NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
526170 | 2l89 | 17398 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 SER 45 1H SER 45 -15.508 -5.411 -16.421 2 H2 SER 45 2H SER 45 -14.530 -5.906 -15.098 3 H3 SER 45 3H SER 45 -15.292 -7.079 -16.091 4 HA SER 45 HA SER 45 -12.860 -6.667 -16.433 5 HB2 SER 45 1HB SER 45 -13.138 -7.008 -18.853 6 HB3 SER 45 2HB SER 45 -14.330 -7.939 -17.948 7 HG SER 45 HG SER 45 -14.871 -6.368 -19.885 8 H ALA 46 H ALA 46 -13.810 -4.037 -15.541 9 HA ALA 46 HA ALA 46 -12.254 -2.406 -17.414 10 HB1 ALA 46 3HB ALA 46 -14.604 -1.963 -17.915 11 HB2 ALA 46 1HB ALA 46 -13.827 -0.548 -17.205 12 HB3 ALA 46 2HB ALA 46 -14.892 -1.554 -16.224 13 H ASP 47 H ASP 47 -10.988 -0.837 -16.471 14 HA ASP 47 HA ASP 47 -9.727 0.157 -14.865 15 HB2 ASP 47 1HB ASP 47 -12.267 0.850 -14.288 16 HB3 ASP 47 2HB ASP 47 -11.850 0.006 -12.798 17 H ASP 48 H ASP 48 -9.682 -2.729 -15.053 18 HA ASP 48 HA ASP 48 -9.422 -3.660 -12.310 19 HB2 ASP 48 1HB ASP 48 -9.237 -5.016 -14.995 20 HB3 ASP 48 2HB ASP 48 -8.761 -5.834 -13.511 21 H ARG 49 H ARG 49 -7.637 -2.765 -11.394 22 HA ARG 49 HA ARG 49 -5.055 -3.500 -12.584 23 HB2 ARG 49 1HB ARG 49 -5.897 -0.772 -11.624 24 HB3 ARG 49 2HB ARG 49 -4.203 -1.240 -11.682 25 HG2 ARG 49 1HG ARG 49 -4.315 -1.565 -14.056 26 HG3 ARG 49 2HG ARG 49 -6.059 -1.292 -14.052 27 HD2 ARG 49 1HD ARG 49 -5.166 0.973 -12.846 28 HD3 ARG 49 2HD ARG 49 -3.836 0.633 -13.951 29 HE ARG 49 HE ARG 49 -6.439 1.582 -14.634 30 HH11 ARG 49 1HH1 ARG 49 -3.759 -0.340 -15.814 31 HH12 ARG 49 2HH1 ARG 49 -4.135 -0.068 -17.480 32 HH21 ARG 49 1HH2 ARG 49 -6.929 1.939 -16.836 33 HH22 ARG 49 2HH2 ARG 49 -5.935 1.228 -18.061 34 H LEU 50 H LEU 50 -6.582 -4.733 -10.450 35 HA LEU 50 HA LEU 50 -4.601 -4.479 -8.301 36 HB2 LEU 50 1HB LEU 50 -7.597 -4.405 -8.007 37 HB3 LEU 50 2HB LEU 50 -6.548 -4.873 -6.681 38 HG LEU 50 HG LEU 50 -5.389 -2.542 -7.301 39 HD11 LEU 50 1HD1 LEU 50 -7.059 -0.876 -7.872 40 HD12 LEU 50 2HD1 LEU 50 -8.286 -2.133 -8.026 41 HD13 LEU 50 3HD1 LEU 50 -6.930 -2.082 -9.151 42 HD21 LEU 50 3HD2 LEU 50 -6.193 -1.833 -5.311 43 HD22 LEU 50 1HD2 LEU 50 -6.751 -3.502 -5.201 44 HD23 LEU 50 2HD2 LEU 50 -7.863 -2.234 -5.717 45 H ASN 51 H ASN 51 -3.598 -6.399 -8.771 46 HA ASN 51 HA ASN 51 -5.228 -8.834 -8.444 47 HB2 ASN 51 1HB ASN 51 -3.450 -8.051 -10.641 48 HB3 ASN 51 2HB ASN 51 -3.091 -9.647 -9.993 49 HD21 ASN 51 2HD2 ASN 51 -3.884 -10.990 -11.488 50 HD22 ASN 51 1HD2 ASN 51 -5.525 -10.986 -12.055 51 H PHE 52 H PHE 52 -3.328 -10.758 -8.342 52 HA PHE 52 HA PHE 52 -2.251 -10.452 -5.735 53 HB2 PHE 52 1HB PHE 52 -1.465 -12.559 -7.759 54 HB3 PHE 52 2HB PHE 52 -1.337 -12.661 -6.002 55 HD1 PHE 52 HD2 PHE 52 -3.958 -11.706 -5.129 56 HD2 PHE 52 HD1 PHE 52 -2.915 -14.246 -8.381 57 HE1 PHE 52 HE2 PHE 52 -6.186 -12.742 -5.031 58 HE2 PHE 52 HE1 PHE 52 -5.143 -15.286 -8.288 59 HZ PHE 52 HZ PHE 52 -6.782 -14.535 -6.611 60 H GLY 53 H GLY 53 -0.284 -9.849 -5.036 61 HA2 GLY 53 1HA GLY 53 1.904 -9.139 -5.065 62 HA3 GLY 53 2HA GLY 53 2.068 -9.895 -6.643 63 H ASP 54 H ASP 54 -0.380 -7.483 -6.007 64 HA ASP 54 HA ASP 54 1.023 -5.639 -7.812 65 HB2 ASP 54 1HB ASP 54 -1.466 -6.652 -8.113 66 HB3 ASP 54 2HB ASP 54 -1.845 -5.202 -7.188 67 H ARG 55 H ARG 55 1.898 -3.905 -6.917 68 HA ARG 55 HA ARG 55 1.613 -3.231 -4.199 69 HB2 ARG 55 1HB ARG 55 2.693 -1.553 -6.474 70 HB3 ARG 55 2HB ARG 55 2.904 -1.198 -4.764 71 HG2 ARG 55 1HG ARG 55 4.307 -3.055 -4.440 72 HG3 ARG 55 2HG ARG 55 3.848 -3.775 -5.983 73 HD2 ARG 55 1HD ARG 55 5.373 -1.194 -5.657 74 HD3 ARG 55 2HD ARG 55 6.101 -2.758 -6.014 75 HE ARG 55 HE ARG 55 4.067 -2.016 -7.895 76 HH11 ARG 55 1HH1 ARG 55 7.450 -1.627 -7.079 77 HH12 ARG 55 2HH1 ARG 55 7.924 -1.245 -8.700 78 HH21 ARG 55 1HH2 ARG 55 4.701 -1.515 -10.032 79 HH22 ARG 55 2HH2 ARG 55 6.367 -1.187 -10.373 80 H ILE 56 H ILE 56 -0.093 -2.372 -3.253 81 HA ILE 56 HA ILE 56 -1.586 -0.250 -4.647 82 HB ILE 56 HB ILE 56 -3.686 -1.096 -3.662 83 HG12 ILE 56 1HG1 ILE 56 -2.099 -3.584 -2.987 84 HG13 ILE 56 2HG1 ILE 56 -2.591 -2.379 -1.802 85 HG21 ILE 56 1HG2 ILE 56 -2.110 -2.564 -5.685 86 HG22 ILE 56 2HG2 ILE 56 -3.672 -1.757 -5.825 87 HG23 ILE 56 3HG2 ILE 56 -3.568 -3.359 -5.094 88 HD11 ILE 56 3HD1 ILE 56 -4.866 -3.199 -3.319 89 HD12 ILE 56 1HD1 ILE 56 -4.562 -3.349 -1.589 90 HD13 ILE 56 2HD1 ILE 56 -4.024 -4.615 -2.692 91 H LEU 57 H LEU 57 -2.654 1.281 -3.264 92 HA LEU 57 HA LEU 57 -1.230 1.635 -0.738 93 HB2 LEU 57 1HB LEU 57 -1.934 3.405 -2.720 94 HB3 LEU 57 2HB LEU 57 -3.164 3.695 -1.503 95 HG LEU 57 HG LEU 57 -1.357 4.063 0.171 96 HD11 LEU 57 1HD1 LEU 57 0.319 2.734 -1.251 97 HD12 LEU 57 2HD1 LEU 57 0.892 4.172 -0.409 98 HD13 LEU 57 3HD1 LEU 57 0.543 4.241 -2.136 99 HD21 LEU 57 3HD2 LEU 57 -1.149 5.861 -2.238 100 HD22 LEU 57 1HD2 LEU 57 -0.819 6.284 -0.558 101 HD23 LEU 57 2HD2 LEU 57 -2.467 5.911 -1.066 102 H VAL 58 H VAL 58 -2.269 1.949 1.248 103 HA VAL 58 HA VAL 58 -5.150 1.515 1.380 104 HB VAL 58 HB VAL 58 -4.227 -0.742 1.456 105 HG11 VAL 58 1HG1 VAL 58 -2.709 0.142 3.906 106 HG12 VAL 58 2HG1 VAL 58 -1.995 -0.146 2.320 107 HG13 VAL 58 3HG1 VAL 58 -2.736 -1.477 3.208 108 HG21 VAL 58 3HG2 VAL 58 -5.538 -1.492 3.174 109 HG22 VAL 58 1HG2 VAL 58 -6.146 0.155 3.012 110 HG23 VAL 58 2HG2 VAL 58 -4.994 -0.239 4.288 111 H LYS 59 H LYS 59 -6.107 2.584 3.035 112 HA LYS 59 HA LYS 59 -4.493 4.364 4.612 113 HB2 LYS 59 1HB LYS 59 -6.914 4.685 3.630 114 HB3 LYS 59 2HB LYS 59 -7.406 3.937 5.144 115 HG2 LYS 59 1HG LYS 59 -6.885 5.754 6.367 116 HG3 LYS 59 2HG LYS 59 -5.472 6.144 5.386 117 HD2 LYS 59 1HD LYS 59 -6.671 7.783 4.471 118 HD3 LYS 59 2HD LYS 59 -7.648 6.540 3.690 119 HE2 LYS 59 1HE LYS 59 -8.362 7.103 6.486 120 HE3 LYS 59 2HE LYS 59 -8.613 8.448 5.375 121 HZ1 LYS 59 3HZ LYS 59 -10.585 7.391 5.121 122 HZ2 LYS 59 1HZ LYS 59 -9.965 5.863 5.501 123 HZ3 LYS 59 2HZ LYS 59 -9.716 6.518 3.962 124 H ALA 60 H ALA 60 -3.557 3.871 6.478 125 HA ALA 60 HA ALA 60 -4.287 1.459 7.906 126 HB1 ALA 60 3HB ALA 60 -1.911 2.735 7.505 127 HB2 ALA 60 1HB ALA 60 -2.203 1.512 8.741 128 HB3 ALA 60 2HB ALA 60 -2.307 3.224 9.152 129 HA PRO 61 HA PRO 61 -6.928 3.157 11.006 130 HB2 PRO 61 1HB PRO 61 -5.332 1.666 13.019 131 HB3 PRO 61 2HB PRO 61 -7.063 1.588 12.673 132 HG2 PRO 61 1HG PRO 61 -5.439 -0.382 11.920 133 HG3 PRO 61 2HG PRO 61 -6.773 0.146 10.878 134 HD2 PRO 61 1HD PRO 61 -3.848 0.750 10.664 135 HD3 PRO 61 2HD PRO 61 -5.018 0.380 9.381 136 H GLY 62 H GLY 62 -6.482 5.311 11.194 137 HA2 GLY 62 1HA GLY 62 -5.919 7.075 12.669 138 HA3 GLY 62 2HA GLY 62 -4.658 6.066 13.356 139 H TYR 63 H TYR 63 -3.539 5.315 10.754 140 HA TYR 63 HA TYR 63 -2.093 7.815 10.234 141 HB2 TYR 63 1HB TYR 63 -1.392 4.923 9.717 142 HB3 TYR 63 2HB TYR 63 -0.423 6.267 9.125 143 HD1 TYR 63 HD2 TYR 63 0.668 7.807 10.782 144 HD2 TYR 63 HD1 TYR 63 -1.210 4.173 11.959 145 HE1 TYR 63 HE2 TYR 63 1.888 7.873 12.916 146 HE2 TYR 63 HE1 TYR 63 0.004 4.232 14.097 147 HH TYR 63 HH TYR 63 2.632 5.907 14.678 148 HA PRO 64 HA PRO 64 -3.651 8.356 6.143 149 HB2 PRO 64 1HB PRO 64 -1.402 9.008 4.724 150 HB3 PRO 64 2HB PRO 64 -2.232 10.120 5.817 151 HG2 PRO 64 1HG PRO 64 0.205 8.454 6.298 152 HG3 PRO 64 2HG PRO 64 -0.117 10.132 6.773 153 HD2 PRO 64 1HD PRO 64 -0.323 8.084 8.512 154 HD3 PRO 64 2HD PRO 64 -1.385 9.504 8.599 155 H TRP 65 H TRP 65 -2.730 7.848 3.679 156 HA TRP 65 HA TRP 65 -3.041 5.053 3.406 157 HB2 TRP 65 1HB TRP 65 -2.003 6.986 1.324 158 HB3 TRP 65 2HB TRP 65 -2.701 5.401 1.027 159 HD1 TRP 65 HD1 TRP 65 -3.719 8.941 2.138 160 HE1 TRP 65 HE1 TRP 65 -6.236 9.239 1.697 161 HE3 TRP 65 HE3 TRP 65 -4.864 4.169 0.698 162 HZ2 TRP 65 HZ2 TRP 65 -8.418 7.662 0.849 163 HZ3 TRP 65 HZ3 TRP 65 -7.189 3.650 0.086 164 HH2 TRP 65 HH2 TRP 65 -8.929 5.361 0.161 165 H TRP 66 H TRP 66 -1.601 3.475 3.615 166 HA TRP 66 HA TRP 66 1.260 4.142 3.446 167 HB2 TRP 66 1HB TRP 66 0.047 3.090 5.573 168 HB3 TRP 66 2HB TRP 66 0.342 1.594 4.691 169 HD1 TRP 66 HD1 TRP 66 2.622 0.515 5.117 170 HE1 TRP 66 HE1 TRP 66 4.888 1.297 6.053 171 HE3 TRP 66 HE3 TRP 66 1.579 5.485 5.718 172 HZ2 TRP 66 HZ2 TRP 66 6.071 3.700 6.935 173 HZ3 TRP 66 HZ3 TRP 66 3.339 6.956 6.610 174 HH2 TRP 66 HH2 TRP 66 5.540 6.078 7.197 175 HA PRO 67 HA PRO 67 1.607 1.607 -0.170 176 HB2 PRO 67 1HB PRO 67 4.248 1.012 -0.076 177 HB3 PRO 67 2HB PRO 67 3.646 2.618 -0.502 178 HG2 PRO 67 1HG PRO 67 4.670 1.620 2.133 179 HG3 PRO 67 2HG PRO 67 5.042 3.137 1.296 180 HD2 PRO 67 1HD PRO 67 3.257 3.022 3.308 181 HD3 PRO 67 2HD PRO 67 3.053 4.127 1.937 182 H ALA 68 H ALA 68 0.649 -0.329 -0.125 183 HA ALA 68 HA ALA 68 1.966 -2.522 1.359 184 HB1 ALA 68 3HB ALA 68 -0.815 -3.072 0.938 185 HB2 ALA 68 1HB ALA 68 -0.636 -1.517 1.751 186 HB3 ALA 68 2HB ALA 68 0.087 -2.965 2.452 187 H LEU 69 H LEU 69 1.074 -4.716 0.436 188 HA LEU 69 HA LEU 69 0.928 -4.551 -2.503 189 HB2 LEU 69 1HB LEU 69 3.047 -5.658 -0.905 190 HB3 LEU 69 2HB LEU 69 2.300 -6.925 -1.855 191 HG LEU 69 HG LEU 69 3.004 -4.411 -3.272 192 HD11 LEU 69 1HD1 LEU 69 4.989 -6.278 -2.054 193 HD12 LEU 69 2HD1 LEU 69 5.047 -4.523 -2.221 194 HD13 LEU 69 3HD1 LEU 69 5.322 -5.553 -3.626 195 HD21 LEU 69 3HD2 LEU 69 2.646 -7.287 -3.862 196 HD22 LEU 69 1HD2 LEU 69 3.848 -6.421 -4.819 197 HD23 LEU 69 2HD2 LEU 69 2.174 -5.867 -4.793 198 H LEU 70 H LEU 70 -0.852 -5.515 -3.227 199 HA LEU 70 HA LEU 70 -2.602 -7.014 -1.629 200 HB2 LEU 70 1HB LEU 70 -2.896 -5.773 -3.958 201 HB3 LEU 70 2HB LEU 70 -2.640 -7.391 -4.582 202 HG LEU 70 HG LEU 70 -4.678 -7.048 -2.438 203 HD11 LEU 70 1HD1 LEU 70 -4.776 -5.700 -5.028 204 HD12 LEU 70 2HD1 LEU 70 -5.738 -5.442 -3.573 205 HD13 LEU 70 3HD1 LEU 70 -6.170 -6.727 -4.699 206 HD21 LEU 70 3HD2 LEU 70 -5.151 -8.610 -4.900 207 HD22 LEU 70 1HD2 LEU 70 -5.491 -9.010 -3.216 208 HD23 LEU 70 2HD2 LEU 70 -3.855 -9.178 -3.849 209 H LEU 71 H LEU 71 -2.758 -9.101 -1.123 210 HA LEU 71 HA LEU 71 -0.834 -10.970 -2.327 211 HB2 LEU 71 1HB LEU 71 -2.187 -10.843 0.344 212 HB3 LEU 71 2HB LEU 71 -1.593 -12.376 -0.261 213 HG LEU 71 HG LEU 71 0.039 -9.910 0.334 214 HD11 LEU 71 1HD1 LEU 71 1.163 -11.828 1.776 215 HD12 LEU 71 2HD1 LEU 71 -0.466 -12.497 1.697 216 HD13 LEU 71 3HD1 LEU 71 -0.204 -10.890 2.374 217 HD21 LEU 71 3HD2 LEU 71 1.046 -10.845 -1.585 218 HD22 LEU 71 1HD2 LEU 71 0.795 -12.494 -1.008 219 HD23 LEU 71 2HD2 LEU 71 1.975 -11.451 -0.214 220 H ARG 72 H ARG 72 -4.171 -10.982 -1.033 221 HA ARG 72 HA ARG 72 -5.113 -12.439 -3.343 222 HB2 ARG 72 1HB ARG 72 -4.535 -13.774 -0.803 223 HB3 ARG 72 2HB ARG 72 -6.182 -14.033 -1.361 224 HG2 ARG 72 1HG ARG 72 -4.455 -14.386 -3.582 225 HG3 ARG 72 2HG ARG 72 -3.791 -15.293 -2.223 226 HD2 ARG 72 1HD ARG 72 -5.724 -16.592 -1.992 227 HD3 ARG 72 2HD ARG 72 -6.700 -15.467 -2.935 228 HE ARG 72 HE ARG 72 -6.001 -16.514 -4.848 229 HH11 ARG 72 1HH1 ARG 72 -3.914 -17.497 -2.212 230 HH12 ARG 72 2HH1 ARG 72 -3.116 -18.723 -3.136 231 HH21 ARG 72 1HH2 ARG 72 -4.944 -18.134 -6.064 232 HH22 ARG 72 2HH2 ARG 72 -3.701 -19.085 -5.324 233 H ARG 73 H ARG 73 -7.458 -12.694 -3.370 234 HA ARG 73 HA ARG 73 -8.767 -10.517 -1.903 235 HB2 ARG 73 1HB ARG 73 -8.867 -10.633 -4.429 236 HB3 ARG 73 2HB ARG 73 -9.855 -12.075 -4.253 237 HG2 ARG 73 1HG ARG 73 -10.749 -9.682 -2.767 238 HG3 ARG 73 2HG ARG 73 -10.870 -9.615 -4.526 239 HD2 ARG 73 1HD ARG 73 -11.959 -11.872 -2.854 240 HD3 ARG 73 2HD ARG 73 -12.914 -10.476 -3.348 241 HE ARG 73 HE ARG 73 -12.026 -11.339 -5.704 242 HH11 ARG 73 1HH1 ARG 73 -13.394 -13.131 -3.024 243 HH12 ARG 73 2HH1 ARG 73 -14.081 -14.356 -4.032 244 HH21 ARG 73 1HH2 ARG 73 -12.936 -12.967 -7.029 245 HH22 ARG 73 2HH2 ARG 73 -13.820 -14.265 -6.302 246 H LYS 74 H LYS 74 -9.409 -11.314 0.032 247 HA LYS 74 HA LYS 74 -10.765 -13.904 0.134 248 HB2 LYS 74 1HB LYS 74 -10.678 -13.441 2.661 249 HB3 LYS 74 2HB LYS 74 -9.169 -13.797 1.835 250 HG2 LYS 74 1HG LYS 74 -8.378 -11.658 2.055 251 HG3 LYS 74 2HG LYS 74 -9.993 -10.954 2.157 252 HD2 LYS 74 1HD LYS 74 -9.360 -12.805 4.337 253 HD3 LYS 74 2HD LYS 74 -8.317 -11.382 4.277 254 HE2 LYS 74 1HE LYS 74 -10.105 -10.731 5.638 255 HE3 LYS 74 2HE LYS 74 -10.473 -10.028 4.063 256 HZ1 LYS 74 3HZ LYS 74 -12.187 -11.485 3.710 257 HZ2 LYS 74 1HZ LYS 74 -12.289 -11.310 5.390 258 HZ3 LYS 74 2HZ LYS 74 -11.555 -12.681 4.726 259 H GLU 75 H GLU 75 -12.895 -14.089 0.243 260 HA GLU 75 HA GLU 75 -14.487 -11.697 0.901 261 HB2 GLU 75 1HB GLU 75 -14.516 -13.202 -1.422 262 HB3 GLU 75 2HB GLU 75 -15.896 -13.819 -0.527 263 HG2 GLU 75 1HG GLU 75 -16.478 -11.305 -0.221 264 HG3 GLU 75 2HG GLU 75 -15.404 -11.084 -1.603 265 H THR 76 H THR 76 -16.029 -11.821 2.455 266 HA THR 76 HA THR 76 -16.754 -14.455 3.504 267 HB THR 76 HB THR 76 -14.950 -13.627 4.948 268 HG1 THR 76 HG1 THR 76 -16.047 -13.917 6.865 269 HG21 THR 76 3HG2 THR 76 -16.690 -11.215 5.214 270 HG22 THR 76 1HG2 THR 76 -14.953 -11.318 4.931 271 HG23 THR 76 2HG2 THR 76 -15.612 -11.705 6.520 272 H LYS 77 H LYS 77 -18.816 -14.633 4.289 273 HA LYS 77 HA LYS 77 -20.499 -12.219 4.200 274 HB2 LYS 77 1HB LYS 77 -22.256 -13.446 3.086 275 HB3 LYS 77 2HB LYS 77 -20.780 -13.586 2.144 276 HG2 LYS 77 1HG LYS 77 -20.461 -15.815 3.422 277 HG3 LYS 77 2HG LYS 77 -22.182 -15.661 3.773 278 HD2 LYS 77 1HD LYS 77 -22.482 -16.704 1.812 279 HD3 LYS 77 2HD LYS 77 -22.102 -15.139 1.092 280 HE2 LYS 77 1HE LYS 77 -20.097 -15.834 0.338 281 HE3 LYS 77 2HE LYS 77 -19.760 -16.767 1.796 282 HZ1 LYS 77 3HZ LYS 77 -19.978 -18.180 -0.161 283 HZ2 LYS 77 1HZ LYS 77 -21.556 -17.623 -0.413 284 HZ3 LYS 77 2HZ LYS 77 -21.187 -18.524 0.971 285 H ASP 78 H ASP 78 -22.873 -13.112 5.040 286 HA ASP 78 HA ASP 78 -22.628 -13.368 7.792 287 HB2 ASP 78 1HB ASP 78 -24.685 -12.673 6.459 288 HB3 ASP 78 2HB ASP 78 -25.002 -14.389 6.230 289 H SER 79 H SER 79 -23.486 -15.925 5.452 290 HA SER 79 HA SER 79 -21.944 -17.891 6.807 291 HB2 SER 79 1HB SER 79 -24.854 -17.717 7.395 292 HB3 SER 79 2HB SER 79 -24.203 -19.326 7.092 293 HG SER 79 HG SER 79 -22.560 -18.738 8.712 294 H LEU 80 H LEU 80 -25.048 -18.321 5.118 295 HA LEU 80 HA LEU 80 -23.716 -18.929 2.618 296 HB2 LEU 80 1HB LEU 80 -24.567 -21.193 2.440 297 HB3 LEU 80 2HB LEU 80 -23.522 -21.040 3.838 298 HG LEU 80 HG LEU 80 -26.345 -20.614 4.471 299 HD11 LEU 80 1HD1 LEU 80 -27.070 -22.226 3.054 300 HD12 LEU 80 2HD1 LEU 80 -26.544 -23.264 4.379 301 HD13 LEU 80 3HD1 LEU 80 -25.500 -23.025 2.978 302 HD21 LEU 80 3HD2 LEU 80 -25.138 -20.929 6.364 303 HD22 LEU 80 1HD2 LEU 80 -23.964 -21.983 5.575 304 HD23 LEU 80 2HD2 LEU 80 -25.543 -22.616 6.044 305 H ASN 81 H ASN 81 -25.760 -17.051 3.659 306 HA ASN 81 HA ASN 81 -28.176 -17.880 2.239 307 HB2 ASN 81 1HB ASN 81 -27.645 -16.277 4.548 308 HB3 ASN 81 2HB ASN 81 -28.488 -15.295 3.357 309 HD21 ASN 81 2HD2 ASN 81 -30.502 -15.191 4.086 310 HD22 ASN 81 1HD2 ASN 81 -31.498 -16.563 4.469 311 H THR 82 H THR 82 -25.542 -15.601 2.010 312 HA THR 82 HA THR 82 -25.002 -13.958 0.538 313 HB THR 82 HB THR 82 -25.259 -14.569 -1.844 314 HG1 THR 82 HG1 THR 82 -27.150 -15.583 -2.044 315 HG21 THR 82 3HG2 THR 82 -23.365 -15.562 -0.981 316 HG22 THR 82 1HG2 THR 82 -24.248 -16.925 -1.667 317 HG23 THR 82 2HG2 THR 82 -24.284 -16.637 0.072 318 H ASN 83 H ASN 83 -27.578 -13.555 1.833 319 HA ASN 83 HA ASN 83 -28.642 -11.601 -0.038 320 HB2 ASN 83 1HB ASN 83 -30.923 -12.306 0.196 321 HB3 ASN 83 2HB ASN 83 -29.973 -13.697 -0.307 322 HD21 ASN 83 2HD2 ASN 83 -32.319 -14.300 0.649 323 HD22 ASN 83 1HD2 ASN 83 -32.232 -14.927 2.266 324 H SER 84 H SER 84 -27.085 -11.547 2.489 325 HA SER 84 HA SER 84 -28.948 -9.920 4.084 326 HB2 SER 84 1HB SER 84 -26.903 -11.933 4.957 327 HB3 SER 84 2HB SER 84 -27.307 -10.580 6.017 328 HG SER 84 HG SER 84 -28.627 -12.399 6.424 329 H SER 85 H SER 85 -25.413 -10.445 4.145 330 HA SER 85 HA SER 85 -24.827 -7.845 3.114 331 HB2 SER 85 1HB SER 85 -25.548 -7.250 5.410 332 HB3 SER 85 2HB SER 85 -24.312 -8.324 6.060 333 HG SER 85 HG SER 85 -24.033 -5.852 4.775 334 H PHE 86 H PHE 86 -22.952 -8.029 2.085 335 HA PHE 86 HA PHE 86 -21.182 -10.258 2.738 336 HB2 PHE 86 1HB PHE 86 -21.425 -8.436 0.351 337 HB3 PHE 86 2HB PHE 86 -20.033 -9.491 0.570 338 HD1 PHE 86 HD1 PHE 86 -20.295 -11.925 0.488 339 HD2 PHE 86 HD2 PHE 86 -23.557 -9.303 -0.288 340 HE1 PHE 86 HE1 PHE 86 -21.534 -13.779 -0.552 341 HE2 PHE 86 HE2 PHE 86 -24.801 -11.152 -1.327 342 HZ PHE 86 HZ PHE 86 -23.790 -13.393 -1.461 343 H ASN 87 H ASN 87 -18.931 -9.994 3.040 344 HA ASN 87 HA ASN 87 -17.995 -7.269 3.583 345 HB2 ASN 87 1HB ASN 87 -18.537 -9.270 5.568 346 HB3 ASN 87 2HB ASN 87 -16.803 -8.972 5.520 347 HD21 ASN 87 2HD2 ASN 87 -19.950 -7.446 5.893 348 HD22 ASN 87 1HD2 ASN 87 -19.378 -6.076 6.793 349 H VAL 88 H VAL 88 -16.901 -7.535 1.561 350 HA VAL 88 HA VAL 88 -14.749 -9.520 1.502 351 HB VAL 88 HB VAL 88 -16.105 -9.375 -0.511 352 HG11 VAL 88 1HG1 VAL 88 -15.208 -6.502 -0.623 353 HG12 VAL 88 2HG1 VAL 88 -16.856 -7.098 -0.429 354 HG13 VAL 88 3HG1 VAL 88 -15.999 -7.354 -1.948 355 HG21 VAL 88 3HG2 VAL 88 -13.728 -9.968 -0.710 356 HG22 VAL 88 1HG2 VAL 88 -13.340 -8.270 -0.993 357 HG23 VAL 88 2HG2 VAL 88 -14.333 -9.153 -2.153 358 H LEU 89 H LEU 89 -12.610 -9.012 1.465 359 HA LEU 89 HA LEU 89 -11.842 -6.182 1.554 360 HB2 LEU 89 1HB LEU 89 -10.540 -8.107 3.439 361 HB3 LEU 89 2HB LEU 89 -10.595 -6.358 3.508 362 HG LEU 89 HG LEU 89 -13.073 -8.011 3.926 363 HD11 LEU 89 1HD1 LEU 89 -12.656 -7.871 6.334 364 HD12 LEU 89 2HD1 LEU 89 -11.069 -7.170 6.017 365 HD13 LEU 89 3HD1 LEU 89 -11.420 -8.822 5.513 366 HD21 LEU 89 3HD2 LEU 89 -13.277 -5.810 5.480 367 HD22 LEU 89 1HD2 LEU 89 -13.861 -5.902 3.819 368 HD23 LEU 89 2HD2 LEU 89 -12.289 -5.183 4.162 369 H TYR 90 H TYR 90 -9.273 -6.130 1.691 370 HA TYR 90 HA TYR 90 -8.258 -8.072 -0.282 371 HB2 TYR 90 1HB TYR 90 -8.272 -5.139 -0.310 372 HB3 TYR 90 2HB TYR 90 -6.686 -5.838 -0.628 373 HD1 TYR 90 HD1 TYR 90 -7.632 -8.353 -2.034 374 HD2 TYR 90 HD2 TYR 90 -8.766 -4.275 -2.453 375 HE1 TYR 90 HE1 TYR 90 -8.290 -8.782 -4.354 376 HE2 TYR 90 HE2 TYR 90 -9.429 -4.693 -4.780 377 HH TYR 90 HH TYR 90 -8.507 -7.330 -6.509 378 H LYS 91 H LYS 91 -6.788 -9.353 0.636 379 HA LYS 91 HA LYS 91 -5.373 -8.614 3.023 380 HB2 LYS 91 1HB LYS 91 -6.041 -10.941 2.603 381 HB3 LYS 91 2HB LYS 91 -5.016 -10.989 1.177 382 HG2 LYS 91 1HG LYS 91 -3.068 -11.052 2.411 383 HG3 LYS 91 2HG LYS 91 -3.825 -10.343 3.837 384 HD2 LYS 91 1HD LYS 91 -4.396 -13.109 2.768 385 HD3 LYS 91 2HD LYS 91 -3.304 -12.750 4.105 386 HE2 LYS 91 1HE LYS 91 -6.282 -12.282 4.000 387 HE3 LYS 91 2HE LYS 91 -5.420 -13.444 5.004 388 HZ1 LYS 91 3HZ LYS 91 -5.929 -11.632 6.387 389 HZ2 LYS 91 1HZ LYS 91 -5.430 -10.490 5.242 390 HZ3 LYS 91 2HZ LYS 91 -4.286 -11.457 6.029 391 H VAL 92 H VAL 92 -3.878 -7.031 2.824 392 HA VAL 92 HA VAL 92 -1.926 -7.261 0.622 393 HB VAL 92 HB VAL 92 -1.588 -4.872 0.711 394 HG11 VAL 92 1HG1 VAL 92 -4.167 -4.231 0.363 395 HG12 VAL 92 2HG1 VAL 92 -4.285 -5.988 0.274 396 HG13 VAL 92 3HG1 VAL 92 -3.217 -5.120 -0.827 397 HG21 VAL 92 3HG2 VAL 92 -3.065 -3.451 2.145 398 HG22 VAL 92 1HG2 VAL 92 -1.876 -4.401 3.038 399 HG23 VAL 92 2HG2 VAL 92 -3.563 -4.917 2.989 400 H LEU 93 H LEU 93 0.257 -6.703 1.028 401 HA LEU 93 HA LEU 93 1.087 -7.223 3.793 402 HB2 LEU 93 1HB LEU 93 2.390 -7.549 1.118 403 HB3 LEU 93 2HB LEU 93 3.397 -7.361 2.541 404 HG LEU 93 HG LEU 93 1.321 -9.522 2.184 405 HD11 LEU 93 1HD1 LEU 93 3.425 -9.544 0.694 406 HD12 LEU 93 2HD1 LEU 93 2.997 -11.003 1.586 407 HD13 LEU 93 3HD1 LEU 93 4.281 -9.950 2.181 408 HD21 LEU 93 3HD2 LEU 93 1.641 -9.025 4.507 409 HD22 LEU 93 1HD2 LEU 93 3.394 -9.027 4.314 410 HD23 LEU 93 2HD2 LEU 93 2.486 -10.529 4.139 411 H PHE 94 H PHE 94 2.138 -5.736 4.987 412 HA PHE 94 HA PHE 94 2.416 -3.053 3.838 413 HB2 PHE 94 1HB PHE 94 1.990 -4.176 6.543 414 HB3 PHE 94 2HB PHE 94 3.006 -2.742 6.474 415 HD1 PHE 94 HD1 PHE 94 -0.211 -3.924 4.962 416 HD2 PHE 94 HD2 PHE 94 1.943 -0.756 6.824 417 HE1 PHE 94 HE1 PHE 94 -2.222 -2.512 4.885 418 HE2 PHE 94 HE2 PHE 94 -0.066 0.659 6.745 419 HZ PHE 94 HZ PHE 94 -2.152 -0.217 5.777 420 H PHE 95 H PHE 95 4.324 -1.742 4.402 421 HA PHE 95 HA PHE 95 6.767 -3.219 5.035 422 HB2 PHE 95 1HB PHE 95 6.656 -1.466 2.575 423 HB3 PHE 95 2HB PHE 95 7.943 -2.557 3.067 424 HD1 PHE 95 HD1 PHE 95 7.730 -4.961 2.745 425 HD2 PHE 95 HD2 PHE 95 4.695 -2.274 1.449 426 HE1 PHE 95 HE1 PHE 95 6.756 -6.737 1.352 427 HE2 PHE 95 HE2 PHE 95 3.715 -4.045 0.054 428 HZ PHE 95 HZ PHE 95 4.744 -6.282 0.006 429 HA PRO 96 HA PRO 96 9.100 -2.380 4.451 430 HB2 PRO 96 1HB PRO 96 10.677 -1.772 6.832 431 HB3 PRO 96 2HB PRO 96 11.104 -1.578 5.128 432 HG2 PRO 96 1HG PRO 96 10.646 0.525 6.775 433 HG3 PRO 96 2HG PRO 96 10.302 0.568 5.037 434 HD2 PRO 96 1HD PRO 96 8.422 0.179 7.335 435 HD3 PRO 96 2HD PRO 96 8.204 1.123 5.846 436 H ASP 97 H ASP 97 7.873 -2.035 7.736 437 HA ASP 97 HA ASP 97 8.668 -4.496 8.791 438 HB2 ASP 97 1HB ASP 97 6.287 -2.731 9.368 439 HB3 ASP 97 2HB ASP 97 6.562 -4.234 10.241 440 H PHE 98 H PHE 98 8.309 -6.416 7.912 441 HA PHE 98 HA PHE 98 6.409 -7.046 5.983 442 HB2 PHE 98 1HB PHE 98 8.104 -8.696 7.825 443 HB3 PHE 98 2HB PHE 98 6.890 -9.478 6.820 444 HD1 PHE 98 HD1 PHE 98 6.978 -8.356 4.274 445 HD2 PHE 98 HD2 PHE 98 10.220 -8.882 6.984 446 HE1 PHE 98 HE1 PHE 98 8.552 -8.380 2.383 447 HE2 PHE 98 HE2 PHE 98 11.797 -8.904 5.095 448 HZ PHE 98 HZ PHE 98 10.964 -8.654 2.793 449 H ASN 99 H ASN 99 4.456 -6.159 6.796 450 HA ASN 99 HA ASN 99 3.032 -7.974 8.621 451 HB2 ASN 99 1HB ASN 99 3.585 -5.182 9.007 452 HB3 ASN 99 2HB ASN 99 1.850 -5.395 8.808 453 HD21 ASN 99 2HD2 ASN 99 3.470 -4.663 11.166 454 HD22 ASN 99 1HD2 ASN 99 3.048 -5.821 12.389 455 H PHE 100 H PHE 100 0.488 -6.928 8.396 456 HA PHE 100 HA PHE 100 -0.150 -6.425 5.638 457 HB2 PHE 100 1HB PHE 100 -1.763 -8.567 5.796 458 HB3 PHE 100 2HB PHE 100 -0.155 -8.632 5.088 459 HD1 PHE 100 HD2 PHE 100 1.718 -9.565 6.364 460 HD2 PHE 100 HD1 PHE 100 -2.277 -9.695 7.817 461 HE1 PHE 100 HE2 PHE 100 2.369 -11.299 7.984 462 HE2 PHE 100 HE1 PHE 100 -1.637 -11.420 9.441 463 HZ PHE 100 HZ PHE 100 0.691 -12.230 9.527 464 H ALA 101 H ALA 101 -2.630 -6.591 5.329 465 HA ALA 101 HA ALA 101 -4.195 -6.081 7.706 466 HB1 ALA 101 3HB ALA 101 -3.071 -3.909 6.156 467 HB2 ALA 101 1HB ALA 101 -3.918 -3.868 7.702 468 HB3 ALA 101 2HB ALA 101 -4.832 -3.837 6.195 469 H TRP 102 H TRP 102 -6.475 -5.962 7.282 470 HA TRP 102 HA TRP 102 -7.237 -6.882 4.591 471 HB2 TRP 102 1HB TRP 102 -9.191 -7.986 6.111 472 HB3 TRP 102 2HB TRP 102 -7.730 -8.839 5.632 473 HD1 TRP 102 HD1 TRP 102 -5.655 -8.653 7.585 474 HE1 TRP 102 HE1 TRP 102 -5.900 -8.901 10.134 475 HE3 TRP 102 HE3 TRP 102 -10.658 -7.701 8.016 476 HZ2 TRP 102 HZ2 TRP 102 -7.947 -8.722 12.073 477 HZ3 TRP 102 HZ3 TRP 102 -11.682 -7.760 10.251 478 HH2 TRP 102 HH2 TRP 102 -10.353 -8.260 12.237 479 H VAL 103 H VAL 103 -8.160 -5.156 3.706 480 HA VAL 103 HA VAL 103 -10.488 -3.978 5.041 481 HB VAL 103 HB VAL 103 -9.750 -1.705 4.172 482 HG11 VAL 103 1HG1 VAL 103 -9.742 -1.995 6.495 483 HG12 VAL 103 2HG1 VAL 103 -8.131 -1.385 6.118 484 HG13 VAL 103 3HG1 VAL 103 -8.370 -3.102 6.442 485 HG21 VAL 103 3HG2 VAL 103 -7.011 -1.874 4.339 486 HG22 VAL 103 1HG2 VAL 103 -7.944 -1.722 2.851 487 HG23 VAL 103 2HG2 VAL 103 -7.437 -3.312 3.413 488 H LYS 104 H LYS 104 -11.925 -2.827 3.563 489 HA LYS 104 HA LYS 104 -12.314 -4.229 1.130 490 HB2 LYS 104 1HB LYS 104 -13.945 -2.803 2.729 491 HB3 LYS 104 2HB LYS 104 -13.634 -1.592 1.494 492 HG2 LYS 104 1HG LYS 104 -14.774 -2.731 -0.111 493 HG3 LYS 104 2HG LYS 104 -14.404 -4.307 0.588 494 HD2 LYS 104 1HD LYS 104 -15.934 -3.180 2.544 495 HD3 LYS 104 2HD LYS 104 -16.664 -2.501 1.089 496 HE2 LYS 104 1HE LYS 104 -16.098 -5.346 0.843 497 HE3 LYS 104 2HE LYS 104 -17.185 -4.986 2.182 498 HZ1 LYS 104 3HZ LYS 104 -18.329 -3.517 0.341 499 HZ2 LYS 104 1HZ LYS 104 -18.677 -5.166 0.495 500 HZ3 LYS 104 2HZ LYS 104 -17.598 -4.637 -0.694 501 H ARG 105 H ARG 105 -12.526 -3.197 -1.027 502 HA ARG 105 HA ARG 105 -10.138 -2.000 -1.873 503 HB2 ARG 105 1HB ARG 105 -12.774 -1.847 -3.335 504 HB3 ARG 105 2HB ARG 105 -11.163 -1.766 -4.031 505 HG2 ARG 105 1HG ARG 105 -11.001 -3.981 -4.170 506 HG3 ARG 105 2HG ARG 105 -11.606 -4.216 -2.530 507 HD2 ARG 105 1HD ARG 105 -13.479 -5.003 -3.437 508 HD3 ARG 105 2HD ARG 105 -13.818 -3.362 -3.982 509 HE ARG 105 HE ARG 105 -12.107 -4.785 -5.780 510 HH11 ARG 105 1HH1 ARG 105 -15.451 -4.311 -4.850 511 HH12 ARG 105 2HH1 ARG 105 -16.074 -4.752 -6.403 512 HH21 ARG 105 1HH2 ARG 105 -12.938 -5.364 -7.827 513 HH22 ARG 105 2HH2 ARG 105 -14.648 -5.350 -8.092 514 H ASN 106 H ASN 106 -12.985 -0.573 -0.530 515 HA ASN 106 HA ASN 106 -12.904 1.990 -1.645 516 HB2 ASN 106 1HB ASN 106 -13.983 0.852 0.902 517 HB3 ASN 106 2HB ASN 106 -13.929 2.602 0.705 518 HD21 ASN 106 2HD2 ASN 106 -15.135 -0.382 -0.733 519 HD22 ASN 106 1HD2 ASN 106 -16.496 0.342 -1.530 520 H SER 107 H SER 107 -11.177 0.627 1.132 521 HA SER 107 HA SER 107 -9.821 3.177 1.584 522 HB2 SER 107 1HB SER 107 -9.079 2.292 3.650 523 HB3 SER 107 2HB SER 107 -10.734 1.713 3.470 524 HG SER 107 HG SER 107 -8.320 0.306 3.287 525 H VAL 108 H VAL 108 -9.387 1.204 -0.755 526 HA VAL 108 HA VAL 108 -6.456 1.194 -0.560 527 HB VAL 108 HB VAL 108 -8.131 -1.030 -1.729 528 HG11 VAL 108 1HG1 VAL 108 -5.297 -1.556 -1.365 529 HG12 VAL 108 2HG1 VAL 108 -5.594 -0.242 -2.501 530 HG13 VAL 108 3HG1 VAL 108 -6.323 -1.824 -2.772 531 HG21 VAL 108 3HG2 VAL 108 -8.000 -0.907 0.784 532 HG22 VAL 108 1HG2 VAL 108 -6.264 -1.175 0.628 533 HG23 VAL 108 2HG2 VAL 108 -7.401 -2.399 0.066 534 H LYS 109 H LYS 109 -5.409 1.979 -2.333 535 HA LYS 109 HA LYS 109 -7.003 2.428 -4.771 536 HB2 LYS 109 1HB LYS 109 -5.756 4.537 -5.112 537 HB3 LYS 109 2HB LYS 109 -6.734 4.555 -3.654 538 HG2 LYS 109 1HG LYS 109 -4.863 4.375 -2.259 539 HG3 LYS 109 2HG LYS 109 -3.816 3.872 -3.587 540 HD2 LYS 109 1HD LYS 109 -5.113 6.501 -3.905 541 HD3 LYS 109 2HD LYS 109 -3.923 6.391 -2.607 542 HE2 LYS 109 1HE LYS 109 -2.199 6.263 -4.039 543 HE3 LYS 109 2HE LYS 109 -3.052 5.153 -5.111 544 HZ1 LYS 109 3HZ LYS 109 -2.451 7.631 -5.798 545 HZ2 LYS 109 1HZ LYS 109 -3.966 7.923 -5.101 546 HZ3 LYS 109 2HZ LYS 109 -3.823 6.834 -6.387 547 HA PRO 110 HA PRO 110 -3.792 0.357 -6.982 548 HB2 PRO 110 1HB PRO 110 -3.916 1.609 -9.395 549 HB3 PRO 110 2HB PRO 110 -5.122 0.439 -8.850 550 HG2 PRO 110 1HG PRO 110 -5.232 3.430 -8.808 551 HG3 PRO 110 2HG PRO 110 -6.494 2.269 -9.263 552 HD2 PRO 110 1HD PRO 110 -6.445 3.478 -6.846 553 HD3 PRO 110 2HD PRO 110 -7.053 1.825 -7.068 554 H LEU 111 H LEU 111 -1.655 0.576 -6.792 555 HA LEU 111 HA LEU 111 -0.487 3.268 -7.034 556 HB2 LEU 111 1HB LEU 111 -0.379 2.009 -4.809 557 HB3 LEU 111 2HB LEU 111 0.762 0.938 -5.597 558 HG LEU 111 HG LEU 111 2.308 2.779 -5.952 559 HD11 LEU 111 1HD1 LEU 111 0.952 4.659 -6.309 560 HD12 LEU 111 2HD1 LEU 111 1.765 4.974 -4.776 561 HD13 LEU 111 3HD1 LEU 111 0.086 4.431 -4.789 562 HD21 LEU 111 3HD2 LEU 111 2.590 1.615 -3.897 563 HD22 LEU 111 1HD2 LEU 111 1.263 2.498 -3.143 564 HD23 LEU 111 2HD2 LEU 111 2.762 3.335 -3.548 565 H LEU 112 H LEU 112 1.153 3.627 -8.445 566 HA LEU 112 HA LEU 112 1.963 1.359 -10.136 567 HB2 LEU 112 1HB LEU 112 1.833 4.317 -10.684 568 HB3 LEU 112 2HB LEU 112 2.620 3.182 -11.761 569 HG LEU 112 HG LEU 112 -0.309 3.189 -11.029 570 HD11 LEU 112 1HD1 LEU 112 -0.483 3.637 -13.531 571 HD12 LEU 112 2HD1 LEU 112 1.229 4.058 -13.452 572 HD13 LEU 112 3HD1 LEU 112 0.051 4.969 -12.506 573 HD21 LEU 112 3HD2 LEU 112 1.420 1.221 -12.411 574 HD22 LEU 112 1HD2 LEU 112 -0.160 1.541 -13.124 575 HD23 LEU 112 2HD2 LEU 112 -0.042 0.975 -11.457 576 H ASP 113 H ASP 113 4.180 1.785 -11.219 577 HA ASP 113 HA ASP 113 6.145 1.795 -9.160 578 HB2 ASP 113 1HB ASP 113 6.237 0.555 -11.407 579 HB3 ASP 113 2HB ASP 113 6.744 2.093 -12.100 580 H SER 114 H SER 114 5.340 4.081 -11.755 581 HA SER 114 HA SER 114 7.323 5.983 -11.174 582 HB2 SER 114 1HB SER 114 4.595 6.385 -12.432 583 HB3 SER 114 2HB SER 114 5.905 7.565 -12.456 584 HG SER 114 HG SER 114 6.181 6.504 -14.319 585 H GLU 115 H GLU 115 4.018 5.581 -9.943 586 HA GLU 115 HA GLU 115 3.841 7.989 -8.507 587 HB2 GLU 115 1HB GLU 115 2.540 5.295 -8.078 588 HB3 GLU 115 2HB GLU 115 2.170 6.692 -7.076 589 HG2 GLU 115 1HG GLU 115 1.673 7.853 -9.347 590 HG3 GLU 115 2HG GLU 115 1.540 6.201 -9.948 591 H ILE 116 H ILE 116 4.869 4.755 -7.425 592 HA ILE 116 HA ILE 116 5.469 5.423 -4.775 593 HB ILE 116 HB ILE 116 6.742 3.289 -6.506 594 HG12 ILE 116 1HG1 ILE 116 4.601 2.921 -4.414 595 HG13 ILE 116 2HG1 ILE 116 4.209 3.249 -6.099 596 HG21 ILE 116 1HG2 ILE 116 7.985 4.016 -4.388 597 HG22 ILE 116 2HG2 ILE 116 7.639 2.299 -4.585 598 HG23 ILE 116 3HG2 ILE 116 6.649 3.280 -3.506 599 HD11 ILE 116 3HD1 ILE 116 4.983 1.200 -6.812 600 HD12 ILE 116 1HD1 ILE 116 4.273 0.813 -5.245 601 HD13 ILE 116 2HD1 ILE 116 6.020 0.984 -5.400 602 H ALA 117 H ALA 117 7.592 5.229 -7.634 603 HA ALA 117 HA ALA 117 9.971 6.071 -6.436 604 HB1 ALA 117 3HB ALA 117 9.328 6.954 -9.212 605 HB2 ALA 117 1HB ALA 117 9.438 5.226 -8.871 606 HB3 ALA 117 2HB ALA 117 10.823 6.274 -8.565 607 H LYS 118 H LYS 118 7.223 7.876 -7.657 608 HA LYS 118 HA LYS 118 8.408 10.454 -7.493 609 HB2 LYS 118 1HB LYS 118 6.088 9.424 -8.564 610 HB3 LYS 118 2HB LYS 118 5.502 10.374 -7.204 611 HG2 LYS 118 1HG LYS 118 5.663 12.160 -8.479 612 HG3 LYS 118 2HG LYS 118 7.420 11.962 -8.425 613 HD2 LYS 118 1HD LYS 118 7.518 11.055 -10.514 614 HD3 LYS 118 2HD LYS 118 5.940 10.275 -10.362 615 HE2 LYS 118 1HE LYS 118 5.050 11.902 -11.585 616 HE3 LYS 118 2HE LYS 118 5.475 13.056 -10.322 617 HZ1 LYS 118 3HZ LYS 118 7.782 12.988 -11.488 618 HZ2 LYS 118 1HZ LYS 118 6.537 13.931 -12.140 619 HZ3 LYS 118 2HZ LYS 118 6.899 12.424 -12.816 620 H PHE 119 H PHE 119 6.053 8.749 -5.439 621 HA PHE 119 HA PHE 119 5.672 10.630 -3.462 622 HB2 PHE 119 1HB PHE 119 4.419 8.602 -3.373 623 HB3 PHE 119 2HB PHE 119 5.876 7.622 -3.284 624 HD1 PHE 119 HD2 PHE 119 7.274 7.732 -1.171 625 HD2 PHE 119 HD1 PHE 119 3.339 9.336 -1.432 626 HE1 PHE 119 HE2 PHE 119 7.094 7.678 1.285 627 HE2 PHE 119 HE1 PHE 119 3.157 9.290 1.022 628 HZ PHE 119 HZ PHE 119 5.040 8.461 2.373 629 H LEU 120 H LEU 120 8.334 8.319 -3.760 630 HA LEU 120 HA LEU 120 9.645 9.107 -1.359 631 HB2 LEU 120 1HB LEU 120 10.619 7.617 -3.791 632 HB3 LEU 120 2HB LEU 120 11.578 7.857 -2.341 633 HG LEU 120 HG LEU 120 8.908 6.660 -1.934 634 HD11 LEU 120 1HD1 LEU 120 9.370 5.374 -3.830 635 HD12 LEU 120 2HD1 LEU 120 9.970 4.386 -2.500 636 HD13 LEU 120 3HD1 LEU 120 11.098 5.314 -3.487 637 HD21 LEU 120 3HD2 LEU 120 10.204 5.282 -0.358 638 HD22 LEU 120 1HD2 LEU 120 10.421 7.008 -0.081 639 HD23 LEU 120 2HD2 LEU 120 11.680 6.079 -0.896 640 H GLY 121 H GLY 121 9.873 10.092 -4.747 641 HA2 GLY 121 1HA GLY 121 12.232 11.691 -4.363 642 HA3 GLY 121 2HA GLY 121 11.206 11.665 -5.785 643 H SER 122 H SER 122 9.158 12.171 -3.240 644 HA SER 122 HA SER 122 8.592 14.831 -3.944 645 HB2 SER 122 1HB SER 122 7.799 13.159 -1.556 646 HB3 SER 122 2HB SER 122 7.199 14.796 -1.811 647 HG SER 122 HG SER 122 6.352 14.066 -3.826 648 H SER 123 H SER 123 10.150 16.355 -3.705 649 HA SER 123 HA SER 123 11.683 16.472 -1.224 650 HB2 SER 123 1HB SER 123 12.245 17.105 -3.931 651 HB3 SER 123 2HB SER 123 12.330 18.614 -3.023 652 HG SER 123 HG SER 123 13.758 16.215 -2.539 653 H LYS 124 H LYS 124 8.941 17.052 -0.959 654 HA LYS 124 HA LYS 124 9.089 19.876 -0.154 655 HB2 LYS 124 1HB LYS 124 6.586 19.980 -0.651 656 HB3 LYS 124 2HB LYS 124 7.676 19.991 -2.029 657 HG2 LYS 124 1HG LYS 124 6.674 17.351 -1.149 658 HG3 LYS 124 2HG LYS 124 5.509 18.445 -1.908 659 HD2 LYS 124 1HD LYS 124 8.143 18.153 -3.234 660 HD3 LYS 124 2HD LYS 124 7.052 16.766 -3.312 661 HE2 LYS 124 1HE LYS 124 5.280 18.325 -4.156 662 HE3 LYS 124 2HE LYS 124 6.516 19.580 -4.254 663 HZ1 LYS 124 3HZ LYS 124 7.771 17.900 -5.686 664 HZ2 LYS 124 1HZ LYS 124 6.440 18.680 -6.381 665 HZ3 LYS 124 2HZ LYS 124 6.293 17.089 -5.825 666 H ARG 125 H ARG 125 7.205 16.871 0.268 667 HA ARG 125 HA ARG 125 7.299 17.298 3.152 668 HB2 ARG 125 1HB ARG 125 5.097 18.117 2.343 669 HB3 ARG 125 2HB ARG 125 4.779 16.530 1.656 670 HG2 ARG 125 1HG ARG 125 5.496 16.320 4.444 671 HG3 ARG 125 2HG ARG 125 4.141 17.425 4.213 672 HD2 ARG 125 1HD ARG 125 3.983 14.931 2.667 673 HD3 ARG 125 2HD ARG 125 3.924 14.721 4.416 674 HE ARG 125 HE ARG 125 1.865 15.759 2.753 675 HH11 ARG 125 1HH1 ARG 125 3.270 16.082 5.947 676 HH12 ARG 125 2HH1 ARG 125 1.805 16.653 6.668 677 HH21 ARG 125 1HH2 ARG 125 -0.064 16.513 3.715 678 HH22 ARG 125 2HH2 ARG 125 -0.088 16.896 5.403 679 H LYS 126 H LYS 126 8.643 15.665 3.561 680 HA LYS 126 HA LYS 126 7.699 12.955 3.000 681 HB2 LYS 126 1HB LYS 126 9.880 12.191 2.325 682 HB3 LYS 126 2HB LYS 126 9.417 13.549 1.311 683 HG2 LYS 126 1HG LYS 126 10.941 14.994 2.359 684 HG3 LYS 126 2HG LYS 126 11.167 13.900 3.723 685 HD2 LYS 126 1HD LYS 126 13.100 13.835 2.248 686 HD3 LYS 126 2HD LYS 126 12.264 12.283 2.236 687 HE2 LYS 126 1HE LYS 126 11.080 13.072 0.152 688 HE3 LYS 126 2HE LYS 126 12.194 14.438 0.132 689 HZ1 LYS 126 3HZ LYS 126 13.159 12.865 -1.263 690 HZ2 LYS 126 1HZ LYS 126 12.795 11.568 -0.240 691 HZ3 LYS 126 2HZ LYS 126 14.008 12.668 0.188 692 H SER 127 H SER 127 8.203 11.405 4.541 693 HA SER 127 HA SER 127 9.562 12.382 6.968 694 HB2 SER 127 1HB SER 127 6.965 12.065 7.032 695 HB3 SER 127 2HB SER 127 7.353 10.347 7.104 696 HG SER 127 HG SER 127 7.215 11.114 9.192 697 H LYS 128 H LYS 128 10.897 10.925 8.043 698 HA LYS 128 HA LYS 128 12.309 9.062 6.571 699 HB2 LYS 128 1HB LYS 128 12.507 10.097 9.112 700 HB3 LYS 128 2HB LYS 128 12.166 8.402 9.430 701 HG2 LYS 128 1HG LYS 128 14.067 7.803 7.940 702 HG3 LYS 128 2HG LYS 128 14.449 9.522 7.817 703 HD2 LYS 128 1HD LYS 128 14.208 8.170 10.488 704 HD3 LYS 128 2HD LYS 128 15.709 8.102 9.562 705 HE2 LYS 128 1HE LYS 128 15.979 9.941 10.989 706 HE3 LYS 128 2HE LYS 128 15.549 10.645 9.433 707 HZ1 LYS 128 3HZ LYS 128 13.625 11.439 10.236 708 HZ2 LYS 128 1HZ LYS 128 14.358 11.262 11.750 709 HZ3 LYS 128 2HZ LYS 128 13.305 10.070 11.176 710 H GLU 129 H GLU 129 9.617 8.480 8.819 711 HA GLU 129 HA GLU 129 9.581 5.665 8.494 712 HB2 GLU 129 1HB GLU 129 7.378 5.755 9.562 713 HB3 GLU 129 2HB GLU 129 8.538 6.753 10.424 714 HG2 GLU 129 1HG GLU 129 7.579 8.746 9.624 715 HG3 GLU 129 2HG GLU 129 6.649 7.896 8.390 716 H LEU 130 H LEU 130 8.038 8.324 6.767 717 HA LEU 130 HA LEU 130 6.294 6.630 5.241 718 HB2 LEU 130 1HB LEU 130 7.032 9.523 5.165 719 HB3 LEU 130 2HB LEU 130 6.246 8.817 3.767 720 HG LEU 130 HG LEU 130 4.963 8.342 6.403 721 HD11 LEU 130 1HD1 LEU 130 5.347 10.605 6.789 722 HD12 LEU 130 2HD1 LEU 130 3.750 10.576 6.044 723 HD13 LEU 130 3HD1 LEU 130 5.160 11.027 5.087 724 HD21 LEU 130 3HD2 LEU 130 4.140 7.489 4.175 725 HD22 LEU 130 1HD2 LEU 130 3.774 9.165 3.763 726 HD23 LEU 130 2HD2 LEU 130 2.967 8.396 5.131 727 H ILE 131 H ILE 131 9.374 8.284 4.556 728 HA ILE 131 HA ILE 131 9.580 7.486 1.872 729 HB ILE 131 HB ILE 131 11.869 7.959 3.788 730 HG12 ILE 131 1HG1 ILE 131 11.071 10.070 1.874 731 HG13 ILE 131 2HG1 ILE 131 9.937 9.784 3.190 732 HG21 ILE 131 1HG2 ILE 131 11.937 6.944 1.241 733 HG22 ILE 131 2HG2 ILE 131 13.272 7.761 2.057 734 HG23 ILE 131 3HG2 ILE 131 12.211 8.668 0.977 735 HD11 ILE 131 3HD1 ILE 131 11.323 11.455 4.000 736 HD12 ILE 131 1HD1 ILE 131 12.774 10.718 3.322 737 HD13 ILE 131 2HD1 ILE 131 11.988 9.991 4.722 738 H GLU 132 H GLU 132 11.028 6.016 4.792 739 HA GLU 132 HA GLU 132 12.246 3.842 3.577 740 HB2 GLU 132 1HB GLU 132 12.009 4.689 6.137 741 HB3 GLU 132 2HB GLU 132 10.937 3.295 6.174 742 HG2 GLU 132 1HG GLU 132 12.740 2.061 6.536 743 HG3 GLU 132 2HG GLU 132 13.185 2.369 4.858 744 H ALA 133 H ALA 133 8.880 4.358 4.422 745 HA ALA 133 HA ALA 133 7.946 1.724 4.132 746 HB1 ALA 133 3HB ALA 133 6.005 3.684 3.280 747 HB2 ALA 133 1HB ALA 133 6.836 4.199 4.747 748 HB3 ALA 133 2HB ALA 133 6.005 2.645 4.706 749 H TYR 134 H TYR 134 7.836 4.422 1.823 750 HA TYR 134 HA TYR 134 6.883 2.811 -0.313 751 HB2 TYR 134 1HB TYR 134 7.843 5.594 -0.015 752 HB3 TYR 134 2HB TYR 134 8.022 4.893 -1.620 753 HD1 TYR 134 HD2 TYR 134 5.427 5.105 1.072 754 HD2 TYR 134 HD1 TYR 134 6.280 5.188 -3.095 755 HE1 TYR 134 HE2 TYR 134 3.060 5.573 0.600 756 HE2 TYR 134 HE1 TYR 134 3.915 5.657 -3.574 757 HH TYR 134 HH TYR 134 1.755 6.703 -1.309 758 H GLU 135 H GLU 135 10.076 3.583 0.877 759 HA GLU 135 HA GLU 135 11.526 2.704 -1.402 760 HB2 GLU 135 1HB GLU 135 12.209 3.989 0.903 761 HB3 GLU 135 2HB GLU 135 12.810 2.371 1.234 762 HG2 GLU 135 1HG GLU 135 13.723 2.787 -1.295 763 HG3 GLU 135 2HG GLU 135 13.800 4.409 -0.612 764 H ALA 136 H ALA 136 10.112 1.102 1.378 765 HA ALA 136 HA ALA 136 11.505 -1.379 1.045 766 HB1 ALA 136 3HB ALA 136 8.921 -0.806 2.493 767 HB2 ALA 136 1HB ALA 136 10.539 -0.734 3.192 768 HB3 ALA 136 2HB ALA 136 9.888 -2.275 2.635 769 H SER 137 H SER 137 8.362 -0.124 -0.003 770 HA SER 137 HA SER 137 7.563 -2.598 -1.241 771 HB2 SER 137 1HB SER 137 6.221 -0.047 -1.988 772 HB3 SER 137 2HB SER 137 5.520 -1.613 -1.584 773 HG SER 137 HG SER 137 5.150 -0.728 0.282 774 H LYS 138 H LYS 138 9.436 0.126 -2.213 775 HA LYS 138 HA LYS 138 8.978 0.269 -4.948 776 HB2 LYS 138 1HB LYS 138 10.403 1.806 -3.543 777 HB3 LYS 138 2HB LYS 138 11.674 0.595 -3.635 778 HG2 LYS 138 1HG LYS 138 12.243 2.075 -5.316 779 HG3 LYS 138 2HG LYS 138 11.383 0.805 -6.190 780 HD2 LYS 138 1HD LYS 138 9.614 2.901 -5.209 781 HD3 LYS 138 2HD LYS 138 10.851 3.512 -6.308 782 HE2 LYS 138 1HE LYS 138 9.086 1.143 -6.913 783 HE3 LYS 138 2HE LYS 138 8.713 2.793 -7.407 784 HZ1 LYS 138 3HZ LYS 138 10.314 2.779 -8.990 785 HZ2 LYS 138 1HZ LYS 138 10.026 1.113 -8.953 786 HZ3 LYS 138 2HZ LYS 138 11.350 1.761 -8.123 787 H THR 139 H THR 139 10.529 -2.253 -3.165 788 HA THR 139 HA THR 139 11.725 -3.370 -5.600 789 HB THR 139 HB THR 139 12.066 -4.630 -2.906 790 HG1 THR 139 HG1 THR 139 13.429 -3.139 -2.221 791 HG21 THR 139 3HG2 THR 139 13.298 -4.916 -5.442 792 HG22 THR 139 1HG2 THR 139 13.622 -5.788 -3.945 793 HG23 THR 139 2HG2 THR 139 14.496 -4.300 -4.305 794 HA PRO 140 HA PRO 140 7.602 -5.551 -5.468 795 HB2 PRO 140 1HB PRO 140 8.313 -6.575 -8.040 796 HB3 PRO 140 2HB PRO 140 7.084 -5.375 -7.647 797 HG2 PRO 140 1HG PRO 140 9.806 -4.996 -8.682 798 HG3 PRO 140 2HG PRO 140 8.416 -3.903 -8.739 799 HD2 PRO 140 1HD PRO 140 10.584 -3.483 -7.153 800 HD3 PRO 140 2HD PRO 140 8.953 -2.918 -6.743 801 HA PRO 141 HA PRO 141 10.271 -9.664 -6.649 802 HB2 PRO 141 1HB PRO 141 12.721 -8.459 -5.416 803 HB3 PRO 141 2HB PRO 141 12.586 -9.707 -6.662 804 HG2 PRO 141 1HG PRO 141 13.164 -7.206 -7.334 805 HG3 PRO 141 2HG PRO 141 12.063 -8.180 -8.326 806 HD2 PRO 141 1HD PRO 141 11.456 -5.931 -6.482 807 HD3 PRO 141 2HD PRO 141 10.606 -6.450 -7.952 808 H ASP 142 H ASP 142 10.678 -7.522 -3.852 809 HA ASP 142 HA ASP 142 11.273 -9.293 -1.843 810 HB2 ASP 142 1HB ASP 142 10.647 -6.670 -1.886 811 HB3 ASP 142 2HB ASP 142 9.158 -7.310 -1.202 812 H LEU 143 H LEU 143 8.164 -8.771 -3.416 813 HA LEU 143 HA LEU 143 7.081 -11.055 -1.898 814 HB2 LEU 143 1HB LEU 143 5.908 -9.059 -1.251 815 HB3 LEU 143 2HB LEU 143 5.653 -8.609 -2.925 816 HG LEU 143 HG LEU 143 4.158 -10.546 -3.221 817 HD11 LEU 143 1HD1 LEU 143 4.492 -10.978 -0.259 818 HD12 LEU 143 2HD1 LEU 143 5.212 -11.988 -1.510 819 HD13 LEU 143 3HD1 LEU 143 3.459 -11.893 -1.356 820 HD21 LEU 143 3HD2 LEU 143 2.613 -9.632 -1.116 821 HD22 LEU 143 1HD2 LEU 143 2.664 -8.962 -2.746 822 HD23 LEU 143 2HD2 LEU 143 3.682 -8.278 -1.479 823 H LYS 144 H LYS 144 7.188 -9.408 -5.037 824 HA LYS 144 HA LYS 144 5.510 -11.047 -6.507 825 HB2 LYS 144 1HB LYS 144 6.729 -8.905 -7.217 826 HB3 LYS 144 2HB LYS 144 8.078 -9.952 -7.632 827 HG2 LYS 144 1HG LYS 144 6.893 -11.000 -9.346 828 HG3 LYS 144 2HG LYS 144 5.335 -10.444 -8.731 829 HD2 LYS 144 1HD LYS 144 6.573 -8.077 -9.185 830 HD3 LYS 144 2HD LYS 144 7.299 -9.075 -10.447 831 HE2 LYS 144 1HE LYS 144 5.371 -9.239 -11.609 832 HE3 LYS 144 2HE LYS 144 4.386 -9.365 -10.153 833 HZ1 LYS 144 3HZ LYS 144 4.240 -7.272 -11.669 834 HZ2 LYS 144 1HZ LYS 144 5.616 -6.781 -10.814 835 HZ3 LYS 144 2HZ LYS 144 4.176 -7.107 -9.987 836 H GLU 145 H GLU 145 5.987 -12.722 -8.067 837 HA GLU 145 HA GLU 145 6.779 -14.742 -8.721 838 HB2 GLU 145 1HB GLU 145 9.266 -13.512 -7.603 839 HB3 GLU 145 2HB GLU 145 9.270 -15.226 -7.988 840 HG2 GLU 145 1HG GLU 145 8.714 -14.762 -10.282 841 HG3 GLU 145 2HG GLU 145 8.540 -13.046 -9.928 842 H GLU 146 H GLU 146 5.290 -14.514 -6.340 843 HA GLU 146 HA GLU 146 6.494 -16.412 -4.472 844 HB2 GLU 146 1HB GLU 146 5.254 -14.229 -3.820 845 HB3 GLU 146 2HB GLU 146 3.790 -15.140 -4.155 846 HG2 GLU 146 1HG GLU 146 4.823 -16.887 -2.537 847 HG3 GLU 146 2HG GLU 146 5.811 -15.530 -1.997 848 H SER 147 H SER 147 6.363 -18.211 -5.975 849 HA SER 147 HA SER 147 3.672 -19.189 -6.577 850 HB2 SER 147 1HB SER 147 6.359 -20.282 -7.443 851 HB3 SER 147 2HB SER 147 4.783 -20.819 -8.024 852 HG SER 147 HG SER 147 6.212 -18.985 -9.104 853 H SER 148 H SER 148 2.905 -21.220 -5.913 854 HA SER 148 HA SER 148 4.501 -22.905 -4.205 855 HB2 SER 148 1HB SER 148 2.855 -20.879 -3.020 856 HB3 SER 148 2HB SER 148 2.172 -22.461 -2.638 857 HG SER 148 HG SER 148 4.712 -21.422 -2.022 858 H THR 149 H THR 149 0.974 -22.383 -4.376 859 HA THR 149 HA THR 149 -0.747 -23.738 -4.957 860 HB THR 149 HB THR 149 0.932 -25.245 -6.905 861 HG1 THR 149 HG1 THR 149 1.491 -23.551 -8.013 862 HG21 THR 149 3HG2 THR 149 -1.494 -25.526 -6.900 863 HG22 THR 149 1HG2 THR 149 -0.910 -24.822 -8.408 864 HG23 THR 149 2HG2 THR 149 -1.686 -23.799 -7.200 865 H ASP 150 H ASP 150 -1.094 -24.958 -3.149 866 HA ASP 150 HA ASP 150 -1.326 -26.859 -1.920 867 HB2 ASP 150 1HB ASP 150 -1.420 -27.852 -4.331 868 HB3 ASP 150 2HB ASP 150 0.199 -28.442 -3.970 869 H LEU 151 H LEU 151 0.032 -28.668 -0.830 870 HA LEU 151 HA LEU 151 2.808 -27.753 -0.497 871 HB2 LEU 151 1HB LEU 151 0.998 -27.184 1.345 872 HB3 LEU 151 2HB LEU 151 1.319 -28.833 1.845 873 HG LEU 151 HG LEU 151 3.850 -27.920 1.664 874 HD11 LEU 151 1HD1 LEU 151 3.622 -25.699 1.181 875 HD12 LEU 151 2HD1 LEU 151 3.609 -25.639 2.943 876 HD13 LEU 151 3HD1 LEU 151 2.094 -25.550 2.046 877 HD21 LEU 151 3HD2 LEU 151 3.280 -29.000 3.614 878 HD22 LEU 151 1HD2 LEU 151 1.876 -27.972 3.902 879 HD23 LEU 151 2HD2 LEU 151 3.500 -27.345 4.182 880 H GLU 152 H GLU 152 4.296 -29.329 0.318 881 HA GLU 152 HA GLU 152 3.964 -31.884 -0.882 882 HB2 GLU 152 1HB GLU 152 6.098 -30.352 0.298 883 HB3 GLU 152 2HB GLU 152 6.147 -32.006 0.892 884 HG2 GLU 152 1HG GLU 152 7.529 -31.851 -1.043 885 HG3 GLU 152 2HG GLU 152 6.103 -32.800 -1.454 Start of MODEL 2 1 H1 SER 45 1H SER 45 -5.954 5.497 -19.442 2 H2 SER 45 2H SER 45 -6.463 6.192 -17.959 3 H3 SER 45 3H SER 45 -6.850 6.958 -19.445 4 HA SER 45 HA SER 45 -8.688 5.742 -18.392 5 HB2 SER 45 1HB SER 45 -9.510 4.992 -20.492 6 HB3 SER 45 2HB SER 45 -8.376 6.285 -20.879 7 HG SER 45 HG SER 45 -8.316 4.007 -21.954 8 H ALA 46 H ALA 46 -9.646 3.366 -19.001 9 HA ALA 46 HA ALA 46 -9.677 1.144 -18.532 10 HB1 ALA 46 3HB ALA 46 -7.263 0.063 -18.327 11 HB2 ALA 46 1HB ALA 46 -6.803 1.558 -19.142 12 HB3 ALA 46 2HB ALA 46 -7.978 0.475 -19.884 13 H ASP 47 H ASP 47 -9.479 -0.331 -16.777 14 HA ASP 47 HA ASP 47 -8.454 0.882 -14.295 15 HB2 ASP 47 1HB ASP 47 -11.110 -0.290 -14.919 16 HB3 ASP 47 2HB ASP 47 -10.434 -0.661 -13.338 17 H ASP 48 H ASP 48 -7.078 -0.972 -16.043 18 HA ASP 48 HA ASP 48 -7.228 -3.599 -14.914 19 HB2 ASP 48 1HB ASP 48 -5.579 -2.227 -16.962 20 HB3 ASP 48 2HB ASP 48 -4.845 -3.620 -16.175 21 H ARG 49 H ARG 49 -6.897 -3.459 -12.706 22 HA ARG 49 HA ARG 49 -4.230 -3.543 -11.783 23 HB2 ARG 49 1HB ARG 49 -5.311 -0.933 -11.975 24 HB3 ARG 49 2HB ARG 49 -5.284 -1.340 -10.267 25 HG2 ARG 49 1HG ARG 49 -3.031 -1.315 -10.153 26 HG3 ARG 49 2HG ARG 49 -2.832 -1.961 -11.783 27 HD2 ARG 49 1HD ARG 49 -3.942 0.780 -11.496 28 HD3 ARG 49 2HD ARG 49 -2.223 0.550 -11.176 29 HE ARG 49 HE ARG 49 -2.647 -0.697 -13.570 30 HH11 ARG 49 1HH1 ARG 49 -3.208 2.542 -12.354 31 HH12 ARG 49 2HH1 ARG 49 -2.986 3.292 -13.898 32 HH21 ARG 49 1HH2 ARG 49 -2.351 0.304 -15.602 33 HH22 ARG 49 2HH2 ARG 49 -2.499 2.024 -15.738 34 H LEU 50 H LEU 50 -4.358 -3.176 -9.160 35 HA LEU 50 HA LEU 50 -5.067 -4.068 -7.194 36 HB2 LEU 50 1HB LEU 50 -7.837 -3.927 -8.383 37 HB3 LEU 50 2HB LEU 50 -7.427 -3.997 -6.681 38 HG LEU 50 HG LEU 50 -6.728 -1.696 -8.507 39 HD11 LEU 50 1HD1 LEU 50 -9.138 -2.303 -6.905 40 HD12 LEU 50 2HD1 LEU 50 -8.964 -1.367 -8.389 41 HD13 LEU 50 3HD1 LEU 50 -8.522 -0.651 -6.839 42 HD21 LEU 50 3HD2 LEU 50 -5.389 -2.254 -6.334 43 HD22 LEU 50 1HD2 LEU 50 -6.801 -1.572 -5.527 44 HD23 LEU 50 2HD2 LEU 50 -5.883 -0.598 -6.674 45 H ASN 51 H ASN 51 -3.950 -6.037 -7.952 46 HA ASN 51 HA ASN 51 -5.783 -8.303 -7.896 47 HB2 ASN 51 1HB ASN 51 -4.023 -7.603 -10.195 48 HB3 ASN 51 2HB ASN 51 -4.117 -9.301 -9.745 49 HD21 ASN 51 2HD2 ASN 51 -5.082 -7.815 -12.125 50 HD22 ASN 51 1HD2 ASN 51 -6.770 -8.206 -12.244 51 H PHE 52 H PHE 52 -4.267 -10.422 -8.003 52 HA PHE 52 HA PHE 52 -2.776 -10.408 -5.610 53 HB2 PHE 52 1HB PHE 52 -2.509 -12.495 -7.776 54 HB3 PHE 52 2HB PHE 52 -2.292 -12.700 -6.039 55 HD1 PHE 52 HD2 PHE 52 -4.696 -11.427 -4.953 56 HD2 PHE 52 HD1 PHE 52 -4.224 -13.918 -8.372 57 HE1 PHE 52 HE2 PHE 52 -7.041 -12.143 -4.754 58 HE2 PHE 52 HE1 PHE 52 -6.568 -14.637 -8.176 59 HZ PHE 52 HZ PHE 52 -7.979 -13.751 -6.365 60 H GLY 53 H GLY 53 -0.622 -10.284 -5.177 61 HA2 GLY 53 1HA GLY 53 1.599 -9.794 -5.484 62 HA3 GLY 53 2HA GLY 53 1.451 -10.549 -7.062 63 H ASP 54 H ASP 54 -0.258 -7.691 -5.860 64 HA ASP 54 HA ASP 54 1.255 -6.019 -7.741 65 HB2 ASP 54 1HB ASP 54 -1.128 -6.861 -8.501 66 HB3 ASP 54 2HB ASP 54 -1.688 -5.576 -7.439 67 H ARG 55 H ARG 55 1.878 -4.117 -6.928 68 HA ARG 55 HA ARG 55 1.476 -3.532 -4.183 69 HB2 ARG 55 1HB ARG 55 2.721 -1.431 -4.674 70 HB3 ARG 55 2HB ARG 55 3.547 -2.881 -5.224 71 HG2 ARG 55 1HG ARG 55 1.812 -1.527 -7.196 72 HG3 ARG 55 2HG ARG 55 3.284 -0.681 -6.718 73 HD2 ARG 55 1HD ARG 55 4.558 -2.054 -7.923 74 HD3 ARG 55 2HD ARG 55 3.798 -3.482 -7.224 75 HE ARG 55 HE ARG 55 2.444 -3.640 -9.071 76 HH11 ARG 55 1HH1 ARG 55 4.024 -0.514 -9.086 77 HH12 ARG 55 2HH1 ARG 55 3.501 -0.123 -10.686 78 HH21 ARG 55 1HH2 ARG 55 1.742 -3.109 -11.171 79 HH22 ARG 55 2HH2 ARG 55 2.203 -1.593 -11.872 80 H ILE 56 H ILE 56 -0.088 -2.449 -3.204 81 HA ILE 56 HA ILE 56 -1.654 -0.486 -4.728 82 HB ILE 56 HB ILE 56 -3.753 -1.293 -3.756 83 HG12 ILE 56 1HG1 ILE 56 -2.179 -3.707 -2.824 84 HG13 ILE 56 2HG1 ILE 56 -2.693 -2.398 -1.761 85 HG21 ILE 56 1HG2 ILE 56 -3.965 -3.356 -5.109 86 HG22 ILE 56 2HG2 ILE 56 -2.217 -3.353 -5.333 87 HG23 ILE 56 3HG2 ILE 56 -3.190 -2.030 -5.976 88 HD11 ILE 56 3HD1 ILE 56 -4.651 -3.381 -1.487 89 HD12 ILE 56 1HD1 ILE 56 -4.119 -4.705 -2.520 90 HD13 ILE 56 2HD1 ILE 56 -4.950 -3.320 -3.224 91 H LEU 57 H LEU 57 -2.666 1.140 -3.483 92 HA LEU 57 HA LEU 57 -1.351 1.603 -0.913 93 HB2 LEU 57 1HB LEU 57 -1.987 3.254 -3.063 94 HB3 LEU 57 2HB LEU 57 -3.154 3.695 -1.832 95 HG LEU 57 HG LEU 57 -1.289 4.109 -0.250 96 HD11 LEU 57 1HD1 LEU 57 0.873 3.709 -0.711 97 HD12 LEU 57 2HD1 LEU 57 0.715 4.193 -2.399 98 HD13 LEU 57 3HD1 LEU 57 0.218 2.578 -1.894 99 HD21 LEU 57 3HD2 LEU 57 -0.747 5.714 -2.712 100 HD22 LEU 57 1HD2 LEU 57 -0.856 6.238 -1.033 101 HD23 LEU 57 2HD2 LEU 57 -2.319 5.814 -1.919 102 H VAL 58 H VAL 58 -2.522 2.103 0.997 103 HA VAL 58 HA VAL 58 -5.414 1.759 0.946 104 HB VAL 58 HB VAL 58 -4.577 -0.530 1.167 105 HG11 VAL 58 1HG1 VAL 58 -2.993 -1.222 2.621 106 HG12 VAL 58 2HG1 VAL 58 -3.502 -0.101 3.882 107 HG13 VAL 58 3HG1 VAL 58 -2.498 0.469 2.550 108 HG21 VAL 58 3HG2 VAL 58 -6.532 0.641 2.631 109 HG22 VAL 58 1HG2 VAL 58 -5.551 -0.091 3.900 110 HG23 VAL 58 2HG2 VAL 58 -6.204 -1.091 2.603 111 H LYS 59 H LYS 59 -6.455 2.865 2.533 112 HA LYS 59 HA LYS 59 -4.762 4.252 4.508 113 HB2 LYS 59 1HB LYS 59 -5.882 5.759 2.947 114 HB3 LYS 59 2HB LYS 59 -7.439 5.048 3.344 115 HG2 LYS 59 1HG LYS 59 -7.425 5.978 5.508 116 HG3 LYS 59 2HG LYS 59 -5.717 6.400 5.398 117 HD2 LYS 59 1HD LYS 59 -6.142 8.318 4.311 118 HD3 LYS 59 2HD LYS 59 -7.366 7.571 3.283 119 HE2 LYS 59 1HE LYS 59 -9.063 8.167 4.646 120 HE3 LYS 59 2HE LYS 59 -8.119 7.898 6.111 121 HZ1 LYS 59 3HZ LYS 59 -8.682 10.235 5.808 122 HZ2 LYS 59 1HZ LYS 59 -7.877 10.259 4.321 123 HZ3 LYS 59 2HZ LYS 59 -7.008 10.005 5.751 124 H ALA 60 H ALA 60 -4.852 3.270 6.428 125 HA ALA 60 HA ALA 60 -7.138 1.703 7.237 126 HB1 ALA 60 3HB ALA 60 -4.447 1.644 7.843 127 HB2 ALA 60 1HB ALA 60 -5.712 0.716 8.644 128 HB3 ALA 60 2HB ALA 60 -5.186 2.254 9.325 129 HA PRO 61 HA PRO 61 -9.385 4.614 9.673 130 HB2 PRO 61 1HB PRO 61 -9.767 3.309 12.056 131 HB3 PRO 61 2HB PRO 61 -10.685 2.965 10.588 132 HG2 PRO 61 1HG PRO 61 -8.328 1.522 11.730 133 HG3 PRO 61 2HG PRO 61 -9.797 0.858 10.995 134 HD2 PRO 61 1HD PRO 61 -7.471 0.998 9.650 135 HD3 PRO 61 2HD PRO 61 -9.035 1.224 8.841 136 H GLY 62 H GLY 62 -7.917 6.284 9.966 137 HA2 GLY 62 1HA GLY 62 -7.125 7.723 11.749 138 HA3 GLY 62 2HA GLY 62 -6.541 6.287 12.575 139 H TYR 63 H TYR 63 -5.431 5.148 10.078 140 HA TYR 63 HA TYR 63 -2.970 6.737 10.030 141 HB2 TYR 63 1HB TYR 63 -3.595 3.858 9.421 142 HB3 TYR 63 2HB TYR 63 -2.099 4.594 8.855 143 HD1 TYR 63 HD2 TYR 63 -1.044 6.138 10.949 144 HD2 TYR 63 HD1 TYR 63 -3.271 2.527 11.266 145 HE1 TYR 63 HE2 TYR 63 0.005 5.688 13.126 146 HE2 TYR 63 HE1 TYR 63 -2.229 2.068 13.444 147 HH TYR 63 HH TYR 63 -0.773 4.231 15.283 148 HA PRO 64 HA PRO 64 -3.681 8.105 5.888 149 HB2 PRO 64 1HB PRO 64 -1.137 8.521 5.055 150 HB3 PRO 64 2HB PRO 64 -1.939 9.566 6.234 151 HG2 PRO 64 1HG PRO 64 0.011 7.342 6.692 152 HG3 PRO 64 2HG PRO 64 -0.064 8.939 7.458 153 HD2 PRO 64 1HD PRO 64 -1.001 6.684 8.646 154 HD3 PRO 64 2HD PRO 64 -1.697 8.289 8.939 155 H TRP 65 H TRP 65 -2.672 7.736 3.574 156 HA TRP 65 HA TRP 65 -3.087 4.999 2.934 157 HB2 TRP 65 1HB TRP 65 -2.072 7.303 1.260 158 HB3 TRP 65 2HB TRP 65 -2.424 5.705 0.615 159 HD1 TRP 65 HD1 TRP 65 -4.188 8.766 2.127 160 HE1 TRP 65 HE1 TRP 65 -6.665 8.701 1.438 161 HE3 TRP 65 HE3 TRP 65 -4.283 4.182 -0.138 162 HZ2 TRP 65 HZ2 TRP 65 -8.428 6.941 0.110 163 HZ3 TRP 65 HZ3 TRP 65 -6.406 3.383 -1.092 164 HH2 TRP 65 HH2 TRP 65 -8.435 4.736 -0.970 165 H TRP 66 H TRP 66 -1.672 3.401 3.171 166 HA TRP 66 HA TRP 66 1.202 4.026 3.062 167 HB2 TRP 66 1HB TRP 66 -0.042 2.883 5.118 168 HB3 TRP 66 2HB TRP 66 0.223 1.431 4.155 169 HD1 TRP 66 HD1 TRP 66 2.528 0.319 4.386 170 HE1 TRP 66 HE1 TRP 66 4.786 0.983 5.429 171 HE3 TRP 66 HE3 TRP 66 1.471 5.174 5.584 172 HZ2 TRP 66 HZ2 TRP 66 5.957 3.259 6.606 173 HZ3 TRP 66 HZ3 TRP 66 3.221 6.528 6.660 174 HH2 TRP 66 HH2 TRP 66 5.420 5.587 7.151 175 HA PRO 67 HA PRO 67 1.458 1.586 -0.631 176 HB2 PRO 67 1HB PRO 67 4.119 1.285 -0.803 177 HB3 PRO 67 2HB PRO 67 3.348 2.860 -1.028 178 HG2 PRO 67 1HG PRO 67 4.724 1.752 1.390 179 HG3 PRO 67 2HG PRO 67 4.844 3.372 0.681 180 HD2 PRO 67 1HD PRO 67 3.273 2.774 2.837 181 HD3 PRO 67 2HD PRO 67 2.927 4.097 1.708 182 H ALA 68 H ALA 68 0.417 -0.335 0.110 183 HA ALA 68 HA ALA 68 2.198 -2.413 1.194 184 HB1 ALA 68 3HB ALA 68 0.111 -3.650 1.709 185 HB2 ALA 68 1HB ALA 68 -0.815 -2.262 1.131 186 HB3 ALA 68 2HB ALA 68 0.235 -2.099 2.539 187 H LEU 69 H LEU 69 1.485 -4.699 0.373 188 HA LEU 69 HA LEU 69 1.144 -4.562 -2.556 189 HB2 LEU 69 1HB LEU 69 3.354 -5.518 -1.091 190 HB3 LEU 69 2HB LEU 69 2.540 -6.939 -1.715 191 HG LEU 69 HG LEU 69 2.936 -4.788 -3.686 192 HD11 LEU 69 1HD1 LEU 69 5.021 -4.480 -2.601 193 HD12 LEU 69 2HD1 LEU 69 5.326 -5.469 -4.026 194 HD13 LEU 69 3HD1 LEU 69 5.266 -6.217 -2.431 195 HD21 LEU 69 3HD2 LEU 69 3.181 -6.544 -5.166 196 HD22 LEU 69 1HD2 LEU 69 2.084 -7.224 -3.964 197 HD23 LEU 69 2HD2 LEU 69 3.798 -7.640 -3.928 198 H LEU 70 H LEU 70 -0.671 -5.502 -3.218 199 HA LEU 70 HA LEU 70 -2.351 -7.024 -1.543 200 HB2 LEU 70 1HB LEU 70 -2.799 -5.678 -3.775 201 HB3 LEU 70 2HB LEU 70 -2.560 -7.252 -4.508 202 HG LEU 70 HG LEU 70 -4.542 -6.852 -2.282 203 HD11 LEU 70 1HD1 LEU 70 -5.714 -5.518 -3.630 204 HD12 LEU 70 2HD1 LEU 70 -6.026 -6.965 -4.588 205 HD13 LEU 70 3HD1 LEU 70 -4.701 -5.889 -5.027 206 HD21 LEU 70 3HD2 LEU 70 -4.428 -9.097 -2.530 207 HD22 LEU 70 1HD2 LEU 70 -3.822 -8.996 -4.184 208 HD23 LEU 70 2HD2 LEU 70 -5.542 -8.774 -3.860 209 H LEU 71 H LEU 71 -2.460 -9.131 -1.097 210 HA LEU 71 HA LEU 71 -0.653 -10.943 -2.544 211 HB2 LEU 71 1HB LEU 71 -1.515 -10.714 0.264 212 HB3 LEU 71 2HB LEU 71 -1.447 -12.352 -0.355 213 HG LEU 71 HG LEU 71 0.962 -11.155 -1.159 214 HD11 LEU 71 1HD1 LEU 71 1.828 -9.951 0.552 215 HD12 LEU 71 2HD1 LEU 71 0.870 -10.783 1.775 216 HD13 LEU 71 3HD1 LEU 71 0.133 -9.527 0.781 217 HD21 LEU 71 3HD2 LEU 71 0.838 -12.831 1.294 218 HD22 LEU 71 1HD2 LEU 71 1.900 -12.953 -0.110 219 HD23 LEU 71 2HD2 LEU 71 0.230 -13.514 -0.215 220 H ARG 72 H ARG 72 -3.853 -11.015 -0.941 221 HA ARG 72 HA ARG 72 -4.937 -12.497 -3.193 222 HB2 ARG 72 1HB ARG 72 -4.266 -13.727 -0.641 223 HB3 ARG 72 2HB ARG 72 -5.960 -13.938 -1.059 224 HG2 ARG 72 1HG ARG 72 -4.741 -14.547 -3.416 225 HG3 ARG 72 2HG ARG 72 -3.562 -15.129 -2.240 226 HD2 ARG 72 1HD ARG 72 -6.414 -15.804 -1.773 227 HD3 ARG 72 2HD ARG 72 -5.593 -16.623 -3.097 228 HE ARG 72 HE ARG 72 -4.181 -17.673 -1.560 229 HH11 ARG 72 1HH1 ARG 72 -6.443 -15.534 0.057 230 HH12 ARG 72 2HH1 ARG 72 -6.164 -16.225 1.618 231 HH21 ARG 72 1HH2 ARG 72 -3.816 -18.567 0.506 232 HH22 ARG 72 2HH2 ARG 72 -4.674 -17.941 1.875 233 H ARG 73 H ARG 73 -7.318 -12.872 -2.944 234 HA ARG 73 HA ARG 73 -8.554 -10.603 -1.528 235 HB2 ARG 73 1HB ARG 73 -8.637 -10.656 -4.076 236 HB3 ARG 73 2HB ARG 73 -9.703 -12.043 -3.917 237 HG2 ARG 73 1HG ARG 73 -11.220 -10.600 -2.536 238 HG3 ARG 73 2HG ARG 73 -10.203 -9.230 -2.983 239 HD2 ARG 73 1HD ARG 73 -12.232 -9.503 -4.405 240 HD3 ARG 73 2HD ARG 73 -10.714 -9.519 -5.302 241 HE ARG 73 HE ARG 73 -11.140 -11.681 -5.921 242 HH11 ARG 73 1HH1 ARG 73 -13.270 -10.841 -3.273 243 HH12 ARG 73 2HH1 ARG 73 -14.210 -12.287 -3.405 244 HH21 ARG 73 1HH2 ARG 73 -12.380 -13.594 -6.085 245 HH22 ARG 73 2HH2 ARG 73 -13.704 -13.852 -4.998 246 H LYS 74 H LYS 74 -9.463 -11.314 0.303 247 HA LYS 74 HA LYS 74 -10.799 -13.931 0.293 248 HB2 LYS 74 1HB LYS 74 -10.724 -13.510 2.869 249 HB3 LYS 74 2HB LYS 74 -9.281 -14.050 2.022 250 HG2 LYS 74 1HG LYS 74 -8.282 -11.940 2.135 251 HG3 LYS 74 2HG LYS 74 -9.808 -11.142 2.521 252 HD2 LYS 74 1HD LYS 74 -8.776 -13.222 4.386 253 HD3 LYS 74 2HD LYS 74 -8.006 -11.634 4.384 254 HE2 LYS 74 1HE LYS 74 -10.527 -10.823 4.480 255 HE3 LYS 74 2HE LYS 74 -10.758 -12.418 5.193 256 HZ1 LYS 74 3HZ LYS 74 -9.172 -10.154 6.207 257 HZ2 LYS 74 1HZ LYS 74 -8.802 -11.729 6.693 258 HZ3 LYS 74 2HZ LYS 74 -10.330 -11.082 7.011 259 H GLU 75 H GLU 75 -12.936 -14.033 0.363 260 HA GLU 75 HA GLU 75 -14.445 -11.603 1.049 261 HB2 GLU 75 1HB GLU 75 -14.586 -13.006 -1.237 262 HB3 GLU 75 2HB GLU 75 -15.782 -13.885 -0.298 263 HG2 GLU 75 1HG GLU 75 -16.667 -11.460 0.214 264 HG3 GLU 75 2HG GLU 75 -15.825 -11.089 -1.289 265 H THR 76 H THR 76 -15.448 -11.581 2.954 266 HA THR 76 HA THR 76 -16.602 -14.073 3.982 267 HB THR 76 HB THR 76 -14.402 -13.766 5.068 268 HG1 THR 76 HG1 THR 76 -16.517 -13.267 6.886 269 HG21 THR 76 3HG2 THR 76 -14.116 -11.403 5.092 270 HG22 THR 76 1HG2 THR 76 -14.149 -11.974 6.759 271 HG23 THR 76 2HG2 THR 76 -15.566 -11.184 6.067 272 H LYS 77 H LYS 77 -18.589 -13.825 4.884 273 HA LYS 77 HA LYS 77 -19.650 -11.090 4.962 274 HB2 LYS 77 1HB LYS 77 -21.889 -12.291 5.093 275 HB3 LYS 77 2HB LYS 77 -21.002 -12.437 3.583 276 HG2 LYS 77 1HG LYS 77 -20.554 -14.556 5.601 277 HG3 LYS 77 2HG LYS 77 -22.137 -14.512 4.823 278 HD2 LYS 77 1HD LYS 77 -19.701 -14.309 3.116 279 HD3 LYS 77 2HD LYS 77 -20.134 -15.882 3.784 280 HE2 LYS 77 1HE LYS 77 -22.367 -15.677 2.787 281 HE3 LYS 77 2HE LYS 77 -21.916 -14.114 2.107 282 HZ1 LYS 77 3HZ LYS 77 -20.041 -15.396 0.983 283 HZ2 LYS 77 1HZ LYS 77 -21.605 -15.624 0.379 284 HZ3 LYS 77 2HZ LYS 77 -20.905 -16.796 1.377 285 H ASP 78 H ASP 78 -21.370 -10.691 6.678 286 HA ASP 78 HA ASP 78 -20.222 -11.476 9.257 287 HB2 ASP 78 1HB ASP 78 -21.389 -9.078 8.236 288 HB3 ASP 78 2HB ASP 78 -22.361 -9.623 9.595 289 H SER 79 H SER 79 -23.591 -10.726 8.381 290 HA SER 79 HA SER 79 -24.419 -13.377 9.281 291 HB2 SER 79 1HB SER 79 -25.645 -10.849 10.421 292 HB3 SER 79 2HB SER 79 -26.108 -12.507 10.804 293 HG SER 79 HG SER 79 -23.794 -11.088 11.533 294 H LEU 80 H LEU 80 -26.186 -10.343 8.627 295 HA LEU 80 HA LEU 80 -27.123 -11.347 6.074 296 HB2 LEU 80 1HB LEU 80 -28.947 -10.975 8.442 297 HB3 LEU 80 2HB LEU 80 -29.540 -10.886 6.795 298 HG LEU 80 HG LEU 80 -28.272 -13.259 6.679 299 HD11 LEU 80 1HD1 LEU 80 -29.515 -13.661 9.303 300 HD12 LEU 80 2HD1 LEU 80 -28.014 -12.737 9.330 301 HD13 LEU 80 3HD1 LEU 80 -28.042 -14.350 8.621 302 HD21 LEU 80 3HD2 LEU 80 -30.338 -14.072 6.340 303 HD22 LEU 80 1HD2 LEU 80 -30.833 -12.387 6.491 304 HD23 LEU 80 2HD2 LEU 80 -30.944 -13.467 7.881 305 H ASN 81 H ASN 81 -28.451 -8.954 8.351 306 HA ASN 81 HA ASN 81 -27.325 -6.741 6.892 307 HB2 ASN 81 1HB ASN 81 -29.760 -7.729 5.974 308 HB3 ASN 81 2HB ASN 81 -30.210 -6.355 6.978 309 HD21 ASN 81 2HD2 ASN 81 -28.601 -4.424 6.599 310 HD22 ASN 81 1HD2 ASN 81 -28.375 -4.016 4.926 311 H THR 82 H THR 82 -27.091 -7.608 9.556 312 HA THR 82 HA THR 82 -28.096 -5.243 10.928 313 HB THR 82 HB THR 82 -29.808 -6.921 11.355 314 HG1 THR 82 HG1 THR 82 -29.819 -6.740 13.546 315 HG21 THR 82 3HG2 THR 82 -27.714 -8.768 11.430 316 HG22 THR 82 1HG2 THR 82 -29.432 -9.066 11.695 317 HG23 THR 82 2HG2 THR 82 -28.377 -8.715 13.063 318 H ASN 83 H ASN 83 -25.525 -5.795 10.034 319 HA ASN 83 HA ASN 83 -24.024 -5.432 12.424 320 HB2 ASN 83 1HB ASN 83 -24.341 -8.002 12.168 321 HB3 ASN 83 2HB ASN 83 -23.168 -7.854 10.862 322 HD21 ASN 83 2HD2 ASN 83 -21.098 -6.779 11.434 323 HD22 ASN 83 1HD2 ASN 83 -20.447 -7.080 13.016 324 H SER 84 H SER 84 -23.743 -6.445 9.036 325 HA SER 84 HA SER 84 -22.406 -4.069 8.258 326 HB2 SER 84 1HB SER 84 -20.691 -5.834 9.471 327 HB3 SER 84 2HB SER 84 -20.523 -6.273 7.771 328 HG SER 84 HG SER 84 -19.870 -3.897 9.074 329 H SER 85 H SER 85 -22.797 -7.520 7.487 330 HA SER 85 HA SER 85 -23.537 -8.597 5.633 331 HB2 SER 85 1HB SER 85 -24.407 -6.119 4.234 332 HB3 SER 85 2HB SER 85 -25.245 -7.656 4.433 333 HG SER 85 HG SER 85 -26.025 -5.699 5.639 334 H PHE 86 H PHE 86 -21.896 -9.401 4.507 335 HA PHE 86 HA PHE 86 -20.289 -9.650 2.930 336 HB2 PHE 86 1HB PHE 86 -21.768 -7.279 1.914 337 HB3 PHE 86 2HB PHE 86 -20.182 -7.598 1.225 338 HD1 PHE 86 HD1 PHE 86 -23.240 -9.544 2.134 339 HD2 PHE 86 HD2 PHE 86 -20.161 -8.806 -0.710 340 HE1 PHE 86 HE1 PHE 86 -24.234 -11.217 0.630 341 HE2 PHE 86 HE2 PHE 86 -21.151 -10.476 -2.221 342 HZ PHE 86 HZ PHE 86 -23.191 -11.685 -1.552 343 H ASN 87 H ASN 87 -18.394 -9.580 3.950 344 HA ASN 87 HA ASN 87 -17.117 -6.957 4.273 345 HB2 ASN 87 1HB ASN 87 -16.867 -9.300 6.177 346 HB3 ASN 87 2HB ASN 87 -16.063 -7.742 6.338 347 HD21 ASN 87 2HD2 ASN 87 -19.245 -9.284 6.234 348 HD22 ASN 87 1HD2 ASN 87 -20.034 -8.118 7.249 349 H VAL 88 H VAL 88 -16.217 -7.405 2.209 350 HA VAL 88 HA VAL 88 -14.194 -9.530 2.144 351 HB VAL 88 HB VAL 88 -15.412 -9.792 0.205 352 HG11 VAL 88 1HG1 VAL 88 -16.890 -7.920 0.357 353 HG12 VAL 88 2HG1 VAL 88 -16.161 -7.913 -1.250 354 HG13 VAL 88 3HG1 VAL 88 -15.584 -6.793 -0.016 355 HG21 VAL 88 3HG2 VAL 88 -13.301 -7.840 -0.695 356 HG22 VAL 88 1HG2 VAL 88 -14.040 -9.120 -1.654 357 HG23 VAL 88 2HG2 VAL 88 -13.001 -9.529 -0.290 358 H LEU 89 H LEU 89 -12.157 -9.038 2.459 359 HA LEU 89 HA LEU 89 -11.306 -6.244 2.081 360 HB2 LEU 89 1HB LEU 89 -9.840 -8.094 3.907 361 HB3 LEU 89 2HB LEU 89 -9.961 -6.345 3.952 362 HG LEU 89 HG LEU 89 -12.303 -8.128 4.600 363 HD11 LEU 89 1HD1 LEU 89 -10.183 -7.052 6.453 364 HD12 LEU 89 2HD1 LEU 89 -10.574 -8.743 6.144 365 HD13 LEU 89 3HD1 LEU 89 -11.732 -7.708 6.980 366 HD21 LEU 89 3HD2 LEU 89 -13.125 -6.133 5.733 367 HD22 LEU 89 1HD2 LEU 89 -12.789 -5.794 4.034 368 HD23 LEU 89 2HD2 LEU 89 -11.662 -5.258 5.280 369 H TYR 90 H TYR 90 -8.762 -6.202 2.028 370 HA TYR 90 HA TYR 90 -7.887 -8.158 0.004 371 HB2 TYR 90 1HB TYR 90 -7.851 -5.219 0.029 372 HB3 TYR 90 2HB TYR 90 -6.309 -5.947 -0.412 373 HD1 TYR 90 HD1 TYR 90 -7.289 -8.390 -1.824 374 HD2 TYR 90 HD2 TYR 90 -8.601 -4.346 -2.028 375 HE1 TYR 90 HE1 TYR 90 -8.122 -8.781 -4.094 376 HE2 TYR 90 HE2 TYR 90 -9.437 -4.731 -4.308 377 HH TYR 90 HH TYR 90 -8.851 -6.405 -6.230 378 H LYS 91 H LYS 91 -6.386 -9.468 0.841 379 HA LYS 91 HA LYS 91 -4.887 -8.823 3.181 380 HB2 LYS 91 1HB LYS 91 -4.302 -11.037 1.205 381 HB3 LYS 91 2HB LYS 91 -3.808 -10.957 2.892 382 HG2 LYS 91 1HG LYS 91 -6.527 -10.773 3.087 383 HG3 LYS 91 2HG LYS 91 -6.325 -11.851 1.706 384 HD2 LYS 91 1HD LYS 91 -4.912 -12.248 4.338 385 HD3 LYS 91 2HD LYS 91 -6.472 -12.975 3.959 386 HE2 LYS 91 1HE LYS 91 -5.272 -14.686 3.157 387 HE3 LYS 91 2HE LYS 91 -4.985 -13.643 1.765 388 HZ1 LYS 91 3HZ LYS 91 -3.205 -13.617 4.132 389 HZ2 LYS 91 1HZ LYS 91 -2.893 -13.029 2.576 390 HZ3 LYS 91 2HZ LYS 91 -2.971 -14.695 2.850 391 H VAL 92 H VAL 92 -3.693 -6.968 2.816 392 HA VAL 92 HA VAL 92 -1.706 -7.073 0.652 393 HB VAL 92 HB VAL 92 -1.506 -4.670 0.832 394 HG11 VAL 92 1HG1 VAL 92 -3.141 -5.062 -0.705 395 HG12 VAL 92 2HG1 VAL 92 -4.069 -4.133 0.471 396 HG13 VAL 92 3HG1 VAL 92 -4.186 -5.892 0.447 397 HG21 VAL 92 3HG2 VAL 92 -1.800 -4.324 3.187 398 HG22 VAL 92 1HG2 VAL 92 -3.460 -4.915 3.116 399 HG23 VAL 92 2HG2 VAL 92 -3.032 -3.393 2.335 400 H LEU 93 H LEU 93 0.441 -6.506 1.015 401 HA LEU 93 HA LEU 93 1.388 -7.025 3.743 402 HB2 LEU 93 1HB LEU 93 2.137 -8.246 1.551 403 HB3 LEU 93 2HB LEU 93 3.122 -6.822 1.306 404 HG LEU 93 HG LEU 93 4.349 -8.696 2.309 405 HD11 LEU 93 1HD1 LEU 93 4.387 -6.767 4.510 406 HD12 LEU 93 2HD1 LEU 93 4.557 -6.072 2.898 407 HD13 LEU 93 3HD1 LEU 93 5.682 -7.312 3.448 408 HD21 LEU 93 3HD2 LEU 93 3.375 -9.938 3.868 409 HD22 LEU 93 1HD2 LEU 93 2.081 -8.758 4.077 410 HD23 LEU 93 2HD2 LEU 93 3.579 -8.595 4.992 411 H PHE 94 H PHE 94 2.346 -5.454 4.923 412 HA PHE 94 HA PHE 94 2.595 -2.795 3.724 413 HB2 PHE 94 1HB PHE 94 2.230 -3.871 6.481 414 HB3 PHE 94 2HB PHE 94 3.119 -2.361 6.331 415 HD1 PHE 94 HD2 PHE 94 -0.039 -3.912 5.032 416 HD2 PHE 94 HD1 PHE 94 1.924 -0.423 6.487 417 HE1 PHE 94 HE2 PHE 94 -2.152 -2.666 4.891 418 HE2 PHE 94 HE1 PHE 94 -0.191 0.823 6.352 419 HZ PHE 94 HZ PHE 94 -2.231 -0.296 5.551 420 H PHE 95 H PHE 95 4.479 -1.460 4.213 421 HA PHE 95 HA PHE 95 6.947 -2.976 4.744 422 HB2 PHE 95 1HB PHE 95 6.506 -0.993 2.500 423 HB3 PHE 95 2HB PHE 95 8.070 -1.658 2.949 424 HD1 PHE 95 HD1 PHE 95 8.580 -4.019 2.549 425 HD2 PHE 95 HD2 PHE 95 4.915 -2.277 1.261 426 HE1 PHE 95 HE1 PHE 95 8.198 -5.935 1.053 427 HE2 PHE 95 HE2 PHE 95 4.528 -4.189 -0.235 428 HZ PHE 95 HZ PHE 95 6.170 -6.023 -0.339 429 HA PRO 96 HA PRO 96 9.181 -2.149 4.362 430 HB2 PRO 96 1HB PRO 96 11.067 -1.594 6.451 431 HB3 PRO 96 2HB PRO 96 11.126 -1.077 4.766 432 HG2 PRO 96 1HG PRO 96 10.776 0.623 6.894 433 HG3 PRO 96 2HG PRO 96 10.236 0.969 5.242 434 HD2 PRO 96 1HD PRO 96 8.661 -0.043 7.580 435 HD3 PRO 96 2HD PRO 96 8.210 1.163 6.353 436 H ASP 97 H ASP 97 8.274 -1.997 7.747 437 HA ASP 97 HA ASP 97 9.443 -4.110 8.943 438 HB2 ASP 97 1HB ASP 97 7.352 -2.489 9.583 439 HB3 ASP 97 2HB ASP 97 6.536 -4.041 9.430 440 H PHE 98 H PHE 98 7.046 -4.354 6.412 441 HA PHE 98 HA PHE 98 6.492 -6.139 5.100 442 HB2 PHE 98 1HB PHE 98 8.786 -7.118 6.291 443 HB3 PHE 98 2HB PHE 98 7.574 -8.316 6.729 444 HD1 PHE 98 HD1 PHE 98 9.203 -6.609 3.895 445 HD2 PHE 98 HD2 PHE 98 6.711 -9.833 5.128 446 HE1 PHE 98 HE1 PHE 98 9.402 -7.615 1.658 447 HE2 PHE 98 HE2 PHE 98 6.908 -10.843 2.894 448 HZ PHE 98 HZ PHE 98 8.255 -9.734 1.155 449 H ASN 99 H ASN 99 5.055 -5.100 7.429 450 HA ASN 99 HA ASN 99 3.686 -7.327 8.641 451 HB2 ASN 99 1HB ASN 99 3.995 -4.587 9.214 452 HB3 ASN 99 2HB ASN 99 2.283 -4.800 8.870 453 HD21 ASN 99 2HD2 ASN 99 4.307 -4.589 11.315 454 HD22 ASN 99 1HD2 ASN 99 3.576 -5.680 12.452 455 H PHE 100 H PHE 100 1.003 -6.361 8.563 456 HA PHE 100 HA PHE 100 0.211 -6.050 5.821 457 HB2 PHE 100 1HB PHE 100 -1.305 -8.257 6.239 458 HB3 PHE 100 2HB PHE 100 0.220 -8.267 5.360 459 HD1 PHE 100 HD1 PHE 100 -1.469 -9.164 8.466 460 HD2 PHE 100 HD2 PHE 100 2.215 -9.192 6.343 461 HE1 PHE 100 HE1 PHE 100 -0.557 -10.773 10.078 462 HE2 PHE 100 HE2 PHE 100 3.139 -10.803 7.951 463 HZ PHE 100 HZ PHE 100 1.755 -11.598 9.821 464 H ALA 101 H ALA 101 -2.307 -6.400 5.698 465 HA ALA 101 HA ALA 101 -3.841 -5.982 8.036 466 HB1 ALA 101 3HB ALA 101 -3.336 -3.826 8.399 467 HB2 ALA 101 1HB ALA 101 -4.377 -3.500 7.011 468 HB3 ALA 101 2HB ALA 101 -2.630 -3.627 6.795 469 H TRP 102 H TRP 102 -5.841 -6.648 7.547 470 HA TRP 102 HA TRP 102 -6.619 -6.965 4.776 471 HB2 TRP 102 1HB TRP 102 -8.282 -7.567 7.231 472 HB3 TRP 102 2HB TRP 102 -8.486 -8.223 5.609 473 HD1 TRP 102 HD1 TRP 102 -5.684 -9.324 4.930 474 HE1 TRP 102 HE1 TRP 102 -4.639 -11.262 6.259 475 HE3 TRP 102 HE3 TRP 102 -8.409 -8.922 9.242 476 HZ2 TRP 102 HZ2 TRP 102 -4.931 -12.466 8.797 477 HZ3 TRP 102 HZ3 TRP 102 -7.962 -10.506 11.070 478 HH2 TRP 102 HH2 TRP 102 -6.259 -12.242 10.850 479 H VAL 103 H VAL 103 -7.250 -5.135 3.777 480 HA VAL 103 HA VAL 103 -9.212 -3.411 5.160 481 HB VAL 103 HB VAL 103 -7.530 -2.380 2.914 482 HG11 VAL 103 1HG1 VAL 103 -9.086 -0.796 3.469 483 HG12 VAL 103 2HG1 VAL 103 -7.753 -0.322 4.521 484 HG13 VAL 103 3HG1 VAL 103 -9.105 -1.249 5.173 485 HG21 VAL 103 3HG2 VAL 103 -6.548 -3.158 5.566 486 HG22 VAL 103 1HG2 VAL 103 -6.149 -1.509 5.085 487 HG23 VAL 103 2HG2 VAL 103 -5.668 -2.866 4.065 488 H LYS 104 H LYS 104 -10.832 -2.386 3.834 489 HA LYS 104 HA LYS 104 -11.876 -4.146 1.825 490 HB2 LYS 104 1HB LYS 104 -12.966 -2.263 3.544 491 HB3 LYS 104 2HB LYS 104 -13.131 -1.510 1.965 492 HG2 LYS 104 1HG LYS 104 -14.534 -3.171 1.174 493 HG3 LYS 104 2HG LYS 104 -13.990 -4.341 2.378 494 HD2 LYS 104 1HD LYS 104 -15.048 -2.802 4.113 495 HD3 LYS 104 2HD LYS 104 -15.826 -1.989 2.753 496 HE2 LYS 104 1HE LYS 104 -17.043 -3.910 2.161 497 HE3 LYS 104 2HE LYS 104 -16.025 -4.959 3.145 498 HZ1 LYS 104 3HZ LYS 104 -18.403 -4.124 3.931 499 HZ2 LYS 104 1HZ LYS 104 -17.473 -2.851 4.546 500 HZ3 LYS 104 2HZ LYS 104 -17.150 -4.443 5.020 501 H ARG 105 H ARG 105 -12.315 -3.628 -0.367 502 HA ARG 105 HA ARG 105 -10.203 -2.469 -1.784 503 HB2 ARG 105 1HB ARG 105 -12.998 -2.738 -2.878 504 HB3 ARG 105 2HB ARG 105 -11.477 -2.818 -3.757 505 HG2 ARG 105 1HG ARG 105 -10.992 -4.898 -2.336 506 HG3 ARG 105 2HG ARG 105 -12.714 -4.865 -1.955 507 HD2 ARG 105 1HD ARG 105 -11.490 -5.032 -4.708 508 HD3 ARG 105 2HD ARG 105 -12.273 -6.347 -3.834 509 HE ARG 105 HE ARG 105 -13.549 -4.285 -5.337 510 HH11 ARG 105 1HH1 ARG 105 -13.956 -6.382 -2.562 511 HH12 ARG 105 2HH1 ARG 105 -15.684 -6.360 -2.642 512 HH21 ARG 105 1HH2 ARG 105 -15.830 -4.258 -5.436 513 HH22 ARG 105 2HH2 ARG 105 -16.749 -5.154 -4.275 514 H ASN 106 H ASN 106 -13.015 -1.005 -0.388 515 HA ASN 106 HA ASN 106 -13.155 1.327 -1.979 516 HB2 ASN 106 1HB ASN 106 -14.058 0.778 0.852 517 HB3 ASN 106 2HB ASN 106 -14.402 2.277 -0.006 518 HD21 ASN 106 2HD2 ASN 106 -15.892 -0.318 0.969 519 HD22 ASN 106 1HD2 ASN 106 -16.968 -0.631 -0.358 520 H SER 107 H SER 107 -11.341 0.523 0.950 521 HA SER 107 HA SER 107 -10.196 3.210 1.040 522 HB2 SER 107 1HB SER 107 -10.909 1.457 3.033 523 HB3 SER 107 2HB SER 107 -9.160 1.239 2.951 524 HG SER 107 HG SER 107 -10.502 3.221 4.071 525 H VAL 108 H VAL 108 -9.592 1.001 -1.029 526 HA VAL 108 HA VAL 108 -6.662 1.101 -0.742 527 HB VAL 108 HB VAL 108 -8.288 -1.054 -2.088 528 HG11 VAL 108 1HG1 VAL 108 -5.492 -1.630 -1.527 529 HG12 VAL 108 2HG1 VAL 108 -5.697 -0.294 -2.657 530 HG13 VAL 108 3HG1 VAL 108 -6.419 -1.863 -3.008 531 HG21 VAL 108 3HG2 VAL 108 -8.022 -0.787 0.568 532 HG22 VAL 108 1HG2 VAL 108 -6.546 -1.684 0.210 533 HG23 VAL 108 2HG2 VAL 108 -8.114 -2.350 -0.244 534 H LYS 109 H LYS 109 -5.470 1.745 -2.512 535 HA LYS 109 HA LYS 109 -6.957 2.427 -4.964 536 HB2 LYS 109 1HB LYS 109 -6.407 4.400 -3.419 537 HB3 LYS 109 2HB LYS 109 -4.727 4.129 -3.862 538 HG2 LYS 109 1HG LYS 109 -5.186 4.598 -6.159 539 HG3 LYS 109 2HG LYS 109 -6.922 4.657 -5.850 540 HD2 LYS 109 1HD LYS 109 -6.022 6.503 -4.079 541 HD3 LYS 109 2HD LYS 109 -4.841 6.686 -5.377 542 HE2 LYS 109 1HE LYS 109 -7.678 6.524 -6.192 543 HE3 LYS 109 2HE LYS 109 -7.200 7.977 -5.315 544 HZ1 LYS 109 3HZ LYS 109 -5.593 8.490 -6.951 545 HZ2 LYS 109 1HZ LYS 109 -7.005 8.094 -7.795 546 HZ3 LYS 109 2HZ LYS 109 -5.739 6.979 -7.696 547 HA PRO 110 HA PRO 110 -3.823 0.051 -7.023 548 HB2 PRO 110 1HB PRO 110 -3.921 1.315 -9.469 549 HB3 PRO 110 2HB PRO 110 -5.046 0.058 -8.948 550 HG2 PRO 110 1HG PRO 110 -5.380 3.030 -8.928 551 HG3 PRO 110 2HG PRO 110 -6.552 1.772 -9.364 552 HD2 PRO 110 1HD PRO 110 -6.640 3.005 -6.983 553 HD3 PRO 110 2HD PRO 110 -7.040 1.283 -7.150 554 H LEU 111 H LEU 111 -1.731 0.312 -6.589 555 HA LEU 111 HA LEU 111 -0.527 2.967 -6.822 556 HB2 LEU 111 1HB LEU 111 -0.310 1.583 -4.724 557 HB3 LEU 111 2HB LEU 111 0.686 0.472 -5.642 558 HG LEU 111 HG LEU 111 2.375 2.163 -5.971 559 HD11 LEU 111 1HD1 LEU 111 1.026 4.131 -6.222 560 HD12 LEU 111 2HD1 LEU 111 2.151 4.386 -4.889 561 HD13 LEU 111 3HD1 LEU 111 0.460 4.009 -4.557 562 HD21 LEU 111 3HD2 LEU 111 1.392 1.663 -3.198 563 HD22 LEU 111 1HD2 LEU 111 2.767 2.736 -3.453 564 HD23 LEU 111 2HD2 LEU 111 2.841 1.063 -4.004 565 H LEU 112 H LEU 112 0.931 3.485 -8.358 566 HA LEU 112 HA LEU 112 1.699 1.371 -10.248 567 HB2 LEU 112 1HB LEU 112 1.479 4.360 -10.518 568 HB3 LEU 112 2HB LEU 112 2.300 3.375 -11.713 569 HG LEU 112 HG LEU 112 -0.607 3.162 -10.939 570 HD11 LEU 112 1HD1 LEU 112 -0.751 3.793 -13.464 571 HD12 LEU 112 2HD1 LEU 112 0.866 4.444 -13.198 572 HD13 LEU 112 3HD1 LEU 112 -0.494 5.052 -12.254 573 HD21 LEU 112 3HD2 LEU 112 -0.286 1.028 -11.608 574 HD22 LEU 112 1HD2 LEU 112 1.203 1.408 -12.470 575 HD23 LEU 112 2HD2 LEU 112 -0.356 1.741 -13.218 576 H ASP 113 H ASP 113 3.832 1.892 -11.409 577 HA ASP 113 HA ASP 113 5.939 1.791 -9.480 578 HB2 ASP 113 1HB ASP 113 5.913 0.555 -11.684 579 HB3 ASP 113 2HB ASP 113 6.192 2.102 -12.480 580 H SER 114 H SER 114 4.991 4.109 -11.991 581 HA SER 114 HA SER 114 7.023 5.981 -11.500 582 HB2 SER 114 1HB SER 114 5.521 7.591 -12.684 583 HB3 SER 114 2HB SER 114 5.755 6.075 -13.555 584 HG SER 114 HG SER 114 3.640 6.127 -13.597 585 H GLU 115 H GLU 115 3.732 5.707 -10.192 586 HA GLU 115 HA GLU 115 3.667 8.100 -8.757 587 HB2 GLU 115 1HB GLU 115 2.359 5.462 -8.052 588 HB3 GLU 115 2HB GLU 115 1.931 7.024 -7.366 589 HG2 GLU 115 1HG GLU 115 1.821 6.571 -10.322 590 HG3 GLU 115 2HG GLU 115 0.501 6.056 -9.275 591 H ILE 116 H ILE 116 4.632 4.858 -7.603 592 HA ILE 116 HA ILE 116 5.343 5.608 -5.001 593 HB ILE 116 HB ILE 116 6.561 3.399 -6.676 594 HG12 ILE 116 1HG1 ILE 116 4.432 3.095 -4.567 595 HG13 ILE 116 2HG1 ILE 116 4.019 3.413 -6.248 596 HG21 ILE 116 1HG2 ILE 116 6.745 2.522 -4.139 597 HG22 ILE 116 2HG2 ILE 116 6.944 4.255 -3.880 598 HG23 ILE 116 3HG2 ILE 116 8.034 3.395 -4.965 599 HD11 ILE 116 3HD1 ILE 116 4.141 1.246 -6.653 600 HD12 ILE 116 1HD1 ILE 116 4.656 0.942 -4.994 601 HD13 ILE 116 2HD1 ILE 116 5.855 1.277 -6.243 602 H ALA 117 H ALA 117 7.367 5.246 -7.918 603 HA ALA 117 HA ALA 117 9.797 6.094 -6.833 604 HB1 ALA 117 3HB ALA 117 9.101 6.889 -9.620 605 HB2 ALA 117 1HB ALA 117 9.153 5.170 -9.222 606 HB3 ALA 117 2HB ALA 117 10.586 6.172 -8.988 607 H LYS 118 H LYS 118 7.026 7.902 -7.990 608 HA LYS 118 HA LYS 118 8.279 10.460 -7.968 609 HB2 LYS 118 1HB LYS 118 5.910 9.456 -8.944 610 HB3 LYS 118 2HB LYS 118 5.381 10.452 -7.594 611 HG2 LYS 118 1HG LYS 118 5.532 12.198 -8.929 612 HG3 LYS 118 2HG LYS 118 7.287 11.980 -8.892 613 HD2 LYS 118 1HD LYS 118 7.343 10.960 -10.945 614 HD3 LYS 118 2HD LYS 118 5.713 10.301 -10.776 615 HE2 LYS 118 1HE LYS 118 5.882 12.059 -12.515 616 HE3 LYS 118 2HE LYS 118 4.739 12.455 -11.234 617 HZ1 LYS 118 3HZ LYS 118 6.072 14.368 -11.779 618 HZ2 LYS 118 1HZ LYS 118 7.505 13.509 -11.501 619 HZ3 LYS 118 2HZ LYS 118 6.460 13.853 -10.217 620 H PHE 119 H PHE 119 5.915 8.906 -5.792 621 HA PHE 119 HA PHE 119 5.694 10.874 -3.867 622 HB2 PHE 119 1HB PHE 119 4.329 8.923 -3.670 623 HB3 PHE 119 2HB PHE 119 5.732 7.866 -3.581 624 HD1 PHE 119 HD1 PHE 119 7.150 7.884 -1.522 625 HD2 PHE 119 HD2 PHE 119 3.411 9.909 -1.730 626 HE1 PHE 119 HE1 PHE 119 7.064 7.968 0.937 627 HE2 PHE 119 HE2 PHE 119 3.323 10.001 0.727 628 HZ PHE 119 HZ PHE 119 5.156 9.033 2.057 629 H LEU 120 H LEU 120 8.195 8.403 -4.185 630 HA LEU 120 HA LEU 120 9.637 9.181 -1.854 631 HB2 LEU 120 1HB LEU 120 10.408 7.536 -4.257 632 HB3 LEU 120 2HB LEU 120 11.446 7.775 -2.862 633 HG LEU 120 HG LEU 120 8.726 6.780 -2.282 634 HD11 LEU 120 1HD1 LEU 120 10.439 5.469 -4.224 635 HD12 LEU 120 2HD1 LEU 120 8.778 5.110 -3.758 636 HD13 LEU 120 3HD1 LEU 120 10.117 4.444 -2.827 637 HD21 LEU 120 3HD2 LEU 120 11.297 5.592 -1.335 638 HD22 LEU 120 1HD2 LEU 120 9.757 5.769 -0.492 639 HD23 LEU 120 2HD2 LEU 120 10.795 7.171 -0.734 640 H GLY 121 H GLY 121 9.744 10.049 -5.270 641 HA2 GLY 121 1HA GLY 121 12.248 11.373 -5.252 642 HA3 GLY 121 2HA GLY 121 10.955 11.623 -6.415 643 H SER 122 H SER 122 9.264 12.227 -3.831 644 HA SER 122 HA SER 122 10.116 15.042 -3.628 645 HB2 SER 122 1HB SER 122 7.289 14.184 -3.110 646 HB3 SER 122 2HB SER 122 7.894 15.745 -3.660 647 HG SER 122 HG SER 122 7.667 15.083 -5.638 648 H SER 123 H SER 123 11.487 13.996 -1.864 649 HA SER 123 HA SER 123 10.012 13.428 0.587 650 HB2 SER 123 1HB SER 123 13.014 13.485 0.371 651 HB3 SER 123 2HB SER 123 12.001 12.544 1.465 652 HG SER 123 HG SER 123 12.930 11.880 -0.966 653 H LYS 124 H LYS 124 9.667 16.050 -0.245 654 HA LYS 124 HA LYS 124 11.498 17.887 0.868 655 HB2 LYS 124 1HB LYS 124 9.485 19.455 0.850 656 HB3 LYS 124 2HB LYS 124 9.956 18.758 -0.696 657 HG2 LYS 124 1HG LYS 124 8.066 17.023 0.545 658 HG3 LYS 124 2HG LYS 124 7.434 18.670 0.577 659 HD2 LYS 124 1HD LYS 124 8.667 17.948 -1.972 660 HD3 LYS 124 2HD LYS 124 7.288 16.932 -1.548 661 HE2 LYS 124 1HE LYS 124 5.882 18.874 -1.288 662 HE3 LYS 124 2HE LYS 124 7.256 19.947 -1.549 663 HZ1 LYS 124 3HZ LYS 124 5.862 19.698 -3.532 664 HZ2 LYS 124 1HZ LYS 124 6.184 18.037 -3.558 665 HZ3 LYS 124 2HZ LYS 124 7.439 19.146 -3.803 666 H ARG 125 H ARG 125 8.398 16.651 2.142 667 HA ARG 125 HA ARG 125 9.458 16.961 4.840 668 HB2 ARG 125 1HB ARG 125 8.055 18.943 4.441 669 HB3 ARG 125 2HB ARG 125 6.712 17.904 3.983 670 HG2 ARG 125 1HG ARG 125 7.296 16.916 6.435 671 HG3 ARG 125 2HG ARG 125 7.739 18.612 6.643 672 HD2 ARG 125 1HD ARG 125 5.188 18.189 5.257 673 HD3 ARG 125 2HD ARG 125 5.218 17.595 6.916 674 HE ARG 125 HE ARG 125 5.092 20.299 6.095 675 HH11 ARG 125 1HH1 ARG 125 6.521 18.246 8.547 676 HH12 ARG 125 2HH1 ARG 125 6.622 19.511 9.723 677 HH21 ARG 125 1HH2 ARG 125 5.230 21.963 7.653 678 HH22 ARG 125 2HH2 ARG 125 5.888 21.620 9.216 679 H LYS 126 H LYS 126 9.639 14.867 5.260 680 HA LYS 126 HA LYS 126 7.279 13.324 5.738 681 HB2 LYS 126 1HB LYS 126 8.289 13.113 3.174 682 HB3 LYS 126 2HB LYS 126 9.026 11.747 3.998 683 HG2 LYS 126 1HG LYS 126 7.106 10.773 3.265 684 HG3 LYS 126 2HG LYS 126 6.563 11.354 4.839 685 HD2 LYS 126 1HD LYS 126 4.919 11.888 3.137 686 HD3 LYS 126 2HD LYS 126 5.647 13.367 3.762 687 HE2 LYS 126 1HE LYS 126 6.585 13.891 1.783 688 HE3 LYS 126 2HE LYS 126 7.018 12.219 1.433 689 HZ1 LYS 126 3HZ LYS 126 4.362 12.129 1.170 690 HZ2 LYS 126 1HZ LYS 126 5.423 12.430 -0.113 691 HZ3 LYS 126 2HZ LYS 126 4.656 13.717 0.671 692 H SER 127 H SER 127 7.665 11.544 7.084 693 HA SER 127 HA SER 127 10.158 11.665 8.519 694 HB2 SER 127 1HB SER 127 7.505 10.420 8.929 695 HB3 SER 127 2HB SER 127 8.868 9.548 9.630 696 HG SER 127 HG SER 127 9.353 11.297 10.871 697 H LYS 128 H LYS 128 11.378 9.651 9.043 698 HA LYS 128 HA LYS 128 12.299 8.392 6.714 699 HB2 LYS 128 1HB LYS 128 12.951 8.360 9.513 700 HB3 LYS 128 2HB LYS 128 12.914 6.708 8.910 701 HG2 LYS 128 1HG LYS 128 15.148 7.688 8.776 702 HG3 LYS 128 2HG LYS 128 14.517 7.271 7.181 703 HD2 LYS 128 1HD LYS 128 13.848 9.990 7.971 704 HD3 LYS 128 2HD LYS 128 15.589 9.707 7.936 705 HE2 LYS 128 1HE LYS 128 14.120 8.610 5.642 706 HE3 LYS 128 2HE LYS 128 14.070 10.367 5.772 707 HZ1 LYS 128 3HZ LYS 128 16.615 10.098 6.111 708 HZ2 LYS 128 1HZ LYS 128 15.965 10.029 4.550 709 HZ3 LYS 128 2HZ LYS 128 16.385 8.602 5.353 710 H GLU 129 H GLU 129 9.995 7.349 9.184 711 HA GLU 129 HA GLU 129 9.610 4.717 8.295 712 HB2 GLU 129 1HB GLU 129 7.906 6.657 9.828 713 HB3 GLU 129 2HB GLU 129 7.254 5.099 9.339 714 HG2 GLU 129 1HG GLU 129 9.137 4.003 10.523 715 HG3 GLU 129 2HG GLU 129 9.638 5.590 11.106 716 H LEU 130 H LEU 130 8.332 7.785 7.151 717 HA LEU 130 HA LEU 130 6.318 6.605 5.479 718 HB2 LEU 130 1HB LEU 130 6.949 9.193 6.369 719 HB3 LEU 130 2HB LEU 130 7.123 9.243 4.627 720 HG LEU 130 HG LEU 130 4.915 9.899 4.987 721 HD11 LEU 130 1HD1 LEU 130 5.367 7.705 3.525 722 HD12 LEU 130 2HD1 LEU 130 3.773 8.437 3.702 723 HD13 LEU 130 3HD1 LEU 130 4.218 7.047 4.688 724 HD21 LEU 130 3HD2 LEU 130 3.372 8.532 6.465 725 HD22 LEU 130 1HD2 LEU 130 4.608 9.485 7.284 726 HD23 LEU 130 2HD2 LEU 130 4.824 7.746 7.082 727 H ILE 131 H ILE 131 9.436 8.221 4.772 728 HA ILE 131 HA ILE 131 9.395 7.675 2.015 729 HB ILE 131 HB ILE 131 11.839 7.983 3.762 730 HG12 ILE 131 1HG1 ILE 131 10.888 10.224 2.074 731 HG13 ILE 131 2HG1 ILE 131 9.894 9.849 3.477 732 HG21 ILE 131 1HG2 ILE 131 13.083 7.780 1.928 733 HG22 ILE 131 2HG2 ILE 131 12.087 8.944 1.054 734 HG23 ILE 131 3HG2 ILE 131 11.634 7.240 1.081 735 HD11 ILE 131 3HD1 ILE 131 11.316 10.889 4.813 736 HD12 ILE 131 1HD1 ILE 131 12.220 11.393 3.385 737 HD13 ILE 131 2HD1 ILE 131 12.658 9.907 4.227 738 H GLU 132 H GLU 132 10.938 5.907 4.694 739 HA GLU 132 HA GLU 132 12.067 3.846 3.189 740 HB2 GLU 132 1HB GLU 132 12.226 4.424 5.744 741 HB3 GLU 132 2HB GLU 132 10.884 3.296 5.886 742 HG2 GLU 132 1HG GLU 132 12.189 1.511 5.015 743 HG3 GLU 132 2HG GLU 132 13.488 2.609 4.555 744 H ALA 133 H ALA 133 8.768 4.471 4.076 745 HA ALA 133 HA ALA 133 7.713 1.875 3.767 746 HB1 ALA 133 3HB ALA 133 5.626 2.855 3.941 747 HB2 ALA 133 1HB ALA 133 6.134 4.324 3.107 748 HB3 ALA 133 2HB ALA 133 6.653 4.027 4.766 749 H TYR 134 H TYR 134 7.590 4.650 1.546 750 HA TYR 134 HA TYR 134 6.648 3.062 -0.629 751 HB2 TYR 134 1HB TYR 134 7.628 5.870 -0.338 752 HB3 TYR 134 2HB TYR 134 7.518 5.179 -1.953 753 HD1 TYR 134 HD1 TYR 134 5.482 5.675 1.138 754 HD2 TYR 134 HD2 TYR 134 5.492 5.262 -3.098 755 HE1 TYR 134 HE1 TYR 134 3.080 6.192 1.087 756 HE2 TYR 134 HE2 TYR 134 3.089 5.780 -3.158 757 HH TYR 134 HH TYR 134 1.142 5.821 -0.381 758 H GLU 135 H GLU 135 9.807 3.887 0.569 759 HA GLU 135 HA GLU 135 11.222 3.089 -1.795 760 HB2 GLU 135 1HB GLU 135 11.900 4.557 0.391 761 HB3 GLU 135 2HB GLU 135 12.646 3.016 0.786 762 HG2 GLU 135 1HG GLU 135 13.981 3.056 -1.166 763 HG3 GLU 135 2HG GLU 135 13.079 4.416 -1.834 764 H ALA 136 H ALA 136 9.968 1.486 1.036 765 HA ALA 136 HA ALA 136 11.597 -0.879 0.701 766 HB1 ALA 136 3HB ALA 136 10.987 -0.368 2.930 767 HB2 ALA 136 1HB ALA 136 10.076 -1.808 2.476 768 HB3 ALA 136 2HB ALA 136 9.280 -0.234 2.505 769 H SER 137 H SER 137 8.450 0.245 -0.311 770 HA SER 137 HA SER 137 7.564 -2.380 -1.161 771 HB2 SER 137 1HB SER 137 5.819 -0.949 -0.388 772 HB3 SER 137 2HB SER 137 6.370 0.386 -1.398 773 HG SER 137 HG SER 137 5.414 -2.074 -2.440 774 H LYS 138 H LYS 138 9.178 0.380 -2.527 775 HA LYS 138 HA LYS 138 8.623 0.074 -5.237 776 HB2 LYS 138 1HB LYS 138 9.814 1.995 -4.138 777 HB3 LYS 138 2HB LYS 138 11.252 0.989 -4.074 778 HG2 LYS 138 1HG LYS 138 11.560 2.304 -5.965 779 HG3 LYS 138 2HG LYS 138 10.986 0.766 -6.612 780 HD2 LYS 138 1HD LYS 138 8.639 1.856 -6.472 781 HD3 LYS 138 2HD LYS 138 9.530 3.375 -6.352 782 HE2 LYS 138 1HE LYS 138 9.032 3.078 -8.644 783 HE3 LYS 138 2HE LYS 138 10.742 2.695 -8.454 784 HZ1 LYS 138 3HZ LYS 138 9.940 0.987 -9.766 785 HZ2 LYS 138 1HZ LYS 138 8.481 0.866 -8.924 786 HZ3 LYS 138 2HZ LYS 138 9.909 0.294 -8.223 787 H THR 139 H THR 139 10.874 -1.708 -3.200 788 HA THR 139 HA THR 139 12.568 -2.842 -5.070 789 HB THR 139 HB THR 139 12.065 -4.935 -3.314 790 HG1 THR 139 HG1 THR 139 10.808 -3.980 -1.892 791 HG21 THR 139 3HG2 THR 139 14.118 -4.489 -2.411 792 HG22 THR 139 1HG2 THR 139 13.898 -2.741 -2.478 793 HG23 THR 139 2HG2 THR 139 14.238 -3.645 -3.953 794 HA PRO 140 HA PRO 140 9.494 -4.899 -7.697 795 HB2 PRO 140 1HB PRO 140 12.054 -5.890 -8.848 796 HB3 PRO 140 2HB PRO 140 10.644 -5.208 -9.666 797 HG2 PRO 140 1HG PRO 140 12.852 -3.760 -9.361 798 HG3 PRO 140 2HG PRO 140 11.253 -3.020 -9.168 799 HD2 PRO 140 1HD PRO 140 13.228 -3.844 -7.085 800 HD3 PRO 140 2HD PRO 140 12.149 -2.436 -7.121 801 HA PRO 141 HA PRO 141 12.044 -9.183 -6.733 802 HB2 PRO 141 1HB PRO 141 12.794 -8.002 -4.078 803 HB3 PRO 141 2HB PRO 141 13.573 -9.310 -4.983 804 HG2 PRO 141 1HG PRO 141 14.603 -6.896 -5.099 805 HG3 PRO 141 2HG PRO 141 14.440 -7.844 -6.590 806 HD2 PRO 141 1HD PRO 141 12.822 -5.535 -5.625 807 HD3 PRO 141 2HD PRO 141 13.270 -5.982 -7.283 808 H ASP 142 H ASP 142 10.455 -7.275 -4.121 809 HA ASP 142 HA ASP 142 9.162 -9.622 -3.071 810 HB2 ASP 142 1HB ASP 142 7.876 -7.891 -1.682 811 HB3 ASP 142 2HB ASP 142 9.614 -7.987 -1.433 812 H LEU 143 H LEU 143 8.355 -10.091 -5.348 813 HA LEU 143 HA LEU 143 6.587 -10.446 -6.719 814 HB2 LEU 143 1HB LEU 143 5.440 -9.899 -4.159 815 HB3 LEU 143 2HB LEU 143 4.430 -9.150 -5.379 816 HG LEU 143 HG LEU 143 4.062 -11.244 -6.478 817 HD11 LEU 143 1HD1 LEU 143 5.013 -13.350 -5.397 818 HD12 LEU 143 2HD1 LEU 143 6.159 -12.280 -4.591 819 HD13 LEU 143 3HD1 LEU 143 6.122 -12.367 -6.352 820 HD21 LEU 143 3HD2 LEU 143 2.887 -10.599 -4.251 821 HD22 LEU 143 1HD2 LEU 143 3.794 -11.957 -3.587 822 HD23 LEU 143 2HD2 LEU 143 2.663 -12.217 -4.916 823 H LYS 144 H LYS 144 5.123 -7.496 -5.452 824 HA LYS 144 HA LYS 144 4.606 -5.507 -6.394 825 HB2 LYS 144 1HB LYS 144 7.388 -5.940 -6.814 826 HB3 LYS 144 2HB LYS 144 6.742 -5.124 -8.231 827 HG2 LYS 144 1HG LYS 144 5.835 -3.359 -6.817 828 HG3 LYS 144 2HG LYS 144 6.439 -4.186 -5.382 829 HD2 LYS 144 1HD LYS 144 7.977 -2.437 -5.932 830 HD3 LYS 144 2HD LYS 144 8.741 -3.977 -6.323 831 HE2 LYS 144 1HE LYS 144 9.237 -2.746 -8.202 832 HE3 LYS 144 2HE LYS 144 7.743 -3.538 -8.698 833 HZ1 LYS 144 3HZ LYS 144 6.521 -1.548 -8.160 834 HZ2 LYS 144 1HZ LYS 144 7.770 -1.166 -9.236 835 HZ3 LYS 144 2HZ LYS 144 7.923 -0.787 -7.595 836 H GLU 145 H GLU 145 6.305 -6.896 -9.205 837 HA GLU 145 HA GLU 145 3.759 -6.989 -10.657 838 HB2 GLU 145 1HB GLU 145 6.189 -5.387 -11.339 839 HB3 GLU 145 2HB GLU 145 5.246 -6.086 -12.651 840 HG2 GLU 145 1HG GLU 145 3.232 -4.987 -11.446 841 HG3 GLU 145 2HG GLU 145 4.468 -4.004 -10.663 842 H GLU 146 H GLU 146 4.511 -9.272 -9.824 843 HA GLU 146 HA GLU 146 5.985 -10.547 -12.036 844 HB2 GLU 146 1HB GLU 146 7.239 -10.450 -9.844 845 HB3 GLU 146 2HB GLU 146 5.999 -11.499 -9.173 846 HG2 GLU 146 1HG GLU 146 6.586 -13.264 -10.681 847 HG3 GLU 146 2HG GLU 146 7.699 -12.209 -11.552 848 H SER 147 H SER 147 5.207 -12.481 -12.817 849 HA SER 147 HA SER 147 3.665 -14.046 -13.383 850 HB2 SER 147 1HB SER 147 4.156 -15.013 -11.206 851 HB3 SER 147 2HB SER 147 3.022 -13.913 -10.425 852 HG SER 147 HG SER 147 2.230 -15.729 -12.450 853 H SER 148 H SER 148 2.776 -12.040 -14.484 854 HA SER 148 HA SER 148 0.004 -11.598 -13.589 855 HB2 SER 148 1HB SER 148 1.821 -9.626 -15.001 856 HB3 SER 148 2HB SER 148 0.125 -9.345 -14.601 857 HG SER 148 HG SER 148 1.462 -8.450 -13.013 858 H THR 149 H THR 149 2.160 -11.676 -16.423 859 HA THR 149 HA THR 149 -0.152 -12.530 -18.039 860 HB THR 149 HB THR 149 0.910 -11.502 -19.979 861 HG1 THR 149 HG1 THR 149 3.032 -11.512 -19.691 862 HG21 THR 149 3HG2 THR 149 0.470 -9.285 -19.558 863 HG22 THR 149 1HG2 THR 149 1.105 -9.362 -17.914 864 HG23 THR 149 2HG2 THR 149 -0.456 -10.090 -18.291 865 H ASP 150 H ASP 150 0.156 -14.186 -19.543 866 HA ASP 150 HA ASP 150 2.743 -15.536 -19.616 867 HB2 ASP 150 1HB ASP 150 1.208 -16.489 -17.761 868 HB3 ASP 150 2HB ASP 150 0.265 -17.157 -19.088 869 H LEU 151 H LEU 151 3.186 -15.636 -21.715 870 HA LEU 151 HA LEU 151 1.205 -16.779 -23.531 871 HB2 LEU 151 1HB LEU 151 1.358 -14.121 -23.489 872 HB3 LEU 151 2HB LEU 151 2.718 -14.427 -24.552 873 HG LEU 151 HG LEU 151 0.169 -15.793 -25.227 874 HD11 LEU 151 1HD1 LEU 151 0.587 -12.848 -25.726 875 HD12 LEU 151 2HD1 LEU 151 -0.556 -13.530 -24.567 876 HD13 LEU 151 3HD1 LEU 151 -0.762 -13.834 -26.292 877 HD21 LEU 151 3HD2 LEU 151 2.070 -16.156 -26.636 878 HD22 LEU 151 1HD2 LEU 151 2.364 -14.423 -26.776 879 HD23 LEU 151 2HD2 LEU 151 0.928 -15.135 -27.512 880 H GLU 152 H GLU 152 4.435 -15.245 -23.759 881 HA GLU 152 HA GLU 152 5.813 -17.676 -24.178 882 HB2 GLU 152 1HB GLU 152 6.448 -17.342 -26.556 883 HB3 GLU 152 2HB GLU 152 4.746 -17.721 -26.342 884 HG2 GLU 152 1HG GLU 152 4.191 -15.350 -26.608 885 HG3 GLU 152 2HG GLU 152 5.899 -14.983 -26.830 Start of MODEL 3 1 H1 SER 45 1H SER 45 -9.732 6.154 -16.729 2 H2 SER 45 2H SER 45 -11.335 6.554 -16.269 3 H3 SER 45 3H SER 45 -10.444 7.607 -17.290 4 HA SER 45 HA SER 45 -12.126 6.284 -18.428 5 HB2 SER 45 1HB SER 45 -10.024 7.247 -19.464 6 HB3 SER 45 2HB SER 45 -9.292 5.653 -19.277 7 HG SER 45 HG SER 45 -10.789 4.810 -20.684 8 H ALA 46 H ALA 46 -9.250 4.265 -17.690 9 HA ALA 46 HA ALA 46 -10.861 1.858 -18.006 10 HB1 ALA 46 3HB ALA 46 -8.455 0.869 -17.407 11 HB2 ALA 46 1HB ALA 46 -7.960 2.471 -17.954 12 HB3 ALA 46 2HB ALA 46 -8.879 1.417 -19.028 13 H ASP 47 H ASP 47 -10.454 0.036 -16.407 14 HA ASP 47 HA ASP 47 -9.938 0.875 -13.680 15 HB2 ASP 47 1HB ASP 47 -12.138 -0.158 -12.916 16 HB3 ASP 47 2HB ASP 47 -12.239 1.418 -13.687 17 H ASP 48 H ASP 48 -8.700 -0.997 -15.565 18 HA ASP 48 HA ASP 48 -9.274 -3.573 -14.280 19 HB2 ASP 48 1HB ASP 48 -8.105 -2.799 -16.918 20 HB3 ASP 48 2HB ASP 48 -7.602 -4.324 -16.196 21 H ARG 49 H ARG 49 -8.167 -2.467 -12.377 22 HA ARG 49 HA ARG 49 -5.342 -3.245 -12.393 23 HB2 ARG 49 1HB ARG 49 -6.454 -0.559 -11.610 24 HB3 ARG 49 2HB ARG 49 -4.978 -1.165 -10.870 25 HG2 ARG 49 1HG ARG 49 -3.939 -0.163 -12.567 26 HG3 ARG 49 2HG ARG 49 -4.471 -1.545 -13.525 27 HD2 ARG 49 1HD ARG 49 -6.227 -0.370 -14.482 28 HD3 ARG 49 2HD ARG 49 -6.262 0.829 -13.190 29 HE ARG 49 HE ARG 49 -4.668 2.039 -14.307 30 HH11 ARG 49 1HH1 ARG 49 -4.836 -1.167 -15.713 31 HH12 ARG 49 2HH1 ARG 49 -3.809 -0.770 -17.048 32 HH21 ARG 49 1HH2 ARG 49 -3.310 2.556 -16.074 33 HH22 ARG 49 2HH2 ARG 49 -2.942 1.341 -17.253 34 H LEU 50 H LEU 50 -4.497 -3.117 -10.011 35 HA LEU 50 HA LEU 50 -4.578 -3.870 -7.869 36 HB2 LEU 50 1HB LEU 50 -7.566 -3.500 -7.927 37 HB3 LEU 50 2HB LEU 50 -6.508 -3.492 -6.530 38 HG LEU 50 HG LEU 50 -5.995 -1.393 -8.560 39 HD11 LEU 50 1HD1 LEU 50 -7.817 -0.024 -8.003 40 HD12 LEU 50 2HD1 LEU 50 -8.312 -1.074 -6.676 41 HD13 LEU 50 3HD1 LEU 50 -8.519 -1.605 -8.345 42 HD21 LEU 50 3HD2 LEU 50 -4.639 -1.274 -6.666 43 HD22 LEU 50 1HD2 LEU 50 -5.972 -1.639 -5.570 44 HD23 LEU 50 2HD2 LEU 50 -5.888 -0.068 -6.367 45 H ASN 51 H ASN 51 -3.967 -5.979 -8.280 46 HA ASN 51 HA ASN 51 -6.061 -7.973 -7.975 47 HB2 ASN 51 1HB ASN 51 -4.683 -7.478 -10.510 48 HB3 ASN 51 2HB ASN 51 -4.544 -9.148 -9.974 49 HD21 ASN 51 2HD2 ASN 51 -5.977 -8.061 -12.251 50 HD22 ASN 51 1HD2 ASN 51 -7.638 -8.525 -12.047 51 H PHE 52 H PHE 52 -4.700 -10.283 -8.335 52 HA PHE 52 HA PHE 52 -3.172 -10.553 -6.009 53 HB2 PHE 52 1HB PHE 52 -3.112 -12.355 -8.442 54 HB3 PHE 52 2HB PHE 52 -2.605 -12.790 -6.809 55 HD1 PHE 52 HD2 PHE 52 -4.721 -11.857 -5.108 56 HD2 PHE 52 HD1 PHE 52 -4.970 -13.577 -8.994 57 HE1 PHE 52 HE2 PHE 52 -6.996 -12.646 -4.612 58 HE2 PHE 52 HE1 PHE 52 -7.244 -14.370 -8.502 59 HZ PHE 52 HZ PHE 52 -8.261 -13.907 -6.306 60 H GLY 53 H GLY 53 -1.057 -10.366 -5.539 61 HA2 GLY 53 1HA GLY 53 1.181 -9.910 -5.774 62 HA3 GLY 53 2HA GLY 53 1.061 -10.610 -7.381 63 H ASP 54 H ASP 54 -0.335 -7.689 -5.891 64 HA ASP 54 HA ASP 54 1.144 -6.037 -7.799 65 HB2 ASP 54 1HB ASP 54 -1.421 -6.719 -8.369 66 HB3 ASP 54 2HB ASP 54 -1.689 -5.266 -7.415 67 H ARG 55 H ARG 55 1.922 -4.220 -6.891 68 HA ARG 55 HA ARG 55 1.603 -3.752 -4.110 69 HB2 ARG 55 1HB ARG 55 2.760 -1.895 -6.202 70 HB3 ARG 55 2HB ARG 55 2.995 -1.773 -4.464 71 HG2 ARG 55 1HG ARG 55 3.966 -4.186 -4.719 72 HG3 ARG 55 2HG ARG 55 4.165 -3.705 -6.406 73 HD2 ARG 55 1HD ARG 55 5.927 -2.430 -5.921 74 HD3 ARG 55 2HD ARG 55 5.063 -1.627 -4.611 75 HE ARG 55 HE ARG 55 6.959 -3.760 -4.381 76 HH11 ARG 55 1HH1 ARG 55 4.175 -2.279 -2.860 77 HH12 ARG 55 2HH1 ARG 55 4.617 -2.787 -1.268 78 HH21 ARG 55 1HH2 ARG 55 7.535 -4.432 -2.274 79 HH22 ARG 55 2HH2 ARG 55 6.531 -4.005 -0.935 80 H ILE 56 H ILE 56 -0.137 -2.915 -3.184 81 HA ILE 56 HA ILE 56 -1.543 -0.713 -4.554 82 HB ILE 56 HB ILE 56 -3.669 -1.515 -3.622 83 HG12 ILE 56 1HG1 ILE 56 -2.199 -4.054 -2.889 84 HG13 ILE 56 2HG1 ILE 56 -2.575 -2.791 -1.721 85 HG21 ILE 56 1HG2 ILE 56 -4.009 -3.357 -5.159 86 HG22 ILE 56 2HG2 ILE 56 -2.268 -3.613 -5.276 87 HG23 ILE 56 3HG2 ILE 56 -2.985 -2.129 -5.903 88 HD11 ILE 56 3HD1 ILE 56 -4.906 -3.591 -3.238 89 HD12 ILE 56 1HD1 ILE 56 -4.660 -3.512 -1.493 90 HD13 ILE 56 2HD1 ILE 56 -4.159 -4.944 -2.392 91 H LEU 57 H LEU 57 -2.478 0.884 -3.247 92 HA LEU 57 HA LEU 57 -1.196 1.162 -0.635 93 HB2 LEU 57 1HB LEU 57 -1.608 2.938 -2.686 94 HB3 LEU 57 2HB LEU 57 -2.904 3.352 -1.581 95 HG LEU 57 HG LEU 57 -1.191 3.608 0.230 96 HD11 LEU 57 1HD1 LEU 57 0.466 2.230 -1.377 97 HD12 LEU 57 2HD1 LEU 57 1.018 3.312 -0.099 98 HD13 LEU 57 3HD1 LEU 57 0.956 3.876 -1.768 99 HD21 LEU 57 3HD2 LEU 57 -0.641 5.798 -0.375 100 HD22 LEU 57 1HD2 LEU 57 -2.123 5.462 -1.271 101 HD23 LEU 57 2HD2 LEU 57 -0.562 5.403 -2.091 102 H VAL 58 H VAL 58 -2.317 1.470 1.282 103 HA VAL 58 HA VAL 58 -5.239 1.191 1.178 104 HB VAL 58 HB VAL 58 -5.173 -0.357 3.113 105 HG11 VAL 58 1HG1 VAL 58 -3.800 -1.254 0.586 106 HG12 VAL 58 2HG1 VAL 58 -5.526 -1.303 0.948 107 HG13 VAL 58 3HG1 VAL 58 -4.413 -2.355 1.823 108 HG21 VAL 58 3HG2 VAL 58 -2.800 -1.586 3.177 109 HG22 VAL 58 1HG2 VAL 58 -3.206 -0.238 4.238 110 HG23 VAL 58 2HG2 VAL 58 -2.256 0.042 2.780 111 H LYS 59 H LYS 59 -6.357 2.387 2.630 112 HA LYS 59 HA LYS 59 -4.813 4.238 4.273 113 HB2 LYS 59 1HB LYS 59 -6.587 5.099 2.773 114 HB3 LYS 59 2HB LYS 59 -7.778 4.186 3.685 115 HG2 LYS 59 1HG LYS 59 -7.370 5.508 5.646 116 HG3 LYS 59 2HG LYS 59 -6.035 6.344 4.851 117 HD2 LYS 59 1HD LYS 59 -7.436 7.582 3.503 118 HD3 LYS 59 2HD LYS 59 -8.744 6.402 3.596 119 HE2 LYS 59 1HE LYS 59 -9.649 7.905 5.010 120 HE3 LYS 59 2HE LYS 59 -8.581 7.141 6.184 121 HZ1 LYS 59 3HZ LYS 59 -8.537 9.655 6.052 122 HZ2 LYS 59 1HZ LYS 59 -7.722 9.477 4.580 123 HZ3 LYS 59 2HZ LYS 59 -7.037 8.873 6.005 124 H ALA 60 H ALA 60 -4.370 3.672 6.296 125 HA ALA 60 HA ALA 60 -5.825 1.629 7.686 126 HB1 ALA 60 3HB ALA 60 -3.282 2.687 7.863 127 HB2 ALA 60 1HB ALA 60 -4.001 1.511 8.964 128 HB3 ALA 60 2HB ALA 60 -4.062 3.231 9.348 129 HA PRO 61 HA PRO 61 -8.810 3.904 10.003 130 HB2 PRO 61 1HB PRO 61 -8.412 3.041 12.579 131 HB3 PRO 61 2HB PRO 61 -9.268 2.110 11.346 132 HG2 PRO 61 1HG PRO 61 -6.434 1.875 12.272 133 HG3 PRO 61 2HG PRO 61 -7.598 0.593 11.886 134 HD2 PRO 61 1HD PRO 61 -5.658 1.304 10.169 135 HD3 PRO 61 2HD PRO 61 -7.266 0.802 9.604 136 H GLY 62 H GLY 62 -8.371 6.048 10.030 137 HA2 GLY 62 1HA GLY 62 -7.756 8.081 10.912 138 HA3 GLY 62 2HA GLY 62 -7.286 7.232 12.376 139 H TYR 63 H TYR 63 -5.836 6.174 9.426 140 HA TYR 63 HA TYR 63 -3.414 7.749 9.975 141 HB2 TYR 63 1HB TYR 63 -3.750 4.937 10.362 142 HB3 TYR 63 2HB TYR 63 -2.651 5.177 9.012 143 HD1 TYR 63 HD1 TYR 63 -3.074 7.176 12.143 144 HD2 TYR 63 HD2 TYR 63 -0.538 4.668 9.821 145 HE1 TYR 63 HE1 TYR 63 -1.232 7.589 13.719 146 HE2 TYR 63 HE2 TYR 63 1.309 5.072 11.392 147 HH TYR 63 HH TYR 63 1.512 5.747 13.870 148 HA PRO 64 HA PRO 64 -3.214 8.460 5.628 149 HB2 PRO 64 1HB PRO 64 -0.546 8.290 5.091 150 HB3 PRO 64 2HB PRO 64 -1.284 9.656 5.936 151 HG2 PRO 64 1HG PRO 64 0.174 7.298 7.059 152 HG3 PRO 64 2HG PRO 64 0.284 9.008 7.518 153 HD2 PRO 64 1HD PRO 64 -1.150 7.214 8.941 154 HD3 PRO 64 2HD PRO 64 -1.630 8.916 8.801 155 H TRP 65 H TRP 65 -2.097 7.570 3.532 156 HA TRP 65 HA TRP 65 -2.770 4.764 3.392 157 HB2 TRP 65 1HB TRP 65 -1.782 6.646 1.236 158 HB3 TRP 65 2HB TRP 65 -2.402 5.022 0.969 159 HD1 TRP 65 HD1 TRP 65 -3.708 8.352 2.501 160 HE1 TRP 65 HE1 TRP 65 -6.191 8.584 1.877 161 HE3 TRP 65 HE3 TRP 65 -4.338 3.929 0.010 162 HZ2 TRP 65 HZ2 TRP 65 -8.160 7.092 0.509 163 HZ3 TRP 65 HZ3 TRP 65 -6.553 3.411 -0.926 164 HH2 TRP 65 HH2 TRP 65 -8.424 4.961 -0.680 165 H TRP 66 H TRP 66 -1.377 3.105 3.478 166 HA TRP 66 HA TRP 66 1.503 3.708 3.290 167 HB2 TRP 66 1HB TRP 66 0.250 2.621 5.410 168 HB3 TRP 66 2HB TRP 66 0.614 1.153 4.507 169 HD1 TRP 66 HD1 TRP 66 2.932 0.148 4.943 170 HE1 TRP 66 HE1 TRP 66 5.144 0.991 5.958 171 HE3 TRP 66 HE3 TRP 66 1.687 5.057 5.641 172 HZ2 TRP 66 HZ2 TRP 66 6.214 3.413 6.924 173 HZ3 TRP 66 HZ3 TRP 66 3.366 6.571 6.611 174 HH2 TRP 66 HH2 TRP 66 5.586 5.762 7.233 175 HA PRO 67 HA PRO 67 1.710 1.154 -0.326 176 HB2 PRO 67 1HB PRO 67 4.357 0.618 -0.369 177 HB3 PRO 67 2HB PRO 67 3.708 2.218 -0.742 178 HG2 PRO 67 1HG PRO 67 4.906 1.209 1.810 179 HG3 PRO 67 2HG PRO 67 5.173 2.754 0.986 180 HD2 PRO 67 1HD PRO 67 3.506 2.489 3.108 181 HD3 PRO 67 2HD PRO 67 3.238 3.679 1.821 182 H ALA 68 H ALA 68 0.685 -0.765 -0.068 183 HA ALA 68 HA ALA 68 2.147 -2.940 1.307 184 HB1 ALA 68 3HB ALA 68 -0.772 -3.216 0.947 185 HB2 ALA 68 1HB ALA 68 -0.243 -1.989 2.098 186 HB3 ALA 68 2HB ALA 68 0.260 -3.665 2.308 187 H LEU 69 H LEU 69 1.259 -5.159 0.457 188 HA LEU 69 HA LEU 69 1.057 -5.026 -2.485 189 HB2 LEU 69 1HB LEU 69 3.153 -6.107 -0.947 190 HB3 LEU 69 2HB LEU 69 2.264 -7.483 -1.574 191 HG LEU 69 HG LEU 69 2.944 -5.339 -3.511 192 HD11 LEU 69 1HD1 LEU 69 5.057 -7.342 -2.873 193 HD12 LEU 69 2HD1 LEU 69 4.964 -5.849 -1.939 194 HD13 LEU 69 3HD1 LEU 69 5.187 -5.785 -3.687 195 HD21 LEU 69 3HD2 LEU 69 3.174 -8.334 -3.713 196 HD22 LEU 69 1HD2 LEU 69 3.132 -7.159 -5.027 197 HD23 LEU 69 2HD2 LEU 69 1.690 -7.445 -4.052 198 H LEU 70 H LEU 70 -0.796 -5.852 -3.199 199 HA LEU 70 HA LEU 70 -2.648 -7.206 -1.585 200 HB2 LEU 70 1HB LEU 70 -2.889 -5.934 -3.881 201 HB3 LEU 70 2HB LEU 70 -2.700 -7.545 -4.548 202 HG LEU 70 HG LEU 70 -4.812 -6.819 -2.519 203 HD11 LEU 70 1HD1 LEU 70 -5.859 -5.755 -4.163 204 HD12 LEU 70 2HD1 LEU 70 -6.055 -7.329 -4.936 205 HD13 LEU 70 3HD1 LEU 70 -4.688 -6.302 -5.366 206 HD21 LEU 70 3HD2 LEU 70 -5.799 -8.954 -3.690 207 HD22 LEU 70 1HD2 LEU 70 -4.632 -9.099 -2.375 208 HD23 LEU 70 2HD2 LEU 70 -4.102 -9.276 -4.048 209 H LEU 71 H LEU 71 -2.858 -9.260 -0.991 210 HA LEU 71 HA LEU 71 -1.162 -11.274 -2.296 211 HB2 LEU 71 1HB LEU 71 -2.586 -11.587 0.338 212 HB3 LEU 71 2HB LEU 71 -1.273 -12.557 -0.297 213 HG LEU 71 HG LEU 71 -0.782 -9.658 0.218 214 HD11 LEU 71 1HD1 LEU 71 -0.679 -9.808 2.473 215 HD12 LEU 71 2HD1 LEU 71 -0.273 -11.523 2.456 216 HD13 LEU 71 3HD1 LEU 71 -1.940 -11.011 2.208 217 HD21 LEU 71 3HD2 LEU 71 1.399 -10.238 0.150 218 HD22 LEU 71 1HD2 LEU 71 0.779 -11.610 -0.768 219 HD23 LEU 71 2HD2 LEU 71 1.127 -11.786 0.952 220 H ARG 72 H ARG 72 -4.414 -11.042 -0.805 221 HA ARG 72 HA ARG 72 -5.610 -12.389 -3.051 222 HB2 ARG 72 1HB ARG 72 -4.933 -13.851 -0.596 223 HB3 ARG 72 2HB ARG 72 -6.610 -14.025 -1.096 224 HG2 ARG 72 1HG ARG 72 -5.182 -14.374 -3.440 225 HG3 ARG 72 2HG ARG 72 -4.206 -15.187 -2.214 226 HD2 ARG 72 1HD ARG 72 -6.574 -16.137 -1.495 227 HD3 ARG 72 2HD ARG 72 -6.947 -15.801 -3.185 228 HE ARG 72 HE ARG 72 -4.509 -17.235 -2.944 229 HH11 ARG 72 1HH1 ARG 72 -7.985 -17.655 -2.803 230 HH12 ARG 72 2HH1 ARG 72 -7.924 -19.321 -3.267 231 HH21 ARG 72 1HH2 ARG 72 -4.438 -19.430 -3.551 232 HH22 ARG 72 2HH2 ARG 72 -5.912 -20.329 -3.692 233 H ARG 73 H ARG 73 -7.945 -12.535 -2.904 234 HA ARG 73 HA ARG 73 -9.049 -10.496 -1.092 235 HB2 ARG 73 1HB ARG 73 -10.928 -10.386 -2.812 236 HB3 ARG 73 2HB ARG 73 -9.376 -9.721 -3.293 237 HG2 ARG 73 1HG ARG 73 -8.897 -11.779 -4.545 238 HG3 ARG 73 2HG ARG 73 -10.477 -12.414 -4.077 239 HD2 ARG 73 1HD ARG 73 -11.584 -11.108 -5.549 240 HD3 ARG 73 2HD ARG 73 -10.499 -9.739 -5.312 241 HE ARG 73 HE ARG 73 -9.253 -10.454 -7.095 242 HH11 ARG 73 1HH1 ARG 73 -11.383 -13.057 -6.114 243 HH12 ARG 73 2HH1 ARG 73 -11.058 -14.018 -7.515 244 HH21 ARG 73 1HH2 ARG 73 -8.824 -11.728 -8.940 245 HH22 ARG 73 2HH2 ARG 73 -9.602 -13.264 -9.120 246 H LYS 74 H LYS 74 -9.960 -11.450 0.608 247 HA LYS 74 HA LYS 74 -11.432 -13.959 0.220 248 HB2 LYS 74 1HB LYS 74 -11.387 -13.900 2.829 249 HB3 LYS 74 2HB LYS 74 -9.948 -14.374 1.939 250 HG2 LYS 74 1HG LYS 74 -8.830 -12.419 2.434 251 HG3 LYS 74 2HG LYS 74 -10.320 -11.522 2.738 252 HD2 LYS 74 1HD LYS 74 -10.302 -13.615 4.602 253 HD3 LYS 74 2HD LYS 74 -8.656 -12.981 4.583 254 HE2 LYS 74 1HE LYS 74 -9.264 -11.007 5.494 255 HE3 LYS 74 2HE LYS 74 -10.787 -10.951 4.605 256 HZ1 LYS 74 3HZ LYS 74 -11.241 -12.964 6.313 257 HZ2 LYS 74 1HZ LYS 74 -11.663 -11.354 6.614 258 HZ3 LYS 74 2HZ LYS 74 -10.230 -11.985 7.251 259 H GLU 75 H GLU 75 -13.575 -14.015 0.320 260 HA GLU 75 HA GLU 75 -14.999 -11.591 1.151 261 HB2 GLU 75 1HB GLU 75 -15.273 -13.162 -1.091 262 HB3 GLU 75 2HB GLU 75 -16.581 -13.735 -0.069 263 HG2 GLU 75 1HG GLU 75 -17.265 -11.325 0.202 264 HG3 GLU 75 2HG GLU 75 -16.108 -10.946 -1.074 265 H THR 76 H THR 76 -15.647 -11.590 3.208 266 HA THR 76 HA THR 76 -16.792 -14.075 4.301 267 HB THR 76 HB THR 76 -14.686 -13.566 5.417 268 HG1 THR 76 HG1 THR 76 -16.798 -12.875 7.174 269 HG21 THR 76 3HG2 THR 76 -15.925 -10.907 6.082 270 HG22 THR 76 1HG2 THR 76 -14.463 -11.206 5.142 271 HG23 THR 76 2HG2 THR 76 -14.490 -11.570 6.867 272 H LYS 77 H LYS 77 -18.825 -13.971 5.045 273 HA LYS 77 HA LYS 77 -20.190 -11.392 4.918 274 HB2 LYS 77 1HB LYS 77 -21.520 -14.045 5.409 275 HB3 LYS 77 2HB LYS 77 -22.207 -12.586 4.713 276 HG2 LYS 77 1HG LYS 77 -21.879 -13.522 2.729 277 HG3 LYS 77 2HG LYS 77 -20.157 -13.234 2.975 278 HD2 LYS 77 1HD LYS 77 -21.054 -15.625 4.346 279 HD3 LYS 77 2HD LYS 77 -21.406 -15.694 2.618 280 HE2 LYS 77 1HE LYS 77 -19.269 -16.076 2.139 281 HE3 LYS 77 2HE LYS 77 -18.762 -14.653 3.045 282 HZ1 LYS 77 3HZ LYS 77 -19.481 -16.886 4.719 283 HZ2 LYS 77 1HZ LYS 77 -18.106 -15.902 4.761 284 HZ3 LYS 77 2HZ LYS 77 -18.176 -17.212 3.697 285 H ASP 78 H ASP 78 -21.909 -10.980 6.573 286 HA ASP 78 HA ASP 78 -22.520 -10.524 8.709 287 HB2 ASP 78 1HB ASP 78 -22.439 -13.207 8.623 288 HB3 ASP 78 2HB ASP 78 -21.194 -12.934 9.833 289 H SER 79 H SER 79 -20.771 -8.861 8.354 290 HA SER 79 HA SER 79 -18.218 -9.132 9.502 291 HB2 SER 79 1HB SER 79 -19.111 -7.307 7.902 292 HB3 SER 79 2HB SER 79 -19.687 -6.507 9.363 293 HG SER 79 HG SER 79 -17.419 -6.768 10.106 294 H LEU 80 H LEU 80 -21.255 -7.838 10.827 295 HA LEU 80 HA LEU 80 -20.007 -7.761 13.490 296 HB2 LEU 80 1HB LEU 80 -22.070 -6.140 12.139 297 HB3 LEU 80 2HB LEU 80 -22.414 -6.527 13.811 298 HG LEU 80 HG LEU 80 -21.305 -4.333 13.501 299 HD11 LEU 80 1HD1 LEU 80 -20.237 -4.489 15.475 300 HD12 LEU 80 2HD1 LEU 80 -19.294 -5.896 14.987 301 HD13 LEU 80 3HD1 LEU 80 -20.973 -6.090 15.493 302 HD21 LEU 80 3HD2 LEU 80 -18.725 -5.715 12.955 303 HD22 LEU 80 1HD2 LEU 80 -19.215 -4.055 12.615 304 HD23 LEU 80 2HD2 LEU 80 -19.813 -5.374 11.610 305 H ASN 81 H ASN 81 -23.463 -7.969 12.763 306 HA ASN 81 HA ASN 81 -23.718 -10.758 13.318 307 HB2 ASN 81 1HB ASN 81 -23.806 -8.887 15.561 308 HB3 ASN 81 2HB ASN 81 -25.278 -9.843 15.428 309 HD21 ASN 81 2HD2 ASN 81 -24.838 -12.237 14.999 310 HD22 ASN 81 1HD2 ASN 81 -23.600 -12.959 15.979 311 H THR 82 H THR 82 -24.599 -8.960 11.285 312 HA THR 82 HA THR 82 -27.513 -8.912 11.706 313 HB THR 82 HB THR 82 -27.445 -7.276 9.741 314 HG1 THR 82 HG1 THR 82 -25.399 -7.579 8.963 315 HG21 THR 82 3HG2 THR 82 -25.868 -6.029 11.900 316 HG22 THR 82 1HG2 THR 82 -27.411 -6.755 12.352 317 HG23 THR 82 2HG2 THR 82 -27.356 -5.496 11.120 318 H ASN 83 H ASN 83 -25.001 -10.318 9.802 319 HA ASN 83 HA ASN 83 -24.939 -11.600 7.932 320 HB2 ASN 83 1HB ASN 83 -26.490 -13.479 7.909 321 HB3 ASN 83 2HB ASN 83 -25.936 -13.164 9.544 322 HD21 ASN 83 2HD2 ASN 83 -28.631 -12.948 7.329 323 HD22 ASN 83 1HD2 ASN 83 -29.861 -12.769 8.543 324 H SER 84 H SER 84 -26.180 -8.996 7.499 325 HA SER 84 HA SER 84 -27.775 -9.700 5.126 326 HB2 SER 84 1HB SER 84 -28.868 -7.330 5.599 327 HB3 SER 84 2HB SER 84 -29.486 -8.784 6.380 328 HG SER 84 HG SER 84 -28.917 -7.984 8.233 329 H SER 85 H SER 85 -24.914 -9.153 5.446 330 HA SER 85 HA SER 85 -24.547 -7.447 3.230 331 HB2 SER 85 1HB SER 85 -24.974 -5.675 4.884 332 HB3 SER 85 2HB SER 85 -23.683 -6.312 5.903 333 HG SER 85 HG SER 85 -22.198 -5.597 4.505 334 H PHE 86 H PHE 86 -22.707 -8.002 2.253 335 HA PHE 86 HA PHE 86 -20.989 -9.964 3.457 336 HB2 PHE 86 1HB PHE 86 -20.664 -8.512 0.819 337 HB3 PHE 86 2HB PHE 86 -19.798 -9.957 1.320 338 HD1 PHE 86 HD2 PHE 86 -23.039 -8.625 0.223 339 HD2 PHE 86 HD1 PHE 86 -20.820 -12.119 1.219 340 HE1 PHE 86 HE2 PHE 86 -24.797 -10.023 -0.777 341 HE2 PHE 86 HE1 PHE 86 -22.576 -13.522 0.218 342 HZ PHE 86 HZ PHE 86 -24.568 -12.475 -0.780 343 H ASN 87 H ASN 87 -18.652 -9.746 3.616 344 HA ASN 87 HA ASN 87 -17.682 -6.996 3.913 345 HB2 ASN 87 1HB ASN 87 -18.452 -8.155 6.130 346 HB3 ASN 87 2HB ASN 87 -16.944 -9.051 5.974 347 HD21 ASN 87 2HD2 ASN 87 -18.130 -5.705 5.756 348 HD22 ASN 87 1HD2 ASN 87 -16.793 -5.005 6.616 349 H VAL 88 H VAL 88 -16.614 -7.446 1.915 350 HA VAL 88 HA VAL 88 -14.509 -9.469 1.969 351 HB VAL 88 HB VAL 88 -15.828 -9.340 -0.070 352 HG11 VAL 88 1HG1 VAL 88 -15.456 -7.285 -1.553 353 HG12 VAL 88 2HG1 VAL 88 -14.961 -6.470 -0.070 354 HG13 VAL 88 3HG1 VAL 88 -16.587 -7.135 -0.209 355 HG21 VAL 88 3HG2 VAL 88 -13.056 -8.286 -0.615 356 HG22 VAL 88 1HG2 VAL 88 -14.048 -9.289 -1.674 357 HG23 VAL 88 2HG2 VAL 88 -13.414 -9.955 -0.170 358 H LEU 89 H LEU 89 -12.354 -9.025 1.946 359 HA LEU 89 HA LEU 89 -11.535 -6.201 2.073 360 HB2 LEU 89 1HB LEU 89 -10.227 -8.273 3.800 361 HB3 LEU 89 2HB LEU 89 -10.185 -6.528 3.953 362 HG LEU 89 HG LEU 89 -12.784 -7.962 4.339 363 HD11 LEU 89 1HD1 LEU 89 -12.329 -8.428 6.613 364 HD12 LEU 89 2HD1 LEU 89 -10.775 -7.598 6.547 365 HD13 LEU 89 3HD1 LEU 89 -11.000 -9.119 5.685 366 HD21 LEU 89 3HD2 LEU 89 -12.370 -5.400 4.259 367 HD22 LEU 89 1HD2 LEU 89 -11.732 -5.628 5.887 368 HD23 LEU 89 2HD2 LEU 89 -13.400 -6.072 5.524 369 H TYR 90 H TYR 90 -8.976 -6.177 2.106 370 HA TYR 90 HA TYR 90 -8.046 -8.018 0.002 371 HB2 TYR 90 1HB TYR 90 -8.012 -5.085 0.148 372 HB3 TYR 90 2HB TYR 90 -6.457 -5.794 -0.273 373 HD1 TYR 90 HD1 TYR 90 -7.388 -8.175 -1.806 374 HD2 TYR 90 HD2 TYR 90 -8.697 -4.127 -1.891 375 HE1 TYR 90 HE1 TYR 90 -8.144 -8.478 -4.116 376 HE2 TYR 90 HE2 TYR 90 -9.458 -4.420 -4.211 377 HH TYR 90 HH TYR 90 -10.168 -6.301 -5.698 378 H LYS 91 H LYS 91 -6.844 -9.447 1.151 379 HA LYS 91 HA LYS 91 -5.237 -8.745 3.393 380 HB2 LYS 91 1HB LYS 91 -5.083 -11.190 1.610 381 HB3 LYS 91 2HB LYS 91 -4.310 -11.021 3.180 382 HG2 LYS 91 1HG LYS 91 -7.049 -10.455 3.558 383 HG3 LYS 91 2HG LYS 91 -6.952 -11.903 2.553 384 HD2 LYS 91 1HD LYS 91 -5.172 -11.728 4.928 385 HD3 LYS 91 2HD LYS 91 -6.888 -12.028 5.202 386 HE2 LYS 91 1HE LYS 91 -6.833 -14.081 4.177 387 HE3 LYS 91 2HE LYS 91 -5.473 -13.648 3.142 388 HZ1 LYS 91 3HZ LYS 91 -5.458 -14.563 5.941 389 HZ2 LYS 91 1HZ LYS 91 -4.185 -13.604 5.373 390 HZ3 LYS 91 2HZ LYS 91 -4.517 -15.089 4.638 391 H VAL 92 H VAL 92 -3.737 -7.177 2.984 392 HA VAL 92 HA VAL 92 -1.837 -7.674 0.785 393 HB VAL 92 HB VAL 92 -1.367 -5.296 0.738 394 HG11 VAL 92 1HG1 VAL 92 -4.010 -6.410 0.247 395 HG12 VAL 92 2HG1 VAL 92 -3.009 -5.375 -0.769 396 HG13 VAL 92 3HG1 VAL 92 -4.033 -4.660 0.476 397 HG21 VAL 92 3HG2 VAL 92 -1.643 -4.730 3.068 398 HG22 VAL 92 1HG2 VAL 92 -3.370 -5.085 2.987 399 HG23 VAL 92 2HG2 VAL 92 -2.708 -3.715 2.093 400 H LEU 93 H LEU 93 0.386 -7.109 1.102 401 HA LEU 93 HA LEU 93 1.271 -7.589 3.858 402 HB2 LEU 93 1HB LEU 93 2.462 -8.073 1.162 403 HB3 LEU 93 2HB LEU 93 3.545 -7.819 2.517 404 HG LEU 93 HG LEU 93 1.444 -9.983 2.344 405 HD11 LEU 93 1HD1 LEU 93 4.329 -10.608 2.468 406 HD12 LEU 93 2HD1 LEU 93 3.720 -9.969 0.942 407 HD13 LEU 93 3HD1 LEU 93 3.019 -11.436 1.626 408 HD21 LEU 93 3HD2 LEU 93 2.861 -10.854 4.326 409 HD22 LEU 93 1HD2 LEU 93 1.668 -9.587 4.619 410 HD23 LEU 93 2HD2 LEU 93 3.378 -9.174 4.481 411 H PHE 94 H PHE 94 2.356 -6.095 4.984 412 HA PHE 94 HA PHE 94 2.728 -3.462 3.761 413 HB2 PHE 94 1HB PHE 94 2.302 -4.505 6.506 414 HB3 PHE 94 2HB PHE 94 3.318 -3.075 6.371 415 HD1 PHE 94 HD1 PHE 94 0.083 -4.319 4.949 416 HD2 PHE 94 HD2 PHE 94 2.263 -1.075 6.641 417 HE1 PHE 94 HE1 PHE 94 -1.924 -2.906 4.821 418 HE2 PHE 94 HE2 PHE 94 0.257 0.341 6.514 419 HZ PHE 94 HZ PHE 94 -1.840 -0.573 5.604 420 H PHE 95 H PHE 95 4.679 -2.213 4.251 421 HA PHE 95 HA PHE 95 7.080 -3.740 4.932 422 HB2 PHE 95 1HB PHE 95 7.032 -2.056 2.426 423 HB3 PHE 95 2HB PHE 95 8.265 -3.199 2.939 424 HD1 PHE 95 HD1 PHE 95 4.883 -2.866 1.525 425 HD2 PHE 95 HD2 PHE 95 8.072 -5.524 2.464 426 HE1 PHE 95 HE1 PHE 95 3.807 -4.624 0.187 427 HE2 PHE 95 HE2 PHE 95 7.001 -7.286 1.124 428 HZ PHE 95 HZ PHE 95 4.866 -6.838 -0.015 429 HA PRO 96 HA PRO 96 9.376 -3.012 4.286 430 HB2 PRO 96 1HB PRO 96 11.311 -2.115 6.218 431 HB3 PRO 96 2HB PRO 96 11.351 -1.933 4.462 432 HG2 PRO 96 1HG PRO 96 11.072 0.157 6.210 433 HG3 PRO 96 2HG PRO 96 10.478 0.176 4.541 434 HD2 PRO 96 1HD PRO 96 8.976 -0.345 7.083 435 HD3 PRO 96 2HD PRO 96 8.495 0.614 5.667 436 H ASP 97 H ASP 97 8.509 -2.288 7.597 437 HA ASP 97 HA ASP 97 9.692 -4.159 9.138 438 HB2 ASP 97 1HB ASP 97 7.474 -4.263 10.422 439 HB3 ASP 97 2HB ASP 97 8.228 -2.686 10.215 440 H PHE 98 H PHE 98 7.303 -4.848 6.696 441 HA PHE 98 HA PHE 98 6.680 -6.806 5.734 442 HB2 PHE 98 1HB PHE 98 8.936 -7.688 7.395 443 HB3 PHE 98 2HB PHE 98 7.733 -8.940 7.110 444 HD1 PHE 98 HD1 PHE 98 7.023 -9.330 4.669 445 HD2 PHE 98 HD2 PHE 98 10.547 -7.235 5.805 446 HE1 PHE 98 HE1 PHE 98 7.979 -9.738 2.440 447 HE2 PHE 98 HE2 PHE 98 11.510 -7.638 3.577 448 HZ PHE 98 HZ PHE 98 10.226 -8.892 1.891 449 H ASN 99 H ASN 99 4.660 -6.110 6.639 450 HA ASN 99 HA ASN 99 3.604 -8.065 8.559 451 HB2 ASN 99 1HB ASN 99 4.050 -5.454 9.266 452 HB3 ASN 99 2HB ASN 99 2.385 -5.384 8.707 453 HD21 ASN 99 2HD2 ASN 99 4.157 -5.654 11.374 454 HD22 ASN 99 1HD2 ASN 99 3.102 -6.611 12.366 455 H PHE 100 H PHE 100 0.936 -6.908 8.496 456 HA PHE 100 HA PHE 100 0.130 -6.682 5.755 457 HB2 PHE 100 1HB PHE 100 -1.503 -8.773 6.253 458 HB3 PHE 100 2HB PHE 100 0.027 -8.920 5.400 459 HD1 PHE 100 HD2 PHE 100 1.979 -9.852 6.504 460 HD2 PHE 100 HD1 PHE 100 -1.786 -9.632 8.468 461 HE1 PHE 100 HE2 PHE 100 2.775 -11.451 8.193 462 HE2 PHE 100 HE1 PHE 100 -1.000 -11.222 10.163 463 HZ PHE 100 HZ PHE 100 1.285 -12.140 10.026 464 H ALA 101 H ALA 101 -2.389 -6.855 5.650 465 HA ALA 101 HA ALA 101 -3.866 -6.233 7.998 466 HB1 ALA 101 3HB ALA 101 -3.298 -4.076 8.187 467 HB2 ALA 101 1HB ALA 101 -4.307 -3.816 6.764 468 HB3 ALA 101 2HB ALA 101 -2.566 -4.038 6.583 469 H TRP 102 H TRP 102 -6.083 -6.177 7.628 470 HA TRP 102 HA TRP 102 -6.894 -6.908 4.901 471 HB2 TRP 102 1HB TRP 102 -8.508 -7.195 7.447 472 HB3 TRP 102 2HB TRP 102 -8.857 -7.915 5.879 473 HD1 TRP 102 HD1 TRP 102 -5.598 -8.794 5.616 474 HE1 TRP 102 HE1 TRP 102 -4.921 -10.957 6.832 475 HE3 TRP 102 HE3 TRP 102 -9.517 -9.156 8.885 476 HZ2 TRP 102 HZ2 TRP 102 -5.917 -12.605 8.894 477 HZ3 TRP 102 HZ3 TRP 102 -9.578 -11.057 10.446 478 HH2 TRP 102 HH2 TRP 102 -7.813 -12.745 10.448 479 H VAL 103 H VAL 103 -7.390 -5.125 3.774 480 HA VAL 103 HA VAL 103 -9.275 -3.202 4.981 481 HB VAL 103 HB VAL 103 -7.153 -2.496 2.955 482 HG11 VAL 103 1HG1 VAL 103 -7.721 -0.162 3.768 483 HG12 VAL 103 2HG1 VAL 103 -9.143 -0.883 4.524 484 HG13 VAL 103 3HG1 VAL 103 -8.935 -0.969 2.773 485 HG21 VAL 103 3HG2 VAL 103 -7.111 -1.807 5.885 486 HG22 VAL 103 1HG2 VAL 103 -5.843 -1.539 4.687 487 HG23 VAL 103 2HG2 VAL 103 -6.238 -3.179 5.200 488 H LYS 104 H LYS 104 -11.018 -2.607 3.753 489 HA LYS 104 HA LYS 104 -11.785 -4.276 1.603 490 HB2 LYS 104 1HB LYS 104 -12.960 -1.616 2.436 491 HB3 LYS 104 2HB LYS 104 -13.732 -2.793 1.383 492 HG2 LYS 104 1HG LYS 104 -13.835 -4.389 3.212 493 HG3 LYS 104 2HG LYS 104 -13.014 -3.242 4.272 494 HD2 LYS 104 1HD LYS 104 -14.984 -1.658 3.572 495 HD3 LYS 104 2HD LYS 104 -15.796 -3.176 3.187 496 HE2 LYS 104 1HE LYS 104 -16.286 -2.393 5.471 497 HE3 LYS 104 2HE LYS 104 -15.482 -3.961 5.452 498 HZ1 LYS 104 3HZ LYS 104 -13.768 -1.612 5.676 499 HZ2 LYS 104 1HZ LYS 104 -13.630 -3.127 6.417 500 HZ3 LYS 104 2HZ LYS 104 -14.719 -1.984 7.023 501 H ARG 105 H ARG 105 -12.443 -3.505 -0.567 502 HA ARG 105 HA ARG 105 -10.283 -2.338 -1.948 503 HB2 ARG 105 1HB ARG 105 -13.092 -2.493 -3.021 504 HB3 ARG 105 2HB ARG 105 -11.584 -2.537 -3.922 505 HG2 ARG 105 1HG ARG 105 -11.696 -4.744 -3.896 506 HG3 ARG 105 2HG ARG 105 -11.471 -4.701 -2.147 507 HD2 ARG 105 1HD ARG 105 -13.470 -5.974 -2.790 508 HD3 ARG 105 2HD ARG 105 -13.866 -4.563 -1.812 509 HE ARG 105 HE ARG 105 -14.019 -4.139 -4.666 510 HH11 ARG 105 1HH1 ARG 105 -15.758 -5.093 -1.784 511 HH12 ARG 105 2HH1 ARG 105 -17.311 -4.717 -2.444 512 HH21 ARG 105 1HH2 ARG 105 -16.079 -3.630 -5.530 513 HH22 ARG 105 2HH2 ARG 105 -17.494 -3.886 -4.567 514 H ASN 106 H ASN 106 -13.027 -0.912 -0.393 515 HA ASN 106 HA ASN 106 -13.180 1.497 -1.860 516 HB2 ASN 106 1HB ASN 106 -13.905 0.994 1.036 517 HB3 ASN 106 2HB ASN 106 -14.419 2.371 0.068 518 HD21 ASN 106 2HD2 ASN 106 -15.824 0.047 1.432 519 HD22 ASN 106 1HD2 ASN 106 -16.880 -0.574 0.201 520 H SER 107 H SER 107 -11.120 0.421 0.767 521 HA SER 107 HA SER 107 -9.923 3.092 0.955 522 HB2 SER 107 1HB SER 107 -10.151 0.786 2.801 523 HB3 SER 107 2HB SER 107 -8.637 1.689 2.874 524 HG SER 107 HG SER 107 -9.746 3.012 4.074 525 H VAL 108 H VAL 108 -9.509 0.880 -1.191 526 HA VAL 108 HA VAL 108 -6.606 0.556 -0.906 527 HB VAL 108 HB VAL 108 -8.193 -1.402 -1.490 528 HG11 VAL 108 1HG1 VAL 108 -7.823 -0.857 -4.336 529 HG12 VAL 108 2HG1 VAL 108 -8.961 0.231 -3.544 530 HG13 VAL 108 3HG1 VAL 108 -9.216 -1.512 -3.475 531 HG21 VAL 108 3HG2 VAL 108 -5.582 -1.111 -1.739 532 HG22 VAL 108 1HG2 VAL 108 -5.968 -1.233 -3.455 533 HG23 VAL 108 2HG2 VAL 108 -6.414 -2.538 -2.356 534 H LYS 109 H LYS 109 -5.248 0.893 -2.841 535 HA LYS 109 HA LYS 109 -6.280 2.689 -4.877 536 HB2 LYS 109 1HB LYS 109 -5.530 4.048 -2.826 537 HB3 LYS 109 2HB LYS 109 -3.896 3.581 -3.272 538 HG2 LYS 109 1HG LYS 109 -4.202 5.690 -4.223 539 HG3 LYS 109 2HG LYS 109 -4.406 4.558 -5.562 540 HD2 LYS 109 1HD LYS 109 -6.867 4.690 -5.221 541 HD3 LYS 109 2HD LYS 109 -6.591 5.933 -4.000 542 HE2 LYS 109 1HE LYS 109 -5.813 7.474 -5.568 543 HE3 LYS 109 2HE LYS 109 -5.486 6.226 -6.770 544 HZ1 LYS 109 3HZ LYS 109 -8.095 5.926 -6.535 545 HZ2 LYS 109 1HZ LYS 109 -7.410 7.042 -7.608 546 HZ3 LYS 109 2HZ LYS 109 -7.997 7.561 -6.111 547 HA PRO 110 HA PRO 110 -3.287 0.276 -7.131 548 HB2 PRO 110 1HB PRO 110 -3.462 1.548 -9.514 549 HB3 PRO 110 2HB PRO 110 -4.719 0.457 -8.922 550 HG2 PRO 110 1HG PRO 110 -4.630 3.446 -8.872 551 HG3 PRO 110 2HG PRO 110 -5.986 2.375 -9.259 552 HD2 PRO 110 1HD PRO 110 -5.687 3.584 -6.840 553 HD3 PRO 110 2HD PRO 110 -6.499 2.020 -7.048 554 H LEU 111 H LEU 111 -1.274 0.659 -6.333 555 HA LEU 111 HA LEU 111 0.016 3.231 -6.781 556 HB2 LEU 111 1HB LEU 111 0.122 1.402 -4.719 557 HB3 LEU 111 2HB LEU 111 1.628 1.111 -5.567 558 HG LEU 111 HG LEU 111 0.708 3.671 -4.271 559 HD11 LEU 111 1HD1 LEU 111 1.794 1.820 -2.929 560 HD12 LEU 111 2HD1 LEU 111 2.565 3.403 -2.849 561 HD13 LEU 111 3HD1 LEU 111 3.258 2.135 -3.860 562 HD21 LEU 111 3HD2 LEU 111 1.697 4.574 -6.135 563 HD22 LEU 111 1HD2 LEU 111 2.794 3.210 -6.350 564 HD23 LEU 111 2HD2 LEU 111 3.096 4.392 -5.078 565 H LEU 112 H LEU 112 1.641 3.599 -8.202 566 HA LEU 112 HA LEU 112 2.586 1.312 -9.803 567 HB2 LEU 112 1HB LEU 112 2.977 3.180 -11.580 568 HB3 LEU 112 2HB LEU 112 1.383 2.487 -11.369 569 HG LEU 112 HG LEU 112 1.960 4.919 -9.779 570 HD11 LEU 112 1HD1 LEU 112 1.113 6.090 -12.058 571 HD12 LEU 112 2HD1 LEU 112 2.175 4.843 -12.712 572 HD13 LEU 112 3HD1 LEU 112 2.799 6.016 -11.551 573 HD21 LEU 112 3HD2 LEU 112 -0.363 5.428 -10.471 574 HD22 LEU 112 1HD2 LEU 112 -0.206 3.877 -9.646 575 HD23 LEU 112 2HD2 LEU 112 -0.381 3.929 -11.401 576 H ASP 113 H ASP 113 4.726 1.706 -10.866 577 HA ASP 113 HA ASP 113 6.726 2.194 -8.974 578 HB2 ASP 113 1HB ASP 113 6.939 2.222 -11.997 579 HB3 ASP 113 2HB ASP 113 8.301 2.121 -10.888 580 H SER 114 H SER 114 5.477 4.266 -11.567 581 HA SER 114 HA SER 114 7.281 6.398 -11.201 582 HB2 SER 114 1HB SER 114 6.068 6.372 -13.241 583 HB3 SER 114 2HB SER 114 4.521 6.235 -12.409 584 HG SER 114 HG SER 114 6.226 8.497 -12.215 585 H GLU 115 H GLU 115 4.308 5.518 -9.552 586 HA GLU 115 HA GLU 115 4.051 8.056 -8.213 587 HB2 GLU 115 1HB GLU 115 2.667 5.399 -7.959 588 HB3 GLU 115 2HB GLU 115 2.438 6.640 -6.734 589 HG2 GLU 115 1HG GLU 115 1.934 7.081 -9.665 590 HG3 GLU 115 2HG GLU 115 0.695 6.578 -8.518 591 H ILE 116 H ILE 116 5.321 4.858 -7.368 592 HA ILE 116 HA ILE 116 5.852 5.391 -4.652 593 HB ILE 116 HB ILE 116 7.327 3.466 -6.463 594 HG12 ILE 116 1HG1 ILE 116 5.157 2.654 -4.562 595 HG13 ILE 116 2HG1 ILE 116 4.717 3.307 -6.135 596 HG21 ILE 116 1HG2 ILE 116 7.005 3.276 -3.483 597 HG22 ILE 116 2HG2 ILE 116 8.368 4.101 -4.234 598 HG23 ILE 116 3HG2 ILE 116 8.107 2.384 -4.528 599 HD11 ILE 116 3HD1 ILE 116 4.737 1.009 -6.454 600 HD12 ILE 116 1HD1 ILE 116 6.201 0.792 -5.496 601 HD13 ILE 116 2HD1 ILE 116 6.294 1.533 -7.094 602 H ALA 117 H ALA 117 8.006 5.454 -7.501 603 HA ALA 117 HA ALA 117 10.313 6.393 -6.257 604 HB1 ALA 117 3HB ALA 117 9.672 7.412 -8.977 605 HB2 ALA 117 1HB ALA 117 9.788 5.666 -8.758 606 HB3 ALA 117 2HB ALA 117 11.162 6.697 -8.361 607 H LYS 118 H LYS 118 7.522 8.119 -7.557 608 HA LYS 118 HA LYS 118 8.510 10.738 -7.207 609 HB2 LYS 118 1HB LYS 118 6.230 9.613 -8.284 610 HB3 LYS 118 2HB LYS 118 5.624 10.490 -6.886 611 HG2 LYS 118 1HG LYS 118 5.709 12.342 -8.064 612 HG3 LYS 118 2HG LYS 118 7.469 12.177 -8.120 613 HD2 LYS 118 1HD LYS 118 7.391 11.019 -10.186 614 HD3 LYS 118 2HD LYS 118 5.648 10.761 -10.059 615 HE2 LYS 118 1HE LYS 118 6.930 13.479 -10.323 616 HE3 LYS 118 2HE LYS 118 6.347 12.536 -11.692 617 HZ1 LYS 118 3HZ LYS 118 4.184 12.503 -10.167 618 HZ2 LYS 118 1HZ LYS 118 4.490 13.733 -11.290 619 HZ3 LYS 118 2HZ LYS 118 4.844 13.974 -9.655 620 H PHE 119 H PHE 119 6.296 8.800 -5.206 621 HA PHE 119 HA PHE 119 5.840 10.569 -3.138 622 HB2 PHE 119 1HB PHE 119 4.690 8.477 -3.131 623 HB3 PHE 119 2HB PHE 119 6.196 7.570 -3.112 624 HD1 PHE 119 HD2 PHE 119 7.647 7.731 -1.003 625 HD2 PHE 119 HD1 PHE 119 3.573 8.959 -1.150 626 HE1 PHE 119 HE2 PHE 119 7.503 7.533 1.446 627 HE2 PHE 119 HE1 PHE 119 3.428 8.766 1.299 628 HZ PHE 119 HZ PHE 119 5.398 8.052 2.590 629 H LEU 120 H LEU 120 8.586 8.358 -3.504 630 HA LEU 120 HA LEU 120 9.878 9.128 -1.104 631 HB2 LEU 120 1HB LEU 120 10.938 7.831 -3.610 632 HB3 LEU 120 2HB LEU 120 11.876 8.043 -2.143 633 HG LEU 120 HG LEU 120 9.271 6.666 -1.848 634 HD11 LEU 120 1HD1 LEU 120 11.592 5.532 -3.378 635 HD12 LEU 120 2HD1 LEU 120 9.876 5.507 -3.787 636 HD13 LEU 120 3HD1 LEU 120 10.484 4.496 -2.478 637 HD21 LEU 120 3HD2 LEU 120 12.031 6.112 -0.768 638 HD22 LEU 120 1HD2 LEU 120 10.525 5.362 -0.240 639 HD23 LEU 120 2HD2 LEU 120 10.796 7.082 0.034 640 H GLY 121 H GLY 121 9.976 10.337 -4.421 641 HA2 GLY 121 1HA GLY 121 12.149 12.177 -3.772 642 HA3 GLY 121 2HA GLY 121 11.388 11.972 -5.342 643 H SER 122 H SER 122 9.257 12.303 -2.647 644 HA SER 122 HA SER 122 7.810 14.414 -3.610 645 HB2 SER 122 1HB SER 122 6.930 13.110 -1.811 646 HB3 SER 122 2HB SER 122 8.273 13.538 -0.755 647 HG SER 122 HG SER 122 6.068 15.084 -1.555 648 H SER 123 H SER 123 10.169 14.739 -0.936 649 HA SER 123 HA SER 123 11.696 16.377 -0.484 650 HB2 SER 123 1HB SER 123 11.469 16.721 -3.168 651 HB3 SER 123 2HB SER 123 10.868 18.276 -2.590 652 HG SER 123 HG SER 123 13.197 18.134 -2.932 653 H LYS 124 H LYS 124 8.384 17.318 -1.274 654 HA LYS 124 HA LYS 124 8.503 19.694 0.358 655 HB2 LYS 124 1HB LYS 124 6.035 19.809 -0.085 656 HB3 LYS 124 2HB LYS 124 7.051 19.822 -1.518 657 HG2 LYS 124 1HG LYS 124 6.221 17.143 -0.751 658 HG3 LYS 124 2HG LYS 124 4.864 18.218 -1.099 659 HD2 LYS 124 1HD LYS 124 6.363 18.854 -3.178 660 HD3 LYS 124 2HD LYS 124 7.035 17.245 -2.881 661 HE2 LYS 124 1HE LYS 124 4.368 16.755 -2.708 662 HE3 LYS 124 2HE LYS 124 4.405 18.037 -3.920 663 HZ1 LYS 124 3HZ LYS 124 5.900 16.749 -5.251 664 HZ2 LYS 124 1HZ LYS 124 4.570 15.777 -4.861 665 HZ3 LYS 124 2HZ LYS 124 6.039 15.565 -4.053 666 H ARG 125 H ARG 125 6.778 16.564 0.624 667 HA ARG 125 HA ARG 125 6.897 16.866 3.523 668 HB2 ARG 125 1HB ARG 125 4.651 17.598 2.875 669 HB3 ARG 125 2HB ARG 125 4.403 16.103 1.984 670 HG2 ARG 125 1HG ARG 125 3.889 14.938 3.829 671 HG3 ARG 125 2HG ARG 125 5.134 15.727 4.799 672 HD2 ARG 125 1HD ARG 125 3.530 16.901 5.796 673 HD3 ARG 125 2HD ARG 125 3.218 17.705 4.259 674 HE ARG 125 HE ARG 125 1.631 15.650 5.507 675 HH11 ARG 125 1HH1 ARG 125 2.404 17.256 2.492 676 HH12 ARG 125 2HH1 ARG 125 0.906 16.836 1.739 677 HH21 ARG 125 1HH2 ARG 