4.746 8 1HA GLY 9 1HA GLY 9 -5.273 -1.776 6.510 9 2HA GLY 9 2HA GLY 9 -6.936 -1.768 7.062 10 H LEU 10 H LEU 10 -6.224 -1.866 3.585 11 HA LEU 10 HA LEU 10 -6.847 -4.733 3.595 12 1HB LEU 10 1HB LEU 10 -8.144 -2.504 2.073 13 2HB LEU 10 2HB LEU 10 -8.034 -4.097 1.350 14 HG LEU 10 HG LEU 10 -9.253 -3.641 4.078 15 1HD1 LEU 10 1HD1 LEU 10 -10.307 -2.370 2.025 16 2HD1 LEU 10 2HD1 LEU 10 -10.966 -3.980 1.648 17 3HD1 LEU 10 3HD1 LEU 10 -11.332 -3.214 3.212 18 1HD2 LEU 10 1HD2 LEU 10 -8.800 -5.906 3.889 19 2HD2 LEU 10 2HD2 LEU 10 -10.481 -5.796 3.312 20 3HD2 LEU 10 3HD2 LEU 10 -9.146 -5.938 2.143 21 HA PRO 11 HA PRO 11 -3.159 -4.667 1.272 22 1HB PRO 11 1HB PRO 11 -2.844 -7.372 1.039 23 2HB PRO 11 2HB PRO 11 -2.295 -6.459 2.432 24 1HG PRO 11 1HG PRO 11 -4.648 -8.234 2.188 25 2HG PRO 11 2HG PRO 11 -3.849 -7.664 3.639 26 1HD PRO 11 1HD PRO 11 -6.324 -6.705 2.554 27 2HD PRO 11 2HD PRO 11 -5.466 -6.058 3.939 28 H VAL 12 H VAL 12 -4.946 -3.675 -0.260 29 HA VAL 12 HA VAL 12 -4.624 -5.268 -2.671 30 HB VAL 12 HB VAL 12 -7.000 -4.943 -3.256 31 1HG1 VAL 12 1HG1 VAL 12 -7.834 -6.801 -2.012 32 2HG1 VAL 12 2HG1 VAL 12 -6.082 -7.052 -2.200 33 3HG1 VAL 12 3HG1 VAL 12 -6.736 -6.470 -0.650 34 1HG2 VAL 12 1HG2 VAL 12 -8.038 -3.309 -2.088 35 2HG2 VAL 12 2HG2 VAL 12 -8.387 -4.621 -0.934 36 3HG2 VAL 12 3HG2 VAL 12 -7.007 -3.531 -0.654 37 H CYS 13 H CYS 13 -3.595 -2.704 -1.308 38 HA CYS 13 HA CYS 13 -4.656 -0.461 -2.427 39 1HB CYS 13 1HB CYS 13 -3.026 -0.068 -0.855 40 2HB CYS 13 2HB CYS 13 -1.914 -1.239 -1.536 41 H GLY 14 H GLY 14 -2.244 -2.803 -3.776 42 1HA GLY 14 1HA GLY 14 -2.307 -3.407 -6.062 43 2HA GLY 14 2HA GLY 14 -2.914 -1.814 -6.468 44 H GLU 15 H GLU 15 -0.670 -1.170 -4.109 45 HA GLU 15 HA GLU 15 1.540 -1.182 -6.005 46 1HB GLU 15 1HB GLU 15 0.127 1.116 -5.265 47 2HB GLU 15 2HB GLU 15 1.519 1.152 -4.202 48 1HG GLU 15 1HG GLU 15 2.449 2.207 -6.045 49 2HG GLU 15 2HG GLU 15 2.846 0.549 -6.454 50 HE2 GLU 15 HE GLU 15 1.894 3.086 -7.888 51 H THR 16 H THR 16 3.690 -0.543 -4.719 52 HA THR 16 HA THR 16 3.570 -1.878 -2.095 53 HB THR 16 HB THR 16 6.021 -2.065 -3.840 54 HG1 THR 16 1HG THR 16 3.484 -3.523 -4.096 55 1HG2 THR 16 1HG2 THR 16 5.667 -4.540 -3.018 56 2HG2 THR 16 2HG2 THR 16 6.206 -3.335 -1.823 57 3HG2 THR 16 3HG2 THR 16 4.497 -3.830 -1.880 58 H CYS 17 H CYS 17 5.798 -1.417 -0.894 59 HA CYS 17 HA CYS 17 6.731 1.253 -1.413 60 1HB CYS 17 1HB CYS 17 6.232 2.040 0.887 61 2HB CYS 17 2HB CYS 17 4.827 1.866 -0.145 62 H VAL 18 H VAL 18 8.496 -0.480 -1.842 63 HA VAL 18 HA VAL 18 9.551 -1.822 0.446 64 HB VAL 18 HB VAL 18 10.951 -1.346 -2.177 65 1HG1 VAL 18 1HG1 VAL 18 11.988 -3.474 -1.748 66 2HG1 VAL 18 2HG1 VAL 18 12.147 -2.476 -0.284 67 3HG1 VAL 18 3HG1 VAL 18 10.926 -3.769 -0.351 68 1HG2 VAL 18 1HG2 VAL 18 9.287 -2.324 -3.296 69 2HG2 VAL 18 2HG2 VAL 18 9.576 -3.801 -2.345 70 3HG2 VAL 18 3HG2 VAL 18 8.377 -2.607 -1.793 71 H GLY 19 H GLY 19 9.837 1.352 -1.012 72 1HA GLY 19 1HA GLY 19 12.356 1.894 0.386 73 2HA GLY 19 2HA GLY 19 11.566 2.904 -0.808 74 H GLY 20 H GLY 20 8.931 2.078 0.866 75 1HA GLY 20 1HA GLY 20 8.148 2.714 3.024 76 2HA GLY 20 2HA GLY 20 9.360 3.978 3.081 77 H THR 21 H THR 21 7.901 3.565 -0.053 78 HA THR 21 HA THR 21 5.861 5.586 0.516 79 HB THR 21 HB THR 21 7.907 6.820 -0.170 80 HG1 THR 21 1HG THR 21 6.721 7.897 -1.805 81 1HG2 THR 21 1HG2 THR 21 8.008 6.078 -2.947 82 2HG2 THR 21 2HG2 THR 21 9.315 5.954 -1.745 83 3HG2 THR 21 3HG2 THR 21 8.207 4.584 -2.000 84 H CYS 22 H CYS 22 3.985 4.711 -0.076 85 HA CYS 22 HA CYS 22 3.800 2.481 -1.706 86 1HB CYS 22 1HB CYS 22 1.343 3.206 -1.877 87 2HB CYS 22 2HB CYS 22 1.998 2.785 -0.307 88 H ASN 23 H ASN 23 3.768 6.004 -2.354 89 HA ASN 23 HA ASN 23 4.216 7.063 -4.222 90 1HB ASN 23 1HB ASN 23 5.061 4.524 -4.979 91 2HB ASN 23 2HB ASN 23 3.797 4.823 -6.155 92 1HD2 ASN 23 1HD2 ASN 23 4.553 5.573 -7.968 93 2HD2 ASN 23 2HD2 ASN 23 5.836 6.716 -8.188 94 H THR 24 H THR 24 1.505 5.337 -3.328 95 HA THR 24 HA THR 24 -0.134 6.578 -5.438 96 HB THR 24 HB THR 24 0.060 4.068 -5.675 97 HG1 THR 24 1HG THR 24 -2.480 5.034 -4.574 98 1HG2 THR 24 1HG2 THR 24 -0.171 4.065 -2.858 99 2HG2 THR 24 2HG2 THR 24 -1.771 3.537 -3.432 100 3HG2 THR 24 3HG2 THR 24 -0.311 2.643 -3.920 101 HA PRO 25 HA PRO 25 -2.168 8.481 -2.169 102 1HB PRO 25 1HB PRO 25 -4.462 9.281 -3.423 103 2HB PRO 25 2HB PRO 25 -2.947 10.152 -3.549 104 1HG PRO 25 1HG PRO 25 -4.256 8.413 -5.549 105 2HG PRO 25 2HG PRO 25 -2.996 9.607 -5.789 106 1HD PRO 25 1HD PRO 25 -2.669 6.758 -5.719 107 2HD PRO 25 2HD PRO 25 -1.397 7.957 -5.844 108 H GLY 26 H GLY 26 -4.431 8.644 -1.035 109 1HA GLY 26 1HA GLY 26 -5.692 7.372 0.369 110 2HA GLY 26 2HA GLY 26 -6.375 6.830 -1.152 111 H CYS 27 H CYS 27 -3.085 6.219 0.246 112 HA CYS 27 HA CYS 27 -3.795 3.375 0.265 113 1HB CYS 27 1HB CYS 27 -2.002 2.807 -0.925 114 2HB CYS 27 2HB CYS 27 -2.010 4.476 -1.456 115 H THR 28 H THR 28 -2.010 2.184 1.755 116 HA THR 28 HA THR 28 -1.232 3.887 3.992 117 HB THR 28 HB THR 28 -3.334 1.701 4.011 118 HG1 THR 28 1HG THR 28 -4.286 3.642 4.500 119 1HG2 THR 28 1HG2 THR 28 -1.340 2.383 6.210 120 2HG2 THR 28 2HG2 THR 28 -3.005 1.899 6.615 121 3HG2 THR 28 3HG2 THR 28 -1.945 0.780 5.724 122 H CYS 29 H CYS 29 0.833 3.440 2.816 123 HA CYS 29 HA CYS 29 1.942 1.067 2.328 124 1HB CYS 29 1HB CYS 29 3.131 3.083 1.892 125 2HB CYS 29 2HB CYS 29 3.191 3.505 3.592 126 H SER 30 H SER 30 2.085 -0.804 3.514 127 HA SER 30 HA SER 30 2.460 -0.474 6.388 128 1HB SER 30 1HB SER 30 1.060 -2.445 6.774 129 2HB SER 30 2HB SER 30 0.154 -1.249 5.867 130 HG SER 30 HG SER 30 1.405 -2.791 4.045 131 H TRP 31 H TRP 31 3.652 -1.614 3.403 132 HA TRP 31 HA TRP 31 5.373 -2.876 2.823 133 1HB TRP 31 1HB TRP 31 6.119 -1.723 5.250 134 2HB TRP 31 2HB TRP 31 6.534 -3.417 5.430 135 HD1 TRP 31 HD TRP 31 7.736 -0.271 3.729 136 HE1 TRP 31 1HE TRP 31 9.922 -0.667 2.305 137 HE3 TRP 31 3HE TRP 31 7.584 -5.348 3.940 138 HZ2 TRP 31 2HZ TRP 31 11.311 -3.007 1.446 139 HZ3 TRP 31 3HZ TRP 31 9.393 -6.614 2.782 140 HH2 TRP 31 HH TRP 31 11.212 -5.524 1.567 141 HA PRO 32 HA PRO 32 6.520 -4.261 2.256 142 1HB PRO 32 1HB PRO 32 6.348 -6.156 0.294 143 2HB PRO 32 2HB PRO 32 7.447 -6.281 1.653 144 1HG PRO 32 1HG PRO 32 4.915 -7.731 1.179 145 2HG PRO 32 2HG PRO 32 6.218 -8.130 2.280 146 1HD PRO 32 1HD PRO 32 3.689 -6.964 2.965 147 2HD PRO 32 2HD PRO 32 5.037 -7.255 4.046 148 H VAL 33 H VAL 33 3.236 -5.083 1.713 149 HA VAL 33 HA VAL 33 3.224 -3.192 -0.534 150 HB VAL 33 HB VAL 33 1.023 -5.135 0.072 151 1HG1 VAL 33 1HG1 VAL 33 0.627 -3.399 -1.610 152 2HG1 VAL 33 2HG1 VAL 33 2.080 -3.914 -2.501 153 3HG1 VAL 33 3HG1 VAL 33 0.685 -5.010 -2.364 154 1HG2 VAL 33 1HG2 VAL 33 2.287 -6.597 -1.715 155 2HG2 VAL 33 2HG2 VAL 33 3.724 -5.764 -1.079 156 3HG2 VAL 33 3HG2 VAL 33 2.698 -6.725 0.012 157 H CYS 34 H CYS 34 1.606 -1.540 -0.574 158 HA CYS 34 HA CYS 34 0.943 -0.627 2.042 159 1HB CYS 34 1HB CYS 34 0.323 1.375 1.048 160 2HB CYS 34 2HB CYS 34 1.645 0.795 0.055 161 H THR 35 H THR 35 -1.441 0.164 2.429 162 HA THR 35 HA THR 35 -3.311 -1.816 1.309 163 HB THR 35 HB THR 35 -4.328 -1.575 3.749 164 HG1 THR 35 1HG THR 35 -2.344 -1.182 5.173 165 1HG2 THR 35 1HG2 THR 35 -3.286 -3.705 3.011 166 2HG2 THR 35 2HG2 THR 35 -1.665 -3.009 3.253 167 3HG2 THR 35 3HG2 THR 35 -2.727 -3.299 4.652 168 H ARG 36 H ARG 36 -5.682 -1.086 1.842 169 HA ARG 36 HA ARG 36 -5.774 1.792 1.430 170 1HB ARG 36 1HB ARG 36 -7.599 1.471 -0.219 171 2HB ARG 36 2HB ARG 36 -6.155 0.623 -0.738 172 1HG ARG 36 1HG ARG 36 -7.049 -1.504 -0.228 173 2HG ARG 36 2HG ARG 36 -8.192 -0.862 0.935 174 1HD ARG 36 1HD ARG 36 -8.483 0.028 -1.931 175 2HD ARG 36 2HD ARG 36 -8.951 -1.616 -1.544 176 HE ARG 36 HE ARG 36 -10.043 0.337 0.338 177 1HH1 ARG 36 2HH2 ARG 36 -10.541 -1.236 -2.770 178 2HH1 ARG 36 1HH2 ARG 36 -12.252 -0.977 -2.773 179 1HH2 ARG 36 2HH1 ARG 36 -12.303 0.679 0.336 180 2HH2 ARG 36 1HH1 ARG 36 -13.262 0.120 -0.993 Start of MODEL 8 1 H ASN 8 H ASN 8 -5.229 1.000 3.641 2 HA ASN 8 HA ASN 8 -5.383 1.585 5.797 3 1HB ASN 8 1HB ASN 8 -6.477 3.873 4.900 4 2HB ASN 8 2HB ASN 8 -7.971 3.121 5.422 5 1HD2 ASN 8 1HD2 ASN 8 -6.607 5.465 6.450 6 2HD2 ASN 8 2HD2 ASN 8 -6.287 5.193 8.130 7 H GLY 9 H GLY 9 -6.629 -0.568 4.141 8 1HA GLY 9 1HA GLY 9 -8.689 -1.419 6.054 9 2HA GLY 9 2HA GLY 9 -9.082 -1.393 4.347 10 H LEU 10 H LEU 10 -8.012 -2.853 2.865 11 HA LEU 10 HA LEU 10 -6.612 -5.029 4.259 12 1HB LEU 10 1HB LEU 10 -8.095 -5.459 1.704 13 2HB LEU 10 2HB LEU 10 -7.699 -6.597 2.977 14 HG LEU 10 HG LEU 10 -9.442 -4.613 4.082 15 1HD1 LEU 10 1HD1 LEU 10 -10.959 -5.947 1.910 16 2HD1 LEU 10 2HD1 LEU 10 -11.184 -4.352 2.667 17 3HD1 LEU 10 3HD1 LEU 10 -9.921 -4.581 1.435 18 1HD2 LEU 10 1HD2 LEU 10 -10.334 -7.393 3.412 19 2HD2 LEU 10 2HD2 LEU 10 -9.001 -7.154 4.568 20 3HD2 LEU 10 3HD2 LEU 10 -10.595 -6.430 4.886 21 HA PRO 11 HA PRO 11 -3.336 -4.449 1.513 22 1HB PRO 11 1HB PRO 11 -2.351 -6.971 1.145 23 2HB PRO 11 2HB PRO 11 -2.028 -6.016 2.578 24 1HG PRO 11 1HG PRO 11 -3.857 -8.316 2.257 25 2HG PRO 11 2HG PRO 11 -3.204 -7.629 3.732 26 1HD PRO 11 1HD PRO 11 -5.860 -7.281 2.705 27 2HD PRO 11 2HD PRO 11 -5.171 -6.503 4.117 28 H VAL 12 H VAL 12 -5.054 -3.699 -0.058 29 HA VAL 12 HA VAL 12 -4.641 -5.332 -2.447 30 HB VAL 12 HB VAL 12 -6.990 -5.036 -3.070 31 1HG1 VAL 12 1HG1 VAL 12 -6.144 -7.074 -1.837 32 2HG1 VAL 12 2HG1 VAL 12 -6.812 -6.362 -0.349 33 3HG1 VAL 12 3HG1 VAL 12 -7.893 -6.774 -1.702 34 1HG2 VAL 12 1HG2 VAL 12 -8.651 -4.310 -1.399 35 2HG2 VAL 12 2HG2 VAL 12 -7.334 -3.915 -0.268 36 3HG2 VAL 12 3HG2 VAL 12 -7.498 -3.013 -1.794 37 H CYS 13 H CYS 13 -3.579 -2.749 -1.156 38 HA CYS 13 HA CYS 13 -4.595 -0.524 -2.358 39 1HB CYS 13 1HB CYS 13 -2.950 -0.249 -0.707 40 2HB CYS 13 2HB CYS 13 -1.800 -1.277 -1.540 41 H GLY 14 H GLY 14 -2.357 -3.051 -3.620 42 1HA GLY 14 1HA GLY 14 -2.277 -3.699 -5.851 43 2HA GLY 14 2HA GLY 14 -2.961 -2.162 -6.343 44 H GLU 15 H GLU 15 -0.757 -1.255 -4.045 45 HA GLU 15 HA GLU 15 1.419 -1.207 -5.987 46 1HB GLU 15 1HB GLU 15 -0.065 1.015 -4.969 47 2HB GLU 15 2HB GLU 15 1.520 1.093 -4.224 48 1HG GLU 15 1HG GLU 15 1.862 2.263 -6.240 49 2HG GLU 15 2HG GLU 15 2.450 0.661 -6.640 50 HE2 GLU 15 HE GLU 15 0.186 0.083 -9.037 51 H THR 16 H THR 16 3.566 -0.424 -4.718 52 HA THR 16 HA THR 16 3.607 -1.884 -2.159 53 HB THR 16 HB THR 16 6.035 -1.779 -3.938 54 HG1 THR 16 1HG THR 16 3.534 -3.265 -4.293 55 1HG2 THR 16 1HG2 THR 16 5.903 -4.311 -3.258 56 2HG2 THR 16 2HG2 THR 16 6.334 -3.139 -1.989 57 3HG2 THR 16 3HG2 THR 16 4.676 -3.779 -2.084 58 H CYS 17 H CYS 17 5.830 -1.298 -0.986 59 HA CYS 17 HA CYS 17 6.552 1.447 -1.385 60 1HB CYS 17 1HB CYS 17 5.997 2.092 0.967 61 2HB CYS 17 2HB CYS 17 4.631 1.929 -0.117 62 H VAL 18 H VAL 18 8.469 -0.060 -1.847 63 HA VAL 18 HA VAL 18 9.587 -1.428 0.409 64 HB VAL 18 HB VAL 18 10.981 -0.786 -2.178 65 1HG1 VAL 18 1HG1 VAL 18 12.207 -1.916 -0.304 66 2HG1 VAL 18 2HG1 VAL 18 11.061 -3.272 -0.439 67 3HG1 VAL 18 3HG1 VAL 18 12.128 -2.868 -1.806 68 1HG2 VAL 18 1HG2 VAL 18 8.501 -2.293 -1.833 69 2HG2 VAL 18 2HG2 VAL 18 9.311 -1.748 -3.320 70 3HG2 VAL 18 3HG2 VAL 18 9.800 -3.276 -2.549 71 H GLY 19 H GLY 19 9.680 1.792 -0.989 72 1HA GLY 19 1HA GLY 19 12.159 2.480 0.394 73 2HA GLY 19 2HA GLY 19 11.235 3.483 -0.708 74 H GLY 20 H GLY 20 8.768 2.315 1.035 75 1HA GLY 20 1HA GLY 20 7.916 2.780 3.165 76 2HA GLY 20 2HA GLY 20 9.139 4.011 3.402 77 H THR 21 H THR 21 7.589 3.908 0.248 78 HA THR 21 HA THR 21 5.530 5.803 0.999 79 HB THR 21 HB THR 21 7.687 7.136 0.727 80 HG1 THR 21 1HG THR 21 6.501 8.625 -0.637 81 1HG2 THR 21 1HG2 THR 21 8.143 5.500 -1.487 82 2HG2 THR 21 2HG2 THR 21 7.458 6.965 -2.231 83 3HG2 THR 21 3HG2 THR 21 8.918 7.080 -1.218 84 H CYS 22 H CYS 22 3.839 4.704 0.183 85 HA CYS 22 HA CYS 22 3.956 2.980 -1.952 86 1HB CYS 22 1HB CYS 22 1.436 3.475 -2.103 87 2HB CYS 22 2HB CYS 22 2.080 2.746 -0.646 88 H ASN 23 H ASN 23 3.394 3.231 -4.215 89 HA ASN 23 HA ASN 23 4.169 5.769 -5.224 90 1HB ASN 23 1HB ASN 23 3.703 3.023 -6.276 91 2HB ASN 23 2HB ASN 23 3.250 4.283 -7.407 92 1HD2 ASN 23 1HD2 ASN 23 5.834 2.949 -5.446 93 2HD2 ASN 23 2HD2 ASN 23 7.171 3.632 -6.309 94 H THR 24 H THR 24 1.322 4.610 -3.934 95 HA THR 24 HA THR 24 -0.312 6.291 -5.714 96 HB THR 24 HB THR 24 -0.645 3.777 -6.045 97 HG1 THR 24 1HG THR 24 -2.519 4.893 -6.523 98 1HG2 THR 24 1HG2 THR 24 -2.323 2.991 -4.087 99 2HG2 THR 24 2HG2 THR 24 -0.576 2.668 -3.978 100 3HG2 THR 24 3HG2 THR 24 -1.282 4.049 -3.104 101 HA PRO 25 HA PRO 25 -1.379 8.306 -2.073 102 1HB PRO 25 1HB PRO 25 -3.570 9.700 -2.925 103 2HB PRO 25 2HB PRO 25 -1.925 10.224 -3.225 104 1HG PRO 25 1HG PRO 25 -3.852 9.000 -5.104 105 2HG PRO 25 2HG PRO 25 -2.394 9.903 -5.460 106 1HD PRO 25 1HD PRO 25 -2.726 7.058 -5.600 107 2HD PRO 25 2HD PRO 25 -1.239 7.952 -5.844 108 H GLY 26 H GLY 26 -3.501 8.934 -0.717 109 1HA GLY 26 1HA GLY 26 -4.856 7.895 0.785 110 2HA GLY 26 2HA GLY 26 -5.750 7.503 -0.670 111 H CYS 27 H CYS 27 -2.558 6.310 0.595 112 HA CYS 27 HA CYS 27 -3.740 3.628 0.575 113 1HB CYS 27 1HB CYS 27 -2.102 2.782 -0.672 114 2HB CYS 27 2HB CYS 27 -1.851 4.437 -1.188 115 H THR 28 H THR 28 -2.316 2.107 2.052 116 HA THR 28 HA THR 28 -1.301 3.653 4.341 117 HB THR 28 HB THR 28 -3.450 1.534 4.170 118 HG1 THR 28 1HG THR 28 -4.064 3.059 6.018 119 1HG2 THR 28 1HG2 THR 28 -2.472 0.324 5.868 120 2HG2 THR 28 2HG2 THR 28 -1.230 1.567 6.143 121 3HG2 THR 28 3HG2 THR 28 -2.839 1.737 6.886 122 H CYS 29 H CYS 29 0.750 3.273 3.088 123 HA CYS 29 HA CYS 29 1.844 0.949 2.420 124 1HB CYS 29 1HB CYS 29 3.036 3.010 2.183 125 2HB CYS 29 2HB CYS 29 3.132 3.234 3.918 126 H SER 30 H SER 30 2.037 -1.019 3.431 127 HA SER 30 HA SER 30 2.290 -0.944 6.337 128 1HB SER 30 1HB SER 30 0.120 -1.938 5.051 129 2HB SER 30 2HB SER 30 1.131 -3.370 5.002 130 HG SER 30 HG SER 30 0.055 -3.551 6.934 131 H TRP 31 H TRP 31 3.626 -1.823 3.288 132 HA TRP 31 HA TRP 31 5.443 -2.933 2.685 133 1HB TRP 31 1HB TRP 31 6.071 -1.834 5.171 134 2HB TRP 31 2HB TRP 31 6.608 -3.498 5.283 135 HD1 TRP 31 HD TRP 31 7.602 -0.198 3.752 136 HE1 TRP 31 1HE TRP 31 9.826 -0.370 2.341 137 HE3 TRP 31 3HE TRP 31 7.804 -5.279 3.709 138 HZ2 TRP 31 2HZ TRP 31 11.384 -2.562 1.387 139 HZ3 TRP 31 3HZ TRP 31 9.710 -6.356 2.515 140 HH2 TRP 31 HH TRP 31 11.461 -5.082 1.381 141 HA PRO 32 HA PRO 32 6.685 -4.205 2.071 142 1HB PRO 32 1HB PRO 32 6.663 -6.022 