125 -0.345 15.092 4.502 678 HH22 ARG 125 2HH2 ARG 125 -0.656 15.611 2.880 679 H LYS 126 H LYS 126 8.325 15.309 3.866 680 HA LYS 126 HA LYS 126 7.524 12.568 3.297 681 HB2 LYS 126 1HB LYS 126 9.590 11.920 2.327 682 HB3 LYS 126 2HB LYS 126 9.077 13.368 1.478 683 HG2 LYS 126 1HG LYS 126 11.116 13.312 3.695 684 HG3 LYS 126 2HG LYS 126 11.493 13.313 1.972 685 HD2 LYS 126 1HD LYS 126 9.779 15.449 2.219 686 HD3 LYS 126 2HD LYS 126 10.700 15.515 3.723 687 HE2 LYS 126 1HE LYS 126 12.043 15.205 1.057 688 HE3 LYS 126 2HE LYS 126 11.607 16.788 1.693 689 HZ1 LYS 126 3HZ LYS 126 13.353 14.821 3.078 690 HZ2 LYS 126 1HZ LYS 126 12.979 16.380 3.621 691 HZ3 LYS 126 2HZ LYS 126 13.901 16.170 2.218 692 H SER 127 H SER 127 7.898 11.200 4.947 693 HA SER 127 HA SER 127 9.515 12.200 7.203 694 HB2 SER 127 1HB SER 127 7.296 10.152 7.355 695 HB3 SER 127 2HB SER 127 8.072 10.994 8.694 696 HG SER 127 HG SER 127 6.295 12.031 6.752 697 H LYS 128 H LYS 128 10.888 10.731 8.311 698 HA LYS 128 HA LYS 128 12.370 8.986 6.761 699 HB2 LYS 128 1HB LYS 128 12.158 9.569 9.637 700 HB3 LYS 128 2HB LYS 128 12.774 7.963 9.265 701 HG2 LYS 128 1HG LYS 128 14.368 9.193 7.653 702 HG3 LYS 128 2HG LYS 128 13.933 10.632 8.574 703 HD2 LYS 128 1HD LYS 128 15.252 10.046 10.277 704 HD3 LYS 128 2HD LYS 128 14.595 8.408 10.312 705 HE2 LYS 128 1HE LYS 128 16.982 8.348 9.878 706 HE3 LYS 128 2HE LYS 128 16.089 7.778 8.469 707 HZ1 LYS 128 3HZ LYS 128 17.411 9.205 7.381 708 HZ2 LYS 128 1HZ LYS 128 17.785 10.106 8.763 709 HZ3 LYS 128 2HZ LYS 128 16.344 10.397 7.928 710 H GLU 129 H GLU 129 9.776 8.159 9.067 711 HA GLU 129 HA GLU 129 9.880 5.371 8.609 712 HB2 GLU 129 1HB GLU 129 7.831 7.218 9.789 713 HB3 GLU 129 2HB GLU 129 7.429 5.532 9.494 714 HG2 GLU 129 1HG GLU 129 8.974 4.758 11.046 715 HG3 GLU 129 2HG GLU 129 9.878 6.271 11.040 716 H LEU 130 H LEU 130 8.218 8.003 6.972 717 HA LEU 130 HA LEU 130 6.528 6.273 5.420 718 HB2 LEU 130 1HB LEU 130 7.084 9.193 5.501 719 HB3 LEU 130 2HB LEU 130 6.432 8.539 4.013 720 HG LEU 130 HG LEU 130 5.013 7.778 6.499 721 HD11 LEU 130 1HD1 LEU 130 5.192 10.589 5.490 722 HD12 LEU 130 2HD1 LEU 130 5.236 9.991 7.149 723 HD13 LEU 130 3HD1 LEU 130 3.718 9.996 6.253 724 HD21 LEU 130 3HD2 LEU 130 4.038 8.763 3.820 725 HD22 LEU 130 1HD2 LEU 130 3.078 7.992 5.083 726 HD23 LEU 130 2HD2 LEU 130 4.313 7.070 4.227 727 H ILE 131 H ILE 131 9.497 8.131 4.745 728 HA ILE 131 HA ILE 131 9.726 7.405 2.043 729 HB ILE 131 HB ILE 131 11.980 8.007 3.961 730 HG12 ILE 131 1HG1 ILE 131 10.994 10.031 2.024 731 HG13 ILE 131 2HG1 ILE 131 9.957 9.699 3.406 732 HG21 ILE 131 1HG2 ILE 131 12.212 6.961 1.472 733 HG22 ILE 131 2HG2 ILE 131 13.420 7.996 2.234 734 HG23 ILE 131 3HG2 ILE 131 12.245 8.688 1.116 735 HD11 ILE 131 3HD1 ILE 131 12.346 11.273 3.253 736 HD12 ILE 131 1HD1 ILE 131 12.527 9.998 4.457 737 HD13 ILE 131 2HD1 ILE 131 11.179 11.130 4.566 738 H GLU 132 H GLU 132 11.233 5.947 4.938 739 HA GLU 132 HA GLU 132 12.603 3.890 3.670 740 HB2 GLU 132 1HB GLU 132 11.687 4.458 6.386 741 HB3 GLU 132 2HB GLU 132 11.756 2.737 6.036 742 HG2 GLU 132 1HG GLU 132 14.041 2.770 5.664 743 HG3 GLU 132 2HG GLU 132 14.068 4.509 5.377 744 H ALA 133 H ALA 133 9.211 4.163 4.529 745 HA ALA 133 HA ALA 133 8.461 1.481 4.111 746 HB1 ALA 133 3HB ALA 133 6.711 3.884 3.668 747 HB2 ALA 133 1HB ALA 133 7.111 3.255 5.266 748 HB3 ALA 133 2HB ALA 133 6.218 2.251 4.126 749 H TYR 134 H TYR 134 8.194 4.300 1.964 750 HA TYR 134 HA TYR 134 7.310 2.771 -0.258 751 HB2 TYR 134 1HB TYR 134 8.081 5.574 0.212 752 HB3 TYR 134 2HB TYR 134 8.364 4.992 -1.426 753 HD1 TYR 134 HD1 TYR 134 5.685 4.905 1.190 754 HD2 TYR 134 HD2 TYR 134 6.637 5.185 -2.947 755 HE1 TYR 134 HE1 TYR 134 3.303 5.214 0.667 756 HE2 TYR 134 HE2 TYR 134 4.257 5.497 -3.477 757 HH TYR 134 HH TYR 134 1.982 6.341 -1.286 758 H GLU 135 H GLU 135 10.453 3.544 1.030 759 HA GLU 135 HA GLU 135 12.009 2.960 -1.256 760 HB2 GLU 135 1HB GLU 135 12.694 3.981 1.068 761 HB3 GLU 135 2HB GLU 135 12.948 2.300 1.516 762 HG2 GLU 135 1HG GLU 135 14.937 2.332 0.563 763 HG3 GLU 135 2HG GLU 135 14.201 2.724 -0.989 764 H ALA 136 H ALA 136 10.440 1.016 1.199 765 HA ALA 136 HA ALA 136 11.707 -1.457 0.417 766 HB1 ALA 136 3HB ALA 136 9.440 -2.137 1.841 767 HB2 ALA 136 1HB ALA 136 9.897 -0.572 2.511 768 HB3 ALA 136 2HB ALA 136 11.056 -1.901 2.505 769 H SER 137 H SER 137 8.832 0.327 -0.456 770 HA SER 137 HA SER 137 7.623 -1.905 -1.834 771 HB2 SER 137 1HB SER 137 5.835 -0.373 -2.418 772 HB3 SER 137 2HB SER 137 6.217 -0.200 -0.708 773 HG SER 137 HG SER 137 5.971 1.814 -1.822 774 H LYS 138 H LYS 138 9.874 0.575 -2.593 775 HA LYS 138 HA LYS 138 9.412 1.041 -5.290 776 HB2 LYS 138 1HB LYS 138 11.717 1.261 -3.474 777 HB3 LYS 138 2HB LYS 138 12.134 1.087 -5.172 778 HG2 LYS 138 1HG LYS 138 10.068 3.087 -4.411 779 HG3 LYS 138 2HG LYS 138 11.765 3.446 -4.090 780 HD2 LYS 138 1HD LYS 138 11.200 4.352 -6.235 781 HD3 LYS 138 2HD LYS 138 12.255 2.959 -6.486 782 HE2 LYS 138 1HE LYS 138 10.324 1.574 -7.021 783 HE3 LYS 138 2HE LYS 138 9.244 2.932 -6.710 784 HZ1 LYS 138 3HZ LYS 138 10.835 2.340 -9.040 785 HZ2 LYS 138 1HZ LYS 138 10.944 3.952 -8.535 786 HZ3 LYS 138 2HZ LYS 138 9.436 3.279 -8.897 787 H THR 139 H THR 139 10.707 -1.817 -3.764 788 HA THR 139 HA THR 139 12.240 -3.042 -5.639 789 HB THR 139 HB THR 139 10.098 -4.758 -4.528 790 HG1 THR 139 HG1 THR 139 11.961 -3.441 -2.842 791 HG21 THR 139 3HG2 THR 139 11.738 -6.153 -5.147 792 HG22 THR 139 1HG2 THR 139 12.386 -5.749 -3.557 793 HG23 THR 139 2HG2 THR 139 12.997 -4.927 -4.993 794 HA PRO 140 HA PRO 140 9.631 -2.753 -9.335 795 HB2 PRO 140 1HB PRO 140 11.851 -4.539 -10.240 796 HB3 PRO 140 2HB PRO 140 11.133 -3.141 -11.047 797 HG2 PRO 140 1HG PRO 140 13.494 -2.933 -9.845 798 HG3 PRO 140 2HG PRO 140 12.307 -1.619 -9.750 799 HD2 PRO 140 1HD PRO 140 13.094 -3.615 -7.681 800 HD3 PRO 140 2HD PRO 140 12.602 -1.921 -7.489 801 HA PRO 141 HA PRO 141 9.714 -7.810 -9.510 802 HB2 PRO 141 1HB PRO 141 10.150 -7.824 -6.539 803 HB3 PRO 141 2HB PRO 141 10.524 -9.082 -7.729 804 HG2 PRO 141 1HG PRO 141 12.450 -7.519 -6.826 805 HG3 PRO 141 2HG PRO 141 12.373 -7.914 -8.554 806 HD2 PRO 141 1HD PRO 141 11.685 -5.380 -7.156 807 HD3 PRO 141 2HD PRO 141 12.341 -5.628 -8.785 808 H ASP 142 H ASP 142 7.760 -8.842 -9.270 809 HA ASP 142 HA ASP 142 5.535 -7.326 -8.424 810 HB2 ASP 142 1HB ASP 142 5.980 -10.053 -9.494 811 HB3 ASP 142 2HB ASP 142 4.490 -9.813 -8.591 812 H LEU 143 H LEU 143 6.278 -10.584 -7.170 813 HA LEU 143 HA LEU 143 5.382 -9.669 -4.521 814 HB2 LEU 143 1HB LEU 143 5.314 -12.329 -5.903 815 HB3 LEU 143 2HB LEU 143 5.256 -12.247 -4.152 816 HG LEU 143 HG LEU 143 3.310 -10.428 -5.085 817 HD11 LEU 143 1HD1 LEU 143 3.409 -12.976 -6.658 818 HD12 LEU 143 2HD1 LEU 143 3.136 -11.329 -7.224 819 HD13 LEU 143 3HD1 LEU 143 1.877 -12.171 -6.322 820 HD21 LEU 143 3HD2 LEU 143 2.965 -11.523 -3.053 821 HD22 LEU 143 1HD2 LEU 143 3.264 -13.115 -3.751 822 HD23 LEU 143 2HD2 LEU 143 1.774 -12.250 -4.131 823 H LYS 144 H LYS 144 6.479 -10.460 -2.630 824 HA LYS 144 HA LYS 144 9.229 -11.391 -3.072 825 HB2 LYS 144 1HB LYS 144 8.336 -8.921 -1.651 826 HB3 LYS 144 2HB LYS 144 9.720 -9.798 -1.011 827 HG2 LYS 144 1HG LYS 144 11.038 -8.846 -2.508 828 HG3 LYS 144 2HG LYS 144 10.073 -9.530 -3.816 829 HD2 LYS 144 1HD LYS 144 9.334 -6.991 -2.371 830 HD3 LYS 144 2HD LYS 144 10.323 -7.021 -3.833 831 HE2 LYS 144 1HE LYS 144 8.460 -8.253 -4.965 832 HE3 LYS 144 2HE LYS 144 7.478 -7.974 -3.527 833 HZ1 LYS 144 3HZ LYS 144 8.310 -5.499 -4.056 834 HZ2 LYS 144 1HZ LYS 144 6.871 -6.150 -4.663 835 HZ3 LYS 144 2HZ LYS 144 8.258 -6.129 -5.627 836 H GLU 145 H GLU 145 10.146 -12.574 -1.349 837 HA GLU 145 HA GLU 145 10.140 -14.132 0.301 838 HB2 GLU 145 1HB GLU 145 8.698 -11.845 1.369 839 HB3 GLU 145 2HB GLU 145 8.151 -13.346 2.100 840 HG2 GLU 145 1HG GLU 145 11.024 -12.459 1.951 841 HG3 GLU 145 2HG GLU 145 9.973 -12.241 3.348 842 H GLU 146 H GLU 146 8.333 -14.442 -1.993 843 HA GLU 146 HA GLU 146 6.797 -16.662 -0.987 844 HB2 GLU 146 1HB GLU 146 5.342 -14.564 -0.729 845 HB3 GLU 146 2HB GLU 146 5.277 -14.533 -2.485 846 HG2 GLU 146 1HG GLU 146 4.425 -16.930 -2.329 847 HG3 GLU 146 2HG GLU 146 4.188 -16.606 -0.613 848 H SER 147 H SER 147 6.609 -14.583 -3.889 849 HA SER 147 HA SER 147 6.980 -14.985 -6.096 850 HB2 SER 147 1HB SER 147 8.599 -17.419 -5.372 851 HB3 SER 147 2HB SER 147 8.816 -16.311 -6.726 852 HG SER 147 HG SER 147 9.673 -16.103 -4.104 853 H SER 148 H SER 148 6.692 -16.649 -7.873 854 HA SER 148 HA SER 148 4.920 -18.845 -7.110 855 HB2 SER 148 1HB SER 148 3.295 -18.197 -8.876 856 HB3 SER 148 2HB SER 148 3.405 -16.998 -7.587 857 HG SER 148 HG SER 148 3.509 -16.348 -9.966 858 H THR 149 H THR 149 7.664 -18.762 -8.088 859 HA THR 149 HA THR 149 7.362 -20.006 -10.743 860 HB THR 149 HB THR 149 10.086 -19.363 -9.815 861 HG1 THR 149 HG1 THR 149 8.257 -17.269 -10.386 862 HG21 THR 149 3HG2 THR 149 10.542 -19.013 -11.981 863 HG22 THR 149 1HG2 THR 149 9.016 -18.186 -12.287 864 HG23 THR 149 2HG2 THR 149 9.065 -19.947 -12.221 865 H ASP 150 H ASP 150 9.657 -21.486 -10.902 866 HA ASP 150 HA ASP 150 10.638 -23.452 -10.333 867 HB2 ASP 150 1HB ASP 150 9.845 -22.489 -7.596 868 HB3 ASP 150 2HB ASP 150 10.610 -24.055 -7.824 869 H LEU 151 H LEU 151 9.348 -24.836 -11.464 870 HA LEU 151 HA LEU 151 7.452 -26.404 -9.896 871 HB2 LEU 151 1HB LEU 151 6.211 -24.554 -11.101 872 HB3 LEU 151 2HB LEU 151 6.694 -25.312 -12.605 873 HG LEU 151 HG LEU 151 5.530 -27.410 -11.289 874 HD11 LEU 151 1HD1 LEU 151 4.530 -26.444 -9.487 875 HD12 LEU 151 2HD1 LEU 151 3.256 -26.198 -10.682 876 HD13 LEU 151 3HD1 LEU 151 4.354 -24.877 -10.279 877 HD21 LEU 151 3HD2 LEU 151 4.899 -27.218 -13.463 878 HD22 LEU 151 1HD2 LEU 151 4.684 -25.471 -13.366 879 HD23 LEU 151 2HD2 LEU 151 3.452 -26.548 -12.711 880 H GLU 152 H GLU 152 9.997 -27.163 -10.647 881 HA GLU 152 HA GLU 152 9.474 -29.163 -12.749 882 HB2 GLU 152 1HB GLU 152 11.873 -27.446 -12.267 883 HB3 GLU 152 2HB GLU 152 12.105 -29.052 -12.940 884 HG2 GLU 152 1HG GLU 152 11.067 -28.531 -14.912 885 HG3 GLU 152 2HG GLU 152 10.094 -27.250 -14.190 Start of MODEL 4 1 H1 SER 45 1H SER 45 -10.953 3.348 -19.868 2 H2 SER 45 2H SER 45 -9.794 2.258 -19.224 3 H3 SER 45 3H SER 45 -10.624 3.342 -18.185 4 HA SER 45 HA SER 45 -12.622 2.244 -18.429 5 HB2 SER 45 1HB SER 45 -11.414 0.352 -20.437 6 HB3 SER 45 2HB SER 45 -13.116 0.700 -20.129 7 HG SER 45 HG SER 45 -11.703 1.730 -22.008 8 H ALA 46 H ALA 46 -12.667 1.249 -16.531 9 HA ALA 46 HA ALA 46 -12.323 -0.232 -14.849 10 HB1 ALA 46 3HB ALA 46 -12.809 -2.146 -15.925 11 HB2 ALA 46 1HB ALA 46 -11.082 -2.448 -15.739 12 HB3 ALA 46 2HB ALA 46 -11.705 -1.806 -17.259 13 H ASP 47 H ASP 47 -10.898 0.882 -13.585 14 HA ASP 47 HA ASP 47 -8.045 0.247 -13.964 15 HB2 ASP 47 1HB ASP 47 -9.375 2.820 -13.606 16 HB3 ASP 47 2HB ASP 47 -8.093 2.557 -12.428 17 H ASP 48 H ASP 48 -10.038 -1.239 -12.402 18 HA ASP 48 HA ASP 48 -8.875 -0.885 -9.713 19 HB2 ASP 48 1HB ASP 48 -11.666 -1.485 -10.585 20 HB3 ASP 48 2HB ASP 48 -11.089 -2.239 -9.103 21 H ARG 49 H ARG 49 -7.737 -2.442 -11.863 22 HA ARG 49 HA ARG 49 -8.313 -5.214 -11.325 23 HB2 ARG 49 1HB ARG 49 -7.320 -3.918 -13.491 24 HB3 ARG 49 2HB ARG 49 -5.831 -4.521 -12.776 25 HG2 ARG 49 1HG ARG 49 -6.233 -6.593 -13.469 26 HG3 ARG 49 2HG ARG 49 -7.887 -6.558 -12.859 27 HD2 ARG 49 1HD ARG 49 -7.384 -4.950 -15.276 28 HD3 ARG 49 2HD ARG 49 -7.233 -6.695 -15.479 29 HE ARG 49 HE ARG 49 -9.591 -6.421 -14.172 30 HH11 ARG 49 1HH1 ARG 49 -8.300 -4.995 -17.100 31 HH12 ARG 49 2HH1 ARG 49 -9.851 -4.823 -17.846 32 HH21 ARG 49 1HH2 ARG 49 -11.636 -6.190 -15.167 33 HH22 ARG 49 2HH2 ARG 49 -11.743 -5.501 -16.751 34 H LEU 50 H LEU 50 -7.881 -5.448 -9.124 35 HA LEU 50 HA LEU 50 -5.052 -5.203 -8.335 36 HB2 LEU 50 1HB LEU 50 -7.617 -4.883 -6.832 37 HB3 LEU 50 2HB LEU 50 -6.191 -5.424 -5.970 38 HG LEU 50 HG LEU 50 -5.001 -3.377 -6.681 39 HD11 LEU 50 1HD1 LEU 50 -5.869 -2.537 -8.605 40 HD12 LEU 50 2HD1 LEU 50 -6.758 -1.541 -7.453 41 HD13 LEU 50 3HD1 LEU 50 -7.527 -2.955 -8.174 42 HD21 LEU 50 3HD2 LEU 50 -6.062 -1.906 -5.141 43 HD22 LEU 50 1HD2 LEU 50 -6.288 -3.549 -4.536 44 HD23 LEU 50 2HD2 LEU 50 -7.616 -2.716 -5.344 45 H ASN 51 H ASN 51 -4.147 -7.158 -8.720 46 HA ASN 51 HA ASN 51 -5.554 -9.551 -7.720 47 HB2 ASN 51 1HB ASN 51 -4.627 -9.099 -10.258 48 HB3 ASN 51 2HB ASN 51 -3.282 -9.980 -9.540 49 HD21 ASN 51 2HD2 ASN 51 -6.743 -10.098 -10.181 50 HD22 ASN 51 1HD2 ASN 51 -6.865 -11.830 -10.180 51 H PHE 52 H PHE 52 -3.540 -11.375 -7.594 52 HA PHE 52 HA PHE 52 -2.250 -10.708 -5.152 53 HB2 PHE 52 1HB PHE 52 -1.440 -13.019 -6.912 54 HB3 PHE 52 2HB PHE 52 -1.359 -12.900 -5.155 55 HD1 PHE 52 HD1 PHE 52 -4.132 -11.863 -4.634 56 HD2 PHE 52 HD2 PHE 52 -2.709 -14.958 -7.190 57 HE1 PHE 52 HE1 PHE 52 -6.307 -12.997 -4.470 58 HE2 PHE 52 HE2 PHE 52 -4.883 -16.096 -7.027 59 HZ PHE 52 HZ PHE 52 -6.687 -15.115 -5.667 60 H GLY 53 H GLY 53 -0.118 -10.242 -4.689 61 HA2 GLY 53 1HA GLY 53 2.028 -9.493 -5.039 62 HA3 GLY 53 2HA GLY 53 1.975 -10.276 -6.610 63 H ASP 54 H ASP 54 -0.365 -7.851 -5.664 64 HA ASP 54 HA ASP 54 0.786 -6.027 -7.662 65 HB2 ASP 54 1HB ASP 54 -1.631 -7.074 -7.854 66 HB3 ASP 54 2HB ASP 54 -2.045 -5.795 -6.719 67 H ARG 55 H ARG 55 1.682 -4.247 -6.909 68 HA ARG 55 HA ARG 55 1.536 -3.482 -4.174 69 HB2 ARG 55 1HB ARG 55 2.638 -1.943 -6.534 70 HB3 ARG 55 2HB ARG 55 2.932 -1.574 -4.842 71 HG2 ARG 55 1HG ARG 55 4.650 -2.969 -4.790 72 HG3 ARG 55 2HG ARG 55 3.639 -4.298 -5.357 73 HD2 ARG 55 1HD ARG 55 4.364 -2.382 -7.448 74 HD3 ARG 55 2HD ARG 55 5.745 -3.203 -6.724 75 HE ARG 55 HE ARG 55 4.920 -5.252 -7.506 76 HH11 ARG 55 1HH1 ARG 55 2.857 -2.579 -8.465 77 HH12 ARG 55 2HH1 ARG 55 2.030 -3.494 -9.678 78 HH21 ARG 55 1HH2 ARG 55 3.805 -6.451 -9.099 79 HH22 ARG 55 2HH2 ARG 55 2.570 -5.688 -10.039 80 H ILE 56 H ILE 56 -0.138 -2.498 -3.275 81 HA ILE 56 HA ILE 56 -1.563 -0.436 -4.826 82 HB ILE 56 HB ILE 56 -3.631 -1.085 -3.527 83 HG12 ILE 56 1HG1 ILE 56 -2.015 -3.595 -3.001 84 HG13 ILE 56 2HG1 ILE 56 -2.496 -2.419 -1.783 85 HG21 ILE 56 1HG2 ILE 56 -3.909 -1.733 -5.670 86 HG22 ILE 56 2HG2 ILE 56 -3.751 -3.348 -4.979 87 HG23 ILE 56 3HG2 ILE 56 -2.359 -2.573 -5.732 88 HD11 ILE 56 3HD1 ILE 56 -4.786 -3.332 -3.252 89 HD12 ILE 56 1HD1 ILE 56 -4.452 -3.413 -1.523 90 HD13 ILE 56 2HD1 ILE 56 -3.881 -4.693 -2.592 91 H LEU 57 H LEU 57 -2.735 1.152 -3.475 92 HA LEU 57 HA LEU 57 -1.203 1.725 -1.027 93 HB2 LEU 57 1HB LEU 57 -1.431 3.296 -3.193 94 HB3 LEU 57 2HB LEU 57 -2.836 3.845 -2.296 95 HG LEU 57 HG LEU 57 -1.338 4.293 -0.343 96 HD11 LEU 57 1HD1 LEU 57 0.916 3.963 -2.300 97 HD12 LEU 57 2HD1 LEU 57 0.439 2.699 -1.170 98 HD13 LEU 57 3HD1 LEU 57 1.009 4.253 -0.564 99 HD21 LEU 57 3HD2 LEU 57 -1.962 5.896 -2.379 100 HD22 LEU 57 1HD2 LEU 57 -0.210 5.875 -2.582 101 HD23 LEU 57 2HD2 LEU 57 -0.913 6.408 -1.057 102 H VAL 58 H VAL 58 -2.210 1.553 0.851 103 HA VAL 58 HA VAL 58 -5.150 1.778 0.898 104 HB VAL 58 HB VAL 58 -4.495 -0.512 1.341 105 HG11 VAL 58 1HG1 VAL 58 -2.434 -0.780 2.181 106 HG12 VAL 58 2HG1 VAL 58 -3.240 -0.654 3.743 107 HG13 VAL 58 3HG1 VAL 58 -2.468 0.762 3.034 108 HG21 VAL 58 3HG2 VAL 58 -6.423 0.257 2.540 109 HG22 VAL 58 1HG2 VAL 58 -5.415 0.954 3.809 110 HG23 VAL 58 2HG2 VAL 58 -5.488 -0.796 3.602 111 H LYS 59 H LYS 59 -6.103 2.985 2.497 112 HA LYS 59 HA LYS 59 -4.272 4.643 4.092 113 HB2 LYS 59 1HB LYS 59 -6.185 6.219 4.278 114 HB3 LYS 59 2HB LYS 59 -5.656 5.952 2.624 115 HG2 LYS 59 1HG LYS 59 -7.726 5.425 2.060 116 HG3 LYS 59 2HG LYS 59 -7.677 4.053 3.169 117 HD2 LYS 59 1HD LYS 59 -8.138 5.986 4.942 118 HD3 LYS 59 2HD LYS 59 -8.856 6.752 3.523 119 HE2 LYS 59 1HE LYS 59 -10.181 4.656 3.169 120 HE3 LYS 59 2HE LYS 59 -9.572 4.079 4.720 121 HZ1 LYS 59 3HZ LYS 59 -10.995 6.662 4.468 122 HZ2 LYS 59 1HZ LYS 59 -10.717 5.745 5.865 123 HZ3 LYS 59 2HZ LYS 59 -11.826 5.208 4.705 124 H ALA 60 H ALA 60 -4.372 4.708 6.271 125 HA ALA 60 HA ALA 60 -6.180 2.800 7.575 126 HB1 ALA 60 3HB ALA 60 -4.631 2.626 9.310 127 HB2 ALA 60 1HB ALA 60 -3.873 4.169 8.916 128 HB3 ALA 60 2HB ALA 60 -3.625 2.773 7.868 129 HA PRO 61 HA PRO 61 -8.813 5.880 9.351 130 HB2 PRO 61 1HB PRO 61 -8.562 4.314 11.874 131 HB3 PRO 61 2HB PRO 61 -10.013 4.822 11.003 132 HG2 PRO 61 1HG PRO 61 -9.201 2.295 10.900 133 HG3 PRO 61 2HG PRO 61 -9.856 3.096 9.459 134 HD2 PRO 61 1HD PRO 61 -7.013 2.482 10.162 135 HD3 PRO 61 2HD PRO 61 -7.827 2.412 8.586 136 H GLY 62 H GLY 62 -7.801 7.796 9.650 137 HA2 GLY 62 1HA GLY 62 -7.105 9.448 11.214 138 HA3 GLY 62 2HA GLY 62 -6.389 8.180 12.193 139 H TYR 63 H TYR 63 -5.017 6.926 9.913 140 HA TYR 63 HA TYR 63 -2.827 8.871 9.680 141 HB2 TYR 63 1HB TYR 63 -2.838 5.854 9.452 142 HB3 TYR 63 2HB TYR 63 -1.419 6.860 9.188 143 HD1 TYR 63 HD2 TYR 63 -3.859 5.732 11.731 144 HD2 TYR 63 HD1 TYR 63 -0.157 7.709 11.019 145 HE1 TYR 63 HE2 TYR 63 -3.353 5.642 14.136 146 HE2 TYR 63 HE1 TYR 63 0.358 7.620 13.421 147 HH TYR 63 HH TYR 63 -1.511 7.364 15.700 148 HA PRO 64 HA PRO 64 -3.235 9.248 5.299 149 HB2 PRO 64 1HB PRO 64 -0.637 9.263 4.460 150 HB3 PRO 64 2HB PRO 64 -1.407 10.630 5.272 151 HG2 PRO 64 1HG PRO 64 0.392 8.523 6.399 152 HG3 PRO 64 2HG PRO 64 0.381 10.267 6.707 153 HD2 PRO 64 1HD PRO 64 -0.700 8.486 8.426 154 HD3 PRO 64 2HD PRO 64 -1.362 10.118 8.210 155 H TRP 65 H TRP 65 -1.894 8.274 3.184 156 HA TRP 65 HA TRP 65 -2.630 5.488 3.195 157 HB2 TRP 65 1HB TRP 65 -1.311 7.061 0.972 158 HB3 TRP 65 2HB TRP 65 -2.150 5.523 0.822 159 HD1 TRP 65 HD1 TRP 65 -2.942 9.216 1.677 160 HE1 TRP 65 HE1 TRP 65 -5.361 9.699 0.952 161 HE3 TRP 65 HE3 TRP 65 -4.291 4.519 0.171 162 HZ2 TRP 65 HZ2 TRP 65 -7.553 8.279 -0.121 163 HZ3 TRP 65 HZ3 TRP 65 -6.568 4.168 -0.694 164 HH2 TRP 65 HH2 TRP 65 -8.164 6.010 -0.834 165 H TRP 66 H TRP 66 -1.258 3.716 2.707 166 HA TRP 66 HA TRP 66 1.623 4.206 3.011 167 HB2 TRP 66 1HB TRP 66 0.342 3.384 5.146 168 HB3 TRP 66 2HB TRP 66 0.378 1.821 4.333 169 HD1 TRP 66 HD1 TRP 66 2.594 0.471 4.433 170 HE1 TRP 66 HE1 TRP 66 4.911 0.885 5.468 171 HE3 TRP 66 HE3 TRP 66 2.060 5.404 5.676 172 HZ2 TRP 66 HZ2 TRP 66 6.325 3.016 6.654 173 HZ3 TRP 66 HZ3 TRP 66 3.951 6.555 6.752 174 HH2 TRP 66 HH2 TRP 66 6.040 5.382 7.221 175 HA PRO 67 HA PRO 67 1.920 1.515 -0.498 176 HB2 PRO 67 1HB PRO 67 4.540 0.836 -0.322 177 HB3 PRO 67 2HB PRO 67 3.999 2.434 -0.847 178 HG2 PRO 67 1HG PRO 67 4.972 1.552 1.844 179 HG3 PRO 67 2HG PRO 67 5.366 3.025 0.941 180 HD2 PRO 67 1HD PRO 67 3.562 2.994 2.954 181 HD3 PRO 67 2HD PRO 67 3.412 4.078 1.562 182 H ALA 68 H ALA 68 0.783 -0.337 -0.226 183 HA ALA 68 HA ALA 68 2.077 -2.523 1.279 184 HB1 ALA 68 3HB ALA 68 0.065 -1.705 2.429 185 HB2 ALA 68 1HB ALA 68 -0.123 -3.367 1.870 186 HB3 ALA 68 2HB ALA 68 -0.891 -2.048 0.986 187 H LEU 69 H LEU 69 1.276 -4.739 0.493 188 HA LEU 69 HA LEU 69 0.831 -4.677 -2.421 189 HB2 LEU 69 1HB LEU 69 2.990 -5.949 -0.873 190 HB3 LEU 69 2HB LEU 69 2.245 -6.982 -2.078 191 HG LEU 69 HG LEU 69 2.716 -5.236 -3.796 192 HD11 LEU 69 1HD1 LEU 69 3.019 -3.194 -2.881 193 HD12 LEU 69 2HD1 LEU 69 4.706 -3.707 -2.865 194 HD13 LEU 69 3HD1 LEU 69 3.730 -3.840 -1.402 195 HD21 LEU 69 3HD2 LEU 69 5.134 -6.235 -2.296 196 HD22 LEU 69 1HD2 LEU 69 5.081 -5.735 -3.987 197 HD23 LEU 69 2HD2 LEU 69 4.195 -7.166 -3.463 198 H LEU 70 H LEU 70 -0.823 -5.866 -3.115 199 HA LEU 70 HA LEU 70 -2.528 -7.234 -1.328 200 HB2 LEU 70 1HB LEU 70 -2.833 -6.213 -3.805 201 HB3 LEU 70 2HB LEU 70 -2.691 -7.915 -4.200 202 HG LEU 70 HG LEU 70 -4.605 -7.149 -2.053 203 HD11 LEU 70 1HD1 LEU 70 -5.902 -7.138 -4.621 204 HD12 LEU 70 2HD1 LEU 70 -4.686 -5.864 -4.531 205 HD13 LEU 70 3HD1 LEU 70 -5.967 -5.947 -3.323 206 HD21 LEU 70 3HD2 LEU 70 -3.980 -9.512 -3.021 207 HD22 LEU 70 1HD2 LEU 70 -5.130 -9.060 -4.278 208 HD23 LEU 70 2HD2 LEU 70 -5.645 -9.120 -2.592 209 H LEU 71 H LEU 71 -2.500 -9.245 -0.580 210 HA LEU 71 HA LEU 71 -0.609 -11.140 -1.767 211 HB2 LEU 71 1HB LEU 71 -0.117 -11.844 0.294 212 HB3 LEU 71 2HB LEU 71 -0.899 -10.370 0.824 213 HG LEU 71 HG LEU 71 -3.054 -11.895 0.856 214 HD11 LEU 71 1HD1 LEU 71 -1.606 -13.803 -0.113 215 HD12 LEU 71 2HD1 LEU 71 -2.723 -14.166 1.203 216 HD13 LEU 71 3HD1 LEU 71 -1.002 -13.966 1.536 217 HD21 LEU 71 3HD2 LEU 71 -2.610 -12.369 3.207 218 HD22 LEU 71 1HD2 LEU 71 -2.083 -10.741 2.779 219 HD23 LEU 71 2HD2 LEU 71 -0.896 -12.033 2.960 220 H ARG 72 H ARG 72 -3.993 -10.883 -0.695 221 HA ARG 72 HA ARG 72 -4.838 -12.732 -2.701 222 HB2 ARG 72 1HB ARG 72 -4.281 -13.736 -0.027 223 HB3 ARG 72 2HB ARG 72 -5.942 -14.034 -0.513 224 HG2 ARG 72 1HG ARG 72 -4.131 -14.678 -2.656 225 HG3 ARG 72 2HG ARG 72 -3.688 -15.529 -1.176 226 HD2 ARG 72 1HD ARG 72 -6.065 -16.268 -0.979 227 HD3 ARG 72 2HD ARG 72 -6.365 -15.556 -2.563 228 HE ARG 72 HE ARG 72 -4.290 -17.210 -3.040 229 HH11 ARG 72 1HH1 ARG 72 -7.395 -17.700 -1.491 230 HH12 ARG 72 2HH1 ARG 72 -7.489 -19.371 -1.933 231 HH21 ARG 72 1HH2 ARG 72 -4.424 -19.412 -3.619 232 HH22 ARG 72 2HH2 ARG 72 -5.801 -20.342 -3.141 233 H ARG 73 H ARG 73 -7.168 -13.057 -2.742 234 HA ARG 73 HA ARG 73 -8.596 -10.787 -1.529 235 HB2 ARG 73 1HB ARG 73 -8.519 -11.095 -4.082 236 HB3 ARG 73 2HB ARG 73 -9.588 -12.467 -3.829 237 HG2 ARG 73 1HG ARG 73 -10.489 -10.025 -2.503 238 HG3 ARG 73 2HG ARG 73 -10.384 -9.890 -4.258 239 HD2 ARG 73 1HD ARG 73 -11.778 -12.169 -2.870 240 HD3 ARG 73 2HD ARG 73 -12.602 -10.679 -3.323 241 HE ARG 73 HE ARG 73 -11.801 -12.819 -5.065 242 HH11 ARG 73 1HH1 ARG 73 -12.554 -9.403 -4.903 243 HH12 ARG 73 2HH1 ARG 73 -12.979 -9.288 -6.576 244 HH21 ARG 73 1HH2 ARG 73 -12.364 -12.661 -7.275 245 HH22 ARG 73 2HH2 ARG 73 -12.871 -11.138 -7.923 246 H LYS 74 H LYS 74 -9.689 -11.337 0.246 247 HA LYS 74 HA LYS 74 -10.882 -14.022 0.373 248 HB2 LYS 74 1HB LYS 74 -10.922 -13.503 2.901 249 HB3 LYS 74 2HB LYS 74 -9.390 -13.928 2.150 250 HG2 LYS 74 1HG LYS 74 -8.630 -11.705 2.194 251 HG3 LYS 74 2HG LYS 74 -10.241 -11.078 2.551 252 HD2 LYS 74 1HD LYS 74 -9.929 -12.697 4.658 253 HD3 LYS 74 2HD LYS 74 -8.237 -12.310 4.346 254 HE2 LYS 74 1HE LYS 74 -8.478 -10.151 4.968 255 HE3 LYS 74 2HE LYS 74 -10.107 -10.031 4.305 256 HZ1 LYS 74 3HZ LYS 74 -10.588 -9.961 6.506 257 HZ2 LYS 74 1HZ LYS 74 -9.238 -10.868 6.965 258 HZ3 LYS 74 2HZ LYS 74 -10.597 -11.641 6.324 259 H GLU 75 H GLU 75 -13.013 -14.238 0.529 260 HA GLU 75 HA GLU 75 -14.630 -11.825 1.020 261 HB2 GLU 75 1HB GLU 75 -14.588 -13.293 -1.270 262 HB3 GLU 75 2HB GLU 75 -15.884 -14.092 -0.394 263 HG2 GLU 75 1HG GLU 75 -16.602 -11.533 -0.037 264 HG3 GLU 75 2HG GLU 75 -15.773 -11.402 -1.588 265 H THR 76 H THR 76 -15.340 -11.944 3.084 266 HA THR 76 HA THR 76 -16.315 -14.547 4.050 267 HB THR 76 HB THR 76 -14.495 -13.597 5.391 268 HG1 THR 76 HG1 THR 76 -15.867 -14.784 6.600 269 HG21 THR 76 3HG2 THR 76 -16.242 -11.207 5.468 270 HG22 THR 76 1HG2 THR 76 -14.484 -11.331 5.394 271 HG23 THR 76 2HG2 THR 76 -15.326 -11.618 6.917 272 H LYS 77 H LYS 77 -18.335 -14.752 4.953 273 HA LYS 77 HA LYS 77 -20.085 -12.406 4.993 274 HB2 LYS 77 1HB LYS 77 -21.866 -13.776 3.829 275 HB3 LYS 77 2HB LYS 77 -20.521 -13.266 2.821 276 HG2 LYS 77 1HG LYS 77 -19.924 -15.819 3.950 277 HG3 LYS 77 2HG LYS 77 -21.520 -15.867 3.203 278 HD2 LYS 77 1HD LYS 77 -20.318 -16.302 1.335 279 HD3 LYS 77 2HD LYS 77 -20.161 -14.545 1.292 280 HE2 LYS 77 1HE LYS 77 -17.988 -15.425 0.966 281 HE3 LYS 77 2HE LYS 77 -18.038 -14.813 2.617 282 HZ1 LYS 77 3HZ LYS 77 -18.118 -17.632 1.712 283 HZ2 LYS 77 1HZ LYS 77 -18.573 -17.180 3.280 284 HZ3 LYS 77 2HZ LYS 77 -16.997 -16.892 2.739 285 H ASP 78 H ASP 78 -22.423 -13.311 5.774 286 HA ASP 78 HA ASP 78 -22.035 -14.152 8.437 287 HB2 ASP 78 1HB ASP 78 -24.249 -13.298 6.780 288 HB3 ASP 78 2HB ASP 78 -24.725 -14.664 7.779 289 H SER 79 H SER 79 -24.042 -15.855 6.042 290 HA SER 79 HA SER 79 -22.772 -18.291 5.953 291 HB2 SER 79 1HB SER 79 -24.178 -17.892 8.493 292 HB3 SER 79 2HB SER 79 -24.708 -19.341 7.639 293 HG SER 79 HG SER 79 -22.793 -20.225 7.917 294 H LEU 80 H LEU 80 -26.171 -17.817 6.908 295 HA LEU 80 HA LEU 80 -27.070 -17.906 4.168 296 HB2 LEU 80 1HB LEU 80 -28.521 -19.920 4.580 297 HB3 LEU 80 2HB LEU 80 -26.807 -20.233 4.401 298 HG LEU 80 HG LEU 80 -26.900 -20.065 7.072 299 HD11 LEU 80 1HD1 LEU 80 -29.227 -19.609 7.298 300 HD12 LEU 80 2HD1 LEU 80 -28.955 -21.270 7.825 301 HD13 LEU 80 3HD1 LEU 80 -29.653 -20.953 6.237 302 HD21 LEU 80 3HD2 LEU 80 -27.219 -22.287 5.146 303 HD22 LEU 80 1HD2 LEU 80 -27.513 -22.654 6.844 304 HD23 LEU 80 2HD2 LEU 80 -25.957 -21.993 6.342 305 H ASN 81 H ASN 81 -27.301 -16.158 6.535 306 HA ASN 81 HA ASN 81 -30.030 -16.337 7.430 307 HB2 ASN 81 1HB ASN 81 -27.698 -14.597 7.996 308 HB3 ASN 81 2HB ASN 81 -29.288 -13.883 8.241 309 HD21 ASN 81 2HD2 ASN 81 -27.349 -16.733 9.044 310 HD22 ASN 81 1HD2 ASN 81 -28.048 -16.975 10.613 311 H THR 82 H THR 82 -28.582 -15.146 4.624 312 HA THR 82 HA THR 82 -29.235 -13.773 2.940 313 HB THR 82 HB THR 82 -31.474 -13.953 2.237 314 HG1 THR 82 HG1 THR 82 -32.707 -13.213 3.835 315 HG21 THR 82 3HG2 THR 82 -30.809 -16.350 3.908 316 HG22 THR 82 1HG2 THR 82 -30.642 -16.141 2.165 317 HG23 THR 82 2HG2 THR 82 -32.245 -16.260 2.890 318 H ASN 83 H ASN 83 -28.495 -12.422 5.312 319 HA ASN 83 HA ASN 83 -30.338 -10.125 5.369 320 HB2 ASN 83 1HB ASN 83 -28.645 -11.428 7.398 321 HB3 ASN 83 2HB ASN 83 -28.565 -9.672 7.407 322 HD21 ASN 83 2HD2 ASN 83 -29.731 -9.082 9.103 323 HD22 ASN 83 1HD2 ASN 83 -31.369 -9.570 9.413 324 H SER 84 H SER 84 -28.023 -10.860 3.437 325 HA SER 84 HA SER 84 -26.366 -9.827 2.290 326 HB2 SER 84 1HB SER 84 -28.224 -8.219 1.900 327 HB3 SER 84 2HB SER 84 -27.673 -7.291 3.294 328 HG SER 84 HG SER 84 -25.857 -6.726 2.218 329 H SER 85 H SER 85 -25.178 -10.776 4.360 330 HA SER 85 HA SER 85 -23.719 -8.568 5.645 331 HB2 SER 85 1HB SER 85 -24.981 -10.609 6.909 332 HB3 SER 85 2HB SER 85 -23.371 -11.304 6.723 333 HG SER 85 HG SER 85 -24.092 -9.686 8.583 334 H PHE 86 H PHE 86 -22.601 -8.485 3.489 335 HA PHE 86 HA PHE 86 -20.543 -10.561 3.212 336 HB2 PHE 86 1HB PHE 86 -21.925 -8.753 1.318 337 HB3 PHE 86 2HB PHE 86 -20.212 -9.014 1.010 338 HD1 PHE 86 HD1 PHE 86 -23.104 -11.154 2.045 339 HD2 PHE 86 HD2 PHE 86 -19.802 -10.596 -0.582 340 HE1 PHE 86 HE1 PHE 86 -23.634 -13.282 0.930 341 HE2 PHE 86 HE2 PHE 86 -20.328 -12.721 -1.700 342 HZ PHE 86 HZ PHE 86 -22.246 -14.066 -0.947 343 H ASN 87 H ASN 87 -18.508 -10.148 3.789 344 HA ASN 87 HA ASN 87 -17.633 -7.349 3.975 345 HB2 ASN 87 1HB ASN 87 -17.147 -9.567 5.976 346 HB3 ASN 87 2HB ASN 87 -16.282 -8.035 5.988 347 HD21 ASN 87 2HD2 ASN 87 -17.012 -6.772 7.533 348 HD22 ASN 87 1HD2 ASN 87 -18.675 -6.575 7.993 349 H VAL 88 H VAL 88 -16.736 -7.738 1.889 350 HA VAL 88 HA VAL 88 -14.525 -9.635 1.723 351 HB VAL 88 HB VAL 88 -15.895 -9.667 -0.211 352 HG11 VAL 88 1HG1 VAL 88 -15.618 -6.677 -0.215 353 HG12 VAL 88 2HG1 VAL 88 -17.091 -7.643 -0.138 354 HG13 VAL 88 3HG1 VAL 88 -16.154 -7.580 -1.631 355 HG21 VAL 88 3HG2 VAL 88 -13.451 -8.059 -0.935 356 HG22 VAL 88 1HG2 VAL 88 -14.337 -9.172 -1.977 357 HG23 VAL 88 2HG2 VAL 88 -13.450 -9.787 -0.581 358 H LEU 89 H LEU 89 -12.446 -9.107 1.814 359 HA LEU 89 HA LEU 89 -11.668 -6.279 1.614 360 HB2 LEU 89 1HB LEU 89 -10.353 -8.046 3.641 361 HB3 LEU 89 2HB LEU 89 -10.398 -6.299 3.565 362 HG LEU 89 HG LEU 89 -12.815 -7.978 4.212 363 HD11 LEU 89 1HD1 LEU 89 -11.307 -6.475 6.293 364 HD12 LEU 89 2HD1 LEU 89 -10.723 -8.063 5.797 365 HD13 LEU 89 3HD1 LEU 89 -12.351 -7.889 6.451 366 HD21 LEU 89 3HD2 LEU 89 -12.431 -5.149 5.049 367 HD22 LEU 89 1HD2 LEU 89 -13.912 -6.024 4.659 368 HD23 LEU 89 2HD2 LEU 89 -12.847 -5.477 3.367 369 H TYR 90 H TYR 90 -9.123 -6.202 1.735 370 HA TYR 90 HA TYR 90 -8.076 -8.285 -0.070 371 HB2 TYR 90 1HB TYR 90 -8.052 -5.340 -0.260 372 HB3 TYR 90 2HB TYR 90 -6.506 -6.112 -0.594 373 HD1 TYR 90 HD2 TYR 90 -7.512 -8.646 -1.846 374 HD2 TYR 90 HD1 TYR 90 -8.675 -4.593 -2.411 375 HE1 TYR 90 HE2 TYR 90 -8.260 -9.185 -4.113 376 HE2 TYR 90 HE1 TYR 90 -9.427 -5.124 -4.692 377 HH TYR 90 HH TYR 90 -10.250 -7.699 -5.804 378 H LYS 91 H LYS 91 -6.611 -9.488 0.980 379 HA LYS 91 HA LYS 91 -5.290 -8.587 3.351 380 HB2 LYS 91 1HB LYS 91 -4.776 -11.031 1.637 381 HB3 LYS 91 2HB LYS 91 -4.073 -10.744 3.220 382 HG2 LYS 91 1HG LYS 91 -6.534 -10.574 4.013 383 HG3 LYS 91 2HG LYS 91 -6.896 -11.404 2.499 384 HD2 LYS 91 1HD LYS 91 -4.712 -12.562 4.115 385 HD3 LYS 91 2HD LYS 91 -6.330 -12.675 4.810 386 HE2 LYS 91 1HE LYS 91 -6.664 -13.380 2.140 387 HE3 LYS 91 2HE LYS 91 -5.148 -14.148 2.612 388 HZ1 LYS 91 3HZ LYS 91 -6.215 -15.330 4.323 389 HZ2 LYS 91 1HZ LYS 91 -7.235 -15.480 2.981 390 HZ3 LYS 91 2HZ LYS 91 -7.624 -14.399 4.222 391 H VAL 92 H VAL 92 -4.011 -6.818 2.943 392 HA VAL 92 HA VAL 92 -1.915 -7.111 0.898 393 HB VAL 92 HB VAL 92 -1.685 -4.734 0.858 394 HG11 VAL 92 1HG1 VAL 92 -3.385 -5.185 -0.591 395 HG12 VAL 92 2HG1 VAL 92 -4.212 -4.087 0.512 396 HG13 VAL 92 3HG1 VAL 92 -4.443 -5.828 0.663 397 HG21 VAL 92 3HG2 VAL 92 -3.553 -4.708 3.225 398 HG22 VAL 92 1HG2 VAL 92 -3.129 -3.273 2.293 399 HG23 VAL 92 2HG2 VAL 92 -1.877 -4.157 3.168 400 H LEU 93 H LEU 93 0.242 -6.648 1.372 401 HA LEU 93 HA LEU 93 0.941 -6.891 4.217 402 HB2 LEU 93 1HB LEU 93 2.260 -7.679 1.662 403 HB3 LEU 93 2HB LEU 93 3.285 -7.285 3.028 404 HG LEU 93 HG LEU 93 1.077 -9.262 3.408 405 HD11 LEU 93 1HD1 LEU 93 3.077 -10.929 2.847 406 HD12 LEU 93 2HD1 LEU 93 3.489 -9.630 1.730 407 HD13 LEU 93 3HD1 LEU 93 1.909 -10.406 1.634 408 HD21 LEU 93 3HD2 LEU 93 3.861 -9.365 4.505 409 HD22 LEU 93 1HD2 LEU 93 2.371 -10.032 5.171 410 HD23 LEU 93 2HD2 LEU 93 2.652 -8.293 5.212 411 H PHE 94 H PHE 94 2.006 -5.278 5.273 412 HA PHE 94 HA PHE 94 2.460 -2.809 3.770 413 HB2 PHE 94 1HB PHE 94 2.195 -3.513 6.659 414 HB3 PHE 94 2HB PHE 94 3.104 -2.069 6.244 415 HD1 PHE 94 HD1 PHE 94 -0.080 -3.596 4.960 416 HD2 PHE 94 HD2 PHE 94 1.879 -0.184 6.599 417 HE1 PHE 94 HE1 PHE 94 -2.165 -2.311 4.779 418 HE2 PHE 94 HE2 PHE 94 -0.207 1.102 6.418 419 HZ PHE 94 HZ PHE 94 -2.233 0.040 5.510 420 H PHE 95 H PHE 95 4.491 -1.531 4.297 421 HA PHE 95 HA PHE 95 6.833 -3.211 4.827 422 HB2 PHE 95 1HB PHE 95 6.487 -1.520 2.340 423 HB3 PHE 95 2HB PHE 95 7.991 -2.288 2.829 424 HD1 PHE 95 HD1 PHE 95 4.510 -2.971 1.774 425 HD2 PHE 95 HD2 PHE 95 8.441 -4.522 2.288 426 HE1 PHE 95 HE1 PHE 95 3.862 -5.007 0.557 427 HE2 PHE 95 HE2 PHE 95 7.799 -6.561 1.070 428 HZ PHE 95 HZ PHE 95 5.507 -6.806 0.205 429 HA PRO 96 HA PRO 96 9.062 -2.723 4.290 430 HB2 PRO 96 1HB PRO 96 11.199 -2.066 6.032 431 HB3 PRO 96 2HB PRO 96 11.076 -1.709 4.308 432 HG2 PRO 96 1HG PRO 96 11.080 0.168 6.371 433 HG3 PRO 96 2HG PRO 96 10.559 0.456 4.704 434 HD2 PRO 96 1HD PRO 96 8.923 -0.067 7.138 435 HD3 PRO 96 2HD PRO 96 8.572 0.967 5.738 436 H ASP 97 H ASP 97 8.536 -1.862 7.661 437 HA ASP 97 HA ASP 97 9.595 -4.023 8.994 438 HB2 ASP 97 1HB ASP 97 8.252 -1.819 9.757 439 HB3 ASP 97 2HB ASP 97 6.999 -3.028 10.013 440 H PHE 98 H PHE 98 6.879 -4.093 6.883 441 HA PHE 98 HA PHE 98 5.580 -5.803 6.156 442 HB2 PHE 98 1HB PHE 98 7.502 -7.342 7.859 443 HB3 PHE 98 2HB PHE 98 6.065 -8.142 7.239 444 HD1 PHE 98 HD2 PHE 98 5.661 -7.990 4.701 445 HD2 PHE 98 HD1 PHE 98 9.409 -7.195 6.554 446 HE1 PHE 98 HE2 PHE 98 6.798 -8.380 2.557 447 HE2 PHE 98 HE1 PHE 98 10.554 -7.584 4.409 448 HZ PHE 98 HZ PHE 98 9.248 -8.179 2.408 449 H ASN 99 H ASN 99 3.817 -4.725 7.065 450 HA ASN 99 HA ASN 99 2.645 -6.109 9.380 451 HB2 ASN 99 1HB ASN 99 2.331 -3.154 8.902 452 HB3 ASN 99 2HB ASN 99 1.824 -4.078 10.310 453 HD21 ASN 99 2HD2 ASN 99 3.138 -4.117 12.003 454 HD22 ASN 99 1HD2 ASN 99 4.807 -3.635 11.993 455 H PHE 100 H PHE 100 1.700 -7.227 7.433 456 HA PHE 100 HA PHE 100 0.002 -6.112 5.594 457 HB2 PHE 100 1HB PHE 100 -1.224 -8.351 5.665 458 HB3 PHE 100 2HB PHE 100 0.498 -8.393 5.322 459 HD1 PHE 100 HD1 PHE 100 2.090 -8.984 7.163 460 HD2 PHE 100 HD2 PHE 100 -2.118 -9.484 7.501 461 HE1 PHE 100 HE1 PHE 100 2.429 -10.584 9.009 462 HE2 PHE 100 HE2 PHE 100 -1.795 -11.065 9.349 463 HZ PHE 100 HZ PHE 100 0.483 -11.624 10.109 464 H ALA 101 H ALA 101 -2.296 -6.012 5.422 465 HA ALA 101 HA ALA 101 -3.843 -5.865 7.891 466 HB1 ALA 101 3HB ALA 101 -3.664 -3.646 8.033 467 HB2 ALA 101 1HB ALA 101 -4.590 -3.544 6.534 468 HB3 ALA 101 2HB ALA 101 -2.826 -3.555 6.483 469 H TRP 102 H TRP 102 -6.172 -5.613 7.491 470 HA TRP 102 HA TRP 102 -6.974 -6.644 4.843 471 HB2 TRP 102 1HB TRP 102 -8.399 -7.153 7.463 472 HB3 TRP 102 2HB TRP 102 -8.743 -7.892 5.904 473 HD1 TRP 102 HD1 TRP 102 -5.546 -8.521 5.310 474 HE1 TRP 102 HE1 TRP 102 -4.511 -10.548 6.505 475 HE3 TRP 102 HE3 TRP 102 -8.920 -9.027 9.121 476 HZ2 TRP 102 HZ2 TRP 102 -5.053 -12.155 8.763 477 HZ3 TRP 102 HZ3 TRP 102 -8.587 -10.837 10.755 478 HH2 TRP 102 HH2 TRP 102 -6.693 -12.367 10.578 479 H VAL 103 H VAL 103 -7.920 -5.053 3.721 480 HA VAL 103 HA VAL 103 -10.054 -3.499 5.007 481 HB VAL 103 HB VAL 103 -9.307 -1.426 3.897 482 HG11 VAL 103 1HG1 VAL 103 -6.944 -2.220 5.501 483 HG12 VAL 103 2HG1 VAL 103 -8.527 -2.341 6.268 484 HG13 VAL 103 3HG1 VAL 103 -7.974 -0.794 5.624 485 HG21 VAL 103 3HG2 VAL 103 -6.561 -2.376 3.473 486 HG22 VAL 103 1HG2 VAL 103 -7.547 -1.277 2.510 487 HG23 VAL 103 2HG2 VAL 103 -7.750 -3.019 2.342 488 H LYS 104 H LYS 104 -11.446 -2.358 3.391 489 HA LYS 104 HA LYS 104 -12.030 -4.135 1.193 490 HB2 LYS 104 1HB LYS 104 -13.642 -2.699 2.769 491 HB3 LYS 104 2HB LYS 104 -13.437 -1.524 1.476 492 HG2 LYS 104 1HG LYS 104 -14.589 -2.777 -0.038 493 HG3 LYS 104 2HG LYS 104 -14.143 -4.307 0.721 494 HD2 LYS 104 1HD LYS 104 -15.625 -3.335 2.693 495 HD3 LYS 104 2HD LYS 104 -16.363 -2.433 1.366 496 HE2 LYS 104 1HE LYS 104 -16.530 -4.714 0.188 497 HE3 LYS 104 2HE LYS 104 -16.227 -5.403 1.782 498 HZ1 LYS 104 3HZ LYS 104 -18.585 -4.002 0.779 499 HZ2 LYS 104 1HZ LYS 104 -18.175 -3.743 2.400 500 HZ3 LYS 104 2HZ LYS 104 -18.477 -5.311 1.845 501 H ARG 105 H ARG 105 -12.392 -3.330 -1.018 502 HA ARG 105 HA ARG 105 -10.128 -2.131 -2.124 503 HB2 ARG 105 1HB ARG 105 -12.854 -2.137 -3.419 504 HB3 ARG 105 2HB ARG 105 -11.289 -2.121 -4.215 505 HG2 ARG 105 1HG ARG 105 -11.143 -4.335 -4.184 506 HG3 ARG 105 2HG ARG 105 -11.577 -4.420 -2.477 507 HD2 ARG 105 1HD ARG 105 -13.443 -4.261 -4.839 508 HD3 ARG 105 2HD ARG 105 -13.221 -5.623 -3.740 509 HE ARG 105 HE ARG 105 -14.048 -3.311 -2.320 510 HH11 ARG 105 1HH1 ARG 105 -15.256 -5.814 -4.442 511 HH12 ARG 105 2HH1 ARG 105 -16.877 -5.708 -3.846 512 HH21 ARG 105 1HH2 ARG 105 -16.190 -3.167 -1.543 513 HH22 ARG 105 2HH2 ARG 105 -17.408 -4.205 -2.205 514 H ASN 106 H ASN 106 -12.948 -0.665 -0.752 515 HA ASN 106 HA ASN 106 -12.915 1.820 -2.064 516 HB2 ASN 106 1HB ASN 106 -13.887 1.004 0.675 517 HB3 ASN 106 2HB ASN 106 -14.093 2.633 0.037 518 HD21 ASN 106 2HD2 ASN 106 -15.060 -0.690 -0.206 519 HD22 ASN 106 1HD2 ASN 106 -16.426 -0.427 -1.244 520 H SER 107 H SER 107 -11.162 0.643 0.776 521 HA SER 107 HA SER 107 -9.874 3.248 1.112 522 HB2 SER 107 1HB SER 107 -9.570 0.733 2.769 523 HB3 SER 107 2HB SER 107 -8.971 2.338 3.185 524 HG SER 107 HG SER 107 -11.615 1.381 3.128 525 H VAL 108 H VAL 108 -9.374 1.108 -1.097 526 HA VAL 108 HA VAL 108 -6.442 1.180 -0.869 527 HB VAL 108 HB VAL 108 -8.073 -1.100 -1.990 528 HG11 VAL 108 1HG1 VAL 108 -6.220 -1.897 -2.941 529 HG12 VAL 108 2HG1 VAL 108 -5.274 -1.633 -1.478 530 HG13 VAL 108 3HG1 VAL 108 -5.482 -0.326 -2.640 531 HG21 VAL 108 3HG2 VAL 108 -8.253 -1.673 0.171 532 HG22 VAL 108 1HG2 VAL 108 -6.981 -0.562 0.675 533 HG23 VAL 108 2HG2 VAL 108 -6.562 -2.146 0.023 534 H LYS 109 H LYS 109 -5.341 1.768 -2.696 535 HA LYS 109 HA LYS 109 -6.895 2.171 -5.167 536 HB2 LYS 109 1HB LYS 109 -4.959 4.080 -3.856 537 HB3 LYS 109 2HB LYS 109 -5.464 4.233 -5.533 538 HG2 LYS 109 1HG LYS 109 -7.856 4.248 -4.603 539 HG3 LYS 109 2HG LYS 109 -7.092 4.566 -3.045 540 HD2 LYS 109 1HD LYS 109 -5.904 6.497 -4.147 541 HD3 LYS 109 2HD LYS 109 -6.946 6.239 -5.547 542 HE2 LYS 109 1HE LYS 109 -8.869 6.852 -4.378 543 HE3 LYS 109 2HE LYS 109 -8.111 6.595 -2.809 544 HZ1 LYS 109 3HZ LYS 109 -7.123 8.621 -2.847 545 HZ2 LYS 109 1HZ LYS 109 -8.458 8.993 -3.816 546 HZ3 LYS 109 2HZ LYS 109 -6.963 8.660 -4.530 547 HA PRO 110 HA PRO 110 -3.575 0.087 -7.209 548 HB2 PRO 110 1HB PRO 110 -3.657 1.193 -9.679 549 HB3 PRO 110 2HB PRO 110 -4.904 0.087 -9.089 550 HG2 PRO 110 1HG PRO 110 -4.935 3.076 -9.233 551 HG3 PRO 110 2HG PRO 110 -6.220 1.922 -9.634 552 HD2 PRO 110 1HD PRO 110 -6.132 3.291 -7.286 553 HD3 PRO 110 2HD PRO 110 -6.857 1.678 -7.439 554 H LEU 111 H LEU 111 -1.478 0.400 -6.791 555 HA LEU 111 HA LEU 111 -0.337 3.085 -7.065 556 HB2 LEU 111 1HB LEU 111 -0.104 1.191 -5.077 557 HB3 LEU 111 2HB LEU 111 1.388 0.984 -5.973 558 HG LEU 111 HG LEU 111 0.411 3.452 -4.548 559 HD11 LEU 111 1HD1 LEU 111 2.882 1.747 -4.278 560 HD12 LEU 111 2HD1 LEU 111 1.529 1.833 -3.149 561 HD13 LEU 111 3HD1 LEU 111 2.571 3.235 -3.386 562 HD21 LEU 111 3HD2 LEU 111 1.303 4.500 -6.375 563 HD22 LEU 111 1HD2 LEU 111 2.410 3.176 -6.734 564 HD23 LEU 111 2HD2 LEU 111 2.760 4.283 -5.405 565 H LEU 112 H LEU 112 1.159 3.587 -8.579 566 HA LEU 112 HA LEU 112 2.046 1.424 -10.369 567 HB2 LEU 112 1HB LEU 112 1.741 4.384 -10.857 568 HB3 LEU 112 2HB LEU 112 2.458 3.273 -12.005 569 HG LEU 112 HG LEU 112 -0.402 3.243 -11.042 570 HD11 LEU 112 1HD1 LEU 112 -0.247 4.978 -12.567 571 HD12 LEU 112 2HD1 LEU 112 -0.711 3.609 -13.578 572 HD13 LEU 112 3HD1 LEU 112 0.969 4.148 -13.538 573 HD21 LEU 112 3HD2 LEU 112 0.292 0.976 -11.398 574 HD22 LEU 112 1HD2 LEU 112 1.072 1.403 -12.921 575 HD23 LEU 112 2HD2 LEU 112 -0.685 1.477 -12.779 576 H ASP 113 H ASP 113 4.180 2.026 -11.530 577 HA ASP 113 HA ASP 113 6.227 2.125 -9.567 578 HB2 ASP 113 1HB ASP 113 6.201 1.126 -12.027 579 HB3 ASP 113 2HB ASP 113 6.862 2.709 -12.426 580 H SER 114 H SER 114 5.233 4.450 -12.073 581 HA SER 114 HA SER 114 7.051 6.474 -11.441 582 HB2 SER 114 1HB SER 114 4.309 6.544 -12.698 583 HB3 SER 114 2HB SER 114 5.273 8.005 -12.477 584 HG SER 114 HG SER 114 5.613 7.076 -14.533 585 H GLU 115 H GLU 115 3.846 5.755 -10.111 586 HA GLU 115 HA GLU 115 3.558 8.075 -8.550 587 HB2 GLU 115 1HB GLU 115 2.401 5.307 -8.399 588 HB3 GLU 115 2HB GLU 115 2.089 6.460 -7.110 589 HG2 GLU 115 1HG GLU 115 1.603 7.343 -9.897 590 HG3 GLU 115 2HG GLU 115 0.476 6.192 -9.183 591 H ILE 116 H ILE 116 4.871 4.869 -7.700 592 HA ILE 116 HA ILE 116 5.506 5.429 -5.027 593 HB ILE 116 HB ILE 116 6.951 3.535 -6.897 594 HG12 ILE 116 1HG1 ILE 116 4.921 2.691 -4.860 595 HG13 ILE 116 2HG1 ILE 116 4.376 3.309 -6.413 596 HG21 ILE 116 1HG2 ILE 116 6.830 2.987 -4.002 597 HG22 ILE 116 2HG2 ILE 116 7.855 4.335 -4.490 598 HG23 ILE 116 3HG2 ILE 116 8.137 2.729 -5.156 599 HD11 ILE 116 3HD1 ILE 116 4.522 0.855 -6.335 600 HD12 ILE 116 1HD1 ILE 116 6.258 0.990 -6.059 601 HD13 ILE 116 2HD1 ILE 116 5.558 1.565 -7.572 602 H ALA 117 H ALA 117 7.540 5.572 -7.952 603 HA ALA 117 HA ALA 117 9.877 6.554 -6.778 604 HB1 ALA 117 3HB ALA 117 9.292 5.812 -9.257 605 HB2 ALA 117 1HB ALA 117 10.643 6.892 -8.911 606 HB3 ALA 117 2HB ALA 117 9.109 7.551 -9.474 607 H LYS 118 H LYS 118 6.950 8.179 -7.821 608 HA LYS 118 HA LYS 118 7.922 10.835 -7.543 609 HB2 LYS 118 1HB LYS 118 5.675 9.686 -8.627 610 HB3 LYS 118 2HB LYS 118 5.041 10.476 -7.188 611 HG2 LYS 118 1HG LYS 118 5.007 12.362 -8.320 612 HG3 LYS 118 2HG LYS 118 6.776 12.317 -8.336 613 HD2 LYS 118 1HD LYS 118 6.829 11.253 -10.446 614 HD3 LYS 118 2HD LYS 118 5.112 10.843 -10.367 615 HE2 LYS 118 1HE LYS 118 5.472 13.692 -10.150 616 HE3 LYS 118 2HE LYS 118 6.293 13.083 -11.586 617 HZ1 LYS 118 3HZ LYS 118 3.440 13.137 -10.959 618 HZ2 LYS 118 1HZ LYS 118 4.006 11.810 -11.844 619 HZ3 LYS 118 2HZ LYS 118 4.228 13.379 -12.436 620 H PHE 119 H PHE 119 5.794 8.823 -5.516 621 HA PHE 119 HA PHE 119 5.288 10.572 -3.455 622 HB2 PHE 119 1HB PHE 119 4.254 8.410 -3.444 623 HB3 PHE 119 2HB PHE 119 5.814 7.596 -3.357 624 HD1 PHE 119 HD2 PHE 119 7.186 7.850 -1.249 625 HD2 PHE 119 HD1 PHE 119 3.094 9.000 -1.497 626 HE1 PHE 119 HE2 PHE 119 7.018 7.762 1.205 627 HE2 PHE 119 HE1 PHE 119 2.925 8.921 0.957 628 HZ PHE 119 HZ PHE 119 4.891 8.300 2.299 629 H LEU 120 H LEU 120 8.116 8.435 -3.755 630 HA LEU 120 HA LEU 120 9.372 9.302 -1.378 631 HB2 LEU 120 1HB LEU 120 10.531 8.048 -3.862 632 HB3 LEU 120 2HB LEU 120 11.410 8.282 -2.360 633 HG LEU 120 HG LEU 120 8.862 6.850 -2.060 634 HD11 LEU 120 1HD1 LEU 120 10.995 5.876 -3.901 635 HD12 LEU 120 2HD1 LEU 120 9.248 5.668 -3.986 636 HD13 LEU 120 3HD1 LEU 120 10.194 4.714 -2.846 637 HD21 LEU 120 3HD2 LEU 120 11.004 7.269 -0.496 638 HD22 LEU 120 1HD2 LEU 120 11.456 5.717 -1.201 639 HD23 LEU 120 2HD2 LEU 120 9.937 5.877 -0.321 640 H GLY 121 H GLY 121 9.341 10.554 -4.661 641 HA2 GLY 121 1HA GLY 121 11.534 12.391 -4.151 642 HA3 GLY 121 2HA GLY 121 10.589 12.269 -5.626 643 H SER 122 H SER 122 8.588 12.416 -2.887 644 HA SER 122 HA SER 122 7.727 15.087 -3.584 645 HB2 SER 122 1HB SER 122 6.707 13.251 -1.396 646 HB3 SER 122 2HB SER 122 5.902 14.695 -2.011 647 HG SER 122 HG SER 122 5.575 13.662 -3.955 648 H SER 123 H SER 123 6.973 16.355 -1.424 649 HA SER 123 HA SER 123 9.097 16.377 0.563 650 HB2 SER 123 1HB SER 123 9.907 17.866 -1.235 651 HB3 SER 123 2HB SER 123 8.433 18.823 -1.098 652 HG SER 123 HG SER 123 9.903 18.421 1.237 653 H LYS 124 H LYS 124 6.593 15.548 1.078 654 HA LYS 124 HA LYS 124 5.210 17.844 2.296 655 HB2 LYS 124 1HB LYS 124 3.289 16.221 2.544 656 HB3 LYS 124 2HB LYS 124 3.723 16.633 0.891 657 HG2 LYS 124 1HG LYS 124 5.199 14.323 1.705 658 HG3 LYS 124 2HG LYS 124 3.483 14.076 2.031 659 HD2 LYS 124 1HD LYS 124 4.018 15.305 -0.568 660 HD3 LYS 124 2HD LYS 124 4.727 13.696 -0.387 661 HE2 LYS 124 1HE LYS 124 2.536 12.822 0.286 662 HE3 LYS 124 2HE LYS 124 1.835 14.425 0.075 663 HZ1 LYS 124 3HZ LYS 124 3.136 12.851 -2.082 664 HZ2 LYS 124 1HZ LYS 124 2.348 14.339 -2.261 665 HZ3 LYS 124 2HZ LYS 124 1.466 12.956 -1.841 666 H ARG 125 H ARG 125 6.092 14.459 3.052 667 HA ARG 125 HA ARG 125 6.603 15.279 5.808 668 HB2 ARG 125 1HB ARG 125 4.318 14.210 5.623 669 HB3 ARG 125 2HB ARG 125 5.123 12.734 5.112 670 HG2 ARG 125 1HG ARG 125 4.618 12.537 7.430 671 HG3 ARG 125 2HG ARG 125 6.364 12.737 7.274 672 HD2 ARG 125 1HD ARG 125 5.868 14.178 9.009 673 HD3 ARG 125 2HD ARG 125 5.838 15.261 7.620 674 HE ARG 125 HE ARG 125 3.581 15.552 7.926 675 HH11 ARG 125 1HH1 ARG 125 4.647 12.850 9.889 676 HH12 ARG 125 2HH1 ARG 125 3.154 12.730 10.754 677 HH21 ARG 125 1HH2 ARG 125 1.612 15.388 9.078 678 HH22 ARG 125 2HH2 ARG 125 1.431 14.168 10.293 679 H LYS 126 H LYS 126 8.750 15.066 5.733 680 HA LYS 126 HA LYS 126 9.980 12.761 4.473 681 HB2 LYS 126 1HB LYS 126 10.771 15.392 4.803 682 HB3 LYS 126 2HB LYS 126 11.773 14.526 5.959 683 HG2 LYS 126 1HG LYS 126 13.004 14.626 3.953 684 HG3 LYS 126 2HG LYS 126 12.403 12.971 4.078 685 HD2 LYS 126 1HD LYS 126 12.128 13.768 1.810 686 HD3 LYS 126 2HD LYS 126 10.545 13.567 2.561 687 HE2 LYS 126 1HE LYS 126 10.058 15.686 2.106 688 HE3 LYS 126 2HE LYS 126 11.423 16.213 3.088 689 HZ1 LYS 126 3HZ LYS 126 11.931 15.301 0.343 690 HZ2 LYS 126 1HZ LYS 126 12.763 16.448 1.269 691 HZ3 LYS 126 2HZ LYS 126 11.273 16.840 0.575 692 H SER 127 H SER 127 9.533 10.984 5.737 693 HA SER 127 HA SER 127 10.781 10.983 8.400 694 HB2 SER 127 1HB SER 127 8.117 10.907 8.167 695 HB3 SER 127 2HB SER 127 8.442 9.197 7.892 696 HG SER 127 HG SER 127 9.515 9.137 9.888 697 H LYS 128 H LYS 128 12.072 9.233 8.830 698 HA LYS 128 HA LYS 128 13.103 7.720 6.726 699 HB2 LYS 128 1HB LYS 128 13.675 8.029 9.451 700 HB3 LYS 128 2HB LYS 128 13.335 6.313 9.257 701 HG2 LYS 128 1HG LYS 128 15.549 6.274 8.803 702 HG3 LYS 128 2HG LYS 128 14.959 6.628 7.178 703 HD2 LYS 128 1HD LYS 128 15.396 8.974 7.474 704 HD3 LYS 128 2HD LYS 128 15.812 8.726 9.170 705 HE2 LYS 128 1HE LYS 128 17.336 7.167 7.164 706 HE3 LYS 128 2HE LYS 128 17.645 8.901 7.228 707 HZ1 LYS 128 3HZ LYS 128 17.783 8.346 9.801 708 HZ2 LYS 128 1HZ LYS 128 19.123 8.211 8.779 709 HZ3 LYS 128 2HZ LYS 128 18.241 6.832 9.199 710 H GLU 129 H GLU 129 10.577 6.964 9.078 711 HA GLU 129 HA GLU 129 10.156 4.285 8.269 712 HB2 GLU 129 1HB GLU 129 8.006 4.471 9.464 713 HB3 GLU 129 2HB GLU 129 9.349 5.072 10.424 714 HG2 GLU 129 1HG GLU 129 8.729 7.372 9.815 715 HG3 GLU 129 2HG GLU 129 7.354 6.747 8.908 716 H LEU 130 H LEU 130 8.928 7.385 7.095 717 HA LEU 130 HA LEU 130 6.890 6.173 5.469 718 HB2 LEU 130 1HB LEU 130 6.759 8.500 6.372 719 HB3 LEU 130 2HB LEU 130 8.034 8.957 5.257 720 HG LEU 130 HG LEU 130 6.490 8.163 3.389 721 HD11 LEU 130 1HD1 LEU 130 4.602 8.095 5.721 722 HD12 LEU 130 2HD1 LEU 130 4.872 6.873 4.476 723 HD13 LEU 130 3HD1 LEU 130 4.037 8.373 4.073 724 HD21 LEU 130 3HD2 LEU 130 6.200 10.590 5.063 725 HD22 LEU 130 1HD2 LEU 130 4.968 10.296 3.837 726 HD23 LEU 130 2HD2 LEU 130 6.663 10.427 3.370 727 H ILE 131 H ILE 131 10.085 7.617 4.808 728 HA ILE 131 HA ILE 131 10.024 7.175 2.026 729 HB ILE 131 HB ILE 131 12.465 7.255 3.809 730 HG12 ILE 131 1HG1 ILE 131 11.276 9.519 2.196 731 HG13 ILE 131 2HG1 ILE 131 10.914 9.266 3.899 732 HG21 ILE 131 1HG2 ILE 131 13.706 6.983 1.984 733 HG22 ILE 131 2HG2 ILE 131 12.836 8.264 1.139 734 HG23 ILE 131 3HG2 ILE 131 12.229 6.607 1.096 735 HD11 ILE 131 3HD1 ILE 131 12.662 10.555 4.337 736 HD12 ILE 131 1HD1 ILE 131 13.210 10.500 2.660 737 HD13 ILE 131 2HD1 ILE 131 13.679 9.226 3.785 738 H GLU 132 H GLU 132 11.495 5.223 4.635 739 HA GLU 132 HA GLU 132 12.452 3.146 3.053 740 HB2 GLU 132 1HB GLU 132 11.595 3.351 5.907 741 HB3 GLU 132 2HB GLU 132 11.906 1.759 5.234 742 HG2 GLU 132 1HG GLU 132 14.162 2.406 4.657 743 HG3 GLU 132 2HG GLU 132 13.862 4.042 5.240 744 H ALA 133 H ALA 133 9.198 3.866 4.114 745 HA ALA 133 HA ALA 133 8.016 1.361 3.648 746 HB1 ALA 133 3HB ALA 133 6.501 3.877 3.139 747 HB2 ALA 133 1HB ALA 133 7.085 3.541 4.768 748 HB3 ALA 133 2HB ALA 133 5.993 2.405 3.976 749 H TYR 134 H TYR 134 8.038 4.259 1.582 750 HA TYR 134 HA TYR 134 6.995 2.818 -0.658 751 HB2 TYR 134 1HB TYR 134 7.846 5.579 -0.117 752 HB3 TYR 134 2HB TYR 134 8.137 5.043 -1.770 753 HD1 TYR 134 HD1 TYR 134 5.459 5.168 0.821 754 HD2 TYR 134 HD2 TYR 134 6.410 5.111 -3.325 755 HE1 TYR 134 HE1 TYR 134 3.098 5.583 0.279 756 HE2 TYR 134 HE2 TYR 134 4.051 5.524 -3.877 757 HH TYR 134 HH TYR 134 2.024 6.713 -2.480 758 H GLU 135 H GLU 135 10.173 3.468 0.582 759 HA GLU 135 HA GLU 135 11.648 2.844 -1.762 760 HB2 GLU 135 1HB GLU 135 12.418 3.991 0.450 761 HB3 GLU 135 2HB GLU 135 12.669 2.345 1.018 762 HG2 GLU 135 1HG GLU 135 13.947 2.269 -1.370 763 HG3 GLU 135 2HG GLU 135 14.214 3.944 -0.889 764 H ALA 136 H ALA 136 10.232 0.951 0.852 765 HA ALA 136 HA ALA 136 11.569 -1.499 0.234 766 HB1 ALA 136 3HB ALA 136 10.722 -1.503 2.376 767 HB2 ALA 136 1HB ALA 136 9.502 -2.447 1.521 768 HB3 ALA 136 2HB ALA 136 9.203 -0.748 1.896 769 H SER 137 H SER 137 8.485 -0.054 -0.696 770 HA SER 137 HA SER 137 7.649 -2.315 -2.271 771 HB2 SER 137 1HB SER 137 6.339 -0.183 -1.108 772 HB3 SER 137 2HB SER 137 6.313 0.238 -2.822 773 HG SER 137 HG SER 137 5.192 -1.977 -1.510 774 H LYS 138 H LYS 138 9.597 0.478 -2.797 775 HA LYS 138 HA LYS 138 9.217 1.020 -5.495 776 HB2 LYS 138 1HB LYS 138 10.588 2.341 -3.856 777 HB3 LYS 138 2HB LYS 138 11.857 1.139 -4.038 778 HG2 LYS 138 1HG LYS 138 12.298 3.099 -5.400 779 HG3 LYS 138 2HG LYS 138 12.039 1.675 -6.409 780 HD2 LYS 138 1HD LYS 138 9.884 2.395 -7.047 781 HD3 LYS 138 2HD LYS 138 9.827 3.607 -5.769 782 HE2 LYS 138 1HE LYS 138 10.235 4.475 -8.105 783 HE3 LYS 138 2HE LYS 138 11.384 4.993 -6.874 784 HZ1 LYS 138 3HZ LYS 138 11.892 2.680 -8.657 785 HZ2 LYS 138 1HZ LYS 138 13.003 3.511 -7.687 786 HZ3 LYS 138 2HZ LYS 138 12.352 4.257 -9.058 787 H THR 139 H THR 139 10.723 -1.750 -4.059 788 HA THR 139 HA THR 139 11.935 -2.498 -6.632 789 HB THR 139 HB THR 139 12.364 -3.926 -4.015 790 HG1 THR 139 HG1 THR 139 13.156 -2.026 -3.450 791 HG21 THR 139 3HG2 THR 139 14.669 -4.221 -5.144 792 HG22 THR 139 1HG2 THR 139 13.794 -3.855 -6.631 793 HG23 THR 139 2HG2 THR 139 13.316 -5.238 -5.644 794 HA PRO 140 HA PRO 140 8.061 -4.963 -6.844 795 HB2 PRO 140 1HB PRO 140 9.185 -5.405 -9.558 796 HB3 PRO 140 2HB PRO 140 7.551 -4.936 -9.076 797 HG2 PRO 140 1HG PRO 140 9.226 -3.161 -10.146 798 HG3 PRO 140 2HG PRO 140 8.116 -2.707 -8.840 799 HD2 PRO 140 1HD PRO 140 11.054 -3.245 -8.732 800 HD3 PRO 140 2HD PRO 140 10.089 -2.042 -7.856 801 HA PRO 141 HA PRO 141 11.015 -8.727 -8.478 802 HB2 PRO 141 1HB PRO 141 13.333 -7.529 -7.002 803 HB3 PRO 141 2HB PRO 141 13.331 -8.620 -8.398 804 HG2 PRO 141 1HG PRO 141 13.750 -6.037 -8.752 805 HG3 PRO 141 2HG PRO 141 12.709 -6.932 -9.876 806 HD2 PRO 141 1HD PRO 141 11.966 -5.006 -7.729 807 HD3 PRO 141 2HD PRO 141 11.180 -5.314 -9.290 808 H ASP 142 H ASP 142 11.098 -6.971 -5.418 809 HA ASP 142 HA ASP 142 11.782 -8.973 -3.650 810 HB2 ASP 142 1HB ASP 142 10.935 -6.389 -3.403 811 HB3 ASP 142 2HB ASP 142 9.567 -7.267 -2.729 812 H LEU 143 H LEU 143 8.788 -8.626 -5.444 813 HA LEU 143 HA LEU 143 7.892 -11.165 -4.307 814 HB2 LEU 143 1HB LEU 143 6.783 -9.462 -2.970 815 HB3 LEU 143 2HB LEU 143 6.180 -8.685 -4.421 816 HG LEU 143 HG LEU 143 4.875 -10.782 -4.905 817 HD11 LEU 143 1HD1 LEU 143 5.979 -12.448 -3.673 818 HD12 LEU 143 2HD1 LEU 143 4.450 -12.191 -2.829 819 HD13 LEU 143 3HD1 LEU 143 5.938 -11.495 -2.188 820 HD21 LEU 143 3HD2 LEU 143 4.367 -9.154 -2.433 821 HD22 LEU 143 1HD2 LEU 143 3.208 -10.331 -3.048 822 HD23 LEU 143 2HD2 LEU 143 3.676 -8.952 -4.042 823 H LYS 144 H LYS 144 6.468 -8.695 -6.480 824 HA LYS 144 HA LYS 144 5.241 -10.504 -8.187 825 HB2 LYS 144 1HB LYS 144 5.057 -8.675 -9.810 826 HB3 LYS 144 2HB LYS 144 4.632 -8.166 -8.185 827 HG2 LYS 144 1HG LYS 144 5.908 -6.397 -8.793 828 HG3 LYS 144 2HG LYS 144 7.178 -7.435 -8.148 829 HD2 LYS 144 1HD LYS 144 8.198 -7.193 -10.120 830 HD3 LYS 144 2HD LYS 144 6.945 -8.245 -10.782 831 HE2 LYS 144 1HE LYS 144 5.696 -5.817 -10.765 832 HE3 LYS 144 2HE LYS 144 7.363 -5.363 -11.111 833 HZ1 LYS 144 3HZ LYS 144 5.617 -7.183 -12.662 834 HZ2 LYS 144 1HZ LYS 144 7.293 -7.121 -12.894 835 HZ3 LYS 144 2HZ LYS 144 6.349 -5.748 -13.177 836 H GLU 145 H GLU 145 8.491 -9.067 -8.533 837 HA GLU 145 HA GLU 145 8.937 -10.829 -10.842 838 HB2 GLU 145 1HB GLU 145 10.012 -8.202 -10.015 839 HB3 GLU 145 2HB GLU 145 11.166 -9.294 -10.768 840 HG2 GLU 145 1HG GLU 145 8.512 -8.609 -11.992 841 HG3 GLU 145 2HG GLU 145 9.988 -7.703 -12.311 842 H GLU 146 H GLU 146 8.867 -12.363 -8.778 843 HA GLU 146 HA GLU 146 11.580 -12.701 -7.717 844 HB2 GLU 146 1HB GLU 146 9.724 -12.601 -6.097 845 HB3 GLU 146 2HB GLU 146 8.981 -13.993 -6.871 846 HG2 GLU 146 1HG GLU 146 10.237 -15.414 -5.725 847 HG3 GLU 146 2HG GLU 146 11.715 -14.541 -6.114 848 H SER 147 H SER 147 12.295 -13.487 -9.841 849 HA SER 147 HA SER 147 11.284 -16.078 -10.689 850 HB2 SER 147 1HB SER 147 12.068 -14.083 -12.210 851 HB3 SER 147 2HB SER 147 13.672 -14.763 -11.934 852 HG SER 147 HG SER 147 12.303 -15.538 -13.807 853 H SER 148 H SER 148 11.945 -17.733 -9.452 854 HA SER 148 HA SER 148 14.691 -17.774 -8.462 855 HB2 SER 148 1HB SER 148 12.158 -19.140 -7.704 856 HB3 SER 148 2HB SER 148 13.663 -20.010 -7.405 857 HG SER 148 HG SER 148 13.188 -18.760 -5.611 858 H THR 149 H THR 149 15.467 -18.050 -10.705 859 HA THR 149 HA THR 149 15.809 -20.883 -11.278 860 HB THR 149 HB THR 149 15.506 -20.199 -13.810 861 HG1 THR 149 HG1 THR 149 13.646 -18.466 -12.557 862 HG21 THR 149 3HG2 THR 149 13.809 -21.604 -13.724 863 HG22 THR 149 1HG2 THR 149 12.823 -20.437 -12.843 864 HG23 THR 149 2HG2 THR 149 13.892 -21.527 -11.963 865 H ASP 150 H ASP 150 16.592 -17.601 -12.450 866 HA ASP 150 HA ASP 150 19.269 -18.482 -13.198 867 HB2 ASP 150 1HB ASP 150 19.477 -16.073 -14.006 868 HB3 ASP 150 2HB ASP 150 18.299 -17.074 -14.841 869 H LEU 151 H LEU 151 21.083 -16.841 -12.671 870 HA LEU 151 HA LEU 151 21.058 -16.431 -9.774 871 HB2 LEU 151 1HB LEU 151 23.168 -16.847 -11.827 872 HB3 LEU 151 2HB LEU 151 23.592 -15.882 -10.428 873 HG LEU 151 HG LEU 151 22.464 -18.675 -10.242 874 HD11 LEU 151 1HD1 LEU 151 25.342 -17.871 -9.910 875 HD12 LEU 151 2HD1 LEU 151 24.690 -18.488 -11.427 876 HD13 LEU 151 3HD1 LEU 151 24.662 -19.498 -9.982 877 HD21 LEU 151 3HD2 LEU 151 24.081 -17.330 -8.134 878 HD22 LEU 151 1HD2 LEU 151 22.823 -18.556 -7.980 879 HD23 LEU 151 2HD2 LEU 151 22.386 -16.881 -8.317 880 H GLU 152 H GLU 152 21.778 -14.464 -8.823 881 HA GLU 152 HA GLU 152 22.088 -12.131 -10.522 882 HB2 GLU 152 1HB GLU 152 19.628 -12.721 -9.006 883 HB3 GLU 152 2HB GLU 152 20.265 -11.097 -8.793 884 HG2 GLU 152 1HG GLU 152 19.616 -10.454 -10.820 885 HG3 GLU 152 2HG GLU 152 20.214 -11.924 -11.580 Start of MODEL 5 1 H1 SER 45 1H SER 45 -18.782 4.143 -11.016 2 H2 SER 45 2H SER 45 -17.571 4.795 -12.042 3 H3 SER 45 3H SER 45 -18.839 5.797 -11.461 4 HA SER 45 HA SER 45 -16.800 6.198 -10.296 5 HB2 SER 45 1HB SER 45 -19.268 6.040 -9.276 6 HB3 SER 45 2HB SER 45 -18.508 4.775 -8.308 7 HG SER 45 HG SER 45 -17.774 6.353 -7.140 8 H ALA 46 H ALA 46 -15.296 5.432 -8.650 9 HA ALA 46 HA ALA 46 -13.809 3.977 -7.733 10 HB1 ALA 46 3HB ALA 46 -16.079 2.671 -7.342 11 HB2 ALA 46 1HB ALA 46 -14.511 1.946 -6.990 12 HB3 ALA 46 2HB ALA 46 -15.345 1.555 -8.494 13 H ASP 47 H ASP 47 -12.012 2.840 -8.383 14 HA ASP 47 HA ASP 47 -11.905 1.516 -10.933 15 HB2 ASP 47 1HB ASP 47 -11.544 4.176 -11.137 16 HB3 ASP 47 2HB ASP 47 -9.896 3.693 -10.749 17 H ASP 48 H ASP 48 -11.513 0.355 -8.573 18 HA ASP 48 HA ASP 48 -8.808 0.439 -7.663 19 HB2 ASP 48 1HB ASP 48 -11.210 -1.216 -7.062 20 HB3 ASP 48 2HB ASP 48 -9.637 -1.900 -6.666 21 H ARG 49 H ARG 49 -7.686 0.181 -9.680 22 HA ARG 49 HA ARG 49 -7.923 -2.308 -11.109 23 HB2 ARG 49 1HB ARG 49 -6.952 0.243 -11.711 24 HB3 ARG 49 2HB ARG 49 -5.522 -0.781 -11.710 25 HG2 ARG 49 1HG ARG 49 -6.146 -1.025 -13.875 26 HG3 ARG 49 2HG ARG 49 -7.087 -2.339 -13.167 27 HD2 ARG 49 1HD ARG 49 -8.738 -0.145 -12.885 28 HD3 ARG 49 2HD ARG 49 -7.977 0.117 -14.454 29 HE ARG 49 HE ARG 49 -8.895 -2.550 -14.240 30 HH11 ARG 49 1HH1 ARG 49 -10.089 0.717 -14.674 31 HH12 ARG 49 2HH1 ARG 49 -11.493 0.214 -15.552 32 HH21 ARG 49 1HH2 ARG 49 -10.752 -3.200 -15.389 33 HH22 ARG 49 2HH2 ARG 49 -11.871 -2.007 -15.956 34 H LEU 50 H LEU 50 -7.516 -3.294 -8.797 35 HA LEU 50 HA LEU 50 -4.636 -3.693 -8.376 36 HB2 LEU 50 1HB LEU 50 -6.495 -4.890 -6.438 37 HB3 LEU 50 2HB LEU 50 -5.024 -3.980 -6.169 38 HG LEU 50 HG LEU 50 -7.765 -2.835 -6.718 39 HD11 LEU 50 1HD1 LEU 50 -6.850 -3.810 -4.380 40 HD12 LEU 50 2HD1 LEU 50 -7.979 -2.460 -4.508 41 HD13 LEU 50 3HD1 LEU 50 -6.257 -2.153 -4.284 42 HD21 LEU 50 3HD2 LEU 50 -6.221 -0.751 -5.902 43 HD22 LEU 50 1HD2 LEU 50 -6.617 -1.110 -7.582 44 HD23 LEU 50 2HD2 LEU 50 -5.086 -1.658 -6.901 45 H ASN 51 H ASN 51 -3.988 -5.934 -7.695 46 HA ASN 51 HA ASN 51 -5.609 -8.151 -8.486 47 HB2 ASN 51 1HB ASN 51 -3.854 -6.932 -10.465 48 HB3 ASN 51 2HB ASN 51 -3.448 -8.623 -10.182 49 HD21 ASN 51 2HD2 ASN 51 -5.294 -10.160 -10.254 50 HD22 ASN 51 1HD2 ASN 51 -6.534 -9.870 -11.433 51 H PHE 52 H PHE 52 -4.099 -10.218 -8.621 52 HA PHE 52 HA PHE 52 -2.795 -10.393 -6.101 53 HB2 PHE 52 1HB PHE 52 -2.711 -12.367 -8.398 54 HB3 PHE 52 2HB PHE 52 -2.286 -12.701 -6.719 55 HD1 PHE 52 HD2 PHE 52 -4.457 -11.447 -5.236 56 HD2 PHE 52 HD1 PHE 52 -4.562 -13.656 -8.873 57 HE1 PHE 52 HE2 PHE 52 -6.787 -12.085 -4.778 58 HE2 PHE 52 HE1 PHE 52 -6.893 -14.297 -8.419 59 HZ PHE 52 HZ PHE 52 -8.008 -13.513 -6.369 60 H GLY 53 H GLY 53 -0.746 -10.009 -5.568 61 HA2 GLY 53 1HA GLY 53 1.538 -9.770 -5.759 62 HA3 GLY 53 2HA GLY 53 1.430 -10.437 -7.381 63 H ASP 54 H ASP 54 -0.058 -7.533 -5.953 64 HA ASP 54 HA ASP 54 1.483 -5.909 -7.839 65 HB2 ASP 54 1HB ASP 54 -1.463 -6.163 -7.586 66 HB3 ASP 54 2HB ASP 54 -0.841 -4.527 -7.768 67 H ARG 55 H ARG 55 1.164 -3.516 -7.263 68 HA ARG 55 HA ARG 55 1.494 -3.234 -4.353 69 HB2 ARG 55 1HB ARG 55 2.438 -1.311 -6.486 70 HB3 ARG 55 2HB ARG 55 2.869 -1.308 -4.783 71 HG2 ARG 55 1HG ARG 55 3.849 -3.657 -5.287 72 HG3 ARG 55 2HG ARG 55 3.804 -3.116 -6.967 73 HD2 ARG 55 1HD ARG 55 4.913 -0.963 -5.688 74 HD3 ARG 55 2HD ARG 55 5.572 -2.315 -4.772 75 HE ARG 55 HE ARG 55 6.209 -1.571 -7.475 76 HH11 ARG 55 1HH1 ARG 55 6.201 -4.181 -5.142 77 HH12 ARG 55 2HH1 ARG 55 7.404 -5.099 -5.979 78 HH21 ARG 55 1HH2 ARG 55 7.798 -2.785 -8.576 79 HH22 ARG 55 2HH2 ARG 55 8.311 -4.307 -7.931 80 H ILE 56 H ILE 56 0.001 -2.141 -3.245 81 HA ILE 56 HA ILE 56 -1.596 -0.098 -4.624 82 HB ILE 56 HB ILE 56 -3.668 -0.913 -3.571 83 HG12 ILE 56 1HG1 ILE 56 -2.040 -3.365 -2.858 84 HG13 ILE 56 2HG1 ILE 56 -2.590 -2.153 -1.705 85 HG21 ILE 56 1HG2 ILE 56 -4.172 -2.341 -5.277 86 HG22 ILE 56 2HG2 ILE 56 -2.675 -3.256 -5.106 87 HG23 ILE 56 3HG2 ILE 56 -2.659 -1.678 -5.893 88 HD11 ILE 56 3HD1 ILE 56 -3.926 -4.459 -2.539 89 HD12 ILE 56 1HD1 ILE 56 -4.803 -3.108 -3.250 90 HD13 ILE 56 2HD1 ILE 56 -4.542 -3.169 -1.508 91 H LEU 57 H LEU 57 -2.609 1.444 -3.237 92 HA LEU 57 HA LEU 57 -1.135 1.819 -0.742 93 HB2 LEU 57 1HB LEU 57 -1.877 3.555 -2.763 94 HB3 LEU 57 2HB LEU 57 -3.017 3.920 -1.481 95 HG LEU 57 HG LEU 57 -1.118 4.282 0.069 96 HD11 LEU 57 1HD1 LEU 57 0.372 2.815 -1.566 97 HD12 LEU 57 2HD1 LEU 57 1.065 4.040 -0.503 98 HD13 LEU 57 3HD1 LEU 57 0.778 4.407 -2.205 99 HD21 LEU 57 3HD2 LEU 57 -0.669 6.009 -2.333 100 HD22 LEU 57 1HD2 LEU 57 -0.705 6.452 -0.626 101 HD23 LEU 57 2HD2 LEU 57 -2.205 6.064 -1.468 102 H VAL 58 H VAL 58 -2.088 2.037 1.256 103 HA VAL 58 HA VAL 58 -4.985 1.529 1.415 104 HB VAL 58 HB VAL 58 -2.917 0.287 3.234 105 HG11 VAL 58 1HG1 VAL 58 -5.913 0.088 3.090 106 HG12 VAL 58 2HG1 VAL 58 -4.910 0.564 4.461 107 HG13 VAL 58 3HG1 VAL 58 -4.921 -1.114 3.914 108 HG21 VAL 58 3HG2 VAL 58 -4.202 -0.672 0.740 109 HG22 VAL 58 1HG2 VAL 58 -4.019 -1.831 2.058 110 HG23 VAL 58 2HG2 VAL 58 -2.602 -1.015 1.396 111 H LYS 59 H LYS 59 -6.084 2.790 2.812 112 HA LYS 59 HA LYS 59 -4.513 4.603 4.518 113 HB2 LYS 59 1HB LYS 59 -6.463 6.109 4.448 114 HB3 LYS 59 2HB LYS 59 -5.799 5.796 2.855 115 HG2 LYS 59 1HG LYS 59 -7.764 5.084 2.130 116 HG3 LYS 59 2HG LYS 59 -7.845 3.880 3.418 117 HD2 LYS 59 1HD LYS 59 -9.231 5.133 4.666 118 HD3 LYS 59 2HD LYS 59 -8.373 6.628 4.289 119 HE2 LYS 59 1HE LYS 59 -9.725 7.122 2.553 120 HE3 LYS 59 2HE LYS 59 -9.863 5.438 2.049 121 HZ1 LYS 59 3HZ LYS 59 -11.986 6.220 2.793 122 HZ2 LYS 59 1HZ LYS 59 -11.341 6.750 4.265 123 HZ3 LYS 59 2HZ LYS 59 -11.412 5.096 3.919 124 H ALA 60 H ALA 60 -4.683 4.441 6.655 125 HA ALA 60 HA ALA 60 -6.571 2.530 7.774 126 HB1 ALA 60 3HB ALA 60 -5.171 3.489 9.906 127 HB2 ALA 60 1HB ALA 60 -4.011 3.699 8.594 128 HB3 ALA 60 2HB ALA 60 -4.692 2.106 8.923 129 HA PRO 61 HA PRO 61 -9.643 5.277 9.328 130 HB2 PRO 61 1HB PRO 61 -9.161 4.078 12.015 131 HB3 PRO 61 2HB PRO 61 -10.673 4.256 11.117 132 HG2 PRO 61 1HG PRO 61 -9.483 1.890 11.285 133 HG3 PRO 61 2HG PRO 61 -10.245 2.412 9.771 134 HD2 PRO 61 1HD PRO 61 -7.350 2.307 10.499 135 HD3 PRO 61 2HD PRO 61 -8.137 1.963 8.944 136 H GLY 62 H GLY 62 -8.620 7.275 9.191 137 HA2 GLY 62 1HA GLY 62 -8.208 9.283 10.376 138 HA3 GLY 62 2HA GLY 62 -7.661 8.332 11.746 139 H TYR 63 H TYR 63 -5.939 6.659 9.923 140 HA TYR 63 HA TYR 63 -3.673 8.497 9.908 141 HB2 TYR 63 1HB TYR 63 -3.611 5.525 9.374 142 HB3 TYR 63 2HB TYR 63 -2.271 6.562 9.841 143 HD1 TYR 63 HD2 TYR 63 -3.615 8.071 12.085 144 HD2 TYR 63 HD1 TYR 63 -3.597 3.932 11.098 145 HE1 TYR 63 HE2 TYR 63 -4.014 7.512 14.444 146 HE2 TYR 63 HE1 TYR 63 -3.998 3.362 13.455 147 HH TYR 63 HH TYR 63 -3.664 5.596 15.975 148 HA PRO 64 HA PRO 64 -3.479 9.150 5.552 149 HB2 PRO 64 1HB PRO 64 -0.555 8.668 5.750 150 HB3 PRO 64 2HB PRO 64 -1.425 10.090 5.159 151 HG2 PRO 64 1HG PRO 64 -0.199 10.132 7.518 152 HG3 PRO 64 2HG PRO 64 -1.772 10.926 7.299 153 HD2 PRO 64 1HD PRO 64 -1.138 8.292 8.580 154 HD3 PRO 64 2HD PRO 64 -2.285 9.546 9.094 155 H TRP 65 H TRP 65 -2.014 8.207 3.582 156 HA TRP 65 HA TRP 65 -2.737 5.396 3.469 157 HB2 TRP 65 1HB TRP 65 -1.641 7.219 1.316 158 HB3 TRP 65 2HB TRP 65 -2.237 5.581 1.066 159 HD1 TRP 65 HD1 TRP 65 -3.628 8.948 2.415 160 HE1 TRP 65 HE1 TRP 65 -6.083 9.140 1.672 161 HE3 TRP 65 HE3 TRP 65 -4.121 4.432 0.069 162 HZ2 TRP 65 HZ2 TRP 65 -7.979 7.584 0.275 163 HZ3 TRP 65 HZ3 TRP 65 -6.289 3.861 -0.943 164 HH2 TRP 65 HH2 TRP 65 -8.179 5.405 -0.841 165 H TRP 66 H TRP 66 -1.361 3.699 3.316 166 HA TRP 66 HA TRP 66 1.528 4.294 3.368 167 HB2 TRP 66 1HB TRP 66 0.335 3.325 5.502 168 HB3 TRP 66 2HB TRP 66 0.421 1.804 4.617 169 HD1 TRP 66 HD1 TRP 66 2.656 0.518 4.733 170 HE1 TRP 66 HE1 TRP 66 5.005 1.026 5.662 171 HE3 TRP 66 HE3 TRP 66 2.031 5.462 5.868 172 HZ2 TRP 66 HZ2 TRP 66 6.397 3.225 6.738 173 HZ3 TRP 66 HZ3 TRP 66 3.926 6.696 6.838 174 HH2 TRP 66 HH2 TRP 66 6.065 5.598 7.252 175 HA PRO 67 HA PRO 67 1.772 1.768 -0.266 176 HB2 PRO 67 1HB PRO 67 4.411 1.150 -0.215 177 HB3 PRO 67 2HB PRO 67 3.812 2.755 -0.646 178 HG2 PRO 67 1HG PRO 67 4.891 1.778 1.972 179 HG3 PRO 67 2HG PRO 67 5.238 3.293 1.117 180 HD2 PRO 67 1HD PRO 67 3.501 3.172 3.177 181 HD3 PRO 67 2HD PRO 67 3.274 4.285 1.815 182 H ALA 68 H ALA 68 0.841 -0.175 -0.253 183 HA ALA 68 HA ALA 68 2.153 -2.371 1.222 184 HB1 ALA 68 3HB ALA 68 -0.184 -1.413 2.044 185 HB2 ALA 68 1HB ALA 68 0.200 -3.133 2.109 186 HB3 ALA 68 2HB ALA 68 -0.783 -2.496 0.787 187 H LEU 69 H LEU 69 1.300 -4.562 0.310 188 HA LEU 69 HA LEU 69 1.027 -4.359 -2.616 189 HB2 LEU 69 1HB LEU 69 3.176 -5.553 -1.073 190 HB3 LEU 69 2HB LEU 69 2.429 -6.724 -2.141 191 HG LEU 69 HG LEU 69 2.741 -4.711 -3.887 192 HD11 LEU 69 1HD1 LEU 69 5.323 -4.426 -2.478 193 HD12 LEU 69 2HD1 LEU 69 3.947 -3.550 -1.805 194 HD13 LEU 69 3HD1 LEU 69 4.435 -3.273 -3.475 195 HD21 LEU 69 3HD2 LEU 69 4.864 -6.701 -3.097 196 HD22 LEU 69 1HD2 LEU 69 4.784 -5.840 -4.634 197 HD23 LEU 69 2HD2 LEU 69 3.519 -6.990 -4.200 198 H LEU 70 H LEU 70 -0.725 -5.366 -3.336 199 HA LEU 70 HA LEU 70 -2.380 -6.936 -1.655 200 HB2 LEU 70 1HB LEU 70 -2.807 -5.533 -3.916 201 HB3 LEU 70 2HB LEU 70 -2.735 -7.152 -4.586 202 HG LEU 70 HG LEU 70 -4.545 -6.489 -2.277 203 HD11 LEU 70 1HD1 LEU 70 -5.731 -6.631 -4.962 204 HD12 LEU 70 2HD1 LEU 70 -4.773 -5.187 -4.633 205 HD13 LEU 70 3HD1 LEU 70 -6.133 -5.598 -3.590 206 HD21 LEU 70 3HD2 LEU 70 -5.348 -8.569 -2.518 207 HD22 LEU 70 1HD2 LEU 70 -3.841 -8.880 -3.376 208 HD23 LEU 70 2HD2 LEU 70 -5.303 -8.490 -4.279 209 H LEU 71 H LEU 71 -2.415 -9.043 -1.257 210 HA LEU 71 HA LEU 71 -0.675 -10.790 -2.853 211 HB2 LEU 71 1HB LEU 71 0.085 -11.013 -0.699 212 HB3 LEU 71 2HB LEU 71 -1.492 -10.735 0.007 213 HG LEU 71 HG LEU 71 -2.173 -13.013 -0.635 214 HD11 LEU 71 1HD1 LEU 71 0.643 -13.731 -1.259 215 HD12 LEU 71 2HD1 LEU 71 -0.333 -12.987 -2.525 216 HD13 LEU 71 3HD1 LEU 71 -0.862 -14.492 -1.776 217 HD21 LEU 71 3HD2 LEU 71 0.066 -12.416 1.192 218 HD22 LEU 71 1HD2 LEU 71 -0.212 -14.118 0.825 219 HD23 LEU 71 2HD2 LEU 71 -1.506 -13.144 1.520 220 H ARG 72 H ARG 72 -3.840 -10.822 -1.175 221 HA ARG 72 HA ARG 72 -5.048 -12.185 -3.409 222 HB2 ARG 72 1HB ARG 72 -3.917 -13.830 -1.555 223 HB3 ARG 72 2HB ARG 72 -5.551 -13.676 -0.922 224 HG2 ARG 72 1HG ARG 72 -5.790 -14.127 -3.694 225 HG3 ARG 72 2HG ARG 72 -4.597 -15.273 -3.083 226 HD2 ARG 72 1HD ARG 72 -6.159 -16.041 -1.392 227 HD3 ARG 72 2HD ARG 72 -7.344 -14.844 -1.910 228 HE ARG 72 HE ARG 72 -7.915 -16.207 -3.660 229 HH11 ARG 72 1HH1 ARG 72 -4.890 -17.330 -2.299 230 HH12 ARG 72 2HH1 ARG 72 -4.879 -18.798 -3.214 231 HH21 ARG 72 1HH2 ARG 72 -7.894 -18.141 -4.871 232 HH22 ARG 72 2HH2 ARG 72 -6.585 -19.258 -4.676 233 H ARG 73 H ARG 73 -7.410 -12.660 -2.966 234 HA ARG 73 HA ARG 73 -8.521 -10.603 -1.170 235 HB2 ARG 73 1HB ARG 73 -10.464 -10.526 -2.790 236 HB3 ARG 73 2HB ARG 73 -8.955 -9.848 -3.376 237 HG2 ARG 73 1HG ARG 73 -8.722 -11.403 -4.992 238 HG3 ARG 73 2HG ARG 73 -9.413 -12.692 -4.004 239 HD2 ARG 73 1HD ARG 73 -11.392 -12.444 -4.984 240 HD3 ARG 73 2HD ARG 73 -11.423 -10.730 -4.574 241 HE ARG 73 HE ARG 73 -9.792 -11.352 -6.861 242 HH11 ARG 73 1HH1 ARG 73 -13.037 -10.596 -5.778 243 HH12 ARG 73 2HH1 ARG 73 -13.539 -9.983 -7.316 244 HH21 ARG 73 1HH2 ARG 73 -10.465 -10.540 -8.888 245 HH22 ARG 73 2HH2 ARG 73 -12.081 -9.951 -9.080 246 H LYS 74 H LYS 74 -9.531 -11.488 0.502 247 HA LYS 74 HA LYS 74 -10.774 -14.129 0.168 248 HB2 LYS 74 1HB LYS 74 -10.745 -13.880 2.823 249 HB3 LYS 74 2HB LYS 74 -9.380 -14.510 1.918 250 HG2 LYS 74 1HG LYS 74 -8.235 -12.421 2.042 251 HG3 LYS 74 2HG LYS 74 -9.654 -11.628 2.733 252 HD2 LYS 74 1HD LYS 74 -8.448 -13.986 4.124 253 HD3 LYS 74 2HD LYS 74 -7.693 -12.399 4.283 254 HE2 LYS 74 1HE LYS 74 -10.160 -11.650 4.822 255 HE3 LYS 74 2HE LYS 74 -10.349 -13.351 5.245 256 HZ1 LYS 74 3HZ LYS 74 -8.982 -13.156 7.029 257 HZ2 LYS 74 1HZ LYS 74 -9.546 -11.563 6.987 258 HZ3 LYS 74 2HZ LYS 74 -8.032 -11.941 6.337 259 H GLU 75 H GLU 75 -12.906 -14.296 0.211 260 HA GLU 75 HA GLU 75 -14.489 -11.970 1.036 261 HB2 GLU 75 1HB GLU 75 -14.657 -13.771 -1.144 262 HB3 GLU 75 2HB GLU 75 -16.076 -14.049 -0.143 263 HG2 GLU 75 1HG GLU 75 -16.732 -11.758 -0.319 264 HG3 GLU 75 2HG GLU 75 -15.226 -11.342 -1.133 265 H THR 76 H THR 76 -15.442 -11.983 2.960 266 HA THR 76 HA THR 76 -16.384 -14.543 4.049 267 HB THR 76 HB THR 76 -14.302 -14.019 5.196 268 HG1 THR 76 HG1 THR 76 -15.107 -14.453 7.110 269 HG21 THR 76 3HG2 THR 76 -14.153 -11.636 4.948 270 HG22 THR 76 1HG2 THR 76 -14.123 -12.053 6.661 271 HG23 THR 76 2HG2 THR 76 -15.596 -11.410 5.936 272 H LYS 77 H LYS 77 -18.432 -14.507 4.739 273 HA LYS 77 HA LYS 77 -19.699 -11.891 5.234 274 HB2 LYS 77 1HB LYS 77 -21.739 -12.716 4.167 275 HB3 LYS 77 2HB LYS 77 -20.386 -12.758 3.045 276 HG2 LYS 77 1HG LYS 77 -20.242 -15.254 4.037 277 HG3 LYS 77 2HG LYS 77 -21.975 -14.961 4.181 278 HD2 LYS 77 1HD LYS 77 -22.016 -15.676 2.043 279 HD3 LYS 77 2HD LYS 77 -21.518 -14.020 1.689 280 HE2 LYS 77 1HE LYS 77 -19.931 -15.180 0.516 281 HE3 LYS 77 2HE LYS 77 -19.111 -15.010 2.067 282 HZ1 LYS 77 3HZ LYS 77 -19.352 -17.325 0.822 283 HZ2 LYS 77 1HZ LYS 77 -20.781 -17.376 1.724 284 HZ3 LYS 77 2HZ LYS 77 -19.292 -17.205 2.507 285 H ASP 78 H ASP 78 -22.007 -12.351 6.268 286 HA ASP 78 HA ASP 78 -21.766 -14.473 8.286 287 HB2 ASP 78 1HB ASP 78 -21.315 -11.778 8.841 288 HB3 ASP 78 2HB ASP 78 -22.966 -12.062 9.384 289 H SER 79 H SER 79 -23.349 -14.594 5.992 290 HA SER 79 HA SER 79 -26.056 -14.270 7.103 291 HB2 SER 79 1HB SER 79 -25.956 -12.823 5.236 292 HB3 SER 79 2HB SER 79 -25.061 -13.993 4.268 293 HG SER 79 HG SER 79 -27.614 -14.693 5.179 294 H LEU 80 H LEU 80 -24.901 -16.088 4.272 295 HA LEU 80 HA LEU 80 -25.224 -18.239 3.616 296 HB2 LEU 80 1HB LEU 80 -24.255 -18.354 6.389 297 HB3 LEU 80 2HB LEU 80 -25.058 -19.814 5.848 298 HG LEU 80 HG LEU 80 -23.024 -18.715 4.004 299 HD11 LEU 80 1HD1 LEU 80 -22.230 -18.556 6.513 300 HD12 LEU 80 2HD1 LEU 80 -21.157 -19.149 5.246 301 HD13 LEU 80 3HD1 LEU 80 -21.989 -20.289 6.303 302 HD21 LEU 80 3HD2 LEU 80 -22.786 -20.900 3.376 303 HD22 LEU 80 1HD2 LEU 80 -24.443 -20.944 3.978 304 HD23 LEU 80 2HD2 LEU 80 -23.121 -21.518 4.994 305 H ASN 81 H ASN 81 -27.612 -16.705 4.428 306 HA ASN 81 HA ASN 81 -29.516 -18.798 4.293 307 HB2 ASN 81 1HB ASN 81 -28.691 -18.238 6.901 308 HB3 ASN 81 2HB ASN 81 -30.203 -17.353 6.728 309 HD21 ASN 81 2HD2 ASN 81 -32.044 -18.611 5.825 310 HD22 ASN 81 1HD2 ASN 81 -32.196 -20.267 6.325 311 H THR 82 H THR 82 -29.501 -15.563 5.810 312 HA THR 82 HA THR 82 -30.590 -14.194 3.611 313 HB THR 82 HB THR 82 -32.613 -15.411 3.905 314 HG1 THR 82 HG1 THR 82 -34.041 -13.774 4.410 315 HG21 THR 82 3HG2 THR 82 -31.999 -16.044 6.345 316 HG22 THR 82 1HG2 THR 82 -33.692 -15.917 5.866 317 HG23 THR 82 2HG2 THR 82 -32.927 -14.600 6.754 318 H ASN 83 H ASN 83 -28.715 -13.084 4.621 319 HA ASN 83 HA ASN 83 -29.629 -11.193 6.684 320 HB2 ASN 83 1HB ASN 83 -27.659 -13.072 7.075 321 HB3 ASN 83 2HB ASN 83 -26.733 -11.646 6.617 322 HD21 ASN 83 2HD2 ASN 83 -27.685 -13.279 9.188 323 HD22 ASN 83 1HD2 ASN 83 -27.904 -11.994 10.336 324 H SER 84 H SER 84 -27.534 -11.752 3.900 325 HA SER 84 HA SER 84 -26.723 -10.384 2.286 326 HB2 SER 84 1HB SER 84 -28.689 -8.341 3.354 327 HB3 SER 84 2HB SER 84 -27.903 -8.312 1.778 328 HG SER 84 HG SER 84 -30.187 -9.373 2.289 329 H SER 85 H SER 85 -25.021 -10.583 4.268 330 HA SER 85 HA SER 85 -23.974 -7.859 4.569 331 HB2 SER 85 1HB SER 85 -24.607 -9.798 6.729 332 HB3 SER 85 2HB SER 85 -23.079 -8.931 6.875 333 HG SER 85 HG SER 85 -24.163 -7.018 6.919 334 H PHE 86 H PHE 86 -22.480 -8.213 2.936 335 HA PHE 86 HA PHE 86 -20.605 -10.438 3.241 336 HB2 PHE 86 1HB PHE 86 -21.144 -8.491 0.999 337 HB3 PHE 86 2HB PHE 86 -19.737 -9.547 1.001 338 HD1 PHE 86 HD2 PHE 86 -23.453 -9.642 1.255 339 HD2 PHE 86 HD1 PHE 86 -19.893 -11.671 0.101 340 HE1 PHE 86 HE2 PHE 86 -24.805 -11.437 0.252 341 HE2 PHE 86 HE1 PHE 86 -21.241 -13.467 -0.906 342 HZ PHE 86 HZ PHE 86 -23.699 -13.351 -0.832 343 H ASN 87 H ASN 87 -18.422 -10.166 3.579 344 HA ASN 87 HA ASN 87 -17.433 -7.433 3.972 345 HB2 ASN 87 1HB ASN 87 -18.124 -8.968 6.110 346 HB3 ASN 87 2HB ASN 87 -16.440 -9.436 5.909 347 HD21 ASN 87 2HD2 ASN 87 -18.634 -6.874 6.704 348 HD22 ASN 87 1HD2 ASN 87 -17.442 -5.768 7.316 349 H VAL 88 H VAL 88 -16.421 -7.794 1.926 350 HA VAL 88 HA VAL 88 -14.312 -9.816 1.839 351 HB VAL 88 HB VAL 88 -15.648 -9.714 -0.149 352 HG11 VAL 88 1HG1 VAL 88 -15.024 -6.775 -0.127 353 HG12 VAL 88 2HG1 VAL 88 -16.602 -7.563 -0.125 354 HG13 VAL 88 3HG1 VAL 88 -15.592 -7.610 -1.571 355 HG21 VAL 88 3HG2 VAL 88 -13.031 -9.857 -0.216 356 HG22 VAL 88 1HG2 VAL 88 -13.179 -8.317 -1.063 357 HG23 VAL 88 2HG2 VAL 88 -13.965 -9.757 -1.709 358 H LEU 89 H LEU 89 -12.175 -9.374 1.862 359 HA LEU 89 HA LEU 89 -11.353 -6.548 1.946 360 HB2 LEU 89 1HB LEU 89 -9.958 -8.585 3.633 361 HB3 LEU 89 2HB LEU 89 -10.002 -6.842 3.809 362 HG LEU 89 HG LEU 89 -12.542 -8.355 4.206 363 HD11 LEU 89 1HD1 LEU 89 -12.031 -9.196 6.261 364 HD12 LEU 89 2HD1 LEU 89 -10.739 -8.029 6.544 365 HD13 LEU 89 3HD1 LEU 89 -10.471 -9.398 5.464 366 HD21 LEU 89 3HD2 LEU 89 -11.746 -6.272 6.087 367 HD22 LEU 89 1HD2 LEU 89 -13.225 -6.443 5.142 368 HD23 LEU 89 2HD2 LEU 89 -11.792 -5.719 4.412 369 H TYR 90 H TYR 90 -8.957 -6.299 1.695 370 HA TYR 90 HA TYR 90 -7.970 -8.166 -0.359 371 HB2 TYR 90 1HB TYR 90 -7.989 -5.230 -0.130 372 HB3 TYR 90 2HB TYR 90 -6.439 -5.904 -0.624 373 HD1 TYR 90 HD2 TYR 90 -7.388 -8.250 -2.202 374 HD2 TYR 90 HD1 TYR 90 -8.757 -4.222 -2.112 375 HE1 TYR 90 HE2 TYR 90 -8.212 -8.486 -4.496 376 HE2 TYR 90 HE1 TYR 90 -9.585 -4.449 -4.415 377 HH TYR 90 HH TYR 90 -10.297 -6.245 -5.953 378 H LYS 91 H LYS 91 -6.593 -9.561 0.590 379 HA LYS 91 HA LYS 91 -5.072 -8.985 2.916 380 HB2 LYS 91 1HB LYS 91 -5.159 -11.217 0.930 381 HB3 LYS 91 2HB LYS 91 -3.770 -11.111 2.002 382 HG2 LYS 91 1HG LYS 91 -5.495 -10.987 3.899 383 HG3 LYS 91 2HG LYS 91 -6.648 -11.564 2.695 384 HD2 LYS 91 1HD LYS 91 -4.059 -12.958 3.372 385 HD3 LYS 91 2HD LYS 91 -5.621 -13.372 4.076 386 HE2 LYS 91 1HE LYS 91 -5.903 -14.766 2.361 387 HE3 LYS 91 2HE LYS 91 -6.094 -13.339 1.342 388 HZ1 LYS 91 3HZ LYS 91 -4.419 -14.888 0.490 389 HZ2 LYS 91 1HZ LYS 91 -3.507 -14.689 1.901 390 HZ3 LYS 91 2HZ LYS 91 -3.748 -13.380 0.858 391 H VAL 92 H VAL 92 -3.775 -7.198 2.674 392 HA VAL 92 HA VAL 92 -1.752 -7.313 0.540 393 HB VAL 92 HB VAL 92 -1.493 -4.920 0.727 394 HG11 VAL 92 1HG1 VAL 92 -4.052 -4.327 0.325 395 HG12 VAL 92 2HG1 VAL 92 -4.175 -6.084 0.246 396 HG13 VAL 92 3HG1 VAL 92 -3.094 -5.225 -0.850 397 HG21 VAL 92 3HG2 VAL 92 -3.413 -5.178 3.024 398 HG22 VAL 92 1HG2 VAL 92 -3.151 -3.651 2.182 399 HG23 VAL 92 2HG2 VAL 92 -1.810 -4.444 3.007 400 H LEU 93 H LEU 93 0.387 -6.539 1.015 401 HA LEU 93 HA LEU 93 1.200 -7.129 3.782 402 HB2 LEU 93 1HB LEU 93 2.113 -8.680 2.137 403 HB3 LEU 93 2HB LEU 93 2.744 -7.345 1.194 404 HG LEU 93 HG LEU 93 4.036 -6.837 3.469 405 HD11 LEU 93 1HD1 LEU 93 4.703 -8.849 4.605 406 HD12 LEU 93 2HD1 LEU 93 3.724 -9.832 3.516 407 HD13 LEU 93 3HD1 LEU 93 2.945 -8.721 4.643 408 HD21 LEU 93 3HD2 LEU 93 5.244 -9.063 1.956 409 HD22 LEU 93 1HD2 LEU 93 5.884 -7.464 2.333 410 HD23 LEU 93 2HD2 LEU 93 4.738 -7.664 1.008 411 H PHE 94 H PHE 94 2.236 -5.598 4.935 412 HA PHE 94 HA PHE 94 2.589 -2.984 3.667 413 HB2 PHE 94 1HB PHE 94 2.168 -3.959 6.441 414 HB3 PHE 94 2HB PHE 94 3.143 -2.505 6.261 415 HD1 PHE 94 HD1 PHE 94 0.011 -3.841 4.705 416 HD2 PHE 94 HD2 PHE 94 1.971 -0.577 6.611 417 HE1 PHE 94 HE1 PHE 94 -2.035 -2.493 4.496 418 HE2 PHE 94 HE2 PHE 94 -0.074 0.775 6.405 419 HZ PHE 94 HZ PHE 94 -2.082 -0.183 5.347 420 H PHE 95 H PHE 95 4.526 -1.681 4.361 421 HA PHE 95 HA PHE 95 6.935 -3.325 4.741 422 HB2 PHE 95 1HB PHE 95 6.695 -1.129 2.671 423 HB3 PHE 95 2HB PHE 95 8.095 -2.155 2.957 424 HD1 PHE 95 HD1 PHE 95 4.513 -2.327 1.956 425 HD2 PHE 95 HD2 PHE 95 8.383 -4.075 1.708 426 HE1 PHE 95 HE1 PHE 95 3.678 -3.928 0.288 427 HE2 PHE 95 HE2 PHE 95 7.552 -5.679 0.041 428 HZ PHE 95 HZ PHE 95 5.199 -5.609 -0.671 429 HA PRO 96 HA PRO 96 9.182 -2.556 4.313 430 HB2 PRO 96 1HB PRO 96 11.199 -2.145 6.293 431 HB3 PRO 96 2HB PRO 96 11.153 -1.518 4.646 432 HG2 PRO 96 1HG PRO 96 10.968 0.027 6.923 433 HG3 PRO 96 2HG PRO 96 10.385 0.513 5.322 434 HD2 PRO 96 1HD PRO 96 8.854 -0.584 7.648 435 HD3 PRO 96 2HD PRO 96 8.401 0.690 6.496 436 H ASP 97 H ASP 97 8.482 -2.528 7.752 437 HA ASP 97 HA ASP 97 9.684 -4.773 8.712 438 HB2 ASP 97 1HB ASP 97 7.102 -3.421 9.352 439 HB3 ASP 97 2HB ASP 97 7.447 -4.970 10.112 440 H PHE 98 H PHE 98 7.084 -4.723 6.403 441 HA PHE 98 HA PHE 98 6.143 -6.387 5.171 442 HB2 PHE 98 1HB PHE 98 8.039 -8.202 6.676 443 HB3 PHE 98 2HB PHE 98 7.032 -8.705 5.325 444 HD1 PHE 98 HD1 PHE 98 7.293 -6.567 3.413 445 HD2 PHE 98 HD2 PHE 98 10.234 -8.252 5.987 446 HE1 PHE 98 HE1 PHE 98 9.055 -5.893 1.837 447 HE2 PHE 98 HE2 PHE 98 12.001 -7.575 4.415 448 HZ PHE 98 HZ PHE 98 11.412 -6.393 2.336 449 H ASN 99 H ASN 99 4.559 -5.484 6.951 450 HA ASN 99 HA ASN 99 3.587 -7.654 8.662 451 HB2 ASN 99 1HB ASN 99 2.612 -4.795 8.525 452 HB3 ASN 99 2HB ASN 99 2.209 -5.990 9.750 453 HD21 ASN 99 2HD2 ASN 99 3.159 -5.524 11.600 454 HD22 ASN 99 1HD2 ASN 99 4.774 -4.916 11.792 455 H PHE 100 H PHE 100 1.017 -7.485 8.847 456 HA PHE 100 HA PHE 100 -0.057 -7.539 6.120 457 HB2 PHE 100 1HB PHE 100 0.248 -9.718 7.802 458 HB3 PHE 100 2HB PHE 100 -1.450 -9.280 7.990 459 HD1 PHE 100 HD1 PHE 100 1.021 -9.452 5.226 460 HD2 PHE 100 HD2 PHE 100 -2.883 -10.388 6.615 461 HE1 PHE 100 HE1 PHE 100 0.514 -10.510 3.072 462 HE2 PHE 100 HE2 PHE 100 -3.407 -11.445 4.468 463 HZ PHE 100 HZ PHE 100 -1.706 -11.517 2.679 464 H ALA 101 H ALA 101 -2.396 -7.303 5.972 465 HA ALA 101 HA ALA 101 -3.965 -6.339 8.101 466 HB1 ALA 101 3HB ALA 101 -4.149 -3.968 6.874 467 HB2 ALA 101 1HB ALA 101 -2.455 -4.329 6.537 468 HB3 ALA 101 2HB ALA 101 -3.031 -4.272 8.204 469 H TRP 102 H TRP 102 -6.001 -6.783 7.570 470 HA TRP 102 HA TRP 102 -6.664 -7.256 4.769 471 HB2 TRP 102 1HB TRP 102 -8.528 -7.668 7.102 472 HB3 TRP 102 2HB TRP 102 -8.552 -8.455 5.529 473 HD1 TRP 102 HD1 TRP 102 -5.700 -9.634 5.298 474 HE1 TRP 102 HE1 TRP 102 -4.884 -11.479 6.898 475 HE3 TRP 102 HE3 TRP 102 -8.955 -8.855 9.163 476 HZ2 TRP 102 HZ2 TRP 102 -5.538 -12.472 9.461 477 HZ3 TRP 102 HZ3 TRP 102 -8.793 -10.294 11.152 478 HH2 TRP 102 HH2 TRP 102 -7.118 -12.065 11.296 479 H VAL 103 H VAL 103 -7.153 -5.442 3.696 480 HA VAL 103 HA VAL 103 -9.153 -3.626 4.884 481 HB VAL 103 HB VAL 103 -6.897 -2.832 3.039 482 HG11 VAL 103 1HG1 VAL 103 -8.651 -1.346 2.626 483 HG12 VAL 103 2HG1 VAL 103 -7.648 -0.509 3.812 484 HG13 VAL 103 3HG1 VAL 103 -9.137 -1.304 4.322 485 HG21 VAL 103 3HG2 VAL 103 -5.686 -3.011 4.933 486 HG22 VAL 103 1HG2 VAL 103 -7.108 -2.956 5.976 487 HG23 VAL 103 2HG2 VAL 103 -6.438 -1.464 5.318 488 H LYS 104 H LYS 104 -10.850 -3.027 3.604 489 HA LYS 104 HA LYS 104 -11.442 -4.610 1.329 490 HB2 LYS 104 1HB LYS 104 -12.817 -2.026 2.056 491 HB3 LYS 104 2HB LYS 104 -13.486 -3.389 1.175 492 HG2 LYS 104 1HG LYS 104 -13.133 -4.726 3.317 493 HG3 LYS 104 2HG LYS 104 -12.894 -3.164 4.105 494 HD2 LYS 104 1HD LYS 104 -15.135 -3.310 4.401 495 HD3 LYS 104 2HD LYS 104 -15.163 -2.646 2.768 496 HE2 LYS 104 1HE LYS 104 -15.479 -4.814 1.816 497 HE3 LYS 104 2HE LYS 104 -15.192 -5.598 3.370 498 HZ1 LYS 104 3HZ LYS 104 -17.504 -3.869 2.669 499 HZ2 LYS 104 1HZ LYS 104 -17.217 -4.517 4.206 500 HZ3 LYS 104 2HZ LYS 104 -17.535 -5.543 2.899 501 H ARG 105 H ARG 105 -12.514 -3.038 -0.597 502 HA ARG 105 HA ARG 105 -10.150 -1.989 -1.897 503 HB2 ARG 105 1HB ARG 105 -12.939 -1.972 -3.033 504 HB3 ARG 105 2HB ARG 105 -11.410 -1.969 -3.898 505 HG2 ARG 105 1HG ARG 105 -11.802 -4.151 -4.165 506 HG3 ARG 105 2HG ARG 105 -11.221 -4.293 -2.505 507 HD2 ARG 105 1HD ARG 105 -13.195 -5.327 -2.172 508 HD3 ARG 105 2HD ARG 105 -13.807 -3.678 -2.060 509 HE ARG 105 HE ARG 105 -13.806 -4.746 -4.732 510 HH11 ARG 105 1HH1 ARG 105 -15.620 -4.479 -1.748 511 HH12 ARG 105 2HH1 ARG 105 -17.152 -4.718 -2.513 512 HH21 ARG 105 1HH2 ARG 105 -15.836 -5.063 -5.735 513 HH22 ARG 105 2HH2 ARG 105 -17.276 -5.050 -4.773 514 H ASN 106 H ASN 106 -12.912 -0.701 -0.239 515 HA ASN 106 HA ASN 106 -12.950 1.862 -1.450 516 HB2 ASN 106 1HB ASN 106 -14.334 2.552 0.435 517 HB3 ASN 106 2HB ASN 106 -14.862 0.989 -0.178 518 HD21 ASN 106 2HD2 ASN 106 -15.410 2.086 2.396 519 HD22 ASN 106 1HD2 ASN 106 -14.698 1.024 3.570 520 H SER 107 H SER 107 -11.133 0.514 1.254 521 HA SER 107 HA SER 107 -9.952 3.136 1.805 522 HB2 SER 107 1HB SER 107 -10.081 0.543 3.287 523 HB3 SER 107 2HB SER 107 -8.751 1.649 3.631 524 HG SER 107 HG SER 107 -10.198 3.189 4.265 525 H VAL 108 H VAL 108 -9.411 1.233 -0.580 526 HA VAL 108 HA VAL 108 -6.482 1.350 -0.363 527 HB VAL 108 HB VAL 108 -8.105 -0.832 -1.679 528 HG11 VAL 108 1HG1 VAL 108 -5.103 -0.639 -1.474 529 HG12 VAL 108 2HG1 VAL 108 -6.019 -0.200 -2.916 530 HG13 VAL 108 3HG1 VAL 108 -6.047 -1.860 -2.324 531 HG21 VAL 108 3HG2 VAL 108 -7.257 -2.295 -0.005 532 HG22 VAL 108 1HG2 VAL 108 -7.915 -0.884 0.822 533 HG23 VAL 108 2HG2 VAL 108 -6.173 -1.052 0.619 534 H LYS 109 H LYS 109 -5.354 1.898 -2.249 535 HA LYS 109 HA LYS 109 -6.965 2.733 -4.565 536 HB2 LYS 109 1HB LYS 109 -6.267 4.630 -2.932 537 HB3 LYS 109 2HB LYS 109 -4.656 4.399 -3.599 538 HG2 LYS 109 1HG LYS 109 -5.491 4.890 -5.830 539 HG3 LYS 109 2HG LYS 109 -7.124 5.081 -5.188 540 HD2 LYS 109 1HD LYS 109 -4.772 6.740 -4.290 541 HD3 LYS 109 2HD LYS 109 -5.866 7.223 -5.587 542 HE2 LYS 109 1HE LYS 109 -7.481 7.827 -4.156 543 HE3 LYS 109 2HE LYS 109 -7.243 6.406 -3.143 544 HZ1 LYS 109 3HZ LYS 109 -6.750 8.523 -2.006 545 HZ2 LYS 109 1HZ LYS 109 -5.488 8.802 -3.100 546 HZ3 LYS 109 2HZ LYS 109 -5.419 7.479 -2.049 547 HA PRO 110 HA PRO 110 -3.955 0.425 -6.872 548 HB2 PRO 110 1HB PRO 110 -4.162 1.796 -9.257 549 HB3 PRO 110 2HB PRO 110 -5.264 0.516 -8.739 550 HG2 PRO 110 1HG PRO 110 -5.591 3.485 -8.568 551 HG3 PRO 110 2HG PRO 110 -6.785 2.249 -9.004 552 HD2 PRO 110 1HD PRO 110 -6.764 3.370 -6.571 553 HD3 PRO 110 2HD PRO 110 -7.161 1.653 -6.792 554 H LEU 111 H LEU 111 -1.849 0.664 -6.506 555 HA LEU 111 HA LEU 111 -0.623 3.314 -6.821 556 HB2 LEU 111 1HB LEU 111 -0.426 2.165 -4.625 557 HB3 LEU 111 2HB LEU 111 0.447 0.865 -5.412 558 HG LEU 111 HG LEU 111 2.273 2.375 -5.961 559 HD11 LEU 111 1HD1 LEU 111 1.504 4.487 -6.325 560 HD12 LEU 111 2HD1 LEU 111 2.083 4.675 -4.670 561 HD13 LEU 111 3HD1 LEU 111 0.365 4.426 -4.980 562 HD21 LEU 111 3HD2 LEU 111 2.594 3.163 -3.388 563 HD22 LEU 111 1HD2 LEU 111 2.903 1.528 -3.975 564 HD23 LEU 111 2HD2 LEU 111 1.363 1.912 -3.205 565 H LEU 112 H LEU 112 0.941 3.693 -8.310 566 HA LEU 112 HA LEU 112 1.681 1.445 -10.057 567 HB2 LEU 112 1HB LEU 112 1.771 4.409 -10.609 568 HB3 LEU 112 2HB LEU 112 2.186 3.143 -11.749 569 HG LEU 112 HG LEU 112 -0.545 3.765 -10.633 570 HD11 LEU 112 1HD1 LEU 112 0.857 4.166 -13.218 571 HD12 LEU 112 2HD1 LEU 112 -0.281 5.215 -12.370 572 HD13 LEU 112 3HD1 LEU 112 -0.870 3.806 -13.251 573 HD21 LEU 112 3HD2 LEU 112 0.496 1.349 -12.040 574 HD22 LEU 112 1HD2 LEU 112 -1.141 1.908 -12.385 575 HD23 LEU 112 2HD2 LEU 112 -0.685 1.472 -10.738 576 H ASP 113 H ASP 113 3.867 1.818 -11.181 577 HA ASP 113 HA ASP 113 5.887 1.817 -9.162 578 HB2 ASP 113 1HB ASP 113 5.975 1.652 -12.173 579 HB3 ASP 113 2HB ASP 113 7.442 1.688 -11.204 580 H SER 114 H SER 114 5.094 4.039 -11.822 581 HA SER 114 HA SER 114 7.157 5.886 -11.335 582 HB2 SER 114 1HB SER 114 4.440 6.550 -12.486 583 HB3 SER 114 2HB SER 114 5.962 7.392 -12.774 584 HG SER 114 HG SER 114 6.213 6.081 -14.383 585 H GLU 115 H GLU 115 3.847 5.662 -10.087 586 HA GLU 115 HA GLU 115 3.801 8.108 -8.707 587 HB2 GLU 115 1HB GLU 115 2.348 5.512 -8.163 588 HB3 GLU 115 2HB GLU 115 2.021 7.010 -7.301 589 HG2 GLU 115 1HG GLU 115 1.741 7.926 -9.774 590 HG3 GLU 115 2HG GLU 115 1.363 6.232 -10.082 591 H ILE 116 H ILE 116 4.719 4.851 -7.593 592 HA ILE 116 HA ILE 116 5.311 5.511 -4.938 593 HB ILE 116 HB ILE 116 6.547 3.369 -6.683 594 HG12 ILE 116 1HG1 ILE 116 4.540 2.919 -4.497 595 HG13 ILE 116 2HG1 ILE 116 4.001 3.424 -6.095 596 HG21 ILE 116 1HG2 ILE 116 7.940 2.857 -5.035 597 HG22 ILE 116 2HG2 ILE 116 6.597 2.726 -3.900 598 HG23 ILE 116 3HG2 ILE 116 7.391 4.280 -4.151 599 HD11 ILE 116 3HD1 ILE 116 5.094 1.457 -7.068 600 HD12 ILE 116 1HD1 ILE 116 3.873 1.024 -5.871 601 HD13 ILE 116 2HD1 ILE 116 5.586 0.948 -5.454 602 H ALA 117 H ALA 117 7.476 5.246 -7.764 603 HA ALA 117 HA ALA 117 9.837 6.100 -6.538 604 HB1 ALA 117 3HB ALA 117 10.735 6.203 -8.644 605 HB2 ALA 117 1HB ALA 117 9.297 6.949 -9.340 606 HB3 ALA 117 2HB ALA 117 9.310 5.221 -8.983 607 H LYS 118 H LYS 118 7.130 7.893 -7.861 608 HA LYS 118 HA LYS 118 8.309 10.469 -7.743 609 HB2 LYS 118 1HB LYS 118 6.003 9.431 -8.803 610 HB3 LYS 118 2HB LYS 118 5.395 10.362 -7.440 611 HG2 LYS 118 1HG LYS 118 5.481 12.122 -8.771 612 HG3 LYS 118 2HG LYS 118 7.237 12.039 -8.588 613 HD2 LYS 118 1HD LYS 118 7.521 10.933 -10.619 614 HD3 LYS 118 2HD LYS 118 5.844 10.379 -10.659 615 HE2 LYS 118 1HE LYS 118 5.446 13.036 -10.719 616 HE3 LYS 118 2HE LYS 118 7.022 12.958 -11.507 617 HZ1 LYS 118 3HZ LYS 118 5.833 11.072 -12.861 618 HZ2 LYS 118 1HZ LYS 118 5.654 12.699 -13.291 619 HZ3 LYS 118 2HZ LYS 118 4.438 11.918 -12.412 620 H PHE 119 H PHE 119 6.000 8.793 -5.612 621 HA PHE 119 HA PHE 119 5.595 10.731 -3.701 622 HB2 PHE 119 1HB PHE 119 4.369 8.718 -3.466 623 HB3 PHE 119 2HB PHE 119 5.828 7.734 -3.436 624 HD1 PHE 119 HD1 PHE 119 7.316 7.826 -1.414 625 HD2 PHE 119 HD2 PHE 119 3.431 9.564 -1.476 626 HE1 PHE 119 HE1 PHE 119 7.292 7.847 1.047 627 HE2 PHE 119 HE2 PHE 119 3.406 9.593 0.985 628 HZ PHE 119 HZ PHE 119 5.343 8.735 2.241 629 H LEU 120 H LEU 120 8.273 8.400 -3.804 630 HA LEU 120 HA LEU 120 9.542 9.241 -1.454 631 HB2 LEU 120 1HB LEU 120 10.727 8.025 -3.947 632 HB3 LEU 120 2HB LEU 120 11.564 8.188 -2.413 633 HG LEU 120 HG LEU 120 8.988 6.815 -2.192 634 HD11 LEU 120 1HD1 LEU 120 9.861 6.094 -4.466 635 HD12 LEU 120 2HD1 LEU 120 9.546 4.810 -3.299 636 HD13 LEU 120 3HD1 LEU 120 11.201 5.340 -3.601 637 HD21 LEU 120 3HD2 LEU 120 10.288 5.313 -0.806 638 HD22 LEU 120 1HD2 LEU 120 10.654 6.986 -0.390 639 HD23 LEU 120 2HD2 LEU 120 11.787 6.051 -1.366 640 H GLY 121 H GLY 121 9.589 10.527 -4.722 641 HA2 GLY 121 1HA GLY 121 11.768 12.363 -4.117 642 HA3 GLY 121 2HA GLY 121 10.920 12.214 -5.645 643 H SER 122 H SER 122 8.927 12.462 -2.832 644 HA SER 122 HA SER 122 7.708 14.849 -3.737 645 HB2 SER 122 1HB SER 122 6.335 14.699 -1.763 646 HB3 SER 122 2HB SER 122 6.595 13.059 -2.358 647 HG SER 122 HG SER 122 7.940 12.653 -0.697 648 H SER 123 H SER 123 7.297 16.520 -1.686 649 HA SER 123 HA SER 123 9.817 17.265 -0.452 650 HB2 SER 123 1HB SER 123 9.617 19.621 -1.388 651 HB3 SER 123 2HB SER 123 10.147 18.380 -2.524 652 HG SER 123 HG SER 123 7.556 19.513 -2.283 653 H LYS 124 H LYS 124 7.091 16.492 0.439 654 HA LYS 124 HA LYS 124 6.456 18.925 1.980 655 HB2 LYS 124 1HB LYS 124 4.146 18.378 1.980 656 HB3 LYS 124 2HB LYS 124 4.693 18.234 0.317 657 HG2 LYS 124 1HG LYS 124 4.815 15.742 1.874 658 HG3 LYS 124 2HG LYS 124 3.195 16.391 1.616 659 HD2 LYS 124 1HD LYS 124 5.208 15.959 -0.586 660 HD3 LYS 124 2HD LYS 124 3.959 14.792 -0.146 661 HE2 LYS 124 1HE LYS 124 2.435 16.979 -0.437 662 HE3 LYS 124 2HE LYS 124 3.734 17.386 -1.557 663 HZ1 LYS 124 3HZ LYS 124 1.740 15.256 -1.715 664 HZ2 LYS 124 1HZ LYS 124 3.280 14.919 -2.332 665 HZ3 LYS 124 2HZ LYS 124 2.391 16.221 -2.941 666 H ARG 125 H ARG 125 6.580 15.388 2.020 667 HA ARG 125 HA ARG 125 7.022 15.513 4.912 668 HB2 ARG 125 1HB ARG 125 4.627 14.792 4.181 669 HB3 ARG 125 2HB ARG 125 5.401 13.284 3.716 670 HG2 ARG 125 1HG ARG 125 5.343 12.568 5.808 671 HG3 ARG 125 2HG ARG 125 6.245 13.983 6.353 672 HD2 ARG 125 1HD ARG 125 4.124 13.826 7.524 673 HD3 ARG 125 2HD ARG 125 4.152 15.252 6.490 674 HE ARG 125 HE ARG 125 2.974 13.000 5.187 675 HH11 ARG 125 1HH1 ARG 125 2.328 15.563 7.483 676 HH12 ARG 125 2HH1 ARG 125 0.627 15.588 7.165 677 HH21 ARG 125 1HH2 ARG 125 0.725 13.040 4.772 678 HH22 ARG 125 2HH2 ARG 125 -0.282 14.159 5.629 679 H LYS 126 H LYS 126 9.106 15.035 4.909 680 HA LYS 126 HA LYS 126 9.982 12.586 3.525 681 HB2 LYS 126 1HB LYS 126 10.984 15.119 3.178 682 HB3 LYS 126 2HB LYS 126 12.090 14.447 4.366 683 HG2 LYS 126 1HG LYS 126 13.066 13.971 2.298 684 HG3 LYS 126 2HG LYS 126 12.315 12.455 2.800 685 HD2 LYS 126 1HD LYS 126 11.664 12.626 0.583 686 HD3 LYS 126 2HD LYS 126 10.279 13.302 1.443 687 HE2 LYS 126 1HE LYS 126 10.528 14.991 -0.031 688 HE3 LYS 126 2HE LYS 126 11.754 15.528 1.112 689 HZ1 LYS 126 3HZ LYS 126 13.241 13.956 -0.377 690 HZ2 LYS 126 1HZ LYS 126 12.965 15.574 -0.787 691 HZ3 LYS 126 2HZ LYS 126 12.078 14.347 -1.541 692 H SER 127 H SER 127 9.681 11.101 5.134 693 HA SER 127 HA SER 127 11.383 11.445 7.505 694 HB2 SER 127 1HB SER 127 9.740 10.682 8.970 695 HB3 SER 127 2HB SER 127 8.801 11.666 7.849 696 HG SER 127 HG SER 127 7.865 9.599 8.261 697 H LYS 128 H LYS 128 12.274 9.498 8.358 698 HA LYS 128 HA LYS 128 13.167 7.685 6.432 699 HB2 LYS 128 1HB LYS 128 13.332 7.906 9.372 700 HB3 LYS 128 2HB LYS 128 13.514 6.277 8.736 701 HG2 LYS 128 1HG LYS 128 15.668 7.385 9.014 702 HG3 LYS 128 2HG LYS 128 15.345 7.007 7.321 703 HD2 LYS 128 1HD LYS 128 14.323 9.502 7.459 704 HD3 LYS 128 2HD LYS 128 15.601 9.620 8.670 705 HE2 LYS 128 1HE LYS 128 16.456 8.284 6.223 706 HE3 LYS 128 2HE LYS 128 15.904 9.935 5.950 707 HZ1 LYS 128 3HZ LYS 128 17.441 10.362 8.033 708 HZ2 LYS 128 1HZ LYS 128 18.066 10.329 6.461 709 HZ3 LYS 128 2HZ LYS 128 18.216 8.972 7.459 710 H GLU 129 H GLU 129 10.629 7.310 8.895 711 HA GLU 129 HA GLU 129 9.939 4.667 8.239 712 HB2 GLU 129 1HB GLU 129 7.856 5.075 9.448 713 HB3 GLU 129 2HB GLU 129 9.233 5.714 10.332 714 HG2 GLU 129 1HG GLU 129 7.809 7.578 8.531 715 HG3 GLU 129 2HG GLU 129 6.962 7.066 9.984 716 H LEU 130 H LEU 130 8.947 7.763 6.846 717 HA LEU 130 HA LEU 130 6.839 6.573 5.278 718 HB2 LEU 130 1HB LEU 130 7.900 9.281 5.689 719 HB3 LEU 130 2HB LEU 130 7.373 8.969 4.050 720 HG LEU 130 HG LEU 130 5.597 10.002 5.365 721 HD11 LEU 130 1HD1 LEU 130 5.367 7.427 4.040 722 HD12 LEU 130 2HD1 LEU 130 4.365 8.870 3.898 723 HD13 LEU 130 3HD1 LEU 130 4.069 7.716 5.198 724 HD21 LEU 130 3HD2 LEU 130 6.010 7.628 7.160 725 HD22 LEU 130 1HD2 LEU 130 4.508 8.555 7.149 726 HD23 LEU 130 2HD2 LEU 130 6.027 9.342 7.576 727 H ILE 131 H ILE 131 10.049 7.939 4.495 728 HA ILE 131 HA ILE 131 9.987 7.270 1.771 729 HB ILE 131 HB ILE 131 12.444 7.418 3.523 730 HG12 ILE 131 1HG1 ILE 131 11.651 9.674 1.757 731 HG13 ILE 131 2HG1 ILE 131 10.696 9.447 3.219 732 HG21 ILE 131 1HG2 ILE 131 12.737 8.258 0.771 733 HG22 ILE 131 2HG2 ILE 131 12.171 6.590 0.886 734 HG23 ILE 131 3HG2 ILE 131 13.665 7.075 1.693 735 HD11 ILE 131 3HD1 ILE 131 13.548 10.223 2.916 736 HD12 ILE 131 1HD1 ILE 131 13.049 9.353 4.365 737 HD13 ILE 131 2HD1 ILE 131 12.297 10.895 3.960 738 H GLU 132 H GLU 132 11.432 5.492 4.512 739 HA GLU 132 HA GLU 132 12.361 3.290 3.086 740 HB2 GLU 132 1HB GLU 132 12.624 3.934 5.601 741 HB3 GLU 132 2HB GLU 132 11.177 2.961 5.822 742 HG2 GLU 132 1HG GLU 132 12.412 1.098 4.642 743 HG3 GLU 132 2HG GLU 132 13.860 2.087 4.797 744 H ALA 133 H ALA 133 9.125 4.164 4.046 745 HA ALA 133 HA ALA 133 7.910 1.628 3.784 746 HB1 ALA 133 3HB ALA 133 7.017 3.858 4.810 747 HB2 ALA 133 1HB ALA 133 5.899 2.719 4.062 748 HB3 ALA 133 2HB ALA 133 6.429 4.147 3.174 749 H TYR 134 H TYR 134 7.897 4.408 1.571 750 HA TYR 134 HA TYR 134 6.774 2.898 -0.571 751 HB2 TYR 134 1HB TYR 134 7.857 5.637 -0.233 752 HB3 TYR 134 2HB TYR 134 7.878 4.986 -1.870 753 HD1 TYR 134 HD2 TYR 134 5.567 5.430 1.033 754 HD2 TYR 134 HD1 TYR 134 5.984 5.197 -3.194 755 HE1 TYR 134 HE2 TYR 134 3.198 6.028 0.772 756 HE2 TYR 134 HE1 TYR 134 3.615 5.793 -3.467 757 HH TYR 134 HH TYR 134 1.485 6.234 -0.674 758 H GLU 135 H GLU 135 10.037 3.498 0.512 759 HA GLU 135 HA GLU 135 11.283 2.602 -1.914 760 HB2 GLU 135 1HB GLU 135 12.179 4.051 0.191 761 HB3 GLU 135 2HB GLU 135 12.804 2.465 0.619 762 HG2 GLU 135 1HG GLU 135 13.260 3.742 -2.058 763 HG3 GLU 135 2HG GLU 135 14.356 3.931 -0.691 764 H ALA 136 H ALA 136 10.062 1.102 0.980 765 HA ALA 136 HA ALA 136 11.536 -1.356 0.618 766 HB1 ALA 136 3HB ALA 136 9.226 -0.650 2.425 767 HB2 ALA 136 1HB ALA 136 10.936 -0.711 2.856 768 HB3 ALA 136 2HB ALA 136 10.078 -2.195 2.444 769 H SER 137 H SER 137 8.350 -0.117 -0.169 770 HA SER 137 HA SER 137 7.270 -2.628 -1.003 771 HB2 SER 137 1HB SER 137 6.271 0.108 -1.799 772 HB3 SER 137 2HB SER 137 5.349 -1.393 -1.696 773 HG SER 137 HG SER 137 6.323 0.244 0.378 774 H LYS 138 H LYS 138 9.035 -0.034 -2.565 775 HA LYS 138 HA LYS 138 8.458 -0.567 -5.239 776 HB2 LYS 138 1HB LYS 138 9.775 1.383 -4.277 777 HB3 LYS 138 2HB LYS 138 11.160 0.304 -4.221 778 HG2 LYS 138 1HG LYS 138 11.592 1.141 -6.252 779 HG3 LYS 138 2HG LYS 138 10.380 -0.023 -6.791 780 HD2 LYS 138 1HD LYS 138 8.651 1.711 -6.609 781 HD3 LYS 138 2HD LYS 138 9.878 2.870 -6.093 782 HE2 LYS 138 1HE LYS 138 9.549 3.269 -8.393 783 HE3 LYS 138 2HE LYS 138 11.067 2.381 -8.272 784 HZ1 LYS 138 3HZ LYS 138 8.561 0.902 -8.718 785 HZ2 LYS 138 1HZ LYS 138 10.142 0.496 -9.167 786 HZ3 LYS 138 2HZ LYS 138 9.300 1.689 -10.019 787 H THR 139 H THR 139 10.866 -2.036 -3.101 788 HA THR 139 HA THR 139 12.435 -3.487 -4.779 789 HB THR 139 HB THR 139 11.409 -5.001 -2.446 790 HG1 THR 139 HG1 THR 139 11.442 -3.311 -1.221 791 HG21 THR 139 3HG2 THR 139 13.654 -5.224 -3.895 792 HG22 THR 139 1HG2 THR 139 13.518 -5.719 -2.210 793 HG23 THR 139 2HG2 THR 139 14.218 -4.153 -2.614 794 HA PRO 140 HA PRO 140 9.223 -5.830 -7.008 795 HB2 PRO 140 1HB PRO 140 11.655 -6.711 -8.467 796 HB3 PRO 140 2HB PRO 140 10.132 -6.076 -9.096 797 HG2 PRO 140 1HG PRO 140 12.327 -4.571 -9.092 798 HG3 PRO 140 2HG PRO 140 10.740 -3.871 -8.717 799 HD2 PRO 140 1HD PRO 140 12.960 -4.636 -6.859 800 HD3 PRO 140 2HD PRO 140 11.893 -3.217 -6.815 801 HA PRO 141 HA PRO 141 12.110 -9.912 -6.226 802 HB2 PRO 141 1HB PRO 141 13.211 -8.580 -3.772 803 HB3 PRO 141 2HB PRO 141 13.910 -9.881 -4.752 804 HG2 PRO 141 1HG PRO 141 14.767 -7.405 -5.062 805 HG3 PRO 141 2HG PRO 141 14.488 -8.430 -6.483 806 HD2 PRO 141 1HD PRO 141 12.870 -6.162 -5.436 807 HD3 PRO 141 2HD PRO 141 13.113 -6.699 -7.110 808 H ASP 142 H ASP 142 10.653 -7.764 -3.803 809 HA ASP 142 HA ASP 142 9.900 -9.507 -1.836 810 HB2 ASP 142 1HB ASP 142 9.104 -6.909 -2.680 811 HB3 ASP 142 2HB ASP 142 7.639 -7.834 -2.368 812 H LEU 143 H LEU 143 8.161 -8.900 -4.877 813 HA LEU 143 HA LEU 143 6.621 -11.365 -4.397 814 HB2 LEU 143 1HB LEU 143 5.294 -9.247 -4.485 815 HB3 LEU 143 2HB LEU 143 5.834 -9.019 -6.132 816 HG LEU 143 HG LEU 143 3.513 -9.954 -5.851 817 HD11 LEU 143 1HD1 LEU 143 5.201 -11.891 -7.373 818 HD12 LEU 143 2HD1 LEU 143 5.084 -10.207 -7.884 819 HD13 LEU 143 3HD1 LEU 143 3.632 -11.202 -7.789 820 HD21 LEU 143 3HD2 LEU 143 4.790 -12.601 -5.320 821 HD22 LEU 143 1HD2 LEU 143 3.118 -12.094 -5.086 822 HD23 LEU 143 2HD2 LEU 143 4.371 -11.535 -3.977 823 H LYS 144 H LYS 144 7.214 -9.432 -7.325 824 HA LYS 144 HA LYS 144 7.899 -9.983 -9.409 825 HB2 LYS 144 1HB LYS 144 10.055 -10.074 -8.277 826 HB3 LYS 144 2HB LYS 144 9.790 -11.761 -7.857 827 HG2 LYS 144 1HG LYS 144 10.818 -12.329 -9.733 828 HG3 LYS 144 2HG LYS 144 9.483 -11.615 -10.640 829 HD2 LYS 144 1HD LYS 144 10.674 -9.779 -11.193 830 HD3 LYS 144 2HD LYS 144 11.480 -9.703 -9.623 831 HE2 LYS 144 1HE LYS 144 12.676 -11.874 -10.517 832 HE3 LYS 144 2HE LYS 144 12.239 -11.201 -12.085 833 HZ1 LYS 144 3HZ LYS 144 13.293 -9.057 -11.035 834 HZ2 LYS 144 1HZ LYS 144 14.260 -10.236 -11.768 835 HZ3 LYS 144 2HZ LYS 144 14.120 -10.186 -10.083 836 H GLU 145 H GLU 145 8.584 -13.236 -8.153 837 HA GLU 145 HA GLU 145 6.418 -14.268 -9.867 838 HB2 GLU 145 1HB GLU 145 9.043 -15.652 -9.287 839 HB3 GLU 145 2HB GLU 145 7.783 -16.197 -10.387 840 HG2 GLU 145 1HG GLU 145 8.239 -14.454 -11.917 841 HG3 GLU 145 2HG GLU 145 9.263 -13.611 -10.757 842 H GLU 146 H GLU 146 4.927 -15.451 -8.864 843 HA GLU 146 HA GLU 146 5.491 -16.374 -6.132 844 HB2 GLU 146 1HB GLU 146 3.069 -16.410 -5.793 845 HB3 GLU 146 2HB GLU 146 3.615 -14.822 -6.314 846 HG2 GLU 146 1HG GLU 146 2.986 -15.905 -8.697 847 HG3 GLU 146 2HG GLU 146 1.848 -16.758 -7.656 848 H SER 147 H SER 147 4.349 -17.433 -9.285 849 HA SER 147 HA SER 147 4.724 -20.205 -8.419 850 HB2 SER 147 1HB SER 147 2.190 -19.053 -8.972 851 HB3 SER 147 2HB SER 147 2.572 -20.128 -10.317 852 HG SER 147 HG SER 147 1.498 -21.092 -8.422 853 H SER 148 H SER 148 3.926 -18.245 -11.303 854 HA SER 148 HA SER 148 6.297 -19.103 -12.668 855 HB2 SER 148 1HB SER 148 4.849 -20.046 -14.623 856 HB3 SER 148 2HB SER 148 5.198 -21.083 -13.241 857 HG SER 148 HG SER 148 2.808 -19.661 -13.787 858 H THR 149 H THR 149 6.935 -17.313 -13.691 859 HA THR 149 HA THR 149 4.908 -15.692 -15.070 860 HB THR 149 HB THR 149 7.215 -14.339 -13.718 861 HG1 THR 149 HG1 THR 149 4.761 -15.018 -12.465 862 HG21 THR 149 3HG2 THR 149 5.587 -12.504 -13.493 863 HG22 THR 149 1HG2 THR 149 4.411 -13.479 -14.376 864 HG23 THR 149 2HG2 THR 149 5.898 -12.959 -15.168 865 H ASP 150 H ASP 150 5.382 -15.957 -17.159 866 HA ASP 150 HA ASP 150 7.761 -14.900 -18.261 867 HB2 ASP 150 1HB ASP 150 8.149 -17.468 -17.367 868 HB3 ASP 150 2HB ASP 150 7.720 -17.728 -19.055 869 H LEU 151 H LEU 151 7.628 -14.619 -20.495 870 HA LEU 151 HA LEU 151 5.008 -14.633 -21.584 871 HB2 LEU 151 1HB LEU 151 7.103 -13.131 -22.106 872 HB3 LEU 151 2HB LEU 151 7.425 -14.356 -23.318 873 HG LEU 151 HG LEU 151 4.943 -13.897 -24.033 874 HD11 LEU 151 1HD1 LEU 151 4.017 -12.412 -22.600 875 HD12 LEU 151 2HD1 LEU 151 4.762 -11.252 -23.700 876 HD13 LEU 151 3HD1 LEU 151 5.564 -11.673 -22.187 877 HD21 LEU 151 3HD2 LEU 151 6.880 -13.501 -25.447 878 HD22 LEU 151 1HD2 LEU 151 7.203 -11.981 -24.611 879 HD23 LEU 151 2HD2 LEU 151 5.740 -12.163 -25.579 880 H GLU 152 H GLU 152 7.935 -16.434 -22.574 881 HA GLU 152 HA GLU 152 6.348 -18.767 -23.180 882 HB2 GLU 152 1HB GLU 152 6.611 -16.959 -25.227 883 HB3 GLU 152 2HB GLU 152 7.973 -18.032 -25.518 884 HG2 GLU 152 1HG GLU 152 6.405 -19.953 -25.458 885 HG3 GLU 152 2HG GLU 152 5.070 -18.807 -25.323 Start of MODEL 6 1 H1 SER 45 1H SER 45 -17.115 -3.149 -17.043 2 H2 SER 45 2H SER 45 -17.584 -2.148 -15.729 3 H3 SER 45 3H SER 45 -16.281 -3.252 -15.549 4 HA SER 45 HA SER 45 -14.901 -2.051 -16.912 5 HB2 SER 45 1HB SER 45 -17.165 -0.185 -17.621 6 HB3 SER 45 2HB SER 45 -15.609 -0.374 -18.428 7 HG SER 45 HG SER 45 -16.280 -2.296 -19.277 8 H ALA 46 H ALA 46 -14.175 0.345 -16.665 9 HA ALA 46 HA ALA 46 -13.662 2.128 -15.341 10 HB1 ALA 46 3HB ALA 46 -15.305 3.190 -14.210 11 HB2 ALA 46 1HB ALA 46 -15.847 1.722 -13.395 12 HB3 ALA 46 2HB ALA 46 -16.332 2.038 -15.061 13 H ASP 47 H ASP 47 -12.422 2.476 -13.499 14 HA ASP 47 HA ASP 47 -11.005 1.887 -11.817 15 HB2 ASP 47 1HB ASP 47 -13.508 0.418 -11.017 16 HB3 ASP 47 2HB ASP 47 -12.041 0.308 -10.053 17 H ASP 48 H ASP 48 -10.824 0.412 -14.268 18 HA ASP 48 HA ASP 48 -10.449 -2.359 -13.708 19 HB2 ASP 48 1HB ASP 48 -10.957 -1.375 -15.975 20 HB3 ASP 48 2HB ASP 48 -9.299 -0.783 -16.020 21 H ARG 49 H ARG 49 -9.113 -2.315 -11.852 22 HA ARG 49 HA ARG 49 -6.317 -2.465 -12.412 23 HB2 ARG 49 1HB ARG 49 -7.419 0.011 -11.316 24 HB3 ARG 49 2HB ARG 49 -6.179 -0.688 -10.286 25 HG2 ARG 49 1HG ARG 49 -4.517 -0.287 -11.771 26 HG3 ARG 49 2HG ARG 49 -5.563 -0.518 -13.174 27 HD2 ARG 49 1HD ARG 49 -6.224 1.816 -11.517 28 HD3 ARG 49 2HD ARG 49 -4.642 1.887 -12.289 29 HE ARG 49 HE ARG 49 -6.745 1.125 -14.088 30 HH11 ARG 49 1HH1 ARG 49 -5.117 3.854 -12.611 31 HH12 ARG 49 2HH1 ARG 49 -5.535 4.950 -13.883 32 HH21 ARG 49 1HH2 ARG 49 -7.296 2.582 -15.761 33 HH22 ARG 49 2HH2 ARG 49 -6.772 4.229 -15.668 34 H LEU 50 H LEU 50 -5.147 -2.572 -10.050 35 HA LEU 50 HA LEU 50 -4.880 -3.702 -8.095 36 HB2 LEU 50 1HB LEU 50 -7.895 -3.775 -8.005 37 HB3 LEU 50 2HB LEU 50 -6.824 -4.170 -6.676 38 HG LEU 50 HG LEU 50 -6.240 -1.524 -7.672 39 HD11 LEU 50 1HD1 LEU 50 -9.019 -1.797 -6.576 40 HD12 LEU 50 2HD1 LEU 50 -8.695 -1.757 -8.310 41 HD13 LEU 50 3HD1 LEU 50 -8.250 -0.383 -7.297 42 HD21 LEU 50 3HD2 LEU 50 -6.285 -0.955 -5.407 43 HD22 LEU 50 1HD2 LEU 50 -5.759 -2.639 -5.417 44 HD23 LEU 50 2HD2 LEU 50 -7.427 -2.239 -5.011 45 H ASN 51 H ASN 51 -3.987 -5.644 -8.364 46 HA ASN 51 HA ASN 51 -5.722 -7.923 -8.969 47 HB2 ASN 51 1HB ASN 51 -3.232 -7.169 -10.501 48 HB3 ASN 51 2HB ASN 51 -3.883 -8.806 -10.508 49 HD21 ASN 51 2HD2 ASN 51 -5.774 -9.240 -11.611 50 HD22 ASN 51 1HD2 ASN 51 -6.506 -8.101 -12.698 51 H PHE 52 H PHE 52 -4.408 -10.041 -8.728 52 HA PHE 52 HA PHE 52 -3.382 -10.140 -6.092 53 HB2 PHE 52 1HB PHE 52 -3.276 -12.194 -8.317 54 HB3 PHE 52 2HB PHE 52 -2.822 -12.513 -6.641 55 HD1 PHE 52 HD1 PHE 52 -4.920 -11.176 -5.126 56 HD2 PHE 52 HD2 PHE 52 -5.176 -13.422 -8.732 57 HE1 PHE 52 HE1 PHE 52 -7.256 -11.744 -4.603 58 HE2 PHE 52 HE2 PHE 52 -7.511 -13.993 -8.215 59 HZ PHE 52 HZ PHE 52 -8.555 -13.154 -6.149 60 H GLY 53 H GLY 53 -1.340 -10.116 -5.308 61 HA2 GLY 53 1HA GLY 53 0.942 -9.865 -5.240 62 HA3 GLY 53 2HA GLY 53 0.990 -10.685 -6.794 63 H ASP 54 H ASP 54 -0.452 -7.572 -5.839 64 HA ASP 54 HA ASP 54 1.431 -6.205 -7.619 65 HB2 ASP 54 1HB ASP 54 -1.001 -6.738 -8.549 66 HB3 ASP 54 2HB ASP 54 -1.411 -5.297 -7.624 67 H ARG 55 H ARG 55 2.046 -4.199 -6.981 68 HA ARG 55 HA ARG 55 1.784 -3.498 -4.265 69 HB2 ARG 55 1HB ARG 55 2.867 -1.315 -5.001 70 HB3 ARG 55 2HB ARG 55 3.767 -2.787 -5.331 71 HG2 ARG 55 1HG ARG 55 2.024 -1.974 -7.530 72 HG3 ARG 55 2HG ARG 55 3.265 -0.785 -7.123 73 HD2 ARG 55 1HD ARG 55 4.792 -2.957 -7.087 74 HD3 ARG 55 2HD ARG 55 3.543 -3.548 -8.181 75 HE ARG 55 HE ARG 55 4.518 -0.965 -8.929 76 HH11 ARG 55 1HH1 ARG 55 5.194 -4.396 -9.112 77 HH12 ARG 55 2HH1 ARG 55 6.138 -4.258 -10.557 78 HH21 ARG 55 1HH2 ARG 55 5.774 -0.789 -10.833 79 HH22 ARG 55 2HH2 ARG 55 6.468 -2.213 -11.532 80 H ILE 56 H ILE 56 0.098 -2.657 -3.280 81 HA ILE 56 HA ILE 56 -1.616 -0.747 -4.739 82 HB ILE 56 HB ILE 56 -3.541 -1.554 -3.436 83 HG12 ILE 56 1HG1 ILE 56 -2.908 -4.072 -2.563 84 HG13 ILE 56 2HG1 ILE 56 -1.447 -3.180 -2.151 85 HG21 ILE 56 1HG2 ILE 56 -3.823 -3.716 -4.608 86 HG22 ILE 56 2HG2 ILE 56 -2.124 -3.647 -5.074 87 HG23 ILE 56 3HG2 ILE 56 -3.248 -2.419 -5.656 88 HD11 ILE 56 3HD1 ILE 56 -4.188 -2.943 -1.073 89 HD12 ILE 56 1HD1 ILE 56 -3.217 -1.475 -1.175 90 HD13 ILE 56 2HD1 ILE 56 -2.631 -2.857 -0.250 91 H LEU 57 H LEU 57 -2.520 0.957 -3.533 92 HA LEU 57 HA LEU 57 -0.989 1.640 -1.140 93 HB2 LEU 57 1HB LEU 57 -1.679 3.137 -3.303 94 HB3 LEU 57 2HB LEU 57 -2.963 3.564 -2.188 95 HG LEU 57 HG LEU 57 -1.236 4.201 -0.511 96 HD11 LEU 57 1HD1 LEU 57 0.474 2.796 -2.194 97 HD12 LEU 57 2HD1 LEU 57 0.924 3.764 -0.792 98 HD13 LEU 57 3HD1 LEU 57 0.928 4.487 -2.399 99 HD21 LEU 57 3HD2 LEU 57 -1.604 5.534 -3.134 100 HD22 LEU 57 1HD2 LEU 57 -0.339 6.158 -2.076 101 HD23 LEU 57 2HD2 LEU 57 -2.006 6.092 -1.510 102 H VAL 58 H VAL 58 -1.806 1.316 0.812 103 HA VAL 58 HA VAL 58 -4.737 1.170 1.099 104 HB VAL 58 HB VAL 58 -3.690 -1.004 1.454 105 HG11 VAL 58 1HG1 VAL 58 -2.237 0.145 3.820 106 HG12 VAL 58 2HG1 VAL 58 -1.488 -0.019 2.233 107 HG13 VAL 58 3HG1 VAL 58 -2.058 -1.450 3.091 108 HG21 VAL 58 3HG2 VAL 58 -4.937 0.391 3.787 109 HG22 VAL 58 1HG2 VAL 58 -4.427 -1.292 3.922 110 HG23 VAL 58 2HG2 VAL 58 -5.620 -0.826 2.710 111 H LYS 59 H LYS 59 -5.674 2.555 2.466 112 HA LYS 59 HA LYS 59 -3.941 4.219 4.153 113 HB2 LYS 59 1HB LYS 59 -5.772 5.028 2.358 114 HB3 LYS 59 2HB LYS 59 -6.798 4.922 3.781 115 HG2 LYS 59 1HG LYS 59 -4.863 6.300 4.891 116 HG3 LYS 59 2HG LYS 59 -4.511 6.739 3.219 117 HD2 LYS 59 1HD LYS 59 -6.854 7.480 2.958 118 HD3 LYS 59 2HD LYS 59 -7.133 7.115 4.661 119 HE2 LYS 59 1HE LYS 59 -6.369 9.122 5.224 120 HE3 LYS 59 2HE LYS 59 -4.814 8.743 4.488 121 HZ1 LYS 59 3HZ LYS 59 -6.413 10.726 3.681 122 HZ2 LYS 59 1HZ LYS 59 -6.903 9.498 2.626 123 HZ3 LYS 59 2HZ LYS 59 -5.279 9.967 2.681 124 H ALA 60 H ALA 60 -4.187 4.341 6.328 125 HA ALA 60 HA ALA 60 -5.959 2.370 7.567 126 HB1 ALA 60 3HB ALA 60 -4.213 3.854 9.364 127 HB2 ALA 60 1HB ALA 60 -3.336 3.066 8.054 128 HB3 ALA 60 2HB ALA 60 -4.370 2.115 9.119 129 HA PRO 61 HA PRO 61 -8.853 5.217 9.301 130 HB2 PRO 61 1HB PRO 61 -8.931 4.537 11.959 131 HB3 PRO 61 2HB PRO 61 -9.733 3.616 10.682 132 HG2 PRO 61 1HG PRO 61 -7.106 3.108 12.020 133 HG3 PRO 61 2HG PRO 61 -8.375 1.953 11.572 134 HD2 PRO 61 1HD PRO 61 -6.148 2.253 10.097 135 HD3 PRO 61 2HD PRO 61 -7.722 1.907 9.350 136 H GLY 62 H GLY 62 -7.813 7.197 9.067 137 HA2 GLY 62 1HA GLY 62 -7.302 9.228 10.187 138 HA3 GLY 62 2HA GLY 62 -6.686 8.293 11.542 139 H TYR 63 H TYR 63 -5.111 6.528 9.755 140 HA TYR 63 HA TYR 63 -2.771 8.219 9.572 141 HB2 TYR 63 1HB TYR 63 -3.258 5.485 10.073 142 HB3 TYR 63 2HB TYR 63 -2.366 5.546 8.558 143 HD1 TYR 63 HD2 TYR 63 -2.062 7.792 11.523 144 HD2 TYR 63 HD1 TYR 63 -0.247 4.769 9.139 145 HE1 TYR 63 HE2 TYR 63 0.035 8.069 12.776 146 HE2 TYR 63 HE1 TYR 63 1.852 5.038 10.388 147 HH TYR 63 HH TYR 63 2.630 7.578 12.164 148 HA PRO 64 HA PRO 64 -2.901 9.024 5.232 149 HB2 PRO 64 1HB PRO 64 -0.245 8.978 4.603 150 HB3 PRO 64 2HB PRO 64 -1.018 10.312 5.468 151 HG2 PRO 64 1HG PRO 64 0.585 8.027 6.550 152 HG3 PRO 64 2HG PRO 64 0.630 9.742 7.003 153 HD2 PRO 64 1HD PRO 64 -0.671 7.895 8.478 154 HD3 PRO 64 2HD PRO 64 -1.245 9.570 8.336 155 H TRP 65 H TRP 65 -2.131 8.168 3.077 156 HA TRP 65 HA TRP 65 -2.701 5.420 2.857 157 HB2 TRP 65 1HB TRP 65 -1.467 7.351 0.886 158 HB3 TRP 65 2HB TRP 65 -1.896 5.694 0.478 159 HD1 TRP 65 HD1 TRP 65 -3.467 9.091 1.259 160 HE1 TRP 65 HE1 TRP 65 -5.937 9.045 0.536 161 HE3 TRP 65 HE3 TRP 65 -3.891 4.124 0.109 162 HZ2 TRP 65 HZ2 TRP 65 -7.817 7.158 -0.397 163 HZ3 TRP 65 HZ3 TRP 65 -6.059 3.281 -0.695 164 HH2 TRP 65 HH2 TRP 65 -7.980 4.767 -0.941 165 H TRP 66 H TRP 66 -1.441 3.625 2.696 166 HA TRP 66 HA TRP 66 1.475 4.006 2.899 167 HB2 TRP 66 1HB TRP 66 -0.061 3.004 4.901 168 HB3 TRP 66 2HB TRP 66 0.337 1.521 4.034 169 HD1 TRP 66 HD1 TRP 66 2.532 0.427 4.760 170 HE1 TRP 66 HE1 TRP 66 4.683 1.209 5.939 171 HE3 TRP 66 HE3 TRP 66 1.467 5.409 5.172 172 HZ2 TRP 66 HZ2 TRP 66 5.775 3.615 6.922 173 HZ3 TRP 66 HZ3 TRP 66 3.121 6.882 6.242 174 HH2 TRP 66 HH2 TRP 66 5.235 5.998 7.089 175 HA PRO 67 HA PRO 67 1.638 1.319 -0.623 176 HB2 PRO 67 1HB PRO 67 4.261 0.826 -0.712 177 HB3 PRO 67 2HB PRO 67 3.622 2.448 -1.006 178 HG2 PRO 67 1HG PRO 67 4.893 1.327 1.455 179 HG3 PRO 67 2HG PRO 67 5.092 2.926 0.719 180 HD2 PRO 67 1HD PRO 67 3.447 2.369 2.870 181 HD3 PRO 67 2HD PRO 67 3.265 3.766 1.794 182 H ALA 68 H ALA 68 0.667 -0.612 -0.368 183 HA ALA 68 HA ALA 68 2.142 -2.732 1.066 184 HB1 ALA 68 3HB ALA 68 -0.759 -3.096 0.731 185 HB2 ALA 68 1HB ALA 68 -0.281 -1.790 1.817 186 HB3 ALA 68 2HB ALA 68 0.279 -3.434 2.117 187 H LEU 69 H LEU 69 1.266 -4.973 0.275 188 HA LEU 69 HA LEU 69 1.095 -4.891 -2.668 189 HB2 LEU 69 1HB LEU 69 3.176 -5.912 -1.139 190 HB3 LEU 69 2HB LEU 69 2.250 -7.332 -1.581 191 HG LEU 69 HG LEU 69 3.068 -5.346 -3.674 192 HD11 LEU 69 1HD1 LEU 69 4.742 -7.700 -2.838 193 HD12 LEU 69 2HD1 LEU 69 5.064 -6.044 -2.323 194 HD13 LEU 69 3HD1 LEU 69 5.125 -6.464 -4.034 195 HD21 LEU 69 3HD2 LEU 69 1.432 -7.019 -4.301 196 HD22 LEU 69 1HD2 LEU 69 2.484 -8.305 -3.707 197 HD23 LEU 69 2HD2 LEU 69 2.968 -7.343 -5.105 198 H LEU 70 H LEU 70 -0.762 -5.688 -3.390 199 HA LEU 70 HA LEU 70 -2.623 -7.043 -1.761 200 HB2 LEU 70 1HB LEU 70 -2.813 -5.732 -4.091 201 HB3 LEU 70 2HB LEU 70 -2.784 -7.373 -4.706 202 HG LEU 70 HG LEU 70 -4.703 -6.674 -2.521 203 HD11 LEU 70 1HD1 LEU 70 -6.139 -6.420 -4.878 204 HD12 LEU 70 2HD1 LEU 70 -4.673 -5.480 -5.158 205 HD13 LEU 70 3HD1 LEU 70 -5.697 -5.125 -3.766 206 HD21 LEU 70 3HD2 LEU 70 -4.129 -8.983 -3.881 207 HD22 LEU 70 1HD2 LEU 70 -5.526 -8.362 -4.760 208 HD23 LEU 70 2HD2 LEU 70 -5.634 -8.646 -3.023 209 H LEU 71 H LEU 71 -2.735 -9.116 -1.178 210 HA LEU 71 HA LEU 71 -1.087 -11.063 -2.644 211 HB2 LEU 71 1HB LEU 71 -2.266 -11.320 0.124 212 HB3 LEU 71 2HB LEU 71 -1.151 -12.433 -0.642 213 HG LEU 71 HG LEU 71 -0.358 -9.578 -0.171 214 HD11 LEU 71 1HD1 LEU 71 -1.130 -10.368 1.981 215 HD12 LEU 71 2HD1 LEU 71 0.631 -10.274 1.968 216 HD13 LEU 71 3HD1 LEU 71 -0.169 -11.838 1.814 217 HD21 LEU 71 3HD2 LEU 71 1.845 -11.059 0.191 218 HD22 LEU 71 1HD2 LEU 71 1.330 -10.467 -1.388 219 HD23 LEU 71 2HD2 LEU 71 0.959 -12.121 -0.903 220 H ARG 72 H ARG 72 -4.223 -10.905 -0.928 221 HA ARG 72 HA ARG 72 -5.609 -12.141 -3.097 222 HB2 ARG 72 1HB ARG 72 -4.453 -13.858 -1.112 223 HB3 ARG 72 2HB ARG 72 -6.204 -13.936 -0.988 224 HG2 ARG 72 1HG ARG 72 -5.144 -14.093 -3.723 225 HG3 ARG 72 2HG ARG 72 -4.717 -15.440 -2.667 226 HD2 ARG 72 1HD ARG 72 -7.443 -14.905 -2.220 227 HD3 ARG 72 2HD ARG 72 -7.209 -14.869 -3.967 228 HE ARG 72 HE ARG 72 -5.919 -17.127 -3.216 229 HH11 ARG 72 1HH1 ARG 72 -9.159 -15.923 -2.639 230 HH12 ARG 72 2HH1 ARG 72 -9.857 -17.503 -2.528 231 HH21 ARG 72 1HH2 ARG 72 -6.847 -19.203 -3.070 232 HH22 ARG 72 2HH2 ARG 72 -8.545 -19.365 -2.772 233 H ARG 73 H ARG 73 -7.892 -12.203 -2.794 234 HA ARG 73 HA ARG 73 -8.787 -10.489 -0.577 235 HB2 ARG 73 1HB ARG 73 -10.781 -10.018 -2.022 236 HB3 ARG 73 2HB ARG 73 -9.255 -9.433 -2.667 237 HG2 ARG 73 1HG ARG 73 -9.160 -11.399 -4.153 238 HG3 ARG 73 2HG ARG 73 -10.734 -11.908 -3.538 239 HD2 ARG 73 1HD ARG 73 -10.358 -9.174 -4.694 240 HD3 ARG 73 2HD ARG 73 -10.609 -10.565 -5.748 241 HE ARG 73 HE ARG 73 -12.598 -10.588 -3.784 242 HH11 ARG 73 1HH1 ARG 73 -11.621 -8.649 -6.531 243 HH12 ARG 73 2HH1 ARG 73 -13.226 -8.093 -6.866 244 HH21 ARG 73 1HH2 ARG 73 -14.712 -9.848 -4.226 245 HH22 ARG 73 2HH2 ARG 73 -14.981 -8.772 -5.557 246 H LYS 74 H LYS 74 -9.625 -11.616 1.033 247 HA LYS 74 HA LYS 74 -11.028 -14.120 0.470 248 HB2 LYS 74 1HB LYS 74 -11.059 -14.038 3.149 249 HB3 LYS 74 2HB LYS 74 -9.699 -14.664 2.231 250 HG2 LYS 74 1HG LYS 74 -8.520 -12.569 2.473 251 HG3 LYS 74 2HG LYS 74 -9.910 -11.852 3.293 252 HD2 LYS 74 1HD LYS 74 -9.456 -14.115 4.771 253 HD3 LYS 74 2HD LYS 74 -7.821 -13.623 4.325 254 HE2 LYS 74 1HE LYS 74 -7.903 -11.735 5.576 255 HE3 LYS 74 2HE LYS 74 -9.621 -11.477 5.266 256 HZ1 LYS 74 3HZ LYS 74 -8.926 -12.100 7.617 257 HZ2 LYS 74 1HZ LYS 74 -8.684 -13.664 7.022 258 HZ3 LYS 74 2HZ LYS 74 -10.218 -12.957 6.945 259 H GLU 75 H GLU 75 -13.083 -13.799 -0.072 260 HA GLU 75 HA GLU 75 -14.639 -11.651 1.069 261 HB2 GLU 75 1HB GLU 75 -14.719 -12.630 -1.354 262 HB3 GLU 75 2HB GLU 75 -15.796 -13.822 -0.640 263 HG2 GLU 75 1HG GLU 75 -17.484 -12.352 -0.387 264 HG3 GLU 75 2HG GLU 75 -16.405 -11.000 -0.048 265 H THR 76 H THR 76 -15.536 -11.843 3.014 266 HA THR 76 HA THR 76 -16.727 -14.433 3.748 267 HB THR 76 HB THR 76 -14.669 -14.043 5.037 268 HG1 THR 76 HG1 THR 76 -16.976 -13.735 6.659 269 HG21 THR 76 3HG2 THR 76 -16.051 -11.594 6.101 270 HG22 THR 76 1HG2 THR 76 -14.594 -11.629 5.109 271 HG23 THR 76 2HG2 THR 76 -14.567 -12.300 6.739 272 H LYS 77 H LYS 77 -18.833 -14.351 4.177 273 HA LYS 77 HA LYS 77 -20.063 -11.711 4.586 274 HB2 LYS 77 1HB LYS 77 -22.155 -12.779 3.804 275 HB3 LYS 77 2HB LYS 77 -20.868 -12.835 2.607 276 HG2 LYS 77 1HG LYS 77 -20.875 -15.193 4.291 277 HG3 LYS 77 2HG LYS 77 -22.421 -14.956 3.473 278 HD2 LYS 77 1HD LYS 77 -19.935 -14.624 1.877 279 HD3 LYS 77 2HD LYS 77 -20.411 -16.261 2.333 280 HE2 LYS 77 1HE LYS 77 -22.512 -14.493 1.214 281 HE3 LYS 77 2HE LYS 77 -21.271 -15.071 0.104 282 HZ1 LYS 77 3HZ LYS 77 -23.479 -16.433 0.655 283 HZ2 LYS 77 1HZ LYS 77 -22.465 -17.073 1.847 284 HZ3 LYS 77 2HZ LYS 77 -22.026 -17.179 0.217 285 H ASP 78 H ASP 78 -22.221 -11.866 5.809 286 HA ASP 78 HA ASP 78 -22.446 -13.843 7.864 287 HB2 ASP 78 1HB ASP 78 -20.570 -12.238 8.624 288 HB3 ASP 78 2HB ASP 78 -21.860 -11.064 8.861 289 H SER 79 H SER 79 -24.357 -13.480 6.220 290 HA SER 79 HA SER 79 -26.137 -11.335 6.570 291 HB2 SER 79 1HB SER 79 -26.633 -14.175 5.659 292 HB3 SER 79 2HB SER 79 -27.838 -12.889 5.573 293 HG SER 79 HG SER 79 -26.574 -13.231 3.620 294 H LEU 80 H LEU 80 -25.467 -14.049 8.583 295 HA LEU 80 HA LEU 80 -27.831 -14.532 9.909 296 HB2 LEU 80 1HB LEU 80 -24.994 -14.874 10.456 297 HB3 LEU 80 2HB LEU 80 -25.911 -14.571 11.920 298 HG LEU 80 HG LEU 80 -27.472 -16.463 10.803 299 HD11 LEU 80 1HD1 LEU 80 -26.383 -17.993 9.514 300 HD12 LEU 80 2HD1 LEU 80 -24.800 -17.599 10.180 301 HD13 LEU 80 3HD1 LEU 80 -25.545 -16.534 8.988 302 HD21 LEU 80 3HD2 LEU 80 -26.634 -17.924 12.428 303 HD22 LEU 80 1HD2 LEU 80 -26.337 -16.315 13.082 304 HD23 LEU 80 2HD2 LEU 80 -25.017 -17.226 12.351 305 H ASN 81 H ASN 81 -25.692 -11.769 10.192 306 HA ASN 81 HA ASN 81 -26.508 -10.681 12.609 307 HB2 ASN 81 1HB ASN 81 -24.645 -9.866 11.109 308 HB3 ASN 81 2HB ASN 81 -25.871 -9.070 10.130 309 HD21 ASN 81 2HD2 ASN 81 -24.775 -7.094 10.612 310 HD22 ASN 81 1HD2 ASN 81 -25.046 -6.296 12.131 311 H THR 82 H THR 82 -27.831 -9.909 9.372 312 HA THR 82 HA THR 82 -30.478 -9.654 10.498 313 HB THR 82 HB THR 82 -30.012 -7.437 10.951 314 HG1 THR 82 HG1 THR 82 -31.762 -7.532 9.478 315 HG21 THR 82 3HG2 THR 82 -28.835 -6.307 8.639 316 HG22 THR 82 1HG2 THR 82 -27.866 -7.698 9.122 317 HG23 THR 82 2HG2 THR 82 -28.186 -6.403 10.274 318 H ASN 83 H ASN 83 -28.842 -8.498 7.526 319 HA ASN 83 HA ASN 83 -29.775 -10.565 5.877 320 HB2 ASN 83 1HB ASN 83 -31.990 -9.575 6.320 321 HB3 ASN 83 2HB ASN 83 -31.417 -8.025 5.712 322 HD21 ASN 83 2HD2 ASN 83 -31.278 -11.411 4.615 323 HD22 ASN 83 1HD2 ASN 83 -31.855 -11.084 3.010 324 H SER 84 H SER 84 -28.469 -10.596 4.173 325 HA SER 84 HA SER 84 -26.918 -9.993 2.634 326 HB2 SER 84 1HB SER 84 -29.065 -8.492 2.077 327 HB3 SER 84 2HB SER 84 -27.924 -7.200 2.449 328 HG SER 84 HG SER 84 -26.530 -8.065 0.871 329 H SER 85 H SER 85 -25.373 -10.124 4.450 330 HA SER 85 HA SER 85 -24.109 -7.507 4.925 331 HB2 SER 85 1HB SER 85 -23.795 -9.728 6.911 332 HB3 SER 85 2HB SER 85 -23.687 -7.985 7.156 333 HG SER 85 HG SER 85 -25.621 -8.954 8.012 334 H PHE 86 H PHE 86 -22.526 -7.606 3.399 335 HA PHE 86 HA PHE 86 -20.810 -9.988 3.336 336 HB2 PHE 86 1HB PHE 86 -21.726 -8.097 1.326 337 HB3 PHE 86 2HB PHE 86 -19.975 -8.269 1.304 338 HD1 PHE 86 HD2 PHE 86 -19.133 -10.784 1.413 339 HD2 PHE 86 HD1 PHE 86 -22.972 -9.539 0.058 340 HE1 PHE 86 HE2 PHE 86 -19.353 -12.870 0.127 341 HE2 PHE 86 HE1 PHE 86 -23.197 -11.622 -1.228 342 HZ PHE 86 HZ PHE 86 -21.386 -13.291 -1.198 343 H ASN 87 H ASN 87 -18.626 -9.889 3.706 344 HA ASN 87 HA ASN 87 -17.475 -7.293 4.449 345 HB2 ASN 87 1HB ASN 87 -18.231 -8.666 6.471 346 HB3 ASN 87 2HB ASN 87 -16.955 -9.803 6.048 347 HD21 ASN 87 2HD2 ASN 87 -17.614 -7.516 8.152 348 HD22 ASN 87 1HD2 ASN 87 -16.048 -6.799 8.376 349 H VAL 88 H VAL 88 -16.506 -7.425 2.354 350 HA VAL 88 HA VAL 88 -14.480 -9.508 1.999 351 HB VAL 88 HB VAL 88 -15.879 -9.150 0.069 352 HG11 VAL 88 1HG1 VAL 88 -15.050 -6.273 0.326 353 HG12 VAL 88 2HG1 VAL 88 -16.680 -6.947 0.312 354 HG13 VAL 88 3HG1 VAL 88 -15.716 -6.941 -1.164 355 HG21 VAL 88 3HG2 VAL 88 -14.159 -8.640 -1.630 356 HG22 VAL 88 1HG2 VAL 88 -13.590 -9.759 -0.390 357 HG23 VAL 88 2HG2 VAL 88 -13.096 -8.066 -0.344 358 H LEU 89 H LEU 89 -12.340 -9.122 2.020 359 HA LEU 89 HA LEU 89 -11.424 -6.344 2.330 360 HB2 LEU 89 1HB LEU 89 -10.113 -8.549 3.874 361 HB3 LEU 89 2HB LEU 89 -10.076 -6.821 4.168 362 HG LEU 89 HG LEU 89 -12.596 -8.423 4.526 363 HD11 LEU 89 1HD1 LEU 89 -10.421 -7.922 6.548 364 HD12 LEU 89 2HD1 LEU 89 -10.954 -9.485 5.927 365 HD13 LEU 89 3HD1 LEU 89 -12.036 -8.517 6.930 366 HD21 LEU 89 3HD2 LEU 89 -13.360 -6.331 4.769 367 HD22 LEU 89 1HD2 LEU 89 -11.741 -5.659 4.953 368 HD23 LEU 89 2HD2 LEU 89 -12.561 -6.376 6.341 369 H TYR 90 H TYR 90 -8.947 -6.259 2.182 370 HA TYR 90 HA TYR 90 -8.064 -8.037 0.005 371 HB2 TYR 90 1HB TYR 90 -8.126 -5.131 0.213 372 HB3 TYR 90 2HB TYR 90 -6.513 -5.730 -0.160 373 HD1 TYR 90 HD1 TYR 90 -7.308 -8.151 -1.770 374 HD2 TYR 90 HD2 TYR 90 -8.712 -4.137 -1.847 375 HE1 TYR 90 HE1 TYR 90 -7.954 -8.431 -4.117 376 HE2 TYR 90 HE2 TYR 90 -9.364 -4.406 -4.201 377 HH TYR 90 HH TYR 90 -9.590 -7.385 -5.723 378 H LYS 91 H LYS 91 -6.735 -9.478 0.950 379 HA LYS 91 HA LYS 91 -5.104 -8.903 3.212 380 HB2 LYS 91 1HB LYS 91 -5.926 -11.176 2.671 381 HB3 LYS 91 2HB LYS 91 -4.908 -11.191 1.236 382 HG2 LYS 91 1HG LYS 91 -2.922 -11.172 2.557 383 HG3 LYS 91 2HG LYS 91 -3.846 -10.909 4.037 384 HD2 LYS 91 1HD LYS 91 -3.169 -13.233 3.878 385 HD3 LYS 91 2HD LYS 91 -4.923 -13.103 3.729 386 HE2 LYS 91 1HE LYS 91 -4.925 -13.866 1.611 387 HE3 LYS 91 2HE LYS 91 -3.467 -12.974 1.184 388 HZ1 LYS 91 3HZ LYS 91 -3.527 -15.604 1.374 389 HZ2 LYS 91 1HZ LYS 91 -3.133 -15.248 2.980 390 HZ3 LYS 91 2HZ LYS 91 -2.139 -14.704 1.724 391 H VAL 92 H VAL 92 -3.833 -7.119 2.728 392 HA VAL 92 HA VAL 92 -1.883 -7.430 0.548 393 HB VAL 92 HB VAL 92 -1.586 -5.045 0.573 394 HG11 VAL 92 1HG1 VAL 92 -4.227 -6.252 0.249 395 HG12 VAL 92 2HG1 VAL 92 -3.322 -5.187 -0.827 396 HG13 VAL 92 3HG1 VAL 92 -4.269 -4.506 0.497 397 HG21 VAL 92 3HG2 VAL 92 -3.429 -5.042 2.964 398 HG22 VAL 92 1HG2 VAL 92 -2.916 -3.597 2.093 399 HG23 VAL 92 2HG2 VAL 92 -1.724 -4.586 2.941 400 H LEU 93 H LEU 93 0.324 -6.879 0.895 401 HA LEU 93 HA LEU 93 1.208 -7.353 3.653 402 HB2 LEU 93 1HB LEU 93 2.074 -8.319 1.129 403 HB3 LEU 93 2HB LEU 93 3.367 -7.321 1.766 404 HG LEU 93 HG LEU 93 2.101 -9.605 3.278 405 HD11 LEU 93 1HD1 LEU 93 3.925 -10.967 2.673 406 HD12 LEU 93 2HD1 LEU 93 4.796 -9.615 1.949 407 HD13 LEU 93 3HD1 LEU 93 3.346 -10.248 1.170 408 HD21 LEU 93 3HD2 LEU 93 3.085 -7.948 4.734 409 HD22 LEU 93 1HD2 LEU 93 4.570 -7.950 3.784 410 HD23 LEU 93 2HD2 LEU 93 4.106 -9.384 4.700 411 H PHE 94 H PHE 94 2.279 -5.820 4.791 412 HA PHE 94 HA PHE 94 2.595 -3.202 3.519 413 HB2 PHE 94 1HB PHE 94 2.427 -4.173 6.338 414 HB3 PHE 94 2HB PHE 94 3.223 -2.642 6.024 415 HD1 PHE 94 HD1 PHE 94 0.089 -4.316 4.802 416 HD2 PHE 94 HD2 PHE 94 1.913 -0.842 6.466 417 HE1 PHE 94 HE1 PHE 94 -2.087 -3.177 4.810 418 HE2 PHE 94 HE2 PHE 94 -0.264 0.298 6.471 419 HZ PHE 94 HZ PHE 94 -2.268 -0.867 5.645 420 H PHE 95 H PHE 95 4.545 -1.932 3.863 421 HA PHE 95 HA PHE 95 6.956 -3.479 4.466 422 HB2 PHE 95 1HB PHE 95 6.753 -1.738 2.002 423 HB3 PHE 95 2HB PHE 95 8.093 -2.777 2.469 424 HD1 PHE 95 HD2 PHE 95 7.477 -5.319 2.740 425 HD2 PHE 95 HD1 PHE 95 5.243 -2.515 0.449 426 HE1 PHE 95 HE2 PHE 95 6.497 -7.162 1.444 427 HE2 PHE 95 HE1 PHE 95 4.259 -4.352 -0.851 428 HZ PHE 95 HZ PHE 95 4.885 -6.681 -0.354 429 HA PRO 96 HA PRO 96 9.016 -3.183 4.474 430 HB2 PRO 96 1HB PRO 96 10.986 -2.769 6.231 431 HB3 PRO 96 2HB PRO 96 10.901 -1.856 4.721 432 HG2 PRO 96 1HG PRO 96 10.167 -1.015 7.489 433 HG3 PRO 96 2HG PRO 96 10.940 -0.080 6.198 434 HD2 PRO 96 1HD PRO 96 8.234 0.002 6.869 435 HD3 PRO 96 2HD PRO 96 8.939 0.574 5.345 436 H ASP 97 H ASP 97 10.215 -4.663 6.319 437 HA ASP 97 HA ASP 97 10.034 -6.052 8.110 438 HB2 ASP 97 1HB ASP 97 7.706 -4.440 9.139 439 HB3 ASP 97 2HB ASP 97 8.800 -5.475 10.047 440 H PHE 98 H PHE 98 7.567 -5.547 5.862 441 HA PHE 98 HA PHE 98 5.874 -6.833 5.068 442 HB2 PHE 98 1HB PHE 98 7.602 -8.888 6.422 443 HB3 PHE 98 2HB PHE 98 6.124 -9.344 5.583 444 HD1 PHE 98 HD2 PHE 98 9.081 -7.146 4.912 445 HD2 PHE 98 HD1 PHE 98 6.422 -10.140 3.474 446 HE1 PHE 98 HE2 PHE 98 10.307 -7.205 2.778 447 HE2 PHE 98 HE1 PHE 98 7.642 -10.206 1.342 448 HZ PHE 98 HZ PHE 98 9.586 -8.738 0.989 449 H ASN 99 H ASN 99 4.509 -5.561 6.581 450 HA ASN 99 HA ASN 99 3.355 -7.272 8.684 451 HB2 ASN 99 1HB ASN 99 3.304 -4.261 8.525 452 HB3 ASN 99 2HB ASN 99 2.627 -5.244 9.814 453 HD21 ASN 99 2HD2 ASN 99 3.898 -4.163 11.339 454 HD22 ASN 99 1HD2 ASN 99 5.596 -4.492 11.498 455 H PHE 100 H PHE 100 2.232 -8.087 6.649 456 HA PHE 100 HA PHE 100 0.368 -6.732 5.173 457 HB2 PHE 100 1HB PHE 100 -0.896 -8.983 5.131 458 HB3 PHE 100 2HB PHE 100 0.745 -8.932 4.504 459 HD1 PHE 100 HD2 PHE 100 2.623 -9.750 5.956 460 HD2 PHE 100 HD1 PHE 100 -1.470 -10.386 6.910 461 HE1 PHE 100 HE2 PHE 100 3.264 -11.588 7.461 462 HE2 PHE 100 HE1 PHE 100 -0.841 -12.214 8.425 463 HZ PHE 100 HZ PHE 100 1.534 -12.822 8.698 464 H ALA 101 H ALA 101 -1.991 -6.764 5.250 465 HA ALA 101 HA ALA 101 -3.240 -6.905 7.875 466 HB1 ALA 101 3HB ALA 101 -2.429 -4.410 6.642 467 HB2 ALA 101 1HB ALA 101 -3.029 -4.719 8.268 468 HB3 ALA 101 2HB ALA 101 -4.166 -4.457 6.947 469 H TRP 102 