0.029 143 2HB PRO 32 2HB PRO 32 7.759 -6.126 1.393 144 1HG PRO 32 1HG PRO 32 5.341 -7.731 0.830 145 2HG PRO 32 2HG PRO 32 6.661 -8.083 1.927 146 1HD PRO 32 1HD PRO 32 4.049 -7.130 2.634 147 2HD PRO 32 2HD PRO 32 5.406 -7.371 3.717 148 H VAL 33 H VAL 33 3.461 -5.189 1.505 149 HA VAL 33 HA VAL 33 3.340 -3.311 -0.745 150 HB VAL 33 HB VAL 33 1.183 -5.255 0.007 151 1HG1 VAL 33 1HG1 VAL 33 2.101 -4.062 -2.632 152 2HG1 VAL 33 2HG1 VAL 33 0.743 -5.195 -2.424 153 3HG1 VAL 33 3HG1 VAL 33 0.672 -3.575 -1.689 154 1HG2 VAL 33 1HG2 VAL 33 2.453 -6.673 -1.887 155 2HG2 VAL 33 2HG2 VAL 33 3.864 -5.891 -1.132 156 3HG2 VAL 33 3HG2 VAL 33 2.767 -6.889 -0.147 157 H CYS 34 H CYS 34 1.660 -1.699 -0.782 158 HA CYS 34 HA CYS 34 1.056 -0.774 1.869 159 1HB CYS 34 1HB CYS 34 0.517 1.269 0.908 160 2HB CYS 34 2HB CYS 34 1.850 0.673 -0.061 161 H THR 35 H THR 35 -1.339 0.167 2.118 162 HA THR 35 HA THR 35 -3.254 -1.688 0.892 163 HB THR 35 HB THR 35 -4.186 -2.217 3.064 164 HG1 THR 35 1HG THR 35 -2.213 -0.243 3.981 165 1HG2 THR 35 1HG2 THR 35 -2.085 -3.488 2.736 166 2HG2 THR 35 2HG2 THR 35 -1.135 -2.102 3.322 167 3HG2 THR 35 3HG2 THR 35 -2.209 -2.981 4.437 168 H ARG 36 H ARG 36 -5.587 -0.831 1.967 169 HA ARG 36 HA ARG 36 -5.532 2.002 1.296 170 1HB ARG 36 1HB ARG 36 -6.726 0.108 -0.245 171 2HB ARG 36 2HB ARG 36 -8.044 0.388 0.876 172 1HG ARG 36 1HG ARG 36 -8.414 2.553 0.131 173 2HG ARG 36 2HG ARG 36 -6.721 2.846 -0.212 174 1HD ARG 36 1HD ARG 36 -7.479 2.676 -2.396 175 2HD ARG 36 2HD ARG 36 -7.151 0.979 -2.112 176 HE ARG 36 HE ARG 36 -9.848 1.750 -1.294 177 1HH1 ARG 36 2HH2 ARG 36 -7.861 0.747 -4.019 178 2HH1 ARG 36 1HH2 ARG 36 -9.198 0.122 -4.927 179 1HH2 ARG 36 2HH1 ARG 36 -11.612 0.925 -2.490 180 2HH2 ARG 36 1HH1 ARG 36 -11.344 0.224 -4.052 Start of MODEL 9 1 H ASN 8 H ASN 8 -5.665 1.908 3.530 2 HA ASN 8 HA ASN 8 -5.504 2.125 5.685 3 1HB ASN 8 1HB ASN 8 -8.405 2.012 5.116 4 2HB ASN 8 2HB ASN 8 -8.049 1.553 6.769 5 1HD2 ASN 8 1HD2 ASN 8 -7.266 3.989 4.306 6 2HD2 ASN 8 2HD2 ASN 8 -7.139 5.350 5.369 7 H GLY 9 H GLY 9 -5.502 -0.726 4.365 8 1HA GLY 9 1HA GLY 9 -4.590 -2.333 6.240 9 2HA GLY 9 2HA GLY 9 -6.300 -2.409 6.618 10 H LEU 10 H LEU 10 -7.607 -2.406 4.202 11 HA LEU 10 HA LEU 10 -7.374 -5.006 3.347 12 1HB LEU 10 1HB LEU 10 -8.905 -2.672 2.720 13 2HB LEU 10 2HB LEU 10 -8.411 -3.435 1.221 14 HG LEU 10 HG LEU 10 -9.618 -5.121 3.393 15 1HD1 LEU 10 1HD1 LEU 10 -11.392 -3.723 3.432 16 2HD1 LEU 10 2HD1 LEU 10 -11.001 -2.998 1.854 17 3HD1 LEU 10 3HD1 LEU 10 -11.812 -4.581 1.930 18 1HD2 LEU 10 1HD2 LEU 10 -8.572 -5.997 1.215 19 2HD2 LEU 10 2HD2 LEU 10 -10.187 -6.593 1.670 20 3HD2 LEU 10 3HD2 LEU 10 -10.021 -5.342 0.415 21 HA PRO 11 HA PRO 11 -3.693 -4.599 1.002 22 1HB PRO 11 1HB PRO 11 -3.207 -7.272 0.709 23 2HB PRO 11 2HB PRO 11 -2.662 -6.346 2.092 24 1HG PRO 11 1HG PRO 11 -4.897 -8.272 1.914 25 2HG PRO 11 2HG PRO 11 -4.078 -7.671 3.343 26 1HD PRO 11 1HD PRO 11 -6.656 -6.866 2.377 27 2HD PRO 11 2HD PRO 11 -5.786 -6.183 3.736 28 H VAL 12 H VAL 12 -5.431 -3.636 -0.500 29 HA VAL 12 HA VAL 12 -5.329 -5.357 -2.864 30 HB VAL 12 HB VAL 12 -7.645 -4.691 -3.404 31 1HG1 VAL 12 1HG1 VAL 12 -7.698 -6.056 -0.717 32 2HG1 VAL 12 2HG1 VAL 12 -8.651 -6.403 -2.180 33 3HG1 VAL 12 3HG1 VAL 12 -6.925 -6.833 -2.119 34 1HG2 VAL 12 1HG2 VAL 12 -9.090 -3.850 -1.532 35 2HG2 VAL 12 2HG2 VAL 12 -7.607 -3.536 -0.598 36 3HG2 VAL 12 3HG2 VAL 12 -7.898 -2.670 -2.126 37 H CYS 13 H CYS 13 -3.867 -2.918 -1.681 38 HA CYS 13 HA CYS 13 -4.679 -0.671 -3.132 39 1HB CYS 13 1HB CYS 13 -2.783 -1.245 -1.188 40 2HB CYS 13 2HB CYS 13 -1.815 -0.802 -2.581 41 H GLY 14 H GLY 14 -2.205 -3.264 -3.698 42 1HA GLY 14 1HA GLY 14 -1.705 -4.184 -5.761 43 2HA GLY 14 2HA GLY 14 -2.451 -2.821 -6.574 44 H GLU 15 H GLU 15 -0.716 -1.337 -4.184 45 HA GLU 15 HA GLU 15 1.661 -1.225 -5.873 46 1HB GLU 15 1HB GLU 15 0.619 1.039 -4.126 47 2HB GLU 15 2HB GLU 15 1.892 1.127 -5.327 48 1HG GLU 15 1HG GLU 15 0.077 1.988 -6.532 49 2HG GLU 15 2HG GLU 15 0.027 0.303 -7.009 50 HE2 GLU 15 HE GLU 15 -3.330 0.681 -6.066 51 H THR 16 H THR 16 3.713 -1.243 -4.841 52 HA THR 16 HA THR 16 3.594 -2.108 -2.042 53 HB THR 16 HB THR 16 6.098 -2.277 -3.694 54 HG1 THR 16 1HG THR 16 4.699 -3.007 -5.299 55 1HG2 THR 16 1HG2 THR 16 4.546 -3.988 -1.728 56 2HG2 THR 16 2HG2 THR 16 5.674 -4.772 -2.859 57 3HG2 THR 16 3HG2 THR 16 6.272 -3.552 -1.708 58 H CYS 17 H CYS 17 5.722 -1.489 -0.787 59 HA CYS 17 HA CYS 17 6.593 1.179 -1.431 60 1HB CYS 17 1HB CYS 17 5.989 2.070 0.806 61 2HB CYS 17 2HB CYS 17 4.628 1.791 -0.262 62 H VAL 18 H VAL 18 8.468 -0.425 -1.707 63 HA VAL 18 HA VAL 18 9.479 -1.631 0.687 64 HB VAL 18 HB VAL 18 10.964 -1.249 -1.901 65 1HG1 VAL 18 1HG1 VAL 18 10.912 -3.608 0.004 66 2HG1 VAL 18 2HG1 VAL 18 12.057 -3.296 -1.322 67 3HG1 VAL 18 3HG1 VAL 18 12.073 -2.265 0.128 68 1HG2 VAL 18 1HG2 VAL 18 8.435 -2.673 -1.492 69 2HG2 VAL 18 2HG2 VAL 18 9.272 -2.230 -2.999 70 3HG2 VAL 18 3HG2 VAL 18 9.728 -3.716 -2.130 71 H GLY 19 H GLY 19 9.684 1.468 -0.932 72 1HA GLY 19 1HA GLY 19 12.138 2.186 0.501 73 2HA GLY 19 2HA GLY 19 11.342 3.099 -0.765 74 H GLY 20 H GLY 20 8.721 2.200 0.937 75 1HA GLY 20 1HA GLY 20 7.754 2.936 2.935 76 2HA GLY 20 2HA GLY 20 9.006 4.149 3.113 77 H THR 21 H THR 21 7.649 3.732 -0.105 78 HA THR 21 HA THR 21 5.690 5.846 0.317 79 HB THR 21 HB THR 21 7.979 6.892 -0.189 80 HG1 THR 21 1HG THR 21 5.915 7.031 -2.270 81 1HG2 THR 21 1HG2 THR 21 8.364 4.941 -2.028 82 2HG2 THR 21 2HG2 THR 21 7.498 6.104 -3.061 83 3HG2 THR 21 3HG2 THR 21 9.017 6.580 -2.264 84 H CYS 22 H CYS 22 4.026 4.417 -0.132 85 HA CYS 22 HA CYS 22 3.963 2.473 -1.993 86 1HB CYS 22 1HB CYS 22 1.500 2.907 -2.147 87 2HB CYS 22 2HB CYS 22 2.140 2.693 -0.529 88 H ASN 23 H ASN 23 3.867 6.006 -2.431 89 HA ASN 23 HA ASN 23 4.320 7.179 -4.230 90 1HB ASN 23 1HB ASN 23 5.289 4.815 -5.135 91 2HB ASN 23 2HB ASN 23 3.892 4.914 -6.188 92 1HD2 ASN 23 1HD2 ASN 23 6.768 6.628 -5.075 93 2HD2 ASN 23 2HD2 ASN 23 7.037 7.582 -6.495 94 H THR 24 H THR 24 1.601 5.407 -3.442 95 HA THR 24 HA THR 24 -0.029 6.708 -5.525 96 HB THR 24 HB THR 24 0.021 4.231 -5.760 97 HG1 THR 24 1HG THR 24 -2.216 4.306 -5.933 98 1HG2 THR 24 1HG2 THR 24 0.160 2.960 -3.859 99 2HG2 THR 24 2HG2 THR 24 -0.234 4.358 -2.830 100 3HG2 THR 24 3HG2 THR 24 -1.540 3.390 -3.557 101 HA PRO 25 HA PRO 25 -1.999 8.764 -2.312 102 1HB PRO 25 1HB PRO 25 -4.327 9.503 -3.536 103 2HB PRO 25 2HB PRO 25 -2.816 10.363 -3.753 104 1HG PRO 25 1HG PRO 25 -4.185 8.524 -5.618 105 2HG PRO 25 2HG PRO 25 -2.933 9.702 -5.959 106 1HD PRO 25 1HD PRO 25 -2.606 6.860 -5.749 107 2HD PRO 25 2HD PRO 25 -1.337 8.048 -5.975 108 H GLY 26 H GLY 26 -4.117 8.959 -1.021 109 1HA GLY 26 1HA GLY 26 -5.322 7.745 0.477 110 2HA GLY 26 2HA GLY 26 -6.123 7.205 -0.985 111 H CYS 27 H CYS 27 -2.776 6.516 0.236 112 HA CYS 27 HA CYS 27 -3.539 3.686 0.237 113 1HB CYS 27 1HB CYS 27 -1.860 3.224 -1.117 114 2HB CYS 27 2HB CYS 27 -1.580 4.943 -1.313 115 H THR 28 H THR 28 -2.201 2.370 1.853 116 HA THR 28 HA THR 28 -1.288 4.029 4.100 117 HB THR 28 HB THR 28 -3.397 1.840 4.018 118 HG1 THR 28 1HG THR 28 -2.920 4.402 5.373 119 1HG2 THR 28 1HG2 THR 28 -2.837 2.611 6.721 120 2HG2 THR 28 2HG2 THR 28 -2.698 0.983 6.015 121 3HG2 THR 28 3HG2 THR 28 -1.293 2.076 6.016 122 H CYS 29 H CYS 29 0.788 3.540 2.906 123 HA CYS 29 HA CYS 29 1.880 1.190 2.403 124 1HB CYS 29 1HB CYS 29 3.059 3.309 2.195 125 2HB CYS 29 2HB CYS 29 3.201 3.438 3.936 126 H SER 30 H SER 30 1.767 -0.736 3.507 127 HA SER 30 HA SER 30 2.012 -0.559 6.409 128 1HB SER 30 1HB SER 30 0.485 -2.342 6.660 129 2HB SER 30 2HB SER 30 -0.219 -1.385 5.373 130 HG SER 30 HG SER 30 0.255 -3.944 5.240 131 H TRP 31 H TRP 31 3.371 -1.647 3.431 132 HA TRP 31 HA TRP 31 5.148 -2.865 2.927 133 1HB TRP 31 1HB TRP 31 5.768 -1.689 5.384 134 2HB TRP 31 2HB TRP 31 6.229 -3.368 5.572 135 HD1 TRP 31 HD TRP 31 7.355 -0.183 3.863 136 HE1 TRP 31 1HE TRP 31 9.614 -0.505 2.538 137 HE3 TRP 31 3HE TRP 31 7.439 -5.255 4.198 138 HZ2 TRP 31 2HZ TRP 31 11.149 -2.794 1.796 139 HZ3 TRP 31 3HZ TRP 31 9.353 -6.457 3.146 140 HH2 TRP 31 HH TRP 31 11.166 -5.309 1.976 141 HA PRO 32 HA PRO 32 6.380 -4.228 2.448 142 1HB PRO 32 1HB PRO 32 6.371 -6.148 0.503 143 2HB PRO 32 2HB PRO 32 7.394 -6.228 1.924 144 1HG PRO 32 1HG PRO 32 4.932 -7.753 1.323 145 2HG PRO 32 2HG PRO 32 6.181 -8.104 2.502 146 1HD PRO 32 1HD PRO 32 3.587 -6.999 3.028 147 2HD PRO 32 2HD PRO 32 4.878 -7.242 4.188 148 H VAL 33 H VAL 33 3.131 -5.019 1.839 149 HA VAL 33 HA VAL 33 3.208 -3.238 -0.498 150 HB VAL 33 HB VAL 33 0.936 -5.091 0.097 151 1HG1 VAL 33 1HG1 VAL 33 2.212 -4.115 -2.482 152 2HG1 VAL 33 2HG1 VAL 33 0.752 -5.124 -2.353 153 3HG1 VAL 33 3HG1 VAL 33 0.740 -3.458 -1.728 154 1HG2 VAL 33 1HG2 VAL 33 3.692 -5.902 -0.728 155 2HG2 VAL 33 2HG2 VAL 33 2.473 -6.781 0.226 156 3HG2 VAL 33 3HG2 VAL 33 2.315 -6.680 -1.544 157 H CYS 34 H CYS 34 1.564 -1.602 -0.669 158 HA CYS 34 HA CYS 34 0.971 -0.413 1.802 159 1HB CYS 34 1HB CYS 34 0.679 1.373 0.538 160 2HB CYS 34 2HB CYS 34 1.041 0.380 -0.860 161 H THR 35 H THR 35 -1.478 0.327 2.211 162 HA THR 35 HA THR 35 -3.306 -1.877 1.588 163 HB THR 35 HB THR 35 -3.974 -1.847 4.047 164 HG1 THR 35 1HG THR 35 -1.471 -0.307 4.076 165 1HG2 THR 35 1HG2 THR 35 -1.949 -3.004 4.924 166 2HG2 THR 35 2HG2 THR 35 -2.319 -3.573 3.278 167 3HG2 THR 35 3HG2 THR 35 -1.002 -2.405 3.542 168 H ARG 36 H ARG 36 -5.606 -1.311 2.053 169 HA ARG 36 HA ARG 36 -5.918 1.515 1.460 170 1HB ARG 36 1HB ARG 36 -6.800 -0.301 -0.152 171 2HB ARG 36 2HB ARG 36 -7.985 -0.703 1.075 172 1HG ARG 36 1HG ARG 36 -9.306 1.007 0.391 173 2HG ARG 36 2HG ARG 36 -8.033 2.157 0.748 174 1HD ARG 36 1HD ARG 36 -7.441 2.374 -1.457 175 2HD ARG 36 2HD ARG 36 -7.538 0.650 -1.752 176 HE ARG 36 HE ARG 36 -10.197 1.635 -1.395 177 1HH1 ARG 36 2HH2 ARG 36 -7.542 1.853 -3.694 178 2HH1 ARG 36 1HH2 ARG 36 -8.575 2.137 -5.055 179 1HH2 ARG 36 2HH1 ARG 36 -11.560 2.011 -3.190 180 2HH2 ARG 36 1HH1 ARG 36 -10.876 2.228 -4.766 Start of MODEL 10 1 H ASN 8 H ASN 8 -6.623 2.301 3.333 2 HA ASN 8 HA ASN 8 -6.468 2.380 5.680 3 1HB ASN 8 1HB ASN 8 -8.799 2.583 4.400 4 2HB ASN 8 2HB ASN 8 -9.169 1.067 5.198 5 1HD2 ASN 8 1HD2 ASN 8 -8.356 4.443 5.625 6 2HD2 ASN 8 2HD2 ASN 8 -8.903 4.624 7.259 7 H GLY 9 H GLY 9 -5.510 -0.370 4.591 8 1HA GLY 9 1HA GLY 9 -4.790 -1.897 6.448 9 2HA GLY 9 2HA GLY 9 -6.499 -2.079 6.793 10 H LEU 10 H LEU 10 -7.595 -2.150 4.163 11 HA LEU 10 HA LEU 10 -7.217 -4.835 3.532 12 1HB LEU 10 1HB LEU 10 -8.893 -2.675 2.762 13 2HB LEU 10 2HB LEU 10 -8.246 -3.380 1.295 14 HG LEU 10 HG LEU 10 -9.537 -5.066 3.444 15 1HD1 LEU 10 1HD1 LEU 10 -10.815 -3.379 1.333 16 2HD1 LEU 10 2HD1 LEU 10 -11.511 -4.977 1.693 17 3HD1 LEU 10 3HD1 LEU 10 -11.358 -3.762 2.983 18 1HD2 LEU 10 1HD2 LEU 10 -9.374 -6.812 2.023 19 2HD2 LEU 10 2HD2 LEU 10 -9.639 -5.808 0.578 20 3HD2 LEU 10 3HD2 LEU 10 -8.035 -5.854 1.346 21 HA PRO 11 HA PRO 11 -3.479 -4.354 1.308 22 1HB PRO 11 1HB PRO 11 -2.897 -7.014 1.073 23 2HB PRO 11 2HB PRO 11 -2.445 -6.053 2.467 24 1HG PRO 11 1HG PRO 11 -4.608 -8.052 2.217 25 2HG PRO 11 2HG PRO 11 -3.873 -7.408 3.671 26 1HD PRO 11 1HD PRO 11 -6.429 -6.698 2.580 27 2HD PRO 11 2HD PRO 11 -5.643 -5.970 3.968 28 H VAL 12 H VAL 12 -5.147 -3.455 -0.294 29 HA VAL 12 HA VAL 12 -4.850 -5.166 -2.638 30 HB VAL 12 HB VAL 12 -7.202 -4.638 -3.273 31 1HG1 VAL 12 1HG1 VAL 12 -7.609 -6.143 -0.781 32 2HG1 VAL 12 2HG1 VAL 12 -7.823 -6.646 -2.475 33 3HG1 VAL 12 3HG1 VAL 12 -6.207 -6.694 -1.729 34 1HG2 VAL 12 1HG2 VAL 12 -7.076 -3.031 -0.898 35 2HG2 VAL 12 2HG2 VAL 12 -8.390 -3.168 -2.092 36 3HG2 VAL 12 3HG2 VAL 12 -8.340 -4.268 -0.694 37 H CYS 13 H CYS 13 -3.636 -2.634 -1.399 38 HA CYS 13 HA CYS 13 -4.550 -0.397 -2.721 39 1HB CYS 13 1HB CYS 13 -3.051 -0.013 -0.995 40 2HB CYS 13 2HB CYS 13 -1.904 -1.205 -1.573 41 H GLY 14 H GLY 14 -2.196 -2.970 -3.675 42 1HA GLY 14 1HA GLY 14 -1.928 -3.737 -5.850 43 2HA GLY 14 2HA GLY 14 -2.620 -2.254 -6.480 44 H GLU 15 H GLU 15 -0.628 -1.126 -4.096 45 HA GLU 15 HA GLU 15 1.683 -1.115 -5.876 46 1HB GLU 15 1HB GLU 15 0.897 1.239 -4.121 47 2HB GLU 15 2HB GLU 15 2.067 1.214 -5.427 48 1HG GLU 15 1HG GLU 15 -0.885 0.616 -5.897 49 2HG GLU 15 2HG GLU 15 -0.251 2.250 -5.944 50 HE2 GLU 15 HE GLU 15 -0.562 0.426 -9.004 51 H THR 16 H THR 16 3.756 -1.209 -4.864 52 HA THR 16 HA THR 16 3.626 -2.116 -2.084 53 HB THR 16 HB THR 16 6.136 -2.291 -3.716 54 HG1 THR 16 1HG THR 16 5.102 -3.503 -5.280 55 1HG2 THR 16 1HG2 THR 16 6.221 -3.648 -1.773 56 2HG2 THR 16 2HG2 THR 16 4.491 -4.057 -1.872 57 3HG2 THR 16 3HG2 THR 16 5.649 -4.803 -3.001 58 H CYS 17 H CYS 17 5.789 -1.578 -0.831 59 HA CYS 17 HA CYS 17 6.693 1.096 -1.395 60 1HB CYS 17 1HB CYS 17 6.122 1.929 0.870 61 2HB CYS 17 2HB CYS 17 4.746 1.698 -0.189 62 H VAL 18 H VAL 18 8.587 -0.423 -1.731 63 HA VAL 18 HA VAL 18 9.588 -1.749 0.619 64 HB VAL 18 HB VAL 18 11.001 -1.328 -2.008 65 1HG1 VAL 18 1HG1 VAL 18 12.220 -3.277 -1.469 66 2HG1 VAL 18 2HG1 VAL 18 12.155 -2.339 0.043 67 3HG1 VAL 18 3HG1 VAL 18 11.079 -3.739 -0.184 68 1HG2 VAL 18 1HG2 VAL 18 9.945 -3.397 -2.824 69 2HG2 VAL 18 2HG2 VAL 18 8.928 -3.453 -1.363 70 3HG2 VAL 18 3HG2 VAL 18 8.742 -2.120 -2.528 71 H GLY 19 H GLY 19 9.761 1.397 -0.871 72 1HA GLY 19 1HA GLY 19 12.239 2.044 0.577 73 2HA GLY 19 2HA GLY 19 11.511 2.970 -0.720 74 H GLY 20 H GLY 20 8.829 2.107 0.942 75 1HA GLY 20 1HA GLY 20 7.796 2.895 2.872 76 2HA GLY 20 2HA GLY 20 9.084 4.059 3.111 77 H THR 21 H THR 21 7.796 3.682 -0.151 78 HA THR 21 HA THR 21 6.078 6.031 0.232 79 HB THR 21 HB THR 21 8.427 6.647 -0.597 80 HG1 THR 21 1HG THR 21 6.201 7.657 -1.115 81 1HG2 THR 21 1HG2 THR 21 7.535 5.632 -3.296 82 2HG2 THR 21 2HG2 THR 21 9.182 5.964 -2.707 83 3HG2 THR 21 3HG2 THR 21 8.341 4.476 -2.209 84 H CYS 22 H CYS 22 4.176 4.869 0.094 85 HA CYS 22 HA CYS 22 3.586 2.758 -1.424 86 1HB CYS 22 1HB CYS 22 2.128 4.252 0.154 87 2HB CYS 22 2HB CYS 22 1.622 5.024 -1.335 88 H ASN 23 H ASN 23 3.724 6.221 -2.460 89 HA ASN 23 HA ASN 23 4.285 7.022 -4.436 90 1HB ASN 23 1HB ASN 23 5.050 4.437 -4.905 91 2HB ASN 23 2HB ASN 23 3.701 4.527 -6.020 92 1HD2 ASN 23 1HD2 ASN 23 6.483 4.238 -6.631 93 2HD2 ASN 23 2HD2 ASN 23 6.973 5.586 -7.602 94 H THR 24 H THR 24 1.475 5.561 -3.359 95 HA THR 24 HA THR 24 -0.116 6.857 -5.450 96 HB THR 24 HB THR 24 0.123 4.340 -5.876 97 HG1 THR 