H TRP 102 -5.622 -6.429 7.725 470 HA TRP 102 HA TRP 102 -6.704 -7.291 5.117 471 HB2 TRP 102 1HB TRP 102 -7.827 -7.908 7.862 472 HB3 TRP 102 2HB TRP 102 -8.480 -8.456 6.323 473 HD1 TRP 102 HD1 TRP 102 -5.521 -9.282 5.130 474 HE1 TRP 102 HE1 TRP 102 -4.489 -11.487 5.960 475 HE3 TRP 102 HE3 TRP 102 -8.212 -9.870 9.440 476 HZ2 TRP 102 HZ2 TRP 102 -4.777 -13.244 8.149 477 HZ3 TRP 102 HZ3 TRP 102 -7.772 -11.840 10.845 478 HH2 TRP 102 HH2 TRP 102 -6.089 -13.492 10.211 479 H VAL 103 H VAL 103 -7.500 -5.488 4.211 480 HA VAL 103 HA VAL 103 -9.524 -3.982 5.712 481 HB VAL 103 HB VAL 103 -8.701 -1.849 4.762 482 HG11 VAL 103 1HG1 VAL 103 -8.026 -2.847 7.049 483 HG12 VAL 103 2HG1 VAL 103 -7.146 -1.447 6.433 484 HG13 VAL 103 3HG1 VAL 103 -6.440 -3.058 6.304 485 HG21 VAL 103 3HG2 VAL 103 -6.946 -3.615 3.319 486 HG22 VAL 103 1HG2 VAL 103 -6.014 -2.418 4.218 487 HG23 VAL 103 2HG2 VAL 103 -7.252 -1.896 3.076 488 H LYS 104 H LYS 104 -11.146 -3.013 4.421 489 HA LYS 104 HA LYS 104 -11.804 -4.440 2.073 490 HB2 LYS 104 1HB LYS 104 -12.960 -1.825 3.052 491 HB3 LYS 104 2HB LYS 104 -13.693 -2.900 1.872 492 HG2 LYS 104 1HG LYS 104 -13.575 -4.655 3.776 493 HG3 LYS 104 2HG LYS 104 -13.405 -3.244 4.822 494 HD2 LYS 104 1HD LYS 104 -15.551 -2.621 4.537 495 HD3 LYS 104 2HD LYS 104 -15.553 -3.055 2.827 496 HE2 LYS 104 1HE LYS 104 -15.519 -5.494 3.700 497 HE3 LYS 104 2HE LYS 104 -16.063 -4.783 5.219 498 HZ1 LYS 104 3HZ LYS 104 -17.507 -3.987 2.814 499 HZ2 LYS 104 1HZ LYS 104 -18.086 -4.298 4.373 500 HZ3 LYS 104 2HZ LYS 104 -17.730 -5.581 3.332 501 H ARG 105 H ARG 105 -12.203 -3.514 -0.067 502 HA ARG 105 HA ARG 105 -9.927 -2.315 -1.173 503 HB2 ARG 105 1HB ARG 105 -12.656 -2.205 -2.444 504 HB3 ARG 105 2HB ARG 105 -11.089 -2.266 -3.240 505 HG2 ARG 105 1HG ARG 105 -11.239 -4.464 -3.369 506 HG3 ARG 105 2HG ARG 105 -11.320 -4.573 -1.610 507 HD2 ARG 105 1HD ARG 105 -13.265 -5.648 -2.450 508 HD3 ARG 105 2HD ARG 105 -13.782 -4.094 -1.800 509 HE ARG 105 HE ARG 105 -14.518 -3.553 -3.880 510 HH11 ARG 105 1HH1 ARG 105 -12.077 -6.036 -4.229 511 HH12 ARG 105 2HH1 ARG 105 -12.243 -6.131 -5.949 512 HH21 ARG 105 1HH2 ARG 105 -14.744 -3.691 -6.148 513 HH22 ARG 105 2HH2 ARG 105 -13.762 -4.804 -7.039 514 H ASN 106 H ASN 106 -12.702 -0.878 0.330 515 HA ASN 106 HA ASN 106 -12.771 1.615 -0.901 516 HB2 ASN 106 1HB ASN 106 -13.625 2.439 1.377 517 HB3 ASN 106 2HB ASN 106 -14.551 1.186 0.560 518 HD21 ASN 106 2HD2 ASN 106 -15.491 0.324 2.348 519 HD22 ASN 106 1HD2 ASN 106 -14.605 -0.499 3.595 520 H SER 107 H SER 107 -10.588 0.387 1.575 521 HA SER 107 HA SER 107 -9.270 3.004 1.724 522 HB2 SER 107 1HB SER 107 -8.337 0.702 3.377 523 HB3 SER 107 2HB SER 107 -8.441 2.411 3.787 524 HG SER 107 HG SER 107 -10.193 0.458 4.304 525 H VAL 108 H VAL 108 -9.111 0.743 -0.446 526 HA VAL 108 HA VAL 108 -6.167 0.677 -0.571 527 HB VAL 108 HB VAL 108 -8.101 -1.401 -1.595 528 HG11 VAL 108 1HG1 VAL 108 -6.308 -1.354 -3.130 529 HG12 VAL 108 2HG1 VAL 108 -5.959 -2.690 -2.033 530 HG13 VAL 108 3HG1 VAL 108 -5.113 -1.154 -1.848 531 HG21 VAL 108 3HG2 VAL 108 -7.907 -1.580 0.779 532 HG22 VAL 108 1HG2 VAL 108 -6.153 -1.424 0.702 533 HG23 VAL 108 2HG2 VAL 108 -6.938 -2.868 0.063 534 H LYS 109 H LYS 109 -5.200 0.894 -2.630 535 HA LYS 109 HA LYS 109 -6.853 1.514 -4.933 536 HB2 LYS 109 1HB LYS 109 -5.202 3.561 -3.488 537 HB3 LYS 109 2HB LYS 109 -5.449 3.688 -5.225 538 HG2 LYS 109 1HG LYS 109 -7.992 3.292 -4.326 539 HG3 LYS 109 2HG LYS 109 -7.282 4.234 -3.015 540 HD2 LYS 109 1HD LYS 109 -6.633 5.226 -5.697 541 HD3 LYS 109 2HD LYS 109 -8.352 5.276 -5.304 542 HE2 LYS 109 1HE LYS 109 -8.065 6.797 -3.619 543 HE3 LYS 109 2HE LYS 109 -6.418 6.266 -3.272 544 HZ1 LYS 109 3HZ LYS 109 -7.090 7.672 -5.787 545 HZ2 LYS 109 1HZ LYS 109 -5.575 7.483 -5.055 546 HZ3 LYS 109 2HZ LYS 109 -6.721 8.523 -4.373 547 HA PRO 110 HA PRO 110 -3.403 -0.161 -7.123 548 HB2 PRO 110 1HB PRO 110 -3.783 1.668 -9.363 549 HB3 PRO 110 2HB PRO 110 -4.120 -0.063 -9.272 550 HG2 PRO 110 1HG PRO 110 -6.075 1.810 -9.428 551 HG3 PRO 110 2HG PRO 110 -6.288 0.263 -8.591 552 HD2 PRO 110 1HD PRO 110 -5.719 2.974 -7.451 553 HD3 PRO 110 2HD PRO 110 -6.820 1.710 -6.861 554 H LEU 111 H LEU 111 -1.295 0.184 -6.793 555 HA LEU 111 HA LEU 111 -0.288 2.940 -6.775 556 HB2 LEU 111 1HB LEU 111 0.015 1.258 -4.822 557 HB3 LEU 111 2HB LEU 111 1.257 0.546 -5.834 558 HG LEU 111 HG LEU 111 2.528 2.604 -5.816 559 HD11 LEU 111 1HD1 LEU 111 0.156 3.704 -4.335 560 HD12 LEU 111 2HD1 LEU 111 0.885 4.293 -5.828 561 HD13 LEU 111 3HD1 LEU 111 1.743 4.473 -4.299 562 HD21 LEU 111 3HD2 LEU 111 2.707 2.829 -3.203 563 HD22 LEU 111 1HD2 LEU 111 3.226 1.356 -4.024 564 HD23 LEU 111 2HD2 LEU 111 1.654 1.414 -3.228 565 H LEU 112 H LEU 112 1.404 3.605 -8.067 566 HA LEU 112 HA LEU 112 2.193 1.722 -10.192 567 HB2 LEU 112 1HB LEU 112 2.053 4.732 -10.246 568 HB3 LEU 112 2HB LEU 112 2.617 3.729 -11.567 569 HG LEU 112 HG LEU 112 -0.187 3.806 -10.452 570 HD11 LEU 112 1HD1 LEU 112 0.004 5.690 -11.763 571 HD12 LEU 112 2HD1 LEU 112 -0.551 4.492 -12.932 572 HD13 LEU 112 3HD1 LEU 112 1.156 4.935 -12.865 573 HD21 LEU 112 3HD2 LEU 112 1.199 1.895 -12.234 574 HD22 LEU 112 1HD2 LEU 112 -0.414 2.410 -12.725 575 HD23 LEU 112 2HD2 LEU 112 -0.171 1.651 -11.151 576 H ASP 113 H ASP 113 4.333 2.451 -11.262 577 HA ASP 113 HA ASP 113 6.355 2.354 -9.211 578 HB2 ASP 113 1HB ASP 113 6.261 1.321 -11.705 579 HB3 ASP 113 2HB ASP 113 7.173 2.794 -12.027 580 H SER 114 H SER 114 5.197 4.713 -11.568 581 HA SER 114 HA SER 114 7.235 6.638 -11.102 582 HB2 SER 114 1HB SER 114 5.302 6.389 -12.989 583 HB3 SER 114 2HB SER 114 4.575 7.621 -11.959 584 HG SER 114 HG SER 114 6.647 7.829 -13.694 585 H GLU 115 H GLU 115 4.004 6.116 -9.742 586 HA GLU 115 HA GLU 115 3.855 8.471 -8.220 587 HB2 GLU 115 1HB GLU 115 2.558 5.769 -7.916 588 HB3 GLU 115 2HB GLU 115 2.248 7.077 -6.782 589 HG2 GLU 115 1HG GLU 115 1.759 8.395 -9.037 590 HG3 GLU 115 2HG GLU 115 1.401 6.763 -9.599 591 H ILE 116 H ILE 116 5.025 5.223 -7.329 592 HA ILE 116 HA ILE 116 5.707 5.928 -4.667 593 HB ILE 116 HB ILE 116 6.909 3.707 -6.330 594 HG12 ILE 116 1HG1 ILE 116 4.653 3.379 -4.363 595 HG13 ILE 116 2HG1 ILE 116 4.332 3.792 -6.043 596 HG21 ILE 116 1HG2 ILE 116 7.603 2.711 -4.308 597 HG22 ILE 116 2HG2 ILE 116 6.630 3.819 -3.339 598 HG23 ILE 116 3HG2 ILE 116 8.061 4.408 -4.182 599 HD11 ILE 116 3HD1 ILE 116 4.211 1.562 -6.264 600 HD12 ILE 116 1HD1 ILE 116 5.223 1.256 -4.853 601 HD13 ILE 116 2HD1 ILE 116 5.965 1.690 -6.392 602 H ALA 117 H ALA 117 7.487 5.872 -7.711 603 HA ALA 117 HA ALA 117 10.072 6.381 -6.810 604 HB1 ALA 117 3HB ALA 117 9.498 5.821 -9.131 605 HB2 ALA 117 1HB ALA 117 10.483 7.282 -9.040 606 HB3 ALA 117 2HB ALA 117 8.743 7.406 -9.316 607 H LYS 118 H LYS 118 7.728 8.740 -8.050 608 HA LYS 118 HA LYS 118 9.166 11.028 -7.272 609 HB2 LYS 118 1HB LYS 118 7.594 12.008 -8.524 610 HB3 LYS 118 2HB LYS 118 6.831 10.435 -8.694 611 HG2 LYS 118 1HG LYS 118 6.197 12.008 -6.265 612 HG3 LYS 118 2HG LYS 118 5.513 12.532 -7.807 613 HD2 LYS 118 1HD LYS 118 5.255 9.714 -7.659 614 HD3 LYS 118 2HD LYS 118 4.677 10.390 -6.130 615 HE2 LYS 118 1HE LYS 118 3.480 12.089 -7.805 616 HE3 LYS 118 2HE LYS 118 3.603 10.696 -8.881 617 HZ1 LYS 118 3HZ LYS 118 2.630 9.482 -6.774 618 HZ2 LYS 118 1HZ LYS 118 1.619 10.258 -7.887 619 HZ3 LYS 118 2HZ LYS 118 2.027 11.025 -6.437 620 H PHE 119 H PHE 119 6.596 9.177 -5.693 621 HA PHE 119 HA PHE 119 5.922 10.821 -3.595 622 HB2 PHE 119 1HB PHE 119 4.829 8.676 -3.863 623 HB3 PHE 119 2HB PHE 119 6.337 7.821 -3.549 624 HD1 PHE 119 HD2 PHE 119 7.349 7.937 -1.260 625 HD2 PHE 119 HD1 PHE 119 3.417 9.333 -2.102 626 HE1 PHE 119 HE2 PHE 119 6.803 7.827 1.136 627 HE2 PHE 119 HE1 PHE 119 2.870 9.231 0.295 628 HZ PHE 119 HZ PHE 119 4.568 8.477 1.907 629 H LEU 120 H LEU 120 8.552 8.422 -3.521 630 HA LEU 120 HA LEU 120 9.567 9.197 -1.021 631 HB2 LEU 120 1HB LEU 120 10.977 7.891 -3.343 632 HB3 LEU 120 2HB LEU 120 11.602 8.000 -1.709 633 HG LEU 120 HG LEU 120 8.926 6.773 -1.952 634 HD11 LEU 120 1HD1 LEU 120 9.703 4.669 -2.782 635 HD12 LEU 120 2HD1 LEU 120 11.367 5.246 -2.854 636 HD13 LEU 120 3HD1 LEU 120 10.157 5.908 -3.952 637 HD21 LEU 120 3HD2 LEU 120 10.439 7.035 0.109 638 HD22 LEU 120 1HD2 LEU 120 11.354 5.688 -0.566 639 HD23 LEU 120 2HD2 LEU 120 9.650 5.484 -0.159 640 H GLY 121 H GLY 121 10.135 10.408 -4.273 641 HA2 GLY 121 1HA GLY 121 12.289 12.154 -3.341 642 HA3 GLY 121 2HA GLY 121 11.777 11.934 -5.006 643 H SER 122 H SER 122 9.303 12.434 -2.635 644 HA SER 122 HA SER 122 8.357 14.771 -3.933 645 HB2 SER 122 1HB SER 122 7.592 13.226 -1.488 646 HB3 SER 122 2HB SER 122 6.926 14.842 -1.703 647 HG SER 122 HG SER 122 6.724 12.673 -3.519 648 H SER 123 H SER 123 7.620 16.603 -2.166 649 HA SER 123 HA SER 123 9.916 17.405 -0.556 650 HB2 SER 123 1HB SER 123 9.632 19.767 -1.680 651 HB3 SER 123 2HB SER 123 10.630 18.533 -2.448 652 HG SER 123 HG SER 123 8.263 19.650 -3.280 653 H LYS 124 H LYS 124 7.089 16.628 -0.058 654 HA LYS 124 HA LYS 124 6.249 19.083 1.338 655 HB2 LYS 124 1HB LYS 124 3.961 18.596 0.954 656 HB3 LYS 124 2HB LYS 124 4.770 18.432 -0.598 657 HG2 LYS 124 1HG LYS 124 4.633 15.921 0.883 658 HG3 LYS 124 2HG LYS 124 3.051 16.614 0.529 659 HD2 LYS 124 1HD LYS 124 5.158 16.382 -1.595 660 HD3 LYS 124 2HD LYS 124 4.097 15.027 -1.204 661 HE2 LYS 124 1HE LYS 124 2.366 15.944 -2.283 662 HE3 LYS 124 2HE LYS 124 2.639 17.520 -1.543 663 HZ1 LYS 124 3HZ LYS 124 3.580 18.257 -3.397 664 HZ2 LYS 124 1HZ LYS 124 3.091 16.830 -4.165 665 HZ3 LYS 124 2HZ LYS 124 4.636 16.939 -3.487 666 H ARG 125 H ARG 125 6.292 15.541 1.389 667 HA ARG 125 HA ARG 125 6.260 15.662 4.314 668 HB2 ARG 125 1HB ARG 125 3.988 15.016 3.258 669 HB3 ARG 125 2HB ARG 125 4.774 13.500 2.835 670 HG2 ARG 125 1HG ARG 125 3.638 13.101 4.850 671 HG3 ARG 125 2HG ARG 125 5.340 13.259 5.287 672 HD2 ARG 125 1HD ARG 125 4.808 15.714 5.752 673 HD3 ARG 125 2HD ARG 125 3.112 15.238 5.674 674 HE ARG 125 HE ARG 125 4.667 13.626 7.468 675 HH11 ARG 125 1HH1 ARG 125 2.843 16.604 7.171 676 HH12 ARG 125 2HH1 ARG 125 2.507 16.708 8.866 677 HH21 ARG 125 1HH2 ARG 125 4.220 13.775 9.700 678 HH22 ARG 125 2HH2 ARG 125 3.288 15.106 10.300 679 H LYS 126 H LYS 126 8.298 15.120 4.654 680 HA LYS 126 HA LYS 126 9.279 12.600 3.486 681 HB2 LYS 126 1HB LYS 126 10.382 15.003 2.975 682 HB3 LYS 126 2HB LYS 126 11.257 14.594 4.444 683 HG2 LYS 126 1HG LYS 126 12.557 13.871 2.587 684 HG3 LYS 126 2HG LYS 126 11.903 12.437 3.380 685 HD2 LYS 126 1HD LYS 126 11.528 11.977 1.140 686 HD3 LYS 126 2HD LYS 126 9.984 12.665 1.645 687 HE2 LYS 126 1HE LYS 126 10.191 14.117 -0.026 688 HE3 LYS 126 2HE LYS 126 11.506 14.861 0.883 689 HZ1 LYS 126 3HZ LYS 126 13.098 13.694 -0.331 690 HZ2 LYS 126 1HZ LYS 126 11.966 14.158 -1.501 691 HZ3 LYS 126 2HZ LYS 126 11.983 12.566 -0.924 692 H SER 127 H SER 127 9.153 11.087 5.011 693 HA SER 127 HA SER 127 10.331 11.665 7.638 694 HB2 SER 127 1HB SER 127 7.752 11.666 7.625 695 HB3 SER 127 2HB SER 127 7.881 9.928 7.356 696 HG SER 127 HG SER 127 8.290 11.378 9.635 697 H LYS 128 H LYS 128 11.486 9.968 8.549 698 HA LYS 128 HA LYS 128 12.650 8.101 6.826 699 HB2 LYS 128 1HB LYS 128 13.368 8.953 9.215 700 HB3 LYS 128 2HB LYS 128 12.491 7.531 9.763 701 HG2 LYS 128 1HG LYS 128 13.931 6.078 8.537 702 HG3 LYS 128 2HG LYS 128 14.706 7.442 7.730 703 HD2 LYS 128 1HD LYS 128 15.092 8.089 10.340 704 HD3 LYS 128 2HD LYS 128 15.149 6.326 10.415 705 HE2 LYS 128 1HE LYS 128 16.946 6.223 8.885 706 HE3 LYS 128 2HE LYS 128 16.740 7.910 8.414 707 HZ1 LYS 128 3HZ LYS 128 18.597 7.813 9.846 708 HZ2 LYS 128 1HZ LYS 128 17.780 6.868 10.987 709 HZ3 LYS 128 2HZ LYS 128 17.343 8.487 10.760 710 H GLU 129 H GLU 129 9.883 7.820 8.995 711 HA GLU 129 HA GLU 129 9.531 5.007 8.607 712 HB2 GLU 129 1HB GLU 129 7.833 7.187 9.796 713 HB3 GLU 129 2HB GLU 129 7.194 5.565 9.565 714 HG2 GLU 129 1HG GLU 129 8.780 4.630 11.052 715 HG3 GLU 129 2HG GLU 129 9.714 6.123 11.098 716 H LEU 130 H LEU 130 8.374 7.918 7.010 717 HA LEU 130 HA LEU 130 6.382 6.514 5.473 718 HB2 LEU 130 1HB LEU 130 6.143 8.902 6.106 719 HB3 LEU 130 2HB LEU 130 7.498 9.288 5.063 720 HG LEU 130 HG LEU 130 6.132 8.322 3.148 721 HD11 LEU 130 1HD1 LEU 130 3.626 8.489 3.603 722 HD12 LEU 130 2HD1 LEU 130 4.054 8.362 5.308 723 HD13 LEU 130 3HD1 LEU 130 4.468 7.057 4.195 724 HD21 LEU 130 3HD2 LEU 130 4.623 10.637 4.196 725 HD22 LEU 130 1HD2 LEU 130 5.403 10.401 2.633 726 HD23 LEU 130 2HD2 LEU 130 6.369 10.833 4.044 727 H ILE 131 H ILE 131 9.582 7.923 4.786 728 HA ILE 131 HA ILE 131 9.644 7.254 2.059 729 HB ILE 131 HB ILE 131 11.997 7.443 3.949 730 HG12 ILE 131 1HG1 ILE 131 11.059 9.589 2.055 731 HG13 ILE 131 2HG1 ILE 131 10.412 9.470 3.688 732 HG21 ILE 131 1HG2 ILE 131 12.441 8.173 1.171 733 HG22 ILE 131 2HG2 ILE 131 11.942 6.491 1.357 734 HG23 ILE 131 3HG2 ILE 131 13.360 7.090 2.218 735 HD11 ILE 131 3HD1 ILE 131 12.153 10.581 4.470 736 HD12 ILE 131 1HD1 ILE 131 12.780 10.730 2.828 737 HD13 ILE 131 2HD1 ILE 131 13.250 9.357 3.830 738 H GLU 132 H GLU 132 11.024 5.506 4.857 739 HA GLU 132 HA GLU 132 12.008 3.296 3.512 740 HB2 GLU 132 1HB GLU 132 11.041 3.786 6.282 741 HB3 GLU 132 2HB GLU 132 11.223 2.111 5.782 742 HG2 GLU 132 1HG GLU 132 13.511 3.771 5.087 743 HG3 GLU 132 2HG GLU 132 13.192 3.706 6.818 744 H ALA 133 H ALA 133 8.709 4.144 4.255 745 HA ALA 133 HA ALA 133 7.554 1.594 3.885 746 HB1 ALA 133 3HB ALA 133 6.564 3.771 4.911 747 HB2 ALA 133 1HB ALA 133 5.508 2.648 4.052 748 HB3 ALA 133 2HB ALA 133 6.081 4.111 3.249 749 H TYR 134 H TYR 134 7.568 4.412 1.708 750 HA TYR 134 HA TYR 134 6.642 2.869 -0.505 751 HB2 TYR 134 1HB TYR 134 7.647 5.665 -0.156 752 HB3 TYR 134 2HB TYR 134 7.552 4.993 -1.783 753 HD1 TYR 134 HD1 TYR 134 5.409 5.154 1.286 754 HD2 TYR 134 HD2 TYR 134 5.610 5.422 -2.952 755 HE1 TYR 134 HE1 TYR 134 3.015 5.702 1.215 756 HE2 TYR 134 HE2 TYR 134 3.216 5.972 -3.038 757 HH TYR 134 HH TYR 134 1.187 5.840 -0.182 758 H GLU 135 H GLU 135 9.781 3.567 0.803 759 HA GLU 135 HA GLU 135 11.253 2.844 -1.546 760 HB2 GLU 135 1HB GLU 135 11.949 4.188 0.667 761 HB3 GLU 135 2HB GLU 135 12.496 2.585 1.142 762 HG2 GLU 135 1HG GLU 135 13.311 3.287 -1.554 763 HG3 GLU 135 2HG GLU 135 13.903 4.424 -0.348 764 H ALA 136 H ALA 136 9.881 1.158 1.197 765 HA ALA 136 HA ALA 136 11.371 -1.273 0.738 766 HB1 ALA 136 3HB ALA 136 10.626 -0.681 2.985 767 HB2 ALA 136 1HB ALA 136 9.944 -2.226 2.475 768 HB3 ALA 136 2HB ALA 136 8.946 -0.772 2.458 769 H SER 137 H SER 137 8.269 0.048 -0.216 770 HA SER 137 HA SER 137 7.299 -2.464 -1.271 771 HB2 SER 137 1HB SER 137 5.303 -1.290 -1.821 772 HB3 SER 137 2HB SER 137 5.836 -0.640 -0.270 773 HG SER 137 HG SER 137 5.864 0.552 -2.810 774 H LYS 138 H LYS 138 9.140 0.227 -2.423 775 HA LYS 138 HA LYS 138 8.526 0.235 -5.135 776 HB2 LYS 138 1HB LYS 138 10.020 1.848 -3.837 777 HB3 LYS 138 2HB LYS 138 11.308 0.675 -4.063 778 HG2 LYS 138 1HG LYS 138 11.604 2.226 -5.781 779 HG3 LYS 138 2HG LYS 138 10.810 0.855 -6.558 780 HD2 LYS 138 1HD LYS 138 8.624 2.168 -5.989 781 HD3 LYS 138 2HD LYS 138 9.713 3.553 -5.878 782 HE2 LYS 138 1HE LYS 138 9.490 1.719 -8.260 783 HE3 LYS 138 2HE LYS 138 8.689 3.281 -8.118 784 HZ1 LYS 138 3HZ LYS 138 11.606 2.755 -8.233 785 HZ2 LYS 138 1HZ LYS 138 10.953 4.262 -7.825 786 HZ3 LYS 138 2HZ LYS 138 10.664 3.600 -9.356 787 H THR 139 H THR 139 10.949 -1.719 -3.405 788 HA THR 139 HA THR 139 12.219 -2.989 -5.484 789 HB THR 139 HB THR 139 12.105 -5.059 -3.820 790 HG1 THR 139 HG1 THR 139 11.655 -3.002 -1.966 791 HG21 THR 139 3HG2 THR 139 13.644 -3.271 -2.321 792 HG22 THR 139 1HG2 THR 139 13.794 -2.765 -4.003 793 HG23 THR 139 2HG2 THR 139 14.191 -4.419 -3.543 794 HA PRO 140 HA PRO 140 8.542 -4.781 -7.486 795 HB2 PRO 140 1HB PRO 140 10.710 -5.763 -9.269 796 HB3 PRO 140 2HB PRO 140 9.182 -4.978 -9.682 797 HG2 PRO 140 1HG PRO 140 11.464 -3.631 -9.830 798 HG3 PRO 140 2HG PRO 140 9.996 -2.852 -9.209 799 HD2 PRO 140 1HD PRO 140 12.362 -3.912 -7.712 800 HD3 PRO 140 2HD PRO 140 11.404 -2.445 -7.416 801 HA PRO 141 HA PRO 141 11.018 -9.209 -7.316 802 HB2 PRO 141 1HB PRO 141 12.423 -8.200 -4.863 803 HB3 PRO 141 2HB PRO 141 12.914 -9.479 -5.984 804 HG2 PRO 141 1HG PRO 141 14.006 -7.096 -6.190 805 HG3 PRO 141 2HG PRO 141 13.489 -7.947 -7.659 806 HD2 PRO 141 1HD PRO 141 12.221 -5.651 -6.246 807 HD3 PRO 141 2HD PRO 141 12.282 -6.008 -7.983 808 H ASP 142 H ASP 142 9.834 -7.175 -4.641 809 HA ASP 142 HA ASP 142 9.149 -9.216 -2.857 810 HB2 ASP 142 1HB ASP 142 7.527 -7.597 -1.875 811 HB3 ASP 142 2HB ASP 142 9.133 -6.929 -2.102 812 H LEU 143 H LEU 143 7.951 -10.943 -3.280 813 HA LEU 143 HA LEU 143 6.181 -12.255 -3.847 814 HB2 LEU 143 1HB LEU 143 4.949 -10.170 -2.881 815 HB3 LEU 143 2HB LEU 143 4.555 -9.834 -4.552 816 HG LEU 143 HG LEU 143 2.703 -10.962 -3.609 817 HD11 LEU 143 1HD1 LEU 143 2.497 -12.922 -4.982 818 HD12 LEU 143 2HD1 LEU 143 4.246 -13.012 -5.177 819 HD13 LEU 143 3HD1 LEU 143 3.347 -11.665 -5.877 820 HD21 LEU 143 3HD2 LEU 143 4.360 -12.040 -1.819 821 HD22 LEU 143 1HD2 LEU 143 4.177 -13.425 -2.895 822 HD23 LEU 143 2HD2 LEU 143 2.757 -12.695 -2.149 823 H LYS 144 H LYS 144 5.602 -9.515 -6.062 824 HA LYS 144 HA LYS 144 5.581 -9.359 -8.333 825 HB2 LYS 144 1HB LYS 144 8.006 -10.218 -7.826 826 HB3 LYS 144 2HB LYS 144 7.425 -11.714 -8.542 827 HG2 LYS 144 1HG LYS 144 8.221 -10.773 -10.425 828 HG3 LYS 144 2HG LYS 144 6.636 -9.995 -10.437 829 HD2 LYS 144 1HD LYS 144 7.895 -8.204 -8.956 830 HD3 LYS 144 2HD LYS 144 9.313 -8.865 -9.773 831 HE2 LYS 144 1HE LYS 144 6.907 -7.532 -10.993 832 HE3 LYS 144 2HE LYS 144 8.593 -7.028 -11.077 833 HZ1 LYS 144 3HZ LYS 144 8.393 -8.005 -13.098 834 HZ2 LYS 144 1HZ LYS 144 7.191 -9.088 -12.603 835 HZ3 LYS 144 2HZ LYS 144 8.810 -9.387 -12.217 836 H GLU 145 H GLU 145 3.362 -10.388 -7.682 837 HA GLU 145 HA GLU 145 1.592 -11.642 -8.330 838 HB2 GLU 145 1HB GLU 145 3.455 -11.871 -10.610 839 HB3 GLU 145 2HB GLU 145 2.207 -13.107 -10.525 840 HG2 GLU 145 1HG GLU 145 0.749 -10.873 -10.068 841 HG3 GLU 145 2HG GLU 145 1.998 -10.251 -11.147 842 H GLU 146 H GLU 146 4.083 -13.906 -9.467 843 HA GLU 146 HA GLU 146 4.628 -16.023 -8.881 844 HB2 GLU 146 1HB GLU 146 5.040 -14.801 -6.674 845 HB3 GLU 146 2HB GLU 146 3.504 -15.474 -6.142 846 HG2 GLU 146 1HG GLU 146 4.310 -17.620 -6.072 847 HG3 GLU 146 2HG GLU 146 5.572 -17.302 -7.259 848 H SER 147 H SER 147 3.773 -18.097 -8.822 849 HA SER 147 HA SER 147 1.113 -18.660 -7.981 850 HB2 SER 147 1HB SER 147 1.106 -17.434 -10.393 851 HB3 SER 147 2HB SER 147 1.276 -19.115 -10.902 852 HG SER 147 HG SER 147 -0.740 -19.402 -10.418 853 H SER 148 H SER 148 0.417 -20.912 -8.987 854 HA SER 148 HA SER 148 2.771 -22.656 -8.726 855 HB2 SER 148 1HB SER 148 0.506 -22.727 -7.259 856 HB3 SER 148 2HB SER 148 0.046 -23.821 -8.565 857 HG SER 148 HG SER 148 1.547 -25.220 -7.953 858 H THR 149 H THR 149 1.624 -21.308 -11.231 859 HA THR 149 HA THR 149 1.059 -21.785 -13.388 860 HB THR 149 HB THR 149 3.473 -22.346 -13.220 861 HG1 THR 149 HG1 THR 149 2.006 -23.959 -15.035 862 HG21 THR 149 3HG2 THR 149 4.085 -24.773 -13.421 863 HG22 THR 149 1HG2 THR 149 2.473 -25.146 -12.812 864 HG23 THR 149 2HG2 THR 149 3.601 -24.231 -11.816 865 H ASP 150 H ASP 150 -0.809 -22.916 -11.581 866 HA ASP 150 HA ASP 150 -2.534 -24.383 -11.468 867 HB2 ASP 150 1HB ASP 150 -1.903 -24.155 -14.354 868 HB3 ASP 150 2HB ASP 150 -2.967 -25.476 -13.884 869 H LEU 151 H LEU 151 -1.418 -25.814 -10.072 870 HA LEU 151 HA LEU 151 -1.059 -28.459 -11.229 871 HB2 LEU 151 1HB LEU 151 1.147 -26.799 -10.505 872 HB3 LEU 151 2HB LEU 151 1.069 -28.135 -9.372 873 HG LEU 151 HG LEU 151 0.864 -28.789 -12.266 874 HD11 LEU 151 1HD1 LEU 151 2.666 -27.107 -12.146 875 HD12 LEU 151 2HD1 LEU 151 3.251 -28.714 -12.580 876 HD13 LEU 151 3HD1 LEU 151 3.482 -28.106 -10.941 877 HD21 LEU 151 3HD2 LEU 151 0.941 -30.291 -10.037 878 HD22 LEU 151 1HD2 LEU 151 2.665 -30.205 -10.402 879 HD23 LEU 151 2HD2 LEU 151 1.541 -30.842 -11.601 880 H GLU 152 H GLU 152 -0.760 -26.569 -8.212 881 HA GLU 152 HA GLU 152 -1.599 -26.875 -6.127 882 HB2 GLU 152 1HB GLU 152 -3.487 -28.410 -7.804 883 HB3 GLU 152 2HB GLU 152 -3.465 -28.846 -6.103 884 HG2 GLU 152 1HG GLU 152 -4.752 -27.115 -5.640 885 HG3 GLU 152 2HG GLU 152 -3.523 -26.018 -6.271 Start of MODEL 7 1 H1 SER 45 1H SER 45 -12.243 -1.384 -20.516 2 H2 SER 45 2H SER 45 -13.111 -2.780 -21.008 3 H3 SER 45 3H SER 45 -11.533 -2.936 -20.351 4 HA SER 45 HA SER 45 -14.026 -2.174 -19.003 5 HB2 SER 45 1HB SER 45 -12.955 -4.047 -17.462 6 HB3 SER 45 2HB SER 45 -13.856 -4.486 -18.912 7 HG SER 45 HG SER 45 -12.099 -5.387 -19.605 8 H ALA 46 H ALA 46 -13.829 -1.571 -16.761 9 HA ALA 46 HA ALA 46 -11.360 -0.062 -16.239 10 HB1 ALA 46 3HB ALA 46 -12.627 1.424 -14.908 11 HB2 ALA 46 1HB ALA 46 -14.006 0.327 -14.872 12 HB3 ALA 46 2HB ALA 46 -13.571 1.146 -16.372 13 H ASP 47 H ASP 47 -11.963 -2.981 -15.654 14 HA ASP 47 HA ASP 47 -11.297 -2.897 -12.790 15 HB2 ASP 47 1HB ASP 47 -13.484 -4.233 -14.080 16 HB3 ASP 47 2HB ASP 47 -12.401 -5.437 -13.390 17 H ASP 48 H ASP 48 -9.473 -2.855 -15.022 18 HA ASP 48 HA ASP 48 -8.305 -5.536 -15.002 19 HB2 ASP 48 1HB ASP 48 -8.660 -4.034 -17.113 20 HB3 ASP 48 2HB ASP 48 -7.194 -3.226 -16.566 21 H ARG 49 H ARG 49 -8.205 -4.125 -12.568 22 HA ARG 49 HA ARG 49 -5.328 -4.011 -12.166 23 HB2 ARG 49 1HB ARG 49 -7.079 -1.731 -11.223 24 HB3 ARG 49 2HB ARG 49 -5.332 -1.862 -11.073 25 HG2 ARG 49 1HG ARG 49 -5.103 -1.701 -13.498 26 HG3 ARG 49 2HG ARG 49 -6.857 -1.588 -13.656 27 HD2 ARG 49 1HD ARG 49 -6.854 0.589 -13.171 28 HD3 ARG 49 2HD ARG 49 -5.813 0.352 -11.770 29 HE ARG 49 HE ARG 49 -4.037 1.031 -13.031 30 HH11 ARG 49 1HH1 ARG 49 -6.634 0.125 -15.206 31 HH12 ARG 49 2HH1 ARG 49 -5.805 0.673 -16.621 32 HH21 ARG 49 1HH2 ARG 49 -2.949 1.749 -14.908 33 HH22 ARG 49 2HH2 ARG 49 -3.714 1.595 -16.454 34 H LEU 50 H LEU 50 -4.933 -3.554 -9.682 35 HA LEU 50 HA LEU 50 -5.096 -4.330 -7.552 36 HB2 LEU 50 1HB LEU 50 -8.033 -4.123 -8.203 37 HB3 LEU 50 2HB LEU 50 -7.439 -4.560 -6.614 38 HG LEU 50 HG LEU 50 -6.395 -2.040 -7.791 39 HD11 LEU 50 1HD1 LEU 50 -8.324 -0.759 -7.241 40 HD12 LEU 50 2HD1 LEU 50 -9.148 -2.172 -6.581 41 HD13 LEU 50 3HD1 LEU 50 -8.841 -2.059 -8.314 42 HD21 LEU 50 3HD2 LEU 50 -6.061 -3.229 -5.417 43 HD22 LEU 50 1HD2 LEU 50 -7.479 -2.246 -5.050 44 HD23 LEU 50 2HD2 LEU 50 -6.003 -1.479 -5.635 45 H ASN 51 H ASN 51 -4.066 -6.310 -8.209 46 HA ASN 51 HA ASN 51 -5.820 -8.630 -7.858 47 HB2 ASN 51 1HB ASN 51 -4.452 -7.933 -10.306 48 HB3 ASN 51 2HB ASN 51 -3.856 -9.470 -9.692 49 HD21 ASN 51 2HD2 ASN 51 -5.646 -8.613 -11.992 50 HD22 ASN 51 1HD2 ASN 51 -7.022 -9.662 -11.856 51 H PHE 52 H PHE 52 -4.186 -10.693 -7.882 52 HA PHE 52 HA PHE 52 -2.686 -10.454 -5.494 53 HB2 PHE 52 1HB PHE 52 -2.379 -12.686 -7.506 54 HB3 PHE 52 2HB PHE 52 -2.128 -12.756 -5.762 55 HD1 PHE 52 HD1 PHE 52 -4.566 -11.430 -4.773 56 HD2 PHE 52 HD2 PHE 52 -4.042 -14.248 -7.920 57 HE1 PHE 52 HE1 PHE 52 -6.888 -12.186 -4.481 58 HE2 PHE 52 HE2 PHE 52 -6.363 -15.008 -7.630 59 HZ PHE 52 HZ PHE 52 -7.791 -13.977 -5.909 60 H GLY 53 H GLY 53 -0.561 -10.135 -5.108 61 HA2 GLY 53 1HA GLY 53 1.678 -9.741 -5.495 62 HA3 GLY 53 2HA GLY 53 1.470 -10.431 -7.097 63 H ASP 54 H ASP 54 -0.430 -7.726 -5.915 64 HA ASP 54 HA ASP 54 1.034 -5.951 -7.756 65 HB2 ASP 54 1HB ASP 54 -1.517 -6.801 -8.164 66 HB3 ASP 54 2HB ASP 54 -1.809 -5.328 -7.244 67 H ARG 55 H ARG 55 1.939 -4.270 -6.786 68 HA ARG 55 HA ARG 55 1.567 -3.692 -4.045 69 HB2 ARG 55 1HB ARG 55 2.953 -1.628 -4.579 70 HB3 ARG 55 2HB ARG 55 3.696 -3.180 -4.933 71 HG2 ARG 55 1HG ARG 55 2.287 -2.268 -7.246 72 HG3 ARG 55 2HG ARG 55 3.338 -0.983 -6.655 73 HD2 ARG 55 1HD ARG 55 5.235 -2.527 -6.660 74 HD3 ARG 55 2HD ARG 55 4.185 -3.820 -7.236 75 HE ARG 55 HE ARG 55 5.298 -1.658 -8.784 76 HH11 ARG 55 1HH1 ARG 55 2.784 -4.091 -8.620 77 HH12 ARG 55 2HH1 ARG 55 2.529 -4.126 -10.330 78 HH21 ARG 55 1HH2 ARG 55 4.959 -1.706 -11.040 79 HH22 ARG 55 2HH2 ARG 55 3.769 -2.772 -11.706 80 H ILE 56 H ILE 56 -0.124 -2.749 -3.168 81 HA ILE 56 HA ILE 56 -1.444 -0.549 -4.618 82 HB ILE 56 HB ILE 56 -3.570 -1.209 -3.502 83 HG12 ILE 56 1HG1 ILE 56 -2.003 -3.701 -2.780 84 HG13 ILE 56 2HG1 ILE 56 -2.627 -2.509 -1.646 85 HG21 ILE 56 1HG2 ILE 56 -2.551 -2.065 -5.832 86 HG22 ILE 56 2HG2 ILE 56 -4.159 -2.504 -5.258 87 HG23 ILE 56 3HG2 ILE 56 -2.811 -3.617 -5.035 88 HD11 ILE 56 3HD1 ILE 56 -4.695 -3.585 -3.372 89 HD12 ILE 56 1HD1 ILE 56 -4.632 -3.462 -1.615 90 HD13 ILE 56 2HD1 ILE 56 -3.874 -4.828 -2.430 91 H LEU 57 H LEU 57 -2.295 1.158 -3.357 92 HA LEU 57 HA LEU 57 -0.873 1.526 -0.834 93 HB2 LEU 57 1HB LEU 57 -0.988 3.228 -2.785 94 HB3 LEU 57 2HB LEU 57 -2.588 3.595 -2.165 95 HG LEU 57 HG LEU 57 -1.458 4.035 0.081 96 HD11 LEU 57 1HD1 LEU 57 0.934 4.707 -0.117 97 HD12 LEU 57 2HD1 LEU 57 0.958 3.947 -1.709 98 HD13 LEU 57 3HD1 LEU 57 0.648 2.974 -0.273 99 HD21 LEU 57 3HD2 LEU 57 -0.518 6.281 -0.835 100 HD22 LEU 57 1HD2 LEU 57 -2.241 5.933 -0.974 101 HD23 LEU 57 2HD2 LEU 57 -1.184 5.724 -2.370 102 H VAL 58 H VAL 58 -1.828 1.248 1.064 103 HA VAL 58 HA VAL 58 -4.769 1.400 1.187 104 HB VAL 58 HB VAL 58 -4.027 -0.914 1.395 105 HG11 VAL 58 1HG1 VAL 58 -1.902 0.186 2.868 106 HG12 VAL 58 2HG1 VAL 58 -2.188 -1.509 2.480 107 HG13 VAL 58 3HG1 VAL 58 -2.810 -0.833 3.984 108 HG21 VAL 58 3HG2 VAL 58 -4.970 0.177 4.043 109 HG22 VAL 58 1HG2 VAL 58 -5.160 -1.476 3.459 110 HG23 VAL 58 2HG2 VAL 58 -5.999 -0.153 2.649 111 H LYS 59 H LYS 59 -5.698 2.434 2.914 112 HA LYS 59 HA LYS 59 -3.879 4.050 4.547 113 HB2 LYS 59 1HB LYS 59 -5.933 4.904 3.099 114 HB3 LYS 59 2HB LYS 59 -6.829 4.481 4.551 115 HG2 LYS 59 1HG LYS 59 -4.758 5.905 5.592 116 HG3 LYS 59 2HG LYS 59 -5.007 6.712 4.043 117 HD2 LYS 59 1HD LYS 59 -7.473 6.104 5.516 118 HD3 LYS 59 2HD LYS 59 -6.400 7.248 6.323 119 HE2 LYS 59 1HE LYS 59 -7.081 7.573 3.425 120 HE3 LYS 59 2HE LYS 59 -8.189 8.138 4.674 121 HZ1 LYS 59 3HZ LYS 59 -6.854 9.968 4.160 122 HZ2 LYS 59 1HZ LYS 59 -5.429 9.055 4.123 123 HZ3 LYS 59 2HZ LYS 59 -6.193 9.373 5.599 124 H ALA 60 H ALA 60 -3.807 3.935 6.733 125 HA ALA 60 HA ALA 60 -5.334 1.768 7.994 126 HB1 ALA 60 3HB ALA 60 -3.555 1.361 9.328 127 HB2 ALA 60 1HB ALA 60 -3.147 3.070 9.488 128 HB3 ALA 60 2HB ALA 60 -2.678 2.184 8.036 129 HA PRO 61 HA PRO 61 -7.957 4.366 10.413 130 HB2 PRO 61 1HB PRO 61 -7.040 2.800 12.778 131 HB3 PRO 61 2HB PRO 61 -8.682 3.126 12.211 132 HG2 PRO 61 1HG PRO 61 -7.583 0.737 11.843 133 HG3 PRO 61 2HG PRO 61 -8.591 1.473 10.583 134 HD2 PRO 61 1HD PRO 61 -5.616 1.223 10.727 135 HD3 PRO 61 2HD PRO 61 -6.693 1.100 9.321 136 H GLY 62 H GLY 62 -7.428 6.400 10.888 137 HA2 GLY 62 1HA GLY 62 -6.470 8.210 11.932 138 HA3 GLY 62 2HA GLY 62 -5.904 7.100 13.170 139 H TYR 63 H TYR 63 -5.038 6.689 9.802 140 HA TYR 63 HA TYR 63 -2.478 8.005 10.124 141 HB2 TYR 63 1HB TYR 63 -2.361 5.616 11.113 142 HB3 TYR 63 2HB TYR 63 -2.440 5.074 9.442 143 HD1 TYR 63 HD2 TYR 63 -0.534 7.602 11.449 144 HD2 TYR 63 HD1 TYR 63 -0.425 4.587 8.447 145 HE1 TYR 63 HE2 TYR 63 1.897 7.898 11.246 146 HE2 TYR 63 HE1 TYR 63 2.007 4.874 8.241 147 HH TYR 63 HH TYR 63 3.657 7.476 9.375 148 HA PRO 64 HA PRO 64 -3.109 8.791 5.811 149 HB2 PRO 64 1HB PRO 64 -0.147 8.643 5.595 150 HB3 PRO 64 2HB PRO 64 -1.245 9.949 5.130 151 HG2 PRO 64 1HG PRO 64 0.266 10.165 7.307 152 HG3 PRO 64 2HG PRO 64 -1.405 10.763 7.302 153 HD2 PRO 64 1HD PRO 64 -0.289 8.252 8.489 154 HD3 PRO 64 2HD PRO 64 -1.521 9.355 9.138 155 H TRP 65 H TRP 65 -2.227 7.990 3.615 156 HA TRP 65 HA TRP 65 -2.666 5.205 3.452 157 HB2 TRP 65 1HB TRP 65 -1.513 7.073 1.368 158 HB3 TRP 65 2HB TRP 65 -2.124 5.452 1.062 159 HD1 TRP 65 HD1 TRP 65 -3.365 8.956 2.062 160 HE1 TRP 65 HE1 TRP 65 -5.859 9.134 1.459 161 HE3 TRP 65 HE3 TRP 65 -4.196 4.127 0.597 162 HZ2 TRP 65 HZ2 TRP 65 -7.908 7.453 0.490 163 HZ3 TRP 65 HZ3 TRP 65 -6.453 3.496 -0.154 164 HH2 TRP 65 HH2 TRP 65 -8.270 5.127 -0.204 165 H TRP 66 H TRP 66 -1.280 3.496 2.985 166 HA TRP 66 HA TRP 66 1.604 4.049 3.166 167 HB2 TRP 66 1HB TRP 66 0.280 3.068 5.288 168 HB3 TRP 66 2HB TRP 66 0.600 1.558 4.439 169 HD1 TRP 66 HD1 TRP 66 2.863 0.478 4.943 170 HE1 TRP 66 HE1 TRP 66 5.091 1.262 5.964 171 HE3 TRP 66 HE3 TRP 66 1.812 5.455 5.466 172 HZ2 TRP 66 HZ2 TRP 66 6.247 3.667 6.877 173 HZ3 TRP 66 HZ3 TRP 66 3.539 6.929 6.416 174 HH2 TRP 66 HH2 TRP 66 5.712 6.049 7.099 175 HA PRO 67 HA PRO 67 1.799 1.386 -0.371 176 HB2 PRO 67 1HB PRO 67 4.431 0.800 -0.377 177 HB3 PRO 67 2HB PRO 67 3.822 2.408 -0.791 178 HG2 PRO 67 1HG PRO 67 4.965 1.426 1.799 179 HG3 PRO 67 2HG PRO 67 5.287 2.943 0.941 180 HD2 PRO 67 1HD PRO 67 3.583 2.782 3.044 181 HD3 PRO 67 2HD PRO 67 3.364 3.942 1.720 182 H ALA 68 H ALA 68 0.870 -0.560 -0.255 183 HA ALA 68 HA ALA 68 2.239 -2.684 1.271 184 HB1 ALA 68 3HB ALA 68 -0.051 -3.670 1.636 185 HB2 ALA 68 1HB ALA 68 -0.718 -2.139 1.069 186 HB3 ALA 68 2HB ALA 68 0.284 -2.181 2.521 187 H LEU 69 H LEU 69 1.386 -4.924 0.462 188 HA LEU 69 HA LEU 69 1.088 -4.838 -2.471 189 HB2 LEU 69 1HB LEU 69 3.217 -5.996 -0.898 190 HB3 LEU 69 2HB LEU 69 2.422 -7.223 -1.866 191 HG LEU 69 HG LEU 69 3.167 -4.698 -3.237 192 HD11 LEU 69 1HD1 LEU 69 5.188 -6.789 -2.440 193 HD12 LEU 69 2HD1 LEU 69 5.154 -5.106 -1.916 194 HD13 LEU 69 3HD1 LEU 69 5.459 -5.496 -3.608 195 HD21 LEU 69 3HD2 LEU 69 2.471 -7.421 -3.903 196 HD22 LEU 69 1HD2 LEU 69 3.977 -6.934 -4.682 197 HD23 LEU 69 2HD2 LEU 69 2.512 -5.985 -4.925 198 H LEU 70 H LEU 70 -0.704 -5.785 -3.137 199 HA LEU 70 HA LEU 70 -2.452 -7.204 -1.453 200 HB2 LEU 70 1HB LEU 70 -2.711 -6.002 -3.852 201 HB3 LEU 70 2HB LEU 70 -2.667 -7.678 -4.364 202 HG LEU 70 HG LEU 70 -4.564 -6.732 -2.227 203 HD11 LEU 70 1HD1 LEU 70 -5.997 -5.851 -3.693 204 HD12 LEU 70 2HD1 LEU 70 -5.694 -7.111 -4.890 205 HD13 LEU 70 3HD1 LEU 70 -4.609 -5.725 -4.772 206 HD21 LEU 70 3HD2 LEU 70 -5.403 -8.866 -4.002 207 HD22 LEU 70 1HD2 LEU 70 -5.328 -8.824 -2.242 208 HD23 LEU 70 2HD2 LEU 70 -3.894 -9.248 -3.175 209 H LEU 71 H LEU 71 -2.645 -9.281 -0.917 210 HA LEU 71 HA LEU 71 -0.850 -11.222 -2.208 211 HB2 LEU 71 1HB LEU 71 -2.244 -11.482 0.458 212 HB3 LEU 71 2HB LEU 71 -1.009 -12.542 -0.192 213 HG LEU 71 HG LEU 71 -0.119 -9.767 0.023 214 HD11 LEU 71 1HD1 LEU 71 -0.249 -11.043 2.673 215 HD12 LEU 71 2HD1 LEU 71 -1.769 -10.401 2.055 216 HD13 LEU 71 3HD1 LEU 71 -0.367 -9.344 2.219 217 HD21 LEU 71 3HD2 LEU 71 1.736 -10.991 -0.137 218 HD22 LEU 71 1HD2 LEU 71 0.889 -12.477 0.293 219 HD23 LEU 71 2HD2 LEU 71 1.489 -11.406 1.559 220 H ARG 72 H ARG 72 -4.086 -11.102 -0.690 221 HA ARG 72 HA ARG 72 -5.257 -12.519 -2.909 222 HB2 ARG 72 1HB ARG 72 -4.386 -13.954 -0.576 223 HB3 ARG 72 2HB ARG 72 -6.138 -14.035 -0.703 224 HG2 ARG 72 1HG ARG 72 -5.242 -14.525 -3.284 225 HG3 ARG 72 2HG ARG 72 -4.104 -15.386 -2.248 226 HD2 ARG 72 1HD ARG 72 -6.630 -15.898 -1.162 227 HD3 ARG 72 2HD ARG 72 -6.837 -16.031 -2.907 228 HE ARG 72 HE ARG 72 -5.658 -17.978 -2.840 229 HH11 ARG 72 1HH1 ARG 72 -4.895 -16.151 0.047 230 HH12 ARG 72 2HH1 ARG 72 -3.959 -17.421 0.756 231 HH21 ARG 72 1HH2 ARG 72 -4.416 -19.651 -1.900 232 HH22 ARG 72 2HH2 ARG 72 -3.688 -19.409 -0.349 233 H ARG 73 H ARG 73 -7.599 -12.708 -2.744 234 HA ARG 73 HA ARG 73 -8.725 -10.660 -0.950 235 HB2 ARG 73 1HB ARG 73 -10.545 -10.443 -2.668 236 HB3 ARG 73 2HB ARG 73 -8.960 -9.905 -3.198 237 HG2 ARG 73 1HG ARG 73 -8.931 -11.356 -4.882 238 HG3 ARG 73 2HG ARG 73 -9.416 -12.693 -3.837 239 HD2 ARG 73 1HD ARG 73 -11.761 -11.820 -3.966 240 HD3 ARG 73 2HD ARG 73 -11.203 -10.677 -5.187 241 HE ARG 73 HE ARG 73 -10.402 -13.047 -6.185 242 HH11 ARG 73 1HH1 ARG 73 -13.493 -11.921 -4.977 243 HH12 ARG 73 2HH1 ARG 73 -14.414 -12.964 -6.007 244 HH21 ARG 73 1HH2 ARG 73 -11.623 -14.417 -7.541 245 HH22 ARG 73 2HH2 ARG 73 -13.353 -14.379 -7.463 246 H LYS 74 H LYS 74 -9.778 -11.554 0.685 247 HA LYS 74 HA LYS 74 -11.165 -14.103 0.258 248 HB2 LYS 74 1HB LYS 74 -11.306 -13.900 2.889 249 HB3 LYS 74 2HB LYS 74 -9.860 -14.496 2.092 250 HG2 LYS 74 1HG LYS 74 -8.676 -12.537 2.483 251 HG3 LYS 74 2HG LYS 74 -10.143 -11.592 2.759 252 HD2 LYS 74 1HD LYS 74 -9.606 -13.864 4.595 253 HD3 LYS 74 2HD LYS 74 -8.594 -12.428 4.758 254 HE2 LYS 74 1HE LYS 74 -10.413 -12.127 6.241 255 HE3 LYS 74 2HE LYS 74 -10.728 -11.083 4.856 256 HZ1 LYS 74 3HZ LYS 74 -12.615 -12.552 5.792 257 HZ2 LYS 74 1HZ LYS 74 -11.864 -13.804 4.936 258 HZ3 LYS 74 2HZ LYS 74 -12.426 -12.434 4.116 259 H GLU 75 H GLU 75 -13.180 -13.763 -0.407 260 HA GLU 75 HA GLU 75 -14.734 -11.505 0.523 261 HB2 GLU 75 1HB GLU 75 -14.669 -12.863 -1.834 262 HB3 GLU 75 2HB GLU 75 -16.066 -13.602 -1.065 263 HG2 GLU 75 1HG GLU 75 -16.795 -11.144 -0.635 264 HG3 GLU 75 2HG GLU 75 -15.654 -10.782 -1.931 265 H THR 76 H THR 76 -15.766 -11.592 2.415 266 HA THR 76 HA THR 76 -16.983 -14.152 3.213 267 HB THR 76 HB THR 76 -15.103 -13.616 4.672 268 HG1 THR 76 HG1 THR 76 -16.329 -14.462 6.123 269 HG21 THR 76 3HG2 THR 76 -16.531 -11.023 5.159 270 HG22 THR 76 1HG2 THR 76 -14.878 -11.272 4.599 271 HG23 THR 76 2HG2 THR 76 -15.320 -11.683 6.256 272 H LYS 77 H LYS 77 -19.110 -14.156 3.574 273 HA LYS 77 HA LYS 77 -20.562 -11.649 3.290 274 HB2 LYS 77 1HB LYS 77 -22.509 -12.992 2.908 275 HB3 LYS 77 2HB LYS 77 -21.185 -13.692 1.992 276 HG2 LYS 77 1HG LYS 77 -20.905 -15.235 4.066 277 HG3 LYS 77 2HG LYS 77 -22.559 -14.738 4.428 278 HD2 LYS 77 1HD LYS 77 -21.685 -15.918 1.794 279 HD3 LYS 77 2HD LYS 77 -22.380 -16.857 3.116 280 HE2 LYS 77 1HE LYS 77 -24.455 -15.749 2.946 281 HE3 LYS 77 2HE LYS 77 -23.780 -14.472 1.935 282 HZ1 LYS 77 3HZ LYS 77 -24.560 -17.204 1.205 283 HZ2 LYS 77 1HZ LYS 77 -23.294 -16.477 0.350 284 HZ3 LYS 77 2HZ LYS 77 -24.822 -15.752 0.378 285 H ASP 78 H ASP 78 -22.911 -12.245 4.704 286 HA ASP 78 HA ASP 78 -22.015 -11.704 7.422 287 HB2 ASP 78 1HB ASP 78 -24.479 -11.228 7.799 288 HB3 ASP 78 2HB ASP 78 -23.652 -10.168 6.667 289 H SER 79 H SER 79 -21.840 -14.435 6.324 290 HA SER 79 HA SER 79 -22.278 -16.594 6.884 291 HB2 SER 79 1HB SER 79 -22.948 -15.403 9.586 292 HB3 SER 79 2HB SER 79 -22.408 -17.051 9.261 293 HG SER 79 HG SER 79 -20.914 -14.942 9.764 294 H LEU 80 H LEU 80 -24.464 -15.232 5.664 295 HA LEU 80 HA LEU 80 -26.672 -15.476 5.197 296 HB2 LEU 80 1HB LEU 80 -25.761 -18.020 6.195 297 HB3 LEU 80 2HB LEU 80 -27.436 -17.771 6.644 298 HG LEU 80 HG LEU 80 -27.324 -18.978 4.556 299 HD11 LEU 80 1HD1 LEU 80 -29.007 -17.861 3.563 300 HD12 LEU 80 2HD1 LEU 80 -28.117 -16.339 3.511 301 HD13 LEU 80 3HD1 LEU 80 -28.902 -16.851 5.004 302 HD21 LEU 80 3HD2 LEU 80 -26.191 -16.776 2.980 303 HD22 LEU 80 1HD2 LEU 80 -25.945 -18.518 2.846 304 HD23 LEU 80 2HD2 LEU 80 -25.048 -17.591 4.048 305 H ASN 81 H ASN 81 -26.723 -13.546 6.704 306 HA ASN 81 HA ASN 81 -28.291 -14.107 9.131 307 HB2 ASN 81 1HB ASN 81 -26.055 -12.511 8.780 308 HB3 ASN 81 2HB ASN 81 -27.381 -11.353 8.775 309 HD21 ASN 81 2HD2 ASN 81 -26.247 -14.193 10.583 310 HD22 ASN 81 1HD2 ASN 81 -26.669 -13.569 12.148 311 H THR 82 H THR 82 -29.201 -13.854 6.202 312 HA THR 82 HA THR 82 -30.882 -12.925 4.982 313 HB THR 82 HB THR 82 -32.989 -12.757 6.065 314 HG1 THR 82 HG1 THR 82 -31.554 -12.349 8.476 315 HG21 THR 82 3HG2 THR 82 -32.951 -14.628 7.793 316 HG22 THR 82 1HG2 THR 82 -31.238 -14.776 7.400 317 HG23 THR 82 2HG2 THR 82 -32.456 -15.009 6.145 318 H ASN 83 H ASN 83 -28.778 -11.078 5.847 319 HA ASN 83 HA ASN 83 -30.283 -8.555 5.996 320 HB2 ASN 83 1HB ASN 83 -28.336 -9.305 7.660 321 HB3 ASN 83 2HB ASN 83 -27.329 -8.611 6.394 322 HD21 ASN 83 2HD2 ASN 83 -30.422 -7.759 7.938 323 HD22 ASN 83 1HD2 ASN 83 -29.980 -6.117 8.289 324 H SER 84 H SER 84 -28.065 -10.421 4.071 325 HA SER 84 HA SER 84 -27.278 -10.193 1.966 326 HB2 SER 84 1HB SER 84 -29.269 -7.921 1.742 327 HB3 SER 84 2HB SER 84 -28.449 -8.712 0.397 328 HG SER 84 HG SER 84 -30.014 -10.100 0.439 329 H SER 85 H SER 85 -25.439 -9.405 3.460 330 HA SER 85 HA SER 85 -24.413 -6.949 2.269 331 HB2 SER 85 1HB SER 85 -25.023 -7.323 5.151 332 HB3 SER 85 2HB SER 85 -23.487 -6.547 4.765 333 HG SER 85 HG SER 85 -24.570 -4.941 3.699 334 H PHE 86 H PHE 86 -22.675 -7.734 1.235 335 HA PHE 86 HA PHE 86 -21.111 -9.892 2.362 336 HB2 PHE 86 1HB PHE 86 -21.123 -8.423 -0.243 337 HB3 PHE 86 2HB PHE 86 -19.670 -9.298 0.227 338 HD1 PHE 86 HD2 PHE 86 -19.664 -11.717 0.378 339 HD2 PHE 86 HD1 PHE 86 -23.163 -9.594 -0.794 340 HE1 PHE 86 HE2 PHE 86 -20.652 -13.811 -0.454 341 HE2 PHE 86 HE1 PHE 86 -24.157 -11.685 -1.627 342 HZ PHE 86 HZ PHE 86 -22.900 -13.796 -1.457 343 H ASN 87 H ASN 87 -18.790 -9.764 2.655 344 HA ASN 87 HA ASN 87 -17.763 -7.073 3.208 345 HB2 ASN 87 1HB ASN 87 -17.862 -9.408 5.108 346 HB3 ASN 87 2HB ASN 87 -16.651 -8.142 5.281 347 HD21 ASN 87 2HD2 ASN 87 -17.253 -6.128 5.995 348 HD22 ASN 87 1HD2 ASN 87 -18.835 -5.790 6.631 349 H VAL 88 H VAL 88 -16.626 -7.386 1.223 350 HA VAL 88 HA VAL 88 -14.542 -9.438 1.225 351 HB VAL 88 HB VAL 88 -15.810 -9.197 -0.841 352 HG11 VAL 88 1HG1 VAL 88 -16.376 -7.248 -1.750 353 HG12 VAL 88 2HG1 VAL 88 -14.701 -6.699 -1.770 354 HG13 VAL 88 3HG1 VAL 88 -15.687 -6.466 -0.329 355 HG21 VAL 88 3HG2 VAL 88 -13.203 -8.085 -1.676 356 HG22 VAL 88 1HG2 VAL 88 -14.028 -9.557 -2.188 357 HG23 VAL 88 2HG2 VAL 88 -13.158 -9.521 -0.655 358 H LEU 89 H LEU 89 -12.398 -9.007 1.328 359 HA LEU 89 HA LEU 89 -11.554 -6.202 1.542 360 HB2 LEU 89 1HB LEU 89 -10.429 -8.307 3.363 361 HB3 LEU 89 2HB LEU 89 -10.305 -6.564 3.498 362 HG LEU 89 HG LEU 89 -12.892 -8.073 3.862 363 HD11 LEU 89 1HD1 LEU 89 -12.484 -7.567 6.303 364 HD12 LEU 89 2HD1 LEU 89 -10.808 -7.236 5.862 365 HD13 LEU 89 3HD1 LEU 89 -11.490 -8.842 5.598 366 HD21 LEU 89 3HD2 LEU 89 -12.395 -5.419 5.065 367 HD22 LEU 89 1HD2 LEU 89 -13.861 -6.087 4.349 368 HD23 LEU 89 2HD2 LEU 89 -12.579 -5.463 3.311 369 H TYR 90 H TYR 90 -9.002 -6.216 1.764 370 HA TYR 90 HA TYR 90 -7.924 -8.094 -0.234 371 HB2 TYR 90 1HB TYR 90 -7.938 -5.143 -0.206 372 HB3 TYR 90 2HB TYR 90 -6.388 -5.879 -0.602 373 HD1 TYR 90 HD2 TYR 90 -7.389 -8.320 -2.035 374 HD2 TYR 90 HD1 TYR 90 -8.564 -4.240 -2.285 375 HE1 TYR 90 HE2 TYR 90 -8.147 -8.688 -4.336 376 HE2 TYR 90 HE1 TYR 90 -9.327 -4.597 -4.593 377 HH TYR 90 HH TYR 90 -8.684 -6.327 -6.500 378 H LYS 91 H LYS 91 -6.575 -9.385 0.874 379 HA LYS 91 HA LYS 91 -5.181 -8.555 3.229 380 HB2 LYS 91 1HB LYS 91 -4.755 -10.994 1.484 381 HB3 LYS 91 2HB LYS 91 -4.081 -10.760 3.090 382 HG2 LYS 91 1HG LYS 91 -6.851 -10.384 3.352 383 HG3 LYS 91 2HG LYS 91 -6.637 -11.803 2.325 384 HD2 LYS 91 1HD LYS 91 -4.878 -11.677 4.683 385 HD3 LYS 91 2HD LYS 91 -6.597 -11.857 5.034 386 HE2 LYS 91 1HE LYS 91 -6.721 -13.926 4.063 387 HE3 LYS 91 2HE LYS 91 -5.411 -13.592 2.930 388 HZ1 LYS 91 3HZ LYS 91 -3.887 -14.376 4.348 389 HZ2 LYS 91 1HZ LYS 91 -5.186 -15.124 5.132 390 HZ3 LYS 91 2HZ LYS 91 -4.594 -13.646 5.701 391 H VAL 92 H VAL 92 -3.765 -6.903 2.902 392 HA VAL 92 HA VAL 92 -1.776 -7.210 0.753 393 HB VAL 92 HB VAL 92 -1.431 -4.833 0.812 394 HG11 VAL 92 1HG1 VAL 92 -3.511 -4.068 -0.029 395 HG12 VAL 92 2HG1 VAL 92 -4.408 -5.260 0.911 396 HG13 VAL 92 3HG1 VAL 92 -3.397 -5.780 -0.438 397 HG21 VAL 92 3HG2 VAL 92 -1.613 -4.372 3.161 398 HG22 VAL 92 1HG2 VAL 92 -3.318 -4.826 3.165 399 HG23 VAL 92 2HG2 VAL 92 -2.793 -3.379 2.307 400 H LEU 93 H LEU 93 0.411 -6.752 1.130 401 HA LEU 93 HA LEU 93 1.278 -7.235 3.894 402 HB2 LEU 93 1HB LEU 93 2.437 -7.750 1.200 403 HB3 LEU 93 2HB LEU 93 3.563 -7.376 2.490 404 HG LEU 93 HG LEU 93 1.586 -9.658 2.489 405 HD11 LEU 93 1HD1 LEU 93 3.562 -9.826 0.933 406 HD12 LEU 93 2HD1 LEU 93 3.430 -11.100 2.146 407 HD13 LEU 93 3HD1 LEU 93 4.588 -9.789 2.367 408 HD21 LEU 93 3HD2 LEU 93 3.581 -8.710 4.525 409 HD22 LEU 93 1HD2 LEU 93 2.976 -10.365 4.494 410 HD23 LEU 93 2HD2 LEU 93 1.859 -9.022 4.739 411 H PHE 94 H PHE 94 2.352 -5.715 5.031 412 HA PHE 94 HA PHE 94 2.686 -3.087 3.780 413 HB2 PHE 94 1HB PHE 94 2.299 -4.105 6.542 414 HB3 PHE 94 2HB PHE 94 3.302 -2.670 6.384 415 HD1 PHE 94 HD1 PHE 94 0.030 -3.971 5.110 416 HD2 PHE 94 HD2 PHE 94 2.262 -0.645 6.560 417 HE1 PHE 94 HE1 PHE 94 -1.989 -2.572 5.012 418 HE2 PHE 94 HE2 PHE 94 0.245 0.756 6.461 419 HZ PHE 94 HZ PHE 94 -1.884 -0.205 5.687 420 H PHE 95 H PHE 95 4.624 -1.803 4.278 421 HA PHE 95 HA PHE 95 7.041 -3.295 4.955 422 HB2 PHE 95 1HB PHE 95 6.917 -1.688 2.396 423 HB3 PHE 95 2HB PHE 95 8.217 -2.736 2.945 424 HD1 PHE 95 HD1 PHE 95 8.052 -5.141 2.737 425 HD2 PHE 95 HD2 PHE 95 4.919 -2.596 1.390 426 HE1 PHE 95 HE1 PHE 95 7.078 -7.014 1.473 427 HE2 PHE 95 HE2 PHE 95 3.941 -4.464 0.126 428 HZ PHE 95 HZ PHE 95 5.018 -6.677 0.167 429 HA PRO 96 HA PRO 96 9.448 -2.468 4.283 430 HB2 PRO 96 1HB PRO 96 11.226 -2.163 6.329 431 HB3 PRO 96 2HB PRO 96 11.223 -1.152 4.881 432 HG2 PRO 96 1HG PRO 96 10.097 -0.591 7.594 433 HG3 PRO 96 2HG PRO 96 10.983 0.489 6.501 434 HD2 PRO 96 1HD PRO 96 8.293 0.580 6.755 435 HD3 PRO 96 2HD PRO 96 9.117 0.939 5.224 436 H ASP 97 H ASP 97 8.421 -2.039 7.648 437 HA ASP 97 HA ASP 97 9.051 -4.517 8.684 438 HB2 ASP 97 1HB ASP 97 7.763 -2.340 9.667 439 HB3 ASP 97 2HB ASP 97 6.409 -3.450 9.494 440 H PHE 98 H PHE 98 8.600 -6.443 7.853 441 HA PHE 98 HA PHE 98 6.631 -7.002 5.962 442 HB2 PHE 98 1HB PHE 98 8.212 -8.784 7.807 443 HB3 PHE 98 2HB PHE 98 7.053 -9.435 6.654 444 HD1 PHE 98 HD1 PHE 98 7.407 -8.059 4.228 445 HD2 PHE 98 HD2 PHE 98 10.369 -9.090 7.107 446 HE1 PHE 98 HE1 PHE 98 9.128 -8.015 2.469 447 HE2 PHE 98 HE2 PHE 98 12.092 -9.046 5.352 448 HZ PHE 98 HZ PHE 98 11.474 -8.507 3.030 449 H ASN 99 H ASN 99 4.738 -6.029 6.844 450 HA ASN 99 HA ASN 99 3.321 -7.764 8.757 451 HB2 ASN 99 1HB ASN 99 3.768 -4.868 8.804 452 HB3 ASN 99 2HB ASN 99 2.072 -5.303 8.961 453 HD21 ASN 99 2HD2 ASN 99 2.014 -4.569 11.092 454 HD22 ASN 99 1HD2 ASN 99 2.750 -5.459 12.387 455 H PHE 100 H PHE 100 0.777 -6.842 8.533 456 HA PHE 100 HA PHE 100 0.069 -6.460 5.760 457 HB2 PHE 100 1HB PHE 100 -1.532 -8.604 6.116 458 HB3 PHE 100 2HB PHE 100 0.037 -8.690 5.325 459 HD1 PHE 100 HD2 PHE 100 2.011 -9.469 6.602 460 HD2 PHE 100 HD1 PHE 100 -1.938 -9.693 8.168 461 HE1 PHE 100 HE2 PHE 100 2.770 -11.106 8.273 462 HE2 PHE 100 HE1 PHE 100 -1.189 -11.321 9.844 463 HZ PHE 100 HZ PHE 100 1.172 -12.036 9.898 464 H ALA 101 H ALA 101 -2.462 -6.731 5.565 465 HA ALA 101 HA ALA 101 -3.946 -6.118 7.943 466 HB1 ALA 101 3HB ALA 101 -2.794 -3.970 6.407 467 HB2 ALA 101 1HB ALA 101 -3.680 -3.908 7.931 468 HB3 ALA 101 2HB ALA 101 -4.556 -3.867 6.401 469 H TRP 102 H TRP 102 -6.208 -6.031 7.607 470 HA TRP 102 HA TRP 102 -7.074 -6.988 4.958 471 HB2 TRP 102 1HB TRP 102 -9.038 -7.988 6.350 472 HB3 TRP 102 2HB TRP 102 -7.492 -8.825 6.332 473 HD1 TRP 102 HD1 TRP 102 -5.925 -8.451 8.599 474 HE1 TRP 102 HE1 TRP 102 -6.662 -8.161 11.048 475 HE3 TRP 102 HE3 TRP 102 -10.792 -7.089 7.829 476 HZ2 TRP 102 HZ2 TRP 102 -9.001 -7.455 12.466 477 HZ3 TRP 102 HZ3 TRP 102 -12.212 -6.625 9.781 478 HH2 TRP 102 HH2 TRP 102 -11.334 -6.804 12.053 479 H VAL 103 H VAL 103 -7.901 -5.261 3.960 480 HA VAL 103 HA VAL 103 -10.100 -3.829 5.267 481 HB VAL 103 HB VAL 103 -9.294 -1.669 4.370 482 HG11 VAL 103 1HG1 VAL 103 -8.137 -1.196 6.250 483 HG12 VAL 103 2HG1 VAL 103 -7.020 -2.544 6.035 484 HG13 VAL 103 3HG1 VAL 103 -8.629 -2.830 6.695 485 HG21 VAL 103 3HG2 VAL 103 -7.700 -3.053 2.732 486 HG22 VAL 103 1HG2 VAL 103 -6.545 -2.719 4.022 487 HG23 VAL 103 2HG2 VAL 103 -7.366 -1.388 3.204 488 H LYS 104 H LYS 104 -11.404 -2.552 3.697 489 HA LYS 104 HA LYS 104 -11.889 -4.129 1.332 490 HB2 LYS 104 1HB LYS 104 -13.586 -2.898 2.936 491 HB3 LYS 104 2HB LYS 104 -13.290 -1.540 1.862 492 HG2 LYS 104 1HG LYS 104 -14.401 -2.485 0.131 493 HG3 LYS 104 2HG LYS 104 -13.940 -4.126 0.588 494 HD2 LYS 104 1HD LYS 104 -15.509 -3.767 2.603 495 HD3 LYS 104 2HD LYS 104 -16.156 -2.419 1.669 496 HE2 LYS 104 1HE LYS 104 -16.174 -4.362 -0.206 497 HE3 LYS 104 2HE LYS 104 -16.420 -5.326 1.249 498 HZ1 LYS 104 3HZ LYS 104 -18.054 -2.929 0.647 499 HZ2 LYS 104 1HZ LYS 104 -18.377 -4.161 1.761 500 HZ3 LYS 104 2HZ LYS 104 -18.481 -4.473 0.101 501 H ARG 105 H ARG 105 -12.296 -3.018 -0.792 502 HA ARG 105 HA ARG 105 -9.976 -1.811 -1.769 503 HB2 ARG 105 1HB ARG 105 -12.768 -2.009 -2.872 504 HB3 ARG 105 2HB ARG 105 -11.482 -1.199 -3.757 505 HG2 ARG 105 1HG ARG 105 -11.300 -3.271 -4.657 506 HG3 ARG 105 2HG ARG 105 -10.212 -3.464 -3.283 507 HD2 ARG 105 1HD ARG 105 -11.795 -5.358 -3.575 508 HD3 ARG 105 2HD ARG 105 -11.918 -4.566 -2.008 509 HE ARG 105 HE ARG 105 -14.052 -3.917 -2.533 510 HH11 ARG 105 1HH1 ARG 105 -12.460 -5.017 -5.450 511 HH12 ARG 105 2HH1 ARG 105 -13.903 -4.969 -6.404 512 HH21 ARG 105 1HH2 ARG 105 -15.954 -3.852 -3.798 513 HH22 ARG 105 2HH2 ARG 105 -15.886 -4.308 -5.468 514 H ASN 106 H ASN 106 -12.737 -0.389 -0.224 515 HA ASN 106 HA ASN 106 -12.700 2.201 -1.240 516 HB2 ASN 106 1HB ASN 106 -13.527 1.015 1.382 517 HB3 ASN 106 2HB ASN 106 -13.482 2.765 1.208 518 HD21 ASN 106 2HD2 ASN 106 -15.827 1.459 1.760 519 HD22 ASN 106 1HD2 ASN 106 -16.882 1.560 0.385 520 H SER 107 H SER 107 -10.783 0.766 1.376 521 HA SER 107 HA SER 107 -9.310 3.270 1.696 522 HB2 SER 107 1HB SER 107 -9.215 0.686 3.270 523 HB3 SER 107 2HB SER 107 -8.254 2.120 3.636 524 HG SER 107 HG SER 107 -9.923 2.802 4.696 525 H VAL 108 H VAL 108 -9.093 1.255 -0.638 526 HA VAL 108 HA VAL 108 -6.156 1.057 -0.565 527 HB VAL 108 HB VAL 108 -8.012 -0.980 -1.798 528 HG11 VAL 108 1HG1 VAL 108 -6.004 -2.283 -2.212 529 HG12 VAL 108 2HG1 VAL 108 -5.009 -1.014 -1.501 530 HG13 VAL 108 3HG1 VAL 108 -5.883 -0.712 -3.000 531 HG21 VAL 108 3HG2 VAL 108 -7.300 -2.492 -0.044 532 HG22 VAL 108 1HG2 VAL 108 -8.023 -1.050 0.666 533 HG23 VAL 108 2HG2 VAL 108 -6.269 -1.240 0.652 534 H LYS 109 H LYS 109 -5.073 1.401 -2.526 535 HA LYS 109 HA LYS 109 -6.665 2.137 -4.867 536 HB2 LYS 109 1HB LYS 109 -4.797 3.962 -3.381 537 HB3 LYS 109 2HB LYS 109 -5.056 4.163 -5.109 538 HG2 LYS 109 1HG LYS 109 -7.577 3.914 -3.761 539 HG3 LYS 109 2HG LYS 109 -6.603 5.181 -3.013 540 HD2 LYS 109 1HD LYS 109 -6.235 6.159 -5.265 541 HD3 LYS 109 2HD LYS 109 -7.325 4.943 -5.933 542 HE2 LYS 109 1HE LYS 109 -8.698 6.111 -3.782 543 HE3 LYS 109 2HE LYS 109 -7.939 7.445 -4.650 544 HZ1 LYS 109 3HZ LYS 109 -10.067 5.647 -5.498 545 HZ2 LYS 109 1HZ LYS 109 -8.939 6.074 -6.687 546 HZ3 LYS 109 2HZ LYS 109 -9.810 7.276 -5.876 547 HA PRO 110 HA PRO 110 -3.445 -0.015 -7.002 548 HB2 PRO 110 1HB PRO 110 -3.686 1.077 -9.477 549 HB3 PRO 110 2HB PRO 110 -4.848 -0.081 -8.819 550 HG2 PRO 110 1HG PRO 110 -5.023 2.904 -8.964 551 HG3 PRO 110 2HG PRO 110 -6.274 1.693 -9.297 552 HD2 PRO 110 1HD PRO 110 -6.152 3.063 -6.964 553 HD3 PRO 110 2HD PRO 110 -6.762 1.400 -7.065 554 H LEU 111 H LEU 111 -1.404 0.463 -6.416 555 HA LEU 111 HA LEU 111 -0.311 3.117 -6.920 556 HB2 LEU 111 1HB LEU 111 0.076 1.191 -4.922 557 HB3 LEU 111 2HB LEU 111 1.574 1.212 -5.831 558 HG LEU 111 HG LEU 111 0.275 3.533 -4.408 559 HD11 LEU 111 1HD1 LEU 111 1.423 2.216 -2.845 560 HD12 LEU 111 2HD1 LEU 111 2.545 3.513 -3.258 561 HD13 LEU 111 3HD1 LEU 111 2.759 1.908 -3.955 562 HD21 LEU 111 3HD2 LEU 111 2.630 4.531 -5.161 563 HD22 LEU 111 1HD2 LEU 111 1.169 4.708 -6.131 564 HD23 LEU 111 2HD2 LEU 111 2.344 3.453 -6.526 565 H LEU 112 H LEU 112 1.303 3.574 -8.368 566 HA LEU 112 HA LEU 112 2.070 1.390 -10.189 567 HB2 LEU 112 1HB LEU 112 2.077 4.351 -10.756 568 HB3 LEU 112 2HB LEU 112 2.385 3.064 -11.904 569 HG LEU 112 HG LEU 112 -0.249 3.724 -10.588 570 HD11 LEU 112 1HD1 LEU 112 0.979 4.192 -13.241 571 HD12 LEU 112 2HD1 LEU 112 -0.140 5.194 -12.314 572 HD13 LEU 112 3HD1 LEU 112 -0.737 3.788 -13.197 573 HD21 LEU 112 3HD2 LEU 112 0.322 1.516 -12.560 574 HD22 LEU 112 1HD2 LEU 112 -1.213 1.883 -11.776 575 HD23 LEU 112 2HD2 LEU 112 0.137 1.267 -10.824 576 H ASP 113 H ASP 113 4.199 1.965 -11.387 577 HA ASP 113 HA ASP 113 6.264 2.020 -9.419 578 HB2 ASP 113 1HB ASP 113 6.130 0.985 -11.912 579 HB3 ASP 113 2HB ASP 113 7.016 2.469 -12.248 580 H SER 114 H SER 114 4.947 4.376 -11.672 581 HA SER 114 HA SER 114 6.991 6.330 -11.213 582 HB2 SER 114 1HB SER 114 5.124 6.030 -13.159 583 HB3 SER 114 2HB SER 114 4.348 7.261 -12.164 584 HG SER 114 HG SER 114 6.593 7.427 -13.749 585 H GLU 115 H GLU 115 3.851 5.589 -9.806 586 HA GLU 115 HA GLU 115 3.567 8.014 -8.353 587 HB2 GLU 115 1HB GLU 115 2.299 5.298 -8.109 588 HB3 GLU 115 2HB GLU 115 1.949 6.577 -6.955 589 HG2 GLU 115 1HG GLU 115 1.708 7.431 -9.730 590 HG3 GLU 115 2HG GLU 115 0.617 6.117 -9.307 591 H ILE 116 H ILE 116 5.033 4.891 -7.590 592 HA ILE 116 HA ILE 116 5.536 5.565 -4.846 593 HB ILE 116 HB ILE 116 6.803 3.381 -6.515 594 HG12 ILE 116 1HG1 ILE 116 4.561 3.041 -4.529 595 HG13 ILE 116 2HG1 ILE 116 4.248 3.368 -6.231 596 HG21 ILE 116 1HG2 ILE 116 6.546 3.366 -3.532 597 HG22 ILE 116 2HG2 ILE 116 7.908 4.165 -4.319 598 HG23 ILE 116 3HG2 ILE 116 7.636 2.439 -4.561 599 HD11 ILE 116 3HD1 ILE 116 5.827 1.320 -6.601 600 HD12 ILE 116 1HD1 ILE 116 4.129 1.088 -6.186 601 HD13 ILE 116 2HD1 ILE 116 5.367 0.937 -4.941 602 H ALA 117 H ALA 117 7.393 5.532 -7.845 603 HA ALA 117 HA ALA 117 9.933 6.157 -6.887 604 HB1 ALA 117 3HB ALA 117 8.632 7.082 -9.448 605 HB2 ALA 117 1HB ALA 117 9.428 5.523 -9.208 606 HB3 ALA 117 2HB ALA 117 10.370 7.012 -9.126 607 H LYS 118 H LYS 118 7.539 8.391 -8.248 608 HA LYS 118 HA LYS 118 8.855 10.763 -7.567 609 HB2 LYS 118 1HB LYS 118 7.215 11.599 -8.826 610 HB3 LYS 118 2HB LYS 118 6.516 9.991 -8.891 611 HG2 LYS 118 1HG LYS 118 5.888 11.739 -6.569 612 HG3 LYS 118 2HG LYS 118 5.086 12.016 -8.119 613 HD2 LYS 118 1HD LYS 118 5.015 9.251 -7.737 614 HD3 LYS 118 2HD LYS 118 4.626 9.950 -6.161 615 HE2 LYS 118 1HE LYS 118 2.555 9.759 -7.210 616 HE3 LYS 118 2HE LYS 118 2.988 11.453 -7.436 617 HZ1 LYS 118 3HZ LYS 118 4.021 10.083 -9.614 618 HZ2 LYS 118 1HZ LYS 118 2.699 11.140 -9.596 619 HZ3 LYS 118 2HZ LYS 118 2.456 9.479 -9.391 620 H PHE 119 H PHE 119 6.457 8.844 -5.806 621 HA PHE 119 HA PHE 119 5.758 10.593 -3.786 622 HB2 PHE 119 1HB PHE 119 4.708 8.436 -3.861 623 HB3 PHE 119 2HB PHE 119 6.250 7.612 -3.635 624 HD1 PHE 119 HD2 PHE 119 7.439 7.868 -1.421 625 HD2 PHE 119 HD1 PHE 119 3.391 9.046 -2.023 626 HE1 PHE 119 HE2 PHE 119 7.061 7.799 1.010 627 HE2 PHE 119 HE1 PHE 119 3.013 8.985 0.409 628 HZ PHE 119 HZ PHE 119 4.856 8.359 1.919 629 H LEU 120 H LEU 120 8.539 8.361 -3.722 630 HA LEU 120 HA LEU 120 9.573 9.246 -1.270 631 HB2 LEU 120 1HB LEU 120 11.035 8.070 -3.629 632 HB3 LEU 120 2HB LEU 120 11.683 8.239 -2.010 633 HG LEU 120 HG LEU 120 9.141 6.791 -2.075 634 HD11 LEU 120 1HD1 LEU 120 9.955 6.002 -4.209 635 HD12 LEU 120 2HD1 LEU 120 10.126 4.723 -3.009 636 HD13 LEU 120 3HD1 LEU 120 11.537 5.648 -3.516 637 HD21 LEU 120 3HD2 LEU 120 10.794 5.142 -0.863 638 HD22 LEU 120 1HD2 LEU 120 10.229 6.611 -0.068 639 HD23 LEU 120 2HD2 LEU 120 11.829 6.568 -0.807 640 H GLY 121 H GLY 121 9.905 10.487 -4.535 641 HA2 GLY 121 1HA GLY 121 11.886 12.464 -3.661 642 HA3 GLY 121 2HA GLY 121 11.396 12.153 -5.318 643 H SER 122 H SER 122 8.979 12.483 -2.823 644 HA SER 122 HA SER 122 7.652 14.569 -4.188 645 HB2 SER 122 1HB SER 122 6.068 14.533 -2.374 646 HB3 SER 122 2HB SER 122 6.559 12.871 -2.687 647 HG SER 122 HG SER 122 6.577 13.318 -0.458 648 H SER 123 H SER 123 6.855 16.496 -2.686 649 HA SER 123 HA SER 123 9.106 17.716 -1.273 650 HB2 SER 123 1HB SER 123 7.704 18.971 -3.644 651 HB3 SER 123 2HB SER 123 8.774 19.849 -2.552 652 HG SER 123 HG SER 123 9.566 18.705 -4.647 653 H LYS 124 H LYS 124 6.603 16.659 -0.309 654 HA LYS 124 HA LYS 124 5.443 19.137 0.784 655 HB2 LYS 124 1HB LYS 124 3.237 17.971 0.862 656 HB3 LYS 124 2HB LYS 124 3.818 18.308 -0.763 657 HG2 LYS 124 1HG LYS 124 4.802 15.788 -0.281 658 HG3 LYS 124 2HG LYS 124 3.234 15.763 0.528 659 HD2 LYS 124 1HD LYS 124 3.138 17.038 -2.089 660 HD3 LYS 124 2HD LYS 124 3.682 15.361 -2.166 661 HE2 LYS 124 1HE LYS 124 1.611 15.070 -0.492 662 HE3 LYS 124 2HE LYS 124 1.050 16.479 -1.391 663 HZ1 LYS 124 3HZ LYS 124 0.251 14.826 -2.708 664 HZ2 LYS 124 1HZ LYS 124 1.481 13.736 -2.311 665 HZ3 LYS 124 2HZ LYS 124 1.779 14.983 -3.412 666 H ARG 125 H ARG 125 5.582 15.602 1.275 667 HA ARG 125 HA ARG 125 6.136 16.080 4.104 668 HB2 ARG 125 1HB ARG 125 3.648 15.346 3.377 669 HB3 ARG 125 2HB ARG 125 4.396 13.758 3.468 670 HG2 ARG 125 1HG ARG 125 4.999 15.445 5.769 671 HG3 ARG 125 2HG ARG 125 3.275 15.130 5.556 672 HD2 ARG 125 1HD ARG 125 4.051 12.664 5.224 673 HD3 ARG 125 2HD ARG 125 5.511 13.205 6.050 674 HE ARG 125 HE ARG 125 4.332 13.294 8.011 675 HH11 ARG 125 1HH1 ARG 125 2.064 13.054 5.352 676 HH12 ARG 125 2HH1 ARG 125 0.696 12.800 6.378 677 HH21 ARG 125 1HH2 ARG 125 2.520 12.959 9.361 678 HH22 ARG 125 2HH2 ARG 125 0.953 12.747 8.655 679 H LYS 126 H LYS 126 8.181 15.430 4.087 680 HA LYS 126 HA LYS 126 8.801 12.753 3.027 681 HB2 LYS 126 1HB LYS 126 9.928 14.973 2.114 682 HB3 LYS 126 2HB LYS 126 10.950 14.766 3.528 683 HG2 LYS 126 1HG LYS 126 12.054 13.758 1.688 684 HG3 LYS 126 2HG LYS 126 11.462 12.459 2.724 685 HD2 LYS 126 1HD LYS 126 10.982 11.817 0.490 686 HD3 LYS 126 2HD LYS 126 9.452 12.318 1.208 687 HE2 LYS 126 1HE LYS 126 9.679 13.199 -1.048 688 HE3 LYS 126 2HE LYS 126 9.662 14.504 0.134 689 HZ1 LYS 126 3HZ LYS 126 12.260 13.434 -0.704 690 HZ2 LYS 126 1HZ LYS 126 11.835 15.008 -0.254 691 HZ3 LYS 126 2HZ LYS 126 11.422 14.428 -1.787 692 H SER 127 H SER 127 8.583 11.452 4.786 693 HA SER 127 HA SER 127 10.138 12.167 7.188 694 HB2 SER 127 1HB SER 127 7.434 10.966 6.864 695 HB3 SER 127 2HB SER 127 8.429 10.351 8.182 696 HG SER 127 HG SER 127 8.533 12.391 9.044 697 H LYS 128 H LYS 128 11.430 10.585 8.131 698 HA LYS 128 HA LYS 128 12.689 8.747 6.472 699 HB2 LYS 128 1HB LYS 128 13.385 9.700 8.804 700 HB3 LYS 128 2HB LYS 128 12.557 8.282 9.434 701 HG2 LYS 128 1HG LYS 128 14.079 7.047 7.659 702 HG3 LYS 128 2HG LYS 128 15.083 8.480 7.889 703 HD2 LYS 128 1HD LYS 128 15.926 7.088 9.513 704 HD3 LYS 128 2HD LYS 128 14.704 7.971 10.428 705 HE2 LYS 128 1HE LYS 128 13.128 6.044 9.774 706 HE3 LYS 128 2HE LYS 128 14.600 5.169 9.357 707 HZ1 LYS 128 3HZ LYS 128 15.387 5.501 11.625 708 HZ2 LYS 128 1HZ LYS 128 13.908 4.677 11.609 709 HZ3 LYS 128 2HZ LYS 128 13.960 6.317 12.021 710 H GLU 129 H GLU 129 10.042 8.261 8.771 711 HA GLU 129 HA GLU 129 9.867 5.447 8.429 712 HB2 GLU 129 1HB GLU 129 8.077 7.548 9.593 713 HB3 GLU 129 2HB GLU 129 7.451 5.928 9.324 714 HG2 GLU 129 1HG GLU 129 9.211 5.008 10.739 715 HG3 GLU 129 2HG GLU 129 9.850 6.629 10.999 716 H LEU 130 H LEU 130 8.426 8.213 6.783 717 HA LEU 130 HA LEU 130 6.562 6.628 5.281 718 HB2 LEU 130 1HB LEU 130 7.313 9.475 5.417 719 HB3 LEU 130 2HB LEU 130 6.763 8.925 3.845 720 HG LEU 130 HG LEU 130 5.119 8.304 6.266 721 HD11 LEU 130 1HD1 LEU 130 5.293 10.578 6.651 722 HD12 LEU 130 2HD1 LEU 130 3.869 10.475 5.617 723 HD13 LEU 130 3HD1 LEU 130 5.421 10.965 4.935 724 HD21 LEU 130 3HD2 LEU 130 4.172 9.063 3.526 725 HD22 LEU 130 1HD2 LEU 130 3.362 8.092 4.755 726 HD23 LEU 130 2HD2 LEU 130 4.735 7.426 3.870 727 H ILE 131 H ILE 131 9.716 8.124 4.567 728 HA ILE 131 HA ILE 131 9.805 7.373 1.857 729 HB ILE 131 HB ILE 131 12.173 7.696 3.702 730 HG12 ILE 131 1HG1 ILE 131 11.415 9.889 1.869 731 HG13 ILE 131 2HG1 ILE 131 10.311 9.625 3.216 732 HG21 ILE 131 1HG2 ILE 131 12.424 8.446 0.886 733 HG22 ILE 131 2HG2 ILE 131 12.122 6.727 1.151 734 HG23 ILE 131 3HG2 ILE 131 13.510 7.508 1.914 735 HD11 ILE 131 3HD1 ILE 131 12.619 9.612 4.554 736 HD12 ILE 131 1HD1 ILE 131 11.710 11.085 4.216 737 HD13 ILE 131 2HD1 ILE 131 13.080 10.642 3.199 738 H GLU 132 H GLU 132 11.169 5.773 4.745 739 HA GLU 132 HA GLU 132 12.294 3.568 3.483 740 HB2 GLU 132 1HB GLU 132 11.379 4.205 6.211 741 HB3 GLU 132 2HB GLU 132 11.419 2.488 5.831 742 HG2 GLU 132 1HG GLU 132 13.782 2.782 5.091 743 HG3 GLU 132 2HG GLU 132 13.702 4.436 5.695 744 H ALA 133 H ALA 133 8.960 4.287 4.219 745 HA ALA 133 HA ALA 133 7.895 1.691 3.921 746 HB1 ALA 133 3HB ALA 133 6.855 3.948 4.817 747 HB2 ALA 133 1HB ALA 133 5.844 2.668 4.147 748 HB3 ALA 133 2HB ALA 133 6.277 4.062 3.155 749 H TYR 134 H TYR 134 7.871 4.434 1.657 750 HA TYR 134 HA TYR 134 6.943 2.845 -0.511 751 HB2 TYR 134 1HB TYR 134 7.853 5.637 -0.155 752 HB3 TYR 134 2HB TYR 134 8.057 4.968 -1.772 753 HD1 TYR 134 HD2 TYR 134 5.422 5.017 0.899 754 HD2 TYR 134 HD1 TYR 134 6.332 5.325 -3.245 755 HE1 TYR 134 HE2 TYR 134 3.050 5.449 0.412 756 HE2 TYR 134 HE1 TYR 134 3.964 5.755 -3.738 757 HH TYR 134 HH TYR 134 1.743 6.629 -1.456 758 H GLU 135 H GLU 135 10.096 3.613 0.750 759 HA GLU 135 HA GLU 135 11.608 2.808 -1.518 760 HB2 GLU 135 1HB GLU 135 12.378 4.198 0.504 761 HB3 GLU 135 2HB GLU 135 12.552 2.661 1.340 762 HG2 GLU 135 1HG GLU 135 14.357 2.029 0.103 763 HG3 GLU 135 2HG GLU 135 13.862 2.965 -1.306 764 H ALA 136 H ALA 136 10.159 1.139 1.211 765 HA ALA 136 HA ALA 136 11.563 -1.335 0.787 766 HB1 ALA 136 3HB ALA 136 9.009 -0.900 2.326 767 HB2 ALA 136 1HB ALA 136 10.625 -0.638 2.983 768 HB3 ALA 136 2HB ALA 136 10.132 -2.252 2.473 769 H SER 137 H SER 137 8.401 -0.027 -0.112 770 HA SER 137 HA SER 137 7.519 -2.469 -1.358 771 HB2 SER 137 1HB SER 137 6.352 0.323 -1.463 772 HB3 SER 137 2HB SER 137 5.563 -1.138 -2.065 773 HG SER 137 HG SER 137 6.008 -0.299 0.560 774 H LYS 138 H LYS 138 9.372 0.262 -2.355 775 HA LYS 138 HA LYS 138 8.794 0.457 -5.067 776 HB2 LYS 138 1HB LYS 138 10.289 1.953 -3.672 777 HB3 LYS 138 2HB LYS 138 11.552 0.751 -3.888 778 HG2 LYS 138 1HG LYS 138 11.895 2.476 -5.490 779 HG3 LYS 138 2HG LYS 138 11.318 1.049 -6.352 780 HD2 LYS 138 1HD LYS 138 8.968 2.189 -5.949 781 HD3 LYS 138 2HD LYS 138 9.954 3.648 -5.835 782 HE2 LYS 138 1HE LYS 138 10.163 1.714 -8.132 783 HE3 LYS 138 2HE LYS 138 9.037 3.071 -8.132 784 HZ1 LYS 138 3HZ LYS 138 10.946 3.828 -9.230 785 HZ2 LYS 138 1HZ LYS 138 11.996 3.155 -8.085 786 HZ3 LYS 138 2HZ LYS 138 11.055 4.501 -7.683 787 H THR 139 H THR 139 10.380 -2.104 -3.397 788 HA THR 139 HA THR 139 11.602 -3.159 -5.833 789 HB THR 139 HB THR 139 11.710 -4.288 -3.031 790 HG1 THR 139 HG1 THR 139 13.167 -2.863 -2.600 791 HG21 THR 139 3HG2 THR 139 13.137 -4.940 -5.559 792 HG22 THR 139 1HG2 THR 139 12.504 -6.009 -4.308 793 HG23 THR 139 2HG2 THR 139 13.985 -5.095 -4.020 794 HA PRO 140 HA PRO 140 7.476 -5.214 -6.279 795 HB2 PRO 140 1HB PRO 140 8.550 -6.332 -8.686 796 HB3 PRO 140 2HB PRO 140 7.320 -5.083 -8.522 797 HG2 PRO 140 1HG PRO 140 10.181 -4.824 -9.120 798 HG3 PRO 140 2HG PRO 140 8.861 -3.682 -9.406 799 HD2 PRO 140 1HD PRO 140 10.774 -3.309 -7.510 800 HD3 PRO 140 2HD PRO 140 9.122 -2.673 -7.371 801 HA PRO 141 HA PRO 141 10.092 -9.439 -6.829 802 HB2 PRO 141 1HB PRO 141 12.483 -8.332 -5.412 