24 1HG THR 24 -2.502 5.266 -4.962 98 1HG2 THR 24 1HG2 THR 24 -1.508 4.268 -3.283 99 2HG2 THR 24 2HG2 THR 24 -1.365 2.908 -4.423 100 3HG2 THR 24 3HG2 THR 24 0.071 3.491 -3.549 101 HA PRO 25 HA PRO 25 -2.186 8.424 -2.028 102 1HB PRO 25 1HB PRO 25 -4.437 9.399 -3.233 103 2HB PRO 25 2HB PRO 25 -2.906 10.252 -3.227 104 1HG PRO 25 1HG PRO 25 -4.193 8.770 -5.438 105 2HG PRO 25 2HG PRO 25 -2.911 9.963 -5.516 106 1HD PRO 25 1HD PRO 25 -2.627 7.119 -5.758 107 2HD PRO 25 2HD PRO 25 -1.335 8.301 -5.720 108 H GLY 26 H GLY 26 -4.487 8.505 -0.947 109 1HA GLY 26 1HA GLY 26 -5.880 7.166 0.227 110 2HA GLY 26 2HA GLY 26 -6.403 6.653 -1.364 111 H CYS 27 H CYS 27 -3.229 6.109 0.299 112 HA CYS 27 HA CYS 27 -3.860 3.251 0.255 113 1HB CYS 27 1HB CYS 27 -2.137 2.768 -1.040 114 2HB CYS 27 2HB CYS 27 -1.982 4.481 -1.375 115 H THR 28 H THR 28 -1.950 2.141 1.730 116 HA THR 28 HA THR 28 -1.230 3.853 3.959 117 HB THR 28 HB THR 28 -3.394 1.742 4.005 118 HG1 THR 28 1HG THR 28 -4.257 3.699 4.578 119 1HG2 THR 28 1HG2 THR 28 -2.994 1.908 6.619 120 2HG2 THR 28 2HG2 THR 28 -2.067 0.709 5.685 121 3HG2 THR 28 3HG2 THR 28 -1.309 2.249 6.157 122 H CYS 29 H CYS 29 0.827 3.347 2.783 123 HA CYS 29 HA CYS 29 1.918 0.979 2.324 124 1HB CYS 29 1HB CYS 29 3.135 3.000 1.950 125 2HB CYS 29 2HB CYS 29 3.191 3.366 3.662 126 H SER 30 H SER 30 1.930 -0.909 3.494 127 HA SER 30 HA SER 30 2.258 -0.621 6.379 128 1HB SER 30 1HB SER 30 0.020 -1.396 6.047 129 2HB SER 30 2HB SER 30 0.498 -2.506 4.778 130 HG SER 30 HG SER 30 1.351 -2.750 7.535 131 H TRP 31 H TRP 31 3.527 -1.748 3.413 132 HA TRP 31 HA TRP 31 5.266 -3.006 2.874 133 1HB TRP 31 1HB TRP 31 5.935 -1.889 5.351 134 2HB TRP 31 2HB TRP 31 6.366 -3.581 5.493 135 HD1 TRP 31 HD TRP 31 7.551 -0.375 3.877 136 HE1 TRP 31 1HE TRP 31 9.780 -0.708 2.504 137 HE3 TRP 31 3HE TRP 31 7.497 -5.459 4.016 138 HZ2 TRP 31 2HZ TRP 31 11.237 -3.008 1.649 139 HZ3 TRP 31 3HZ TRP 31 9.360 -6.671 2.888 140 HH2 TRP 31 HH TRP 31 11.186 -5.528 1.733 141 HA PRO 32 HA PRO 32 6.434 -4.391 2.340 142 1HB PRO 32 1HB PRO 32 6.326 -6.274 0.362 143 2HB PRO 32 2HB PRO 32 7.378 -6.409 1.758 144 1HG PRO 32 1HG PRO 32 4.861 -7.851 1.187 145 2HG PRO 32 2HG PRO 32 6.125 -8.259 2.330 146 1HD PRO 32 1HD PRO 32 3.576 -7.091 2.935 147 2HD PRO 32 2HD PRO 32 4.885 -7.392 4.061 148 H VAL 33 H VAL 33 3.165 -5.178 1.703 149 HA VAL 33 HA VAL 33 3.236 -3.301 -0.555 150 HB VAL 33 HB VAL 33 0.963 -5.167 0.001 151 1HG1 VAL 33 1HG1 VAL 33 0.708 -5.089 -2.427 152 2HG1 VAL 33 2HG1 VAL 33 0.768 -3.442 -1.755 153 3HG1 VAL 33 3HG1 VAL 33 2.195 -4.122 -2.572 154 1HG2 VAL 33 1HG2 VAL 33 3.566 -5.957 -1.349 155 2HG2 VAL 33 2HG2 VAL 33 2.895 -6.629 0.156 156 3HG2 VAL 33 3HG2 VAL 33 2.060 -6.904 -1.391 157 H CYS 34 H CYS 34 1.617 -1.639 -0.658 158 HA CYS 34 HA CYS 34 0.916 -0.693 1.943 159 1HB CYS 34 1HB CYS 34 0.255 1.307 0.881 160 2HB CYS 34 2HB CYS 34 1.723 0.767 0.090 161 H THR 35 H THR 35 -1.434 0.079 2.342 162 HA THR 35 HA THR 35 -3.331 -1.807 1.110 163 HB THR 35 HB THR 35 -4.355 -2.014 3.378 164 HG1 THR 35 1HG THR 35 -3.596 -0.600 4.932 165 1HG2 THR 35 1HG2 THR 35 -2.481 -3.133 4.594 166 2HG2 THR 35 2HG2 THR 35 -2.497 -3.619 2.881 167 3HG2 THR 35 3HG2 THR 35 -1.318 -2.415 3.453 168 H ARG 36 H ARG 36 -5.699 -0.963 2.003 169 HA ARG 36 HA ARG 36 -5.689 1.874 1.360 170 1HB ARG 36 1HB ARG 36 -6.611 -0.066 -0.365 171 2HB ARG 36 2HB ARG 36 -8.081 0.271 0.528 172 1HG ARG 36 1HG ARG 36 -7.472 2.807 0.089 173 2HG ARG 36 2HG ARG 36 -6.425 2.169 -1.163 174 1HD ARG 36 1HD ARG 36 -8.541 2.643 -2.225 175 2HD ARG 36 2HD ARG 36 -8.439 0.899 -2.093 176 HE ARG 36 HE ARG 36 -10.236 0.926 -0.591 177 1HH1 ARG 36 2HH2 ARG 36 -8.905 4.173 -0.861 178 2HH1 ARG 36 1HH2 ARG 36 -10.172 4.907 0.064 179 1HH2 ARG 36 2HH1 ARG 36 -11.907 1.895 0.630 180 2HH2 ARG 36 1HH1 ARG 36 -11.891 3.603 0.918 Start of MODEL 11 1 H ASN 8 H ASN 8 -5.747 1.759 3.530 2 HA ASN 8 HA ASN 8 -6.625 2.381 5.438 3 1HB ASN 8 1HB ASN 8 -8.983 1.938 3.977 4 2HB ASN 8 2HB ASN 8 -9.198 0.900 5.373 5 1HD2 ASN 8 1HD2 ASN 8 -8.748 4.160 4.226 6 2HD2 ASN 8 2HD2 ASN 8 -9.221 5.001 5.664 7 H GLY 9 H GLY 9 -5.428 -0.362 4.593 8 1HA GLY 9 1HA GLY 9 -4.622 -1.710 6.518 9 2HA GLY 9 2HA GLY 9 -6.307 -1.930 6.945 10 H LEU 10 H LEU 10 -7.398 -2.207 4.260 11 HA LEU 10 HA LEU 10 -6.901 -4.958 3.891 12 1HB LEU 10 1HB LEU 10 -8.643 -2.870 2.770 13 2HB LEU 10 2HB LEU 10 -8.225 -4.147 1.644 14 HG LEU 10 HG LEU 10 -9.397 -4.659 4.389 15 1HD1 LEU 10 1HD1 LEU 10 -11.551 -4.977 3.315 16 2HD1 LEU 10 2HD1 LEU 10 -10.952 -3.326 3.023 17 3HD1 LEU 10 3HD1 LEU 10 -10.853 -4.549 1.734 18 1HD2 LEU 10 1HD2 LEU 10 -8.989 -6.432 1.968 19 2HD2 LEU 10 2HD2 LEU 10 -8.205 -6.569 3.561 20 3HD2 LEU 10 3HD2 LEU 10 -9.951 -6.879 3.397 21 HA PRO 11 HA PRO 11 -3.409 -4.496 1.330 22 1HB PRO 11 1HB PRO 11 -2.882 -7.153 0.963 23 2HB PRO 11 2HB PRO 11 -2.324 -6.249 2.356 24 1HG PRO 11 1HG PRO 11 -4.528 -8.211 2.183 25 2HG PRO 11 2HG PRO 11 -3.686 -7.627 3.605 26 1HD PRO 11 1HD PRO 11 -6.300 -6.849 2.716 27 2HD PRO 11 2HD PRO 11 -5.412 -6.181 4.072 28 H VAL 12 H VAL 12 -5.023 -3.475 -0.177 29 HA VAL 12 HA VAL 12 -4.947 -5.111 -2.576 30 HB VAL 12 HB VAL 12 -7.281 -4.769 -3.066 31 1HG1 VAL 12 1HG1 VAL 12 -8.293 -6.230 -1.351 32 2HG1 VAL 12 2HG1 VAL 12 -6.685 -6.804 -1.852 33 3HG1 VAL 12 3HG1 VAL 12 -6.882 -5.957 -0.299 34 1HG2 VAL 12 1HG2 VAL 12 -7.510 -2.600 -1.835 35 2HG2 VAL 12 2HG2 VAL 12 -8.847 -3.742 -1.553 36 3HG2 VAL 12 3HG2 VAL 12 -7.585 -3.524 -0.315 37 H CYS 13 H CYS 13 -3.634 -2.647 -1.325 38 HA CYS 13 HA CYS 13 -4.617 -0.345 -2.474 39 1HB CYS 13 1HB CYS 13 -2.985 -0.067 -0.844 40 2HB CYS 13 2HB CYS 13 -1.892 -1.223 -1.580 41 H GLY 14 H GLY 14 -2.333 -2.866 -3.712 42 1HA GLY 14 1HA GLY 14 -2.313 -3.536 -5.958 43 2HA GLY 14 2HA GLY 14 -2.932 -1.970 -6.444 44 H GLU 15 H GLU 15 -0.729 -1.151 -4.120 45 HA GLU 15 HA GLU 15 1.480 -1.196 -6.022 46 1HB GLU 15 1HB GLU 15 0.056 1.087 -5.195 47 2HB GLU 15 2HB GLU 15 1.512 1.124 -4.222 48 1HG GLU 15 1HG GLU 15 2.047 2.302 -6.247 49 2HG GLU 15 2HG GLU 15 2.852 0.750 -6.371 50 HE2 GLU 15 HE GLU 15 1.530 0.976 -9.490 51 H THR 16 H THR 16 3.621 -0.436 -4.698 52 HA THR 16 HA THR 16 3.567 -1.908 -2.145 53 HB THR 16 HB THR 16 6.057 -1.813 -3.833 54 HG1 THR 16 1HG THR 16 4.955 -2.804 -5.474 55 1HG2 THR 16 1HG2 THR 16 6.328 -3.250 -1.973 56 2HG2 THR 16 2HG2 THR 16 4.622 -3.756 -1.997 57 3HG2 THR 16 3HG2 THR 16 5.755 -4.389 -3.215 58 H CYS 17 H CYS 17 5.746 -1.354 -0.890 59 HA CYS 17 HA CYS 17 6.495 1.396 -1.240 60 1HB CYS 17 1HB CYS 17 5.812 2.170 0.928 61 2HB CYS 17 2HB CYS 17 4.414 1.637 0.017 62 H VAL 18 H VAL 18 8.379 -0.204 -1.698 63 HA VAL 18 HA VAL 18 9.458 -1.606 0.532 64 HB VAL 18 HB VAL 18 10.908 -0.823 -1.988 65 1HG1 VAL 18 1HG1 VAL 18 11.032 -3.370 -0.344 66 2HG1 VAL 18 2HG1 VAL 18 12.115 -2.876 -1.668 67 3HG1 VAL 18 3HG1 VAL 18 12.128 -1.985 -0.127 68 1HG2 VAL 18 1HG2 VAL 18 9.822 -3.324 -2.490 69 2HG2 VAL 18 2HG2 VAL 18 8.476 -2.437 -1.735 70 3HG2 VAL 18 3HG2 VAL 18 9.271 -1.781 -3.186 71 H GLY 19 H GLY 19 9.556 1.684 -0.675 72 1HA GLY 19 1HA GLY 19 11.949 2.294 0.915 73 2HA GLY 19 2HA GLY 19 11.187 3.320 -0.284 74 H GLY 20 H GLY 20 8.538 2.140 1.232 75 1HA GLY 20 1HA GLY 20 7.406 2.667 3.179 76 2HA GLY 20 2HA GLY 20 8.664 3.799 3.632 77 H THR 21 H THR 21 7.449 3.844 0.308 78 HA THR 21 HA THR 21 5.549 5.959 0.903 79 HB THR 21 HB THR 21 8.223 6.326 -0.496 80 HG1 THR 21 1HG THR 21 8.112 7.161 1.612 81 1HG2 THR 21 1HG2 THR 21 5.630 7.413 -1.364 82 2HG2 THR 21 2HG2 THR 21 6.713 8.702 -0.785 83 3HG2 THR 21 3HG2 THR 21 7.235 7.626 -2.104 84 H CYS 22 H CYS 22 3.839 4.813 0.099 85 HA CYS 22 HA CYS 22 3.947 3.158 -2.100 86 1HB CYS 22 1HB CYS 22 1.475 4.725 -1.431 87 2HB CYS 22 2HB CYS 22 1.620 3.079 -2.017 88 H ASN 23 H ASN 23 3.615 3.505 -4.347 89 HA ASN 23 HA ASN 23 4.257 6.121 -5.216 90 1HB ASN 23 1HB ASN 23 3.489 3.576 -6.737 91 2HB ASN 23 2HB ASN 23 4.017 5.048 -7.528 92 1HD2 ASN 23 1HD2 ASN 23 6.106 5.970 -6.774 93 2HD2 ASN 23 2HD2 ASN 23 7.411 4.885 -6.427 94 H THR 24 H THR 24 1.426 4.777 -4.095 95 HA THR 24 HA THR 24 -0.223 6.413 -5.906 96 HB THR 24 HB THR 24 -0.407 3.869 -6.233 97 HG1 THR 24 1HG THR 24 -2.732 5.190 -5.038 98 1HG2 THR 24 1HG2 THR 24 -1.756 4.114 -3.491 99 2HG2 THR 24 2HG2 THR 24 -1.809 2.683 -4.549 100 3HG2 THR 24 3HG2 THR 24 -0.268 3.193 -3.817 101 HA PRO 25 HA PRO 25 -1.517 8.354 -2.300 102 1HB PRO 25 1HB PRO 25 -3.765 9.613 -3.208 103 2HB PRO 25 2HB PRO 25 -2.148 10.235 -3.467 104 1HG PRO 25 1HG PRO 25 -3.950 8.897 -5.391 105 2HG PRO 25 2HG PRO 25 -2.540 9.887 -5.713 106 1HD PRO 25 1HD PRO 25 -2.697 7.027 -5.857 107 2HD PRO 25 2HD PRO 25 -1.261 8.009 -6.066 108 H GLY 26 H GLY 26 -3.651 8.827 -0.949 109 1HA GLY 26 1HA GLY 26 -4.985 7.710 0.509 110 2HA GLY 26 2HA GLY 26 -5.833 7.280 -0.963 111 H CYS 27 H CYS 27 -2.648 6.266 0.485 112 HA CYS 27 HA CYS 27 -3.641 3.515 0.313 113 1HB CYS 27 1HB CYS 27 -1.899 2.850 -0.881 114 2HB CYS 27 2HB CYS 27 -1.612 4.545 -1.219 115 H THR 28 H THR 28 -1.971 2.099 1.801 116 HA THR 28 HA THR 28 -1.302 3.632 4.203 117 HB THR 28 HB THR 28 -3.252 1.298 3.959 118 HG1 THR 28 1HG THR 28 -4.484 2.910 5.159 119 1HG2 THR 28 1HG2 THR 28 -2.723 2.306 6.675 120 2HG2 THR 28 2HG2 THR 28 -2.837 0.622 6.108 121 3HG2 THR 28 3HG2 THR 28 -1.293 1.499 5.988 122 H CYS 29 H CYS 29 0.856 3.355 3.212 123 HA CYS 29 HA CYS 29 2.088 1.114 2.518 124 1HB CYS 29 1HB CYS 29 3.131 3.343 2.663 125 2HB CYS 29 2HB CYS 29 3.243 3.179 4.404 126 H SER 30 H SER 30 2.050 -0.923 3.402 127 HA SER 30 HA SER 30 2.113 -1.050 6.317 128 1HB SER 30 1HB SER 30 0.519 -2.724 6.338 129 2HB SER 30 2HB SER 30 -0.007 -1.860 4.907 130 HG SER 30 HG SER 30 0.923 -4.437 5.129 131 H TRP 31 H TRP 31 3.542 -1.899 3.257 132 HA TRP 31 HA TRP 31 5.358 -3.036 2.699 133 1HB TRP 31 1HB TRP 31 5.943 -1.942 5.200 134 2HB TRP 31 2HB TRP 31 6.453 -3.615 5.326 135 HD1 TRP 31 HD TRP 31 7.557 -0.333 3.856 136 HE1 TRP 31 1HE TRP 31 9.801 -0.540 2.483 137 HE3 TRP 31 3HE TRP 31 7.624 -5.417 3.727 138 HZ2 TRP 31 2HZ TRP 31 11.319 -2.758 1.519 139 HZ3 TRP 31 3HZ TRP 31 9.522 -6.523 2.549 140 HH2 TRP 31 HH TRP 31 11.328 -5.279 1.469 141 HA PRO 32 HA PRO 32 6.562 -4.325 2.087 142 1HB PRO 32 1HB PRO 32 6.522 -6.136 0.040 143 2HB PRO 32 2HB PRO 32 7.606 -6.264 1.411 144 1HG PRO 32 1HG PRO 32 5.163 -7.824 0.828 145 2HG PRO 32 2HG PRO 32 6.470 -8.202 1.934 146 1HD PRO 32 1HD PRO 32 3.871 -7.203 2.626 147 2HD PRO 32 2HD PRO 32 5.216 -7.471 3.718 148 H VAL 33 H VAL 33 3.315 -5.189 1.554 149 HA VAL 33 HA VAL 33 3.245 -3.290 -0.687 150 HB VAL 33 HB VAL 33 1.032 -5.204 -0.075 151 1HG1 VAL 33 1HG1 VAL 33 0.876 -5.188 -2.582 152 2HG1 VAL 33 2HG1 VAL 33 0.626 -3.600 -1.817 153 3HG1 VAL 33 3HG1 VAL 33 2.180 -3.975 -2.600 154 1HG2 VAL 33 1HG2 VAL 33 3.768 -5.946 -1.002 155 2HG2 VAL 33 2HG2 VAL 33 2.568 -6.892 -0.089 156 3HG2 VAL 33 3HG2 VAL 33 2.390 -6.689 -1.849 157 H CYS 34 H CYS 34 1.574 -1.676 -0.702 158 HA CYS 34 HA CYS 34 0.913 -0.833 1.960 159 1HB CYS 34 1HB CYS 34 0.433 1.235 1.065 160 2HB CYS 34 2HB CYS 34 1.720 0.647 0.030 161 H THR 35 H THR 35 -1.479 0.054 2.241 162 HA THR 35 HA THR 35 -3.358 -1.803 0.949 163 HB THR 35 HB THR 35 -4.451 -1.958 3.257 164 HG1 THR 35 1HG THR 35 -2.744 -1.306 4.940 165 1HG2 THR 35 1HG2 THR 35 -1.791 -2.887 4.016 166 2HG2 THR 35 2HG2 THR 35 -3.227 -3.856 3.608 167 3HG2 THR 35 3HG2 THR 35 -2.119 -3.322 2.322 168 H ARG 36 H ARG 36 -5.734 -0.985 1.804 169 HA ARG 36 HA ARG 36 -5.691 1.890 1.375 170 1HB ARG 36 1HB ARG 36 -6.329 0.714 -0.742 171 2HB ARG 36 2HB ARG 36 -7.620 -0.117 0.101 172 1HG ARG 36 1HG ARG 36 -8.253 2.454 0.762 173 2HG ARG 36 2HG ARG 36 -7.451 2.748 -0.769 174 1HD ARG 36 1HD ARG 36 -9.280 0.455 -0.962 175 2HD ARG 36 2HD ARG 36 -10.122 1.885 -0.397 176 HE ARG 36 HE ARG 36 -8.388 2.517 -2.636 177 1HH1 ARG 36 2HH2 ARG 36 -11.500 1.097 -1.813 178 2HH1 ARG 36 1HH2 ARG 36 -12.213 1.455 -3.350 179 1HH2 ARG 36 2HH1 ARG 36 -9.329 2.990 -4.665 180 2HH2 ARG 36 1HH1 ARG 36 -10.970 2.539 -4.983 Start of MODEL 12 1 H ASN 8 H ASN 8 -5.268 1.447 3.573 2 HA ASN 8 HA ASN 8 -5.249 1.042 5.702 3 1HB ASN 8 1HB ASN 8 -6.854 2.389 7.219 4 2HB ASN 8 2HB ASN 8 -5.785 3.336 6.203 5 1HD2 ASN 8 1HD2 ASN 8 -8.835 3.090 7.293 6 2HD2 ASN 8 2HD2 ASN 8 -9.728 3.873 6.034 7 H GLY 9 H GLY 9 -6.653 -0.801 4.079 8 1HA GLY 9 1HA GLY 9 -8.765 -1.722 5.921 9 2HA GLY 9 2HA GLY 9 -9.048 -1.665 4.193 10 H LEU 10 H LEU 10 -7.343 -2.836 2.776 11 HA LEU 10 HA LEU 10 -6.161 -5.092 4.204 12 1HB LEU 10 1HB LEU 10 -8.277 -5.199 2.098 13 2HB LEU 10 2HB LEU 10 -7.035 -6.436 2.112 14 HG LEU 10 HG LEU 10 -8.630 -5.803 4.593 15 1HD1 LEU 10 1HD1 LEU 10 -9.942 -7.948 3.780 16 2HD1 LEU 10 2HD1 LEU 10 -10.434 -6.311 3.282 17 3HD1 LEU 10 3HD1 LEU 10 -9.488 -7.332 2.173 18 1HD2 LEU 10 1HD2 LEU 10 -8.047 -8.082 5.224 19 2HD2 LEU 10 2HD2 LEU 10 -7.200 -8.313 3.677 20 3HD2 LEU 10 3HD2 LEU 10 -6.587 -7.133 4.859 21 HA PRO 11 HA PRO 11 -2.912 -4.442 1.440 22 1HB PRO 11 1HB PRO 11 -1.862 -6.937 1.064 23 2HB PRO 11 2HB PRO 11 -1.560 -5.976 2.498 24 1HG PRO 11 1HG PRO 11 -3.330 -8.323 2.178 25 2HG PRO 11 2HG PRO 11 -2.690 -7.623 3.652 26 1HD PRO 11 1HD PRO 11 -5.358 -7.341 2.635 27 2HD PRO 11 2HD PRO 11 -4.684 -6.549 4.046 28 H VAL 12 H VAL 12 -5.039 -3.999 0.013 29 HA VAL 12 HA VAL 12 -4.453 -5.515 -2.436 30 HB VAL 12 HB VAL 12 -6.863 -5.236 -2.991 31 1HG1 VAL 12 1HG1 VAL 12 -7.411 -6.838 -0.759 32 2HG1 VAL 12 2HG1 VAL 12 -6.831 -7.378 -2.354 33 3HG1 VAL 12 3HG1 VAL 12 -5.667 -7.040 -1.050 34 1HG2 VAL 12 1HG2 VAL 12 -8.463 -4.486 -1.467 35 2HG2 VAL 12 2HG2 VAL 12 -7.375 -4.682 -0.072 36 3HG2 VAL 12 3HG2 VAL 12 -7.116 -3.347 -1.221 37 H CYS 13 H CYS 13 -3.714 -2.769 -1.025 38 HA CYS 13 HA CYS 13 -4.799 -0.654 -2.269 39 1HB CYS 13 1HB CYS 13 -3.193 -0.144 -0.700 40 2HB CYS 13 2HB CYS 13 -2.019 -1.263 -1.361 41 H GLY 14 H GLY 14 -2.456 -3.055 -3.574 42 1HA GLY 14 1HA GLY 14 -2.407 -3.682 -5.819 43 2HA GLY 14 2HA GLY 14 -3.114 -2.147 -6.282 44 H GLU 15 H GLU 15 -0.862 -1.342 -3.950 45 HA GLU 15 HA GLU 15 1.287 -1.209 -5.914 46 1HB GLU 15 1HB GLU 15 -0.199 0.987 -5.165 47 2HB GLU 15 2HB GLU 15 1.102 1.059 -3.993 48 1HG GLU 15 1HG GLU 15 1.684 2.338 -6.035 49 2HG GLU 15 2HG GLU 15 2.789 0.997 -5.803 50 HE2 GLU 15 HE GLU 15 0.354 2.008 -8.313 