803 HB3 PRO 141 2HB PRO 141 12.396 -9.585 -6.659 804 HG2 PRO 141 1HG PRO 141 13.195 -7.162 -7.306 805 HG3 PRO 141 2HG PRO 141 12.063 -8.024 -8.369 806 HD2 PRO 141 1HD PRO 141 11.533 -5.820 -6.420 807 HD3 PRO 141 2HD PRO 141 10.841 -6.088 -8.031 808 H ASP 142 H ASP 142 11.162 -10.813 -4.917 809 HA ASP 142 HA ASP 142 10.897 -11.728 -2.865 810 HB2 ASP 142 1HB ASP 142 11.830 -9.317 -2.363 811 HB3 ASP 142 2HB ASP 142 10.230 -9.073 -1.677 812 H LEU 143 H LEU 143 8.780 -12.040 -4.426 813 HA LEU 143 HA LEU 143 6.664 -12.582 -2.696 814 HB2 LEU 143 1HB LEU 143 6.293 -10.194 -2.584 815 HB3 LEU 143 2HB LEU 143 6.295 -10.071 -4.332 816 HG LEU 143 HG LEU 143 4.195 -11.284 -4.467 817 HD11 LEU 143 1HD1 LEU 143 4.608 -12.751 -2.491 818 HD12 LEU 143 2HD1 LEU 143 2.990 -12.056 -2.558 819 HD13 LEU 143 3HD1 LEU 143 4.192 -11.384 -1.456 820 HD21 LEU 143 3HD2 LEU 143 4.354 -8.777 -3.907 821 HD22 LEU 143 1HD2 LEU 143 3.799 -9.252 -2.302 822 HD23 LEU 143 2HD2 LEU 143 2.798 -9.585 -3.716 823 H LYS 144 H LYS 144 7.423 -11.629 -6.041 824 HA LYS 144 HA LYS 144 5.402 -13.059 -7.336 825 HB2 LYS 144 1HB LYS 144 8.187 -12.498 -8.376 826 HB3 LYS 144 2HB LYS 144 6.783 -12.913 -9.347 827 HG2 LYS 144 1HG LYS 144 6.346 -10.755 -9.555 828 HG3 LYS 144 2HG LYS 144 6.028 -10.682 -7.821 829 HD2 LYS 144 1HD LYS 144 7.737 -9.241 -7.716 830 HD3 LYS 144 2HD LYS 144 8.783 -10.639 -7.960 831 HE2 LYS 144 1HE LYS 144 9.405 -8.958 -9.545 832 HE3 LYS 144 2HE LYS 144 8.602 -10.263 -10.417 833 HZ1 LYS 144 3HZ LYS 144 6.732 -8.980 -10.782 834 HZ2 LYS 144 1HZ LYS 144 7.968 -7.835 -10.930 835 HZ3 LYS 144 2HZ LYS 144 7.059 -7.918 -9.506 836 H GLU 145 H GLU 145 8.838 -14.074 -7.202 837 HA GLU 145 HA GLU 145 7.993 -16.840 -7.597 838 HB2 GLU 145 1HB GLU 145 10.067 -15.461 -8.663 839 HB3 GLU 145 2HB GLU 145 10.870 -16.220 -7.295 840 HG2 GLU 145 1HG GLU 145 11.190 -17.890 -8.756 841 HG3 GLU 145 2HG GLU 145 9.553 -18.341 -8.285 842 H GLU 146 H GLU 146 7.908 -18.305 -6.013 843 HA GLU 146 HA GLU 146 9.384 -17.782 -3.525 844 HB2 GLU 146 1HB GLU 146 6.981 -17.147 -3.285 845 HB3 GLU 146 2HB GLU 146 6.547 -18.812 -3.645 846 HG2 GLU 146 1HG GLU 146 7.978 -19.460 -1.656 847 HG3 GLU 146 2HG GLU 146 8.000 -17.745 -1.247 848 H SER 147 H SER 147 10.690 -19.400 -3.065 849 HA SER 147 HA SER 147 11.649 -21.448 -2.953 850 HB2 SER 147 1HB SER 147 9.150 -21.778 -1.964 851 HB3 SER 147 2HB SER 147 9.117 -22.942 -3.290 852 HG SER 147 HG SER 147 10.944 -23.931 -2.415 853 H SER 148 H SER 148 10.962 -20.226 -5.652 854 HA SER 148 HA SER 148 11.345 -20.722 -7.834 855 HB2 SER 148 1HB SER 148 12.566 -23.056 -6.441 856 HB3 SER 148 2HB SER 148 12.325 -23.174 -8.184 857 HG SER 148 HG SER 148 14.372 -22.286 -7.621 858 H THR 149 H THR 149 9.706 -20.945 -9.182 859 HA THR 149 HA THR 149 7.794 -23.129 -8.757 860 HB THR 149 HB THR 149 6.209 -21.826 -10.042 861 HG1 THR 149 HG1 THR 149 8.216 -19.852 -10.369 862 HG21 THR 149 3HG2 THR 149 5.723 -20.212 -8.529 863 HG22 THR 149 1HG2 THR 149 7.395 -19.658 -8.410 864 HG23 THR 149 2HG2 THR 149 6.894 -21.136 -7.589 865 H ASP 150 H ASP 150 10.218 -23.869 -9.934 866 HA ASP 150 HA ASP 150 9.266 -24.878 -12.483 867 HB2 ASP 150 1HB ASP 150 10.686 -22.628 -12.690 868 HB3 ASP 150 2HB ASP 150 12.029 -23.759 -12.563 869 H LEU 151 H LEU 151 10.911 -26.489 -13.413 870 HA LEU 151 HA LEU 151 11.876 -28.136 -11.196 871 HB2 LEU 151 1HB LEU 151 10.402 -28.824 -13.338 872 HB3 LEU 151 2HB LEU 151 12.000 -29.123 -13.991 873 HG LEU 151 HG LEU 151 11.108 -31.176 -13.109 874 HD11 LEU 151 1HD1 LEU 151 12.869 -31.828 -11.623 875 HD12 LEU 151 2HD1 LEU 151 13.177 -30.151 -11.176 876 HD13 LEU 151 3HD1 LEU 151 13.528 -30.703 -12.813 877 HD21 LEU 151 3HD2 LEU 151 10.899 -31.110 -10.443 878 HD22 LEU 151 1HD2 LEU 151 9.532 -30.827 -11.520 879 HD23 LEU 151 2HD2 LEU 151 10.393 -29.462 -10.808 880 H GLU 152 H GLU 152 13.961 -28.177 -10.677 881 HA GLU 152 HA GLU 152 15.957 -27.725 -12.783 882 HB2 GLU 152 1HB GLU 152 15.900 -26.388 -10.074 883 HB3 GLU 152 2HB GLU 152 17.287 -26.368 -11.153 884 HG2 GLU 152 1HG GLU 152 15.782 -25.305 -12.877 885 HG3 GLU 152 2HG GLU 152 14.591 -25.119 -11.590 Start of MODEL 8 1 H1 SER 45 1H SER 45 -16.746 3.337 -16.185 2 H2 SER 45 2H SER 45 -16.834 1.626 -16.287 3 H3 SER 45 3H SER 45 -15.435 2.378 -15.639 4 HA SER 45 HA SER 45 -16.553 3.088 -13.752 5 HB2 SER 45 1HB SER 45 -19.116 2.216 -13.743 6 HB3 SER 45 2HB SER 45 -18.657 3.831 -14.278 7 HG SER 45 HG SER 45 -19.839 3.067 -15.930 8 H ALA 46 H ALA 46 -15.739 1.665 -12.328 9 HA ALA 46 HA ALA 46 -16.947 -0.857 -11.853 10 HB1 ALA 46 3HB ALA 46 -15.885 -1.999 -13.481 11 HB2 ALA 46 1HB ALA 46 -14.545 -1.988 -12.334 12 HB3 ALA 46 2HB ALA 46 -14.603 -0.799 -13.634 13 H ASP 47 H ASP 47 -15.861 -2.080 -10.129 14 HA ASP 47 HA ASP 47 -14.106 -0.378 -8.487 15 HB2 ASP 47 1HB ASP 47 -16.491 -0.488 -7.674 16 HB3 ASP 47 2HB ASP 47 -16.248 -2.210 -7.396 17 H ASP 48 H ASP 48 -13.190 -2.363 -10.288 18 HA ASP 48 HA ASP 48 -11.836 -4.114 -8.391 19 HB2 ASP 48 1HB ASP 48 -12.193 -6.101 -9.857 20 HB3 ASP 48 2HB ASP 48 -13.671 -5.510 -9.106 21 H ARG 49 H ARG 49 -9.959 -2.965 -8.761 22 HA ARG 49 HA ARG 49 -8.695 -3.452 -11.371 23 HB2 ARG 49 1HB ARG 49 -9.366 -0.889 -10.212 24 HB3 ARG 49 2HB ARG 49 -7.626 -1.030 -10.401 25 HG2 ARG 49 1HG ARG 49 -7.790 -1.296 -12.727 26 HG3 ARG 49 2HG ARG 49 -9.520 -1.637 -12.649 27 HD2 ARG 49 1HD ARG 49 -9.604 0.772 -11.585 28 HD3 ARG 49 2HD ARG 49 -8.082 0.969 -12.450 29 HE ARG 49 HE ARG 49 -9.280 1.149 -14.379 30 HH11 ARG 49 1HH1 ARG 49 -11.264 -0.498 -12.014 31 HH12 ARG 49 2HH1 ARG 49 -12.658 -0.557 -13.036 32 HH21 ARG 49 1HH2 ARG 49 -11.125 1.073 -15.729 33 HH22 ARG 49 2HH2 ARG 49 -12.580 0.335 -15.149 34 H LEU 50 H LEU 50 -8.468 -4.909 -8.877 35 HA LEU 50 HA LEU 50 -5.597 -4.525 -8.394 36 HB2 LEU 50 1HB LEU 50 -7.417 -5.358 -6.162 37 HB3 LEU 50 2HB LEU 50 -5.791 -4.712 -6.073 38 HG LEU 50 HG LEU 50 -7.041 -2.577 -7.133 39 HD11 LEU 50 1HD1 LEU 50 -9.239 -2.389 -6.684 40 HD12 LEU 50 2HD1 LEU 50 -9.124 -3.314 -5.188 41 HD13 LEU 50 3HD1 LEU 50 -9.193 -4.152 -6.737 42 HD21 LEU 50 3HD2 LEU 50 -7.330 -2.939 -4.196 43 HD22 LEU 50 1HD2 LEU 50 -6.688 -1.577 -5.110 44 HD23 LEU 50 2HD2 LEU 50 -5.716 -3.031 -4.899 45 H ASN 51 H ASN 51 -4.402 -6.372 -8.271 46 HA ASN 51 HA ASN 51 -5.837 -8.940 -8.265 47 HB2 ASN 51 1HB ASN 51 -4.040 -7.836 -10.330 48 HB3 ASN 51 2HB ASN 51 -3.703 -9.499 -9.866 49 HD21 ASN 51 2HD2 ASN 51 -4.313 -9.704 -12.213 50 HD22 ASN 51 1HD2 ASN 51 -5.989 -9.999 -12.561 51 H PHE 52 H PHE 52 -3.939 -10.759 -8.227 52 HA PHE 52 HA PHE 52 -2.747 -10.464 -5.643 53 HB2 PHE 52 1HB PHE 52 -2.145 -12.671 -7.614 54 HB3 PHE 52 2HB PHE 52 -2.046 -12.728 -5.853 55 HD1 PHE 52 HD1 PHE 52 -4.586 -11.655 -4.981 56 HD2 PHE 52 HD2 PHE 52 -3.721 -14.211 -8.275 57 HE1 PHE 52 HE1 PHE 52 -6.877 -12.546 -4.889 58 HE2 PHE 52 HE2 PHE 52 -6.010 -15.106 -8.185 59 HZ PHE 52 HZ PHE 52 -7.592 -14.274 -6.491 60 H GLY 53 H GLY 53 -0.724 -9.930 -5.089 61 HA2 GLY 53 1HA GLY 53 1.513 -9.408 -5.273 62 HA3 GLY 53 2HA GLY 53 1.512 -10.163 -6.858 63 H ASP 54 H ASP 54 -0.584 -7.500 -5.869 64 HA ASP 54 HA ASP 54 0.840 -5.758 -7.763 65 HB2 ASP 54 1HB ASP 54 -1.920 -6.554 -7.690 66 HB3 ASP 54 2HB ASP 54 -1.812 -4.818 -7.429 67 H ARG 55 H ARG 55 1.615 -3.923 -6.975 68 HA ARG 55 HA ARG 55 1.463 -3.291 -4.221 69 HB2 ARG 55 1HB ARG 55 2.413 -1.602 -6.546 70 HB3 ARG 55 2HB ARG 55 2.676 -1.219 -4.851 71 HG2 ARG 55 1HG ARG 55 4.406 -2.617 -4.684 72 HG3 ARG 55 2HG ARG 55 3.586 -3.892 -5.586 73 HD2 ARG 55 1HD ARG 55 4.677 -1.455 -6.956 74 HD3 ARG 55 2HD ARG 55 5.703 -2.845 -6.604 75 HE ARG 55 HE ARG 55 3.348 -3.672 -7.935 76 HH11 ARG 55 1HH1 ARG 55 6.388 -2.047 -8.538 77 HH12 ARG 55 2HH1 ARG 55 6.453 -2.525 -10.199 78 HH21 ARG 55 1HH2 ARG 55 3.435 -4.292 -10.126 79 HH22 ARG 55 2HH2 ARG 55 4.776 -3.796 -11.102 80 H ILE 56 H ILE 56 -0.248 -2.484 -3.217 81 HA ILE 56 HA ILE 56 -1.834 -0.402 -4.573 82 HB ILE 56 HB ILE 56 -3.877 -1.285 -3.527 83 HG12 ILE 56 1HG1 ILE 56 -2.183 -3.682 -2.780 84 HG13 ILE 56 2HG1 ILE 56 -2.751 -2.466 -1.641 85 HG21 ILE 56 1HG2 ILE 56 -3.834 -1.990 -5.691 86 HG22 ILE 56 2HG2 ILE 56 -3.792 -3.561 -4.890 87 HG23 ILE 56 3HG2 ILE 56 -2.302 -2.843 -5.503 88 HD11 ILE 56 3HD1 ILE 56 -4.646 -3.571 -1.391 89 HD12 ILE 56 1HD1 ILE 56 -4.059 -4.807 -2.501 90 HD13 ILE 56 2HD1 ILE 56 -4.979 -3.435 -3.117 91 H LEU 57 H LEU 57 -2.837 1.146 -3.221 92 HA LEU 57 HA LEU 57 -1.400 1.571 -0.714 93 HB2 LEU 57 1HB LEU 57 -2.297 3.263 -2.779 94 HB3 LEU 57 2HB LEU 57 -3.274 3.659 -1.377 95 HG LEU 57 HG LEU 57 -1.279 4.131 -0.069 96 HD11 LEU 57 1HD1 LEU 57 0.556 2.983 -0.619 97 HD12 LEU 57 2HD1 LEU 57 0.827 4.249 -1.813 98 HD13 LEU 57 3HD1 LEU 57 0.025 2.752 -2.285 99 HD21 LEU 57 3HD2 LEU 57 -0.621 6.148 -1.134 100 HD22 LEU 57 1HD2 LEU 57 -2.307 5.869 -1.569 101 HD23 LEU 57 2HD2 LEU 57 -1.028 5.517 -2.730 102 H VAL 58 H VAL 58 -2.362 1.711 1.271 103 HA VAL 58 HA VAL 58 -5.264 1.262 1.413 104 HB VAL 58 HB VAL 58 -3.259 -0.178 3.153 105 HG11 VAL 58 1HG1 VAL 58 -5.981 -1.218 2.912 106 HG12 VAL 58 2HG1 VAL 58 -5.884 0.372 3.665 107 HG13 VAL 58 3HG1 VAL 58 -4.977 -0.979 4.343 108 HG21 VAL 58 3HG2 VAL 58 -4.482 -0.902 0.553 109 HG22 VAL 58 1HG2 VAL 58 -4.391 -2.166 1.781 110 HG23 VAL 58 2HG2 VAL 58 -2.922 -1.354 1.240 111 H LYS 59 H LYS 59 -6.263 2.638 2.736 112 HA LYS 59 HA LYS 59 -4.637 4.219 4.596 113 HB2 LYS 59 1HB LYS 59 -6.267 5.184 2.760 114 HB3 LYS 59 2HB LYS 59 -7.489 4.866 3.981 115 HG2 LYS 59 1HG LYS 59 -5.265 6.208 5.179 116 HG3 LYS 59 2HG LYS 59 -5.810 7.099 3.758 117 HD2 LYS 59 1HD LYS 59 -7.961 7.396 4.620 118 HD3 LYS 59 2HD LYS 59 -7.763 6.100 5.802 119 HE2 LYS 59 1HE LYS 59 -7.553 7.966 7.135 120 HE3 LYS 59 2HE LYS 59 -5.870 7.628 6.741 121 HZ1 LYS 59 3HZ LYS 59 -5.726 9.438 5.376 122 HZ2 LYS 59 1HZ LYS 59 -6.847 10.023 6.499 123 HZ3 LYS 59 2HZ LYS 59 -7.375 9.448 4.999 124 H ALA 60 H ALA 60 -4.824 3.956 6.732 125 HA ALA 60 HA ALA 60 -6.999 2.243 7.732 126 HB1 ALA 60 3HB ALA 60 -5.463 1.936 9.719 127 HB2 ALA 60 1HB ALA 60 -4.221 2.751 8.767 128 HB3 ALA 60 2HB ALA 60 -4.914 1.233 8.198 129 HA PRO 61 HA PRO 61 -8.959 5.455 10.032 130 HB2 PRO 61 1HB PRO 61 -8.788 3.619 12.376 131 HB3 PRO 61 2HB PRO 61 -10.192 4.451 11.700 132 HG2 PRO 61 1HG PRO 61 -9.845 1.852 11.283 133 HG3 PRO 61 2HG PRO 61 -10.452 2.901 9.988 134 HD2 PRO 61 1HD PRO 61 -7.726 1.735 10.363 135 HD3 PRO 61 2HD PRO 61 -8.646 2.001 8.867 136 H GLY 62 H GLY 62 -7.817 7.205 10.585 137 HA2 GLY 62 1HA GLY 62 -6.506 8.608 11.858 138 HA3 GLY 62 2HA GLY 62 -6.363 7.314 13.038 139 H TYR 63 H TYR 63 -5.446 6.708 9.735 140 HA TYR 63 HA TYR 63 -2.634 7.248 10.257 141 HB2 TYR 63 1HB TYR 63 -3.822 4.520 10.048 142 HB3 TYR 63 2HB TYR 63 -2.253 4.796 9.302 143 HD1 TYR 63 HD1 TYR 63 -0.640 6.264 10.994 144 HD2 TYR 63 HD2 TYR 63 -3.732 3.573 12.136 145 HE1 TYR 63 HE1 TYR 63 0.457 5.937 13.170 146 HE2 TYR 63 HE2 TYR 63 -2.644 3.241 14.316 147 HH TYR 63 HH TYR 63 -0.220 3.449 15.219 148 HA PRO 64 HA PRO 64 -2.990 8.543 6.000 149 HB2 PRO 64 1HB PRO 64 -0.043 8.150 6.038 150 HB3 PRO 64 2HB PRO 64 -0.984 9.570 5.567 151 HG2 PRO 64 1HG PRO 64 0.319 9.522 7.885 152 HG3 PRO 64 2HG PRO 64 -1.292 10.255 7.768 153 HD2 PRO 64 1HD PRO 64 -0.495 7.592 8.880 154 HD3 PRO 64 2HD PRO 64 -1.703 8.749 9.479 155 H TRP 65 H TRP 65 -2.112 7.834 3.829 156 HA TRP 65 HA TRP 65 -2.625 5.061 3.475 157 HB2 TRP 65 1HB TRP 65 -1.513 7.083 1.516 158 HB3 TRP 65 2HB TRP 65 -2.096 5.477 1.093 159 HD1 TRP 65 HD1 TRP 65 -3.416 8.843 2.444 160 HE1 TRP 65 HE1 TRP 65 -5.903 9.039 1.824 161 HE3 TRP 65 HE3 TRP 65 -4.121 4.198 0.417 162 HZ2 TRP 65 HZ2 TRP 65 -7.901 7.441 0.633 163 HZ3 TRP 65 HZ3 TRP 65 -6.353 3.614 -0.439 164 HH2 TRP 65 HH2 TRP 65 -8.203 5.204 -0.331 165 H TRP 66 H TRP 66 -1.280 3.361 3.258 166 HA TRP 66 HA TRP 66 1.619 3.902 3.265 167 HB2 TRP 66 1HB TRP 66 0.237 2.724 5.311 168 HB3 TRP 66 2HB TRP 66 0.753 1.318 4.384 169 HD1 TRP 66 HD1 TRP 66 3.001 0.396 5.173 170 HE1 TRP 66 HE1 TRP 66 5.125 1.371 6.255 171 HE3 TRP 66 HE3 TRP 66 1.627 5.315 5.377 172 HZ2 TRP 66 HZ2 TRP 66 6.086 3.889 7.086 173 HZ3 TRP 66 HZ3 TRP 66 3.211 6.942 6.325 174 HH2 TRP 66 HH2 TRP 66 5.396 6.239 7.154 175 HA PRO 67 HA PRO 67 1.771 1.397 -0.384 176 HB2 PRO 67 1HB PRO 67 4.386 0.743 -0.422 177 HB3 PRO 67 2HB PRO 67 3.824 2.389 -0.740 178 HG2 PRO 67 1HG PRO 67 4.954 1.223 1.774 179 HG3 PRO 67 2HG PRO 67 5.291 2.792 1.019 180 HD2 PRO 67 1HD PRO 67 3.589 2.482 3.122 181 HD3 PRO 67 2HD PRO 67 3.415 3.766 1.914 182 H ALA 68 H ALA 68 0.607 -0.454 -0.087 183 HA ALA 68 HA ALA 68 1.968 -2.714 1.246 184 HB1 ALA 68 3HB ALA 68 -0.939 -1.971 1.089 185 HB2 ALA 68 1HB ALA 68 0.046 -2.314 2.513 186 HB3 ALA 68 2HB ALA 68 -0.427 -3.625 1.430 187 H LEU 69 H LEU 69 1.124 -4.893 0.339 188 HA LEU 69 HA LEU 69 0.793 -4.701 -2.581 189 HB2 LEU 69 1HB LEU 69 2.969 -5.902 -1.065 190 HB3 LEU 69 2HB LEU 69 2.215 -7.050 -2.155 191 HG LEU 69 HG LEU 69 2.822 -4.438 -3.367 192 HD11 LEU 69 1HD1 LEU 69 5.026 -6.253 -2.402 193 HD12 LEU 69 2HD1 LEU 69 4.775 -4.558 -1.986 194 HD13 LEU 69 3HD1 LEU 69 5.230 -5.002 -3.630 195 HD21 LEU 69 3HD2 LEU 69 1.982 -6.354 -4.636 196 HD22 LEU 69 1HD2 LEU 69 3.408 -7.285 -4.176 197 HD23 LEU 69 2HD2 LEU 69 3.578 -5.855 -5.196 198 H LEU 70 H LEU 70 -0.986 -5.698 -3.234 199 HA LEU 70 HA LEU 70 -2.648 -7.215 -1.559 200 HB2 LEU 70 1HB LEU 70 -2.974 -6.004 -3.948 201 HB3 LEU 70 2HB LEU 70 -2.865 -7.674 -4.472 202 HG LEU 70 HG LEU 70 -4.776 -6.859 -2.303 203 HD11 LEU 70 1HD1 LEU 70 -6.335 -7.071 -4.521 204 HD12 LEU 70 2HD1 LEU 70 -4.918 -6.242 -5.161 205 HD13 LEU 70 3HD1 LEU 70 -5.803 -5.551 -3.802 206 HD21 LEU 70 3HD2 LEU 70 -4.822 -9.126 -2.314 207 HD22 LEU 70 1HD2 LEU 70 -4.274 -9.241 -3.986 208 HD23 LEU 70 2HD2 LEU 70 -5.956 -8.851 -3.634 209 H LEU 71 H LEU 71 -2.763 -9.320 -1.064 210 HA LEU 71 HA LEU 71 -0.860 -11.139 -2.377 211 HB2 LEU 71 1HB LEU 71 -2.241 -11.587 0.264 212 HB3 LEU 71 2HB LEU 71 -0.877 -12.471 -0.391 213 HG LEU 71 HG LEU 71 -0.543 -9.551 0.119 214 HD11 LEU 71 1HD1 LEU 71 -0.260 -9.741 2.404 215 HD12 LEU 71 2HD1 LEU 71 -0.107 -11.496 2.346 216 HD13 LEU 71 3HD1 LEU 71 -1.684 -10.740 2.118 217 HD21 LEU 71 3HD2 LEU 71 1.679 -10.034 0.150 218 HD22 LEU 71 1HD2 LEU 71 1.127 -11.363 -0.870 219 HD23 LEU 71 2HD2 LEU 71 1.437 -11.637 0.845 220 H ARG 72 H ARG 72 -4.117 -11.227 -0.886 221 HA ARG 72 HA ARG 72 -5.104 -12.772 -3.138 222 HB2 ARG 72 1HB ARG 72 -4.533 -13.943 -0.512 223 HB3 ARG 72 2HB ARG 72 -6.170 -14.244 -1.078 224 HG2 ARG 72 1HG ARG 72 -4.705 -14.804 -3.307 225 HG3 ARG 72 2HG ARG 72 -3.620 -15.325 -2.017 226 HD2 ARG 72 1HD ARG 72 -5.945 -16.377 -1.143 227 HD3 ARG 72 2HD ARG 72 -6.216 -16.429 -2.884 228 HE ARG 72 HE ARG 72 -3.663 -17.480 -2.114 229 HH11 ARG 72 1HH1 ARG 72 -7.060 -18.260 -2.479 230 HH12 ARG 72 2HH1 ARG 72 -6.773 -19.953 -2.689 231 HH21 ARG 72 1HH2 ARG 72 -3.297 -19.716 -2.385 232 HH22 ARG 72 2HH2 ARG 72 -4.640 -20.779 -2.634 233 H ARG 73 H ARG 73 -7.457 -13.072 -3.084 234 HA ARG 73 HA ARG 73 -8.780 -10.884 -1.618 235 HB2 ARG 73 1HB ARG 73 -8.699 -10.815 -4.172 236 HB3 ARG 73 2HB ARG 73 -9.799 -12.187 -4.142 237 HG2 ARG 73 1HG ARG 73 -11.479 -10.884 -3.018 238 HG3 ARG 73 2HG ARG 73 -10.370 -9.520 -2.863 239 HD2 ARG 73 1HD ARG 73 -10.330 -9.204 -5.239 240 HD3 ARG 73 2HD ARG 73 -11.243 -10.688 -5.501 241 HE ARG 73 HE ARG 73 -12.907 -9.220 -3.965 242 HH11 ARG 73 1HH1 ARG 73 -11.174 -8.497 -6.922 243 HH12 ARG 73 2HH1 ARG 73 -12.376 -7.397 -7.503 244 HH21 ARG 73 1HH2 ARG 73 -14.492 -7.773 -4.744 245 HH22 ARG 73 2HH2 ARG 73 -14.259 -6.987 -6.269 246 H LYS 74 H LYS 74 -9.609 -11.820 0.183 247 HA LYS 74 HA LYS 74 -11.071 -14.352 -0.106 248 HB2 LYS 74 1HB LYS 74 -11.017 -14.279 2.463 249 HB3 LYS 74 2HB LYS 74 -9.520 -14.628 1.611 250 HG2 LYS 74 1HG LYS 74 -8.554 -12.651 2.204 251 HG3 LYS 74 2HG LYS 74 -10.097 -11.801 2.310 252 HD2 LYS 74 1HD LYS 74 -10.060 -13.877 4.265 253 HD3 LYS 74 2HD LYS 74 -8.570 -12.943 4.406 254 HE2 LYS 74 1HE LYS 74 -10.195 -10.895 4.234 255 HE3 LYS 74 2HE LYS 74 -11.405 -12.068 4.755 256 HZ1 LYS 74 3HZ LYS 74 -10.674 -11.265 6.751 257 HZ2 LYS 74 1HZ LYS 74 -9.090 -11.015 6.215 258 HZ3 LYS 74 2HZ LYS 74 -9.623 -12.577 6.574 259 H GLU 75 H GLU 75 -13.168 -14.166 -0.425 260 HA GLU 75 HA GLU 75 -14.615 -11.843 0.595 261 HB2 GLU 75 1HB GLU 75 -14.873 -12.447 -1.779 262 HB3 GLU 75 2HB GLU 75 -15.498 -14.021 -1.306 263 HG2 GLU 75 1HG GLU 75 -17.230 -12.532 0.023 264 HG3 GLU 75 2HG GLU 75 -16.791 -11.354 -1.210 265 H THR 76 H THR 76 -15.390 -12.050 2.597 266 HA THR 76 HA THR 76 -16.735 -14.576 3.296 267 HB THR 76 HB THR 76 -14.571 -14.342 4.481 268 HG1 THR 76 HG1 THR 76 -16.267 -15.428 5.523 269 HG21 THR 76 3HG2 THR 76 -15.804 -11.943 5.805 270 HG22 THR 76 1HG2 THR 76 -14.459 -11.912 4.667 271 HG23 THR 76 2HG2 THR 76 -14.271 -12.705 6.230 272 H LYS 77 H LYS 77 -18.848 -14.273 3.597 273 HA LYS 77 HA LYS 77 -20.011 -11.692 3.731 274 HB2 LYS 77 1HB LYS 77 -21.531 -14.128 4.590 275 HB3 LYS 77 2HB LYS 77 -22.094 -12.720 3.701 276 HG2 LYS 77 1HG LYS 77 -21.993 -14.020 1.902 277 HG3 LYS 77 2HG LYS 77 -20.244 -13.798 1.989 278 HD2 LYS 77 1HD LYS 77 -20.062 -15.825 3.359 279 HD3 LYS 77 2HD LYS 77 -21.810 -16.049 3.253 280 HE2 LYS 77 1HE LYS 77 -20.856 -15.723 0.616 281 HE3 LYS 77 2HE LYS 77 -19.769 -16.856 1.417 282 HZ1 LYS 77 3HZ LYS 77 -22.046 -17.886 2.195 283 HZ2 LYS 77 1HZ LYS 77 -21.369 -18.279 0.694 284 HZ3 LYS 77 2HZ LYS 77 -22.613 -17.137 0.787 285 H ASP 78 H ASP 78 -21.424 -10.890 5.444 286 HA ASP 78 HA ASP 78 -20.397 -11.596 8.111 287 HB2 ASP 78 1HB ASP 78 -20.210 -9.147 6.805 288 HB3 ASP 78 2HB ASP 78 -21.558 -8.928 7.910 289 H SER 79 H SER 79 -22.481 -13.062 7.254 290 HA SER 79 HA SER 79 -24.948 -11.840 8.217 291 HB2 SER 79 1HB SER 79 -24.257 -14.089 6.479 292 HB3 SER 79 2HB SER 79 -25.542 -14.477 7.622 293 HG SER 79 HG SER 79 -25.493 -12.274 5.825 294 H LEU 80 H LEU 80 -22.656 -12.531 10.033 295 HA LEU 80 HA LEU 80 -24.244 -13.844 12.075 296 HB2 LEU 80 1HB LEU 80 -21.876 -15.061 10.777 297 HB3 LEU 80 2HB LEU 80 -21.933 -15.166 12.524 298 HG LEU 80 HG LEU 80 -24.319 -16.026 10.937 299 HD11 LEU 80 1HD1 LEU 80 -22.613 -17.198 9.789 300 HD12 LEU 80 2HD1 LEU 80 -23.314 -18.336 10.941 301 HD13 LEU 80 3HD1 LEU 80 -21.763 -17.571 11.287 302 HD21 LEU 80 3HD2 LEU 80 -24.065 -17.786 12.927 303 HD22 LEU 80 1HD2 LEU 80 -24.878 -16.234 13.127 304 HD23 LEU 80 2HD2 LEU 80 -23.207 -16.429 13.654 305 H ASN 81 H ASN 81 -23.196 -11.144 11.650 306 HA ASN 81 HA ASN 81 -21.558 -10.933 14.085 307 HB2 ASN 81 1HB ASN 81 -20.777 -10.219 11.427 308 HB3 ASN 81 2HB ASN 81 -20.927 -8.746 12.377 309 HD21 ASN 81 2HD2 ASN 81 -18.633 -8.538 12.112 310 HD22 ASN 81 1HD2 ASN 81 -17.561 -9.431 13.145 311 H THR 82 H THR 82 -22.980 -8.602 11.797 312 HA THR 82 HA THR 82 -24.846 -7.688 13.844 313 HB THR 82 HB THR 82 -22.810 -6.359 14.203 314 HG1 THR 82 HG1 THR 82 -24.914 -4.872 13.015 315 HG21 THR 82 3HG2 THR 82 -22.420 -6.418 11.508 316 HG22 THR 82 1HG2 THR 82 -21.602 -5.340 12.637 317 HG23 THR 82 2HG2 THR 82 -23.026 -4.781 11.760 318 H ASN 83 H ASN 83 -25.204 -9.093 11.366 319 HA ASN 83 HA ASN 83 -26.530 -9.112 9.529 320 HB2 ASN 83 1HB ASN 83 -27.926 -7.760 11.408 321 HB3 ASN 83 2HB ASN 83 -27.846 -6.536 10.147 322 HD21 ASN 83 2HD2 ASN 83 -29.364 -9.346 11.231 323 HD22 ASN 83 1HD2 ASN 83 -30.339 -9.656 9.828 324 H SER 84 H SER 84 -24.069 -8.200 8.951 325 HA SER 84 HA SER 84 -24.329 -5.728 7.415 326 HB2 SER 84 1HB SER 84 -22.232 -6.794 8.873 327 HB3 SER 84 2HB SER 84 -21.773 -7.134 7.204 328 HG SER 84 HG SER 84 -22.534 -4.593 8.221 329 H SER 85 H SER 85 -23.220 -9.078 6.855 330 HA SER 85 HA SER 85 -23.354 -10.452 5.056 331 HB2 SER 85 1HB SER 85 -25.591 -8.616 4.643 332 HB3 SER 85 2HB SER 85 -24.952 -9.266 3.134 333 HG SER 85 HG SER 85 -26.607 -10.468 4.672 334 H PHE 86 H PHE 86 -21.932 -10.790 3.476 335 HA PHE 86 HA PHE 86 -20.363 -10.473 1.882 336 HB2 PHE 86 1HB PHE 86 -22.281 -8.276 1.343 337 HB3 PHE 86 2HB PHE 86 -20.705 -8.173 0.569 338 HD1 PHE 86 HD1 PHE 86 -23.410 -10.671 1.158 339 HD2 PHE 86 HD2 PHE 86 -20.489 -9.116 -1.517 340 HE1 PHE 86 HE1 PHE 86 -24.183 -12.224 -0.581 341 HE2 PHE 86 HE2 PHE 86 -21.260 -10.667 -3.266 342 HZ PHE 86 HZ PHE 86 -23.110 -12.224 -2.800 343 H ASN 87 H ASN 87 -18.586 -10.306 3.164 344 HA ASN 87 HA ASN 87 -17.547 -7.589 3.557 345 HB2 ASN 87 1HB ASN 87 -18.076 -9.622 5.597 346 HB3 ASN 87 2HB ASN 87 -16.408 -9.061 5.617 347 HD21 ASN 87 2HD2 ASN 87 -19.698 -7.740 5.347 348 HD22 ASN 87 1HD2 ASN 87 -19.417 -6.386 6.398 349 H VAL 88 H VAL 88 -16.461 -8.007 1.574 350 HA VAL 88 HA VAL 88 -14.366 -10.051 1.668 351 HB VAL 88 HB VAL 88 -15.389 -10.301 -0.375 352 HG11 VAL 88 1HG1 VAL 88 -16.948 -8.512 -0.359 353 HG12 VAL 88 2HG1 VAL 88 -16.030 -8.378 -1.860 354 HG13 VAL 88 3HG1 VAL 88 -15.666 -7.307 -0.508 355 HG21 VAL 88 3HG2 VAL 88 -12.850 -9.620 -0.466 356 HG22 VAL 88 1HG2 VAL 88 -13.482 -8.249 -1.381 357 HG23 VAL 88 2HG2 VAL 88 -13.774 -9.896 -1.943 358 H LEU 89 H LEU 89 -12.408 -9.523 2.238 359 HA LEU 89 HA LEU 89 -11.566 -6.709 2.033 360 HB2 LEU 89 1HB LEU 89 -10.170 -8.724 3.750 361 HB3 LEU 89 2HB LEU 89 -10.218 -6.979 3.908 362 HG LEU 89 HG LEU 89 -12.706 -8.604 4.341 363 HD11 LEU 89 1HD1 LEU 89 -12.175 -9.130 6.511 364 HD12 LEU 89 2HD1 LEU 89 -10.932 -7.887 6.629 365 HD13 LEU 89 3HD1 LEU 89 -10.619 -9.364 5.721 366 HD21 LEU 89 3HD2 LEU 89 -13.459 -6.510 4.561 367 HD22 LEU 89 1HD2 LEU 89 -11.832 -5.840 4.685 368 HD23 LEU 89 2HD2 LEU 89 -12.622 -6.508 6.113 369 H TYR 90 H TYR 90 -9.009 -6.636 2.052 370 HA TYR 90 HA TYR 90 -8.050 -8.464 -0.052 371 HB2 TYR 90 1HB TYR 90 -8.065 -5.518 0.098 372 HB3 TYR 90 2HB TYR 90 -6.528 -6.222 -0.396 373 HD1 TYR 90 HD1 TYR 90 -7.518 -8.599 -1.897 374 HD2 TYR 90 HD2 TYR 90 -8.852 -4.560 -1.900 375 HE1 TYR 90 HE1 TYR 90 -8.376 -8.891 -4.170 376 HE2 TYR 90 HE2 TYR 90 -9.717 -4.843 -4.184 377 HH TYR 90 HH TYR 90 -8.845 -7.216 -6.197 378 H LYS 91 H LYS 91 -6.659 -9.814 0.939 379 HA LYS 91 HA LYS 91 -5.134 -9.111 3.243 380 HB2 LYS 91 1HB LYS 91 -4.615 -11.410 1.341 381 HB3 LYS 91 2HB LYS 91 -4.080 -11.278 3.010 382 HG2 LYS 91 1HG LYS 91 -6.636 -11.147 3.524 383 HG3 LYS 91 2HG LYS 91 -6.791 -11.893 1.933 384 HD2 LYS 91 1HD LYS 91 -4.920 -13.032 3.978 385 HD3 LYS 91 2HD LYS 91 -6.642 -13.409 4.028 386 HE2 LYS 91 1HE LYS 91 -5.410 -13.687 1.379 387 HE3 LYS 91 2HE LYS 91 -4.774 -14.791 2.597 388 HZ1 LYS 91 3HZ LYS 91 -7.662 -14.578 2.536 389 HZ2 LYS 91 1HZ LYS 91 -6.679 -15.949 2.656 390 HZ3 LYS 91 2HZ LYS 91 -6.977 -15.251 1.146 391 H VAL 92 H VAL 92 -3.817 -7.355 2.894 392 HA VAL 92 HA VAL 92 -1.869 -7.568 0.694 393 HB VAL 92 HB VAL 92 -1.604 -5.172 0.770 394 HG11 VAL 92 1HG1 VAL 92 -4.283 -6.367 0.425 395 HG12 VAL 92 2HG1 VAL 92 -3.273 -5.483 -0.716 396 HG13 VAL 92 3HG1 VAL 92 -4.207 -4.606 0.495 397 HG21 VAL 92 3HG2 VAL 92 -1.843 -4.720 3.114 398 HG22 VAL 92 1HG2 VAL 92 -3.524 -5.255 3.095 399 HG23 VAL 92 2HG2 VAL 92 -3.058 -3.784 2.243 400 H LEU 93 H LEU 93 0.302 -6.918 1.044 401 HA LEU 93 HA LEU 93 1.206 -7.400 3.795 402 HB2 LEU 93 1HB LEU 93 2.000 -8.637 1.538 403 HB3 LEU 93 2HB LEU 93 3.150 -7.315 1.557 404 HG LEU 93 HG LEU 93 3.882 -8.003 3.817 405 HD11 LEU 93 1HD1 LEU 93 1.962 -10.286 3.375 406 HD12 LEU 93 2HD1 LEU 93 1.868 -9.044 4.625 407 HD13 LEU 93 3HD1 LEU 93 3.180 -10.223 4.650 408 HD21 LEU 93 3HD2 LEU 93 4.692 -10.388 2.960 409 HD22 LEU 93 1HD2 LEU 93 5.347 -8.884 2.317 410 HD23 LEU 93 2HD2 LEU 93 4.094 -9.750 1.429 411 H PHE 94 H PHE 94 2.236 -5.872 4.921 412 HA PHE 94 HA PHE 94 2.519 -3.235 3.681 413 HB2 PHE 94 1HB PHE 94 2.114 -4.255 6.437 414 HB3 PHE 94 2HB PHE 94 3.080 -2.792 6.286 415 HD1 PHE 94 HD1 PHE 94 -0.126 -4.202 4.964 416 HD2 PHE 94 HD2 PHE 94 1.975 -0.792 6.413 417 HE1 PHE 94 HE1 PHE 94 -2.180 -2.861 4.783 418 HE2 PHE 94 HE2 PHE 94 -0.079 0.550 6.235 419 HZ PHE 94 HZ PHE 94 -2.159 -0.482 5.419 420 H PHE 95 H PHE 95 4.428 -1.907 4.232 421 HA PHE 95 HA PHE 95 6.879 -3.432 4.766 422 HB2 PHE 95 1HB PHE 95 6.534 -1.541 2.427 423 HB3 PHE 95 2HB PHE 95 8.022 -2.366 2.873 424 HD1 PHE 95 HD1 PHE 95 4.541 -2.959 1.739 425 HD2 PHE 95 HD2 PHE 95 8.500 -4.492 2.047 426 HE1 PHE 95 HE1 PHE 95 3.910 -4.860 0.314 427 HE2 PHE 95 HE2 PHE 95 7.876 -6.394 0.620 428 HZ PHE 95 HZ PHE 95 5.579 -6.583 -0.247 429 HA PRO 96 HA PRO 96 9.167 -2.626 4.302 430 HB2 PRO 96 1HB PRO 96 10.956 -2.001 6.482 431 HB3 PRO 96 2HB PRO 96 11.151 -1.650 4.763 432 HG2 PRO 96 1HG PRO 96 10.768 0.274 6.653 433 HG3 PRO 96 2HG PRO 96 10.253 0.449 4.966 434 HD2 PRO 96 1HD PRO 96 8.629 -0.303 7.374 435 HD3 PRO 96 2HD PRO 96 8.224 0.805 6.044 436 H ASP 97 H ASP 97 8.057 -2.368 7.603 437 HA ASP 97 HA ASP 97 9.155 -4.440 8.949 438 HB2 ASP 97 1HB ASP 97 7.080 -2.781 9.434 439 HB3 ASP 97 2HB ASP 97 6.213 -4.300 9.222 440 H PHE 98 H PHE 98 7.002 -4.787 6.235 441 HA PHE 98 HA PHE 98 6.404 -6.599 5.010 442 HB2 PHE 98 1HB PHE 98 8.388 -7.897 6.841 443 HB3 PHE 98 2HB PHE 98 7.350 -8.904 5.845 444 HD1 PHE 98 HD1 PHE 98 7.288 -8.304 3.309 445 HD2 PHE 98 HD2 PHE 98 10.382 -7.126 5.984 446 HE1 PHE 98 HE1 PHE 98 8.814 -7.995 1.403 447 HE2 PHE 98 HE2 PHE 98 11.912 -6.814 4.082 448 HZ PHE 98 HZ PHE 98 11.128 -7.249 1.789 449 H ASN 99 H ASN 99 4.921 -5.591 7.304 450 HA ASN 99 HA ASN 99 3.642 -7.879 8.529 451 HB2 ASN 99 1HB ASN 99 3.990 -5.283 9.315 452 HB3 ASN 99 2HB ASN 99 2.333 -5.234 8.722 453 HD21 ASN 99 2HD2 ASN 99 3.682 -5.163 11.454 454 HD22 ASN 99 1HD2 ASN 99 2.778 -6.316 12.385 455 H PHE 100 H PHE 100 0.937 -6.939 8.502 456 HA PHE 100 HA PHE 100 0.113 -6.643 5.760 457 HB2 PHE 100 1HB PHE 100 -1.408 -8.826 6.216 458 HB3 PHE 100 2HB PHE 100 0.128 -8.878 5.362 459 HD1 PHE 100 HD1 PHE 100 2.163 -9.625 6.525 460 HD2 PHE 100 HD2 PHE 100 -1.678 -9.837 8.341 461 HE1 PHE 100 HE1 PHE 100 3.043 -11.203 8.193 462 HE2 PHE 100 HE2 PHE 100 -0.806 -11.409 10.013 463 HZ PHE 100 HZ PHE 100 1.560 -12.097 9.942 464 H ALA 101 H ALA 101 -2.395 -6.952 5.659 465 HA ALA 101 HA ALA 101 -3.908 -6.484 8.011 466 HB1 ALA 101 3HB ALA 101 -4.485 -4.048 6.929 467 HB2 ALA 101 1HB ALA 101 -2.746 -4.160 6.653 468 HB3 ALA 101 2HB ALA 101 -3.392 -4.316 8.287 469 H TRP 102 H TRP 102 -6.071 -6.721 7.630 470 HA TRP 102 HA TRP 102 -6.852 -7.355 4.886 471 HB2 TRP 102 1HB TRP 102 -8.433 -7.707 7.445 472 HB3 TRP 102 2HB TRP 102 -8.832 -8.373 5.867 473 HD1 TRP 102 HD1 TRP 102 -5.874 -9.484 5.177 474 HE1 TRP 102 HE1 TRP 102 -5.040 -11.591 6.399 475 HE3 TRP 102 HE3 TRP 102 -8.986 -9.361 9.235 476 HZ2 TRP 102 HZ2 TRP 102 -5.625 -13.012 8.767 477 HZ3 TRP 102 HZ3 TRP 102 -8.784 -11.131 10.931 478 HH2 TRP 102 HH2 TRP 102 -7.137 -12.918 10.700 479 H VAL 103 H VAL 103 -7.409 -5.584 3.749 480 HA VAL 103 HA VAL 103 -9.365 -3.740 4.962 481 HB VAL 103 HB VAL 103 -7.189 -2.960 3.022 482 HG11 VAL 103 1HG1 VAL 103 -9.243 -1.334 4.514 483 HG12 VAL 103 2HG1 VAL 103 -9.125 -1.560 2.767 484 HG13 VAL 103 3HG1 VAL 103 -7.880 -0.651 3.625 485 HG21 VAL 103 3HG2 VAL 103 -6.717 -1.579 5.337 486 HG22 VAL 103 1HG2 VAL 103 -5.860 -3.034 4.823 487 HG23 VAL 103 2HG2 VAL 103 -7.220 -3.158 5.938 488 H LYS 104 H LYS 104 -11.081 -3.122 3.720 489 HA LYS 104 HA LYS 104 -11.764 -4.754 1.494 490 HB2 LYS 104 1HB LYS 104 -13.045 -2.606 3.060 491 HB3 LYS 104 2HB LYS 104 -13.588 -2.732 1.394 492 HG2 LYS 104 1HG LYS 104 -14.523 -4.801 1.706 493 HG3 LYS 104 2HG LYS 104 -13.461 -5.197 3.058 494 HD2 LYS 104 1HD LYS 104 -14.921 -4.399 4.543 495 HD3 LYS 104 2HD LYS 104 -15.105 -2.891 3.647 496 HE2 LYS 104 1HE LYS 104 -16.432 -5.377 2.652 497 HE3 LYS 104 2HE LYS 104 -17.150 -4.485 3.992 498 HZ1 LYS 104 3HZ LYS 104 -17.032 -2.476 2.519 499 HZ2 LYS 104 1HZ LYS 104 -18.125 -3.668 2.020 500 HZ3 LYS 104 2HZ LYS 104 -16.633 -3.509 1.240 501 H ARG 105 H ARG 105 -12.811 -3.518 -0.487 502 HA ARG 105 HA ARG 105 -10.640 -2.346 -1.924 503 HB2 ARG 105 1HB ARG 105 -13.550 -2.652 -2.676 504 HB3 ARG 105 2HB ARG 105 -12.274 -2.157 -3.776 505 HG2 ARG 105 1HG ARG 105 -12.127 -4.319 -4.297 506 HG3 ARG 105 2HG ARG 105 -11.276 -4.489 -2.761 507 HD2 ARG 105 1HD ARG 105 -12.965 -6.148 -2.775 508 HD3 ARG 105 2HD ARG 105 -13.522 -4.880 -1.689 509 HE ARG 105 HE ARG 105 -14.569 -5.458 -4.367 510 HH11 ARG 105 1HH1 ARG 105 -14.827 -3.674 -1.353 511 HH12 ARG 105 2HH1 ARG 105 -16.435 -3.132 -1.677 512 HH21 ARG 105 1HH2 ARG 105 -16.689 -4.733 -4.773 513 HH22 ARG 105 2HH2 ARG 105 -17.491 -3.732 -3.612 514 H ASN 106 H ASN 106 -13.210 -1.038 -0.031 515 HA ASN 106 HA ASN 106 -13.443 1.488 -1.293 516 HB2 ASN 106 1HB ASN 106 -14.219 0.392 1.381 517 HB3 ASN 106 2HB ASN 106 -14.291 2.129 1.108 518 HD21 ASN 106 2HD2 ASN 106 -16.056 -0.625 1.032 519 HD22 ASN 106 1HD2 ASN 106 -17.283 -0.158 -0.103 520 H SER 107 H SER 107 -11.325 0.245 1.240 521 HA SER 107 HA SER 107 -10.102 2.886 1.551 522 HB2 SER 107 1HB SER 107 -10.144 0.388 3.178 523 HB3 SER 107 2HB SER 107 -8.750 1.458 3.334 524 HG SER 107 HG SER 107 -10.166 3.134 3.887 525 H VAL 108 H VAL 108 -9.746 0.861 -0.782 526 HA VAL 108 HA VAL 108 -6.810 0.694 -0.650 527 HB VAL 108 HB VAL 108 -8.317 -1.403 -1.062 528 HG11 VAL 108 1HG1 VAL 108 -9.387 -0.053 -3.056 529 HG12 VAL 108 2HG1 VAL 108 -9.162 -1.798 -3.148 530 HG13 VAL 108 3HG1 VAL 108 -8.017 -0.717 -3.941 531 HG21 VAL 108 3HG2 VAL 108 -5.916 -0.822 -2.799 532 HG22 VAL 108 1HG2 VAL 108 -6.539 -2.420 -2.388 533 HG23 VAL 108 2HG2 VAL 108 -5.872 -1.383 -1.128 534 H LYS 109 H LYS 109 -5.563 1.301 -2.485 535 HA LYS 109 HA LYS 109 -6.897 2.762 -4.625 536 HB2 LYS 109 1HB LYS 109 -6.508 4.443 -2.863 537 HB3 LYS 109 2HB LYS 109 -4.796 4.043 -2.867 538 HG2 LYS 109 1HG LYS 109 -4.433 5.036 -4.929 539 HG3 LYS 109 2HG LYS 109 -6.137 4.951 -5.381 540 HD2 LYS 109 1HD LYS 109 -6.253 6.520 -3.162 541 HD3 LYS 109 2HD LYS 109 -4.687 6.983 -3.828 542 HE2 LYS 109 1HE LYS 109 -6.473 6.858 -6.001 543 HE3 LYS 109 2HE LYS 109 -7.321 7.705 -4.709 544 HZ1 LYS 109 3HZ LYS 109 -5.872 9.438 -4.767 545 HZ2 LYS 109 1HZ LYS 109 -5.742 8.955 -6.383 546 HZ3 LYS 109 2HZ LYS 109 -4.558 8.498 -5.266 547 HA PRO 110 HA PRO 110 -3.789 0.402 -6.839 548 HB2 PRO 110 1HB PRO 110 -4.455 2.406 -8.941 549 HB3 PRO 110 2HB PRO 110 -4.400 0.644 -9.045 550 HG2 PRO 110 1HG PRO 110 -6.733 1.919 -8.941 551 HG3 PRO 110 2HG PRO 110 -6.494 0.388 -8.081 552 HD2 PRO 110 1HD PRO 110 -6.578 3.174 -7.007 553 HD3 PRO 110 2HD PRO 110 -7.183 1.667 -6.290 554 H LEU 111 H LEU 111 -1.670 0.693 -6.573 555 HA LEU 111 HA LEU 111 -0.568 3.417 -6.764 556 HB2 LEU 111 1HB LEU 111 -0.362 2.264 -4.570 557 HB3 LEU 111 2HB LEU 111 0.591 1.016 -5.348 558 HG LEU 111 HG LEU 111 2.317 2.683 -5.903 559 HD11 LEU 111 1HD1 LEU 111 1.140 4.710 -6.101 560 HD12 LEU 111 2HD1 LEU 111 2.154 4.897 -4.670 561 HD13 LEU 111 3HD1 LEU 111 0.434 4.552 -4.493 562 HD21 LEU 111 3HD2 LEU 111 2.599 3.309 -3.260 563 HD22 LEU 111 1HD2 LEU 111 3.084 1.784 -4.002 564 HD23 LEU 111 2HD2 LEU 111 1.522 1.915 -3.196 565 H LEU 112 H LEU 112 1.241 3.825 -8.008 566 HA LEU 112 HA LEU 112 2.189 1.615 -9.711 567 HB2 LEU 112 1HB LEU 112 2.475 3.316 -11.526 568 HB3 LEU 112 2HB LEU 112 0.814 2.955 -11.105 569 HG LEU 112 HG LEU 112 2.055 5.290 -9.758 570 HD11 LEU 112 1HD1 LEU 112 2.745 5.339 -12.210 571 HD12 LEU 112 2HD1 LEU 112 1.884 6.746 -11.585 572 HD13 LEU 112 3HD1 LEU 112 1.031 5.554 -12.566 573 HD21 LEU 112 3HD2 LEU 112 -0.159 4.933 -9.147 574 HD22 LEU 112 1HD2 LEU 112 -0.644 4.494 -10.785 575 HD23 LEU 112 2HD2 LEU 112 -0.281 6.173 -10.393 576 H ASP 113 H ASP 113 4.339 2.065 -10.729 577 HA ASP 113 HA ASP 113 6.246 2.676 -8.742 578 HB2 ASP 113 1HB ASP 113 6.345 1.956 -11.625 579 HB3 ASP 113 2HB ASP 113 7.772 2.729 -10.940 580 H SER 114 H SER 114 5.033 4.533 -11.514 581 HA SER 114 HA SER 114 6.855 6.664 -11.348 582 HB2 SER 114 1HB SER 114 3.977 7.039 -12.163 583 HB3 SER 114 2HB SER 114 5.409 7.864 -12.778 584 HG SER 114 HG SER 114 5.842 6.207 -14.051 585 H GLU 115 H GLU 115 4.027 5.886 -9.449 586 HA GLU 115 HA GLU 115 3.907 8.508 -8.216 587 HB2 GLU 115 1HB GLU 115 2.373 5.949 -7.914 588 HB3 GLU 115 2HB GLU 115 2.289 7.156 -6.640 589 HG2 GLU 115 1HG GLU 115 1.643 8.806 -8.461 590 HG3 GLU 115 2HG GLU 115 1.410 7.401 -9.496 591 H ILE 116 H ILE 116 4.912 5.230 -7.294 592 HA ILE 116 HA ILE 116 5.642 5.830 -4.640 593 HB ILE 116 HB ILE 116 6.768 3.659 -6.425 594 HG12 ILE 116 1HG1 ILE 116 4.664 3.243 -4.323 595 HG13 ILE 116 2HG1 ILE 116 4.203 3.784 -5.933 596 HG21 ILE 116 1HG2 ILE 116 6.839 4.031 -3.436 597 HG22 ILE 116 2HG2 ILE 116 8.207 3.984 -4.545 598 HG23 ILE 116 3HG2 ILE 116 7.259 2.528 -4.255 599 HD11 ILE 116 3HD1 ILE 116 3.976 1.419 -5.850 600 HD12 ILE 116 1HD1 ILE 116 5.601 1.227 -5.194 601 HD13 ILE 116 2HD1 ILE 116 5.379 1.786 -6.853 602 H ALA 117 H ALA 117 7.615 5.514 -7.598 603 HA ALA 117 HA ALA 117 10.094 6.202 -6.542 604 HB1 ALA 117 3HB ALA 117 9.391 7.247 -9.236 605 HB2 ALA 117 1HB ALA 117 9.316 5.504 -8.982 606 HB3 ALA 117 2HB ALA 117 10.826 6.370 -8.702 607 H LYS 118 H LYS 118 7.436 8.223 -7.660 608 HA LYS 118 HA LYS 118 8.773 10.709 -7.426 609 HB2 LYS 118 1HB LYS 118 6.311 9.853 -8.363 610 HB3 LYS 118 2HB LYS 118 5.905 10.848 -6.969 611 HG2 LYS 118 1HG LYS 118 6.199 12.646 -8.193 612 HG3 LYS 118 2HG LYS 118 7.901 12.208 -8.383 613 HD2 LYS 118 1HD LYS 118 7.521 11.133 -10.423 614 HD3 LYS 118 2HD LYS 118 5.789 10.966 -10.117 615 HE2 LYS 118 1HE LYS 118 5.562 13.426 -10.319 616 HE3 LYS 118 2HE LYS 118 7.274 13.524 -10.726 617 HZ1 LYS 118 3HZ LYS 118 6.520 11.772 -12.531 618 HZ2 LYS 118 1HZ LYS 118 6.399 13.438 -12.801 619 HZ3 LYS 118 2HZ LYS 118 5.033 12.555 -12.333 620 H PHE 119 H PHE 119 6.401 9.101 -5.314 621 HA PHE 119 HA PHE 119 6.314 10.927 -3.240 622 HB2 PHE 119 1HB PHE 119 4.853 9.039 -3.164 623 HB3 PHE 119 2HB PHE 119 6.197 7.906 -3.219 624 HD1 PHE 119 HD1 PHE 119 7.739 7.784 -1.192 625 HD2 PHE 119 HD2 PHE 119 3.947 9.723 -1.128 626 HE1 PHE 119 HE1 PHE 119 7.685 7.594 1.263 627 HE2 PHE 119 HE2 PHE 119 3.897 9.540 1.326 628 HZ PHE 119 HZ PHE 119 5.770 8.476 2.514 629 H LEU 120 H LEU 120 8.684 8.372 -3.804 630 HA LEU 120 HA LEU 120 10.206 8.890 -1.459 631 HB2 LEU 120 1HB LEU 120 10.863 7.448 -4.023 632 HB3 LEU 120 2HB LEU 120 11.952 7.532 -2.650 633 HG LEU 120 HG LEU 120 9.222 6.556 -2.074 634 HD11 LEU 120 1HD1 LEU 120 9.791 4.276 -2.861 635 HD12 LEU 120 2HD1 LEU 120 11.206 4.941 -3.675 636 HD13 LEU 120 3HD1 LEU 120 9.590 5.431 -4.178 637 HD21 LEU 120 3HD2 LEU 120 11.634 5.065 -1.281 638 HD22 LEU 120 1HD2 LEU 120 10.242 5.572 -0.323 639 HD23 LEU 120 2HD2 LEU 120 11.532 6.718 -0.679 640 H GLY 121 H GLY 121 10.353 10.013 -4.820 641 HA2 GLY 121 1HA GLY 121 12.787 11.537 -4.264 642 HA3 GLY 121 2HA GLY 121 11.996 11.372 -5.821 643 H SER 122 H SER 122 9.992 12.149 -3.118 644 HA SER 122 HA SER 122 8.878 14.420 -4.199 645 HB2 SER 122 1HB SER 122 7.978 14.882 -1.988 646 HB3 SER 122 2HB SER 122 7.961 13.141 -2.278 647 HG SER 122 HG SER 122 9.537 12.863 -0.837 648 H SER 123 H SER 123 11.524 14.265 -1.825 649 HA SER 123 HA SER 123 13.087 15.758 -1.150 650 HB2 SER 123 1HB SER 123 14.305 16.795 -2.828 651 HB3 SER 123 2HB SER 123 13.424 15.580 -3.753 652 HG SER 123 HG SER 123 13.336 17.666 -4.710 653 H LYS 124 H LYS 124 10.079 16.508 -0.994 654 HA LYS 124 HA LYS 124 10.554 19.318 -0.261 655 HB2 LYS 124 1HB LYS 124 8.183 19.791 -0.931 656 HB3 LYS 124 2HB LYS 124 9.265 19.425 -2.268 657 HG2 LYS 124 1HG LYS 124 8.220 16.958 -1.578 658 HG3 LYS 124 2HG LYS 124 6.858 18.064 -1.395 659 HD2 LYS 124 1HD LYS 124 8.293 18.693 -3.796 660 HD3 LYS 124 2HD LYS 124 7.900 16.973 -3.776 661 HE2 LYS 124 1HE LYS 124 5.945 17.701 -4.647 662 HE3 LYS 124 2HE LYS 124 5.552 17.983 -2.952 663 HZ1 LYS 124 3HZ LYS 124 6.377 19.945 -5.000 664 HZ2 LYS 124 1HZ LYS 124 6.533 20.291 -3.350 665 HZ3 LYS 124 2HZ LYS 124 5.010 19.965 -4.006 666 H ARG 125 H ARG 125 8.235 16.632 0.133 667 HA ARG 125 HA ARG 125 8.200 17.155 3.010 668 HB2 ARG 125 1HB ARG 125 6.188 18.213 1.906 669 HB3 ARG 125 2HB ARG 125 5.692 16.600 1.410 670 HG2 ARG 125 1HG ARG 125 4.603 16.430 3.329 671 HG3 ARG 125 2HG ARG 125 6.167 16.387 4.147 672 HD2 ARG 125 1HD ARG 125 5.884 18.434 5.000 673 HD3 ARG 125 2HD ARG 125 5.349 19.091 3.455 674 HE ARG 125 HE ARG 125 3.701 18.229 5.634 675 HH11 ARG 125 1HH1 ARG 125 3.807 18.667 2.161 676 HH12 ARG 125 2HH1 ARG 125 2.092 18.837 2.005 677 HH21 ARG 125 1HH2 ARG 125 1.437 18.452 5.419 678 HH22 ARG 125 2HH2 ARG 125 0.748 18.717 3.854 679 H LYS 126 H LYS 126 9.257 15.355 3.586 680 HA LYS 126 HA LYS 126 7.928 12.813 3.209 681 HB2 LYS 126 1HB LYS 126 9.790 11.680 2.245 682 HB3 LYS 126 2HB LYS 126 9.486 13.114 1.276 683 HG2 LYS 126 1HG LYS 126 11.603 12.951 3.408 684 HG3 LYS 126 2HG LYS 126 11.891 12.637 1.697 685 HD2 LYS 126 1HD LYS 126 10.579 15.067 1.690 686 HD3 LYS 126 2HD LYS 126 11.613 15.166 3.115 687 HE2 LYS 126 1HE LYS 126 12.775 14.145 0.572 688 HE3 LYS 126 2HE LYS 126 12.480 15.875 0.729 689 HZ1 LYS 126 3HZ LYS 126 13.766 15.712 2.883 690 HZ2 LYS 126 1HZ LYS 126 14.665 15.530 1.461 691 HZ3 LYS 126 2HZ LYS 126 14.252 14.171 2.380 692 H SER 127 H SER 127 8.195 11.441 4.894 693 HA SER 127 HA SER 127 9.948 12.347 7.076 694 HB2 SER 127 1HB SER 127 7.275 11.057 6.985 695 HB3 SER 127 2HB SER 127 8.346 10.543 8.287 696 HG SER 127 HG SER 127 7.210 12.302 9.020 697 H LYS 128 H LYS 128 11.309 10.858 8.137 698 HA LYS 128 HA LYS 128 12.621 8.973 6.590 699 HB2 LYS 128 1HB LYS 128 13.073 10.015 9.050 700 HB3 LYS 128 2HB LYS 128 12.539 8.401 9.499 701 HG2 LYS 128 1HG LYS 128 14.271 7.433 8.060 702 HG3 LYS 128 2HG LYS 128 14.821 9.058 7.647 703 HD2 LYS 128 1HD LYS 128 15.384 9.480 9.976 704 HD3 LYS 128 2HD LYS 128 14.766 7.891 10.430 705 HE2 LYS 128 1HE LYS 128 16.527 6.773 9.393 706 HE3 LYS 128 2HE LYS 128 16.938 8.155 8.381 707 HZ1 LYS 128 3HZ LYS 128 18.327 7.510 10.519 708 HZ2 LYS 128 1HZ LYS 128 17.184 8.504 11.271 709 HZ3 LYS 128 2HZ LYS 128 18.145 9.115 10.020 710 H GLU 129 H GLU 129 9.994 8.467 8.924 711 HA GLU 129 HA GLU 129 9.894 5.643 8.613 712 HB2 GLU 129 1HB GLU 129 7.760 5.778 9.802 713 HB3 GLU 129 2HB GLU 129 8.987 6.754 10.596 714 HG2 GLU 129 1HG GLU 129 7.996 8.716 9.271 715 HG3 GLU 129 2HG GLU 129 6.623 7.650 8.989 716 H LEU 130 H LEU 130 8.367 8.334 6.930 717 HA LEU 130 HA LEU 130 6.519 6.639 5.502 718 HB2 LEU 130 1HB LEU 130 7.068 9.512 5.689 719 HB3 LEU 130 2HB LEU 130 6.617 8.988 4.079 720 HG LEU 130 HG LEU 130 4.917 8.106 6.364 721 HD11 LEU 130 1HD1 LEU 130 4.176 10.687 5.156 722 HD12 LEU 130 2HD1 LEU 130 5.533 10.728 6.282 723 HD13 LEU 130 3HD1 LEU 130 3.973 10.100 6.807 724 HD21 LEU 130 3HD2 LEU 130 4.547 7.350 4.020 725 HD22 LEU 130 1HD2 LEU 130 4.229 9.028 3.577 726 HD23 LEU 130 2HD2 LEU 130 3.171 8.203 4.721 727 H ILE 131 H ILE 131 9.598 8.243 4.738 728 HA ILE 131 HA ILE 131 9.648 7.536 2.010 729 HB ILE 131 HB ILE 131 12.038 7.940 3.813 730 HG12 ILE 131 1HG1 ILE 131 11.139 10.097 1.996 731 HG13 ILE 131 2HG1 ILE 131 10.101 9.792 3.384 732 HG21 ILE 131 1HG2 ILE 131 11.913 7.037 1.197 733 HG22 ILE 131 2HG2 ILE 131 13.329 7.702 2.011 734 HG23 ILE 131 3HG2 ILE 131 12.295 8.751 1.042 735 HD11 ILE 131 3HD1 ILE 131 12.758 11.008 3.243 736 HD12 ILE 131 1HD1 ILE 131 12.541 9.858 4.562 737 HD13 ILE 131 2HD1 ILE 131 11.458 11.240 4.412 738 H GLU 132 H GLU 132 11.147 5.966 4.841 739 HA GLU 132 HA GLU 132 12.335 3.833 3.509 740 HB2 GLU 132 1HB GLU 132 11.647 4.492 6.253 741 HB3 GLU 132 2HB GLU 132 11.476 2.770 5.941 742 HG2 GLU 132 1HG GLU 132 13.696 2.458 5.649 743 HG3 GLU 132 2HG GLU 132 13.942 4.060 4.955 744 H ALA 133 H ALA 133 8.992 4.362 4.391 745 HA ALA 133 HA ALA 133 8.093 1.698 4.086 746 HB1 ALA 133 3HB ALA 133 6.704 4.357 4.011 747 HB2 ALA 133 1HB ALA 133 6.675 3.129 5.280 748 HB3 ALA 133 2HB ALA 133 5.840 2.839 3.756 749 H TYR 134 H TYR 134 7.869 4.493 1.898 750 HA TYR 134 HA TYR 134 6.851 2.970 -0.271 751 HB2 TYR 134 1HB TYR 134 7.795 5.738 0.129 752 HB3 TYR 134 2HB TYR 134 7.976 5.119 -1.509 753 HD1 TYR 134 HD2 TYR 134 5.349 4.957 1.167 754 HD2 TYR 134 HD1 TYR 134 6.259 5.687 -2.925 755 HE1 TYR 134 HE2 TYR 134 2.975 5.425 0.726 756 HE2 TYR 134 HE1 TYR 134 3.889 6.156 -3.373 757 HH TYR 134 HH TYR 134 1.868 6.995 -1.892 758 H GLU 135 H GLU 135 10.071 3.737 0.841 759 HA GLU 135 HA GLU 135 11.485 2.973 -1.489 760 HB2 GLU 135 1HB GLU 135 12.373 4.279 0.512 761 HB3 GLU 135 2HB GLU 135 12.497 2.735 1.343 762 HG2 GLU 135 1HG GLU 135 13.822 2.136 -0.908 763 HG3 GLU 135 2HG GLU 135 14.150 3.866 -0.816 764 H ALA 136 H ALA 136 10.145 1.208 1.235 765 HA ALA 136 HA ALA 136 11.508 -1.254 0.696 766 HB1 ALA 136 3HB ALA 136 10.667 -0.768 2.919 767 HB2 ALA 136 1HB ALA 136 9.923 -2.236 2.289 768 HB3 ALA 136 2HB ALA 136 9.015 -0.725 2.306 769 H SER 137 H SER 137 8.356 0.096 -0.166 770 HA SER 137 HA SER 137 7.469 -2.300 -1.493 771 HB2 SER 137 1HB SER 137 6.353 0.403 -0.977 772 HB3 SER 137 2HB SER 137 5.728 -0.462 -2.383 773 HG SER 137 HG SER 137 4.731 -1.808 -1.105 774 H LYS 138 H LYS 138 9.355 0.442 -2.389 775 HA LYS 138 HA LYS 138 8.799 0.720 -5.096 776 HB2 LYS 138 1HB LYS 138 10.318 2.147 -3.640 777 HB3 LYS 138 2HB LYS 138 11.565 0.941 -3.918 778 HG2 LYS 138 1HG LYS 138 11.933 2.692 -5.463 779 HG3 LYS 138 2HG LYS 138 11.271 1.336 -6.374 780 HD2 LYS 138 1HD LYS 138 8.987 2.499 -5.955 781 HD3 LYS 138 2HD LYS 138 9.970 3.924 -5.614 782 HE2 LYS 138 1HE LYS 138 9.198 3.791 -7.967 783 HE3 LYS 138 2HE LYS 138 10.951 3.842 -7.800 784 HZ1 LYS 138 3HZ LYS 138 9.693 2.085 -9.333 785 HZ2 LYS 138 1HZ LYS 138 9.744 1.192 -7.894 786 HZ3 LYS 138 2HZ LYS 138 11.178 1.757 -8.593 787 H THR 139 H THR 139 10.407 -1.898 -3.490 788 HA THR 139 HA THR 139 11.518 -2.905 -6.008 789 HB THR 139 HB THR 139 11.822 -4.083 -3.242 790 HG1 THR 139 HG1 THR 139 13.341 -2.695 -2.858 791 HG21 THR 139 3HG2 THR 139 13.024 -4.682 -5.872 792 HG22 THR 139 1HG2 THR 139 12.662 -5.745 -4.512 793 HG23 THR 139 2HG2 THR 139 14.092 -4.714 -4.469 794 HA PRO 140 HA PRO 140 7.577 -5.207 -6.256 795 HB2 PRO 140 1HB PRO 140 8.913 -6.123 -8.746 796 HB3 PRO 140 2HB PRO 140 7.283 -5.486 -8.513 797 HG2 PRO 140 1HG PRO 140 9.184 -4.001 -9.646 798 HG3 PRO 140 2HG PRO 140 7.997 -3.287 -8.543 799 HD2 PRO 140 1HD PRO 140 10.858 -3.986 -8.051 800 HD3 PRO 140 2HD PRO 140 9.916 -2.604 -7.466 801 HA PRO 141 HA PRO 141 10.411 -9.320 -7.066 802 HB2 PRO 141 1HB PRO 141 12.623 -8.008 -5.514 803 HB3 PRO 141 2HB PRO 141 12.711 -9.316 -6.705 804 HG2 PRO 141 1HG PRO 141 13.317 -6.851 -7.427 805 HG3 PRO 141 2HG PRO 141 12.343 -7.877 -8.499 806 HD2 PRO 141 1HD PRO 141 11.508 -5.580 -6.805 807 HD3 PRO 141 2HD PRO 141 10.853 -6.134 -8.358 808 H ASP 142 H ASP 142 10.422 -7.178 -4.228 809 HA ASP 142 HA ASP 142 10.773 -8.852 -2.126 810 HB2 ASP 142 1HB ASP 142 8.995 -6.491 -2.540 811 HB3 ASP 142 2HB ASP 142 8.786 -7.429 -1.066 812 H LEU 143 H LEU 143 7.634 -8.335 -3.747 813 HA LEU 143 HA LEU 143 6.746 -10.905 -2.613 814 HB2 LEU 143 1HB LEU 143 5.473 -8.981 -1.791 815 HB3 LEU 143 2HB LEU 143 5.068 -8.543 -3.439 816 HG LEU 143 HG LEU 143 3.848 -10.701 -3.670 817 HD11 LEU 143 1HD1 LEU 143 4.470 -10.940 -0.730 818 HD12 LEU 143 2HD1 LEU 143 4.984 -12.030 -2.019 819 HD13 LEU 143 3HD1 LEU 143 3.279 -11.917 -1.587 820 HD21 LEU 143 3HD2 LEU 143 1.974 -10.044 -2.110 821 HD22 LEU 143 1HD2 LEU 143 2.539 -8.791 -3.214 822 HD23 LEU 143 2HD2 LEU 143 3.034 -8.762 -1.521 823 H LYS 144 H LYS 144 6.905 -8.929 -5.532 824 HA LYS 144 HA LYS 144 5.318 -10.338 -7.277 825 HB2 LYS 144 1HB LYS 144 6.878 -8.237 -7.612 826 HB3 LYS 144 2HB LYS 144 8.005 -9.436 -8.232 827 HG2 LYS 144 1HG LYS 144 6.022 -10.181 -9.717 828 HG3 LYS 144 2HG LYS 144 5.346 -8.601 -9.314 829 HD2 LYS 144 1HD LYS 144 7.018 -7.454 -10.425 830 HD3 LYS 144 2HD LYS 144 8.163 -8.791 -10.301 831 HE2 LYS 144 1HE LYS 144 5.673 -8.862 -12.002 832 HE3 LYS 144 2HE LYS 144 7.255 -8.372 -12.605 833 HZ1 LYS 144 3HZ LYS 144 7.884 -10.704 -11.519 834 HZ2 LYS 144 1HZ LYS 144 7.363 -10.552 -13.122 835 HZ3 LYS 144 2HZ LYS 144 6.273 -11.026 -11.921 836 H GLU 145 H GLU 145 8.556 -11.178 -6.146 837 HA GLU 145 HA GLU 145 8.569 -13.587 -7.810 838 HB2 GLU 145 1HB GLU 145 10.584 -11.906 -7.340 839 HB3 GLU 145 2HB GLU 145 10.806 -12.954 -5.944 840 HG2 GLU 145 1HG GLU 145 10.428 -14.629 -8.178 841 HG3 GLU 145 2HG GLU 145 11.572 -13.378 -8.657 842 H GLU 146 H GLU 146 8.471 -12.566 -4.441 843 HA GLU 146 HA GLU 146 7.790 -13.635 -2.554 844 HB2 GLU 146 1HB GLU 146 6.202 -14.787 -4.284 845 HB3 GLU 146 2HB GLU 146 7.254 -16.176 -4.048 846 HG2 GLU 146 1HG GLU 146 6.601 -16.479 -1.870 847 HG3 GLU 146 2HG GLU 146 6.121 -14.795 -1.667 848 H SER 147 H SER 147 8.584 -15.095 -0.977 849 HA SER 147 HA SER 147 11.287 -16.006 -1.556 850 HB2 SER 147 1HB SER 147 11.650 -16.020 0.792 851 HB3 SER 147 2HB SER 147 10.679 -14.585 0.472 852 HG SER 147 HG SER 147 8.831 -15.829 1.106 853 H SER 148 H SER 148 11.944 -18.055 -0.247 854 HA SER 148 HA SER 148 9.923 -20.121 -0.144 855 HB2 SER 148 1HB SER 148 11.262 -19.758 -2.552 856 HB3 SER 148 2HB SER 148 12.149 -21.071 -1.779 857 HG SER 148 HG SER 148 9.590 -21.020 -2.796 858 H THR 149 H THR 149 10.401 -20.623 1.954 859 HA THR 149 HA THR 149 13.126 -21.611 2.473 860 HB THR 149 HB THR 149 12.923 -20.753 4.796 861 HG1 THR 149 HG1 THR 149 10.682 -20.577 4.958 862 HG21 THR 149 3HG2 THR 149 13.985 -18.929 4.154 863 HG22 THR 149 1HG2 THR 149 12.487 -18.221 3.547 864 HG23 THR 149 2HG2 THR 149 13.468 -19.247 2.499 865 H ASP 150 H ASP 150 12.913 -23.757 2.586 866 HA ASP 150 HA ASP 150 10.693 -24.857 4.185 867 HB2 ASP 150 1HB ASP 150 11.874 -25.678 1.609 868 HB3 ASP 150 2HB ASP 150 11.562 -26.994 2.735 869 H LEU 151 H LEU 151 14.134 -25.245 3.388 870 HA LEU 151 HA LEU 151 14.479 -27.021 5.690 871 HB2 LEU 151 1HB LEU 151 15.664 -26.853 3.117 872 HB3 LEU 151 2HB LEU 151 16.924 -26.518 4.288 873 HG LEU 151 HG LEU 151 16.791 -28.902 3.628 874 HD11 LEU 151 1HD1 LEU 151 16.045 -28.662 6.519 875 HD12 LEU 151 2HD1 LEU 151 17.572 -28.027 5.905 876 HD13 LEU 151 3HD1 LEU 151 17.208 -29.747 5.756 877 HD21 LEU 151 3HD2 LEU 151 14.290 -29.163 5.241 878 HD22 LEU 151 1HD2 LEU 151 14.968 -30.255 4.032 879 HD23 LEU 151 2HD2 LEU 151 14.195 -28.752 3.529 880 H GLU 152 H GLU 152 16.193 -26.637 7.225 881 HA GLU 152 HA GLU 152 16.570 -23.779 7.742 882 HB2 GLU 152 1HB GLU 152 16.897 -26.210 9.502 883 HB3 GLU 152 2HB GLU 152 17.337 -24.585 10.006 884 HG2 GLU 152 1HG GLU 152 14.681 -24.521 8.993 885 HG3 GLU 152 2HG GLU 152 14.816 -25.852 10.140 Start of MODEL 9 1 H1 SER 45 1H SER 45 -7.160 5.719 -19.572 2 H2 SER 45 2H SER 45 -6.791 4.115 -19.089 3 H3 SER 45 3H SER 45 -6.585 5.411 -17.986 4 HA SER 45 HA SER 45 -8.850 5.755 -17.786 5 HB2 SER 45 1HB SER 45 -10.488 4.646 -19.199 6 HB3 SER 45 2HB SER 45 -9.304 5.446 -20.229 7 HG SER 45 HG SER 45 -9.872 2.777 -19.954 8 H ALA 46 H ALA 46 -10.457 4.289 -16.735 9 HA ALA 46 HA ALA 46 -11.000 2.658 -15.246 10 HB1 ALA 46 3HB ALA 46 -10.790 0.529 -15.963 11 HB2 ALA 46 1HB ALA 46 -9.063 0.687 -16.280 12 HB3 ALA 46 2HB ALA 46 -10.234 1.312 -17.441 13 H ASP 47 H ASP 47 -9.951 0.994 -13.638 14 HA ASP 47 HA ASP 47 -7.264 1.611 -12.807 15 HB2 ASP 47 1HB ASP 47 -9.587 2.926 -11.553 16 HB3 ASP 47 2HB ASP 47 -8.454 2.191 -10.425 17 H ASP 48 H ASP 48 -8.662 -0.772 -13.549 18 HA ASP 48 HA ASP 48 -9.063 -2.210 -11.043 19 HB2 ASP 48 1HB ASP 48 -9.436 -3.110 -13.907 20 HB3 ASP 48 2HB ASP 48 -9.818 -4.073 -12.482 21 H ARG 49 H ARG 49 -6.738 -1.876 -10.541 22 HA ARG 49 HA ARG 49 -5.142 -4.066 -11.691 23 HB2 ARG 49 1HB ARG 49 -4.403 -1.206 -11.272 24 HB3 ARG 49 2HB ARG 49 -3.164 -2.425 -11.012 25 HG2 ARG 49 1HG ARG 49 -3.724 -3.292 -13.323 26 HG3 ARG 49 2HG ARG 49 -4.663 -1.813 -13.540 27 HD2 ARG 49 1HD ARG 49 -2.817 -0.495 -13.661 28 HD3 ARG 49 2HD ARG 49 -1.903 -1.489 -12.526 29 HE ARG 49 HE ARG 49 -1.855 -1.658 -15.364 30 HH11 ARG 49 1HH1 ARG 49 -1.633 -3.611 -12.464 31 HH12 ARG 49 2HH1 ARG 49 -0.664 -4.833 -13.211 32 HH21 ARG 49 1HH2 ARG 49 -0.574 -3.273 -16.345 33 HH22 ARG 49 2HH2 ARG 49 -0.059 -4.640 -15.414 34 H LEU 50 H LEU 50 -6.799 -4.174 -9.380 35 HA LEU 50 HA LEU 50 -4.823 -4.299 -7.202 36 HB2 LEU 50 1HB LEU 50 -7.824 -4.361 -6.913 37 HB3 LEU 50 2HB LEU 50 -6.636 -4.147 -5.644 38 HG LEU 50 HG LEU 50 -6.034 -2.004 -7.153 39 HD11 LEU 50 1HD1 LEU 50 -8.957 -1.780 -7.362 40 HD12 LEU 50 2HD1 LEU 50 -8.193 -2.866 -8.520 41 HD13 LEU 50 3HD1 LEU 50 -7.689 -1.180 -8.426 42 HD21 LEU 50 3HD2 LEU 50 -7.927 -0.884 -5.639 43 HD22 LEU 50 1HD2 LEU 50 -6.396 -1.463 -4.985 44 HD23 LEU 50 2HD2 LEU 50 -7.842 -2.463 -4.858 45 H ASN 51 H ASN 51 -4.133 -6.305 -8.379 46 HA ASN 51 HA ASN 51 -5.735 -8.613 -7.476 47 HB2 ASN 51 1HB ASN 51 -5.271 -7.983 -10.101 48 HB3 ASN 51 2HB ASN 51 -3.936 -9.080 -9.762 49 HD21 ASN 51 2HD2 ASN 51 -4.330 -11.163 -10.045 50 HD22 ASN 51 1HD2 ASN 51 -5.898 -11.908 -10.032 51 H PHE 52 H PHE 52 -4.039 -10.666 -7.887 52 HA PHE 52 HA PHE 52 -2.279 -10.537 -5.716 53 HB2 PHE 52 1HB PHE 52 -1.958 -12.493 -7.994 54 HB3 PHE 52 2HB PHE 52 -1.579 -12.730 -6.287 55 HD1 PHE 52 HD2 PHE 52 -4.087 -11.710 -5.046 56 HD2 PHE 52 HD1 PHE 52 -3.471 -14.204 -8.440 57 HE1 PHE 52 HE2 PHE 52 -6.301 -12.720 -4.703 58 HE2 PHE 52 HE1 PHE 52 -5.687 -15.218 -8.101 59 HZ PHE 52 HZ PHE 52 -7.104 -14.477 -6.229 60 H GLY 53 H GLY 53 -0.295 -9.760 -5.473 61 HA2 GLY 53 1HA GLY 53 1.833 -9.026 -5.956 62 HA3 GLY 53 2HA GLY 53 1.691 -9.818 -7.519 63 H ASP 54 H ASP 54 -0.136 -7.143 -6.024 64 HA ASP 54 HA ASP 54 0.794 -5.375 -8.176 65 HB2 ASP 54 1HB ASP 54 -2.043 -5.952 -7.364 66 HB3 ASP 54 2HB ASP 54 -1.613 -4.411 -8.097 67 H ARG 55 H ARG 55 1.300 -3.348 -7.546 68 HA ARG 55 HA ARG 55 1.414 -2.753 -4.743 69 HB2 ARG 55 1HB ARG 55 2.446 -1.564 -7.233 70 HB3 ARG 55 2HB ARG 55 2.060 -0.395 -5.978 71 HG2 ARG 55 1HG ARG 55 4.146 -0.799 -5.282 72 HG3 ARG 55 2HG ARG 55 3.435 -2.236 -4.548 73 HD2 ARG 55 1HD ARG 55 4.814 -3.479 -5.770 74 HD3 ARG 55 2HD ARG 55 3.963 -2.925 -7.211 75 HE ARG 55 HE ARG 55 6.006 -1.122 -6.274 76 HH11 ARG 55 1HH1 ARG 55 5.332 -3.899 -8.298 77 HH12 ARG 55 2HH1 ARG 55 6.686 -3.622 -9.339 78 HH21 ARG 55 1HH2 ARG 55 7.791 -0.766 -7.651 79 HH22 ARG 55 2HH2 ARG 55 8.081 -1.846 -8.972 80 H ILE 56 H ILE 56 -0.204 -1.945 -3.586 81 HA ILE 56 HA ILE 56 -1.974 0.046 -4.823 82 HB ILE 56 HB ILE 56 -3.950 -0.942 -3.726 83 HG12 ILE 56 1HG1 ILE 56 -2.116 -3.291 -3.175 84 HG13 ILE 56 2HG1 ILE 56 -2.769 -2.199 -1.957 85 HG21 ILE 56 1HG2 ILE 56 -2.998 -1.525 -6.120 86 HG22 ILE 56 2HG2 ILE 56 -4.433 -2.322 -5.479 87 HG23 ILE 56 3HG2 ILE 56 -2.871 -3.138 -5.419 88 HD11 ILE 56 3HD1 ILE 56 -4.723 -3.547 -3.712 89 HD12 ILE 56 1HD1 ILE 56 -4.808 -3.165 -1.994 90 HD13 ILE 56 2HD1 ILE 56 -3.866 -4.550 -2.543 91 H LEU 57 H LEU 57 -2.797 1.608 -3.438 92 HA LEU 57 HA LEU 57 -1.365 1.847 -0.903 93 HB2 LEU 57 1HB LEU 57 -1.822 3.667 -2.844 94 HB3 LEU 57 2HB LEU 57 -3.190 3.997 -1.799 95 HG LEU 57 HG LEU 57 -1.558 4.275 0.102 96 HD11 LEU 57 1HD1 LEU 57 0.713 4.318 -0.218 97 HD12 LEU 57 2HD1 LEU 57 0.576 4.660 -1.942 98 HD13 LEU 57 3HD1 LEU 57 0.249 3.037 -1.336 99 HD21 LEU 57 3HD2 LEU 57 -1.722 6.068 -2.275 100 HD22 LEU 57 1HD2 LEU 57 -0.641 6.495 -0.948 101 HD23 LEU 57 2HD2 LEU 57 -2.368 6.289 -0.650 102 H VAL 58 H VAL 58 -2.291 1.464 1.002 103 HA VAL 58 HA VAL 58 -5.238 1.428 1.148 104 HB VAL 58 HB VAL 58 -4.305 -0.848 1.226 105 HG11 VAL 58 1HG1 VAL 58 -2.269 0.261 2.702 106 HG12 VAL 58 2HG1 VAL 58 -2.562 -1.461 2.472 107 HG13 VAL 58 3HG1 VAL 58 -3.187 -0.646 3.904 108 HG21 VAL 58 3HG2 VAL 58 -5.218 -1.312 3.684 109 HG22 VAL 58 1HG2 VAL 58 -6.280 -0.908 2.337 110 HG23 VAL 58 2HG2 VAL 58 -5.805 0.339 3.489 111 H LYS 59 H LYS 59 -6.191 2.443 2.849 112 HA LYS 59 HA LYS 59 -4.427 3.991 4.601 113 HB2 LYS 59 1HB LYS 59 -6.446 4.907 3.159 114 HB3 LYS 59 2HB LYS 59 -7.386 4.385 4.549 115 HG2 LYS 59 1HG LYS 59 -5.343 5.771 5.722 116 HG3 LYS 59 2HG LYS 59 -5.612 6.678 4.234 117 HD2 LYS 59 1HD LYS 59 -8.051 5.893 5.686 118 HD3 LYS 59 2HD LYS 59 -7.012 7.045 6.526 119 HE2 LYS 59 1HE LYS 59 -8.173 8.562 5.328 120 HE3 LYS 59 2HE LYS 59 -7.026 8.132 4.061 121 HZ1 LYS 59 3HZ LYS 59 -9.158 8.027 3.101 122 HZ2 LYS 59 1HZ LYS 59 -9.803 7.155 4.400 123 HZ3 LYS 59 2HZ LYS 59 -8.700 6.418 3.350 124 H ALA 60 H ALA 60 -4.400 3.794 6.780 125 HA ALA 60 HA ALA 60 -5.984 1.597 7.934 126 HB1 ALA 60 3HB ALA 60 -3.286 1.946 7.968 127 HB2 ALA 60 1HB ALA 60 -4.190 0.989 9.142 128 HB3 ALA 60 2HB ALA 60 -3.751 2.657 9.514 129 HA PRO 61 HA PRO 61 -8.101 4.308 10.709 130 HB2 PRO 61 1HB PRO 61 -8.113 2.973 13.063 131 HB3 PRO 61 2HB PRO 61 -9.060 2.447 11.668 132 HG2 PRO 61 1HG PRO 61 -6.430 1.432 12.664 133 HG3 PRO 61 2HG PRO 61 -7.823 0.520 12.053 134 HD2 PRO 61 1HD PRO 61 -5.616 1.056 10.552 135 HD3 PRO 61 2HD PRO 61 -7.237 0.857 9.856 136 H GLY 62 H GLY 62 -7.251 6.204 11.317 137 HA2 GLY 62 1HA GLY 62 -6.304 7.601 12.975 138 HA3 GLY 62 2HA GLY 62 -5.366 6.235 13.555 139 H TYR 63 H TYR 63 -4.556 5.622 10.697 140 HA TYR 63 HA TYR 63 -2.551 7.767 10.432 141 HB2 TYR 63 1HB TYR 63 -2.209 4.836 9.756 142 HB3 TYR 63 2HB TYR 63 -0.970 6.080 9.637 143 HD1 TYR 63 HD1 TYR 63 -2.964 4.031 11.962 144 HD2 TYR 63 HD2 TYR 63 0.211 6.842 11.592 145 HE1 TYR 63 HE1 TYR 63 -2.287 3.566 14.280 146 HE2 TYR 63 HE2 TYR 63 0.896 6.382 13.908 147 HH TYR 63 HH TYR 63 -0.213 3.738 15.669 148 HA PRO 64 HA PRO 64 -3.857 8.420 6.269 149 HB2 PRO 64 1HB PRO 64 -1.507 8.996 5.017 150 HB3 PRO 64 2HB PRO 64 -2.318 10.115 6.119 151 HG2 PRO 64 1HG PRO 64 -0.025 8.264 6.648 152 HG3 PRO 64 2HG PRO 64 -0.246 9.947 7.160 153 HD2 PRO 64 1HD PRO 64 -0.695 7.860 8.814 154 HD3 PRO 64 2HD PRO 64 -1.632 9.363 8.910 155 H TRP 65 H TRP 65 -2.786 7.900 3.869 156 HA TRP 65 HA TRP 65 -3.140 5.089 3.581 157 HB2 TRP 65 1HB TRP 65 -2.190 7.148 1.577 158 HB3 TRP 65 2HB TRP 65 -2.644 5.496 1.185 159 HD1 TRP 65 HD1 TRP 65 -4.254 8.727 2.588 160 HE1 TRP 65 HE1 TRP 65 -6.742 8.723 1.939 161 HE3 TRP 65 HE3 TRP 65 -4.521 4.111 0.401 162 HZ2 TRP 65 HZ2 TRP 65 -8.579 6.995 0.667 163 HZ3 TRP 65 HZ3 TRP 65 -6.679 3.360 -0.506 164 HH2 TRP 65 HH2 TRP 65 -8.667 4.773 -0.376 165 H TRP 66 H TRP 66 -1.674 3.477 3.137 166 HA TRP 66 HA TRP 66 1.180 4.211 3.229 167 HB2 TRP 66 1HB TRP 66 -0.031 3.029 5.313 168 HB3 TRP 66 2HB TRP 66 0.356 1.593 4.370 169 HD1 TRP 66 HD1 TRP 66 2.638 0.590 4.907 170 HE1 TRP 66 HE1 TRP 66 4.857 1.450 5.883 171 HE3 TRP 66 HE3 TRP 66 1.436 5.533 5.423 172 HZ2 TRP 66 HZ2 TRP 66 5.952 3.897 6.757 173 HZ3 TRP 66 HZ3 TRP 66 3.132 7.068 6.333 174 HH2 TRP 66 HH2 TRP 66 5.345 6.262 6.980 175 HA PRO 67 HA PRO 67 1.520 1.826 -0.484 176 HB2 PRO 67 1HB PRO 67 4.168 1.246 -0.427 177 HB3 PRO 67 2HB PRO 67 3.546 2.856 -0.810 178 HG2 PRO 67 1HG PRO 67 4.619 1.806 1.784 179 HG3 PRO 67 2HG PRO 67 4.940 3.359 0.990 180 HD2 PRO 67 1HD PRO 67 3.190 3.120 3.027 181 HD3 PRO 67 2HD PRO 67 2.949 4.281 1.708 182 H ALA 68 H ALA 68 0.397 -0.056 -0.221 183 HA ALA 68 HA ALA 68 1.822 -2.314 1.048 184 HB1 ALA 68 3HB ALA 68 -0.660 -1.317 1.719 185 HB2 ALA 68 1HB ALA 68 -0.043 -2.921 2.116 186 HB3 ALA 68 2HB ALA 68 -1.045 -2.691 0.682 187 H LEU 69 H LEU 69 0.861 -4.478 0.110 188 HA LEU 69 HA LEU 69 0.543 -4.232 -2.806 189 HB2 LEU 69 1HB LEU 69 2.760 -5.448 -1.354 190 HB3 LEU 69 2HB LEU 69 2.006 -6.561 -2.479 191 HG LEU 69 HG LEU 69 2.266 -4.350 -4.046 192 HD11 LEU 69 1HD1 LEU 69 4.527 -3.474 -3.704 193 HD12 LEU 69 2HD1 LEU 69 4.658 -4.404 -2.213 194 HD13 LEU 69 3HD1 LEU 69 3.470 -3.107 -2.341 195 HD21 LEU 69 3HD2 LEU 69 4.551 -6.263 -3.768 196 HD22 LEU 69 1HD2 LEU 69 3.834 -5.578 -5.227 197 HD23 LEU 69 2HD2 LEU 69 2.974 -6.822 -4.323 198 H LEU 70 H LEU 70 -1.182 -5.301 -3.506 199 HA LEU 70 HA LEU 70 -2.810 -6.873 -1.833 200 HB2 LEU 70 1HB LEU 70 -3.228 -5.619 -4.152 201 HB3 LEU 70 2HB LEU 70 -2.979 -7.237 -4.774 202 HG LEU 70 HG LEU 70 -4.887 -7.015 -2.529 203 HD11 LEU 70 1HD1 LEU 70 -6.481 -6.472 -4.723 204 HD12 LEU 70 2HD1 LEU 70 -5.128 -5.355 -4.891 205 HD13 LEU 70 3HD1 LEU 70 -6.087 -5.364 -3.412 206 HD21 LEU 70 3HD2 LEU 70 -4.317 -9.104 -3.810 207 HD22 LEU 70 1HD2 LEU 70 -5.135 -8.386 -5.198 208 HD23 LEU 70 2HD2 LEU 70 -6.034 -8.721 -3.719 209 H LEU 71 H LEU 71 -2.706 -8.935 -1.253 210 HA LEU 71 HA LEU 71 -0.856 -10.706 -2.691 211 HB2 LEU 71 1HB LEU 71 -0.099 -10.707 -0.529 212 HB3 LEU 71 2HB LEU 71 -1.692 -10.446 0.146 213 HG LEU 71 HG LEU 71 -2.254 -12.812 -0.306 214 HD11 LEU 71 1HD1 LEU 71 -0.264 -12.805 -2.110 215 HD12 LEU 71 2HD1 LEU 71 -0.896 -14.272 -1.364 216 HD13 LEU 71 3HD1 LEU 71 0.575 -13.528 -0.739 217 HD21 LEU 71 3HD2 LEU 71 0.300 -12.692 1.265 218 HD22 LEU 71 1HD2 LEU 71 -1.137 -13.671 1.561 219 HD23 LEU 71 2HD2 LEU 71 -1.182 -11.931 1.842 220 H ARG 72 H ARG 72 -3.996 -10.862 -0.972 221 HA ARG 72 HA ARG 72 -5.055 -12.558 -3.079 222 HB2 ARG 72 1HB ARG 72 -4.209 -13.586 -0.494 223 HB3 ARG 72 2HB ARG 72 -5.909 -13.910 -0.807 224 HG2 ARG 72 1HG ARG 72 -3.886 -14.514 -2.914 225 HG3 ARG 72 2HG ARG 72 -4.085 -15.610 -1.546 226 HD2 ARG 72 1HD ARG 72 -6.471 -15.816 -2.067 227 HD3 ARG 72 2HD ARG 72 -6.266 -14.728 -3.437 228 HE ARG 72 HE ARG 72 -5.363 -16.457 -4.642 229 HH11 ARG 72 1HH1 ARG 72 -5.480 -17.377 -1.263 230 HH12 ARG 72 2HH1 ARG 72 -5.067 -19.028 -1.570 231 HH21 ARG 72 1HH2 ARG 72 -4.815 -18.640 -5.038 232 HH22 ARG 72 2HH2 ARG 72 -4.688 -19.745 -3.713 233 H ARG 73 H ARG 73 -7.362 -12.822 -2.996 234 HA ARG 73 HA ARG 73 -8.687 -10.697 -1.443 235 HB2 ARG 73 1HB ARG 73 -8.675 -10.550 -3.989 236 HB3 ARG 73 2HB ARG 73 -9.734 -11.953 -3.978 237 HG2 ARG 73 1HG ARG 73 -11.441 -10.748 -2.823 238 HG3 ARG 73 2HG ARG 73 -10.366 -9.373 -2.562 239 HD2 ARG 73 1HD ARG 73 -10.898 -8.509 -4.539 240 HD3 ARG 73 2HD ARG 73 -10.499 -10.016 -5.362 241 HE ARG 73 HE ARG 73 -12.942 -10.509 -4.304 242 HH11 ARG 73 1HH1 ARG 73 -11.682 -7.938 -6.324 243 HH12 ARG 73 2HH1 ARG 73 -13.197 -7.647 -7.109 244 HH21 ARG 73 1HH2 ARG 73 -14.935 -10.119 -5.345 245 HH22 ARG 73 2HH2 ARG 73 -15.042 -8.885 -6.554 246 H LYS 74 H LYS 74 -9.244 -11.846 0.381 247 HA LYS 74 HA LYS 74 -10.670 -14.369 0.093 248 HB2 LYS 74 1HB LYS 74 -10.696 -14.217 2.667 249 HB3 LYS 74 2HB LYS 74 -9.161 -14.510 1.864 250 HG2 LYS 74 1HG LYS 74 -8.366 -12.387 2.324 251 HG3 LYS 74 2HG LYS 74 -9.983 -11.722 2.562 252 HD2 LYS 74 1HD LYS 74 -10.143 -13.252 4.590 253 HD3 LYS 74 2HD LYS 74 -8.406 -13.498 4.408 254 HE2 LYS 74 1HE LYS 74 -8.044 -11.086 4.610 255 HE3 LYS 74 2HE LYS 74 -9.780 -10.839 4.791 256 HZ1 LYS 74 3HZ LYS 74 -7.895 -12.115 6.673 257 HZ2 LYS 74 1HZ LYS 74 -9.558 -12.419 6.768 258 HZ3 LYS 74 2HZ LYS 74 -8.973 -10.843 6.955 259 H GLU 75 H GLU 75 -12.798 -14.460 -0.078 260 HA GLU 75 HA GLU 75 -14.395 -12.154 0.782 261 HB2 GLU 75 1HB GLU 75 -14.417 -13.281 -1.621 262 HB3 GLU 75 2HB GLU 75 -15.560 -14.365 -0.842 263 HG2 GLU 75 1HG GLU 75 -16.405 -11.833 -0.102 264 HG3 GLU 75 2HG GLU 75 -15.922 -11.661 -1.787 265 H THR 76 H THR 76 -15.056 -12.401 2.829 266 HA THR 76 HA THR 76 -16.139 -15.020 3.639 267 HB THR 76 HB THR 76 -14.210 -14.285 4.969 268 HG1 THR 76 HG1 THR 76 -15.128 -14.719 6.900 269 HG21 THR 76 3HG2 THR 76 -14.497 -12.400 6.570 270 HG22 THR 76 1HG2 THR 76 -15.892 -11.887 5.623 271 HG23 THR 76 2HG2 THR 76 -14.291 -11.918 4.885 272 H LYS 77 H LYS 77 -18.232 -15.165 4.358 273 HA LYS 77 HA LYS 77 -19.717 -12.752 5.002 274 HB2 LYS 77 1HB LYS 77 -21.497 -13.240 3.331 275 HB3 LYS 77 2HB LYS 77 -19.970 -12.749 2.616 276 HG2 LYS 77 1HG LYS 77 -20.399 -14.494 1.258 277 HG3 LYS 77 2HG LYS 77 -19.624 -15.398 2.560 278 HD2 LYS 77 1HD LYS 77 -22.221 -15.287 3.408 279 HD3 LYS 77 2HD LYS 77 -22.411 -15.406 1.657 280 HE2 LYS 77 1HE LYS 77 -20.713 -17.329 1.812 281 HE3 LYS 77 2HE LYS 77 -21.062 -17.315 3.540 282 HZ1 LYS 77 3HZ LYS 77 -23.372 -17.734 3.069 283 HZ2 LYS 77 1HZ LYS 77 -22.428 -18.916 2.312 284 HZ3 LYS 77 2HZ LYS 77 -23.097 -17.656 1.402 285 H ASP 78 H ASP 78 -22.112 -13.371 5.499 286 HA ASP 78 HA ASP 78 -22.442 -16.103 6.422 287 HB2 ASP 78 1HB ASP 78 -21.858 -13.838 8.232 288 HB3 ASP 78 2HB ASP 78 -23.201 -14.870 8.718 289 H SER 79 H SER 79 -23.957 -15.580 4.578 290 HA SER 79 HA SER 79 -26.427 -14.318 5.562 291 HB2 SER 79 1HB SER 79 -25.654 -14.881 2.694 292 HB3 SER 79 2HB SER 79 -27.034 -13.939 3.254 293 HG SER 79 HG SER 79 -24.727 -12.986 2.650 294 H LEU 80 H LEU 80 -25.422 -17.214 5.889 295 HA LEU 80 HA LEU 80 -26.253 -19.333 5.825 296 HB2 LEU 80 1HB LEU 80 -28.149 -17.829 6.880 297 HB3 LEU 80 2HB LEU 80 -29.011 -18.260 5.417 298 HG LEU 80 HG LEU 80 -27.848 -20.594 6.712 299 HD11 LEU 80 1HD1 LEU 80 -28.786 -20.569 8.777 300 HD12 LEU 80 2HD1 LEU 80 -30.107 -19.507 8.290 301 HD13 LEU 80 3HD1 LEU 80 -28.506 -18.837 8.601 302 HD21 LEU 80 3HD2 LEU 80 -29.699 -21.578 5.903 303 HD22 LEU 80 1HD2 LEU 80 -29.883 -20.082 4.989 304 HD23 LEU 80 2HD2 LEU 80 -30.763 -20.305 6.499 305 H ASN 81 H ASN 81 -25.534 -18.065 3.271 306 HA ASN 81 HA ASN 81 -25.504 -18.565 1.067 307 HB2 ASN 81 1HB ASN 81 -25.728 -20.947 2.245 308 HB3 ASN 81 2HB ASN 81 -27.263 -20.943 1.385 309 HD21 ASN 81 2HD2 ASN 81 -23.998 -21.616 1.187 310 HD22 ASN 81 1HD2 ASN 81 -23.867 -21.770 -0.537 311 H THR 82 H THR 82 -27.248 -16.623 1.598 312 HA THR 82 HA THR 82 -29.328 -17.107 -0.379 313 HB THR 82 HB THR 82 -31.111 -16.146 0.981 314 HG1 THR 82 HG1 THR 82 -30.796 -15.407 2.969 315 HG21 THR 82 3HG2 THR 82 -30.715 -18.597 1.128 316 HG22 THR 82 1HG2 THR 82 -31.518 -17.891 2.530 317 HG23 THR 82 2HG2 THR 82 -29.805 -18.301 2.610 318 H ASN 83 H ASN 83 -29.131 -14.394 1.892 319 HA ASN 83 HA ASN 83 -27.559 -12.646 0.385 320 HB2 ASN 83 1HB ASN 83 -30.310 -12.929 -0.570 321 HB3 ASN 83 2HB ASN 83 -29.908 -11.267 -0.156 322 HD21 ASN 83 2HD2 ASN 83 -30.265 -12.973 -2.714 323 HD22 ASN 83 1HD2 ASN 83 -28.923 -12.474 -3.696 324 H SER 84 H SER 84 -26.889 -12.117 2.479 325 HA SER 84 HA SER 84 -28.798 -10.467 3.991 326 HB2 SER 84 1HB SER 84 -26.732 -12.354 5.146 327 HB3 SER 84 2HB SER 84 -27.737 -11.252 6.086 328 HG SER 84 HG SER 84 -28.455 -13.547 5.783 329 H SER 85 H SER 85 -25.304 -11.164 4.371 330 HA SER 85 HA SER 85 -24.585 -8.514 3.505 331 HB2 SER 85 1HB SER 85 -24.802 -9.185 6.391 332 HB3 SER 85 2HB SER 85 -23.376 -8.274 5.893 333 HG SER 85 HG SER 85 -24.712 -6.677 5.074 334 H PHE 86 H PHE 86 -22.742 -8.736 2.453 335 HA PHE 86 HA PHE 86 -21.020 -11.025 3.028 336 HB2 PHE 86 1HB PHE 86 -21.224 -9.118 0.703 337 HB3 PHE 86 2HB PHE 86 -19.864 -10.220 0.880 338 HD1 PHE 86 HD2 PHE 86 -23.596 -10.451 1.152 339 HD2 PHE 86 HD1 PHE 86 -19.992 -12.094 -0.409 340 HE1 PHE 86 HE2 PHE 86 -24.889 -12.226 0.044 341 HE2 PHE 86 HE1 PHE 86 -21.280 -13.870 -1.519 342 HZ PHE 86 HZ PHE 86 -23.730 -13.940 -1.294 343 H ASN 87 H ASN 87 -18.699 -10.767 3.185 344 HA ASN 87 HA ASN 87 -17.788 -8.084 3.942 345 HB2 ASN 87 1HB ASN 87 -17.890 -10.505 5.660 346 HB3 ASN 87 2HB ASN 87 -16.416 -9.549 5.748 347 HD21 ASN 87 2HD2 ASN 87 -19.402 -9.972 7.055 348 HD22 ASN 87 1HD2 ASN 87 -19.629 -8.404 7.765 349 H VAL 88 H VAL 88 -16.775 -8.149 1.851 350 HA VAL 88 HA VAL 88 -14.558 -10.052 1.596 351 HB VAL 88 HB VAL 88 -16.031 -9.890 -0.342 352 HG11 VAL 88 1HG1 VAL 88 -16.796 -7.605 -0.143 353 HG12 VAL 88 2HG1 VAL 88 -16.056 -7.846 -1.725 354 HG13 VAL 88 3HG1 VAL 88 -15.169 -7.003 -0.457 355 HG21 VAL 88 3HG2 VAL 88 -13.262 -8.795 -0.815 356 HG22 VAL 88 1HG2 VAL 88 -14.303 -9.482 -2.060 357 HG23 VAL 88 2HG2 VAL 88 -13.728 -10.493 -0.736 358 H LEU 89 H LEU 89 -12.466 -9.447 1.530 359 HA LEU 89 HA LEU 89 -11.827 -6.584 1.690 360 HB2 LEU 89 1HB LEU 89 -10.465 -8.620 3.440 361 HB3 LEU 89 2HB LEU 89 -10.340 -6.875 3.517 362 HG LEU 89 HG LEU 89 -12.812 -8.464 4.216 363 HD11 LEU 89 1HD1 LEU 89 -10.486 -7.521 5.793 364 HD12 LEU 89 2HD1 LEU 89 -11.512 -8.937 6.016 365 HD13 LEU 89 3HD1 LEU 89 -12.084 -7.346 6.520 366 HD21 LEU 89 3HD2 LEU 89 -13.923 -6.528 4.461 367 HD22 LEU 89 1HD2 LEU 89 -12.683 -5.861 3.400 368 HD23 LEU 89 2HD2 LEU 89 -12.527 -5.701 5.148 369 H TYR 90 H TYR 90 -9.289 -6.384 1.696 370 HA TYR 90 HA TYR 90 -8.236 -8.179 -0.390 371 HB2 TYR 90 1HB TYR 90 -8.456 -5.256 -0.304 372 HB3 TYR 90 2HB TYR 90 -6.841 -5.825 -0.710 373 HD1 TYR 90 HD1 TYR 90 -7.610 -8.331 -2.187 374 HD2 TYR 90 HD2 TYR 90 -9.156 -4.373 -2.376 375 HE1 TYR 90 HE1 TYR 90 -8.327 -8.730 -4.494 376 HE2 TYR 90 HE2 TYR 90 -9.879 -4.761 -4.692 377 HH TYR 90 HH TYR 90 -8.768 -7.081 -6.598 378 H LYS 91 H LYS 91 -6.775 -9.443 0.596 379 HA LYS 91 HA LYS 91 -5.301 -8.671 2.906 380 HB2 LYS 91 1HB LYS 91 -4.697 -10.927 0.981 381 HB3 LYS 91 2HB LYS 91 -4.099 -10.770 2.626 382 HG2 LYS 91 1HG LYS 91 -6.812 -10.667 2.982 383 HG3 LYS 91 2HG LYS 91 -6.644 -11.800 1.640 384 HD2 LYS 91 1HD LYS 91 -4.894 -12.089 4.047 385 HD3 LYS 91 2HD LYS 91 -6.562 -12.659 4.110 386 HE2 LYS 91 1HE LYS 91 -5.029 -13.468 1.726 387 HE3 LYS 91 2HE LYS 91 -4.473 -14.151 3.253 388 HZ1 LYS 91 3HZ LYS 91 -7.119 -14.446 1.966 389 HZ2 LYS 91 1HZ LYS 91 -6.898 -14.772 3.612 390 HZ3 LYS 91 2HZ LYS 91 -6.044 -15.657 2.451 391 H VAL 92 H VAL 92 -4.053 -6.875 2.615 392 HA VAL 92 HA VAL 92 -2.134 -6.899 0.388 393 HB VAL 92 HB VAL 92 -1.909 -4.509 0.657 394 HG11 VAL 92 1HG1 VAL 92 -3.982 -3.838 -0.197 395 HG12 VAL 92 2HG1 VAL 92 -4.860 -5.051 0.734 396 HG13 VAL 92 3HG1 VAL 92 -3.852 -5.544 -0.627 397 HG21 VAL 92 3HG2 VAL 92 -3.418 -3.299 2.261 398 HG22 VAL 92 1HG2 VAL 92 -2.103 -4.205 3.008 399 HG23 VAL 92 2HG2 VAL 92 -3.743 -4.855 3.021 400 H LEU 93 H LEU 93 0.041 -6.454 0.715 401 HA LEU 93 HA LEU 93 0.988 -7.026 3.428 402 HB2 LEU 93 1HB LEU 93 1.930 -7.634 0.731 403 HB3 LEU 93 2HB LEU 93 3.199 -7.000 1.761 404 HG LEU 93 HG LEU 93 1.595 -9.098 3.036 405 HD11 LEU 93 1HD1 LEU 93 1.994 -10.861 1.683 406 HD12 LEU 93 2HD1 LEU 93 3.497 -10.186 1.058 407 HD13 LEU 93 3HD1 LEU 93 1.950 -9.619 0.431 408 HD21 LEU 93 3HD2 LEU 93 3.897 -7.941 3.628 409 HD22 LEU 93 1HD2 LEU 93 4.532 -9.239 2.615 410 HD23 LEU 93 2HD2 LEU 93 3.571 -9.624 4.043 411 H PHE 94 H PHE 94 2.055 -5.571 4.589 412 HA PHE 94 HA PHE 94 2.386 -2.884 3.484 413 HB2 PHE 94 1HB PHE 94 2.010 -4.049 6.189 414 HB3 PHE 94 2HB PHE 94 3.007 -2.604 6.101 415 HD1 PHE 94 HD2 PHE 94 -0.249 -3.845 4.746 416 HD2 PHE 94 HD1 PHE 94 1.950 -0.608 6.421 417 HE1 PHE 94 HE2 PHE 94 -2.279 -2.458 4.725 418 HE2 PHE 94 HE1 PHE 94 -0.078 0.783 6.405 419 HZ PHE 94 HZ PHE 94 -2.195 -0.141 5.555 420 H PHE 95 H PHE 95 4.347 -1.656 3.969 421 HA PHE 95 HA PHE 95 6.730 -3.214 4.612 422 HB2 PHE 95 1HB PHE 95 6.699 -1.508 2.122 423 HB3 PHE 95 2HB PHE 95 7.920 -2.668 2.630 424 HD1 PHE 95 HD1 PHE 95 7.565 -5.056 2.349 425 HD2 PHE 95 HD2 PHE 95 4.677 -2.218 1.040 426 HE1 PHE 95 HE1 PHE 95 6.462 -6.801 1.011 427 HE2 PHE 95 HE2 PHE 95 3.569 -3.957 -0.300 428 HZ PHE 95 HZ PHE 95 4.460 -6.252 -0.314 429 HA PRO 96 HA PRO 96 8.902 -2.818 4.501 430 HB2 PRO 96 1HB PRO 96 10.792 -2.397 6.357 431 HB3 PRO 96 2HB PRO 96 10.750 -1.466 4.855 432 HG2 PRO 96 1HG PRO 96 9.838 -0.691 7.597 433 HG3 PRO 96 2HG PRO 96 10.702 0.274 6.387 434 HD2 PRO 96 1HD PRO 96 7.984 0.403 6.841 435 HD3 PRO 96 2HD PRO 96 8.776 0.878 5.327 436 H ASP 97 H ASP 97 10.170 -4.188 6.504 437 HA ASP 97 HA ASP 97 9.947 -5.589 8.288 438 HB2 ASP 97 1HB ASP 97 8.450 -3.424 9.117 439 HB3 ASP 97 2HB ASP 97 7.303 -4.754 9.228 440 H PHE 98 H PHE 98 8.039 -5.506 5.625 441 HA PHE 98 HA PHE 98 6.565 -6.904 4.613 442 HB2 PHE 98 1HB PHE 98 8.615 -8.500 5.904 443 HB3 PHE 98 2HB PHE 98 7.116 -9.406 5.722 444 HD1 PHE 98 HD1 PHE 98 9.836 -7.705 3.957 445 HD2 PHE 98 HD2 PHE 98 6.266 -9.986 3.555 446 HE1 PHE 98 HE1 PHE 98 10.367 -8.111 1.589 447 HE2 PHE 98 HE2 PHE 98 6.794 -10.398 1.187 448 HZ PHE 98 HZ PHE 98 8.846 -9.462 0.201 449 H ASN 99 H ASN 99 5.067 -5.644 6.256 450 HA ASN 99 HA ASN 99 3.690 -7.505 8.051 451 HB2 ASN 99 1HB ASN 99 4.310 -4.804 8.272 452 HB3 ASN 99 2HB ASN 99 2.592 -4.804 7.891 453 HD21 ASN 99 2HD2 ASN 99 3.795 -3.973 10.339 454 HD22 ASN 99 1HD2 ASN 99 3.192 -5.016 11.589 455 H PHE 100 H PHE 100 1.092 -6.469 7.965 456 HA PHE 100 HA PHE 100 0.104 -6.248 5.303 457 HB2 PHE 100 1HB PHE 100 -1.286 -8.538 5.800 458 HB3 PHE 100 2HB PHE 100 0.149 -8.448 4.786 459 HD1 PHE 100 HD1 PHE 100 -1.010 -9.162 8.225 460 HD2 PHE 100 HD2 PHE 100 2.085 -9.607 5.344 461 HE1 PHE 100 HE1 PHE 100 0.136 -10.738 9.713 462 HE2 PHE 100 HE2 PHE 100 3.240 -11.196 6.824 463 HZ PHE 100 HZ PHE 100 2.270 -11.763 9.015 464 H ALA 101 H ALA 101 -2.405 -6.769 5.341 465 HA ALA 101 HA ALA 101 -3.781 -6.389 7.801 466 HB1 ALA 101 3HB ALA 101 -4.631 -4.040 6.633 467 HB2 ALA 101 1HB ALA 101 -2.890 -4.020 6.359 468 HB3 ALA 101 2HB ALA 101 -3.521 -4.175 7.998 469 H TRP 102 H TRP 102 -6.093 -6.325 7.540 470 HA TRP 102 HA TRP 102 -6.988 -7.162 4.858 471 HB2 TRP 102 1HB TRP 102 -8.730 -7.914 7.104 472 HB3 TRP 102 2HB TRP 102 -8.183 -8.871 5.735 473 HD1 TRP 102 HD1 TRP 102 -5.397 -9.632 6.053 474 HE1 TRP 102 HE1 TRP 102 -4.357 -10.676 8.163 475 HE3 TRP 102 HE3 TRP 102 -8.870 -8.138 9.496 476 HZ2 TRP 102 HZ2 TRP 102 -4.935 -10.846 10.921 477 HZ3 TRP 102 HZ3 TRP 102 -8.552 -8.782 11.848 478 HH2 TRP 102 HH2 TRP 102 -6.625 -10.110 12.545 479 H VAL 103 H VAL 103 -7.963 -5.476 3.926 480 HA VAL 103 HA VAL 103 -10.144 -4.150 5.372 481 HB VAL 103 HB VAL 103 -9.468 -1.943 4.523 482 HG11 VAL 103 1HG1 VAL 103 -8.837 -2.467 6.766 483 HG12 VAL 103 2HG1 VAL 103 -7.486 -1.626 6.005 484 HG13 VAL 103 3HG1 VAL 103 -7.430 -3.376 6.214 485 HG21 VAL 103 3HG2 VAL 103 -6.708 -2.497 3.957 486 HG22 VAL 103 1HG2 VAL 103 -7.909 -1.677 2.961 487 HG23 VAL 103 2HG2 VAL 103 -7.744 -3.431 2.878 488 H LYS 104 H LYS 104 -11.576 -2.888 3.886 489 HA LYS 104 HA LYS 104 -12.161 -4.456 1.547 490 HB2 LYS 104 1HB LYS 104 -13.886 -3.423 3.087 491 HB3 LYS 104 2HB LYS 104 -13.469 -1.864 2.385 492 HG2 LYS 104 1HG LYS 104 -14.470 -2.335 0.390 493 HG3 LYS 104 2HG LYS 104 -14.221 -4.074 0.548 494 HD2 LYS 104 1HD LYS 104 -16.060 -2.666 2.435 495 HD3 LYS 104 2HD LYS 104 -16.614 -3.058 0.805 496 HE2 LYS 104 1HE LYS 104 -15.818 -5.429 1.280 497 HE3 LYS 104 2HE LYS 104 -15.693 -4.935 2.968 498 HZ1 LYS 104 3HZ LYS 104 -17.809 -5.666 3.009 499 HZ2 LYS 104 1HZ LYS 104 -18.055 -5.440 1.350 500 HZ3 LYS 104 2HZ LYS 104 -18.161 -4.124 2.408 501 H ARG 105 H ARG 105 -12.552 -3.455 -0.593 502 HA ARG 105 HA ARG 105 -10.273 -2.191 -1.615 503 HB2 ARG 105 1HB ARG 105 -12.975 -2.043 -2.935 504 HB3 ARG 105 2HB ARG 105 -11.393 -2.085 -3.698 505 HG2 ARG 105 1HG ARG 105 -11.649 -4.268 -3.964 506 HG3 ARG 105 2HG ARG 105 -11.572 -4.450 -2.210 507 HD2 ARG 105 1HD ARG 105 -13.576 -5.501 -2.961 508 HD3 ARG 105 2HD ARG 105 -14.032 -4.010 -2.140 509 HE ARG 105 HE ARG 105 -13.877 -3.263 -4.737 510 HH11 ARG 105 1HH1 ARG 105 -15.562 -5.851 -3.092 511 HH12 ARG 105 2HH1 ARG 105 -16.865 -5.894 -4.231 512 HH21 ARG 105 1HH2 ARG 105 -15.605 -3.319 -6.234 513 HH22 ARG 105 2HH2 ARG 105 -16.889 -4.458 -6.013 514 H ASN 106 H ASN 106 -13.112 -0.849 -0.146 515 HA ASN 106 HA ASN 106 -13.169 1.709 -1.256 516 HB2 ASN 106 1HB ASN 106 -13.835 0.927 1.590 517 HB3 ASN 106 2HB ASN 106 -14.354 2.397 0.774 518 HD21 ASN 106 2HD2 ASN 106 -15.599 -0.248 1.884 519 HD22 ASN 106 1HD2 ASN 106 -16.757 -0.652 0.654 520 H SER 107 H SER 107 -11.238 0.417 1.416 521 HA SER 107 HA SER 107 -9.959 3.007 1.810 522 HB2 SER 107 1HB SER 107 -8.746 1.793 3.667 523 HB3 SER 107 2HB SER 107 -10.499 1.857 3.844 524 HG SER 107 HG SER 107 -10.524 -0.236 3.797 525 H VAL 108 H VAL 108 -9.599 1.037 -0.576 526 HA VAL 108 HA VAL 108 -6.655 1.066 -0.536 527 HB VAL 108 HB VAL 108 -8.417 -0.953 -1.926 528 HG11 VAL 108 1HG1 VAL 108 -5.414 -0.906 -1.644 529 HG12 VAL 108 2HG1 VAL 108 -6.296 -0.453 -3.101 530 HG13 VAL 108 3HG1 VAL 108 -6.377 -2.108 -2.502 531 HG21 VAL 108 3HG2 VAL 108 -7.998 -0.932 0.713 532 HG22 VAL 108 1HG2 VAL 108 -6.532 -1.768 0.205 533 HG23 VAL 108 2HG2 VAL 108 -8.112 -2.421 -0.224 534 H LYS 109 H LYS 109 -5.606 1.688 -2.433 535 HA LYS 109 HA LYS 109 -7.251 2.534 -4.706 536 HB2 LYS 109 1HB LYS 109 -6.715 4.427 -2.991 537 HB3 LYS 109 2HB LYS 109 -5.104 4.366 -3.690 538 HG2 LYS 109 1HG LYS 109 -5.987 4.887 -5.875 539 HG3 LYS 109 2HG LYS 109 -7.636 4.838 -5.248 540 HD2 LYS 109 1HD LYS 109 -7.402 6.830 -4.107 541 HD3 LYS 109 2HD LYS 109 -5.648 6.677 -3.993 542 HE2 LYS 109 1HE LYS 109 -6.333 8.460 -5.544 543 HE3 LYS 109 2HE LYS 109 -5.413 7.189 -6.345 544 HZ1 LYS 109 3HZ LYS 109 -7.334 6.349 -7.361 545 HZ2 LYS 109 1HZ LYS 109 -7.469 8.028 -7.526 546 HZ3 LYS 109 2HZ LYS 109 -8.375 7.218 -6.348 547 HA PRO 110 HA PRO 110 -4.080 0.533 -7.074 548 HB2 PRO 110 1HB PRO 110 -4.626 2.638 -9.100 549 HB3 PRO 110 2HB PRO 110 -4.662 0.880 -9.265 550 HG2 PRO 110 1HG PRO 110 -6.923 2.291 -9.166 551 HG3 PRO 110 2HG PRO 110 -6.796 0.707 -8.378 552 HD2 PRO 110 1HD PRO 110 -6.732 3.439 -7.168 553 HD3 PRO 110 2HD PRO 110 -7.468 1.946 -6.550 554 H LEU 111 H LEU 111 -1.933 0.742 -7.002 555 HA LEU 111 HA LEU 111 -0.776 3.454 -6.937 556 HB2 LEU 111 1HB LEU 111 -0.644 1.858 -4.879 557 HB3 LEU 111 2HB LEU 111 0.594 1.037 -5.807 558 HG LEU 111 HG LEU 111 1.959 3.041 -5.847 559 HD11 LEU 111 1HD1 LEU 111 0.409 4.807 -5.956 560 HD12 LEU 111 2HD1 LEU 111 1.220 4.989 -4.402 561 HD13 LEU 111 3HD1 LEU 111 -0.399 4.297 -4.474 562 HD21 LEU 111 3HD2 LEU 111 0.939 2.390 -3.084 563 HD22 LEU 111 1HD2 LEU 111 2.452 3.220 -3.448 564 HD23 LEU 111 2HD2 LEU 111 2.220 1.546 -3.952 565 H LEU 112 H LEU 112 1.142 3.847 -8.108 566 HA LEU 112 HA LEU 112 1.726 1.828 -10.177 567 HB2 LEU 112 1HB LEU 112 2.053 4.824 -10.287 568 HB3 LEU 112 2HB LEU 112 2.476 3.711 -11.574 569 HG LEU 112 HG LEU 112 -0.298 4.274 -10.532 570 HD11 LEU 112 1HD1 LEU 112 -0.485 4.920 -13.051 571 HD12 LEU 112 2HD1 LEU 112 1.267 5.100 -12.930 572 HD13 LEU 112 3HD1 LEU 112 0.209 6.055 -11.892 573 HD21 LEU 112 3HD2 LEU 112 -0.541 2.083 -11.137 574 HD22 LEU 112 1HD2 LEU 112 0.781 2.142 -12.303 575 HD23 LEU 112 2HD2 LEU 112 -0.782 2.853 -12.704 576 H ASP 113 H ASP 113 3.995 2.238 -11.173 577 HA ASP 113 HA ASP 113 5.903 1.890 -9.028 578 HB2 ASP 113 1HB ASP 113 6.440 1.958 -12.007 579 HB3 ASP 113 2HB ASP 113 7.492 1.307 -10.757 580 H SER 114 H SER 114 5.415 4.198 -11.689 581 HA SER 114 HA SER 114 7.634 5.825 -11.131 582 HB2 SER 114 1HB SER 114 5.124 6.134 -12.697 583 HB3 SER 114 2HB SER 114 5.972 7.613 -12.249 584 HG SER 114 HG SER 114 6.990 7.091 -14.059 585 H GLU 115 H GLU 115 4.255 6.031 -10.033 586 HA GLU 115 HA GLU 115 4.405 8.428 -8.629 587 HB2 GLU 115 1HB GLU 115 2.743 5.951 -8.174 588 HB3 GLU 115 2HB GLU 115 2.559 7.394 -7.186 589 HG2 GLU 115 1HG GLU 115 2.348 8.521 -9.590 590 HG3 GLU 115 2HG GLU 115 1.786 6.901 -9.995 591 H ILE 116 H ILE 116 4.883 5.127 -7.342 592 HA ILE 116 HA ILE 116 5.551 5.834 -4.730 593 HB ILE 116 HB ILE 116 6.573 3.465 -6.317 594 HG12 ILE 116 1HG1 ILE 116 4.312 3.528 -4.315 595 HG13 ILE 116 2HG1 ILE 116 4.055 3.731 -6.044 596 HG21 ILE 116 1HG2 ILE 116 7.905 4.015 -4.283 597 HG22 ILE 116 2HG2 ILE 116 7.127 2.434 -4.228 598 HG23 ILE 116 3HG2 ILE 116 6.445 3.784 -3.324 599 HD11 ILE 116 3HD1 ILE 116 3.631 1.446 -5.371 600 HD12 ILE 116 1HD1 ILE 116 5.256 1.321 -4.698 601 HD13 ILE 116 2HD1 ILE 116 5.035 1.522 -6.437 602 H ALA 117 H ALA 117 7.716 5.143 -7.486 603 HA ALA 117 HA ALA 117 10.144 5.736 -6.241 604 HB1 ALA 117 3HB ALA 117 9.799 6.522 -9.087 605 HB2 ALA 117 1HB ALA 117 9.536 4.830 -8.665 606 HB3 ALA 117 2HB ALA 117 11.088 5.594 -8.319 607 H LYS 118 H LYS 118 7.716 7.814 -7.674 608 HA LYS 118 HA LYS 118 9.244 10.207 -7.656 609 HB2 LYS 118 1HB LYS 118 6.834 9.448 -8.729 610 HB3 LYS 118 2HB LYS 118 6.342 10.524 -7.428 611 HG2 LYS 118 1HG LYS 118 6.742 12.209 -8.788 612 HG3 LYS 118 2HG LYS 118 8.461 11.817 -8.646 613 HD2 LYS 118 1HD LYS 118 8.386 10.439 -10.594 614 HD3 LYS 118 2HD LYS 118 6.623 10.519 -10.654 615 HE2 LYS 118 1HE LYS 118 8.135 13.074 -10.782 616 HE3 LYS 118 2HE LYS 118 8.171 12.032 -12.202 617 HZ1 LYS 118 3HZ LYS 118 5.810 12.111 -12.353 618 HZ2 LYS 118 1HZ LYS 118 6.356 13.705 -12.201 619 HZ3 LYS 118 2HZ LYS 118 5.669 12.918 -10.872 620 H PHE 119 H PHE 119 6.680 8.964 -5.525 621 HA PHE 119 HA PHE 119 6.525 11.025 -3.698 622 HB2 PHE 119 1HB PHE 119 5.018 9.202 -3.451 623 HB3 PHE 119 2HB PHE 119 6.327 8.038 -3.304 624 HD1 PHE 119 HD2 PHE 119 7.554 7.799 -1.212 625 HD2 PHE 119 HD1 PHE 119 4.289 10.508 -1.561 626 HE1 PHE 119 HE2 PHE 119 7.422 7.945 1.241 627 HE2 PHE 119 HE1 PHE 119 4.158 10.666 0.890 628 HZ PHE 119 HZ PHE 119 5.729 9.385 2.288 629 H LEU 120 H LEU 120 8.863 8.368 -3.750 630 HA LEU 120 HA LEU 120 10.238 9.144 -1.397 631 HB2 LEU 120 1HB LEU 120 11.110 7.473 -3.750 632 HB3 LEU 120 2HB LEU 120 12.043 7.664 -2.277 633 HG LEU 120 HG LEU 120 9.269 6.775 -1.862 634 HD11 LEU 120 1HD1 LEU 120 11.084 5.354 -3.698 635 HD12 LEU 120 2HD1 LEU 120 9.331 5.269 -3.539 636 HD13 LEU 120 3HD1 LEU 120 10.359 4.366 -2.431 637 HD21 LEU 120 3HD2 LEU 120 11.140 6.989 -0.158 638 HD22 LEU 120 1HD2 LEU 120 11.842 5.553 -0.900 639 HD23 LEU 120 2HD2 LEU 120 10.244 5.472 -0.163 640 H GLY 121 H GLY 121 10.622 9.919 -4.828 641 HA2 GLY 121 1HA GLY 121 13.036 11.462 -4.305 642 HA3 GLY 121 2HA GLY 121 12.293 11.189 -5.870 643 H SER 122 H SER 122 10.175 12.214 -3.342 644 HA SER 122 HA SER 122 9.254 14.466 -4.673 645 HB2 SER 122 1HB SER 122 8.094 15.041 -2.639 646 HB3 SER 122 2HB SER 122 8.107 13.282 -2.770 647 HG SER 122 HG SER 122 8.668 13.918 -0.676 648 H SER 123 H SER 123 11.642 14.266 -2.049 649 HA SER 123 HA SER 123 13.236 15.689 -1.302 650 HB2 SER 123 1HB SER 123 13.045 16.380 -4.206 651 HB3 SER 123 2HB SER 123 14.037 17.393 -3.159 652 HG SER 123 HG SER 123 15.204 15.532 -2.567 653 H LYS 124 H LYS 124 10.282 16.479 -1.237 654 HA LYS 124 HA LYS 124 10.743 19.302 -0.543 655 HB2 LYS 124 1HB LYS 124 8.389 19.764 -1.267 656 HB3 LYS 124 2HB LYS 124 9.494 19.367 -2.576 657 HG2 LYS 124 1HG LYS 124 8.456 16.917 -1.877 658 HG3 LYS 124 2HG LYS 124 7.082 18.010 -1.690 659 HD2 LYS 124 1HD LYS 124 8.008 18.907 -4.027 660 HD3 LYS 124 2HD LYS 124 8.592 17.245 -4.124 661 HE2 LYS 124 1HE LYS 124 5.807 17.539 -3.227 662 HE3 LYS 124 2HE LYS 124 6.113 18.057 -4.885 663 HZ1 LYS 124 3HZ LYS 124 6.335 15.382 -3.703 664 HZ2 LYS 124 1HZ LYS 124 7.360 15.777 -4.989 665 HZ3 LYS 124 2HZ LYS 124 5.683 15.850 -5.190 666 H ARG 125 H ARG 125 8.432 16.611 -0.150 667 HA ARG 125 HA ARG 125 8.331 17.190 2.712 668 HB2 ARG 125 1HB ARG 125 6.355 18.248 1.675 669 HB3 ARG 125 2HB ARG 125 5.899 16.699 0.981 670 HG2 ARG 125 1HG ARG 125 6.125 16.084 3.632 671 HG3 ARG 125 2HG ARG 125 5.513 17.738 3.683 672 HD2 ARG 125 1HD ARG 125 3.950 16.635 1.742 673 HD3 ARG 125 2HD ARG 125 4.201 15.259 2.815 674 HE ARG 125 HE ARG 125 2.881 16.278 4.383 675 HH11 ARG 125 1HH1 ARG 125 3.759 18.644 1.953 676 HH12 ARG 125 2HH1 ARG 125 2.665 19.845 2.550 677 HH21 ARG 125 1HH2 ARG 125 1.446 17.871 5.169 678 HH22 ARG 125 2HH2 ARG 125 1.354 19.408 4.375 679 H LYS 126 H LYS 126 9.367 15.417 3.372 680 HA LYS 126 HA LYS 126 8.079 12.844 2.929 681 HB2 LYS 126 1HB LYS 126 10.055 11.712 2.259 682 HB3 LYS 126 2HB LYS 126 9.928 13.139 1.241 683 HG2 LYS 126 1HG LYS 126 11.602 13.158 3.725 684 HG3 LYS 126 2HG LYS 126 12.222 12.521 2.202 685 HD2 LYS 126 1HD LYS 126 10.916 15.125 1.947 686 HD3 LYS 126 2HD LYS 126 12.336 15.142 2.993 687 HE2 LYS 126 1HE LYS 126 13.215 13.655 0.883 688 HE3 LYS 126 2HE LYS 126 12.128 14.794 0.090 689 HZ1 LYS 126 3HZ LYS 126 14.607 15.407 0.457 690 HZ2 LYS 126 1HZ LYS 126 14.104 15.798 2.025 691 HZ3 LYS 126 2HZ LYS 126 13.414 16.580 0.694 692 H SER 127 H SER 127 8.575 11.251 4.519 693 HA SER 127 HA SER 127 9.882 12.316 6.937 694 HB2 SER 127 1HB SER 127 7.179 11.217 6.579 695 HB3 SER 127 2HB SER 127 8.069 10.505 7.925 696 HG SER 127 HG SER 127 7.130 12.279 8.773 697 H LYS 128 H LYS 128 11.020 10.803 8.231 698 HA LYS 128 HA LYS 128 12.482 8.867 6.892 699 HB2 LYS 128 1HB LYS 128 12.064 9.606 9.715 700 HB3 LYS 128 2HB LYS 128 12.586 7.945 9.463 701 HG2 LYS 128 1HG LYS 128 14.671 8.591 9.091 702 HG3 LYS 128 2HG LYS 128 14.152 9.727 7.846 703 HD2 LYS 128 1HD LYS 128 13.804 10.420 10.735 704 HD3 LYS 128 2HD LYS 128 15.387 10.599 9.973 705 HE2 LYS 128 1HE LYS 128 12.875 11.798 8.826 706 HE3 LYS 128 2HE LYS 128 13.893 12.651 9.983 707 HZ1 LYS 128 3HZ LYS 128 14.874 11.585 7.391 708 HZ2 LYS 128 1HZ LYS 128 15.712 12.591 8.463 709 HZ3 LYS 128 2HZ LYS 128 14.368 13.181 7.623 710 H GLU 129 H GLU 129 9.617 8.404 8.955 711 HA GLU 129 HA GLU 129 9.511 5.586 8.617 712 HB2 GLU 129 1HB GLU 129 7.527 7.641 9.560 713 HB3 GLU 129 2HB GLU 129 7.074 5.952 9.383 714 HG2 GLU 129 1HG GLU 129 8.409 5.268 11.122 715 HG3 GLU 129 2HG GLU 129 9.486 6.657 10.983 716 H LEU 130 H LEU 130 8.180 8.306 6.823 717 HA LEU 130 HA LEU 130 6.425 6.705 5.216 718 HB2 LEU 130 1HB LEU 130 7.164 9.542 5.403 719 HB3 LEU 130 2HB LEU 130 6.783 9.004 3.781 720 HG LEU 130 HG LEU 130 4.905 8.445 6.056 721 HD11 LEU 130 1HD1 LEU 130 5.401 11.024 4.664 722 HD12 LEU 130 2HD1 LEU 130 4.887 10.711 6.322 723 HD13 LEU 130 3HD1 LEU 130 3.732 10.565 4.998 724 HD21 LEU 130 3HD2 LEU 130 3.408 7.869 4.454 725 HD22 LEU 130 1HD2 LEU 130 4.879 7.533 3.540 726 HD23 LEU 130 2HD2 LEU 130 4.019 9.054 3.301 727 H ILE 131 H ILE 131 9.619 8.188 4.702 728 HA ILE 131 HA ILE 131 9.934 7.463 2.017 729 HB ILE 131 HB ILE 131 12.088 7.736 4.121 730 HG12 ILE 131 1HG1 ILE 131 11.632 9.835 2.076 731 HG13 ILE 131 2HG1 ILE 131 10.400 9.693 3.325 732 HG21 ILE 131 1HG2 ILE 131 12.938 8.395 1.469 733 HG22 ILE 131 2HG2 ILE 131 12.251 6.770 1.483 734 HG23 ILE 131 3HG2 ILE 131 13.578 7.177 2.572 735 HD11 ILE 131 3HD1 ILE 131 12.716 9.640 4.779 736 HD12 ILE 131 1HD1 ILE 131 11.701 11.056 4.507 737 HD13 ILE 131 2HD1 ILE 131 13.100 10.763 3.474 738 H GLU 132 H GLU 132 11.133 5.778 4.933 739 HA GLU 132 HA GLU 132 12.218 3.555 3.671 740 HB2 GLU 132 1HB GLU 132 10.865 3.732 6.371 741 HB3 GLU 132 2HB GLU 132 11.838 2.370 5.832 742 HG2 GLU 132 1HG GLU 132 13.009 5.113 5.814 743 HG3 GLU 132 2HG GLU 132 12.884 4.219 7.329 744 H ALA 133 H ALA 133 8.894 4.369 4.326 745 HA ALA 133 HA ALA 133 7.754 1.808 3.976 746 HB1 ALA 133 3HB ALA 133 6.763 4.055 4.917 747 HB2 ALA 133 1HB ALA 133 5.722 2.850 4.158 748 HB3 ALA 133 2HB ALA 133 6.245 4.267 3.245 749 H TYR 134 H TYR 134 7.933 4.586 1.767 750 HA TYR 134 HA TYR 134 6.937 3.104 -0.445 751 HB2 TYR 134 1HB TYR 134 8.138 5.805 -0.077 752 HB3 TYR 134 2HB TYR 134 8.121 5.128 -1.703 753 HD1 TYR 134 HD2 TYR 134 5.748 5.414 1.182 754 HD2 TYR 134 HD1 TYR 134 6.330 5.744 -3.018 755 HE1 TYR 134 HE2 TYR 134 3.407 6.116 0.919 756 HE2 TYR 134 HE1 TYR 134 3.991 6.445 -3.293 757 HH TYR 134 HH TYR 134 1.860 6.271 -2.113 758 H GLU 135 H GLU 135 10.131 3.637 0.870 759 HA GLU 135 HA GLU 135 11.593 2.749 -1.403 760 HB2 GLU 135 1HB GLU 135 12.243 3.813 1.085 761 HB3 GLU 135 2HB GLU 135 12.879 2.173 1.145 762 HG2 GLU 135 1HG GLU 135 13.496 4.239 -0.954 763 HG3 GLU 135 2HG GLU 135 14.559 3.726 0.356 764 H ALA 136 H ALA 136 10.017 1.161 1.294 765 HA ALA 136 HA ALA 136 11.212 -1.419 0.773 766 HB1 ALA 136 3HB ALA 136 8.795 -0.823 2.464 767 HB2 ALA 136 1HB ALA 136 10.454 -0.642 3.032 768 HB3 ALA 136 2HB ALA 136 9.857 -2.229 2.550 769 H SER 137 H SER 137 8.271 0.284 -0.070 770 HA SER 137 HA SER 137 6.990 -2.032 -1.214 771 HB2 SER 137 1HB SER 137 5.151 -0.616 -1.678 772 HB3 SER 137 2HB SER 137 5.795 -0.045 -0.141 773 HG SER 137 HG SER 137 7.052 1.469 -1.590 774 H LYS 138 H LYS 138 9.227 0.350 -2.288 775 HA LYS 138 HA LYS 138 8.613 0.566 -4.994 776 HB2 LYS 138 1HB LYS 138 10.947 1.067 -3.301 777 HB3 LYS 138 2HB LYS 138 11.369 0.637 -4.953 778 HG2 LYS 138 1HG LYS 138 9.220 2.613 -4.727 779 HG3 LYS 138 2HG LYS 138 10.778 3.141 -4.094 780 HD2 LYS 138 1HD LYS 138 10.803 3.783 -6.349 781 HD3 LYS 138 2HD LYS 138 11.763 2.304 -6.296 782 HE2 LYS 138 1HE LYS 138 9.620 1.078 -6.914 783 HE3 LYS 138 2HE LYS 138 8.939 2.664 -7.273 784 HZ1 LYS 138 3HZ LYS 138 11.498 1.870 -8.494 785 HZ2 LYS 138 1HZ LYS 138 10.331 2.956 -9.062 786 HZ3 LYS 138 2HZ LYS 138 10.048 1.291 -9.145 787 H THR 139 H THR 139 10.604 -1.890 -3.340 788 HA THR 139 HA THR 139 10.341 -3.581 -5.735 789 HB THR 139 HB THR 139 12.890 -3.718 -4.193 790 HG1 THR 139 HG1 THR 139 13.380 -1.755 -4.686 791 HG21 THR 139 3HG2 THR 139 12.215 -5.209 -6.177 792 HG22 THR 139 1HG2 THR 139 13.836 -4.512 -6.139 793 HG23 THR 139 2HG2 THR 139 12.590 -3.794 -7.161 794 HA PRO 140 HA PRO 140 9.414 -6.191 -2.072 795 HB2 PRO 140 1HB PRO 140 6.780 -5.956 -1.919 796 HB3 PRO 140 2HB PRO 140 7.808 -4.608 -1.417 797 HG2 PRO 140 1HG PRO 140 6.127 -4.890 -3.836 798 HG3 PRO 140 2HG PRO 140 6.654 -3.423 -3.002 799 HD2 PRO 140 1HD PRO 140 7.841 -4.720 -5.312 800 HD3 PRO 140 2HD PRO 140 8.289 -3.176 -4.562 801 HA PRO 141 HA PRO 141 7.972 -8.851 -5.749 802 HB2 PRO 141 1HB PRO 141 10.231 -10.230 -6.289 803 HB3 PRO 141 2HB PRO 141 9.917 -8.634 -6.976 804 HG2 PRO 141 1HG PRO 141 11.607 -9.366 -4.615 805 HG3 PRO 141 2HG PRO 141 11.968 -8.257 -5.952 806 HD2 PRO 141 1HD PRO 141 11.086 -7.405 -3.525 807 HD3 PRO 141 2HD PRO 141 10.732 -6.546 -5.039 808 H ASP 142 H ASP 142 10.372 -11.085 -4.726 809 HA ASP 142 HA ASP 142 10.159 -13.108 -3.691 810 HB2 ASP 142 1HB ASP 142 10.223 -11.121 -1.846 811 HB3 ASP 142 2HB ASP 142 8.720 -11.920 -1.395 812 H LEU 143 H LEU 143 7.920 -12.428 -5.434 813 HA LEU 143 HA LEU 143 6.172 -14.529 -4.896 814 HB2 LEU 143 1HB LEU 143 5.332 -13.220 -3.042 815 HB3 LEU 143 2HB LEU 143 5.120 -11.820 -4.074 816 HG LEU 143 HG LEU 143 3.398 -13.149 -5.361 817 HD11 LEU 143 1HD1 LEU 143 2.595 -15.176 -4.610 818 HD12 LEU 143 2HD1 LEU 143 3.227 -14.942 -2.979 819 HD13 LEU 143 3HD1 LEU 143 4.325 -15.342 -4.301 820 HD21 LEU 143 3HD2 LEU 143 2.882 -11.439 -3.615 821 HD22 LEU 143 1HD2 LEU 143 2.753 -12.753 -2.446 822 HD23 LEU 143 2HD2 LEU 143 1.643 -12.677 -3.815 823 H LYS 144 H LYS 144 6.100 -11.195 -6.180 824 HA LYS 144 HA LYS 144 4.356 -11.608 -8.296 825 HB2 LYS 144 1HB LYS 144 5.316 -9.629 -9.332 826 HB3 LYS 144 2HB LYS 144 5.127 -9.384 -7.603 827 HG2 LYS 144 1HG LYS 144 7.579 -10.001 -7.386 828 HG3 LYS 144 2HG LYS 144 7.662 -9.863 -9.145 829 HD2 LYS 144 1HD LYS 144 6.425 -7.617 -7.651 830 HD3 LYS 144 2HD LYS 144 8.175 -7.807 -7.530 831 HE2 LYS 144 1HE LYS 144 6.868 -7.902 -10.212 832 HE3 LYS 144 2HE LYS 144 7.116 -6.342 -9.429 833 HZ1 LYS 144 3HZ LYS 144 9.074 -8.204 -10.534 834 HZ2 LYS 144 1HZ LYS 144 9.529 -7.369 -9.134 835 HZ3 LYS 144 2HZ LYS 144 9.078 -6.514 -10.521 836 H GLU 145 H GLU 145 7.763 -12.414 -8.049 837 HA GLU 145 HA GLU 145 8.314 -12.834 -10.771 838 HB2 GLU 145 1HB GLU 145 9.509 -14.114 -8.307 839 HB3 GLU 145 2HB GLU 145 10.158 -14.310 -9.930 840 HG2 GLU 145 1HG GLU 145 9.956 -11.583 -9.677 841 HG3 GLU 145 2HG GLU 145 10.427 -12.098 -8.059 842 H GLU 146 H GLU 146 6.749 -14.864 -8.369 843 HA GLU 146 HA GLU 146 6.704 -17.170 -10.139 844 HB2 GLU 146 1HB GLU 146 6.042 -16.642 -7.297 845 HB3 GLU 146 2HB GLU 146 5.109 -17.901 -8.090 846 HG2 GLU 146 1HG GLU 146 6.878 -19.047 -7.132 847 HG3 GLU 146 2HG GLU 146 7.375 -18.857 -8.813 848 H SER 147 H SER 147 5.019 -17.782 -11.387 849 HA SER 147 HA SER 147 2.319 -17.121 -10.902 850 HB2 SER 147 1HB SER 147 2.018 -15.626 -12.942 851 HB3 SER 147 2HB SER 147 2.798 -14.880 -11.548 852 HG SER 147 HG SER 147 4.724 -14.952 -12.573 853 H SER 148 H SER 148 0.872 -18.044 -12.416 854 HA SER 148 HA SER 148 2.135 -20.033 -14.172 855 HB2 SER 148 1HB SER 148 0.254 -21.419 -13.875 856 HB3 SER 148 2HB SER 148 0.542 -20.729 -12.279 857 HG SER 148 HG SER 148 -1.604 -20.446 -13.946 858 H THR 149 H THR 149 0.002 -17.282 -14.164 859 HA THR 149 HA THR 149 -0.935 -16.065 -15.833 860 HB THR 149 HB THR 149 0.721 -17.745 -17.726 861 HG1 THR 149 HG1 THR 149 2.229 -16.915 -16.429 862 HG21 THR 149 3HG2 THR 149 -0.145 -16.457 -19.298 863 HG22 THR 149 1HG2 THR 149 0.697 -15.097 -18.554 864 HG23 THR 149 2HG2 THR 149 -0.972 -15.451 -18.108 865 H ASP 150 H ASP 150 -2.466 -18.058 -14.857 866 HA ASP 150 HA ASP 150 -4.389 -19.198 -15.252 867 HB2 ASP 150 1HB ASP 150 -4.166 -17.376 -17.460 868 HB3 ASP 150 2HB ASP 150 -4.854 -18.892 -18.030 869 H LEU 151 H LEU 151 -5.255 -21.132 -16.250 870 HA LEU 151 HA LEU 151 -3.117 -22.814 -17.360 871 HB2 LEU 151 1HB LEU 151 -4.212 -23.458 -15.180 872 HB3 LEU 151 2HB LEU 151 -5.686 -23.744 -16.087 873 HG LEU 151 HG LEU 151 -4.283 -25.375 -17.501 874 HD11 LEU 151 1HD1 LEU 151 -2.553 -25.781 -15.149 875 HD12 LEU 151 2HD1 LEU 151 -2.183 -24.380 -16.154 876 HD13 LEU 151 3HD1 LEU 151 -2.213 -25.994 -16.867 877 HD21 LEU 151 3HD2 LEU 151 -4.637 -26.236 -14.648 878 HD22 LEU 151 1HD2 LEU 151 -4.886 -27.164 -16.128 879 HD23 LEU 151 2HD2 LEU 151 -6.019 -25.888 -15.686 880 H GLU 152 H GLU 152 -6.480 -21.829 -17.838 881 HA GLU 152 HA GLU 152 -6.276 -22.696 -20.622 882 HB2 GLU 152 1HB GLU 152 -8.258 -23.659 -18.618 883 HB3 GLU 152 2HB GLU 152 -8.839 -23.347 -20.248 884 HG2 GLU 152 1HG GLU 152 -8.282 -25.533 -20.468 885 HG3 GLU 152 2HG GLU 152 -6.737 -24.802 -20.902 Start of MODEL 10 1 H1 SER 45 1H SER 45 -17.886 1.610 -17.605 2 H2 SER 45 2H SER 45 -18.849 0.399 -18.350 3 H3 SER 45 3H SER 45 -17.264 0.716 -18.929 4 HA SER 45 HA SER 45 -17.836 -0.214 -16.200 5 HB2 SER 45 1HB SER 45 -16.888 -2.420 -17.307 6 HB3 SER 45 2HB SER 45 -18.605 -2.036 -17.418 7 HG SER 45 HG SER 45 -16.709 -2.180 -19.390 8 H ALA 46 H ALA 46 -16.129 0.512 -15.066 9 HA ALA 46 HA ALA 46 -13.456 -0.136 -16.020 10 HB1 ALA 46 3HB ALA 46 -12.617 2.150 -15.527 11 HB2 ALA 46 1HB ALA 46 -14.290 2.684 -15.364 12 HB3 ALA 46 2HB ALA 46 -13.707 2.073 -16.912 13 H ASP 47 H ASP 47 -13.200 -1.557 -14.339 14 HA ASP 47 HA ASP 47 -12.561 -0.366 -11.784 15 HB2 ASP 47 1HB ASP 47 -15.113 -1.336 -12.048 16 HB3 ASP 47 2HB ASP 47 -14.259 -2.726 -11.381 17 H ASP 48 H ASP 48 -11.095 -1.714 -13.893 18 HA ASP 48 HA ASP 48 -10.215 -4.138 -12.475 19 HB2 ASP 48 1HB ASP 48 -11.045 -4.159 -14.972 20 HB3 ASP 48 2HB ASP 48 -9.424 -3.555 -15.305 21 H ARG 49 H ARG 49 -9.384 -1.726 -11.466 22 HA ARG 49 HA ARG 49 -6.658 -1.333 -12.468 23 HB2 ARG 49 1HB ARG 49 -6.646 0.704 -11.086 24 HB3 ARG 49 2HB ARG 49 -7.992 0.690 -12.215 25 HG2 ARG 49 1HG ARG 49 -9.132 -0.423 -10.010 26 HG3 ARG 49 2HG ARG 49 -7.984 0.703 -9.287 27 HD2 ARG 49 1HD ARG 49 -8.996 2.553 -10.242 28 HD3 ARG 49 2HD ARG 49 -9.757 1.604 -11.520 29 HE ARG 49 HE ARG 49 -10.954 0.668 -9.292 30 HH11 ARG 49 1HH1 ARG 49 -10.461 3.918 -10.508 31 HH12 ARG 49 2HH1 ARG 49 -11.899 4.540 -9.772 32 HH21 ARG 49 1HH2 ARG 49 -12.847 1.496 -8.333 33 HH22 ARG 49 2HH2 ARG 49 -13.252 3.167 -8.538 34 H LEU 50 H LEU 50 -7.586 -3.666 -10.819 35 HA LEU 50 HA LEU 50 -5.444 -3.549 -8.850 36 HB2 LEU 50 1HB LEU 50 -8.345 -3.858 -8.212 37 HB3 LEU 50 2HB LEU 50 -7.175 -4.749 -7.259 38 HG LEU 50 HG LEU 50 -6.734 -1.825 -7.602 39 HD11 LEU 50 1HD1 LEU 50 -8.242 -1.280 -5.793 40 HD12 LEU 50 2HD1 LEU 50 -8.760 -2.961 -5.682 41 HD13 LEU 50 3HD1 LEU 50 -9.140 -2.015 -7.121 42 HD21 LEU 50 3HD2 LEU 50 -5.467 -2.034 -5.741 43 HD22 LEU 50 1HD2 LEU 50 -5.403 -3.720 -6.254 44 HD23 LEU 50 2HD2 LEU 50 -6.543 -3.221 -5.005 45 H ASN 51 H ASN 51 -4.578 -5.571 -8.325 46 HA ASN 51 HA ASN 51 -5.822 -8.006 -9.218 47 HB2 ASN 51 1HB ASN 51 -4.015 -8.675 -10.764 48 HB3 ASN 51 2HB ASN 51 -4.883 -7.257 -11.340 49 HD21 ASN 51 2HD2 ASN 51 -1.875 -8.512 -10.206 50 HD22 ASN 51 1HD2 ASN 51 -0.931 -7.085 -10.502 51 H PHE 52 H PHE 52 -4.166 -9.906 -8.948 52 HA PHE 52 HA PHE 52 -3.222 -9.760 -6.245 53 HB2 PHE 52 1HB PHE 52 -2.927 -11.970 -8.292 54 HB3 PHE 52 2HB PHE 52 -2.557 -12.114 -6.572 55 HD1 PHE 52 HD2 PHE 52 -4.822 -10.768 -5.315 56 HD2 PHE 52 HD1 PHE 52 -4.717 -13.366 -8.686 57 HE1 PHE 52 HE2 PHE 52 -7.148 -11.428 -4.875 58 HE2 PHE 52 HE1 PHE 52 -7.044 -14.032 -8.249 59 HZ PHE 52 HZ PHE 52 -8.264 -13.063 -6.341 60 H GLY 53 H GLY 53 -1.152 -9.773 -5.465 61 HA2 GLY 53 1HA GLY 53 1.119 -9.441 -5.417 62 HA3 GLY 53 2HA GLY 53 1.177 -10.196 -7.002 63 H ASP 54 H ASP 54 -0.483 -7.214 -6.040 64 HA ASP 54 HA ASP 54 1.355 -5.699 -7.757 65 HB2 ASP 54 1HB ASP 54 -1.188 -6.246 -8.515 66 HB3 ASP 54 2HB ASP 54 -1.449 -4.756 -7.611 67 H ARG 55 H ARG 55 1.997 -3.756 -7.004 68 HA ARG 55 HA ARG 55 1.755 -3.191 -4.245 69 HB2 ARG 55 1HB ARG 55 2.976 -1.830 -6.599 70 HB3 ARG 55 2HB ARG 55 2.686 -0.859 -5.162 71 HG2 ARG 55 1HG ARG 55 4.474 -1.695 -4.159 72 HG3 ARG 55 2HG ARG 55 3.923 -3.347 -4.440 73 HD2 ARG 55 1HD ARG 55 5.279 -1.689 -6.553 74 HD3 ARG 55 2HD ARG 55 6.162 -2.727 -5.437 75 HE ARG 55 HE ARG 55 4.083 -4.146 -6.768 76 HH11 ARG 55 1HH1 ARG 55 7.339 -2.930 -7.170 77 HH12 ARG 55 2HH1 ARG 55 7.749 -4.085 -8.391 78 HH21 ARG 55 1HH2 ARG 55 4.631 -5.673 -8.376 79 HH22 ARG 55 2HH2 ARG 55 6.217 -5.645 -9.073 80 H ILE 56 H ILE 56 0.114 -2.289 -3.199 81 HA ILE 56 HA ILE 56 -1.559 -0.319 -4.613 82 HB ILE 56 HB ILE 56 -3.563 -1.193 -3.520 83 HG12 ILE 56 1HG1 ILE 56 -3.047 -3.749 -2.726 84 HG13 ILE 56 2HG1 ILE 56 -1.585 -2.929 -2.187 85 HG21 ILE 56 1HG2 ILE 56 -3.348 -1.982 -5.692 86 HG22 ILE 56 2HG2 ILE 56 -3.607 -3.449 -4.749 87 HG23 ILE 56 3HG2 ILE 56 -1.983 -3.021 -5.285 88 HD11 ILE 56 3HD1 ILE 56 -2.854 -2.627 -0.346 89 HD12 ILE 56 1HD1 ILE 56 -4.370 -2.666 -1.248 90 HD13 ILE 56 2HD1 ILE 56 -3.376 -1.209 -1.251 91 H LEU 57 H LEU 57 -2.429 1.333 -3.362 92 HA LEU 57 HA LEU 57 -1.031 1.777 -0.837 93 HB2 LEU 57 1HB LEU 57 -1.353 3.452 -2.864 94 HB3 LEU 57 2HB LEU 57 -2.865 3.796 -2.042 95 HG LEU 57 HG LEU 57 -1.452 4.214 0.047 96 HD11 LEU 57 1HD1 LEU 57 0.866 4.804 -0.312 97 HD12 LEU 57 2HD1 LEU 57 0.728 4.399 -2.024 98 HD13 LEU 57 3HD1 LEU 57 0.586 3.133 -0.805 99 HD21 LEU 57 3HD2 LEU 57 -2.414 6.106 -0.872 100 HD22 LEU 57 1HD2 LEU 57 -1.529 5.949 -2.389 101 HD23 LEU 57 2HD2 LEU 57 -0.695 6.495 -0.934 102 H VAL 58 H VAL 58 -2.051 2.015 1.120 103 HA VAL 58 HA VAL 58 -4.976 1.875 1.179 104 HB VAL 58 HB VAL 58 -4.231 -0.446 1.306 105 HG11 VAL 58 1HG1 VAL 58 -2.503 -1.175 2.513 106 HG12 VAL 58 2HG1 VAL 58 -3.031 -0.303 3.952 107 HG13 VAL 58 3HG1 VAL 58 -2.081 0.525 2.719 108 HG21 VAL 58 3HG2 VAL 58 -6.220 -0.125 2.458 109 HG22 VAL 58 1HG2 VAL 58 -5.443 0.795 3.746 110 HG23 VAL 58 2HG2 VAL 58 -5.199 -0.948 3.639 111 H LYS 59 H LYS 59 -5.903 2.949 2.862 112 HA LYS 59 HA LYS 59 -4.066 4.277 4.741 113 HB2 LYS 59 1HB LYS 59 -5.795 5.998 4.997 114 HB3 LYS 59 2HB LYS 59 -5.296 5.827 3.322 115 HG2 LYS 59 1HG LYS 59 -7.497 5.828 2.912 116 HG3 LYS 59 2HG LYS 59 -7.407 4.134 3.390 117 HD2 LYS 59 1HD LYS 59 -8.934 4.622 4.943 118 HD3 LYS 59 2HD LYS 59 -7.651 5.483 5.793 119 HE2 LYS 59 1HE LYS 59 -9.527 6.685 3.757 120 HE3 LYS 59 2HE LYS 59 -9.665 6.864 5.504 121 HZ1 LYS 59 3HZ LYS 59 -7.789 8.116 3.649 122 HZ2 LYS 59 1HZ LYS 59 -7.194 7.718 5.183 123 HZ3 LYS 59 2HZ LYS 59 -8.527 8.749 5.034 124 H ALA 60 H ALA 60 -4.345 4.107 6.908 125 HA ALA 60 HA ALA 60 -6.353 2.169 7.823 126 HB1 ALA 60 3HB ALA 60 -3.676 2.267 8.304 127 HB2 ALA 60 1HB ALA 60 -4.850 1.431 9.321 128 HB3 ALA 60 2HB ALA 60 -4.319 3.059 9.743 129 HA PRO 61 HA PRO 61 -8.748 5.093 10.093 130 HB2 PRO 61 1HB PRO 61 -9.090 3.871 12.520 131 HB3 PRO 61 2HB PRO 61 -9.976 3.423 11.059 132 HG2 PRO 61 1HG PRO 61 -7.573 2.138 12.288 133 HG3 PRO 61 2HG PRO 61 -8.999 1.380 11.556 134 HD2 PRO 61 1HD PRO 61 -6.652 1.583 10.246 135 HD3 PRO 61 2HD PRO 61 -8.213 1.683 9.404 136 H GLY 62 H GLY 62 -7.765 6.957 10.603 137 HA2 GLY 62 1HA GLY 62 -6.935 8.479 12.182 138 HA3 GLY 62 2HA GLY 62 -6.378 7.131 13.157 139 H TYR 63 H TYR 63 -5.538 6.963 9.828 140 HA TYR 63 HA TYR 63 -3.024 8.369 10.142 141 HB2 TYR 63 1HB TYR 63 -3.214 5.371 9.999 142 HB3 TYR 63 2HB TYR 63 -1.800 6.209 9.371 143 HD1 TYR 63 HD2 TYR 63 -0.756 7.978 11.073 144 HD2 TYR 63 HD1 TYR 63 -3.151 4.645 12.195 145 HE1 TYR 63 HE2 TYR 63 0.212 8.049 13.331 146 HE2 TYR 63 HE1 TYR 63 -2.189 4.707 14.457 147 HH TYR 63 HH TYR 63 0.570 6.453 15.239 148 HA PRO 64 HA PRO 64 -3.443 8.905 5.781 149 HB2 PRO 64 1HB PRO 64 -0.870 9.000 4.926 150 HB3 PRO 64 2HB PRO 64 -1.607 10.291 5.881 151 HG2 PRO 64 1HG PRO 64 0.183 8.064 6.771 152 HG3 PRO 64 2HG PRO 64 0.220 9.777 7.225 153 HD2 PRO 64 1HD PRO 64 -0.875 7.862 8.803 154 HD3 PRO 64 2HD PRO 64 -1.471 9.532 8.768 155 H TRP 65 H TRP 65 -2.079 8.038 3.628 156 HA TRP 65 HA TRP 65 -2.757 5.226 3.551 157 HB2 TRP 65 1HB TRP 65 -1.644 6.977 1.348 158 HB3 TRP 65 2HB TRP 65 -2.354 5.380 1.154 159 HD1 TRP 65 HD1 TRP 65 -3.471 8.893 2.383 160 HE1 TRP 65 HE1 TRP 65 -5.930 9.218 1.704 161 HE3 TRP 65 HE3 TRP 65 -4.359 4.303 0.311 162 HZ2 TRP 65 HZ2 TRP 65 -7.977 7.728 0.453 163 HZ3 TRP 65 HZ3 TRP 65 -6.594 3.834 -0.605 164 HH2 TRP 65 HH2 TRP 65 -8.365 5.513 -0.533 165 H TRP 66 H TRP 66 -1.355 3.536 3.019 166 HA TRP 66 HA TRP 66 1.521 4.134 3.207 167 HB2 TRP 66 1HB TRP 66 0.214 3.056 5.282 168 HB3 TRP 66 2HB TRP 66 0.525 1.584 4.368 169 HD1 TRP 66 HD1 TRP 66 2.767 0.463 4.873 170 HE1 TRP 66 HE1 TRP 66 5.008 1.203 5.902 171 HE3 TRP 66 HE3 TRP 66 1.778 5.441 5.483 172 HZ2 TRP 66 HZ2 TRP 66 6.194 3.577 6.845 173 HZ3 TRP 66 HZ3 TRP 66 3.525 6.878 6.451 174 HH2 TRP 66 HH2 TRP 66 5.691 5.960 7.108 175 HA PRO 67 HA PRO 67 1.801 1.599 -0.421 176 HB2 PRO 67 1HB PRO 67 4.430 0.977 -0.366 177 HB3 PRO 67 2HB PRO 67 3.853 2.602 -0.757 178 HG2 PRO 67 1HG PRO 67 4.905 1.541 1.839 179 HG3 PRO 67 2HG PRO 67 5.271 3.075 1.031 180 HD2 PRO 67 1HD PRO 67 3.508 2.887 3.078 181 HD3 PRO 67 2HD PRO 67 3.330 4.074 1.771 182 H ALA 68 H ALA 68 0.721 -0.282 -0.203 183 HA ALA 68 HA ALA 68 2.052 -2.477 1.261 184 HB1 ALA 68 3HB ALA 68 -0.383 -1.410 1.876 185 HB2 ALA 68 1HB ALA 68 0.139 -3.045 2.279 186 HB3 ALA 68 2HB ALA 68 -0.834 -2.759 0.833 187 H LEU 69 H LEU 69 1.158 -4.682 0.405 188 HA LEU 69 HA LEU 69 0.966 -4.555 -2.531 189 HB2 LEU 69 1HB LEU 69 3.111 -5.592 -1.005 190 HB3 LEU 69 2HB LEU 69 2.284 -6.962 -1.718 191 HG LEU 69 HG LEU 69 2.663 -4.872 -3.679 192 HD11 LEU 69 1HD1 LEU 69 5.076 -4.951 -3.837 193 HD12 LEU 69 2HD1 LEU 69 5.160 -5.957 -2.390 194 HD13 LEU 69 3HD1 LEU 69 4.589 -4.293 -2.275 195 HD21 LEU 69 3HD2 LEU 69 2.166 -7.277 -4.085 196 HD22 LEU 69 1HD2 LEU 69 3.798 -7.659 -3.537 197 HD23 LEU 69 2HD2 LEU 69 3.560 -6.671 -4.978 198 H LEU 70 H LEU 70 -0.815 -5.475 -3.253 199 HA LEU 70 HA LEU 70 -2.599 -6.923 -1.629 200 HB2 LEU 70 1HB LEU 70 -2.774 -5.685 -4.046 201 HB3 LEU 70 2HB LEU 70 -2.797 -7.370 -4.534 202 HG LEU 70 HG LEU 70 -4.709 -6.097 -2.573 203 HD11 LEU 70 1HD1 LEU 70 -4.722 -5.714 -5.241 204 HD12 LEU 70 2HD1 LEU 70 -6.175 -5.756 -4.245 205 HD13 LEU 70 3HD1 LEU 70 -5.670 -7.196 -5.128 206 HD21 LEU 70 3HD2 LEU 70 -4.152 -8.882 -3.351 207 HD22 LEU 70 1HD2 LEU 70 -5.854 -8.421 -3.338 208 HD23 LEU 70 2HD2 LEU 70 -4.879 -8.235 -1.881 209 H LEU 71 H LEU 71 -2.496 -8.951 -0.950 210 HA LEU 71 HA LEU 71 -0.742 -10.835 -2.329 211 HB2 LEU 71 1HB LEU 71 -0.187 -10.928 -0.110 212 HB3 LEU 71 2HB LEU 71 -1.814 -10.575 0.430 213 HG LEU 71 HG LEU 71 -2.474 -12.898 -0.151 214 HD11 LEU 71 1HD1 LEU 71 -0.826 -13.376 -1.857 215 HD12 LEU 71 2HD1 LEU 71 -0.690 -14.548 -0.546 216 HD13 LEU 71 3HD1 LEU 71 0.476 -13.232 -0.677 217 HD21 LEU 71 3HD2 LEU 71 -0.110 -12.953 1.696 218 HD22 LEU 71 1HD2 LEU 71 -1.628 -13.842 1.815 219 HD23 LEU 71 2HD2 LEU 71 -1.595 -12.106 2.122 220 H ARG 72 H ARG 72 -4.049 -10.743 -0.967 221 HA ARG 72 HA ARG 72 -5.120 -12.129 -3.222 222 HB2 ARG 72 1HB ARG 72 -4.245 -13.677 -0.942 223 HB3 ARG 72 2HB ARG 72 -5.978 -13.851 -1.188 224 HG2 ARG 72 1HG ARG 72 -4.587 -14.055 -3.697 225 HG3 ARG 72 2HG ARG 72 -3.920 -15.189 -2.521 226 HD2 ARG 72 1HD ARG 72 -6.820 -14.923 -3.308 227 HD3 ARG 72 2HD ARG 72 -5.724 -16.220 -3.778 228 HE ARG 72 HE ARG 72 -5.968 -15.930 -0.935 229 HH11 ARG 72 1HH1 ARG 72 -7.408 -17.371 -3.780 230 HH12 ARG 72 2HH1 ARG 72 -8.197 -18.630 -2.894 231 HH21 ARG 72 1HH2 ARG 72 -7.017 -17.588 0.230 232 HH22 ARG 72 2HH2 ARG 72 -7.977 -18.753 -0.619 233 H ARG 73 H ARG 73 -7.442 -12.398 -3.121 234 HA ARG 73 HA ARG 73 -8.684 -10.518 -1.226 235 HB2 ARG 73 1HB ARG 73 -8.766 -10.131 -3.794 236 HB3 ARG 73 2HB ARG 73 -9.957 -11.425 -3.795 237 HG2 ARG 73 1HG ARG 73 -11.199 -10.052 -2.039 238 HG3 ARG 73 2HG ARG 73 -10.133 -8.725 -2.501 239 HD2 ARG 73 1HD ARG 73 -12.284 -8.663 -3.696 240 HD3 ARG 73 2HD ARG 73 -10.912 -8.845 -4.788 241 HE ARG 73 HE ARG 73 -12.125 -11.340 -4.024 242 HH11 ARG 73 1HH1 ARG 73 -12.274 -8.666 -6.279 243 HH12 ARG 73 2HH1 ARG 73 -13.043 -9.595 -7.519 244 HH21 ARG 73 1HH2 ARG 73 -13.141 -12.559 -5.668 245 HH22 ARG 73 2HH2 ARG 73 -13.535 -11.802 -7.174 246 H LYS 74 H LYS 74 -9.610 -11.566 0.407 247 HA LYS 74 HA LYS 74 -10.851 -14.180 -0.103 248 HB2 LYS 74 1HB LYS 74 -10.858 -14.204 2.509 249 HB3 LYS 74 2HB LYS 74 -9.371 -14.530 1.631 250 HG2 LYS 74 1HG LYS 74 -8.461 -12.450 2.149 251 HG3 LYS 74 2HG LYS 74 -10.033 -11.764 2.567 252 HD2 LYS 74 1HD LYS 74 -8.896 -14.047 4.140 253 HD3 LYS 74 2HD LYS 74 -8.388 -12.390 4.466 254 HE2 LYS 74 1HE LYS 74 -10.231 -12.021 5.647 255 HE3 LYS 74 2HE LYS 74 -11.235 -12.463 4.267 256 HZ1 LYS 74 3HZ LYS 74 -10.147 -14.298 6.334 257 HZ2 LYS 74 1HZ LYS 74 -10.967 -14.811 4.945 258 HZ3 LYS 74 2HZ LYS 74 -11.769 -13.875 6.102 259 H GLU 75 H GLU 75 -12.972 -14.514 0.134 260 HA GLU 75 HA GLU 75 -14.636 -12.228 0.942 261 HB2 GLU 75 1HB GLU 75 -14.760 -13.629 -1.358 262 HB3 GLU 75 2HB GLU 75 -15.866 -14.583 -0.378 263 HG2 GLU 75 1HG GLU 75 -16.691 -12.021 0.125 264 HG3 GLU 75 2HG GLU 75 -16.208 -11.947 -1.569 265 H THR 76 H THR 76 -15.088 -12.377 3.072 266 HA THR 76 HA THR 76 -15.916 -14.998 4.130 267 HB THR 76 HB THR 76 -13.926 -14.050 5.213 268 HG1 THR 76 HG1 THR 76 -16.171 -13.960 6.944 269 HG21 THR 76 3HG2 THR 76 -14.915 -12.057 6.871 270 HG22 THR 76 1HG2 THR 76 -15.466 -11.622 5.254 271 HG23 THR 76 2HG2 THR 76 -13.751 -11.876 5.560 272 H LYS 77 H LYS 77 -17.915 -15.269 4.944 273 HA LYS 77 HA LYS 77 -19.810 -13.091 4.648 274 HB2 LYS 77 1HB LYS 77 -20.032 -15.720 4.124 275 HB3 LYS 77 2HB LYS 77 -20.682 -15.699 5.758 276 HG2 LYS 77 1HG LYS 77 -22.504 -14.429 5.164 277 HG3 LYS 77 2HG LYS 77 -21.695 -13.734 3.758 278 HD2 LYS 77 1HD LYS 77 -21.857 -15.842 2.580 279 HD3 LYS 77 2HD LYS 77 -22.560 -16.614 4.003 280 HE2 LYS 77 1HE LYS 77 -24.371 -14.784 3.816 281 HE3 LYS 77 2HE LYS 77 -23.764 -14.565 2.176 282 HZ1 LYS 77 3HZ LYS 77 -25.692 -16.163 2.512 283 HZ2 LYS 77 1HZ LYS 77 -24.563 -17.228 3.185 284 HZ3 LYS 77 2HZ LYS 77 -24.394 -16.716 1.582 285 H ASP 78 H ASP 78 -21.514 -12.797 6.375 286 HA ASP 78 HA ASP 78 -20.604 -13.320 9.086 287 HB2 ASP 78 1HB ASP 78 -19.795 -10.980 7.974 288 HB3 ASP 78 2HB ASP 78 -21.338 -10.489 8.666 289 H SER 79 H SER 79 -22.792 -14.449 7.918 290 HA SER 79 HA SER 79 -24.892 -13.532 9.638 291 HB2 SER 79 1HB SER 79 -26.108 -13.657 7.013 292 HB3 SER 79 2HB SER 79 -26.198 -12.381 8.225 293 HG SER 79 HG SER 79 -24.431 -11.421 7.356 294 H LEU 80 H LEU 80 -24.906 -15.311 6.534 295 HA LEU 80 HA LEU 80 -25.644 -17.394 5.987 296 HB2 LEU 80 1HB LEU 80 -23.711 -17.649 8.036 297 HB3 LEU 80 2HB LEU 80 -24.972 -18.812 8.395 298 HG LEU 80 HG LEU 80 -23.304 -19.925 7.105 299 HD11 LEU 80 1HD1 LEU 80 -24.635 -20.934 5.557 300 HD12 LEU 80 2HD1 LEU 80 -25.299 -19.413 4.964 301 HD13 LEU 80 3HD1 LEU 80 -25.864 -20.085 6.493 302 HD21 LEU 80 3HD2 LEU 80 -23.577 -18.243 4.699 303 HD22 LEU 80 1HD2 LEU 80 -22.166 -19.070 5.356 304 HD23 LEU 80 2HD2 LEU 80 -22.685 -17.532 6.045 305 H ASN 81 H ASN 81 -27.571 -15.687 7.275 306 HA ASN 81 HA ASN 81 -29.542 -17.666 7.935 307 HB2 ASN 81 1HB ASN 81 -28.097 -16.686 10.089 308 HB3 ASN 81 2HB ASN 81 -29.552 -15.693 10.089 309 HD21 ASN 81 2HD2 ASN 81 -28.256 -18.395 11.339 310 HD22 ASN 81 1HD2 ASN 81 -29.698 -19.317 11.635 311 H THR 82 H THR 82 -28.894 -14.173 8.333 312 HA THR 82 HA THR 82 -31.499 -13.274 7.936 313 HB THR 82 HB THR 82 -29.819 -11.795 8.824 314 HG1 THR 82 HG1 THR 82 -30.329 -9.988 7.669 315 HG21 THR 82 3HG2 THR 82 -28.490 -11.339 6.216 316 HG22 THR 82 1HG2 THR 82 -28.004 -12.746 7.164 317 HG23 THR 82 2HG2 THR 82 -27.880 -11.132 7.857 318 H ASN 83 H ASN 83 -28.897 -13.628 5.521 319 HA ASN 83 HA ASN 83 -30.580 -14.477 3.464 320 HB2 ASN 83 1HB ASN 83 -30.587 -11.620 3.832 321 HB3 ASN 83 2HB ASN 83 -29.867 -12.015 2.274 322 HD21 ASN 83 2HD2 ASN 83 -32.533 -10.868 3.235 323 HD22 ASN 83 1HD2 ASN 83 -33.709 -11.779 2.338 324 H SER 84 H SER 84 -28.014 -12.044 3.181 325 HA SER 84 HA SER 84 -25.893 -13.866 2.830 326 HB2 SER 84 1HB SER 84 -25.648 -13.188 0.271 327 HB3 SER 84 2HB SER 84 -26.590 -14.598 0.758 328 HG SER 84 HG SER 84 -28.099 -13.624 -0.351 329 H SER 85 H SER 85 -24.862 -12.368 4.166 330 HA SER 85 HA SER 85 -24.203 -9.802 2.878 331 HB2 SER 85 1HB SER 85 -25.492 -9.819 5.134 332 HB3 SER 85 2HB SER 85 -23.940 -10.274 5.838 333 HG SER 85 HG SER 85 -23.570 -8.207 5.818 334 H PHE 86 H PHE 86 -22.390 -10.412 1.782 335 HA PHE 86 HA PHE 86 -20.280 -11.860 3.160 336 HB2 PHE 86 1HB PHE 86 -20.120 -10.740 0.367 337 HB3 PHE 86 2HB PHE 86 -19.208 -12.075 1.058 338 HD1 PHE 86 HD2 PHE 86 -20.301 -14.261 1.421 339 HD2 PHE 86 HD1 PHE 86 -22.276 -11.064 -0.578 340 HE1 PHE 86 HE2 PHE 86 -21.941 -15.850 0.504 341 HE2 PHE 86 HE1 PHE 86 -23.918 -12.647 -1.496 342 HZ PHE 86 HZ PHE 86 -23.752 -15.044 -0.956 343 H ASN 87 H ASN 87 -18.157 -11.076 3.408 344 HA ASN 87 HA ASN 87 -17.815 -8.169 3.176 345 HB2 ASN 87 1HB ASN 87 -17.192 -9.883 5.592 346 HB3 ASN 87 2HB ASN 87 -16.578 -8.247 5.374 347 HD21 ASN 87 2HD2 ASN 87 -18.344 -6.609 4.845 348 HD22 ASN 87 1HD2 ASN 87 -19.788 -6.720 5.801 349 H VAL 88 H VAL 88 -16.654 -8.715 1.271 350 HA VAL 88 HA VAL 88 -14.229 -10.280 1.511 351 HB VAL 88 HB VAL 88 -15.461 -10.498 -0.545 352 HG11 VAL 88 1HG1 VAL 88 -15.776 -7.679 -0.319 353 HG12 VAL 88 2HG1 VAL 88 -16.556 -8.792 -1.441 354 HG13 VAL 88 3HG1 VAL 88 -15.019 -8.040 -1.870 355 HG21 VAL 88 3HG2 VAL 88 -13.065 -10.739 -0.731 356 HG22 VAL 88 1HG2 VAL 88 -12.878 -9.000 -0.961 357 HG23 VAL 88 2HG2 VAL 88 -13.697 -9.970 -2.187 358 H LEU 89 H LEU 89 -12.175 -9.534 1.568 359 HA LEU 89 HA LEU 89 -11.767 -6.623 1.482 360 HB2 LEU 89 1HB LEU 89 -10.244 -8.335 3.413 361 HB3 LEU 89 2HB LEU 89 -10.468 -6.596 3.419 362 HG LEU 89 HG LEU 89 -12.847 -8.355 3.846 363 HD11 LEU 89 1HD1 LEU 89 -11.160 -7.507 6.163 364 HD12 LEU 89 2HD1 LEU 89 -10.822 -9.024 5.329 365 HD13 LEU 89 3HD1 LEU 89 -12.397 -8.761 6.075 366 HD21 LEU 89 3HD2 LEU 89 -13.817 -6.473 4.620 367 HD22 LEU 89 1HD2 LEU 89 -12.564 -5.686 3.662 368 HD23 LEU 89 2HD2 LEU 89 -12.342 -5.901 5.398 369 H TYR 90 H TYR 90 -9.264 -6.202 1.577 370 HA TYR 90 HA TYR 90 -8.019 -7.957 -0.434 371 HB2 TYR 90 1HB TYR 90 -8.188 -5.018 -0.146 372 HB3 TYR 90 2HB TYR 90 -6.620 -5.644 -0.643 373 HD1 TYR 90 HD1 TYR 90 -7.511 -7.984 -2.264 374 HD2 TYR 90 HD2 TYR 90 -8.957 -3.988 -2.115 375 HE1 TYR 90 HE1 TYR 90 -8.318 -8.201 -4.566 376 HE2 TYR 90 HE2 TYR 90 -9.771 -4.190 -4.421 377 HH TYR 90 HH TYR 90 -10.167 -7.053 -5.996 378 H LYS 91 H LYS 91 -6.738 -9.307 0.739 379 HA LYS 91 HA LYS 91 -5.316 -8.527 3.079 380 HB2 LYS 91 1HB LYS 91 -5.308 -10.928 1.289 381 HB3 LYS 91 2HB LYS 91 -3.993 -10.723 2.435 382 HG2 LYS 91 1HG LYS 91 -6.262 -10.291 3.956 383 HG3 LYS 91 2HG LYS 91 -6.717 -11.603 2.867 384 HD2 LYS 91 1HD LYS 91 -4.134 -12.232 3.718 385 HD3 LYS 91 2HD LYS 91 -4.956 -11.640 5.160 386 HE2 LYS 91 1HE LYS 91 -6.696 -13.386 3.690 387 HE3 LYS 91 2HE LYS 91 -5.152 -14.184 3.983 388 HZ1 LYS 91 3HZ LYS 91 -6.728 -12.853 6.115 389 HZ2 LYS 91 1HZ LYS 91 -5.386 -13.865 6.306 390 HZ3 LYS 91 2HZ LYS 91 -6.852 -14.501 5.756 391 H VAL 92 H VAL 92 -3.945 -6.820 2.778 392 HA VAL 92 HA VAL 92 -1.928 -7.076 0.648 393 HB VAL 92 HB VAL 92 -1.651 -4.696 0.678 394 HG11 VAL 92 1HG1 VAL 92 -4.323 -4.158 0.500 395 HG12 VAL 92 2HG1 VAL 92 -4.284 -5.906 0.283 396 HG13 VAL 92 3HG1 VAL 92 -3.340 -4.866 -0.780 397 HG21 VAL 92 3HG2 VAL 92 -3.538 -4.716 3.031 398 HG22 VAL 92 1HG2 VAL 92 -3.084 -3.262 2.145 399 HG23 VAL 92 2HG2 VAL 92 -1.855 -4.187 3.009 400 H LEU 93 H LEU 93 0.241 -6.614 1.066 401 HA LEU 93 HA LEU 93 1.030 -7.029 3.859 402 HB2 LEU 93 1HB LEU 93 1.829 -8.399 1.716 403 HB3 LEU 93 2HB LEU 93 3.007 -7.105 1.633 404 HG LEU 93 HG LEU 93 3.703 -7.651 3.965 405 HD11 LEU 93 1HD1 LEU 93 3.010 -9.771 4.943 406 HD12 LEU 93 2HD1 LEU 93 1.911 -10.049 3.592 407 HD13 LEU 93 3HD1 LEU 93 1.622 -8.710 4.702 408 HD21 LEU 93 3HD2 LEU 93 4.565 -10.050 3.213 409 HD22 LEU 93 1HD2 LEU 93 5.204 -8.561 2.521 410 HD23 LEU 93 2HD2 LEU 93 3.979 -9.482 1.651 411 H PHE 94 H PHE 94 2.136 -5.546 4.976 412 HA PHE 94 HA PHE 94 2.535 -2.930 3.729 413 HB2 PHE 94 1HB PHE 94 2.104 -3.944 6.482 414 HB3 PHE 94 2HB PHE 94 3.135 -2.528 6.335 415 HD1 PHE 94 HD2 PHE 94 -0.100 -3.704 4.841 416 HD2 PHE 94 HD1 PHE 94 2.076 -0.546 6.696 417 HE1 PHE 94 HE2 PHE 94 -2.089 -2.265 4.726 418 HE2 PHE 94 HE1 PHE 94 0.086 0.893 6.585 419 HZ PHE 94 HZ PHE 94 -1.999 0.035 5.600 420 H PHE 95 H PHE 95 4.507 -1.686 4.293 421 HA PHE 95 HA PHE 95 6.883 -3.274 4.911 422 HB2 PHE 95 1HB PHE 95 6.806 -1.515 2.455 423 HB3 PHE 95 2HB PHE 95 8.091 -2.608 2.950 424 HD1 PHE 95 HD1 PHE 95 4.681 -2.417 1.569 425 HD2 PHE 95 HD2 PHE 95 8.028 -4.916 2.392 426 HE1 PHE 95 HE1 PHE 95 3.698 -4.186 0.177 427 HE2 PHE 95 HE2 PHE 95 7.049 -6.690 0.998 428 HZ PHE 95 HZ PHE 95 4.881 -6.327 -0.112 429 HA PRO 96 HA PRO 96 9.206 -2.657 4.500 430 HB2 PRO 96 1HB PRO 96 10.905 -1.955 6.734 431 HB3 PRO 96 2HB PRO 96 11.230 -1.793 5.004 432 HG2 PRO 96 1HG PRO 96 10.885 0.334 6.670 433 HG3 PRO 96 2HG PRO 96 10.487 0.372 4.944 434 HD2 PRO 96 1HD PRO 96 8.669 0.001 7.299 435 HD3 PRO 96 2HD PRO 96 8.429 0.979 5.833 436 H ASP 97 H ASP 97 7.914 -2.031 7.673 437 HA ASP 97 HA ASP 97 8.747 -4.009 9.298 438 HB2 ASP 97 1HB ASP 97 6.118 -2.670 8.937 439 HB3 ASP 97 2HB ASP 97 6.149 -4.100 9.961 440 H PHE 98 H PHE 98 6.756 -4.498 6.463 441 HA PHE 98 HA PHE 98 6.203 -6.388 5.330 442 HB2 PHE 98 1HB PHE 98 8.269 -7.343 7.132 443 HB3 PHE 98 2HB PHE 98 7.050 -8.578 6.844 444 HD1 PHE 98 HD1 PHE 98 6.405 -8.975 4.356 445 HD2 PHE 98 HD2 PHE 98 9.990 -7.065 5.624 446 HE1 PHE 98 HE1 PHE 98 7.443 -9.493 2.187 447 HE2 PHE 98 HE2 PHE 98 11.035 -7.581 3.456 448 HZ PHE 98 HZ PHE 98 9.760 -8.797 1.735 449 H ASN 99 H ASN 99 4.614 -5.172 7.488 450 HA ASN 99 HA ASN 99 3.176 -7.336 8.745 451 HB2 ASN 99 1HB ASN 99 3.526 -4.655 9.326 452 HB3 ASN 99 2HB ASN 99 1.872 -4.706 8.726 453 HD21 ASN 99 2HD2 ASN 99 0.716 -4.484 10.545 454 HD22 ASN 99 1HD2 ASN 99 0.817 -5.545 11.915 455 H PHE 100 H PHE 100 0.501 -6.259 8.453 456 HA PHE 100 HA PHE 100 -0.109 -6.153 5.650 457 HB2 PHE 100 1HB PHE 100 -1.723 -8.271 6.136 458 HB3 PHE 100 2HB PHE 100 -0.143 -8.401 5.374 459 HD1 PHE 100 HD1 PHE 100 1.762 -9.257 6.599 460 HD2 PHE 100 HD2 PHE 100 -2.091 -9.017 8.385 461 HE1 PHE 100 HE1 PHE 100 2.509 -10.754 8.399 462 HE2 PHE 100 HE2 PHE 100 -1.354 -10.507 10.188 463 HZ PHE 100 HZ PHE 100 0.952 -11.382 10.199 464 H ALA 101 H ALA 101 -2.617 -6.431 5.375 465 HA ALA 101 HA ALA 101 -4.255 -5.710 7.599 466 HB1 ALA 101 3HB ALA 101 -3.870 -3.513 7.607 467 HB2 ALA 101 1HB ALA 101 -4.716 -3.450 6.061 468 HB3 ALA 101 2HB ALA 101 -2.958 -3.594 6.099 469 H TRP 102 H TRP 102 -6.501 -5.503 7.038 470 HA TRP 102 HA TRP 102 -7.145 -6.528 4.346 471 HB2 TRP 102 1HB TRP 102 -8.829 -6.974 6.811 472 HB3 TRP 102 2HB TRP 102 -8.945 -7.793 5.259 473 HD1 TRP 102 HD1 TRP 102 -5.667 -8.340 5.157 474 HE1 TRP 102 HE1 TRP 102 -4.767 -10.286 6.575 475 HE3 TRP 102 HE3 TRP 102 -9.560 -8.826 8.437 476 HZ2 TRP 102 HZ2 TRP 102 -5.598 -11.830 8.788 477 HZ3 TRP 102 HZ3 TRP 102 -9.427 -10.564 10.174 478 HH2 TRP 102 HH2 TRP 102 -7.486 -12.035 10.343 479 H VAL 103 H VAL 103 -8.104 -5.048 3.123 480 HA VAL 103 HA VAL 103 -9.929 -3.110 4.400 481 HB VAL 103 HB VAL 103 -8.264 -2.640 1.927 482 HG11 VAL 103 1HG1 VAL 103 -10.233 -1.300 1.858 483 HG12 VAL 103 2HG1 VAL 103 -8.898 -0.258 2.346 484 HG13 VAL 103 3HG1 VAL 103 -10.047 -0.839 3.550 485 HG21 VAL 103 3HG2 VAL 103 -7.549 -2.507 4.704 486 HG22 VAL 103 1HG2 VAL 103 -7.475 -0.901 3.976 487 HG23 VAL 103 2HG2 VAL 103 -6.551 -2.231 3.276 488 H LYS 104 H LYS 104 -11.804 -2.486 3.217 489 HA LYS 104 HA LYS 104 -12.814 -4.600 1.503 490 HB2 LYS 104 1HB LYS 104 -14.147 -2.115 2.597 491 HB3 LYS 104 2HB LYS 104 -14.964 -3.351 1.652 492 HG2 LYS 104 1HG LYS 104 -14.682 -4.968 3.358 493 HG3 LYS 104 2HG LYS 104 -13.571 -3.929 4.251 494 HD2 LYS 104 1HD LYS 104 -15.304 -2.437 4.857 495 HD3 LYS 104 2HD LYS 104 -16.424 -3.152 3.695 496 HE2 LYS 104 1HE LYS 104 -16.781 -5.035 5.000 497 HE3 LYS 104 2HE LYS 104 -15.272 -4.827 5.890 498 HZ1 LYS 104 3HZ LYS 104 -17.318 -4.296 7.170 499 HZ2 LYS 104 1HZ LYS 104 -17.586 -2.984 6.134 500 HZ3 LYS 104 2HZ LYS 104 -16.201 -3.029 7.105 501 H ARG 105 H ARG 105 -10.722 -2.838 0.399 502 HA ARG 105 HA ARG 105 -10.208 -2.027 -1.661 503 HB2 ARG 105 1HB ARG 105 -13.132 -2.164 -2.373 504 HB3 ARG 105 2HB ARG 105 -11.764 -2.083 -3.472 505 HG2 ARG 105 1HG ARG 105 -11.662 -4.290 -3.545 506 HG3 ARG 105 2HG ARG 105 -11.437 -4.361 -1.797 507 HD2 ARG 105 1HD ARG 105 -13.397 -5.659 -2.649 508 HD3 ARG 105 2HD ARG 105 -13.790 -4.455 -1.422 509 HE ARG 105 HE ARG 105 -14.140 -3.226 -3.881 510 HH11 ARG 105 1HH1 ARG 105 -15.509 -5.940 -2.153 511 HH12 ARG 105 2HH1 ARG 105 -17.067 -5.783 -2.887 512 HH21 ARG 105 1HH2 ARG 105 -16.204 -3.013 -4.843 513 HH22 ARG 105 2HH2 ARG 105 -17.463 -4.122 -4.413 514 H ASN 106 H ASN 106 -12.733 -0.569 0.237 515 HA ASN 106 HA ASN 106 -12.915 1.870 -1.203 516 HB2 ASN 106 1HB ASN 106 -13.639 1.183 1.651 517 HB3 ASN 106 2HB ASN 106 -13.994 2.730 0.892 518 HD21 ASN 106 2HD2 ASN 106 -15.943 1.014 1.955 519 HD22 ASN 106 1HD2 ASN 106 -16.940 0.453 0.649 520 H SER 107 H SER 107 -10.979 0.838 1.586 521 HA SER 107 HA SER 107 -9.710 3.459 1.720 522 HB2 SER 107 1HB SER 107 -8.630 1.323 3.435 523 HB3 SER 107 2HB SER 107 -9.153 2.952 3.854 524 HG SER 107 HG SER 107 -10.427 1.045 4.649 525 H VAL 108 H VAL 108 -9.320 1.397 -0.531 526 HA VAL 108 HA VAL 108 -6.374 1.358 -0.424 527 HB VAL 108 HB VAL 108 -8.171 -0.634 -1.806 528 HG11 VAL 108 1HG1 VAL 108 -6.057 -1.879 -2.211 529 HG12 VAL 108 2HG1 VAL 108 -5.167 -0.473 -1.628 530 HG13 VAL 108 3HG1 VAL 108 -6.157 -0.349 -3.083 531 HG21 VAL 108 3HG2 VAL 108 -7.919 -2.065 -0.073 532 HG22 VAL 108 1HG2 VAL 108 -7.707 -0.568 0.837 533 HG23 VAL 108 2HG2 VAL 108 -6.297 -1.488 0.310 534 H LYS 109 H LYS 109 -5.251 1.745 -2.387 535 HA LYS 109 HA LYS 109 -6.785 2.670 -4.694 536 HB2 LYS 109 1HB LYS 109 -6.445 4.668 -3.281 537 HB3 LYS 109 2HB LYS 109 -4.711 4.386 -3.313 538 HG2 LYS 109 1HG LYS 109 -4.628 4.810 -5.676 539 HG3 LYS 109 2HG LYS 109 -6.388 4.927 -5.754 540 HD2 LYS 109 1HD LYS 109 -6.427 7.013 -4.856 541 HD3 LYS 109 2HD LYS 109 -5.013 6.721 -3.841 542 HE2 LYS 109 1HE LYS 109 -3.555 7.392 -5.444 543 HE3 LYS 109 2HE LYS 109 -4.550 6.773 -6.761 544 HZ1 LYS 109 3HZ LYS 109 -5.683 8.707 -6.935 545 HZ2 LYS 109 1HZ LYS 109 -4.258 9.349 -6.288 546 HZ3 LYS 109 2HZ LYS 109 -5.591 9.066 -5.286 547 HA PRO 110 HA PRO 110 -3.672 0.400 -6.907 548 HB2 PRO 110 1HB PRO 110 -4.038 2.516 -8.971 549 HB3 PRO 110 2HB PRO 110 -4.123 0.758 -9.132 550 HG2 PRO 110 1HG PRO 110 -6.341 2.230 -9.123 551 HG3 PRO 110 2HG PRO 110 -6.288 0.654 -8.312 552 HD2 PRO 110 1HD PRO 110 -6.212 3.395 -7.135 553 HD3 PRO 110 2HD PRO 110 -6.979 1.920 -6.516 554 H LEU 111 H LEU 111 -1.523 0.464 -6.779 555 HA LEU 111 HA LEU 111 -0.169 3.086 -6.800 556 HB2 LEU 111 1HB LEU 111 -0.261 1.197 -4.736 557 HB3 LEU 111 2HB LEU 111 1.322 0.991 -5.458 558 HG LEU 111 HG LEU 111 0.187 3.481 -4.194 559 HD11 LEU 111 1HD1 LEU 111 2.497 1.660 -3.553 560 HD12 LEU 111 2HD1 LEU 111 1.055 1.963 -2.583 561 HD13 LEU 111 3HD1 LEU 111 2.254 3.237 -2.801 562 HD21 LEU 111 3HD2 LEU 111 1.358 4.564 -5.793 563 HD22 LEU 111 1HD2 LEU 111 2.364 3.162 -6.163 564 HD23 LEU 111 2HD2 LEU 111 2.724 4.160 -4.754 565 H LEU 112 H LEU 112 1.435 3.337 -8.271 566 HA LEU 112 HA LEU 112 2.414 0.913 -9.638 567 HB2 LEU 112 1HB LEU 112 2.194 3.657 -10.854 568 HB3 LEU 112 2HB LEU 112 2.594 2.159 -11.671 569 HG LEU 112 HG LEU 112 -0.087 2.914 -10.513 570 HD11 LEU 112 1HD1 LEU 112 1.130 2.923 -13.207 571 HD12 LEU 112 2HD1 LEU 112 -0.073 4.001 -12.498 572 HD13 LEU 112 3HD1 LEU 112 -0.551 2.405 -13.078 573 HD21 LEU 112 3HD2 LEU 112 -0.211 0.666 -10.203 574 HD22 LEU 112 1HD2 LEU 112 1.036 0.319 -11.399 575 HD23 LEU 112 2HD2 LEU 112 -0.602 0.705 -11.921 576 H ASP 113 H ASP 113 4.516 1.485 -10.899 577 HA ASP 113 HA ASP 113 6.501 2.066 -8.970 578 HB2 ASP 113 1HB ASP 113 6.440 1.101 -11.670 579 HB3 ASP 113 2HB ASP 113 7.639 2.386 -11.547 580 H SER 114 H SER 114 4.957 3.977 -11.481 581 HA SER 114 HA SER 114 6.700 6.215 -11.313 582 HB2 SER 114 1HB SER 114 3.832 6.522 -12.127 583 HB3 SER 114 2HB SER 114 5.276 7.260 -12.819 584 HG SER 114 HG SER 114 4.157 5.449 -13.998 585 H GLU 115 H GLU 115 3.835 5.208 -9.549 586 HA GLU 115 HA GLU 115 3.471 7.748 -8.240 587 HB2 GLU 115 1HB GLU 115 2.281 5.039 -7.624 588 HB3 GLU 115 2HB GLU 115 1.793 6.551 -6.877 589 HG2 GLU 115 1HG GLU 115 1.572 7.095 -9.562 590 