51 H THR 16 H THR 16 3.434 -0.433 -4.648 52 HA THR 16 HA THR 16 3.484 -1.847 -2.066 53 HB THR 16 HB THR 16 5.867 -1.945 -3.905 54 HG1 THR 16 1HG THR 16 4.739 -3.668 -5.071 55 1HG2 THR 16 1HG2 THR 16 4.457 -3.776 -1.923 56 2HG2 THR 16 2HG2 THR 16 5.590 -4.446 -3.121 57 3HG2 THR 16 3HG2 THR 16 6.157 -3.253 -1.929 58 H CYS 17 H CYS 17 5.737 -1.326 -0.950 59 HA CYS 17 HA CYS 17 6.605 1.355 -1.496 60 1HB CYS 17 1HB CYS 17 6.155 2.057 0.905 61 2HB CYS 17 2HB CYS 17 4.809 2.075 -0.217 62 H VAL 18 H VAL 18 8.441 -0.244 -1.925 63 HA VAL 18 HA VAL 18 9.530 -1.588 0.363 64 HB VAL 18 HB VAL 18 10.910 -1.112 -2.266 65 1HG1 VAL 18 1HG1 VAL 18 11.971 -3.216 -1.835 66 2HG1 VAL 18 2HG1 VAL 18 12.084 -2.247 -0.346 67 3HG1 VAL 18 3HG1 VAL 18 10.881 -3.554 -0.468 68 1HG2 VAL 18 1HG2 VAL 18 9.723 -3.402 -2.840 69 2HG2 VAL 18 2HG2 VAL 18 8.485 -2.789 -1.717 70 3HG2 VAL 18 3HG2 VAL 18 8.920 -1.848 -3.164 71 H GLY 19 H GLY 19 9.756 1.569 -1.161 72 1HA GLY 19 1HA GLY 19 12.298 2.188 0.126 73 2HA GLY 19 2HA GLY 19 11.372 3.205 -0.959 74 H GLY 20 H GLY 20 8.960 2.127 0.951 75 1HA GLY 20 1HA GLY 20 8.142 2.705 3.036 76 2HA GLY 20 2HA GLY 20 9.490 3.798 3.286 77 H THR 21 H THR 21 7.770 3.841 0.187 78 HA THR 21 HA THR 21 6.070 6.042 1.030 79 HB THR 21 HB THR 21 8.372 6.995 0.441 80 HG1 THR 21 1HG THR 21 6.199 8.052 0.127 81 1HG2 THR 21 1HG2 THR 21 7.570 6.411 -2.434 82 2HG2 THR 21 2HG2 THR 21 9.142 6.967 -1.810 83 3HG2 THR 21 3HG2 THR 21 8.630 5.281 -1.557 84 H CYS 22 H CYS 22 4.162 5.142 0.477 85 HA CYS 22 HA CYS 22 3.764 3.315 -1.510 86 1HB CYS 22 1HB CYS 22 2.209 4.368 0.380 87 2HB CYS 22 2HB CYS 22 1.609 5.307 -0.972 88 H ASN 23 H ASN 23 3.627 3.426 -3.748 89 HA ASN 23 HA ASN 23 4.360 5.878 -4.947 90 1HB ASN 23 1HB ASN 23 4.190 3.061 -5.690 91 2HB ASN 23 2HB ASN 23 3.424 4.026 -6.935 92 1HD2 ASN 23 1HD2 ASN 23 5.974 2.497 -6.812 93 2HD2 ASN 23 2HD2 ASN 23 7.223 3.591 -7.306 94 H THR 24 H THR 24 1.473 4.787 -3.685 95 HA THR 24 HA THR 24 -0.092 6.338 -5.630 96 HB THR 24 HB THR 24 -0.328 3.792 -5.901 97 HG1 THR 24 1HG THR 24 -2.308 4.558 -6.524 98 1HG2 THR 24 1HG2 THR 24 -2.283 3.451 -3.831 99 2HG2 THR 24 2HG2 THR 24 -0.770 2.537 -4.045 100 3HG2 THR 24 3HG2 THR 24 -0.789 4.002 -3.034 101 HA PRO 25 HA PRO 25 -1.431 8.402 -2.109 102 1HB PRO 25 1HB PRO 25 -3.586 9.734 -3.131 103 2HB PRO 25 2HB PRO 25 -1.935 10.285 -3.333 104 1HG PRO 25 1HG PRO 25 -3.711 8.986 -5.308 105 2HG PRO 25 2HG PRO 25 -2.250 9.913 -5.587 106 1HD PRO 25 1HD PRO 25 -2.518 7.059 -5.690 107 2HD PRO 25 2HD PRO 25 -1.036 7.978 -5.855 108 H GLY 26 H GLY 26 -3.636 9.005 -0.894 109 1HA GLY 26 1HA GLY 26 -5.063 7.965 0.537 110 2HA GLY 26 2HA GLY 26 -5.863 7.542 -0.964 111 H CYS 27 H CYS 27 -2.652 6.378 0.223 112 HA CYS 27 HA CYS 27 -3.823 3.691 0.267 113 1HB CYS 27 1HB CYS 27 -2.143 2.899 -0.948 114 2HB CYS 27 2HB CYS 27 -1.821 4.567 -1.374 115 H THR 28 H THR 28 -2.170 2.224 1.726 116 HA THR 28 HA THR 28 -1.373 3.776 4.080 117 HB THR 28 HB THR 28 -3.377 1.482 3.919 118 HG1 THR 28 1HG THR 28 -3.084 4.159 5.076 119 1HG2 THR 28 1HG2 THR 28 -2.140 0.717 5.788 120 2HG2 THR 28 2HG2 THR 28 -1.585 2.354 6.208 121 3HG2 THR 28 3HG2 THR 28 -3.264 1.868 6.550 122 H CYS 29 H CYS 29 0.711 3.393 2.855 123 HA CYS 29 HA CYS 29 1.816 1.028 2.292 124 1HB CYS 29 1HB CYS 29 2.996 3.059 1.896 125 2HB CYS 29 2HB CYS 29 3.072 3.437 3.604 126 H SER 30 H SER 30 1.950 -0.869 3.437 127 HA SER 30 HA SER 30 2.327 -0.600 6.317 128 1HB SER 30 1HB SER 30 0.550 -2.488 4.742 129 2HB SER 30 2HB SER 30 1.112 -2.929 6.342 130 HG SER 30 HG SER 30 -1.036 -1.707 6.076 131 H TRP 31 H TRP 31 3.548 -1.661 3.311 132 HA TRP 31 HA TRP 31 5.295 -2.880 2.713 133 1HB TRP 31 1HB TRP 31 6.012 -1.759 5.167 134 2HB TRP 31 2HB TRP 31 6.463 -3.446 5.310 135 HD1 TRP 31 HD TRP 31 7.595 -0.239 3.672 136 HE1 TRP 31 1HE TRP 31 9.794 -0.559 2.246 137 HE3 TRP 31 3HE TRP 31 7.563 -5.323 3.793 138 HZ2 TRP 31 2HZ TRP 31 11.239 -2.851 1.350 139 HZ3 TRP 31 3HZ TRP 31 9.404 -6.524 2.617 140 HH2 TRP 31 HH TRP 31 11.199 -5.370 1.425 141 HA PRO 32 HA PRO 32 6.465 -4.231 2.119 142 1HB PRO 32 1HB PRO 32 6.327 -6.091 0.123 143 2HB PRO 32 2HB PRO 32 7.429 -6.221 1.479 144 1HG PRO 32 1HG PRO 32 4.925 -7.710 0.977 145 2HG PRO 32 2HG PRO 32 6.235 -8.104 2.071 146 1HD PRO 32 1HD PRO 32 3.686 -6.998 2.778 147 2HD PRO 32 2HD PRO 32 5.038 -7.284 3.854 148 H VAL 33 H VAL 33 3.196 -5.103 1.562 149 HA VAL 33 HA VAL 33 3.148 -3.174 -0.653 150 HB VAL 33 HB VAL 33 0.742 -4.637 -0.539 151 1HG1 VAL 33 1HG1 VAL 33 1.129 -4.804 -2.749 152 2HG1 VAL 33 2HG1 VAL 33 2.544 -3.773 -2.427 153 3HG1 VAL 33 3HG1 VAL 33 2.732 -5.540 -2.512 154 1HG2 VAL 33 1HG2 VAL 33 3.177 -6.431 -0.265 155 2HG2 VAL 33 2HG2 VAL 33 1.800 -6.316 0.858 156 3HG2 VAL 33 3HG2 VAL 33 1.561 -6.971 -0.780 157 H CYS 34 H CYS 34 1.543 -1.524 -0.649 158 HA CYS 34 HA CYS 34 0.850 -0.687 1.983 159 1HB CYS 34 1HB CYS 34 0.205 1.338 1.031 160 2HB CYS 34 2HB CYS 34 1.576 0.807 0.077 161 H THR 35 H THR 35 -1.595 0.223 2.186 162 HA THR 35 HA THR 35 -3.453 -1.698 0.986 163 HB THR 35 HB THR 35 -4.441 -2.061 3.272 164 HG1 THR 35 1HG THR 35 -3.308 -1.051 5.016 165 1HG2 THR 35 1HG2 THR 35 -1.772 -2.727 4.136 166 2HG2 THR 35 2HG2 THR 35 -3.016 -3.829 3.495 167 3HG2 THR 35 3HG2 THR 35 -1.866 -3.043 2.386 168 H ARG 36 H ARG 36 -5.811 -0.958 1.979 169 HA ARG 36 HA ARG 36 -5.861 1.869 1.298 170 1HB ARG 36 1HB ARG 36 -8.157 1.486 0.467 171 2HB ARG 36 2HB ARG 36 -7.055 0.363 -0.303 172 1HG ARG 36 1HG ARG 36 -8.197 -1.414 0.523 173 2HG ARG 36 2HG ARG 36 -8.012 -0.826 2.164 174 1HD ARG 36 1HD ARG 36 -10.206 -0.245 2.226 175 2HD ARG 36 2HD ARG 36 -9.975 0.844 0.873 176 HE ARG 36 HE ARG 36 -10.853 -0.784 -0.581 177 1HH1 ARG 36 2HH2 ARG 36 -10.145 -2.239 2.544 178 2HH1 ARG 36 1HH2 ARG 36 -10.945 -3.730 2.175 179 1HH2 ARG 36 2HH1 ARG 36 -11.907 -2.752 -1.070 180 2HH2 ARG 36 1HH1 ARG 36 -11.954 -4.024 0.105 Start of MODEL 13 1 H ASN 8 H ASN 8 -5.314 1.583 3.648 2 HA ASN 8 HA ASN 8 -4.902 1.861 5.758 3 1HB ASN 8 1HB ASN 8 -6.757 2.376 7.360 4 2HB ASN 8 2HB ASN 8 -6.945 3.269 5.863 5 1HD2 ASN 8 1HD2 ASN 8 -8.816 3.198 4.878 6 2HD2 ASN 8 2HD2 ASN 8 -10.074 2.029 5.105 7 H GLY 9 H GLY 9 -5.430 -0.867 4.477 8 1HA GLY 9 1HA GLY 9 -4.772 -2.608 6.405 9 2HA GLY 9 2HA GLY 9 -6.509 -2.500 6.619 10 H LEU 10 H LEU 10 -7.769 -2.533 4.335 11 HA LEU 10 HA LEU 10 -7.455 -5.070 3.314 12 1HB LEU 10 1HB LEU 10 -8.732 -2.665 2.005 13 2HB LEU 10 2HB LEU 10 -8.988 -4.338 1.552 14 HG LEU 10 HG LEU 10 -9.532 -3.931 4.380 15 1HD1 LEU 10 1HD1 LEU 10 -10.567 -1.912 2.492 16 2HD1 LEU 10 2HD1 LEU 10 -11.789 -2.676 3.537 17 3HD1 LEU 10 3HD1 LEU 10 -10.386 -1.856 4.262 18 1HD2 LEU 10 1HD2 LEU 10 -11.350 -5.291 3.972 19 2HD2 LEU 10 2HD2 LEU 10 -11.576 -4.681 2.315 20 3HD2 LEU 10 3HD2 LEU 10 -10.230 -5.787 2.681 21 HA PRO 11 HA PRO 11 -3.905 -4.315 0.853 22 1HB PRO 11 1HB PRO 11 -3.278 -6.936 0.390 23 2HB PRO 11 2HB PRO 11 -2.726 -6.053 1.799 24 1HG PRO 11 1HG PRO 11 -4.852 -8.099 1.610 25 2HG PRO 11 2HG PRO 11 -4.004 -7.524 3.032 26 1HD PRO 11 1HD PRO 11 -6.666 -6.827 2.223 27 2HD PRO 11 2HD PRO 11 -5.777 -6.166 3.580 28 H VAL 12 H VAL 12 -5.405 -3.266 -0.660 29 HA VAL 12 HA VAL 12 -5.508 -4.955 -3.034 30 HB VAL 12 HB VAL 12 -7.831 -3.909 -3.434 31 1HG1 VAL 12 1HG1 VAL 12 -8.779 -5.778 -1.738 32 2HG1 VAL 12 2HG1 VAL 12 -7.991 -6.173 -3.285 33 3HG1 VAL 12 3HG1 VAL 12 -7.064 -6.253 -1.768 34 1HG2 VAL 12 1HG2 VAL 12 -8.304 -4.004 -0.513 35 2HG2 VAL 12 2HG2 VAL 12 -7.361 -2.607 -1.087 36 3HG2 VAL 12 3HG2 VAL 12 -8.980 -2.923 -1.755 37 H CYS 13 H CYS 13 -3.828 -2.687 -1.931 38 HA CYS 13 HA CYS 13 -4.606 -0.346 -3.288 39 1HB CYS 13 1HB CYS 13 -2.034 -1.275 -2.027 40 2HB CYS 13 2HB CYS 13 -2.123 0.239 -2.905 41 H GLY 14 H GLY 14 -2.345 -3.093 -3.965 42 1HA GLY 14 1HA GLY 14 -1.973 -3.985 -6.073 43 2HA GLY 14 2HA GLY 14 -2.569 -2.516 -6.823 44 H GLU 15 H GLU 15 -0.735 -1.188 -4.488 45 HA GLU 15 HA GLU 15 1.653 -1.312 -6.159 46 1HB GLU 15 1HB GLU 15 0.135 0.910 -5.573 47 2HB GLU 15 2HB GLU 15 1.335 0.992 -4.299 48 1HG GLU 15 1HG GLU 15 2.488 2.127 -5.963 49 2HG GLU 15 2HG GLU 15 3.037 0.498 -6.307 50 HE2 GLU 15 HE GLU 15 2.841 0.225 -8.629 51 H THR 16 H THR 16 3.681 -0.472 -4.703 52 HA THR 16 HA THR 16 3.520 -1.892 -2.129 53 HB THR 16 HB THR 16 6.048 -1.935 -3.775 54 HG1 THR 16 1HG THR 16 4.841 -2.893 -5.366 55 1HG2 THR 16 1HG2 THR 16 6.273 -3.207 -1.780 56 2HG2 THR 16 2HG2 THR 16 4.577 -3.746 -1.827 57 3HG2 THR 16 3HG2 THR 16 5.762 -4.440 -2.958 58 H CYS 17 H CYS 17 5.715 -1.342 -0.858 59 HA CYS 17 HA CYS 17 6.509 1.382 -1.295 60 1HB CYS 17 1HB CYS 17 5.863 2.153 0.947 61 2HB CYS 17 2HB CYS 17 4.493 1.827 -0.095 62 H VAL 18 H VAL 18 8.419 -0.155 -1.667 63 HA VAL 18 HA VAL 18 9.440 -1.524 0.627 64 HB VAL 18 HB VAL 18 10.921 -0.868 -1.911 65 1HG1 VAL 18 1HG1 VAL 18 12.122 -1.959 -0.003 66 2HG1 VAL 18 2HG1 VAL 18 10.999 -3.334 -0.143 67 3HG1 VAL 18 3HG1 VAL 18 12.088 -2.934 -1.493 68 1HG2 VAL 18 1HG2 VAL 18 8.961 -1.697 -2.853 69 2HG2 VAL 18 2HG2 VAL 18 9.946 -3.168 -2.660 70 3HG2 VAL 18 3HG2 VAL 18 8.651 -2.804 -1.494 71 H GLY 19 H GLY 19 9.582 1.711 -0.713 72 1HA GLY 19 1HA GLY 19 11.988 2.365 0.832 73 2HA GLY 19 2HA GLY 19 11.198 3.361 -0.374 74 H GLY 20 H GLY 20 8.582 2.222 1.220 75 1HA GLY 20 1HA GLY 20 7.497 2.790 3.187 76 2HA GLY 20 2HA GLY 20 8.758 3.943 3.575 77 H THR 21 H THR 21 7.483 3.897 0.279 78 HA THR 21 HA THR 21 5.540 5.973 0.842 79 HB THR 21 HB THR 21 8.140 6.430 -0.704 80 HG1 THR 21 1HG THR 21 6.660 7.706 1.489 81 1HG2 THR 21 1HG2 THR 21 5.535 8.021 -0.611 82 2HG2 THR 21 2HG2 THR 21 7.102 8.803 -0.933 83 3HG2 THR 21 3HG2 THR 21 6.482 7.560 -2.047 84 H CYS 22 H CYS 22 3.955 4.570 0.077 85 HA CYS 22 HA CYS 22 4.113 2.983 -2.120 86 1HB CYS 22 1HB CYS 22 1.637 3.232 -2.273 87 2HB CYS 22 2HB CYS 22 2.248 2.789 -0.692 88 H ASN 23 H ASN 23 3.338 3.292 -4.374 89 HA ASN 23 HA ASN 23 4.127 5.884 -5.310 90 1HB ASN 23 1HB ASN 23 4.135 3.187 -6.339 91 2HB ASN 23 2HB ASN 23 3.147 4.145 -7.424 92 1HD2 ASN 23 1HD2 ASN 23 6.300 3.623 -6.073 93 2HD2 ASN 23 2HD2 ASN 23 7.209 4.646 -7.133 94 H THR 24 H THR 24 1.321 4.549 -4.099 95 HA THR 24 HA THR 24 -0.387 6.074 -5.957 96 HB THR 24 HB THR 24 -0.732 3.599 -6.080 97 HG1 THR 24 1HG THR 24 -2.734 5.055 -4.498 98 1HG2 THR 24 1HG2 THR 24 -1.947 2.641 -3.976 99 2HG2 THR 24 2HG2 THR 24 -0.171 2.740 -3.905 100 3HG2 THR 24 3HG2 THR 24 -1.164 3.965 -3.082 101 HA PRO 25 HA PRO 25 -1.476 8.467 -2.562 102 1HB PRO 25 1HB PRO 25 -3.787 9.603 -3.481 103 2HB PRO 25 2HB PRO 25 -2.193 10.180 -3.925 104 1HG PRO 25 1HG PRO 25 -4.108 8.606 -5.535 105 2HG PRO 25 2HG PRO 25 -2.728 9.542 -6.075 106 1HD PRO 25 1HD PRO 25 -2.877 6.688 -5.831 107 2HD PRO 25 2HD PRO 25 -1.464 7.630 -6.259 108 H GLY 26 H GLY 26 -3.471 9.100 -1.110 109 1HA GLY 26 1HA GLY 26 -4.637 8.130 0.595 110 2HA GLY 26 2HA GLY 26 -5.673 7.677 -0.744 111 H CYS 27 H CYS 27 -2.403 6.536 0.376 112 HA CYS 27 HA CYS 27 -3.564 3.846 0.464 113 1HB CYS 27 1HB CYS 27 -2.001 3.047 -0.880 114 2HB CYS 27 2HB CYS 27 -1.600 4.708 -1.274 115 H THR 28 H THR 28 -2.422 2.400 2.085 116 HA THR 28 HA THR 28 -1.263 4.001 4.272 117 HB THR 28 HB THR 28 -3.485 1.959 4.178 118 HG1 THR 28 1HG THR 28 -3.584 4.384 4.526 119 1HG2 THR 28 1HG2 THR 28 -3.002 2.020 6.837 120 2HG2 THR 28 2HG2 THR 28 -2.326 0.736 5.806 121 3HG2 THR 28 3HG2 THR 28 -1.317 2.127 6.273 122 H CYS 29 H CYS 29 0.785 3.520 3.069 123 HA CYS 29 HA CYS 29 1.829 1.162 2.472 124 1HB CYS 29 1HB CYS 29 3.077 3.198 2.241 125 2HB CYS 29 2HB CYS 29 3.162 3.416 3.978 126 H SER 30 H SER 30 1.939 -0.797 3.512 127 HA SER 30 HA SER 30 2.117 -0.690 6.422 128 1HB SER 30 1HB SER 30 -0.085 -1.525 5.728 129 2HB SER 30 2HB SER 30 0.653 -2.699 4.657 130 HG SER 30 HG SER 30 1.378 -3.907 6.397 131 H TRP 31 H TRP 31 3.502 -1.672 3.414 132 HA TRP 31 HA TRP 31 5.314 -2.824 2.879 133 1HB TRP 31 1HB TRP 31 5.913 -1.656 5.342 134 2HB TRP 31 2HB TRP 31 6.422 -3.324 5.517 135 HD1 TRP 31 HD TRP 31 7.503 -0.092 3.910 136 HE1 TRP 31 1HE TRP 31 9.747 -0.343 2.544 137 HE3 TRP 31 3HE TRP 31 7.609 -5.175 4.009 138 HZ2 TRP 31 2HZ TRP 31 11.280 -2.589 1.677 139 HZ3 TRP 31 3HZ TRP 31 9.514 -6.318 2.880 140 HH2 TRP 31 HH TRP 31 11.309 -5.110 1.741 141 HA PRO 32 HA PRO 32 6.538 -4.133 2.321 142 1HB PRO 32 1HB PRO 32 6.515 -6.011 0.335 143 2HB PRO 32 2HB PRO 32 7.590 -6.090 1.716 144 1HG PRO 32 1HG PRO 32 5.155 -7.674 1.169 145 2HG PRO 32 2HG PRO 32 6.455 -8.013 2.295 146 1HD PRO 32 1HD PRO 32 3.850 -6.998 2.936 147 2HD PRO 32 2HD PRO 32 5.187 -7.227 4.044 148 H VAL 33 H VAL 33 3.303 -5.063 1.758 149 HA VAL 33 HA VAL 33 3.241 -3.201 -0.514 150 HB VAL 33 HB VAL 33 0.983 -5.048 0.006 151 1HG1 VAL 33 1HG1 VAL 33 1.335 -5.297 -2.557 152 2HG1 VAL 33 2HG1 VAL 33 0.718 -3.756 -1.917 153 3HG1 VAL 33 3HG1 VAL 33 2.430 -3.906 -2.378 154 1HG2 VAL 33 1HG2 VAL 33 2.297 -6.844 -1.325 155 2HG2 VAL 33 2HG2 VAL 33 3.748 -5.997 -0.737 156 3HG2 VAL 33 3HG2 VAL 33 2.591 -6.691 0.424 157 H CYS 34 H CYS 34 1.557 -1.610 -0.583 158 HA CYS 34 HA CYS 34 0.973 -0.533 1.939 159 1HB CYS 34 1HB CYS 34 0.557 1.290 0.759 160 2HB CYS 34 2HB CYS 34 0.991 0.376 -0.671 161 H THR 35 H THR 35 -1.577 0.190 2.225 162 HA THR 35 HA THR 35 -3.337 -2.032 1.585 163 HB THR 35 HB THR 35 -3.942 -2.103 4.117 164 HG1 THR 35 1HG THR 35 -1.229 -0.998 4.145 165 1HG2 THR 35 1HG2 THR 35 -1.053 -2.921 3.591 166 2HG2 THR 35 2HG2 THR 35 -2.252 -3.721 4.636 167 3HG2 THR 35 3HG2 THR 35 -2.408 -3.820 2.866 168 H ARG 36 H ARG 36 -5.628 -1.545 2.155 169 HA ARG 36 HA ARG 36 -6.023 1.266 1.653 170 1HB ARG 36 1HB ARG 36 -7.146 -0.824 0.412 171 2HB ARG 36 2HB ARG 36 -8.274 -0.762 1.752 172 1HG ARG 36 1HG ARG 36 -9.064 1.393 1.171 173 2HG ARG 36 2HG ARG 36 -7.620 1.791 0.261 174 1HD ARG 36 1HD ARG 36 -8.919 1.284 -1.564 175 2HD ARG 36 2HD ARG 36 -8.494 -0.372 -1.182 176 HE ARG 36 HE ARG 36 -10.705 -0.750 -0.533 177 1HH1 ARG 36 2HH2 ARG 36 -10.080 2.713 -0.464 178 2HH1 ARG 36 1HH2 ARG 36 -11.725 3.132 -0.117 179 1HH2 ARG 36 2HH1 ARG 36 -12.875 -0.197 -0.075 180 2HH2 ARG 36 1HH1 ARG 36 -13.325 1.465 0.105 Start of MODEL 14 1 H ASN 8 H ASN 8 -5.680 1.869 3.395 2 HA ASN 8 HA ASN 8 -5.135 2.034 5.537 3 1HB ASN 8 1HB ASN 8 -8.159 2.015 5.344 4 2HB ASN 8 2HB ASN 8 -7.439 2.142 6.936 5 1HD2 ASN 8 1HD2 ASN 8 -8.025 4.204 7.350 6 2HD2 ASN 8 2HD2 ASN 8 -7.413 5.594 6.517 7 H GLY 9 H GLY 9 -5.587 -0.887 4.478 8 1HA GLY 9 1HA GLY 9 -4.839 -2.378 6.589 9 2HA GLY 9 2HA GLY 9 -6.578 -2.314 6.793 10 H LEU 10 H LEU 10 -7.690 -2.464 4.324 11 HA LEU 10 HA LEU 10 -7.309 -5.153 3.638 12 1HB LEU 10 1HB LEU 10 -9.018 -2.919 2.870 13 2HB LEU 10 2HB LEU 10 -8.631 -3.960 1.515 14 HG LEU 10 HG LEU 10 -9.788 -4.948 4.134 15 1HD1 LEU 10 1HD1 LEU 10 -11.857 -4.475 3.456 16 2HD1 LEU 10 2HD1 LEU 10 -11.105 -3.400 2.253 17 3HD1 LEU 10 3HD1 LEU 10 -11.542 -5.065 1.806 18 1HD2 LEU 10 1HD2 LEU 10 -8.504 -6.634 2.898 19 2HD2 LEU 10 2HD2 LEU 10 -10.243 -7.010 2.919 20 3HD2 LEU 10 3HD2 LEU 10 -9.498 -6.331 1.452 21 HA PRO 11 HA PRO 11 -3.822 -4.503 1.078 22 1HB PRO 11 1HB PRO 11 -3.187 -7.136 0.716 23 2HB PRO 11 2HB PRO 11 -2.631 -6.196 2.087 24 1HG PRO 11 1HG PRO 11 -4.749 -8.256 1.990 25 2HG PRO 11 2HG PRO 11 -3.897 -7.623 3.384 26 1HD PRO 11 1HD PRO 11 -6.566 -6.969 2.562 27 2HD PRO 11 2HD PRO 11 -5.672 -6.252 3.886 28 H VAL 12 H VAL 12 -5.215 -3.500 -0.513 29 HA VAL 12 HA VAL 12 -5.314 -5.252 -2.818 30 HB VAL 12 HB VAL 12 -7.663 -4.558 -3.293 31 1HG1 VAL 12 1HG1 VAL 12 -7.069 -6.798 -2.408 32 2HG1 VAL 12 2HG1 VAL 12 -7.314 -6.187 -0.754 33 3HG1 VAL 12 3HG1 VAL 12 -8.684 -6.258 -1.888 34 1HG2 VAL 12 1HG2 VAL 12 -7.260 -2.977 -0.929 35 2HG2 VAL 12 2HG2 VAL 12 -8.655 -3.010 -2.034 36 3HG2 VAL 12 3HG2 VAL 12 -8.594 -4.121 -0.644 37 H CYS 13 H CYS 13 -3.803 -2.846 -1.723 38 HA CYS 13 HA CYS 13 -4.700 -0.576 -3.098 39 1HB CYS 13 1HB CYS 13 -2.560 -1.278 -1.356 40 2HB CYS 13 2HB CYS 13 -1.860 -0.515 -2.769 41 H GLY 14 H GLY 14 -2.091 -3.023 -3.777 42 1HA GLY 14 1HA GLY 14 -1.782 -3.967 -5.908 43 2HA GLY 14 2HA GLY 14 -2.502 -2.553 -6.650 44 H GLU 15 H GLU 15 -0.613 -1.293 -4.211 45 HA GLU 15 HA GLU 15 1.737 -1.232 -5.938 46 1HB GLU 15 1HB GLU 15 0.694 1.110 -4.289 47 2HB GLU 15 2HB GLU 15 2.059 1.133 -5.387 48 1HG GLU 15 1HG GLU 15 0.248 2.079 -6.631 49 2HG GLU 15 2HG GLU 15 0.425 0.451 -7.255 50 HE2 GLU 15 HE GLU 15 -2.629 1.586 -4.971 51 H THR 16 H THR 16 3.779 -1.283 -4.885 52 HA THR 16 HA THR 16 3.611 -2.109 -2.082 53 HB THR 16 HB THR 16 6.146 -2.284 -3.686 54 HG1 THR 16 1HG THR 16 4.861 -3.091 -5.321 55 1HG2 THR 16 1HG2 THR 16 5.682 -4.782 -2.859 56 2HG2 THR 16 2HG2 THR 16 6.289 -3.568 -1.708 57 3HG2 THR 16 3HG2 THR 16 4.558 -3.978 -1.737 58 H CYS 17 H CYS 17 5.724 -1.494 -0.794 59 HA CYS 17 HA CYS 17 6.596 1.179 -1.421 60 1HB CYS 17 1HB CYS 17 5.969 2.063 0.809 61 2HB CYS 17 2HB CYS 17 4.614 1.769 -0.263 62 H VAL 18 H VAL 18 8.504 -0.357 -1.689 63 HA VAL 18 HA VAL 18 9.495 -1.597 0.703 64 HB VAL 18 HB VAL 18 10.992 -1.178 -1.873 65 1HG1 VAL 18 1HG1 VAL 18 12.126 -3.198 -1.299 66 2HG1 VAL 18 2HG1 VAL 18 12.100 -2.187 0.165 67 3HG1 VAL 18 3HG1 VAL 18 10.971 -3.554 0.008 68 1HG2 VAL 18 1HG2 VAL 18 8.500 -2.689 -1.455 69 2HG2 VAL 18 2HG2 VAL 18 9.281 -2.152 -2.962 70 3HG2 VAL 18 3HG2 VAL 18 9.822 -3.648 -2.164 71 H GLY 19 H GLY 19 9.728 1.505 -0.931 72 1HA GLY 19 1HA GLY 19 12.155 2.237 0.528 73 2HA GLY 19 2HA GLY 19 11.338 3.163 -0.716 74 H GLY 20 H GLY 20 8.711 2.270 0.919 75 1HA GLY 20 1HA GLY 20 7.772 2.938 2.975 76 2HA GLY 20 2HA GLY 20 8.999 4.178 3.140 77 H THR 21 H THR 21 7.676 3.789 -0.077 78 HA THR 21 HA THR 21 5.633 5.819 0.377 79 HB THR 21 HB THR 21 8.099 6.138 -1.407 80 HG1 THR 21 1HG THR 21 7.969 8.190 -0.003 81 1HG2 THR 21 1HG2 THR 21 6.412 7.130 -2.761 82 2HG2 THR 21 2HG2 THR 21 5.426 7.587 -1.351 83 3HG2 THR 21 3HG2 THR 21 6.917 8.484 -1.723 84 H CYS 22 H CYS 22 3.996 4.400 -0.138 85 HA CYS 22 HA CYS 22 3.999 2.464 -2.007 86 1HB CYS 22 1HB CYS 22 1.542 2.848 -2.209 87 2HB CYS 22 2HB CYS 22 2.143 2.675 -0.572 88 H ASN 23 H ASN 23 3.880 5.997 -2.434 89 HA ASN 23 HA ASN 23 4.380 7.173 -4.222 90 1HB ASN 23 1HB ASN 23 5.347 4.813 -5.127 91 2HB ASN 23 2HB ASN 23 3.958 4.915 -6.191 92 1HD2 ASN 23 1HD2 ASN 23 5.125 5.209 -8.033 93 2HD2 ASN 23 2HD2 ASN 23 6.000 6.656 -8.415 94 H THR 24 H THR 24 1.639 5.415 -3.477 95 HA THR 24 HA THR 24 0.041 6.759 -5.558 96 HB THR 24 HB THR 24 0.092 4.287 -5.853 97 HG1 THR 24 1HG THR 24 -2.129 4.407 -6.092 98 1HG2 THR 24 1HG2 THR 24 -1.487 3.336 -3.748 99 2HG2 THR 24 2HG2 THR 24 0.252 3.017 -3.943 100 3HG2 THR 24 3HG2 THR 24 -0.296 4.361 -2.914 101 HA PRO 25 HA PRO 25 -1.967 8.737 -2.321 102 1HB PRO 25 1HB PRO 25 -4.277 9.513 -3.558 103 2HB PRO 25 2HB PRO 25 -2.761 10.374 -3.731 104 1HG PRO 25 1HG PRO 25 -4.109 8.587 -5.663 105 2HG PRO 25 2HG PRO 25 -2.849 9.771 -5.956 106 1HD PRO 25 1HD PRO 25 -2.531 6.923 -5.814 107 2HD PRO 25 2HD PRO 25 -1.256 8.113 -5.991 108 H GLY 26 H GLY 26 -4.114 8.909 -1.066 109 1HA GLY 26 1HA GLY 26 -5.352 7.668 0.381 110 2HA GLY 26 2HA GLY 26 -6.116 7.144 -1.107 111 H CYS 27 H CYS 27 -2.790 6.457 0.168 112 HA CYS 27 HA CYS 27 -3.536 3.623 0.116 113 1HB CYS 27 1HB CYS 27 -1.819 3.183 -1.195 114 2HB CYS 27 2HB CYS 27 -1.563 4.906 -1.383 115 H THR 28 H THR 28 -2.239 2.292 1.746 116 HA THR 28 HA THR 28 -1.392 3.924 4.039 117 HB THR 28 HB THR 28 -3.434 1.671 3.885 118 HG1 THR 28 1HG THR 28 -4.457 3.644 4.100 119 1HG2 THR 28 1HG2 THR 28 -2.864 0.907 5.960 120 2HG2 THR 28 2HG2 THR 28 -1.413 1.937 5.922 121 3HG2 THR 28 3HG2 THR 28 -2.936 2.569 6.593 122 H CYS 29 H CYS 29 0.715 3.483 2.864 123 HA CYS 29 HA CYS 29 1.844 1.141 2.372 124 1HB CYS 29 1HB CYS 29 2.989 3.277 2.153 125 2HB CYS 29 2HB CYS 29 3.118 3.423 3.895 126 H SER 30 H SER 30 1.787 -0.779 3.488 127 HA SER 30 HA SER 30 2.015 -0.575 6.389 128 1HB SER 30 1HB SER 30 -0.222 -1.397 5.469 129 2HB SER 30 2HB SER 30 0.623 -2.799 4.839 130 HG SER 30 HG SER 30 1.338 -3.238 7.078 131 H TRP 31 H TRP 31 3.388 -1.656 3.424 132 HA TRP 31 HA TRP 31 5.173 -2.865 2.924 133 1HB TRP 31 1HB TRP 31 5.774 -1.693 5.387 134 2HB TRP 31 2HB TRP 31 6.245 -3.370 5.570 135 HD1 TRP 31 HD TRP 31 7.367 -0.170 3.893 136 HE1 TRP 31 1HE TRP 31 9.631 -0.473 2.571 137 HE3 TRP 31 3HE TRP 31 7.462 -5.247 4.176 138 HZ2 TRP 31 2HZ TRP 31 11.172 -2.751 1.809 139 HZ3 TRP 31 3HZ TRP 31 9.381 -6.432 3.117 140 HH2 TRP 31 HH TRP 31 11.194 -5.268 1.964 141 HA PRO 32 HA PRO 32 6.403 -4.220 2.435 142 1HB PRO 32 1HB PRO 32 6.399 -6.131 0.482 143 2HB PRO 32 2HB PRO 32 7.424 -6.213 1.900 144 1HG PRO 32 1HG PRO 32 4.968 -7.745 1.298 145 2HG PRO 32 2HG PRO 32 6.220 -8.095 2.473 146 1HD PRO 32 1HD PRO 32 3.622 -7.004 3.007 147 2HD PRO 32 2HD PRO 32 4.915 -7.247 4.165 148 H VAL 33 H VAL 33 3.160 -5.042 1.809 149 HA VAL 33 HA VAL 33 3.225 -3.238 -0.510 150 HB VAL 33 HB VAL 33 0.959 -5.101 0.052 151 1HG1 VAL 33 1HG1 VAL 33 0.316 -4.411 -1.966 152 2HG1 VAL 33 2HG1 VAL 33 1.734 -3.339 -2.036 153 3HG1 VAL 33 3HG1 VAL 33 1.838 -4.994 -2.681 154 1HG2 VAL 33 1HG2 VAL 33 2.475 -6.803 0.199 155 2HG2 VAL 33 2HG2 VAL 33 2.383 -6.682 -1.574 156 3HG2 VAL 33 3HG2 VAL 33 3.730 -5.916 -0.698 157 H CYS 34 H CYS 34 1.567 -1.613 -0.669 158 HA CYS 34 HA CYS 34 0.944 -0.470 1.821 159 1HB CYS 34 1HB CYS 34 0.685 1.342 0.588 160 2HB CYS 34 2HB CYS 34 1.055 0.377 -0.827 161 H THR 35 H THR 35 -1.510 0.256 2.208 162 HA THR 35 HA THR 35 -3.318 -1.944 1.511 163 HB THR 35 HB THR 35 -4.046 -1.931 3.952 164 HG1 THR 35 1HG THR 35 -1.531 -0.424 4.093 165 1HG2 THR 35 1HG2 THR 35 -1.042 -2.405 3.837 166 2HG2 THR 35 2HG2 THR 35 -2.269 -3.302 4.763 167 3HG2 THR 35 3HG2 THR 35 -2.161 -3.505 2.997 168 H ARG 36 H ARG 36 -5.646 -1.368 2.090 169 HA ARG 36 HA ARG 36 -5.968 1.407 1.318 170 1HB ARG 36 1HB ARG 36 -8.100 0.774 0.384 171 2HB ARG 36 2HB ARG 36 -6.982 -0.493 -0.081 172 1HG ARG 36 1HG ARG 36 -8.349 -2.009 0.901 173 2HG ARG 36 2HG ARG 36 -7.985 -1.289 2.457 174 1HD ARG 36 1HD ARG 36 -10.210 -0.785 2.562 175 2HD ARG 36 2HD ARG 36 -9.847 0.505 1.433 176 HE ARG 36 HE ARG 36 -10.284 -2.039 0.078 177 1HH1 ARG 36 2HH2 ARG 36 -11.911 0.738 1.501 178 2HH1 ARG 36 1HH2 ARG 36 -13.342 0.552 0.544 179 1HH2 ARG 36 2HH1 ARG 36 -12.174 -2.286 -1.185 180 2HH2 ARG 36 1HH1 ARG 36 -13.493 -1.180 -0.993 Start of MODEL 15 1 H ASN 8 H ASN 8 -6.841 2.244 3.212 2 HA ASN 8 HA ASN 8 -8.230 2.405 4.902 3 1HB ASN 8 1HB ASN 8 -9.994 1.163 2.926 4 2HB ASN 8 2HB ASN 8 -10.308 0.473 4.506 5 1HD2 ASN 8 1HD2 ASN 8 -11.742 2.407 2.682 6 2HD2 ASN 8 2HD2 ASN 8 -12.167 3.758 3.679 7 H GLY 9 H GLY 9 -6.119 0.267 4.290 8 1HA GLY 9 1HA GLY 9 -5.148 -1.235 5.739 9 2HA GLY 9 2HA GLY 9 -6.664 -1.420 6.600 10 H LEU 10 H LEU 10 -5.942 -1.721 3.057 11 HA LEU 10 HA LEU 10 -6.692 -4.547 3.273 12 1HB LEU 10 1HB LEU 10 -7.826 -2.416 1.509 13 2HB LEU 10 2HB LEU 10 -7.699 -4.052 0.894 14 HG LEU 10 HG LEU 10 -9.139 -3.315 3.456 15 1HD1 LEU 10 1HD1 LEU 10 -9.995 -3.185 0.637 16 2HD1 LEU 10 2HD1 LEU 10 -11.102 -4.060 1.723 17 3HD1 LEU 10 3HD1 LEU 10 -10.648 -2.377 2.082 18 1HD2 LEU 10 1HD2 LEU 10 -8.734 -5.874 1.944 19 2HD2 LEU 10 2HD2 LEU 10 -8.652 -5.553 3.693 20 3HD2 LEU 10 3HD2 LEU 10 -10.230 -5.619 2.874 21 HA PRO 11 HA PRO 11 -2.897 -4.867 1.172 22 1HB PRO 11 1HB PRO 11 -2.780 -7.593 1.034 23 2HB PRO 11 2HB PRO 11 -2.262 -6.682 2.438 24 1HG PRO 11 1HG PRO 11 -4.723 -8.279 2.069 25 2HG PRO 11 2HG PRO 11 -3.987 -7.724 3.560 26 1HD PRO 11 1HD PRO 11 -6.295 -6.615 2.269 27 2HD PRO 11 2HD PRO 11 -5.491 -5.991 3.697 28 H VAL 12 H VAL 12 -4.667 -3.849 -0.467 29 HA VAL 12 HA VAL 12 -4.167 -5.444 -2.845 30 HB VAL 12 HB VAL 12 -6.547 -5.063 -3.559 31 1HG1 VAL 12 1HG1 VAL 12 -5.970 -7.281 -3.022 32 2HG1 VAL 12 2HG1 VAL 12 -5.834 -6.921 -1.284 33 3HG1 VAL 12 3HG1 VAL 12 -7.435 -6.958 -2.062 34 1HG2 VAL 12 1HG2 VAL 12 -7.831 -3.746 -2.290 35 2HG2 VAL 12 2HG2 VAL 12 -7.866 -5.054 -1.083 36 3HG2 VAL 12 3HG2 VAL 12 -6.644 -3.764 -0.963 37 H CYS 13 H CYS 13 -3.384 -2.808 -1.367 38 HA CYS 13 HA CYS 13 -4.396 -0.618 -2.598 39 1HB CYS 13 1HB CYS 13 -2.778 -0.549 -0.774 40 2HB CYS 13 2HB CYS 13 -1.516 -1.145 -1.835 41 H GLY 14 H GLY 14 -2.389 -3.219 -3.899 42 1HA GLY 14 1HA GLY 14 -2.059 -3.719 -6.104 43 2HA GLY 14 2HA GLY 14 -2.703 -2.158 -6.576 44 H GLU 15 H GLU 15 -0.697 -1.149 -4.241 45 HA GLU 15 HA GLU 15 1.642 -1.215 -5.981 46 1HB GLU 15 1HB GLU 15 0.778 1.169 -4.292 47 2HB GLU 15 2HB GLU 15 2.106 1.119 -5.434 48 1HG GLU 15 1HG GLU 15 -0.783 0.592 -6.260 49 2HG GLU 15 2HG GLU 15 -0.081 2.198 -6.269 50 HE2 GLU 15 HE GLU 15 0.445 -0.632 -8.826 51 H THR 16 H THR 16 3.711 -1.278 -4.920 52 HA THR 16 HA THR 16 3.511 -2.223 -2.158 53 HB THR 16 HB THR 16 6.028 -2.333 -3.826 54 HG1 THR 16 1HG THR 16 4.882 -3.455 -5.348 55 1HG2 THR 16 1HG2 THR 16 6.269 -3.565 -1.811 56 2HG2 THR 16 2HG2 THR 16 4.563 -4.072 -1.809 57 3HG2 THR 16 3HG2 THR 16 5.712 -4.817 -2.947 58 H CYS 17 H CYS 17 5.786 -1.709 -0.952 59 HA CYS 17 HA CYS 17 6.606 0.998 -1.411 60 1HB CYS 17 1HB CYS 17 5.956 1.881 0.741 61 2HB CYS 17 2HB CYS 17 4.546 1.398 -0.181 62 H VAL 18 H VAL 18 8.440 -0.672 -1.783 63 HA VAL 18 HA VAL 18 9.466 -1.977 0.541 64 HB VAL 18 HB VAL 18 10.925 -1.471 -2.043 65 1HG1 VAL 18 1HG1 VAL 18 12.117 -2.548 -0.131 66 2HG1 VAL 18 2HG1 VAL 18 10.925 -3.869 -0.183 67 3HG1 VAL 18 3HG1 VAL 18 11.997 -3.582 -1.574 68 1HG2 VAL 18 1HG2 VAL 18 8.978 -2.269 -2.984 69 2HG2 VAL 18 2HG2 VAL 18 9.822 -3.797 -2.635 70 3HG2 VAL 18 3HG2 VAL 18 8.539 -3.218 -1.544 71 H GLY 19 H GLY 19 9.666 1.205 -0.890 72 1HA GLY 19 1HA GLY 19 12.076 1.822 0.694 73 2HA GLY 19 2HA GLY 19 11.471 2.736 -0.674 74 H GLY 20 H GLY 20 8.651 1.953 0.796 75 1HA GLY 20 1HA GLY 20 7.493 2.800 2.630 76 2HA GLY 20 2HA GLY 20 8.778 3.953 2.933 77 H THR 21 H THR 21 7.784 3.545 -0.415 78 HA THR 21 HA THR 21 6.150 5.987 -0.210 79 HB THR 21 HB THR 21 8.394 5.252 -2.153 80 HG1 THR 21 1HG THR 21 9.219 6.483 -0.474 81 1HG2 THR 21 1HG2 THR 21 7.359 7.914 -2.544 82 2HG2 THR 21 2HG2 THR 21 7.439 6.593 -3.733 83 3HG2 THR 21 3HG2 THR 21 5.997 6.779 -2.706 84 H CYS 22 H CYS 22 4.415 4.302 0.017 85 HA CYS 22 HA CYS 22 3.778 2.394 -1.731 86 1HB CYS 22 1HB CYS 22 1.416 2.847 -1.259 87 2HB CYS 22 2HB CYS 22 2.413 2.867 0.182 88 H ASN 23 H ASN 23 3.613 5.945 -2.203 89 HA ASN 23 HA ASN 23 3.366 7.183 -3.965 90 1HB ASN 23 1HB ASN 23 4.901 5.112 -4.907 91 2HB ASN 23 2HB ASN 23 3.519 4.948 -5.973 92 1HD2 ASN 23 1HD2 ASN 23 4.620 5.576 -7.783 93 2HD2 ASN 23 2HD2 ASN 23 5.129 7.203 -8.093 94 H THR 24 H THR 24 1.101 5.444 -2.783 95 HA THR 24 HA THR 24 -0.726 5.577 -5.093 96 HB THR 24 HB THR 24 -1.305 3.826 -2.714 97 HG1 THR 24 1HG THR 24 0.920 3.350 -3.120 98 1HG2 THR 24 1HG2 THR 24 -1.780 3.869 -5.685 99 2HG2 THR 24 2HG2 THR 24 -1.559 2.272 -4.933 100 3HG2 THR 24 3HG2 THR 24 -2.867 3.343 -4.377 101 HA PRO 25 HA PRO 25 -3.020 8.427 -2.853 102 1HB PRO 25 1HB PRO 25 -5.480 8.163 -4.014 103 2HB PRO 25 2HB PRO 25 -4.172 9.081 -4.735 104 1HG PRO 25 1HG PRO 25 -5.202 6.416 -5.493 105 2HG PRO 25 2HG PRO 25 -4.214 7.518 -6.431 106 1HD PRO 25 1HD PRO 25 -3.331 5.148 -5.079 107 2HD PRO 25 2HD PRO 25 -2.325 6.311 -5.920 108 H GLY 26 H GLY 26 -4.096 8.723 -0.952 109 1HA GLY 26 1HA GLY 26 -4.927 7.970 1.008 110 2HA GLY 26 2HA GLY 26 -6.188 7.293 -0.002 111 H CYS 27 H CYS 27 -2.673 6.461 0.438 112 HA CYS 27 HA CYS 27 -3.560 3.715 0.927 113 1HB CYS 27 1HB CYS 27 -1.965 2.987 -0.426 114 2HB CYS 27 2HB CYS 27 -1.807 4.643 -0.975 115 H THR 28 H THR 28 -1.848 2.505 2.412 116 HA THR 28 HA THR 28 -0.735 4.313 4.420 117 HB THR 28 HB THR 28 -3.143 3.622 5.022 118 HG1 THR 28 1HG THR 28 -2.146 3.923 6.973 119 1HG2 THR 28 1HG2 THR 28 -2.486 1.108 4.204 120 2HG2 THR 28 2HG2 THR 28 -1.983 0.991 5.907 121 3HG2 THR 28 3HG2 THR 28 -3.667 1.403 5.503 122 H CYS 29 H CYS 29 1.062 3.462 2.857 123 HA CYS 29 HA CYS 29 2.043 1.132 2.486 124 1HB CYS 29 1HB CYS 29 3.386 3.083 2.133 125 2HB CYS 29 2HB CYS 29 3.544 3.369 3.854 126 H SER 30 H SER 30 2.017 -0.792 3.595 127 HA SER 30 HA SER 30 2.371 -0.605 6.485 128 1HB SER 30 1HB SER 30 0.090 -1.309 5.968 129 2HB SER 30 2HB SER 30 0.665 -2.534 4.855 130 HG SER 30 HG SER 30 0.364 -2.666 7.598 131 H TRP 31 H TRP 31 3.588 -1.710 3.469 132 HA TRP 31 HA TRP 31 5.299 -2.988 2.893 133 1HB TRP 31 1HB TRP 31 6.027 -1.894 5.364 134 2HB TRP 31 2HB TRP 31 6.439 -3.593 5.487 135 HD1 TRP 31 HD TRP 31 7.593 -0.394 3.805 136 HE1 TRP 31 1HE TRP 31 9.806 -0.744 2.412 137 HE3 TRP 31 3HE TRP 31 7.576 -5.472 4.066 138 HZ2 TRP 31 2HZ TRP 31 11.269 -3.054 1.594 139 HZ3 TRP 31 3HZ TRP 31 9.433 -6.698 2.943 140 HH2 TRP 31 HH TRP 31 11.237 -5.572 1.738 141 HA PRO 32 HA PRO 32 6.481 -4.394 2.376 142 1HB PRO 32 1HB PRO 32 6.367 -6.281 0.402 143 2HB PRO 32 2HB PRO 32 7.408 -6.423 1.804 144 1HG PRO 32 1HG PRO 32 4.881 -7.841 1.222 145 2HG PRO 32 2HG PRO 32 6.133 -8.259 2.373 146 1HD PRO 32 1HD PRO 32 3.593 -7.063 2.959 147 2HD PRO 32 2HD PRO 32 4.891 -7.374 4.094 148 H VAL 33 H VAL 33 3.195 -5.053 1.803 149 HA VAL 33 HA VAL 33 3.304 -3.259 -0.521 150 HB VAL 33 HB VAL 33 1.021 -5.083 0.186 151 1HG1 VAL 33 1HG1 VAL 33 0.893 -5.016 -2.415 152 2HG1 VAL 33 2HG1 VAL 33 0.347 -3.602 -1.481 153 3HG1 VAL 33 3HG1 VAL 33 1.948 -3.590 -2.260 154 1HG2 VAL 33 1HG2 VAL 33 2.446 -6.362 -1.844 155 2HG2 VAL 33 2HG2 VAL 33 3.691 -5.880 -0.668 156 3HG2 VAL 33 3HG2 VAL 33 2.312 -6.878 -0.147 157 H CYS 34 H CYS 34 1.655 -1.588 -0.673 158 HA CYS 34 HA CYS 34 1.081 -0.513 1.924 159 1HB CYS 34 1HB CYS 34 0.843 1.489 0.908 160 2HB CYS 34 2HB CYS 34 1.843 0.695 -0.293 161 H THR 35 H THR 35 -1.181 0.225 2.483 162 HA THR 35 HA THR 35 -3.226 -1.449 1.186 163 HB THR 35 HB THR 35 -4.120 -1.448 3.714 164 HG1 THR 35 1HG THR 35 -2.371 -1.111 5.143 165 1HG2 THR 35 1HG2 THR 35 -1.910 -3.248 3.926 166 2HG2 THR 35 2HG2 THR 35 -3.579 -3.653 3.459 167 3HG2 THR 35 3HG2 THR 35 -2.380 -3.244 2.209 168 H ARG 36 H ARG 36 -5.395 -0.615 1.235 169 HA ARG 36 HA ARG 36 -5.372 2.160 0.824 170 1HB ARG 36 1HB ARG 36 -7.451 -0.035 0.769 171 2HB ARG 36 2HB ARG 36 -8.015 1.625 0.806 172 1HG ARG 36 1HG ARG 36 -7.218 2.100 -1.319 173 2HG ARG 36 2HG ARG 36 -5.825 1.049 -1.153 174 1HD ARG 36 1HD ARG 36 -7.020 -0.294 -2.599 175 2HD ARG 36 2HD ARG 36 -7.778 -0.848 -1.120 176 HE ARG 36 HE ARG 36 -9.273 1.390 -1.845 177 1HH1 ARG 36 2HH2 ARG 36 -8.396 -1.632 -3.418 178 2HH1 ARG 36 1HH2 ARG 36 -9.833 -1.695 -4.384 179 1HH2 ARG 36 2HH1 ARG 36 -11.168 1.309 -3.119 180 2HH2 ARG 36 1HH1 ARG 36 -11.420 -0.010 -4.213 Start of MODEL 16 1 H ASN 8 H ASN 8 -6.292 2.151 3.465 2 HA ASN 8 HA ASN 8 -5.679 2.037 5.787 3 1HB ASN 8 1HB ASN 8 -8.576 1.721 4.944 4 2HB ASN 8 2HB ASN 8 -8.208 1.790 6.656 5 1HD2 ASN 8 1HD2 ASN 8 -9.593 3.642 4.774 6 2HD2 ASN 8 2HD2 ASN 8 -8.837 5.188 4.970 7 H GLY 9 H GLY 9 -5.533 -0.776 4.413 8 1HA GLY 9 1HA GLY 9 -4.951 -2.475 6.299 9 2HA GLY 9 2HA GLY 9 -6.689 -2.466 6.516 10 H LEU 10 H LEU 10 -7.787 -2.375 4.016 11 HA LEU 10 HA LEU 10 -7.492 -4.980 3.110 12 1HB LEU 10 1HB LEU 10 -8.672 -2.531 1.799 13 2HB LEU 10 2HB LEU 10 -8.812 -4.151 1.146 14 HG LEU 10 HG LEU 10 -9.661 -3.998 3.945 15 1HD1 LEU 10 1HD1 LEU 10 -11.895 -2.869 2.741 16 2HD1 LEU 10 2HD1 LEU 10 -10.789 -2.081 3.892 17 3HD1 LEU 10 3HD1 LEU 10 -10.537 -1.889 2.140 18 1HD2 LEU 10 1HD2 LEU 10 -11.698 -4.770 2.055 19 2HD2 LEU 10 2HD2 LEU 10 -10.152 -5.558 1.659 20 3HD2 LEU 10 3HD2 LEU 10 -10.857 -5.745 3.283 21 HA PRO 11 HA PRO 11 -3.757 -4.336 0.895 22 1HB PRO 11 1HB PRO 11 -3.120 -6.975 0.582 23 2HB PRO 11 2HB PRO 11 -2.661 -6.039 1.990 24 1HG PRO 11 1HG PRO 11 -4.783 -8.080 1.733 25 2HG PRO 11 2HG PRO 11 -4.033 -7.455 3.188 26 1HD PRO 11 1HD PRO 11 -6.626 -6.778 2.167 27 2HD PRO 11 2HD PRO 11 -5.828 -6.067 3.555 28 H VAL 12 H VAL 12 -5.417 -3.415 -0.671 29 HA VAL 12 HA VAL 12 -5.236 -5.143 -3.025 30 HB VAL 12 HB VAL 12 -7.552 -4.365 -3.623 31 1HG1 VAL 12 1HG1 VAL 12 -7.928 -5.954 -1.150 32 2HG1 VAL 12 2HG1 VAL 12 -8.397 -6.310 -2.829 33 3HG1 VAL 12 3HG1 VAL 12 -6.722 -6.586 -2.296 34 1HG2 VAL 12 1HG2 VAL 12 -7.237 -2.892 -1.174 35 2HG2 VAL 12 2HG2 VAL 12 -8.571 -2.844 -2.353 36 3HG2 VAL 12 3HG2 VAL 12 -8.609 -4.015 -1.013 37 H CYS 13 H CYS 13 -3.808 -2.701 -1.812 38 HA CYS 13 HA CYS 13 -4.571 -0.447 -3.259 39 1HB CYS 13 1HB CYS 13 -2.067 -1.300 -1.851 40 2HB CYS 13 2HB CYS 13 -2.046 0.139 -2.851 41 H GLY 14 H GLY 14 -2.268 -3.161 -3.887 42 1HA GLY 14 1HA GLY 14 -1.777 -4.039 -5.961 43 2HA GLY 14 2HA GLY 14 -2.449 -2.624 -6.745 44 H GLU 15 H GLU 15 -0.668 -1.244 -4.344 45 HA GLU 15 HA GLU 15 1.750 -1.281 -5.979 46 1HB GLU 15 1HB GLU 15 0.749 1.092 -4.353 47 2HB GLU 15 2HB GLU 15 2.079 1.078 -5.494 48 1HG GLU 15 1HG GLU 15 -0.682 0.265 -6.437 49 2HG GLU 15 2HG GLU 15 -0.316 1.967 -6.235 50 HE2 GLU 15 HE GLU 15 0.155 0.012 -9.215 51 H THR 16 H THR 16 3.763 -1.362 -4.880 52 HA THR 16 HA THR 16 3.520 -2.147 -2.071 53 HB THR 16 HB THR 16 6.065 -2.394 -3.668 54 HG1 THR 16 1HG THR 16 5.061 -3.902 -5.019 55 1HG2 THR 16 1HG2 THR 16 5.595 -4.849 -2.713 56 2HG2 THR 16 2HG2 THR 16 6.241 -3.585 -1.639 57 3HG2 THR 16 3HG2 THR 16 4.505 -3.977 -1.609 58 H CYS 17 H CYS 17 5.701 -1.577 -0.805 59 HA CYS 17 HA CYS 17 6.573 1.095 -1.428 60 1HB CYS 17 1HB CYS 17 5.975 1.998 0.783 61 2HB CYS 17 2HB CYS 17 4.588 1.655 -0.232 62 H VAL 18 H VAL 18 8.479 -0.424 -1.733 63 HA VAL 18 HA VAL 18 9.498 -1.690 0.637 64 HB VAL 18 HB VAL 18 10.948 -1.267 -1.967 65 1HG1 VAL 18 1HG1 VAL 18 12.123 -2.266 0.020 66 2HG1 VAL 18 2HG1 VAL 18 10.972 -3.621 -0.053 67 3HG1 VAL 18 3HG1 VAL 18 12.073 -3.314 -1.418 68 1HG2 VAL 18 1HG2 VAL 18 8.854 -2.064 -2.729 69 2HG2 VAL 18 2HG2 VAL 18 9.905 -3.498 -2.645 70 3HG2 VAL 18 3HG2 VAL 18 8.699 -3.203 -1.369 71 H GLY 19 H GLY 19 9.654 1.438 -0.915 72 1HA GLY 19 1HA GLY 19 12.101 2.145 0.552 73 2HA GLY 19 2HA GLY 19 11.360 3.045 -0.756 74 H GLY 20 H GLY 20 8.668 2.196 0.854 75 1HA GLY 20 1HA GLY 20 7.639 2.967 2.810 76 2HA GLY 20 2HA GLY 20 8.888 4.179 3.008 77 H THR 21 H THR 21 7.691 3.740 -0.257 78 HA THR 21 HA THR 21 5.766 5.921 0.076 79 HB THR 21 HB THR 21 8.136 5.869 -1.868 80 HG1 THR 21 1HG THR 21 8.847 7.496 -0.435 81 1HG2 THR 21 1HG2 THR 21 5.588 7.176 -2.113 82 2HG2 THR 21 2HG2 THR 21 6.761 8.413 -1.601 83 3HG2 THR 21 3HG2 THR 21 7.052 7.469 -3.083 84 H CYS 22 H CYS 22 4.118 4.347 -0.166 85 HA CYS 22 HA CYS 22 3.923 2.376 -1.952 86 1HB CYS 22 1HB CYS 22 1.409 3.166 -2.117 87 2HB CYS 22 2HB CYS 22 2.076 2.461 -0.658 88 H ASN 23 H ASN 23 3.845 5.888 -2.551 89 HA ASN 23 HA ASN 23 4.238 6.972 -4.419 90 1HB ASN 23 1HB ASN 23 5.092 4.499 -5.243 91 2HB ASN 23 2HB ASN 23 3.715 4.691 -6.308 92 1HD2 ASN 23 1HD2 ASN 23 6.481 4.591 -7.016 93 2HD2 ASN 23 2HD2 ASN 23 6.904 6.078 -7.796 94 H THR 24 H THR 24 1.540 5.250 -3.457 95 HA THR 24 HA THR 24 -0.158 6.492 -5.522 96 HB THR 24 HB THR 24 -0.133 4.018 -5.715 97 HG1 THR 24 1HG THR 24 -2.457 4.997 -4.219 98 1HG2 THR 24 1HG2 THR 24 -0.442 4.223 -2.744 99 2HG2 THR 24 2HG2 THR 24 -1.507 3.041 -3.542 100 3HG2 THR 24 3HG2 THR 24 0.259 2.909 -3.718 101 HA PRO 25 HA PRO 25 -2.018 8.624 -2.295 102 1HB PRO 25 1HB PRO 25 -4.390 9.332 -3.455 103 2HB PRO 25 2HB PRO 25 -2.887 10.187 -3.745 104 1HG PRO 25 1HG PRO 25 -4.319 8.303 -5.518 105 2HG PRO 25 2HG PRO 25 -3.080 9.472 -5.929 106 1HD PRO 25 1HD PRO 25 -2.743 6.636 -5.662 107 2HD PRO 25 2HD PRO 25 -1.483 7.818 -5.960 108 H GLY 26 H GLY 26 -4.129 8.861 -0.968 109 1HA GLY 26 1HA GLY 26 -5.277 7.685 0.606 110 2HA GLY 26 2HA GLY 26 -6.115 7.096 -0.815 111 H CYS 27 H CYS 27 -2.749 6.468 0.401 112 HA CYS 27 HA CYS 27 -3.514 3.648 0.602 113 1HB CYS 27 1HB CYS 27 -2.048 3.066 -0.936 114 2HB CYS 27 2HB CYS 27 -1.716 4.756 -1.254 115 H THR 28 H THR 28 -2.399 2.487 2.329 116 HA THR 28 HA THR 28 -1.039 4.278 4.235 117 HB THR 28 HB THR 28 -3.454 3.519 4.787 118 HG1 THR 28 1HG THR 28 -2.640 3.039 6.987 119 1HG2 THR 28 1HG2 THR 28 -2.382 0.995 5.892 120 2HG2 THR 28 2HG2 THR 28 -3.935 1.294 5.075 121 3HG2 THR 28 3HG2 THR 28 -2.470 0.976 4.115 122 H CYS 29 H CYS 29 0.873 3.579 2.870 123 HA CYS 29 HA CYS 29 1.840 1.177 2.462 124 1HB CYS 29 1HB CYS 29 3.144 3.108 1.968 125 2HB CYS 29 2HB CYS 29 3.292 3.535 3.661 126 H SER 30 H SER 30 1.906 -0.692 3.658 127 HA SER 30 HA SER 30 2.301 -0.357 6.530 128 1HB SER 30 1HB SER 30 0.812 -2.157 6.964 129 2HB SER 30 2HB SER 30 0.004 -1.202 5.738 130 HG SER 30 HG SER 30 0.159 -2.819 4.325 131 H TRP 31 H TRP 31 3.532 -1.527 3.558 132 HA TRP 31 HA TRP 31 5.283 -2.769 3.015 133 1HB TRP 31 1HB TRP 31 5.984 -1.582 5.444 134 2HB TRP 31 2HB TRP 31 6.430 -3.266 5.632 135 HD1 TRP 31 HD TRP 31 7.545 -0.106 3.868 136 HE1 TRP 31 1HE TRP 31 9.764 -0.465 2.484 137 HE3 TRP 31 3HE TRP 31 7.581 -5.177 4.242 138 HZ2 TRP 31 2HZ TRP 31 11.251 -2.777 1.719 139 HZ3 TRP 31 3HZ TRP 31 9.452 -6.408 3.147 140 HH2 TRP 31 HH TRP 31 11.245 -5.291 1.919 141 HA PRO 32 HA PRO 32 6.492 -4.151 2.520 142 1HB PRO 32 1HB PRO 32 6.416 -6.086 0.592 143 2HB PRO 32 2HB PRO 32 7.471 -6.166 1.989 144 1HG PRO 32 1HG PRO 32 4.980 -7.667 1.460 145 2HG PRO 32 2HG PRO 32 6.251 -8.023 2.612 146 1HD PRO 32 1HD PRO 32 3.683 -6.884 3.188 147 2HD PRO 32 2HD PRO 32 4.997 -7.132 4.321 148 H VAL 33 H VAL 33 3.229 -4.963 1.950 149 HA VAL 33 HA VAL 33 3.265 -3.120 -0.341 150 HB VAL 33 HB VAL 33 1.025 -5.029 0.113 151 1HG1 VAL 33 1HG1 VAL 33 0.477 -4.362 -1.943 152 2HG1 VAL 33 2HG1 VAL 33 1.861 -3.244 -1.918 153 3HG1 VAL 33 3HG1 VAL 33 2.057 -4.886 -2.575 154 1HG2 VAL 33 1HG2 VAL 33 2.578 -6.703 0.350 155 2HG2 VAL 33 2HG2 VAL 33 2.492 -6.623 -1.426 156 3HG2 VAL 33 3HG2 VAL 33 3.829 -5.827 -0.563 157 H CYS 34 H CYS 34 1.567 -1.538 -0.464 158 HA CYS 34 HA CYS 34 0.895 -0.478 2.043 159 1HB CYS 34 1HB CYS 34 0.509 1.349 0.861 160 2HB CYS 34 2HB CYS 34 0.996 0.446 -0.560 161 H THR 35 H THR 35 -1.659 0.223 2.272 162 HA THR 35 HA THR 35 -3.402 -1.980 1.535 163 HB THR 35 HB THR 35 -4.045 -1.966 4.133 164 HG1 THR 35 1HG THR 35 -1.286 -1.020 3.823 165 1HG2 THR 35 1HG2 THR 35 -3.042 -3.955 2.928 166 2HG2 THR 35 2HG2 THR 35 -1.428 -3.251 3.191 167 3HG2 THR 35 3HG2 THR 35 -2.412 -3.766 4.582 168 H ARG 36 H ARG 36 -5.653 -1.480 1.727 169 HA ARG 36 HA ARG 36 -6.037 1.341 1.453 170 1HB ARG 36 1HB ARG 36 -7.600 -1.151 0.831 171 2HB ARG 36 2HB ARG 36 -8.542 0.295 1.137 172 1HG ARG 36 1HG ARG 36 -6.361 1.053 -0.580 173 2HG ARG 36 2HG ARG 36 -7.050 -0.416 -1.241 174 1HD ARG 36 1HD ARG 36 -8.841 1.889 -0.381 175 2HD ARG 36 2HD ARG 36 -8.090 1.880 -1.963 176 HE ARG 36 HE ARG 36 -9.499 -0.613 -1.287 177 1HH1 ARG 36 2HH2 ARG 36 -9.750 2.569 -2.768 178 2HH1 ARG 36 1HH2 ARG 36 -11.128 2.153 -3.731 179 1HH2 ARG 36 2HH1 ARG 36 -11.317 -1.163 -2.558 180 2HH2 ARG 36 1HH1 ARG 36 -12.026 0.016 -3.611 Start of MODEL 17 1 H ASN 8 H ASN 8 -5.122 0.951 3.760 2 HA ASN 8 HA ASN 8 -5.204 1.589 5.934 3 1HB ASN 8 1HB ASN 8 -6.811 3.697 4.853 4 2HB ASN 8 2HB ASN 8 -7.807 2.924 6.069 5 1HD2 ASN 8 1HD2 ASN 8 -6.054 5.474 5.732 6 2HD2 ASN 8 2HD2 ASN 8 -5.220 5.615 7.244 7 H GLY 9 H GLY 9 -6.386 -0.604 4.281 8 1HA GLY 9 1HA GLY 9 -8.291 -1.615 6.250 9 2HA GLY 9 2HA GLY 9 -8.857 -1.468 4.598 10 H LEU 10 H LEU 10 -8.004 -2.830 2.934 11 HA LEU 10 HA LEU 10 -6.438 -5.073 4.001 12 1HB LEU 10 1HB LEU 10 -8.175 -5.181 1.551 13 2HB LEU 10 2HB LEU 10 -7.547 -6.503 2.517 14 HG LEU 10 HG LEU 10 -9.187 -4.873 4.207 15 1HD1 LEU 10 1HD1 LEU 10 -11.371 -5.189 3.041 16 2HD1 LEU 10 2HD1 LEU 10 -10.299 -3.992 2.274 17 3HD1 LEU 10 3HD1 LEU 10 -10.470 -5.617 1.566 18 1HD2 LEU 10 1HD2 LEU 10 -9.870 -6.876 4.938 19 2HD2 LEU 10 2HD2 LEU 10 -10.278 -7.449 3.303 20 3HD2 LEU 10 3HD2 LEU 10 -8.596 -7.524 3.879 21 HA PRO 11 HA PRO 11 -3.334 -4.154 1.149 22 1HB PRO 11 1HB PRO 11 -2.267 -6.608 0.594 23 2HB PRO 11 2HB PRO 11 -1.906 -5.716 2.059 24 1HG PRO 11 1HG PRO 11 -3.655 -8.074 1.708 25 2HG PRO 11 2HG PRO 11 -2.952 -7.437 3.182 26 1HD PRO 11 1HD PRO 11 -5.671 -7.153 2.315 27 2HD PRO 11 2HD PRO 11 -4.940 -6.420 3.729 28 H VAL 12 H VAL 12 -5.054 -3.343 -0.327 29 HA VAL 12 HA VAL 12 -4.855 -4.962 -2.762 30 HB VAL 12 HB VAL 12 -7.195 -4.320 -3.271 31 1HG1 VAL 12 1HG1 VAL 12 -7.391 -5.796 -0.687 32 2HG1 VAL 12 2HG1 VAL 12 -8.031 -6.207 -2.296 33 3HG1 VAL 12 3HG1 VAL 12 -6.308 -6.467 -1.930 34 1HG2 VAL 12 1HG2 VAL 12 -6.888 -2.604 -1.060 35 2HG2 VAL 12 2HG2 VAL 12 -8.360 -2.885 -2.021 36 3HG2 VAL 12 3HG2 VAL 12 -8.061 -3.843 -0.550 37 H CYS 13 H CYS 13 -3.591 -2.424 -1.403 38 HA CYS 13 HA CYS 13 -4.392 -0.153 -2.669 39 1HB CYS 13 1HB CYS 13 -2.778 0.014 -0.969 40 2HB CYS 13 2HB CYS 13 -1.684 -1.100 -1.762 41 H GLY 14 H GLY 14 -2.245 -2.820 -3.818 42 1HA GLY 14 1HA GLY 14 -2.154 -3.519 -6.038 43 2HA GLY 14 2HA GLY 14 -2.731 -1.954 -6.574 44 H GLU 15 H GLU 15 -0.501 -1.260 -4.174 45 HA GLU 15 HA GLU 15 1.724 -1.359 -6.049 46 1HB GLU 15 1HB GLU 15 0.349 0.983 -5.368 47 2HB GLU 15 2HB GLU 15 1.742 1.017 -4.304 48 1HG GLU 15 1HG GLU 15 2.515 2.093 -6.274 49 2HG GLU 15 2HG GLU 15 3.168 0.472 -6.404 50 HE2 GLU 15 HE GLU 15 2.842 -0.389 -8.215 51 H THR 16 H THR 16 3.866 -0.674 -4.731 52 HA THR 16 HA THR 16 3.706 -2.027 -2.116 53 HB THR 16 HB THR 16 6.228 -2.115 -3.752 54 HG1 THR 16 1HG THR 16 4.786 -2.702 -5.395 55 1HG2 THR 16 1HG2 THR 16 5.732 -4.662 -3.063 56 2HG2 THR 16 2HG2 THR 16 6.411 -3.524 -1.875 57 3HG2 THR 16 3HG2 THR 16 4.670 -3.892 -1.861 58 H CYS 17 H CYS 17 5.837 -1.509 -0.809 59 HA CYS 17 HA CYS 17 6.718 1.195 -1.271 60 1HB CYS 17 1HB CYS 17 6.040 2.077 0.848 61 2HB CYS 17 2HB CYS 17 4.627 1.522 -0.026 62 H VAL 18 H VAL 18 8.527 -0.526 -1.668 63 HA VAL 18 HA VAL 18 9.556 -1.851 0.634 64 HB VAL 18 HB VAL 18 10.995 -1.290 -1.954 65 1HG1 VAL 18 1HG1 VAL 18 11.077 -3.742 -0.171 66 2HG1 VAL 18 2HG1 VAL 18 12.175 -3.320 -1.508 67 3HG1 VAL 18 3HG1 VAL 18 12.194 -2.366 -0.006 68 1HG2 VAL 18 1HG2 VAL 18 8.557 -2.895 -1.495 69 2HG2 VAL 18 2HG2 VAL 18 9.226 -2.223 -3.001 70 3HG2 VAL 18 3HG2 VAL 18 9.868 -3.748 -2.345 71 H GLY 19 H GLY 19 9.739 1.366 -0.702 72 1HA GLY 19 1HA GLY 19 12.156 1.947 0.888 73 2HA GLY 19 2HA GLY 19 11.548 2.893 -0.456 74 H GLY 20 H GLY 20 8.713 2.120 0.934 75 1HA GLY 20 1HA GLY 20 7.599 2.895 2.856 76 2HA GLY 20 2HA GLY 20 8.848 4.099 3.107 77 H THR 21 H THR 21 7.834 3.645 -0.214 78 HA THR 21 HA THR 21 6.001 5.934 0.008 79 HB THR 21 HB THR 21 8.421 5.548 -1.815 80 HG1 THR 21 1HG THR 21 8.803 7.678 -0.817 81 1HG2 THR 21 1HG2 THR 21 6.107 6.479 -2.875 82 2HG2 THR 21 2HG2 THR 21 6.612 7.952 -2.015 83 3HG2 THR 21 3HG2 THR 21 7.673 7.236 -3.251 84 H CYS 22 H CYS 22 4.210 4.522 -0.094 85 HA CYS 22 HA CYS 22 3.909 2.470 -1.877 86 1HB CYS 22 1HB CYS 22 1.494 2.772 -1.585 87 2HB CYS 22 2HB CYS 22 2.374 2.796 -0.070 88 H ASN 23 H ASN 23 3.448 6.020 -2.253 89 HA ASN 23 HA ASN 23 3.397 7.281 -4.024 90 1HB ASN 23 1HB ASN 23 4.602 4.855 -5.078 91 2HB ASN 23 2HB ASN 23 3.514 5.499 -6.290 92 1HD2 ASN 23 1HD2 ASN 23 5.819 5.605 -7.223 93 2HD2 ASN 23 2HD2 ASN 23 6.636 7.126 -7.084 94 H THR 24 H THR 24 1.180 5.108 -3.081 95 HA THR 24 HA THR 24 -0.625 5.477 -5.373 96 HB THR 24 HB THR 24 -1.235 3.646 -3.058 97 HG1 THR 24 1HG THR 24 0.794 3.359 -5.160 98 1HG2 THR 24 1HG2 THR 24 -1.668 3.778 -6.037 99 2HG2 THR 24 2HG2 THR 24 -1.469 2.162 -5.318 100 3HG2 THR 24 3HG2 THR 24 -2.781 3.229 -4.760 101 HA PRO 25 HA PRO 25 -3.006 8.240 -3.113 102 1HB PRO 25 1HB PRO 25 -5.421 8.008 -4.371 103 2HB PRO 25 2HB PRO 25 -4.095 8.957 -5.011 104 1HG PRO 25 1HG PRO 25 -5.082 6.317 -5.901 105 2HG PRO 25 2HG PRO 25 -4.068 7.458 -6.762 106 1HD PRO 25 1HD PRO 25 -3.219 5.043 -5.467 107 2HD PRO 25 2HD PRO 25 -2.191 6.241 -6.229 108 H GLY 26 H GLY 26 -4.153 8.463 -1.244 109 1HA GLY 26 1HA GLY 26 -5.090 7.661 0.643 110 2HA GLY 26 2HA GLY 26 -6.264 6.940 -0.440 111 H CYS 27 H CYS 27 -2.741 6.264 0.175 112 HA CYS 27 HA CYS 27 -3.548 3.497 0.713 113 1HB CYS 27 1HB CYS 27 -2.064 2.769 -0.750 114 2HB CYS 27 2HB CYS 27 -1.865 4.424 -1.290 115 H THR 28 H THR 28 -1.866 2.364 2.213 116 HA THR 28 HA THR 28 -0.610 4.262 4.054 117 HB THR 28 HB THR 28 -3.056 3.474 4.702 118 HG1 THR 28 1HG THR 28 -0.612 3.142 6.296 119 1HG2 THR 28 1HG2 THR 28 -2.255 0.963 4.321 120 2HG2 THR 28 2HG2 THR 28 -1.484 1.176 5.911 121 3HG2 THR 28 3HG2 THR 28 -3.247 1.356 5.745 122 H CYS 29 H CYS 29 1.432 3.704 3.277 123 HA CYS 29 HA CYS 29 2.421 1.350 2.581 124 1HB CYS 29 1HB CYS 29 3.686 3.462 2.692 125 2HB CYS 29 2HB CYS 29 3.811 3.299 4.432 126 H SER 30 H SER 30 2.158 -0.665 3.479 127 HA SER 30 HA SER 30 2.229 -0.784 6.393 128 1HB SER 30 1HB SER 30 0.035 -1.441 5.707 129 2HB SER 30 2HB SER 30 0.643 -2.380 4.357 130 HG SER 30 HG SER 30 0.447 -3.063 7.095 131 H TRP 31 H TRP 31 3.616 -1.777 3.349 132 HA TRP 31 HA TRP 31 5.351 -3.045 2.821 133 1HB TRP 31 1HB TRP 31 5.993 -1.955 5.322 134 2HB TRP 31 2HB TRP 31 6.423 -3.649 5.442 135 HD1 TRP 31 HD TRP 31 7.614 -0.420 3.872 136 HE1 TRP 31 1HE TRP 31 9.859 -0.733 2.520 137 HE3 TRP 31 3HE TRP 31 7.577 -5.505 3.964 138 HZ2 TRP 31 2HZ TRP 31 11.334 -3.020 1.659 139 HZ3 TRP 31 3HZ TRP 31 9.456 -6.700 2.844 140 HH2 TRP 31 HH TRP 31 11.290 -5.540 1.719 141 HA PRO 32 HA PRO 32 6.528 -4.437 2.305 142 1HB PRO 32 1HB PRO 32 6.445 -6.311 0.317 143 2HB PRO 32 2HB PRO 32 7.470 -6.458 1.730 144 1HG PRO 32 1HG PRO 32 4.956 -7.883 1.108 145 2HG PRO 32 2HG PRO 32 6.197 -8.303 2.272 146 1HD PRO 32 1HD PRO 32 3.644 -7.124 2.836 147 2HD PRO 32 2HD PRO 32 4.930 -7.436 3.984 148 H VAL 33 H VAL 33 3.244 -5.028 1.754 149 HA VAL 33 HA VAL 33 3.374 -3.192 -0.538 150 HB VAL 33 HB VAL 33 0.909 -4.567 -0.506 151 1HG1 VAL 33 1HG1 VAL 33 2.977 -5.496 -2.407 152 2HG1 VAL 33 2HG1 VAL 33 1.367 -4.800 -2.707 153 3HG1 VAL 33 3HG1 VAL 33 2.744 -3.733 -2.343 154 1HG2 VAL 33 1HG2 VAL 33 3.282 -6.414 -0.098 155 2HG2 VAL 33 2HG2 VAL 33 1.808 -6.302 0.895 156 3HG2 VAL 33 3HG2 VAL 33 1.715 -6.931 -0.768 157 H CYS 34 H CYS 34 1.711 -1.553 -0.657 158 HA CYS 34 HA CYS 34 0.969 -0.660 1.965 159 1HB CYS 34 1HB CYS 34 0.603 1.398 1.035 160 2HB CYS 34 2HB CYS 34 1.837 0.749 -0.026 161 H THR 35 H THR 35 -1.373 0.094 2.342 162 HA THR 35 HA THR 35 -3.290 -1.571 0.867 163 HB THR 35 HB THR 35 -4.211 -2.404 2.932 164 HG1 THR 35 1HG THR 35 -4.160 -0.741 4.415 165 1HG2 THR 35 1HG2 THR 35 -2.327 -3.406 4.154 166 2HG2 THR 35 2HG2 THR 35 -1.942 -3.437 2.416 167 3HG2 THR 35 3HG2 THR 35 -1.202 -2.208 3.470 168 H ARG 36 H ARG 36 -5.642 -0.876 1.749 169 HA ARG 36 HA ARG 36 -5.603 1.997 1.367 170 1HB ARG 36 1HB ARG 36 -7.269 -0.185 0.375 171 2HB ARG 36 2HB ARG 36 -8.279 0.987 1.199 172 1HG ARG 36 1HG ARG 36 -7.699 2.736 -0.276 173 2HG ARG 36 2HG ARG 36 -6.184 1.989 -0.738 174 1HD ARG 36 1HD ARG 36 -7.305 1.329 -2.620 175 2HD ARG 36 2HD ARG 36 -7.984 0.076 -1.599 176 HE ARG 36 HE ARG 36 -9.435 2.639 -1.518 177 1HH1 ARG 36 2HH2 ARG 36 -9.169 -0.526 -3.033 178 2HH1 ARG 36 1HH2 ARG 36 -10.802 -0.527 -3.613 179 1HH2 ARG 36 2HH1 ARG 36 -11.589 2.639 -2.282 180 2HH2 ARG 36 1HH1 ARG 36 -12.187 1.285 -3.182 Start of MODEL 18 1 H ASN 8 H ASN 8 -5.253 1.558 3.467 2 HA ASN 8 HA ASN 8 -5.026 0.902 5.568 3 1HB ASN 8 1HB ASN 8 -6.200 3.400 5.344 4 2HB ASN 8 2HB ASN 8 -7.323 2.615 6.437 5 1HD2 ASN 8 1HD2 ASN 8 -5.164 4.743 6.664 6 2HD2 ASN 8 2HD2 ASN 8 -4.220 4.288 8.044 7 H GLY 9 H GLY 9 -6.595 -1.072 4.358 8 1HA GLY 9 1HA GLY 9 -8.364 -1.856 6.550 9 2HA GLY 9 2HA GLY 9 -9.075 -1.718 4.954 10 H LEU 10 H LEU 10 -7.458 -2.768 3.140 11 HA LEU 10 HA LEU 10 -6.325 -5.231 4.197 12 1HB LEU 10 1HB LEU 10 -8.690 -5.035 2.370 13 2HB LEU 10 2HB LEU 10 -7.566 -6.368 2.194 14 HG LEU 10 HG LEU 10 -9.036 -5.683 4.756 15 1HD1 LEU 10 1HD1 LEU 10 -10.600 -7.367 4.290 16 2HD1 LEU 10 2HD1 LEU 10 -10.448 -6.458 2.767 17 3HD1 LEU 10 3HD1 LEU 10 -9.629 -8.028 2.953 18 1HD2 LEU 10 1HD2 LEU 10 -6.798 -7.413 4.196 19 2HD2 LEU 10 2HD2 LEU 10 -7.575 -7.025 5.749 20 3HD2 LEU 10 3HD2 LEU 10 -8.194 -8.365 4.755 21 HA PRO 11 HA PRO 11 -3.444 -4.510 1.068 22 1HB PRO 11 1HB PRO 11 -2.563 -7.017 0.429 23 2HB PRO 11 2HB PRO 11 -2.029 -6.148 1.854 24 1HG PRO 11 1HG PRO 11 -3.925 -8.408 1.663 25 2HG PRO 11 2HG PRO 11 -3.064 -7.814 3.069 26 1HD PRO 11 1HD PRO 11 -5.829 -7.381 2.440 27 2HD PRO 11 2HD PRO 11 -4.940 -6.691 3.783 28 H VAL 12 H VAL 12 -5.343 -3.653 -0.210 29 HA VAL 12 HA VAL 12 -5.416 -5.264 -2.662 30 HB VAL 12 HB VAL 12 -7.728 -4.709 -2.965 31 1HG1 VAL 12 1HG1 VAL 12 -8.746 -5.941 -1.081 32 2HG1 VAL 12 2HG1 VAL 12 -7.261 -6.724 -1.671 33 3HG1 VAL 12 3HG1 VAL 12 -7.228 -5.776 -0.166 34 1HG2 VAL 12 1HG2 VAL 12 -8.240 -2.650 -2.123 35 2HG2 VAL 12 2HG2 VAL 12 -8.845 -3.642 -0.775 36 3HG2 VAL 12 3HG2 VAL 12 -7.244 -2.872 -0.665 37 H CYS 13 H CYS 13 -3.854 -2.827 -1.474 38 HA CYS 13 HA CYS 13 -4.713 -0.562 -2.853 39 1HB CYS 13 1HB CYS 13 -2.622 -1.259 -1.095 40 2HB CYS 13 2HB CYS 13 -1.846 -0.617 -2.530 41 H GLY 14 H GLY 14 -2.361 -3.209 -3.621 42 1HA GLY 14 1HA GLY 14 -2.017 -4.086 -5.737 43 2HA GLY 14 2HA GLY 14 -2.736 -2.664 -6.467 44 H GLU 15 H GLU 15 -0.823 -1.322 -4.140 45 HA GLU 15 HA GLU 15 1.468 -1.267 -5.947 46 1HB GLU 15 1HB GLU 15 0.073 0.875 -5.727 47 2HB GLU 15 2HB GLU 15 0.619 0.972 -4.066 48 1HG GLU 15 1HG GLU 15 2.014 2.319 -5.707 49 2HG GLU 15 2HG GLU 15 2.935 1.189 -4.732 50 HE2 GLU 15 HE GLU 15 3.538 -1.096 -6.632 51 H THR 16 H THR 16 3.587 -0.620 -4.750 52 HA THR 16 HA THR 16 3.584 -1.906 -2.097 53 HB THR 16 HB THR 16 6.035 -1.941 -3.838 54 HG1 THR 16 1HG THR 16 4.945 -3.820 -4.942 55 1HG2 THR 16 1HG2 THR 16 4.586 -3.793 -1.914 56 2HG2 THR 16 2HG2 THR 16 5.739 -4.467 -3.091 57 3HG2 THR 16 3HG2 THR 16 6.289 -3.275 -1.889 58 H CYS 17 H CYS 17 5.762 -1.293 -0.903 59 HA CYS 17 HA CYS 17 6.553 1.415 -1.452 60 1HB CYS 17 1HB CYS 17 6.002 2.169 0.876 61 2HB CYS 17 2HB CYS 17 4.645 2.003 -0.221 62 H VAL 18 H VAL 18 8.458 -0.118 -1.828 63 HA VAL 18 HA VAL 18 9.541 -1.417 0.482 64 HB VAL 18 HB VAL 18 10.964 -0.861 -2.110 65 1HG1 VAL 18 1HG1 VAL 18 12.159 -1.932 -0.170 66 2HG1 VAL 18 2HG1 VAL 18 11.028 -3.300 -0.307 67 3HG1 VAL 18 3HG1 VAL 18 12.123 -2.910 -1.656 68 1HG2 VAL 18 1HG2 VAL 18 8.529 -2.484 -1.673 69 2HG2 VAL 18 2HG2 VAL 18 9.194 -1.783 -3.168 70 3HG2 VAL 18 3HG2 VAL 18 9.850 -3.312 -2.533 71 H GLY 19 H GLY 19 9.694 1.753 -1.031 72 1HA GLY 19 1HA GLY 19 12.165 2.474 0.330 73 2HA GLY 19 2HA GLY 19 11.213 3.462 -0.761 74 H GLY 20 H GLY 20 8.786 2.304 1.039 75 1HA GLY 20 1HA GLY 20 7.950 2.789 3.164 76 2HA GLY 20 2HA GLY 20 9.201 3.993 3.401 77 H THR 21 H THR 21 7.570 3.905 0.273 78 HA THR 21 HA THR 21 5.517 5.768 1.013 79 HB THR 21 HB THR 21 8.052 6.659 -0.443 80 HG1 THR 21 1HG THR 21 8.178 7.204 1.728 81 1HG2 THR 21 1HG2 THR 21 5.657 8.454 0.009 82 2HG2 THR 21 2HG2 THR 21 6.973 8.618 -1.178 83 3HG2 THR 21 3HG2 THR 21 5.680 7.423 -1.442 84 H CYS 22 H CYS 22 4.001 4.454 0.079 85 HA CYS 22 HA CYS 22 4.261 2.974 -2.167 86 1HB CYS 22 1HB CYS 22 1.800 3.201 -2.428 87 2HB CYS 22 2HB CYS 22 2.331 2.739 -0.824 88 H ASN 23 H ASN 23 3.188 3.438 -4.400 89 HA ASN 23 HA ASN 23 4.191 6.010 -5.253 90 1HB ASN 23 1HB ASN 23 4.180 3.376 -6.371 91 2HB ASN 23 2HB ASN 23 3.120 4.322 -7.396 92 1HD2 ASN 23 1HD2 ASN 23 6.244 4.560 -5.707 93 2HD2 ASN 23 2HD2 ASN 23 7.111 5.383 -6.960 94 H THR 24 H THR 24 1.342 4.732 -4.086 95 HA THR 24 HA THR 24 -0.315 6.383 -5.880 96 HB THR 24 HB THR 24 -0.756 3.936 -6.102 97 HG1 THR 24 1HG THR 24 -3.032 4.249 -5.606 98 1HG2 THR 24 1HG2 THR 24 -1.551 4.102 -3.150 99 2HG2 THR 24 2HG2 THR 24 -1.680 2.677 -4.207 100 3HG2 THR 24 3HG2 THR 24 -0.078 3.290 -3.733 101 HA PRO 25 HA PRO 25 -1.333 8.682 -2.401 102 1HB PRO 25 1HB PRO 25 -3.637 9.886 -3.249 103 2HB PRO 25 2HB PRO 25 -2.039 10.449 -3.699 104 1HG PRO 25 1HG PRO 25 -4.005 8.959 -5.327 105 2HG PRO 25 2HG PRO 25 -2.617 9.887 -5.860 106 1HD PRO 25 1HD PRO 25 -2.814 7.029 -5.701 107 2HD PRO 25 2HD PRO 25 -1.389 7.960 -6.122 108 H GLY 26 H GLY 26 -3.204 9.264 -0.832 109 1HA GLY 26 1HA GLY 26 -4.370 8.258 0.844 110 2HA GLY 26 2HA GLY 26 -5.461 7.903 -0.481 111 H CYS 27 H CYS 27 -2.194 6.607 0.469 112 HA CYS 27 HA CYS 27 -3.416 3.945 0.364 113 1HB CYS 27 1HB CYS 27 -1.770 3.219 -0.923 114 2HB CYS 27 2HB CYS 27 -1.339 4.898 -1.176 115 H THR 28 H THR 28 -2.278 2.345 1.899 116 HA THR 28 HA THR 28 -1.342 3.765 4.306 117 HB THR 28 HB THR 28 -3.295 1.438 3.960 118 HG1 THR 28 1HG THR 28 -4.544 3.243 4.252 119 1HG2 THR 28 1HG2 THR 28 -1.914 0.820 5.883 120 2HG2 THR 28 2HG2 THR 28 -1.892 2.501 6.466 121 3HG2 THR 28 3HG2 THR 28 -3.404 1.561 6.516 122 H CYS 29 H CYS 29 0.769 3.430 3.059 123 HA CYS 29 HA CYS 29 1.892 1.100 2.431 124 1HB CYS 29 1HB CYS 29 3.030 3.228 2.223 125 2HB CYS 29 2HB CYS 29 3.174 3.369 3.964 126 H SER 30 H SER 30 1.959 -0.853 3.485 127 HA SER 30 HA SER 30 2.234 -0.729 6.387 128 1HB SER 30 1HB SER 30 -0.007 -1.555 5.620 129 2HB SER 30 2HB SER 30 0.783 -2.850 4.742 130 HG SER 30 HG SER 30 1.431 -3.821 6.655 131 H TRP 31 H TRP 31 3.560 -1.685 3.361 132 HA TRP 31 HA TRP 31 5.352 -2.845 2.781 133 1HB TRP 31 1HB TRP 31 5.991 -1.734 5.263 134 2HB TRP 31 2HB TRP 31 6.500 -3.407 5.385 135 HD1 TRP 31 HD TRP 31 7.534 -0.135 3.807 136 HE1 TRP 31 1HE TRP 31 9.763 -0.352 2.411 137 HE3 TRP 31 3HE TRP 31 7.692 -5.216 3.863 138 HZ2 TRP 31 2HZ TRP 31 11.307 -2.576 1.507 139 HZ3 TRP 31 3HZ TRP 31 9.595 -6.332 2.701 140 HH2 TRP 31 HH TRP 31 11.362 -5.096 1.550 141 HA PRO 32 HA PRO 32 6.577 -4.157 2.201 142 1HB PRO 32 1HB PRO 32 6.536 -6.004 0.187 143 2HB PRO 32 2HB PRO 32 7.613 -6.112 1.565 144 1HG PRO 32 1HG PRO 32 5.166 -7.670 1.000 145 2HG PRO 32 2HG PRO 32 6.466 -8.035 2.117 146 1HD PRO 32 1HD PRO 32 3.869 -7.011 2.779 147 2HD PRO 32 2HD PRO 32 5.207 -7.267 3.881 148 H VAL 33 H VAL 33 3.334 -5.055 1.633 149 HA VAL 33 HA VAL 33 3.281 -3.165 -0.616 150 HB VAL 33 HB VAL 33 0.893 -4.735 -0.346 151 1HG1 VAL 33 1HG1 VAL 33 2.536 -5.456 -2.609 152 2HG1 VAL 33 2HG1 VAL 33 1.022 -4.522 -2.563 153 3HG1 VAL 33 3HG1 VAL 33 2.584 -3.695 -2.354 154 1HG2 VAL 33 1HG2 VAL 33 2.138 -6.438 0.778 155 2HG2 VAL 33 2HG2 VAL 33 1.936 -6.964 -0.911 156 3HG2 VAL 33 3HG2 VAL 33 3.493 -6.294 -0.369 157 H CYS 34 H CYS 34 1.592 -1.569 -0.668 158 HA CYS 34 HA CYS 34 1.010 -0.551 1.900 159 1HB CYS 34 1HB CYS 34 0.694 1.338 0.795 160 2HB CYS 34 2HB CYS 34 1.163 0.476 -0.657 161 H THR 35 H THR 35 -1.514 0.248 2.150 162 HA THR 35 HA THR 35 -3.300 -1.935 1.391 163 HB THR 35 HB THR 35 -4.043 -2.092 3.807 164 HG1 THR 35 1HG THR 35 -3.117 -0.584 5.143 165 1HG2 THR 35 1HG2 THR 35 -1.822 -3.327 2.701 166 2HG2 THR 35 2HG2 THR 35 -1.101 -2.488 4.095 167 3HG2 THR 35 3HG2 THR 35 -2.426 -3.650 4.343 168 H ARG 36 H ARG 36 -5.630 -1.375 2.003 169 HA ARG 36 HA ARG 36 -5.932 1.431 1.347 170 1HB ARG 36 1HB ARG 36 -7.030 -0.733 0.119 171 2HB ARG 36 2HB ARG 36 -8.274 -0.466 1.324 172 1HG ARG 36 1HG ARG 36 -8.412 1.952 0.580 173 2HG ARG 36 2HG ARG 36 -7.253 1.596 -0.685 174 1HD ARG 36 1HD ARG 36 -9.238 1.278 -1.868 175 2HD ARG 36 2HD ARG 36 -8.974 -0.357 -1.295 176 HE ARG 36 HE ARG 36 -10.835 -0.146 0.114 177 1HH1 ARG 36 2HH2 ARG 36 -9.831 3.049 -0.968 178 2HH1 ARG 36 1HH2 ARG 36 -11.213 3.849 -0.297 179 1HH2 ARG 36 2HH1 ARG 36 -12.657 0.910 0.999 180 2HH2 ARG 36 1HH1 ARG 36 -12.831 2.626 0.829 Start of MODEL 19 1 H ASN 8 H ASN 8 -5.659 2.013 3.832 2 HA ASN 8 HA ASN 8 -5.667 2.074 6.011 3 1HB ASN 8 1HB ASN 8 -8.665 1.738 5.497 4 2HB ASN 8 2HB ASN 8 -8.019 2.156 7.071 5 1HD2 ASN 8 1HD2 ASN 8 -8.535 3.173 3.785 6 2HD2 ASN 8 2HD2 ASN 8 -8.206 4.861 3.986 7 H GLY 9 H GLY 9 -5.571 -0.685 4.655 8 1HA GLY 9 1HA GLY 9 -4.979 -2.530 6.210 9 2HA GLY 9 2HA GLY 9 -6.570 -2.319 6.911 10 H LEU 10 H LEU 10 -5.562 -2.184 3.432 11 HA LEU 10 HA LEU 10 -6.984 -4.685 2.977 12 1HB LEU 10 1HB LEU 10 -7.764 -2.001 1.904 13 2HB LEU 10 2HB LEU 10 -8.000 -3.429 0.916 14 HG LEU 10 HG LEU 10 -9.111 -3.154 3.719 15 1HD1 LEU 10 1HD1 LEU 10 -10.070 -2.028 1.167 16 2HD1 LEU 10 2HD1 LEU 10 -11.285 -2.939 2.096 17 3HD1 LEU 10 3HD1 LEU 10 -10.437 -1.566 2.847 18 1HD2 LEU 10 1HD2 LEU 10 -9.988 -5.196 3.481 19 2HD2 LEU 10 2HD2 LEU 10 -10.462 -4.904 1.790 20 3HD2 LEU 10 3HD2 LEU 10 -8.797 -5.401 2.174 21 HA PRO 11 HA PRO 11 -3.270 -4.875 0.645 22 1HB PRO 11 1HB PRO 11 -3.215 -7.593 0.364 23 2HB PRO 11 2HB PRO 11 -2.526 -6.758 1.742 24 1HG PRO 11 1HG PRO 11 -5.039 -8.306 1.581 25 2HG PRO 11 2HG PRO 11 -4.128 -7.835 3.003 26 1HD PRO 11 1HD PRO 11 -6.550 -6.636 2.041 27 2HD PRO 11 2HD PRO 11 -5.578 -6.093 3.394 28 H VAL 12 H VAL 12 -5.163 -3.744 -0.742 29 HA VAL 12 HA VAL 12 -5.063 -5.317 -3.200 30 HB VAL 12 HB VAL 12 -7.393 -4.857 -3.670 31 1HG1 VAL 12 1HG1 VAL 12 -7.005 -6.173 -0.960 32 2HG1 VAL 12 2HG1 VAL 12 -8.437 -6.350 -2.003 33 3HG1 VAL 12 3HG1 VAL 12 -6.856 -6.959 -2.550 34 1HG2 VAL 12 1HG2 VAL 12 -8.607 -3.318 -2.603 35 2HG2 VAL 12 2HG2 VAL 12 -8.295 -4.084 -1.026 36 3HG2 VAL 12 3HG2 VAL 12 -7.149 -2.887 -1.678 37 H CYS 13 H CYS 13 -3.680 -2.901 -1.899 38 HA CYS 13 HA CYS 13 -4.620 -0.593 -3.149 39 1HB CYS 13 1HB CYS 13 -2.388 -1.377 -1.512 40 2HB CYS 13 2HB CYS 13 -1.815 -0.383 -2.837 41 H GLY 14 H GLY 14 -2.151 -3.091 -4.043 42 1HA GLY 14 1HA GLY 14 -1.833 -3.823 -6.240 43 2HA GLY 14 2HA GLY 14 -2.473 -2.311 -6.854 44 H GLU 15 H GLU 15 -0.610 -1.232 -4.372 45 HA GLU 15 HA GLU 15 1.805 -1.244 -6.008 46 1HB GLU 15 1HB GLU 15 0.714 1.098 -4.385 47 2HB GLU 15 2HB GLU 15 2.214 1.101 -5.292 48 1HG GLU 15 1HG GLU 15 -0.469 0.499 -6.607 49 2HG GLU 15 2HG GLU 15 0.142 2.134 -6.450 50 HE2 GLU 15 HE GLU 15 1.604 2.661 -8.337 51 H THR 16 H THR 16 3.836 -1.205 -4.838 52 HA THR 16 HA THR 16 3.521 -2.156 -2.077 53 HB THR 16 HB THR 16 6.079 -2.374 -3.670 54 HG1 THR 16 1HG THR 16 3.509 -3.739 -4.018 55 1HG2 THR 16 1HG2 THR 16 5.670 -4.825 -2.734 56 2HG2 THR 16 2HG2 THR 16 6.238 -3.558 -1.620 57 3HG2 THR 16 3HG2 THR 16 4.517 -4.016 -1.646 58 H CYS 17 H CYS 17 5.767 -1.665 -0.816 59 HA CYS 17 HA CYS 17 6.663 1.010 -1.321 60 1HB CYS 17 1HB CYS 17 6.015 1.896 0.870 61 2HB CYS 17 2HB CYS 17 4.640 1.562 -0.163 62 H VAL 18 H VAL 18 8.515 -0.609 -1.612 63 HA VAL 18 HA VAL 18 9.451 -1.903 0.774 64 HB VAL 18 HB VAL 18 10.974 -1.529 -1.794 65 1HG1 VAL 18 1HG1 VAL 18 12.069 -2.593 0.191 66 2HG1 VAL 18 2HG1 VAL 18 10.840 -3.878 0.124 67 3HG1 VAL 18 3HG1 VAL 18 11.967 -3.653 -1.234 68 1HG2 VAL 18 1HG2 VAL 18 8.496 -3.138 -1.317 69 2HG2 VAL 18 2HG2 VAL 18 9.055 -2.303 -2.786 70 3HG2 VAL 18 3HG2 VAL 18 9.789 -3.853 -2.310 71 H GLY 19 H GLY 19 9.780 1.206 -0.814 72 1HA GLY 19 1HA GLY 19 12.188 1.831 0.757 73 2HA GLY 19 2HA GLY 19 11.566 2.728 -0.613 74 H GLY 20 H GLY 20 8.745 2.071 0.846 75 1HA GLY 20 1HA GLY 20 7.629 2.947 2.701 76 2HA GLY 20 2HA GLY 20 8.942 4.071 2.982 77 H THR 21 H THR 21 7.943 3.668 -0.356 78 HA THR 21 HA THR 21 6.367 6.150 -0.165 79 HB THR 21 HB THR 21 8.642 6.605 -1.057 80 HG1 THR 21 1HG THR 21 6.815 7.695 -2.038 81 1HG2 THR 21 1HG2 THR 21 9.649 4.960 -2.300 82 2HG2 THR 21 2HG2 THR 21 8.105 4.109 -2.544 83 3HG2 THR 21 3HG2 THR 21 8.563 5.450 -3.622 84 H CYS 22 H CYS 22 4.523 4.656 0.066 85 HA CYS 22 HA CYS 22 3.781 2.682 -1.547 86 1HB CYS 22 1HB CYS 22 2.444 3.553 0.312 87 2HB CYS 22 2HB CYS 22 2.004 4.956 -0.642 88 H ASN 23 H ASN 23 3.607 6.226 -2.266 89 HA ASN 23 HA ASN 23 3.596 7.315 -4.145 90 1HB ASN 23 1HB ASN 23 4.769 4.793 -4.932 91 2HB ASN 23 2HB ASN 23 3.664 5.270 -6.207 92 1HD2 ASN 23 1HD2 ASN 23 4.196 6.830 -7.581 93 2HD2 ASN 23 2HD2 ASN 23 5.620 7.815 -7.507 94 H THR 24 H THR 24 1.289 5.347 -3.018 95 HA THR 24 HA THR 24 -0.487 5.596 -5.352 96 HB THR 24 HB THR 24 -1.161 3.898 -2.956 97 HG1 THR 24 1HG THR 24 0.862 3.414 -5.031 98 1HG2 THR 24 1HG2 THR 24 -2.688 3.397 -4.643 99 2HG2 THR 24 2HG2 THR 24 -1.575 3.907 -5.935 100 3HG2 THR 24 3HG2 THR 24 -1.376 2.313 -5.166 101 HA PRO 25 HA PRO 25 -2.814 8.517 -3.241 102 1HB PRO 25 1HB PRO 25 -5.241 8.260 -4.471 103 2HB PRO 25 2HB PRO 25 -3.901 9.147 -5.171 104 1HG PRO 25 1HG PRO 25 -4.943 6.478 -5.903 105 2HG PRO 25 2HG PRO 25 -3.913 7.549 -6.834 106 1HD PRO 25 1HD PRO 25 -3.101 5.196 -5.408 107 2HD PRO 25 2HD PRO 25 -2.056 6.330 -6.242 108 H GLY 26 H GLY 26 -3.974 8.879 -1.396 109 1HA GLY 26 1HA GLY 26 -4.851 8.166 0.563 110 2HA GLY 26 2HA GLY 26 -6.101 7.504 -0.471 111 H CYS 27 H CYS 27 -2.621 6.598 0.086 112 HA CYS 27 HA CYS 27 -3.593 3.888 0.622 113 1HB CYS 27 1HB CYS 27 -2.115 3.142 -0.835 114 2HB CYS 27 2HB CYS 27 -1.700 4.796 -1.240 115 H THR 28 H THR 28 -2.113 2.661 2.223 116 HA THR 28 HA THR 28 -0.869 4.490 4.152 117 HB THR 28 HB THR 28 -3.321 3.857 4.723 118 HG1 THR 28 1HG THR 28 -2.320 4.327 6.639 119 1HG2 THR 28 1HG2 THR 28 -3.878 1.670 5.214 120 2HG2 THR 28 2HG2 THR 28 -2.531 1.269 4.121 121 3HG2 THR 28 3HG2 THR 28 -2.265 1.318 5.880 122 H CYS 29 H CYS 29 0.993 3.636 2.784 123 HA CYS 29 HA CYS 29 1.893 1.241 2.423 124 1HB CYS 29 1HB CYS 29 3.302 3.138 2.064 125 2HB CYS 29 2HB CYS 29 3.411 3.470 3.781 126 H SER 30 H SER 30 1.891 -0.670 3.555 127 HA SER 30 HA SER 30 2.109 -0.437 6.454 128 1HB SER 30 1HB SER 30 0.595 -2.289 6.715 129 2HB SER 30 2HB SER 30 -0.163 -1.168 5.600 130 HG SER 30 HG SER 30 0.789 -3.779 5.160 131 H TRP 31 H TRP 31 3.433 -1.607 3.502 132 HA TRP 31 HA TRP 31 5.165 -2.894 3.015 133 1HB TRP 31 1HB TRP 31 5.817 -1.721 5.464 134 2HB TRP 31 2HB TRP 31 6.215 -3.415 5.668 135 HD1 TRP 31 HD TRP 31 7.473 -0.286 3.951 136 HE1 TRP 31 1HE TRP 31 9.721 -0.702 2.635 137 HE3 TRP 31 3HE TRP 31 7.351 -5.358 4.296 138 HZ2 TRP 31 2HZ TRP 31 11.164 -3.053 1.901 139 HZ3 TRP 31 3HZ TRP 31 9.218 -6.638 3.254 140 HH2 TRP 31 HH TRP 31 11.079 -5.566 2.087 141 HA PRO 32 HA PRO 32 6.344 -4.306 2.548 142 1HB PRO 32 1HB PRO 32 6.268 -6.237 0.617 143 2HB PRO 32 2HB PRO 32 7.284 -6.346 2.040 144 1HG PRO 32 1HG PRO 32 4.769 -7.781 1.446 145 2HG PRO 32 2HG PRO 32 6.002 -8.170 2.629 146 1HD PRO 32 1HD PRO 32 3.449 -6.966 3.142 147 2HD PRO 32 2HD PRO 32 4.727 -7.248 4.307 148 H VAL 33 H VAL 33 3.075 -5.030 1.895 149 HA VAL 33 HA VAL 33 3.220 -3.211 -0.410 150 HB VAL 33 HB VAL 33 0.929 -5.070 0.085 151 1HG1 VAL 33 1HG1 VAL 33 2.246 -3.843 -2.353 152 2HG1 VAL 33 2HG1 VAL 33 0.994 -5.104 -2.452 153 3HG1 VAL 33 3HG1 VAL 33 0.617 -3.532 -1.706 154 1HG2 VAL 33 1HG2 VAL 33 2.398 -6.801 0.169 155 2HG2 VAL 33 2HG2 VAL 33 2.405 -6.581 -1.597 156 3HG2 VAL 33 3HG2 VAL 33 3.705 -5.877 -0.607 157 H CYS 34 H CYS 34 1.611 -1.550 -0.575 158 HA CYS 34 HA CYS 34 0.958 -0.410 1.893 159 1HB CYS 34 1HB CYS 34 0.623 1.400 0.667 160 2HB CYS 34 2HB CYS 34 1.107 0.448 -0.723 161 H THR 35 H THR 35 -1.575 0.399 2.081 162 HA THR 35 HA THR 35 -3.423 -1.709 1.370 163 HB THR 35 HB THR 35 -3.854 -1.431 4.144 164 HG1 THR 35 1HG THR 35 -1.575 -0.454 3.928 165 1HG2 THR 35 1HG2 THR 35 -4.036 -3.656 3.463 166 2HG2 THR 35 2HG2 THR 35 -2.668 -3.523 2.331 167 3HG2 THR 35 3HG2 THR 35 -2.365 -3.706 4.075 168 H ARG 36 H ARG 36 -5.675 -1.127 1.851 169 HA ARG 36 HA ARG 36 -5.884 1.761 1.760 170 1HB ARG 36 1HB ARG 36 -7.266 -0.470 0.437 171 2HB ARG 36 2HB ARG 36 -8.421 0.610 1.194 172 1HG ARG 36 1HG ARG 36 -7.240 2.560 0.055 173 2HG ARG 36 2HG ARG 36 -6.245 1.397 -0.800 174 1HD ARG 36 1HD ARG 36 -8.771 0.388 -1.301 175 2HD ARG 36 2HD ARG 36 -9.114 2.104 -1.216 176 HE ARG 36 HE ARG 36 -6.761 1.586 -2.837 177 1HH1 ARG 36 2HH2 ARG 36 -10.279 1.532 -2.891 178 2HH1 ARG 36 1HH2 ARG 36 -10.384 1.746 -4.606 179 1HH2 ARG 36 2HH1 ARG 36 -6.898 1.868 -5.101 180 2HH2 ARG 36 1HH1 ARG 36 -8.447 1.938 -5.872 Start of MODEL 20 1 H ASN 8 H ASN 8 -5.184 1.214 3.681 2 HA ASN 8 HA ASN 8 -5.382 0.589 5.746 3 1HB ASN 8 1HB ASN 8 -6.181 3.233 5.800 4 2HB ASN 8 2HB ASN 8 -7.597 2.467 6.492 5 1HD2 ASN 8 1HD2 ASN 8 -5.080 4.081 7.400 6 2HD2 ASN 8 2HD2 ASN 8 -4.588 3.292 8.862 7 H GLY 9 H GLY 9 -6.970 -0.810 3.837 8 1HA GLY 9 1HA GLY 9 -9.338 -1.526 5.456 9 2HA GLY 9 2HA GLY 9 -9.433 -1.329 3.716 10 H LEU 10 H LEU 10 -7.773 -2.672 2.388 11 HA LEU 10 HA LEU 10 -7.085 -5.156 3.754 12 1HB LEU 10 1HB LEU 10 -8.902 -4.899 1.367 13 2HB LEU 10 2HB LEU 10 -7.997 -6.364 1.689 14 HG LEU 10 HG LEU 10 -9.393 -5.548 4.081 15 1HD1 LEU 10 1HD1 LEU 10 -10.795 -4.662 1.913 16 2HD1 LEU 10 2HD1 LEU 10 -11.461 -6.299 2.124 17 3HD1 LEU 10 3HD1 LEU 10 -11.512 -5.137 3.471 18 1HD2 LEU 10 1HD2 LEU 10 -9.958 -7.965 2.363 19 2HD2 LEU 10 2HD2 LEU 10 -8.493 -7.826 3.365 20 3HD2 LEU 10 3HD2 LEU 10 -10.101 -7.788 4.129 21 HA PRO 11 HA PRO 11 -3.561 -4.836 1.284 22 1HB PRO 11 1HB PRO 11 -2.788 -7.437 0.959 23 2HB PRO 11 2HB PRO 11 -2.489 -6.525 2.425 24 1HG PRO 11 1HG PRO 11 -4.493 -8.642 1.936 25 2HG PRO 11 2HG PRO 11 -3.895 -8.029 3.465 26 1HD PRO 11 1HD PRO 11 -6.420 -7.427 2.244 27 2HD PRO 11 2HD PRO 11 -5.773 -6.727 3.714 28 H VAL 12 H VAL 12 -5.189 -3.966 -0.376 29 HA VAL 12 HA VAL 12 -4.655 -5.551 -2.771 30 HB VAL 12 HB VAL 12 -7.016 -4.944 -3.505 31 1HG1 VAL 12 1HG1 VAL 12 -6.205 -7.233 -2.864 32 2HG1 VAL 12 2HG1 VAL 12 -6.812 -6.929 -1.219 33 3HG1 VAL 12 3HG1 VAL 12 -7.944 -6.965 -2.593 34 1HG2 VAL 12 1HG2 VAL 12 -7.852 -4.958 -0.648 35 2HG2 VAL 12 2HG2 VAL 12 -7.150 -3.447 -1.271 36 3HG2 VAL 12 3HG2 VAL 12 -8.582 -4.151 -2.057 37 H CYS 13 H CYS 13 -3.481 -3.115 -1.455 38 HA CYS 13 HA CYS 13 -4.410 -0.803 -2.649 39 1HB CYS 13 1HB CYS 13 -2.459 -1.409 -0.864 40 2HB CYS 13 2HB CYS 13 -1.485 -1.034 -2.271 41 H GLY 14 H GLY 14 -2.260 -3.439 -3.783 42 1HA GLY 14 1HA GLY 14 -1.892 -4.042 -5.965 43 2HA GLY 14 2HA GLY 14 -2.598 -2.537 -6.523 44 H GLU 15 H GLU 15 -0.686 -1.335 -4.194 45 HA GLU 15 HA GLU 15 1.631 -1.254 -5.966 46 1HB GLU 15 1HB GLU 15 0.019 0.875 -5.255 47 2HB GLU 15 2HB GLU 15 1.281 0.987 -4.045 48 1HG GLU 15 1HG GLU 15 2.833 1.685 -5.565 49 2HG GLU 15 2HG GLU 15 2.389 0.442 -6.718 50 HE2 GLU 15 HE GLU 15 2.173 1.626 -8.427 51 H THR 16 H THR 16 3.711 -0.527 -4.655 52 HA THR 16 HA THR 16 3.663 -1.854 -2.027 53 HB THR 16 HB THR 16 6.096 -2.065 -3.788 54 HG1 THR 16 1HG THR 16 4.900 -3.938 -4.794 55 1HG2 THR 16 1HG2 THR 16 6.309 -3.323 -1.777 56 2HG2 THR 16 2HG2 THR 16 4.590 -3.784 -1.781 57 3HG2 THR 16 3HG2 THR 16 5.716 -4.538 -2.934 58 H CYS 17 H CYS 17 5.853 -1.325 -0.835 59 HA CYS 17 HA CYS 17 6.749 1.348 -1.450 60 1HB CYS 17 1HB CYS 17 6.321 2.093 0.918 61 2HB CYS 17 2HB CYS 17 4.930 2.014 -0.144 62 H VAL 18 H VAL 18 8.398 -0.623 -1.880 63 HA VAL 18 HA VAL 18 9.594 -1.765 0.423 64 HB VAL 18 HB VAL 18 10.895 -1.477 -2.272 65 1HG1 VAL 18 1HG1 VAL 18 11.855 -3.628 -1.769 66 2HG1 VAL 18 2HG1 VAL 18 12.105 -2.563 -0.366 67 3HG1 VAL 18 3HG1 VAL 18 10.831 -3.804 -0.325 68 1HG2 VAL 18 1HG2 VAL 18 8.947 -2.237 -3.158 69 2HG2 VAL 18 2HG2 VAL 18 9.556 -3.802 -2.568 70 3HG2 VAL 18 3HG2 VAL 18 8.366 -2.891 -1.607 71 H GLY 19 H GLY 19 9.844 1.304 -1.255 72 1HA GLY 19 1HA GLY 19 12.421 1.898 0.023 73 2HA GLY 19 2HA GLY 19 11.631 2.818 -1.243 74 H GLY 20 H GLY 20 9.067 2.090 0.674 75 1HA GLY 20 1HA GLY 20 8.264 2.971 2.683 76 2HA GLY 20 2HA GLY 20 9.564 4.146 2.707 77 H THR 21 H THR 21 7.980 3.606 -0.384 78 HA THR 21 HA THR 21 6.195 5.884 0.054 79 HB THR 21 HB THR 21 8.449 6.675 -0.849 80 HG1 THR 21 1HG THR 21 7.244 7.723 -2.720 81 1HG2 THR 21 1HG2 THR 21 7.726 5.756 -3.576 82 2HG2 THR 21 2HG2 THR 21 9.328 5.845 -2.806 83 3HG2 THR 21 3HG2 THR 21 8.280 4.435 -2.518 84 H CYS 22 H CYS 22 4.357 4.627 -0.031 85 HA CYS 22 HA CYS 22 3.951 2.516 -1.733 86 1HB CYS 22 1HB CYS 22 1.551 2.891 -1.365 87 2HB CYS 22 2HB CYS 22 2.490 2.916 0.114 88 H ASN 23 H ASN 23 3.777 6.045 -2.239 89 HA ASN 23 HA ASN 23 3.615 7.263 -4.026 90 1HB ASN 23 1HB ASN 23 5.055 5.121 -4.947 91 2HB ASN 23 2HB ASN 23 3.655 4.982 -5.991 92 1HD2 ASN 23 1HD2 ASN 23 5.840 7.466 -4.673 93 2HD2 ASN 23 2HD2 ASN 23 6.026 8.391 -6.126 94 H THR 24 H THR 24 1.329 5.351 -2.888 95 HA THR 24 HA THR 24 -0.520 5.642 -5.161 96 HB THR 24 HB THR 24 -1.143 3.932 -2.761 97 HG1 THR 24 1HG THR 24 1.095 3.444 -3.212 98 1HG2 THR 24 1HG2 THR 24 -1.406 2.395 -5.033 99 2HG2 THR 24 2HG2 THR 24 -2.718 3.402 -4.375 100 3HG2 THR 24 3HG2 THR 24 -1.701 4.019 -5.700 101 HA PRO 25 HA PRO 25 -2.728 8.577 -2.944 102 1HB PRO 25 1HB PRO 25 -5.203 8.361 -4.082 103 2HB PRO 25 2HB PRO 25 -3.879 9.234 -4.827 104 1HG PRO 25 1HG PRO 25 -4.984 6.585 -5.537 105 2HG PRO 25 2HG PRO 25 -3.976 7.648 -6.499 106 1HD PRO 25 1HD PRO 25 -3.143 5.275 -5.120 107 2HD PRO 25 2HD PRO 25 -2.115 6.399 -5.986 108 H GLY 26 H GLY 26 -3.835 8.950 -1.064 109 1HA GLY 26 1HA GLY 26 -4.631 8.227 0.929 110 2HA GLY 26 2HA GLY 26 -5.936 7.605 -0.061 111 H CYS 27 H CYS 27 -2.457 6.618 0.354 112 HA CYS 27 HA CYS 27 -3.460 3.913 0.843 113 1HB CYS 27 1HB CYS 27 -1.924 3.145 -0.548 114 2HB CYS 27 2HB CYS 27 -1.623 4.804 -1.026 115 H THR 28 H THR 28 -2.005 2.625 2.418 116 HA THR 28 HA THR 28 -0.819 4.402 4.437 117 HB THR 28 HB THR 28 -3.220 3.652 4.980 118 HG1 THR 28 1HG THR 28 -1.014 2.552 6.572 119 1HG2 THR 28 1HG2 THR 28 -2.150 1.089 4.261 120 2HG2 THR 28 2HG2 THR 28 -2.365 1.077 6.028 121 3HG2 THR 28 3HG2 THR 28 -3.749 1.431 4.966 122 H CYS 29 H CYS 29 0.985 3.590 2.817 123 HA CYS 29 HA CYS 29 1.991 1.253 2.465 124 1HB CYS 29 1HB CYS 29 3.307 3.169 1.984 125 2HB CYS 29 2HB CYS 29 3.450 3.598 3.677 126 H SER 30 H SER 30 2.068 -0.636 3.628 127 HA SER 30 HA SER 30 2.494 -0.350 6.501 128 1HB SER 30 1HB SER 30 0.180 -1.151 5.773 129 2HB SER 30 2HB SER 30 0.947 -2.588 5.125 130 HG SER 30 HG SER 30 0.225 -3.041 7.245 131 H TRP 31 H TRP 31 3.633 -1.535 3.481 132 HA TRP 31 HA TRP 31 5.355 -2.793 2.891 133 1HB TRP 31 1HB TRP 31 6.153 -1.567 5.264 134 2HB TRP 31 2HB TRP 31 6.584 -3.252 5.485 135 HD1 TRP 31 HD TRP 31 7.677 -0.159 3.588 136 HE1 TRP 31 1HE TRP 31 9.850 -0.586 2.152 137 HE3 TRP 31 3HE TRP 31 7.676 -5.216 4.129 138 HZ2 TRP 31 2HZ TRP 31 11.291 -2.938 1.420 139 HZ3 TRP 31 3HZ TRP 31 9.502 -6.502 3.022 140 HH2 TRP 31 HH TRP 31 11.267 -5.444 1.704 141 HA PRO 32 HA PRO 32 6.572 -4.190 2.402 142 1HB PRO 32 1HB PRO 32 6.458 -6.160 0.512 143 2HB PRO 32 2HB PRO 32 7.538 -6.216 1.890 144 1HG PRO 32 1HG PRO 32 5.036 -7.723 1.434 145 2HG PRO 32 2HG PRO 32 6.329 -8.059 2.569 146 1HD PRO 32 1HD PRO 32 3.772 -6.907 3.173 147 2HD PRO 32 2HD PRO 32 5.108 -7.137 4.284 148 H VAL 33 H VAL 33 3.292 -4.972 1.935 149 HA VAL 33 HA VAL 33 3.291 -3.218 -0.422 150 HB VAL 33 HB VAL 33 1.064 -5.102 0.243 151 1HG1 VAL 33 1HG1 VAL 33 0.717 -3.512 -1.561 152 2HG1 VAL 33 2HG1 VAL 33 2.228 -4.026 -2.348 153 3HG1 VAL 33 3HG1 VAL 33 0.857 -5.155 -2.232 154 1HG2 VAL 33 1HG2 VAL 33 2.740 -6.704 0.361 155 2HG2 VAL 33 2HG2 VAL 33 2.329 -6.727 -1.371 156 3HG2 VAL 33 3HG2 VAL 33 3.780 -5.859 -0.811 157 H CYS 34 H CYS 34 1.664 -1.575 -0.543 158 HA CYS 34 HA CYS 34 1.000 -0.540 2.026 159 1HB CYS 34 1HB CYS 34 0.682 1.420 0.983 160 2HB CYS 34 2HB CYS 34 1.596 0.639 -0.292 161 H THR 35 H THR 35 -1.445 0.382 2.182 162 HA THR 35 HA THR 35 -3.354 -1.518 1.080 163 HB THR 35 HB THR 35 -4.225 -1.665 3.595 164 HG1 THR 35 1HG THR 35 -2.671 -0.912 4.992 165 1HG2 THR 35 1HG2 THR 35 -1.787 -3.248 3.665 166 2HG2 THR 35 2HG2 THR 35 -3.460 -3.811 3.435 167 3HG2 THR 35 3HG2 THR 35 -2.483 -3.327 2.028 168 H ARG 36 H ARG 36 -5.647 -0.836 1.587 169 HA ARG 36 HA ARG 36 -5.678 2.040 1.346 170 1HB ARG 36 1HB ARG 36 -7.086 -0.070 0.063 171 2HB ARG 36 2HB ARG 36 -8.286 0.723 1.064 172 1HG ARG 36 1HG ARG 36 -8.080 2.779 -0.061 173 2HG ARG 36 2HG ARG 36 -6.438 2.454 -0.579 174 1HD ARG 36 1HD ARG 36 -8.598 0.633 -1.628 175 2HD ARG 36 2HD ARG 36 -8.541 2.263 -2.270 176 HE ARG 36 HE ARG 36 -5.895 1.091 -2.258 177 1HH1 ARG 36 2HH2 ARG 36 -8.954 1.037 -3.998 178 2HH1 ARG 36 1HH2 ARG 36 -8.239 0.544 -5.496 179 1HH2 ARG 36 2HH1 ARG 36 -4.952 0.440 -4.235 180 2HH2 ARG 36 1HH1 ARG 36 -5.948 0.201 -5.632
Contact the webmaster for help, if required. Friday, May 10, 2024 1:50:32 AM GMT (wattos1)