HG3 GLU 115 2HG GLU 115 1.058 5.412 -9.449 591 H ILE 116 H ILE 116 5.140 4.747 -7.538 592 HA ILE 116 HA ILE 116 5.646 5.447 -4.783 593 HB ILE 116 HB ILE 116 6.907 3.253 -6.444 594 HG12 ILE 116 1HG1 ILE 116 4.787 2.797 -4.373 595 HG13 ILE 116 2HG1 ILE 116 4.320 3.292 -5.996 596 HG21 ILE 116 1HG2 ILE 116 8.071 4.071 -4.308 597 HG22 ILE 116 2HG2 ILE 116 7.771 2.343 -4.476 598 HG23 ILE 116 3HG2 ILE 116 6.723 3.323 -3.452 599 HD11 ILE 116 3HD1 ILE 116 4.937 1.311 -6.926 600 HD12 ILE 116 1HD1 ILE 116 4.485 0.761 -5.312 601 HD13 ILE 116 2HD1 ILE 116 6.184 1.003 -5.718 602 H ALA 117 H ALA 117 7.382 5.453 -7.840 603 HA ALA 117 HA ALA 117 9.952 6.118 -6.969 604 HB1 ALA 117 3HB ALA 117 8.526 6.946 -9.496 605 HB2 ALA 117 1HB ALA 117 9.429 5.446 -9.261 606 HB3 ALA 117 2HB ALA 117 10.274 6.995 -9.238 607 H LYS 118 H LYS 118 7.436 8.269 -8.240 608 HA LYS 118 HA LYS 118 8.709 10.688 -7.666 609 HB2 LYS 118 1HB LYS 118 6.948 11.484 -8.788 610 HB3 LYS 118 2HB LYS 118 6.330 9.842 -8.846 611 HG2 LYS 118 1HG LYS 118 5.755 11.492 -6.445 612 HG3 LYS 118 2HG LYS 118 4.859 11.793 -7.937 613 HD2 LYS 118 1HD LYS 118 4.917 9.011 -7.650 614 HD3 LYS 118 2HD LYS 118 4.576 9.647 -6.036 615 HE2 LYS 118 1HE LYS 118 2.464 9.402 -6.997 616 HE3 LYS 118 2HE LYS 118 2.823 11.118 -7.185 617 HZ1 LYS 118 3HZ LYS 118 2.474 10.874 -9.346 618 HZ2 LYS 118 1HZ LYS 118 2.255 9.205 -9.177 619 HZ3 LYS 118 2HZ LYS 118 3.803 9.832 -9.447 620 H PHE 119 H PHE 119 6.432 8.753 -5.759 621 HA PHE 119 HA PHE 119 5.872 10.502 -3.695 622 HB2 PHE 119 1HB PHE 119 4.809 8.336 -3.739 623 HB3 PHE 119 2HB PHE 119 6.359 7.520 -3.539 624 HD1 PHE 119 HD1 PHE 119 7.586 7.738 -1.373 625 HD2 PHE 119 HD2 PHE 119 3.577 9.085 -1.871 626 HE1 PHE 119 HE1 PHE 119 7.287 7.738 1.070 627 HE2 PHE 119 HE2 PHE 119 3.277 9.094 0.572 628 HZ PHE 119 HZ PHE 119 5.139 8.421 2.037 629 H LEU 120 H LEU 120 8.568 8.170 -3.724 630 HA LEU 120 HA LEU 120 9.756 9.087 -1.357 631 HB2 LEU 120 1HB LEU 120 11.011 7.708 -3.724 632 HB3 LEU 120 2HB LEU 120 11.781 7.931 -2.164 633 HG LEU 120 HG LEU 120 9.135 6.602 -2.132 634 HD11 LEU 120 1HD1 LEU 120 10.116 5.552 -4.089 635 HD12 LEU 120 2HD1 LEU 120 10.118 4.425 -2.731 636 HD13 LEU 120 3HD1 LEU 120 11.609 5.241 -3.203 637 HD21 LEU 120 3HD2 LEU 120 10.192 6.821 -0.052 638 HD22 LEU 120 1HD2 LEU 120 11.759 6.331 -0.695 639 HD23 LEU 120 2HD2 LEU 120 10.467 5.144 -0.520 640 H GLY 121 H GLY 121 9.913 10.283 -4.634 641 HA2 GLY 121 1HA GLY 121 12.160 12.049 -4.006 642 HA3 GLY 121 2HA GLY 121 11.411 11.839 -5.580 643 H SER 122 H SER 122 9.217 12.240 -2.968 644 HA SER 122 HA SER 122 8.333 14.766 -4.044 645 HB2 SER 122 1HB SER 122 7.352 12.958 -1.846 646 HB3 SER 122 2HB SER 122 6.678 14.571 -2.061 647 HG SER 122 HG SER 122 5.606 12.764 -3.195 648 H SER 123 H SER 123 9.578 16.494 -3.594 649 HA SER 123 HA SER 123 10.884 16.761 -1.023 650 HB2 SER 123 1HB SER 123 11.634 17.540 -3.490 651 HB3 SER 123 2HB SER 123 10.893 19.039 -2.928 652 HG SER 123 HG SER 123 13.276 18.419 -2.444 653 H LYS 124 H LYS 124 8.226 16.671 -0.528 654 HA LYS 124 HA LYS 124 7.616 19.439 0.268 655 HB2 LYS 124 1HB LYS 124 5.184 18.861 -0.029 656 HB3 LYS 124 2HB LYS 124 6.105 18.979 -1.523 657 HG2 LYS 124 1HG LYS 124 6.300 16.302 -0.786 658 HG3 LYS 124 2HG LYS 124 4.629 16.749 -0.439 659 HD2 LYS 124 1HD LYS 124 5.664 17.733 -3.008 660 HD3 LYS 124 2HD LYS 124 5.561 15.975 -2.877 661 HE2 LYS 124 1HE LYS 124 3.177 16.424 -1.971 662 HE3 LYS 124 2HE LYS 124 3.374 18.018 -2.700 663 HZ1 LYS 124 3HZ LYS 124 2.502 16.942 -4.466 664 HZ2 LYS 124 1HZ LYS 124 3.048 15.420 -3.972 665 HZ3 LYS 124 2HZ LYS 124 4.110 16.493 -4.731 666 H ARG 125 H ARG 125 6.713 16.036 0.840 667 HA ARG 125 HA ARG 125 6.906 16.511 3.715 668 HB2 ARG 125 1HB ARG 125 4.496 16.622 2.997 669 HB3 ARG 125 2HB ARG 125 4.641 14.962 2.437 670 HG2 ARG 125 1HG ARG 125 4.092 14.266 4.461 671 HG3 ARG 125 2HG ARG 125 5.571 14.991 5.094 672 HD2 ARG 125 1HD ARG 125 4.490 16.794 5.933 673 HD3 ARG 125 2HD ARG 125 3.318 16.839 4.618 674 HE ARG 125 HE ARG 125 2.643 14.612 6.033 675 HH11 ARG 125 1HH1 ARG 125 3.068 17.989 6.865 676 HH12 ARG 125 2HH1 ARG 125 1.910 17.944 8.150 677 HH21 ARG 125 1HH2 ARG 125 1.115 14.564 7.729 678 HH22 ARG 125 2HH2 ARG 125 0.803 16.003 8.640 679 H LYS 126 H LYS 126 8.690 15.330 4.038 680 HA LYS 126 HA LYS 126 8.629 12.504 3.214 681 HB2 LYS 126 1HB LYS 126 10.402 14.325 2.255 682 HB3 LYS 126 2HB LYS 126 11.279 13.728 3.657 683 HG2 LYS 126 1HG LYS 126 12.005 12.128 2.286 684 HG3 LYS 126 2HG LYS 126 10.411 11.410 2.511 685 HD2 LYS 126 1HD LYS 126 10.833 11.489 0.166 686 HD3 LYS 126 2HD LYS 126 9.630 12.726 0.529 687 HE2 LYS 126 1HE LYS 126 11.348 13.527 -1.038 688 HE3 LYS 126 2HE LYS 126 11.329 14.450 0.463 689 HZ1 LYS 126 3HZ LYS 126 13.268 13.334 1.215 690 HZ2 LYS 126 1HZ LYS 126 13.581 13.828 -0.373 691 HZ3 LYS 126 2HZ LYS 126 13.210 12.210 -0.049 692 H SER 127 H SER 127 9.327 10.975 4.666 693 HA SER 127 HA SER 127 10.333 11.818 7.272 694 HB2 SER 127 1HB SER 127 7.624 10.753 6.776 695 HB3 SER 127 2HB SER 127 8.502 9.958 8.080 696 HG SER 127 HG SER 127 7.480 12.516 7.932 697 H LYS 128 H LYS 128 11.557 10.232 8.316 698 HA LYS 128 HA LYS 128 12.859 8.337 6.743 699 HB2 LYS 128 1HB LYS 128 13.411 9.338 9.131 700 HB3 LYS 128 2HB LYS 128 12.627 7.867 9.688 701 HG2 LYS 128 1HG LYS 128 14.423 6.644 9.240 702 HG3 LYS 128 2HG LYS 128 14.549 7.304 7.608 703 HD2 LYS 128 1HD LYS 128 15.835 9.150 8.354 704 HD3 LYS 128 2HD LYS 128 15.473 8.809 10.046 705 HE2 LYS 128 1HE LYS 128 16.910 6.786 8.371 706 HE3 LYS 128 2HE LYS 128 17.789 8.149 9.063 707 HZ1 LYS 128 3HZ LYS 128 16.074 6.654 10.884 708 HZ2 LYS 128 1HZ LYS 128 17.603 7.333 11.143 709 HZ3 LYS 128 2HZ LYS 128 17.459 5.855 10.335 710 H GLU 129 H GLU 129 10.026 8.005 8.816 711 HA GLU 129 HA GLU 129 9.839 5.160 8.524 712 HB2 GLU 129 1HB GLU 129 7.641 5.403 9.595 713 HB3 GLU 129 2HB GLU 129 8.888 6.263 10.485 714 HG2 GLU 129 1HG GLU 129 8.038 8.324 9.959 715 HG3 GLU 129 2HG GLU 129 7.286 7.755 8.470 716 H LEU 130 H LEU 130 8.551 7.957 6.824 717 HA LEU 130 HA LEU 130 6.675 6.411 5.272 718 HB2 LEU 130 1HB LEU 130 7.461 9.257 5.453 719 HB3 LEU 130 2HB LEU 130 6.853 8.724 3.898 720 HG LEU 130 HG LEU 130 5.260 8.030 6.315 721 HD11 LEU 130 1HD1 LEU 130 5.771 10.785 5.347 722 HD12 LEU 130 2HD1 LEU 130 5.381 10.202 6.965 723 HD13 LEU 130 3HD1 LEU 130 4.109 10.355 5.754 724 HD21 LEU 130 3HD2 LEU 130 4.747 7.355 3.913 725 HD22 LEU 130 1HD2 LEU 130 4.345 9.052 3.642 726 HD23 LEU 130 2HD2 LEU 130 3.442 8.109 4.828 727 H ILE 131 H ILE 131 9.855 7.888 4.676 728 HA ILE 131 HA ILE 131 10.008 7.263 1.942 729 HB ILE 131 HB ILE 131 12.303 7.455 3.899 730 HG12 ILE 131 1HG1 ILE 131 11.626 9.668 2.031 731 HG13 ILE 131 2HG1 ILE 131 10.569 9.449 3.421 732 HG21 ILE 131 1HG2 ILE 131 12.877 8.277 1.197 733 HG22 ILE 131 2HG2 ILE 131 12.274 6.619 1.232 734 HG23 ILE 131 3HG2 ILE 131 13.682 7.067 2.196 735 HD11 ILE 131 3HD1 ILE 131 13.209 9.330 4.387 736 HD12 ILE 131 1HD1 ILE 131 12.009 10.596 4.642 737 HD13 ILE 131 2HD1 ILE 131 13.125 10.699 3.280 738 H GLU 132 H GLU 132 11.436 5.523 4.718 739 HA GLU 132 HA GLU 132 12.408 3.330 3.322 740 HB2 GLU 132 1HB GLU 132 11.724 3.924 6.115 741 HB3 GLU 132 2HB GLU 132 11.610 2.219 5.701 742 HG2 GLU 132 1HG GLU 132 14.037 3.537 4.737 743 HG3 GLU 132 2HG GLU 132 13.873 3.478 6.492 744 H ALA 133 H ALA 133 9.155 4.117 4.302 745 HA ALA 133 HA ALA 133 7.962 1.592 4.013 746 HB1 ALA 133 3HB ALA 133 7.032 3.804 5.004 747 HB2 ALA 133 1HB ALA 133 5.931 2.680 4.207 748 HB3 ALA 133 2HB ALA 133 6.503 4.114 3.351 749 H TYR 134 H TYR 134 8.027 4.334 1.740 750 HA TYR 134 HA TYR 134 6.921 2.790 -0.380 751 HB2 TYR 134 1HB TYR 134 7.950 5.531 -0.054 752 HB3 TYR 134 2HB TYR 134 8.155 4.860 -1.669 753 HD1 TYR 134 HD1 TYR 134 5.505 5.108 0.967 754 HD2 TYR 134 HD2 TYR 134 6.448 5.175 -3.177 755 HE1 TYR 134 HE1 TYR 134 3.161 5.644 0.446 756 HE2 TYR 134 HE2 TYR 134 4.109 5.708 -3.708 757 HH TYR 134 HH TYR 134 2.102 6.968 -2.069 758 H GLU 135 H GLU 135 10.177 3.366 0.735 759 HA GLU 135 HA GLU 135 11.470 2.386 -1.624 760 HB2 GLU 135 1HB GLU 135 12.303 3.195 1.106 761 HB3 GLU 135 2HB GLU 135 13.356 2.066 0.267 762 HG2 GLU 135 1HG GLU 135 12.449 4.495 -1.182 763 HG3 GLU 135 2HG GLU 135 13.681 4.665 0.066 764 H ALA 136 H ALA 136 10.133 0.945 1.265 765 HA ALA 136 HA ALA 136 11.487 -1.584 0.902 766 HB1 ALA 136 3HB ALA 136 10.857 -0.795 3.134 767 HB2 ALA 136 1HB ALA 136 10.130 -2.358 2.758 768 HB3 ALA 136 2HB ALA 136 9.155 -0.890 2.680 769 H SER 137 H SER 137 8.372 -0.179 0.106 770 HA SER 137 HA SER 137 7.226 -2.670 -0.788 771 HB2 SER 137 1HB SER 137 6.127 0.074 -1.383 772 HB3 SER 137 2HB SER 137 5.250 -1.446 -1.213 773 HG SER 137 HG SER 137 6.363 0.201 0.778 774 H LYS 138 H LYS 138 8.990 -0.026 -2.232 775 HA LYS 138 HA LYS 138 8.213 -0.260 -4.901 776 HB2 LYS 138 1HB LYS 138 9.661 1.537 -3.903 777 HB3 LYS 138 2HB LYS 138 10.998 0.398 -3.928 778 HG2 LYS 138 1HG LYS 138 11.462 1.203 -5.946 779 HG3 LYS 138 2HG LYS 138 10.051 0.308 -6.514 780 HD2 LYS 138 1HD LYS 138 8.691 2.190 -6.498 781 HD3 LYS 138 2HD LYS 138 9.730 3.054 -5.364 782 HE2 LYS 138 1HE LYS 138 10.604 2.345 -8.154 783 HE3 LYS 138 2HE LYS 138 9.762 3.846 -7.775 784 HZ1 LYS 138 3HZ LYS 138 12.490 3.040 -7.153 785 HZ2 LYS 138 1HZ LYS 138 11.688 3.940 -5.965 786 HZ3 LYS 138 2HZ LYS 138 11.873 4.569 -7.524 787 H THR 139 H THR 139 10.848 -1.896 -3.178 788 HA THR 139 HA THR 139 12.087 -3.326 -5.144 789 HB THR 139 HB THR 139 11.361 -4.587 -2.501 790 HG1 THR 139 HG1 THR 139 12.211 -2.895 -1.618 791 HG21 THR 139 3HG2 THR 139 13.738 -4.797 -4.315 792 HG22 THR 139 1HG2 THR 139 12.687 -6.081 -3.710 793 HG23 THR 139 2HG2 THR 139 13.798 -5.261 -2.615 794 HA PRO 140 HA PRO 140 8.451 -5.536 -6.832 795 HB2 PRO 140 1HB PRO 140 10.665 -6.553 -8.548 796 HB3 PRO 140 2HB PRO 140 9.065 -5.958 -9.008 797 HG2 PRO 140 1HG PRO 140 11.223 -4.448 -9.374 798 HG3 PRO 140 2HG PRO 140 9.698 -3.731 -8.824 799 HD2 PRO 140 1HD PRO 140 12.175 -4.343 -7.271 800 HD3 PRO 140 2HD PRO 140 11.046 -2.981 -7.111 801 HA PRO 141 HA PRO 141 11.172 -9.741 -6.248 802 HB2 PRO 141 1HB PRO 141 12.776 -8.434 -4.082 803 HB3 PRO 141 2HB PRO 141 13.217 -9.773 -5.151 804 HG2 PRO 141 1HG PRO 141 14.140 -7.358 -5.643 805 HG3 PRO 141 2HG PRO 141 13.538 -8.356 -6.983 806 HD2 PRO 141 1HD PRO 141 12.252 -6.038 -5.613 807 HD3 PRO 141 2HD PRO 141 12.205 -6.498 -7.326 808 H ASP 142 H ASP 142 9.931 -7.450 -3.858 809 HA ASP 142 HA ASP 142 9.674 -9.085 -1.644 810 HB2 ASP 142 1HB ASP 142 7.671 -7.689 -1.030 811 HB3 ASP 142 2HB ASP 142 9.130 -6.783 -1.402 812 H LEU 143 H LEU 143 7.850 -9.218 -4.617 813 HA LEU 143 HA LEU 143 6.566 -11.658 -3.665 814 HB2 LEU 143 1HB LEU 143 4.971 -9.773 -3.304 815 HB3 LEU 143 2HB LEU 143 5.002 -9.464 -5.026 816 HG LEU 143 HG LEU 143 3.019 -10.765 -4.145 817 HD11 LEU 143 1HD1 LEU 143 4.433 -12.413 -6.184 818 HD12 LEU 143 2HD1 LEU 143 4.000 -10.745 -6.558 819 HD13 LEU 143 3HD1 LEU 143 2.747 -11.904 -6.114 820 HD21 LEU 143 3HD2 LEU 143 3.266 -13.091 -3.663 821 HD22 LEU 143 1HD2 LEU 143 4.357 -12.193 -2.609 822 HD23 LEU 143 2HD2 LEU 143 4.992 -13.035 -4.022 823 H LYS 144 H LYS 144 6.039 -9.673 -6.588 824 HA LYS 144 HA LYS 144 6.309 -10.104 -8.800 825 HB2 LYS 144 1HB LYS 144 8.712 -11.197 -7.521 826 HB3 LYS 144 2HB LYS 144 8.360 -11.915 -9.087 827 HG2 LYS 144 1HG LYS 144 8.203 -9.573 -10.000 828 HG3 LYS 144 2HG LYS 144 8.851 -9.016 -8.456 829 HD2 LYS 144 1HD LYS 144 10.935 -9.698 -8.948 830 HD3 LYS 144 2HD LYS 144 10.374 -11.199 -9.688 831 HE2 LYS 144 1HE LYS 144 9.797 -9.997 -11.725 832 HE3 LYS 144 2HE LYS 144 10.289 -8.475 -10.984 833 HZ1 LYS 144 3HZ LYS 144 12.274 -10.613 -11.040 834 HZ2 LYS 144 1HZ LYS 144 12.470 -8.945 -11.248 835 HZ3 LYS 144 2HZ LYS 144 11.893 -9.894 -12.521 836 H GLU 145 H GLU 145 7.403 -13.327 -7.761 837 HA GLU 145 HA GLU 145 4.856 -14.528 -8.440 838 HB2 GLU 145 1HB GLU 145 6.841 -14.293 -10.422 839 HB3 GLU 145 2HB GLU 145 6.890 -15.972 -9.898 840 HG2 GLU 145 1HG GLU 145 4.570 -16.265 -10.421 841 HG3 GLU 145 2HG GLU 145 4.384 -14.542 -10.757 842 H GLU 146 H GLU 146 4.645 -16.688 -7.691 843 HA GLU 146 HA GLU 146 6.918 -17.829 -6.250 844 HB2 GLU 146 1HB GLU 146 5.473 -18.216 -4.238 845 HB3 GLU 146 2HB GLU 146 5.901 -16.536 -4.525 846 HG2 GLU 146 1HG GLU 146 3.774 -15.925 -4.743 847 HG3 GLU 146 2HG GLU 146 3.404 -17.281 -5.806 848 H SER 147 H SER 147 5.106 -18.492 -8.624 849 HA SER 147 HA SER 147 4.187 -20.323 -9.594 850 HB2 SER 147 1HB SER 147 6.418 -21.225 -8.641 851 HB3 SER 147 2HB SER 147 5.408 -22.021 -7.434 852 HG SER 147 HG SER 147 5.544 -23.476 -9.044 853 H SER 148 H SER 148 2.039 -19.847 -9.176 854 HA SER 148 HA SER 148 0.666 -21.761 -7.538 855 HB2 SER 148 1HB SER 148 1.146 -20.121 -5.802 856 HB3 SER 148 2HB SER 148 0.499 -18.824 -6.805 857 HG SER 148 HG SER 148 -0.921 -21.003 -5.674 858 H THR 149 H THR 149 0.254 -18.626 -9.193 859 HA THR 149 HA THR 149 -2.374 -19.337 -10.132 860 HB THR 149 HB THR 149 -1.894 -17.020 -9.579 861 HG1 THR 149 HG1 THR 149 -2.181 -17.177 -12.390 862 HG21 THR 149 3HG2 THR 149 0.514 -17.423 -11.029 863 HG22 THR 149 1HG2 THR 149 0.007 -16.026 -10.079 864 HG23 THR 149 2HG2 THR 149 -0.397 -16.120 -11.793 865 H ASP 150 H ASP 150 -3.015 -19.676 -12.263 866 HA ASP 150 HA ASP 150 -0.865 -20.455 -14.124 867 HB2 ASP 150 1HB ASP 150 -2.930 -22.049 -13.032 868 HB3 ASP 150 2HB ASP 150 -3.349 -21.782 -14.720 869 H LEU 151 H LEU 151 -1.946 -20.702 -16.457 870 HA LEU 151 HA LEU 151 -3.001 -18.055 -17.068 871 HB2 LEU 151 1HB LEU 151 -2.305 -20.209 -19.054 872 HB3 LEU 151 2HB LEU 151 -2.430 -18.484 -19.336 873 HG LEU 151 HG LEU 151 -0.367 -19.407 -17.401 874 HD11 LEU 151 1HD1 LEU 151 0.163 -19.512 -20.355 875 HD12 LEU 151 2HD1 LEU 151 -0.298 -20.940 -19.429 876 HD13 LEU 151 3HD1 LEU 151 1.184 -20.070 -19.031 877 HD21 LEU 151 3HD2 LEU 151 -0.566 -17.239 -19.483 878 HD22 LEU 151 1HD2 LEU 151 0.887 -17.564 -18.539 879 HD23 LEU 151 2HD2 LEU 151 -0.596 -17.058 -17.728 880 H GLU 152 H GLU 152 -5.135 -18.108 -16.455 881 HA GLU 152 HA GLU 152 -6.904 -20.238 -17.206 882 HB2 GLU 152 1HB GLU 152 -7.700 -17.491 -16.247 883 HB3 GLU 152 2HB GLU 152 -8.626 -18.978 -16.130 884 HG2 GLU 152 1HG GLU 152 -7.839 -19.189 -14.070 885 HG3 GLU 152 2HG GLU 152 -6.268 -19.543 -14.786 Start of MODEL 11 1 H1 SER 45 1H SER 45 -5.137 9.941 -11.591 2 H2 SER 45 2H SER 45 -4.474 11.140 -12.622 3 H3 SER 45 3H SER 45 -3.917 9.519 -12.720 4 HA SER 45 HA SER 45 -6.606 10.521 -13.386 5 HB2 SER 45 1HB SER 45 -4.337 10.732 -14.868 6 HB3 SER 45 2HB SER 45 -4.905 9.142 -15.378 7 HG SER 45 HG SER 45 -6.778 10.040 -16.107 8 H ALA 46 H ALA 46 -4.446 7.674 -13.701 9 HA ALA 46 HA ALA 46 -6.646 5.868 -14.033 10 HB1 ALA 46 3HB ALA 46 -4.122 5.693 -14.804 11 HB2 ALA 46 1HB ALA 46 -5.086 4.255 -14.464 12 HB3 ALA 46 2HB ALA 46 -3.957 4.866 -13.255 13 H ASP 47 H ASP 47 -7.834 4.910 -12.503 14 HA ASP 47 HA ASP 47 -6.698 4.274 -9.922 15 HB2 ASP 47 1HB ASP 47 -7.731 6.724 -10.018 16 HB3 ASP 47 2HB ASP 47 -9.232 5.838 -9.760 17 H ASP 48 H ASP 48 -7.315 2.331 -11.491 18 HA ASP 48 HA ASP 48 -9.522 1.017 -10.228 19 HB2 ASP 48 1HB ASP 48 -9.885 2.196 -12.910 20 HB3 ASP 48 2HB ASP 48 -10.370 0.510 -12.772 21 H ARG 49 H ARG 49 -6.771 0.469 -10.366 22 HA ARG 49 HA ARG 49 -6.748 -1.998 -11.981 23 HB2 ARG 49 1HB ARG 49 -4.397 -0.238 -11.258 24 HB3 ARG 49 2HB ARG 49 -4.293 -1.760 -12.131 25 HG2 ARG 49 1HG ARG 49 -4.917 -0.831 -14.074 26 HG3 ARG 49 2HG ARG 49 -6.134 0.193 -13.310 27 HD2 ARG 49 1HD ARG 49 -4.498 1.651 -14.199 28 HD3 ARG 49 2HD ARG 49 -4.234 1.614 -12.456 29 HE ARG 49 HE ARG 49 -2.550 -0.297 -13.389 30 HH11 ARG 49 1HH1 ARG 49 -3.036 3.075 -14.202 31 HH12 ARG 49 2HH1 ARG 49 -1.391 3.326 -14.675 32 HH21 ARG 49 1HH2 ARG 49 -0.376 0.048 -14.009 33 HH22 ARG 49 2HH2 ARG 49 0.117 1.613 -14.566 34 H LEU 50 H LEU 50 -7.493 -3.355 -10.359 35 HA LEU 50 HA LEU 50 -5.684 -3.697 -8.054 36 HB2 LEU 50 1HB LEU 50 -8.676 -3.771 -8.204 37 HB3 LEU 50 2HB LEU 50 -7.846 -4.723 -6.992 38 HG LEU 50 HG LEU 50 -8.637 -2.575 -6.106 39 HD11 LEU 50 1HD1 LEU 50 -6.746 -3.559 -5.027 40 HD12 LEU 50 2HD1 LEU 50 -6.477 -1.820 -5.135 41 HD13 LEU 50 3HD1 LEU 50 -5.648 -2.911 -6.245 42 HD21 LEU 50 3HD2 LEU 50 -6.573 -1.082 -7.634 43 HD22 LEU 50 1HD2 LEU 50 -8.102 -0.528 -6.954 44 HD23 LEU 50 2HD2 LEU 50 -8.092 -1.465 -8.448 45 H ASN 51 H ASN 51 -4.473 -5.445 -8.567 46 HA ASN 51 HA ASN 51 -5.890 -7.936 -9.211 47 HB2 ASN 51 1HB ASN 51 -3.995 -6.533 -10.926 48 HB3 ASN 51 2HB ASN 51 -3.470 -8.174 -10.572 49 HD21 ASN 51 2HD2 ASN 51 -5.684 -9.642 -10.524 50 HD22 ASN 51 1HD2 ASN 51 -6.526 -9.564 -12.039 51 H PHE 52 H PHE 52 -4.103 -9.817 -9.159 52 HA PHE 52 HA PHE 52 -3.160 -9.869 -6.454 53 HB2 PHE 52 1HB PHE 52 -2.715 -11.861 -8.694 54 HB3 PHE 52 2HB PHE 52 -2.367 -12.140 -6.987 55 HD1 PHE 52 HD1 PHE 52 -4.708 -11.077 -5.644 56 HD2 PHE 52 HD2 PHE 52 -4.434 -13.284 -9.274 57 HE1 PHE 52 HE1 PHE 52 -7.003 -11.896 -5.316 58 HE2 PHE 52 HE2 PHE 52 -6.731 -14.106 -8.950 59 HZ PHE 52 HZ PHE 52 -8.017 -13.411 -6.971 60 H GLY 53 H GLY 53 -1.155 -9.610 -5.653 61 HA2 GLY 53 1HA GLY 53 1.079 -9.091 -5.547 62 HA3 GLY 53 2HA GLY 53 1.243 -9.874 -7.112 63 H ASP 54 H ASP 54 -0.550 -6.961 -6.115 64 HA ASP 54 HA ASP 54 1.128 -5.382 -7.934 65 HB2 ASP 54 1HB ASP 54 -1.259 -6.052 -8.773 66 HB3 ASP 54 2HB ASP 54 -1.805 -4.804 -7.658 67 H ARG 55 H ARG 55 1.754 -3.432 -7.191 68 HA ARG 55 HA ARG 55 1.581 -2.824 -4.448 69 HB2 ARG 55 1HB ARG 55 2.559 -1.360 -6.866 70 HB3 ARG 55 2HB ARG 55 2.375 -0.477 -5.356 71 HG2 ARG 55 1HG ARG 55 4.554 -1.129 -5.192 72 HG3 ARG 55 2HG ARG 55 3.762 -2.481 -4.382 73 HD2 ARG 55 1HD ARG 55 5.346 -3.415 -5.874 74 HD3 ARG 55 2HD ARG 55 3.759 -3.667 -6.599 75 HE ARG 55 HE ARG 55 4.964 -1.260 -7.531 76 HH11 ARG 55 1HH1 ARG 55 5.026 -4.736 -7.920 77 HH12 ARG 55 2HH1 ARG 55 5.604 -4.668 -9.548 78 HH21 ARG 55 1HH2 ARG 55 5.729 -1.174 -9.680 79 HH22 ARG 55 2HH2 ARG 55 6.003 -2.644 -10.550 80 H ILE 56 H ILE 56 -0.048 -2.001 -3.327 81 HA ILE 56 HA ILE 56 -1.812 -0.039 -4.619 82 HB ILE 56 HB ILE 56 -3.802 -1.051 -3.592 83 HG12 ILE 56 1HG1 ILE 56 -2.065 -3.460 -3.030 84 HG13 ILE 56 2HG1 ILE 56 -2.524 -2.287 -1.798 85 HG21 ILE 56 1HG2 ILE 56 -2.200 -2.401 -5.680 86 HG22 ILE 56 2HG2 ILE 56 -3.801 -1.667 -5.770 87 HG23 ILE 56 3HG2 ILE 56 -3.604 -3.271 -5.064 88 HD11 ILE 56 3HD1 ILE 56 -4.681 -3.527 -3.411 89 HD12 ILE 56 1HD1 ILE 56 -4.678 -3.012 -1.725 90 HD13 ILE 56 2HD1 ILE 56 -3.880 -4.514 -2.189 91 H LEU 57 H LEU 57 -2.817 1.441 -3.210 92 HA LEU 57 HA LEU 57 -1.398 1.762 -0.678 93 HB2 LEU 57 1HB LEU 57 -1.894 3.571 -2.567 94 HB3 LEU 57 2HB LEU 57 -3.380 3.758 -1.655 95 HG LEU 57 HG LEU 57 -1.979 4.174 0.392 96 HD11 LEU 57 1HD1 LEU 57 0.071 3.126 -0.935 97 HD12 LEU 57 2HD1 LEU 57 0.285 4.325 0.340 98 HD13 LEU 57 3HD1 LEU 57 0.328 4.820 -1.351 99 HD21 LEU 57 3HD2 LEU 57 -1.304 6.482 -0.347 100 HD22 LEU 57 1HD2 LEU 57 -2.981 6.043 -0.675 101 HD23 LEU 57 2HD2 LEU 57 -1.791 6.021 -1.977 102 H VAL 58 H VAL 58 -2.476 2.076 1.307 103 HA VAL 58 HA VAL 58 -5.350 1.581 1.394 104 HB VAL 58 HB VAL 58 -4.450 -0.664 1.471 105 HG11 VAL 58 1HG1 VAL 58 -2.187 -0.098 2.232 106 HG12 VAL 58 2HG1 VAL 58 -2.898 -1.404 3.178 107 HG13 VAL 58 3HG1 VAL 58 -2.820 0.226 3.846 108 HG21 VAL 58 3HG2 VAL 58 -6.387 -0.350 2.822 109 HG22 VAL 58 1HG2 VAL 58 -5.435 0.334 4.140 110 HG23 VAL 58 2HG2 VAL 58 -5.274 -1.373 3.728 111 H LYS 59 H LYS 59 -6.350 2.426 3.190 112 HA LYS 59 HA LYS 59 -4.611 3.789 5.144 113 HB2 LYS 59 1HB LYS 59 -6.365 5.521 5.341 114 HB3 LYS 59 2HB LYS 59 -5.672 5.443 3.728 115 HG2 LYS 59 1HG LYS 59 -7.781 5.450 3.016 116 HG3 LYS 59 2HG LYS 59 -7.817 3.758 3.512 117 HD2 LYS 59 1HD LYS 59 -9.168 4.177 5.261 118 HD3 LYS 59 2HD LYS 59 -8.323 5.668 5.679 119 HE2 LYS 59 1HE LYS 59 -9.589 6.946 4.207 120 HE3 LYS 59 2HE LYS 59 -10.075 5.543 3.256 121 HZ1 LYS 59 3HZ LYS 59 -11.758 5.059 4.657 122 HZ2 LYS 59 1HZ LYS 59 -11.670 6.712 5.010 123 HZ3 LYS 59 2HZ LYS 59 -10.938 5.587 6.039 124 H ALA 60 H ALA 60 -5.054 3.517 7.275 125 HA ALA 60 HA ALA 60 -7.081 1.528 7.954 126 HB1 ALA 60 3HB ALA 60 -5.257 0.883 9.130 127 HB2 ALA 60 1HB ALA 60 -5.878 2.038 10.309 128 HB3 ALA 60 2HB ALA 60 -4.591 2.514 9.199 129 HA PRO 61 HA PRO 61 -10.155 4.260 9.554 130 HB2 PRO 61 1HB PRO 61 -10.136 2.581 12.016 131 HB3 PRO 61 2HB PRO 61 -11.490 3.036 10.976 132 HG2 PRO 61 1HG PRO 61 -10.485 0.580 10.873 133 HG3 PRO 61 2HG PRO 61 -10.992 1.412 9.391 134 HD2 PRO 61 1HD PRO 61 -8.238 0.949 10.459 135 HD3 PRO 61 2HD PRO 61 -8.818 0.920 8.781 136 H GLY 62 H GLY 62 -9.008 6.151 9.915 137 HA2 GLY 62 1HA GLY 62 -8.712 7.824 11.631 138 HA3 GLY 62 2HA GLY 62 -8.116 6.558 12.693 139 H TYR 63 H TYR 63 -6.467 5.423 10.448 140 HA TYR 63 HA TYR 63 -4.219 7.281 10.736 141 HB2 TYR 63 1HB TYR 63 -4.323 4.355 9.980 142 HB3 TYR 63 2HB TYR 63 -2.847 5.309 10.008 143 HD1 TYR 63 HD2 TYR 63 -5.636 4.126 12.173 144 HD2 TYR 63 HD1 TYR 63 -1.628 5.545 11.992 145 HE1 TYR 63 HE2 TYR 63 -5.348 3.597 14.556 146 HE2 TYR 63 HE1 TYR 63 -1.329 5.017 14.374 147 HH TYR 63 HH TYR 63 -2.977 4.780 16.435 148 HA PRO 64 HA PRO 64 -4.207 8.398 6.462 149 HB2 PRO 64 1HB PRO 64 -1.559 8.711 5.957 150 HB3 PRO 64 2HB PRO 64 -2.484 9.839 6.955 151 HG2 PRO 64 1HG PRO 64 -0.677 7.608 7.796 152 HG3 PRO 64 2HG PRO 64 -0.814 9.248 8.458 153 HD2 PRO 64 1HD PRO 64 -1.962 7.085 9.632 154 HD3 PRO 64 2HD PRO 64 -2.656 8.716 9.731 155 H TRP 65 H TRP 65 -2.928 7.895 4.324 156 HA TRP 65 HA TRP 65 -3.250 5.089 3.829 157 HB2 TRP 65 1HB TRP 65 -2.158 7.238 1.996 158 HB3 TRP 65 2HB TRP 65 -2.679 5.629 1.511 159 HD1 TRP 65 HD1 TRP 65 -4.139 8.942 2.841 160 HE1 TRP 65 HE1 TRP 65 -6.606 9.078 2.132 161 HE3 TRP 65 HE3 TRP 65 -4.646 4.296 0.764 162 HZ2 TRP 65 HZ2 TRP 65 -8.518 7.438 0.857 163 HZ3 TRP 65 HZ3 TRP 65 -6.829 3.660 -0.179 164 HH2 TRP 65 HH2 TRP 65 -8.724 5.200 -0.132 165 H TRP 66 H TRP 66 -1.634 3.651 2.992 166 HA TRP 66 HA TRP 66 1.157 4.426 3.337 167 HB2 TRP 66 1HB TRP 66 0.024 3.362 5.483 168 HB3 TRP 66 2HB TRP 66 0.322 1.861 4.614 169 HD1 TRP 66 HD1 TRP 66 2.597 0.803 5.059 170 HE1 TRP 66 HE1 TRP 66 4.868 1.609 5.953 171 HE3 TRP 66 HE3 TRP 66 1.567 5.791 5.514 172 HZ2 TRP 66 HZ2 TRP 66 6.066 4.035 6.746 173 HZ3 TRP 66 HZ3 TRP 66 3.337 7.287 6.342 174 HH2 TRP 66 HH2 TRP 66 5.542 6.420 6.937 175 HA PRO 67 HA PRO 67 1.648 1.919 -0.284 176 HB2 PRO 67 1HB PRO 67 4.293 1.297 -0.068 177 HB3 PRO 67 2HB PRO 67 3.707 2.885 -0.577 178 HG2 PRO 67 1HG PRO 67 4.635 1.987 2.127 179 HG3 PRO 67 2HG PRO 67 5.017 3.483 1.256 180 HD2 PRO 67 1HD PRO 67 3.175 3.423 3.207 181 HD3 PRO 67 2HD PRO 67 2.980 4.456 1.779 182 H ALA 68 H ALA 68 0.595 0.006 -0.178 183 HA ALA 68 HA ALA 68 1.919 -2.192 1.282 184 HB1 ALA 68 3HB ALA 68 -0.546 -3.125 1.266 185 HB2 ALA 68 1HB ALA 68 -0.954 -1.411 1.160 186 HB3 ALA 68 2HB ALA 68 0.003 -2.010 2.519 187 H LEU 69 H LEU 69 1.056 -4.390 0.376 188 HA LEU 69 HA LEU 69 0.880 -4.218 -2.561 189 HB2 LEU 69 1HB LEU 69 3.061 -5.216 -1.046 190 HB3 LEU 69 2HB LEU 69 2.289 -6.590 -1.813 191 HG LEU 69 HG LEU 69 2.986 -4.159 -3.425 192 HD11 LEU 69 1HD1 LEU 69 5.136 -5.213 -3.975 193 HD12 LEU 69 2HD1 LEU 69 4.842 -6.431 -2.734 194 HD13 LEU 69 3HD1 LEU 69 5.037 -4.738 -2.281 195 HD21 LEU 69 3HD2 LEU 69 2.796 -5.557 -5.259 196 HD22 LEU 69 1HD2 LEU 69 1.530 -6.161 -4.192 197 HD23 LEU 69 2HD2 LEU 69 3.068 -7.016 -4.305 198 H LEU 70 H LEU 70 -0.868 -5.197 -3.300 199 HA LEU 70 HA LEU 70 -2.599 -6.732 -1.694 200 HB2 LEU 70 1HB LEU 70 -2.921 -5.401 -3.983 201 HB3 LEU 70 2HB LEU 70 -2.723 -7.010 -4.650 202 HG LEU 70 HG LEU 70 -4.772 -6.333 -2.543 203 HD11 LEU 70 1HD1 LEU 70 -5.985 -5.337 -4.105 204 HD12 LEU 70 2HD1 LEU 70 -6.025 -6.858 -4.996 205 HD13 LEU 70 3HD1 LEU 70 -4.761 -5.675 -5.331 206 HD21 LEU 70 3HD2 LEU 70 -3.907 -8.771 -3.897 207 HD22 LEU 70 1HD2 LEU 70 -5.646 -8.499 -3.969 208 HD23 LEU 70 2HD2 LEU 70 -4.828 -8.564 -2.408 209 H LEU 71 H LEU 71 -2.733 -8.842 -1.267 210 HA LEU 71 HA LEU 71 -0.839 -10.642 -2.610 211 HB2 LEU 71 1HB LEU 71 -2.307 -11.132 -0.020 212 HB3 LEU 71 2HB LEU 71 -0.977 -12.066 -0.678 213 HG LEU 71 HG LEU 71 -0.714 -9.188 0.187 214 HD11 LEU 71 1HD1 LEU 71 -0.199 -9.799 2.299 215 HD12 LEU 71 2HD1 LEU 71 0.469 -11.355 1.807 216 HD13 LEU 71 3HD1 LEU 71 -1.277 -11.141 1.926 217 HD21 LEU 71 3HD2 LEU 71 1.121 -9.466 -1.104 218 HD22 LEU 71 1HD2 LEU 71 1.103 -11.223 -0.950 219 HD23 LEU 71 2HD2 LEU 71 1.744 -10.229 0.358 220 H ARG 72 H ARG 72 -4.157 -10.748 -1.236 221 HA ARG 72 HA ARG 72 -5.165 -12.036 -3.597 222 HB2 ARG 72 1HB ARG 72 -4.155 -13.681 -1.522 223 HB3 ARG 72 2HB ARG 72 -5.906 -13.816 -1.480 224 HG2 ARG 72 1HG ARG 72 -5.444 -14.052 -4.137 225 HG3 ARG 72 2HG ARG 72 -3.982 -14.780 -3.472 226 HD2 ARG 72 1HD ARG 72 -5.238 -16.383 -2.242 227 HD3 ARG 72 2HD ARG 72 -6.752 -15.543 -2.572 228 HE ARG 72 HE ARG 72 -5.385 -17.396 -4.289 229 HH11 ARG 72 1HH1 ARG 72 -7.643 -14.721 -4.194 230 HH12 ARG 72 2HH1 ARG 72 -8.400 -15.144 -5.691 231 HH21 ARG 72 1HH2 ARG 72 -6.382 -17.946 -6.268 232 HH22 ARG 72 2HH2 ARG 72 -7.683 -16.976 -6.870 233 H ARG 73 H ARG 73 -7.483 -12.500 -3.480 234 HA ARG 73 HA ARG 73 -8.834 -10.573 -1.732 235 HB2 ARG 73 1HB ARG 73 -10.758 -10.842 -3.311 236 HB3 ARG 73 2HB ARG 73 -9.306 -10.193 -4.055 237 HG2 ARG 73 1HG ARG 73 -8.802 -12.499 -4.888 238 HG3 ARG 73 2HG ARG 73 -10.390 -12.989 -4.294 239 HD2 ARG 73 1HD ARG 73 -11.381 -11.179 -5.717 240 HD3 ARG 73 2HD ARG 73 -9.779 -10.932 -6.413 241 HE ARG 73 HE ARG 73 -10.063 -12.831 -7.660 242 HH11 ARG 73 1HH1 ARG 73 -12.499 -12.775 -5.141 243 HH12 ARG 73 2HH1 ARG 73 -13.372 -14.122 -5.785 244 HH21 ARG 73 1HH2 ARG 73 -11.219 -14.611 -8.502 245 HH22 ARG 73 2HH2 ARG 73 -12.644 -15.167 -7.693 246 H LYS 74 H LYS 74 -9.453 -11.480 0.126 247 HA LYS 74 HA LYS 74 -10.480 -14.224 0.101 248 HB2 LYS 74 1HB LYS 74 -10.369 -13.861 2.672 249 HB3 LYS 74 2HB LYS 74 -8.884 -14.133 1.774 250 HG2 LYS 74 1HG LYS 74 -8.236 -11.894 1.939 251 HG3 LYS 74 2HG LYS 74 -9.861 -11.365 2.384 252 HD2 LYS 74 1HD LYS 74 -9.071 -13.274 4.306 253 HD3 LYS 74 2HD LYS 74 -7.700 -12.191 4.077 254 HE2 LYS 74 1HE LYS 74 -8.720 -10.759 5.442 255 HE3 LYS 74 2HE LYS 74 -9.915 -10.509 4.172 256 HZ1 LYS 74 3HZ LYS 74 -10.626 -11.255 6.557 257 HZ2 LYS 74 1HZ LYS 74 -10.254 -12.799 5.975 258 HZ3 LYS 74 2HZ LYS 74 -11.422 -11.859 5.194 259 H GLU 75 H GLU 75 -12.593 -14.431 -0.135 260 HA GLU 75 HA GLU 75 -14.386 -12.305 0.744 261 HB2 GLU 75 1HB GLU 75 -14.391 -14.060 -1.434 262 HB3 GLU 75 2HB GLU 75 -15.704 -14.615 -0.406 263 HG2 GLU 75 1HG GLU 75 -16.401 -12.133 -0.348 264 HG3 GLU 75 2HG GLU 75 -15.355 -11.969 -1.755 265 H THR 76 H THR 76 -14.829 -12.397 2.869 266 HA THR 76 HA THR 76 -15.789 -14.967 3.938 267 HB THR 76 HB THR 76 -13.551 -14.445 4.823 268 HG1 THR 76 HG1 THR 76 -14.076 -14.836 6.916 269 HG21 THR 76 3HG2 THR 76 -13.581 -12.019 4.745 270 HG22 THR 76 1HG2 THR 76 -13.210 -12.597 6.369 271 HG23 THR 76 2HG2 THR 76 -14.822 -11.984 5.996 272 H LYS 77 H LYS 77 -17.768 -14.913 4.846 273 HA LYS 77 HA LYS 77 -18.998 -12.269 5.214 274 HB2 LYS 77 1HB LYS 77 -21.130 -13.324 4.919 275 HB3 LYS 77 2HB LYS 77 -20.074 -13.850 3.622 276 HG2 LYS 77 1HG LYS 77 -19.950 -16.002 4.407 277 HG3 LYS 77 2HG LYS 77 -20.330 -15.534 6.065 278 HD2 LYS 77 1HD LYS 77 -22.327 -15.280 3.831 279 HD3 LYS 77 2HD LYS 77 -22.140 -16.771 4.755 280 HE2 LYS 77 1HE LYS 77 -23.753 -15.799 6.025 281 HE3 LYS 77 2HE LYS 77 -22.348 -15.062 6.787 282 HZ1 LYS 77 3HZ LYS 77 -24.359 -13.627 5.997 283 HZ2 LYS 77 1HZ LYS 77 -23.568 -13.693 4.504 284 HZ3 LYS 77 2HZ LYS 77 -22.782 -13.046 5.851 285 H ASP 78 H ASP 78 -21.173 -13.188 6.886 286 HA ASP 78 HA ASP 78 -19.867 -12.946 9.414 287 HB2 ASP 78 1HB ASP 78 -22.696 -13.041 8.474 288 HB3 ASP 78 2HB ASP 78 -22.372 -13.358 10.176 289 H SER 79 H SER 79 -22.431 -15.277 8.672 290 HA SER 79 HA SER 79 -21.272 -17.181 10.507 291 HB2 SER 79 1HB SER 79 -23.304 -18.520 9.999 292 HB3 SER 79 2HB SER 79 -23.679 -16.872 10.503 293 HG SER 79 HG SER 79 -24.541 -16.513 8.619 294 H LEU 80 H LEU 80 -21.475 -16.779 7.052 295 HA LEU 80 HA LEU 80 -20.419 -17.817 5.334 296 HB2 LEU 80 1HB LEU 80 -18.682 -18.244 7.366 297 HB3 LEU 80 2HB LEU 80 -19.102 -19.898 6.969 298 HG LEU 80 HG LEU 80 -18.582 -18.716 4.498 299 HD11 LEU 80 1HD1 LEU 80 -16.100 -18.011 5.182 300 HD12 LEU 80 2HD1 LEU 80 -16.950 -17.487 6.636 301 HD13 LEU 80 3HD1 LEU 80 -17.427 -16.857 5.061 302 HD21 LEU 80 3HD2 LEU 80 -16.399 -20.154 5.899 303 HD22 LEU 80 1HD2 LEU 80 -17.081 -20.409 4.294 304 HD23 LEU 80 2HD2 LEU 80 -17.942 -20.988 5.719 305 H ASN 81 H ASN 81 -22.930 -18.427 5.653 306 HA ASN 81 HA ASN 81 -23.174 -21.038 4.548 307 HB2 ASN 81 1HB ASN 81 -23.207 -21.069 7.299 308 HB3 ASN 81 2HB ASN 81 -24.923 -20.957 6.911 309 HD21 ASN 81 2HD2 ASN 81 -23.246 -23.153 8.035 310 HD22 ASN 81 1HD2 ASN 81 -23.558 -24.517 7.007 311 H THR 82 H THR 82 -24.991 -18.482 6.246 312 HA THR 82 HA THR 82 -27.372 -18.871 4.722 313 HB THR 82 HB THR 82 -28.171 -16.836 5.826 314 HG1 THR 82 HG1 THR 82 -26.858 -15.510 6.890 315 HG21 THR 82 3HG2 THR 82 -27.554 -19.155 7.132 316 HG22 THR 82 1HG2 THR 82 -28.498 -17.820 7.793 317 HG23 THR 82 2HG2 THR 82 -26.769 -17.930 8.130 318 H ASN 83 H ASN 83 -24.535 -16.860 4.332 319 HA ASN 83 HA ASN 83 -23.804 -15.569 2.609 320 HB2 ASN 83 1HB ASN 83 -25.218 -17.505 1.345 321 HB3 ASN 83 2HB ASN 83 -26.107 -16.075 0.830 322 HD21 ASN 83 2HD2 ASN 83 -24.159 -18.036 -0.473 323 HD22 ASN 83 1HD2 ASN 83 -23.033 -16.997 -1.292 324 H SER 84 H SER 84 -25.689 -14.539 4.633 325 HA SER 84 HA SER 84 -27.545 -12.775 3.448 326 HB2 SER 84 1HB SER 84 -26.360 -13.116 6.148 327 HB3 SER 84 2HB SER 84 -27.062 -11.540 5.786 328 HG SER 84 HG SER 84 -29.016 -12.516 5.383 329 H SER 85 H SER 85 -24.552 -11.768 5.159 330 HA SER 85 HA SER 85 -24.156 -9.750 3.061 331 HB2 SER 85 1HB SER 85 -25.096 -8.984 5.416 332 HB3 SER 85 2HB SER 85 -23.399 -9.110 5.879 333 HG SER 85 HG SER 85 -22.987 -7.367 4.776 334 H PHE 86 H PHE 86 -22.390 -10.363 2.037 335 HA PHE 86 HA PHE 86 -20.266 -11.820 3.307 336 HB2 PHE 86 1HB PHE 86 -21.095 -11.231 0.617 337 HB3 PHE 86 2HB PHE 86 -19.386 -10.857 0.800 338 HD1 PHE 86 HD1 PHE 86 -17.998 -12.734 2.057 339 HD2 PHE 86 HD2 PHE 86 -21.685 -13.362 0.025 340 HE1 PHE 86 HE1 PHE 86 -17.451 -15.121 1.809 341 HE2 PHE 86 HE2 PHE 86 -21.145 -15.748 -0.225 342 HZ PHE 86 HZ PHE 86 -19.025 -16.631 0.666 343 H ASN 87 H ASN 87 -18.057 -11.136 3.430 344 HA ASN 87 HA ASN 87 -17.636 -8.232 3.400 345 HB2 ASN 87 1HB ASN 87 -17.472 -10.055 5.708 346 HB3 ASN 87 2HB ASN 87 -16.073 -9.010 5.505 347 HD21 ASN 87 2HD2 ASN 87 -19.596 -8.994 5.720 348 HD22 ASN 87 1HD2 ASN 87 -19.720 -7.421 6.445 349 H VAL 88 H VAL 88 -16.593 -8.668 1.394 350 HA VAL 88 HA VAL 88 -14.225 -10.329 1.383 351 HB VAL 88 HB VAL 88 -15.545 -10.325 -0.624 352 HG11 VAL 88 1HG1 VAL 88 -15.181 -7.345 -0.550 353 HG12 VAL 88 2HG1 VAL 88 -16.679 -8.273 -0.627 354 HG13 VAL 88 3HG1 VAL 88 -15.615 -8.199 -2.029 355 HG21 VAL 88 3HG2 VAL 88 -13.841 -9.726 -2.294 356 HG22 VAL 88 1HG2 VAL 88 -13.156 -10.604 -0.928 357 HG23 VAL 88 2HG2 VAL 88 -12.944 -8.857 -1.049 358 H LEU 89 H LEU 89 -12.153 -9.684 1.457 359 HA LEU 89 HA LEU 89 -11.577 -6.801 1.520 360 HB2 LEU 89 1HB LEU 89 -10.288 -8.763 3.406 361 HB3 LEU 89 2HB LEU 89 -10.144 -7.017 3.415 362 HG LEU 89 HG LEU 89 -12.672 -8.539 4.055 363 HD11 LEU 89 1HD1 LEU 89 -10.479 -7.429 5.763 364 HD12 LEU 89 2HD1 LEU 89 -11.276 -8.999 5.849 365 HD13 LEU 89 3HD1 LEU 89 -12.129 -7.548 6.375 366 HD21 LEU 89 3HD2 LEU 89 -13.744 -6.566 4.276 367 HD22 LEU 89 1HD2 LEU 89 -12.514 -6.001 3.147 368 HD23 LEU 89 2HD2 LEU 89 -12.311 -5.732 4.877 369 H TYR 90 H TYR 90 -9.070 -6.510 1.582 370 HA TYR 90 HA TYR 90 -7.893 -8.354 -0.395 371 HB2 TYR 90 1HB TYR 90 -8.067 -5.409 -0.302 372 HB3 TYR 90 2HB TYR 90 -6.482 -6.047 -0.731 373 HD1 TYR 90 HD2 TYR 90 -7.319 -8.500 -2.207 374 HD2 TYR 90 HD1 TYR 90 -8.814 -4.521 -2.346 375 HE1 TYR 90 HE2 TYR 90 -8.087 -8.878 -4.502 376 HE2 TYR 90 HE1 TYR 90 -9.592 -4.889 -4.647 377 HH TYR 90 HH TYR 90 -8.965 -6.432 -6.581 378 H LYS 91 H LYS 91 -6.400 -9.574 0.588 379 HA LYS 91 HA LYS 91 -5.079 -8.809 2.996 380 HB2 LYS 91 1HB LYS 91 -4.167 -10.985 1.106 381 HB3 LYS 91 2HB LYS 91 -3.890 -10.876 2.838 382 HG2 LYS 91 1HG LYS 91 -6.454 -11.034 3.041 383 HG3 LYS 91 2HG LYS 91 -6.396 -11.611 1.374 384 HD2 LYS 91 1HD LYS 91 -4.723 -12.833 3.557 385 HD3 LYS 91 2HD LYS 91 -6.367 -13.375 3.217 386 HE2 LYS 91 1HE LYS 91 -4.633 -13.168 0.857 387 HE3 LYS 91 2HE LYS 91 -4.118 -14.368 2.040 388 HZ1 LYS 91 3HZ LYS 91 -6.592 -14.272 0.452 389 HZ2 LYS 91 1HZ LYS 91 -6.602 -15.067 1.945 390 HZ3 LYS 91 2HZ LYS 91 -5.545 -15.570 0.726 391 H VAL 92 H VAL 92 -3.927 -6.915 2.736 392 HA VAL 92 HA VAL 92 -1.854 -6.885 0.644 393 HB VAL 92 HB VAL 92 -1.820 -4.518 0.750 394 HG11 VAL 92 1HG1 VAL 92 -4.748 -5.073 1.051 395 HG12 VAL 92 2HG1 VAL 92 -3.837 -5.718 -0.314 396 HG13 VAL 92 3HG1 VAL 92 -3.928 -3.975 -0.056 397 HG21 VAL 92 3HG2 VAL 92 -3.253 -3.255 2.377 398 HG22 VAL 92 1HG2 VAL 92 -1.886 -4.102 3.101 399 HG23 VAL 92 2HG2 VAL 92 -3.512 -4.775 3.235 400 H LEU 93 H LEU 93 0.277 -6.374 1.118 401 HA LEU 93 HA LEU 93 1.053 -6.762 3.925 402 HB2 LEU 93 1HB LEU 93 2.258 -7.421 1.317 403 HB3 LEU 93 2HB LEU 93 3.388 -6.806 2.508 404 HG LEU 93 HG LEU 93 1.537 -9.102 3.111 405 HD11 LEU 93 1HD1 LEU 93 4.353 -9.688 2.480 406 HD12 LEU 93 2HD1 LEU 93 3.333 -9.265 1.106 407 HD13 LEU 93 3HD1 LEU 93 2.893 -10.620 2.146 408 HD21 LEU 93 3HD2 LEU 93 2.976 -9.529 4.927 409 HD22 LEU 93 1HD2 LEU 93 2.707 -7.786 4.938 410 HD23 LEU 93 2HD2 LEU 93 4.216 -8.441 4.303 411 H PHE 94 H PHE 94 2.028 -5.160 5.081 412 HA PHE 94 HA PHE 94 2.256 -2.557 3.768 413 HB2 PHE 94 1HB PHE 94 2.039 -3.514 6.563 414 HB3 PHE 94 2HB PHE 94 2.966 -2.045 6.322 415 HD1 PHE 94 HD1 PHE 94 -0.282 -3.453 5.054 416 HD2 PHE 94 HD2 PHE 94 1.825 -0.127 6.688 417 HE1 PHE 94 HE1 PHE 94 -2.352 -2.127 5.032 418 HE2 PHE 94 HE2 PHE 94 -0.243 1.198 6.663 419 HZ PHE 94 HZ PHE 94 -2.336 0.199 5.838 420 H PHE 95 H PHE 95 4.157 -1.149 4.295 421 HA PHE 95 HA PHE 95 6.655 -2.607 4.736 422 HB2 PHE 95 1HB PHE 95 6.168 -0.820 2.344 423 HB3 PHE 95 2HB PHE 95 7.708 -1.547 2.777 424 HD1 PHE 95 HD1 PHE 95 7.696 -4.152 2.997 425 HD2 PHE 95 HD2 PHE 95 4.806 -1.894 0.839 426 HE1 PHE 95 HE1 PHE 95 7.121 -6.150 1.683 427 HE2 PHE 95 HE2 PHE 95 4.227 -3.885 -0.480 428 HZ PHE 95 HZ PHE 95 5.384 -6.020 -0.058 429 HA PRO 96 HA PRO 96 8.599 -2.318 4.938 430 HB2 PRO 96 1HB PRO 96 10.591 -1.823 6.641 431 HB3 PRO 96 2HB PRO 96 10.457 -0.935 5.119 432 HG2 PRO 96 1HG PRO 96 9.831 -0.051 7.889 433 HG3 PRO 96 2HG PRO 96 10.452 0.886 6.522 434 HD2 PRO 96 1HD PRO 96 7.771 0.750 7.408 435 HD3 PRO 96 2HD PRO 96 8.359 1.488 5.906 436 H ASP 97 H ASP 97 9.810 -3.769 6.761 437 HA ASP 97 HA ASP 97 9.672 -5.135 8.568 438 HB2 ASP 97 1HB ASP 97 8.755 -2.749 9.585 439 HB3 ASP 97 2HB ASP 97 7.438 -3.852 9.959 440 H PHE 98 H PHE 98 7.341 -4.789 6.305 441 HA PHE 98 HA PHE 98 5.544 -6.001 5.614 442 HB2 PHE 98 1HB PHE 98 6.713 -8.216 7.299 443 HB3 PHE 98 2HB PHE 98 5.740 -8.379 5.844 444 HD1 PHE 98 HD2 PHE 98 9.055 -7.450 7.156 445 HD2 PHE 98 HD1 PHE 98 6.719 -8.230 3.685 446 HE1 PHE 98 HE2 PHE 98 11.106 -7.550 5.802 447 HE2 PHE 98 HE1 PHE 98 8.767 -8.335 2.327 448 HZ PHE 98 HZ PHE 98 10.963 -7.993 3.383 449 H ASN 99 H ASN 99 3.998 -4.733 6.803 450 HA ASN 99 HA ASN 99 2.843 -6.175 9.105 451 HB2 ASN 99 1HB ASN 99 2.570 -3.215 8.613 452 HB3 ASN 99 2HB ASN 99 2.125 -4.113 10.059 453 HD21 ASN 99 2HD2 ASN 99 3.558 -4.250 11.657 454 HD22 ASN 99 1HD2 ASN 99 5.229 -3.793 11.542 455 H PHE 100 H PHE 100 1.914 -7.217 7.021 456 HA PHE 100 HA PHE 100 0.031 -6.111 5.380 457 HB2 PHE 100 1HB PHE 100 -1.013 -8.418 5.315 458 HB3 PHE 100 2HB PHE 100 0.712 -8.349 4.977 459 HD1 PHE 100 HD1 PHE 100 2.329 -8.935 6.822 460 HD2 PHE 100 HD2 PHE 100 -1.845 -9.724 7.056 461 HE1 PHE 100 HE1 PHE 100 2.742 -10.598 8.595 462 HE2 PHE 100 HE2 PHE 100 -1.443 -11.376 8.828 463 HZ PHE 100 HZ PHE 100 0.854 -11.819 9.601 464 H ALA 101 H ALA 101 -2.270 -6.108 5.335 465 HA ALA 101 HA ALA 101 -3.729 -6.356 7.841 466 HB1 ALA 101 3HB ALA 101 -4.674 -3.921 6.968 467 HB2 ALA 101 1HB ALA 101 -2.933 -3.790 6.698 468 HB3 ALA 101 2HB ALA 101 -3.553 -4.172 8.307 469 H TRP 102 H TRP 102 -5.962 -6.612 7.576 470 HA TRP 102 HA TRP 102 -6.826 -7.231 4.838 471 HB2 TRP 102 1HB TRP 102 -8.311 -7.865 7.393 472 HB3 TRP 102 2HB TRP 102 -8.559 -8.568 5.799 473 HD1 TRP 102 HD1 TRP 102 -5.392 -9.194 5.267 474 HE1 TRP 102 HE1 TRP 102 -4.344 -11.195 6.496 475 HE3 TRP 102 HE3 TRP 102 -8.769 -9.669 9.080 476 HZ2 TRP 102 HZ2 TRP 102 -4.877 -12.771 8.779 477 HZ3 TRP 102 HZ3 TRP 102 -8.426 -11.449 10.743 478 HH2 TRP 102 HH2 TRP 102 -6.519 -12.967 10.594 479 H VAL 103 H VAL 103 -7.801 -5.615 3.798 480 HA VAL 103 HA VAL 103 -9.891 -4.095 5.190 481 HB VAL 103 HB VAL 103 -9.151 -1.999 4.126 482 HG11 VAL 103 1HG1 VAL 103 -6.782 -2.974 5.650 483 HG12 VAL 103 2HG1 VAL 103 -8.356 -2.919 6.443 484 HG13 VAL 103 3HG1 VAL 103 -7.654 -1.446 5.776 485 HG21 VAL 103 3HG2 VAL 103 -7.511 -1.868 2.615 486 HG22 VAL 103 1HG2 VAL 103 -7.617 -3.626 2.514 487 HG23 VAL 103 2HG2 VAL 103 -6.427 -2.874 3.576 488 H LYS 104 H LYS 104 -11.363 -2.960 3.695 489 HA LYS 104 HA LYS 104 -11.952 -4.628 1.406 490 HB2 LYS 104 1HB LYS 104 -13.599 -3.477 3.126 491 HB3 LYS 104 2HB LYS 104 -13.468 -2.123 2.015 492 HG2 LYS 104 1HG LYS 104 -14.581 -3.203 0.340 493 HG3 LYS 104 2HG LYS 104 -14.088 -4.804 0.895 494 HD2 LYS 104 1HD LYS 104 -15.574 -4.078 2.989 495 HD3 LYS 104 2HD LYS 104 -16.366 -3.108 1.747 496 HE2 LYS 104 1HE LYS 104 -17.244 -4.914 0.713 497 HE3 LYS 104 2HE LYS 104 -15.823 -5.911 1.019 498 HZ1 LYS 104 3HZ LYS 104 -17.760 -5.187 3.144 499 HZ2 LYS 104 1HZ LYS 104 -16.560 -6.380 3.194 500 HZ3 LYS 104 2HZ LYS 104 -17.916 -6.584 2.202 501 H ARG 105 H ARG 105 -12.543 -3.594 -0.708 502 HA ARG 105 HA ARG 105 -10.385 -2.239 -1.836 503 HB2 ARG 105 1HB ARG 105 -13.230 -2.607 -2.753 504 HB3 ARG 105 2HB ARG 105 -12.042 -1.750 -3.728 505 HG2 ARG 105 1HG ARG 105 -11.549 -3.729 -4.606 506 HG3 ARG 105 2HG ARG 105 -10.738 -4.078 -3.079 507 HD2 ARG 105 1HD ARG 105 -12.239 -5.887 -3.642 508 HD3 ARG 105 2HD ARG 105 -12.828 -5.046 -2.211 509 HE ARG 105 HE ARG 105 -14.177 -3.833 -4.204 510 HH11 ARG 105 1HH1 ARG 105 -13.708 -7.210 -3.399 511 HH12 ARG 105 2HH1 ARG 105 -15.239 -7.701 -4.037 512 HH21 ARG 105 1HH2 ARG 105 -16.206 -4.491 -5.033 513 HH22 ARG 105 2HH2 ARG 105 -16.656 -6.162 -4.959 514 H ASN 106 H ASN 106 -13.143 -0.973 -0.133 515 HA ASN 106 HA ASN 106 -13.092 1.654 -1.197 516 HB2 ASN 106 1HB ASN 106 -14.452 2.285 0.764 517 HB3 ASN 106 2HB ASN 106 -15.075 0.853 -0.046 518 HD21 ASN 106 2HD2 ASN 106 -15.769 -0.637 1.309 519 HD22 ASN 106 1HD2 ASN 106 -15.123 -0.971 2.884 520 H SER 107 H SER 107 -11.289 0.081 1.371 521 HA SER 107 HA SER 107 -10.111 2.635 2.178 522 HB2 SER 107 1HB SER 107 -8.841 0.770 3.717 523 HB3 SER 107 2HB SER 107 -10.341 1.576 4.175 524 HG SER 107 HG SER 107 -11.473 -0.198 3.652 525 H VAL 108 H VAL 108 -9.604 0.889 -0.377 526 HA VAL 108 HA VAL 108 -6.666 1.000 -0.216 527 HB VAL 108 HB VAL 108 -8.362 -0.972 -1.744 528 HG11 VAL 108 1HG1 VAL 108 -6.347 -1.972 -2.552 529 HG12 VAL 108 2HG1 VAL 108 -5.354 -0.891 -1.576 530 HG13 VAL 108 3HG1 VAL 108 -6.277 -0.252 -2.937 531 HG21 VAL 108 3HG2 VAL 108 -6.731 -2.458 -0.183 532 HG22 VAL 108 1HG2 VAL 108 -8.369 -1.983 0.264 533 HG23 VAL 108 2HG2 VAL 108 -6.990 -1.055 0.854 534 H LYS 109 H LYS 109 -5.565 1.829 -2.001 535 HA LYS 109 HA LYS 109 -7.195 2.912 -4.201 536 HB2 LYS 109 1HB LYS 109 -6.688 4.724 -2.614 537 HB3 LYS 109 2HB LYS 109 -4.973 4.366 -2.750 538 HG2 LYS 109 1HG LYS 109 -4.927 5.073 -5.027 539 HG3 LYS 109 2HG LYS 109 -6.686 5.212 -5.074 540 HD2 LYS 109 1HD LYS 109 -5.379 6.788 -2.966 541 HD3 LYS 109 2HD LYS 109 -4.975 7.276 -4.612 542 HE2 LYS 109 1HE LYS 109 -7.638 6.996 -4.859 543 HE3 LYS 109 2HE LYS 109 -7.542 7.436 -3.155 544 HZ1 LYS 109 3HZ LYS 109 -6.836 9.517 -3.635 545 HZ2 LYS 109 1HZ LYS 109 -7.671 9.230 -5.078 546 HZ3 LYS 109 2HZ LYS 109 -5.991 9.052 -5.026 547 HA PRO 110 HA PRO 110 -4.331 0.752 -6.831 548 HB2 PRO 110 1HB PRO 110 -4.822 3.037 -8.677 549 HB3 PRO 110 2HB PRO 110 -4.965 1.300 -8.970 550 HG2 PRO 110 1HG PRO 110 -7.135 2.809 -8.648 551 HG3 PRO 110 2HG PRO 110 -7.056 1.169 -7.982 552 HD2 PRO 110 1HD PRO 110 -6.811 3.799 -6.592 553 HD3 PRO 110 2HD PRO 110 -7.560 2.289 -6.032 554 H LEU 111 H LEU 111 -2.185 0.772 -6.745 555 HA LEU 111 HA LEU 111 -0.771 3.363 -6.741 556 HB2 LEU 111 1HB LEU 111 -0.817 1.554 -4.703 557 HB3 LEU 111 2HB LEU 111 0.599 1.019 -5.585 558 HG LEU 111 HG LEU 111 1.278 2.501 -3.827 559 HD11 LEU 111 1HD1 LEU 111 2.689 3.881 -5.014 560 HD12 LEU 111 2HD1 LEU 111 1.482 4.230 -6.252 561 HD13 LEU 111 3HD1 LEU 111 2.273 2.653 -6.209 562 HD21 LEU 111 3HD2 LEU 111 0.343 5.024 -4.501 563 HD22 LEU 111 1HD2 LEU 111 -0.153 4.043 -3.123 564 HD23 LEU 111 2HD2 LEU 111 -1.073 3.979 -4.625 565 H LEU 112 H LEU 112 1.038 3.578 -8.053 566 HA LEU 112 HA LEU 112 1.713 1.263 -9.746 567 HB2 LEU 112 1HB LEU 112 2.220 3.066 -11.526 568 HB3 LEU 112 2HB LEU 112 0.560 2.572 -11.259 569 HG LEU 112 HG LEU 112 1.388 4.883 -9.644 570 HD11 LEU 112 1HD1 LEU 112 1.485 4.969 -12.640 571 HD12 LEU 112 2HD1 LEU 112 2.646 5.602 -11.473 572 HD13 LEU 112 3HD1 LEU 112 1.085 6.395 -11.683 573 HD21 LEU 112 3HD2 LEU 112 -0.787 5.506 -9.909 574 HD22 LEU 112 1HD2 LEU 112 -0.953 3.774 -10.193 575 HD23 LEU 112 2HD2 LEU 112 -0.884 4.889 -11.557 576 H ASP 113 H ASP 113 3.885 1.369 -10.718 577 HA ASP 113 HA ASP 113 5.858 1.889 -8.786 578 HB2 ASP 113 1HB ASP 113 5.825 0.390 -11.019 579 HB3 ASP 113 2HB ASP 113 6.713 1.785 -11.626 580 H SER 114 H SER 114 4.802 3.741 -11.615 581 HA SER 114 HA SER 114 6.813 5.703 -11.545 582 HB2 SER 114 1HB SER 114 4.685 5.196 -13.195 583 HB3 SER 114 2HB SER 114 4.145 6.654 -12.364 584 HG SER 114 HG SER 114 6.125 7.637 -13.006 585 H GLU 115 H GLU 115 3.944 5.247 -9.603 586 HA GLU 115 HA GLU 115 4.005 7.922 -8.507 587 HB2 GLU 115 1HB GLU 115 2.351 5.468 -8.045 588 HB3 GLU 115 2HB GLU 115 2.365 6.727 -6.820 589 HG2 GLU 115 1HG GLU 115 1.925 7.685 -9.552 590 HG3 GLU 115 2HG GLU 115 0.665 6.625 -8.928 591 H ILE 116 H ILE 116 4.860 4.657 -7.414 592 HA ILE 116 HA ILE 116 5.666 5.326 -4.810 593 HB ILE 116 HB ILE 116 6.706 3.077 -6.552 594 HG12 ILE 116 1HG1 ILE 116 4.499 3.065 -4.480 595 HG13 ILE 116 2HG1 ILE 116 4.251 3.040 -6.223 596 HG21 ILE 116 1HG2 ILE 116 8.013 3.797 -4.438 597 HG22 ILE 116 2HG2 ILE 116 7.645 2.090 -4.680 598 HG23 ILE 116 3HG2 ILE 116 6.676 3.050 -3.561 599 HD11 ILE 116 3HD1 ILE 116 5.780 0.920 -4.744 600 HD12 ILE 116 1HD1 ILE 116 5.204 0.878 -6.410 601 HD13 ILE 116 2HD1 ILE 116 4.052 0.830 -5.076 602 H ALA 117 H ALA 117 7.606 4.851 -7.767 603 HA ALA 117 HA ALA 117 10.098 5.562 -6.741 604 HB1 ALA 117 3HB ALA 117 9.381 6.384 -9.515 605 HB2 ALA 117 1HB ALA 117 9.360 4.669 -9.106 606 HB3 ALA 117 2HB ALA 117 10.843 5.602 -8.914 607 H LYS 118 H LYS 118 7.473 7.543 -8.012 608 HA LYS 118 HA LYS 118 8.849 10.013 -7.979 609 HB2 LYS 118 1HB LYS 118 6.368 9.146 -8.823 610 HB3 LYS 118 2HB LYS 118 5.985 10.222 -7.487 611 HG2 LYS 118 1HG LYS 118 6.265 11.935 -8.831 612 HG3 LYS 118 2HG LYS 118 7.970 11.495 -8.981 613 HD2 LYS 118 1HD LYS 118 7.521 10.128 -10.894 614 HD3 LYS 118 2HD LYS 118 5.777 10.289 -10.669 615 HE2 LYS 118 1HE LYS 118 5.747 12.139 -11.905 616 HE3 LYS 118 2HE LYS 118 6.957 12.892 -10.868 617 HZ1 LYS 118 3HZ LYS 118 7.894 10.925 -12.819 618 HZ2 LYS 118 1HZ LYS 118 8.638 12.341 -12.267 619 HZ3 LYS 118 2HZ LYS 118 7.397 12.428 -13.412 620 H PHE 119 H PHE 119 6.493 8.615 -5.705 621 HA PHE 119 HA PHE 119 6.447 10.601 -3.793 622 HB2 PHE 119 1HB PHE 119 4.985 8.738 -3.531 623 HB3 PHE 119 2HB PHE 119 6.324 7.599 -3.499 624 HD1 PHE 119 HD1 PHE 119 7.849 7.576 -1.488 625 HD2 PHE 119 HD2 PHE 119 4.164 9.709 -1.558 626 HE1 PHE 119 HE1 PHE 119 7.843 7.641 0.973 627 HE2 PHE 119 HE2 PHE 119 4.163 9.784 0.902 628 HZ PHE 119 HZ PHE 119 6.006 8.751 2.162 629 H LEU 120 H LEU 120 8.800 7.981 -4.143 630 HA LEU 120 HA LEU 120 10.362 8.712 -1.878 631 HB2 LEU 120 1HB LEU 120 10.987 7.026 -4.295 632 HB3 LEU 120 2HB LEU 120 12.076 7.227 -2.935 633 HG LEU 120 HG LEU 120 9.341 6.334 -2.268 634 HD11 LEU 120 1HD1 LEU 120 9.678 5.028 -4.266 635 HD12 LEU 120 2HD1 LEU 120 9.885 3.986 -2.860 636 HD13 LEU 120 3HD1 LEU 120 11.296 4.568 -3.742 637 HD21 LEU 120 3HD2 LEU 120 11.417 4.704 -1.220 638 HD22 LEU 120 1HD2 LEU 120 10.410 5.879 -0.375 639 HD23 LEU 120 2HD2 LEU 120 11.934 6.384 -1.101 640 H GLY 121 H GLY 121 10.445 9.523 -5.321 641 HA2 GLY 121 1HA GLY 121 12.997 10.731 -5.376 642 HA3 GLY 121 2HA GLY 121 11.683 11.055 -6.495 643 H SER 122 H SER 122 10.088 11.764 -3.895 644 HA SER 122 HA SER 122 10.762 14.589 -4.000 645 HB2 SER 122 1HB SER 122 8.530 13.224 -2.476 646 HB3 SER 122 2HB SER 122 8.677 14.946 -2.817 647 HG SER 122 HG SER 122 8.095 12.830 -4.589 648 H SER 123 H SER 123 12.862 14.190 -2.916 649 HA SER 123 HA SER 123 12.821 13.462 -0.127 650 HB2 SER 123 1HB SER 123 15.278 14.083 -0.254 651 HB3 SER 123 2HB SER 123 14.763 12.789 -1.335 652 HG SER 123 HG SER 123 15.984 15.011 -1.992 653 H LYS 124 H LYS 124 11.897 16.243 -1.636 654 HA LYS 124 HA LYS 124 13.208 18.244 -0.152 655 HB2 LYS 124 1HB LYS 124 11.294 19.691 -0.835 656 HB3 LYS 124 2HB LYS 124 12.068 18.845 -2.167 657 HG2 LYS 124 1HG LYS 124 10.073 17.106 -1.411 658 HG3 LYS 124 2HG LYS 124 9.331 18.692 -1.195 659 HD2 LYS 124 1HD LYS 124 10.830 18.582 -3.660 660 HD3 LYS 124 2HD LYS 124 9.643 17.279 -3.588 661 HE2 LYS 124 1HE LYS 124 8.826 20.047 -2.828 662 HE3 LYS 124 2HE LYS 124 8.987 19.634 -4.535 663 HZ1 LYS 124 3HZ LYS 124 6.717 19.322 -3.640 664 HZ2 LYS 124 1HZ LYS 124 7.310 18.117 -2.608 665 HZ3 LYS 124 2HZ LYS 124 7.375 17.903 -4.285 666 H ARG 125 H ARG 125 9.967 16.810 0.308 667 HA ARG 125 HA ARG 125 10.224 17.344 3.166 668 HB2 ARG 125 1HB ARG 125 8.863 19.166 2.117 669 HB3 ARG 125 2HB ARG 125 7.704 17.946 1.609 670 HG2 ARG 125 1HG ARG 125 6.660 18.287 3.535 671 HG3 ARG 125 2HG ARG 125 8.021 17.490 4.327 672 HD2 ARG 125 1HD ARG 125 7.699 20.446 3.820 673 HD3 ARG 125 2HD ARG 125 7.593 19.626 5.377 674 HE ARG 125 HE ARG 125 10.101 19.087 4.231 675 HH11 ARG 125 1HH1 ARG 125 8.327 21.751 5.654 676 HH12 ARG 125 2HH1 ARG 125 9.753 22.568 6.197 677 HH21 ARG 125 1HH2 ARG 125 11.977 20.177 4.946 678 HH22 ARG 125 2HH2 ARG 125 11.818 21.677 5.796 679 H LYS 126 H LYS 126 10.401 15.312 3.802 680 HA LYS 126 HA LYS 126 8.096 13.601 3.697 681 HB2 LYS 126 1HB LYS 126 9.893 13.293 1.626 682 HB3 LYS 126 2HB LYS 126 10.433 12.088 2.784 683 HG2 LYS 126 1HG LYS 126 8.914 11.026 1.309 684 HG3 LYS 126 2HG LYS 126 8.089 11.220 2.856 685 HD2 LYS 126 1HD LYS 126 6.581 11.790 1.051 686 HD3 LYS 126 2HD LYS 126 6.977 13.243 1.971 687 HE2 LYS 126 1HE LYS 126 8.572 13.926 0.283 688 HE3 LYS 126 2HE LYS 126 8.317 12.423 -0.605 689 HZ1 LYS 126 3HZ LYS 126 6.401 13.169 -1.487 690 HZ2 LYS 126 1HZ LYS 126 7.048 14.696 -1.153 691 HZ3 LYS 126 2HZ LYS 126 5.932 14.000 -0.092 692 H SER 127 H SER 127 8.115 12.027 5.325 693 HA SER 127 HA SER 127 10.130 12.444 7.371 694 HB2 SER 127 1HB SER 127 8.520 10.561 8.457 695 HB3 SER 127 2HB SER 127 8.161 12.287 8.518 696 HG SER 127 HG SER 127 6.495 10.694 7.687 697 H LYS 128 H LYS 128 11.341 10.727 8.330 698 HA LYS 128 HA LYS 128 12.559 8.984 6.515 699 HB2 LYS 128 1HB LYS 128 12.752 9.540 9.366 700 HB3 LYS 128 2HB LYS 128 12.979 7.832 9.022 701 HG2 LYS 128 1HG LYS 128 14.505 10.052 7.680 702 HG3 LYS 128 2HG LYS 128 15.080 9.134 9.072 703 HD2 LYS 128 1HD LYS 128 14.906 7.063 7.742 704 HD3 LYS 128 2HD LYS 128 14.405 8.021 6.349 705 HE2 LYS 128 1HE LYS 128 16.610 7.968 5.869 706 HE3 LYS 128 2HE LYS 128 16.666 9.317 7.002 707 HZ1 LYS 128 3HZ LYS 128 18.345 7.516 7.376 708 HZ2 LYS 128 1HZ LYS 128 17.072 6.499 7.833 709 HZ3 LYS 128 2HZ LYS 128 17.399 7.901 8.725 710 H GLU 129 H GLU 129 9.921 8.485 8.807 711 HA GLU 129 HA GLU 129 9.703 5.682 8.441 712 HB2 GLU 129 1HB GLU 129 7.538 5.880 9.536 713 HB3 GLU 129 2HB GLU 129 8.737 6.846 10.386 714 HG2 GLU 129 1HG GLU 129 7.707 8.681 8.669 715 HG3 GLU 129 2HG GLU 129 6.299 7.667 8.976 716 H LEU 130 H LEU 130 8.361 8.470 6.741 717 HA LEU 130 HA LEU 130 6.512 6.908 5.196 718 HB2 LEU 130 1HB LEU 130 7.274 9.725 5.404 719 HB3 LEU 130 2HB LEU 130 6.913 9.229 3.763 720 HG LEU 130 HG LEU 130 5.018 8.757 6.062 721 HD11 LEU 130 1HD1 LEU 130 4.392 10.884 4.134 722 HD12 LEU 130 2HD1 LEU 130 5.724 11.241 5.233 723 HD13 LEU 130 3HD1 LEU 130 4.140 10.816 5.878 724 HD21 LEU 130 3HD2 LEU 130 4.925 7.468 3.808 725 HD22 LEU 130 1HD2 LEU 130 4.298 8.987 3.168 726 HD23 LEU 130 2HD2 LEU 130 3.446 8.162 4.473 727 H ILE 131 H ILE 131 9.678 8.406 4.507 728 HA ILE 131 HA ILE 131 9.835 7.556 1.830 729 HB ILE 131 HB ILE 131 12.162 7.980 3.708 730 HG12 ILE 131 1HG1 ILE 131 11.276 10.073 1.781 731 HG13 ILE 131 2HG1 ILE 131 10.323 9.867 3.247 732 HG21 ILE 131 1HG2 ILE 131 12.126 6.982 1.133 733 HG22 ILE 131 2HG2 ILE 131 13.517 7.681 1.960 734 HG23 ILE 131 3HG2 ILE 131 12.517 8.688 0.914 735 HD11 ILE 131 3HD1 ILE 131 12.357 11.542 3.111 736 HD12 ILE 131 1HD1 ILE 131 13.262 10.091 3.543 737 HD13 ILE 131 2HD1 ILE 131 11.966 10.666 4.591 738 H GLU 132 H GLU 132 11.140 6.068 4.796 739 HA GLU 132 HA GLU 132 12.333 3.838 3.627 740 HB2 GLU 132 1HB GLU 132 12.267 4.707 6.116 741 HB3 GLU 132 2HB GLU 132 10.937 3.566 6.255 742 HG2 GLU 132 1HG GLU 132 12.717 1.962 5.103 743 HG3 GLU 132 2HG GLU 132 13.831 3.082 5.885 744 H ALA 133 H ALA 133 8.971 4.512 4.354 745 HA ALA 133 HA ALA 133 7.957 1.894 4.150 746 HB1 ALA 133 3HB ALA 133 5.893 2.844 4.333 747 HB2 ALA 133 1HB ALA 133 6.285 4.164 3.232 748 HB3 ALA 133 2HB ALA 133 6.868 4.200 4.897 749 H TYR 134 H TYR 134 8.046 4.505 1.746 750 HA TYR 134 HA TYR 134 7.108 2.824 -0.359 751 HB2 TYR 134 1HB TYR 134 8.161 5.599 -0.165 752 HB3 TYR 134 2HB TYR 134 8.244 4.816 -1.741 753 HD1 TYR 134 HD1 TYR 134 5.811 5.417 1.036 754 HD2 TYR 134 HD2 TYR 134 6.417 4.980 -3.152 755 HE1 TYR 134 HE1 TYR 134 3.447 5.957 0.641 756 HE2 TYR 134 HE2 TYR 134 4.053 5.520 -3.555 757 HH TYR 134 HH TYR 134 2.088 6.941 -1.342 758 H GLU 135 H GLU 135 10.254 3.606 0.937 759 HA GLU 135 HA GLU 135 11.808 2.661 -1.239 760 HB2 GLU 135 1HB GLU 135 12.379 3.941 1.114 761 HB3 GLU 135 2HB GLU 135 12.961 2.315 1.447 762 HG2 GLU 135 1HG GLU 135 13.755 3.425 -1.154 763 HG3 GLU 135 2HG GLU 135 14.421 4.240 0.259 764 H ALA 136 H ALA 136 10.246 1.113 1.505 765 HA ALA 136 HA ALA 136 11.600 -1.403 1.186 766 HB1 ALA 136 3HB ALA 136 9.492 -2.134 2.606 767 HB2 ALA 136 1HB ALA 136 9.356 -0.391 2.846 768 HB3 ALA 136 2HB ALA 136 10.830 -1.235 3.322 769 H SER 137 H SER 137 8.535 -0.036 0.099 770 HA SER 137 HA SER 137 7.651 -2.491 -1.131 771 HB2 SER 137 1HB SER 137 5.683 -1.304 -1.742 772 HB3 SER 137 2HB SER 137 6.127 -0.712 -0.142 773 HG SER 137 HG SER 137 6.258 0.579 -2.623 774 H LYS 138 H LYS 138 9.603 0.179 -2.063 775 HA LYS 138 HA LYS 138 9.171 0.399 -4.791 776 HB2 LYS 138 1HB LYS 138 10.651 1.826 -3.315 777 HB3 LYS 138 2HB LYS 138 11.877 0.576 -3.479 778 HG2 LYS 138 1HG LYS 138 12.359 2.305 -5.046 779 HG3 LYS 138 2HG LYS 138 11.785 0.900 -5.942 780 HD2 LYS 138 1HD LYS 138 9.462 2.269 -5.464 781 HD3 LYS 138 2HD LYS 138 10.626 3.576 -5.692 782 HE2 LYS 138 1HE LYS 138 9.544 2.910 -7.799 783 HE3 LYS 138 2HE LYS 138 11.289 2.661 -7.831 784 HZ1 LYS 138 3HZ LYS 138 9.503 0.442 -7.070 785 HZ2 LYS 138 1HZ LYS 138 11.053 0.382 -7.745 786 HZ3 LYS 138 2HZ LYS 138 9.730 0.816 -8.704 787 H THR 139 H THR 139 10.591 -2.251 -3.095 788 HA THR 139 HA THR 139 11.935 -3.265 -5.477 789 HB THR 139 HB THR 139 11.758 -4.442 -2.695 790 HG1 THR 139 HG1 THR 139 13.796 -2.901 -3.928 791 HG21 THR 139 3HG2 THR 139 13.519 -5.177 -5.019 792 HG22 THR 139 1HG2 THR 139 12.329 -6.193 -4.205 793 HG23 THR 139 2HG2 THR 139 13.790 -5.695 -3.355 794 HA PRO 140 HA PRO 140 7.805 -5.177 -6.322 795 HB2 PRO 140 1HB PRO 140 8.851 -6.144 -8.768 796 HB3 PRO 140 2HB PRO 140 7.786 -4.760 -8.533 797 HG2 PRO 140 1HG PRO 140 10.712 -4.842 -8.939 798 HG3 PRO 140 2HG PRO 140 9.553 -3.562 -9.324 799 HD2 PRO 140 1HD PRO 140 11.289 -3.384 -7.257 800 HD3 PRO 140 2HD PRO 140 9.677 -2.640 -7.227 801 HA PRO 141 HA PRO 141 10.495 -9.394 -7.205 802 HB2 PRO 141 1HB PRO 141 12.485 -8.443 -5.176 803 HB3 PRO 141 2HB PRO 141 12.693 -9.601 -6.497 804 HG2 PRO 141 1HG PRO 141 13.538 -7.095 -6.755 805 HG3 PRO 141 2HG PRO 141 12.783 -7.949 -8.114 806 HD2 PRO 141 1HD PRO 141 11.708 -5.761 -6.433 807 HD3 PRO 141 2HD PRO 141 11.305 -6.203 -8.102 808 H ASP 142 H ASP 142 10.062 -7.553 -4.200 809 HA ASP 142 HA ASP 142 9.986 -9.475 -2.273 810 HB2 ASP 142 1HB ASP 142 8.921 -6.846 -2.576 811 HB3 ASP 142 2HB ASP 142 7.672 -7.856 -1.856 812 H LEU 143 H LEU 143 7.524 -8.873 -4.726 813 HA LEU 143 HA LEU 143 6.376 -11.492 -4.181 814 HB2 LEU 143 1HB LEU 143 5.034 -10.022 -2.800 815 HB3 LEU 143 2HB LEU 143 4.750 -8.952 -4.161 816 HG LEU 143 HG LEU 143 3.402 -10.630 -5.269 817 HD11 LEU 143 1HD1 LEU 143 4.148 -12.732 -4.855 818 HD12 LEU 143 2HD1 LEU 143 2.851 -12.680 -3.663 819 HD13 LEU 143 3HD1 LEU 143 4.517 -12.393 -3.165 820 HD21 LEU 143 3HD2 LEU 143 2.332 -10.775 -2.510 821 HD22 LEU 143 1HD2 LEU 143 1.538 -10.305 -4.012 822 HD23 LEU 143 2HD2 LEU 143 2.613 -9.173 -3.193 823 H LYS 144 H LYS 144 6.253 -8.570 -6.218 824 HA LYS 144 HA LYS 144 4.874 -9.460 -8.398 825 HB2 LYS 144 1HB LYS 144 5.935 -7.176 -8.024 826 HB3 LYS 144 2HB LYS 144 7.416 -7.860 -8.680 827 HG2 LYS 144 1HG LYS 144 5.728 -8.548 -10.637 828 HG3 LYS 144 2HG LYS 144 4.900 -7.110 -10.035 829 HD2 LYS 144 1HD LYS 144 7.351 -6.101 -10.152 830 HD3 LYS 144 2HD LYS 144 7.550 -7.370 -11.363 831 HE2 LYS 144 1HE LYS 144 5.083 -6.155 -11.926 832 HE3 LYS 144 2HE LYS 144 6.197 -4.835 -11.579 833 HZ1 LYS 144 3HZ LYS 144 6.189 -6.728 -13.793 834 HZ2 LYS 144 1HZ LYS 144 7.709 -6.296 -13.186 835 HZ3 LYS 144 2HZ LYS 144 6.657 -5.104 -13.760 836 H GLU 145 H GLU 145 8.325 -10.063 -7.736 837 HA GLU 145 HA GLU 145 8.853 -11.426 -10.157 838 HB2 GLU 145 1HB GLU 145 10.639 -10.495 -8.772 839 HB3 GLU 145 2HB GLU 145 10.256 -11.628 -7.485 840 HG2 GLU 145 1HG GLU 145 11.408 -13.287 -8.440 841 HG3 GLU 145 2HG GLU 145 10.812 -12.905 -10.055 842 H GLU 146 H GLU 146 8.675 -12.874 -6.888 843 HA GLU 146 HA GLU 146 7.842 -14.855 -6.140 844 HB2 GLU 146 1HB GLU 146 5.831 -14.076 -7.511 845 HB3 GLU 146 2HB GLU 146 6.398 -15.166 -8.768 846 HG2 GLU 146 1HG GLU 146 4.971 -16.574 -7.731 847 HG3 GLU 146 2HG GLU 146 6.390 -16.876 -6.728 848 H SER 147 H SER 147 8.461 -17.013 -6.136 849 HA SER 147 HA SER 147 9.643 -18.166 -8.521 850 HB2 SER 147 1HB SER 147 11.715 -18.770 -7.000 851 HB3 SER 147 2HB SER 147 11.652 -17.236 -7.868 852 HG SER 147 HG SER 147 10.854 -17.619 -5.165 853 H SER 148 H SER 148 8.323 -19.923 -8.521 854 HA SER 148 HA SER 148 8.801 -21.933 -6.498 855 HB2 SER 148 1HB SER 148 6.020 -20.818 -6.942 856 HB3 SER 148 2HB SER 148 6.360 -22.316 -6.081 857 HG SER 148 HG SER 148 7.812 -20.854 -4.762 858 H THR 149 H THR 149 9.666 -23.221 -8.100 859 HA THR 149 HA THR 149 7.732 -24.578 -9.783 860 HB THR 149 HB THR 149 9.531 -24.324 -11.721 861 HG1 THR 149 HG1 THR 149 10.580 -22.414 -11.693 862 HG21 THR 149 3HG2 THR 149 7.034 -23.315 -11.349 863 HG22 THR 149 1HG2 THR 149 8.004 -23.122 -12.811 864 HG23 THR 149 2HG2 THR 149 7.987 -21.850 -11.588 865 H ASP 150 H ASP 150 11.298 -24.304 -9.574 866 HA ASP 150 HA ASP 150 11.445 -27.053 -8.615 867 HB2 ASP 150 1HB ASP 150 12.324 -26.145 -11.299 868 HB3 ASP 150 2HB ASP 150 13.437 -27.198 -10.430 869 H LEU 151 H LEU 151 13.612 -27.632 -7.831 870 HA LEU 151 HA LEU 151 14.741 -25.608 -6.238 871 HB2 LEU 151 1HB LEU 151 14.825 -28.263 -6.117 872 HB3 LEU 151 2HB LEU 151 16.360 -28.010 -6.926 873 HG LEU 151 HG LEU 151 16.647 -26.253 -4.911 874 HD11 LEU 151 1HD1 LEU 151 15.814 -27.774 -2.897 875 HD12 LEU 151 2HD1 LEU 151 14.549 -28.164 -4.062 876 HD13 LEU 151 3HD1 LEU 151 14.821 -26.490 -3.585 877 HD21 LEU 151 3HD2 LEU 151 17.198 -29.061 -4.162 878 HD22 LEU 151 1HD2 LEU 151 18.263 -27.657 -4.170 879 HD23 LEU 151 2HD2 LEU 151 17.891 -28.489 -5.679 880 H GLU 152 H GLU 152 15.700 -26.940 -9.368 881 HA GLU 152 HA GLU 152 17.742 -24.825 -9.563 882 HB2 GLU 152 1HB GLU 152 18.296 -27.468 -9.578 883 HB3 GLU 152 2HB GLU 152 18.008 -27.214 -11.294 884 HG2 GLU 152 1HG GLU 152 19.743 -25.596 -11.427 885 HG3 GLU 152 2HG GLU 152 19.921 -25.553 -9.675 Start of MODEL 12 1 H1 SER 45 1H SER 45 -10.952 2.655 -19.518 2 H2 SER 45 2H SER 45 -9.422 1.901 -19.701 3 H3 SER 45 3H SER 45 -10.009 2.961 -20.916 4 HA SER 45 HA SER 45 -8.449 4.170 -19.753 5 HB2 SER 45 1HB SER 45 -9.915 5.869 -18.570 6 HB3 SER 45 2HB SER 45 -10.423 5.460 -20.209 7 HG SER 45 HG SER 45 -11.531 4.533 -17.766 8 H ALA 46 H ALA 46 -7.611 5.023 -17.721 9 HA ALA 46 HA ALA 46 -6.793 4.809 -15.614 10 HB1 ALA 46 3HB ALA 46 -9.489 3.555 -15.115 11 HB2 ALA 46 1HB ALA 46 -9.029 5.236 -14.857 12 HB3 ALA 46 2HB ALA 46 -8.332 3.968 -13.850 13 H ASP 47 H ASP 47 -6.413 3.057 -13.784 14 HA ASP 47 HA ASP 47 -6.094 0.396 -14.947 15 HB2 ASP 47 1HB ASP 47 -3.806 1.979 -13.757 16 HB3 ASP 47 2HB ASP 47 -3.729 0.288 -14.245 17 H ASP 48 H ASP 48 -7.963 0.528 -13.256 18 HA ASP 48 HA ASP 48 -6.954 0.147 -10.534 19 HB2 ASP 48 1HB ASP 48 -8.967 1.634 -11.080 20 HB3 ASP 48 2HB ASP 48 -9.851 0.141 -11.382 21 H ARG 49 H ARG 49 -6.452 -1.833 -12.630 22 HA ARG 49 HA ARG 49 -8.152 -4.077 -11.836 23 HB2 ARG 49 1HB ARG 49 -6.901 -5.291 -13.674 24 HB3 ARG 49 2HB ARG 49 -7.908 -3.948 -14.194 25 HG2 ARG 49 1HG ARG 49 -5.999 -2.538 -14.487 26 HG3 ARG 49 2HG ARG 49 -4.937 -3.742 -13.755 27 HD2 ARG 49 1HD ARG 49 -5.797 -5.276 -15.668 28 HD3 ARG 49 2HD ARG 49 -6.262 -3.759 -16.436 29 HE ARG 49 HE ARG 49 -3.536 -3.813 -15.517 30 HH11 ARG 49 1HH1 ARG 49 -5.669 -4.585 -18.189 31 HH12 ARG 49 2HH1 ARG 49 -4.411 -4.510 -19.373 32 HH21 ARG 49 1HH2 ARG 49 -1.884 -3.717 -17.085 33 HH22 ARG 49 2HH2 ARG 49 -2.262 -4.018 -18.748 34 H LEU 50 H LEU 50 -7.101 -3.847 -9.657 35 HA LEU 50 HA LEU 50 -4.381 -4.590 -9.299 36 HB2 LEU 50 1HB LEU 50 -6.563 -4.886 -7.245 37 HB3 LEU 50 2HB LEU 50 -4.848 -4.661 -6.965 38 HG LEU 50 HG LEU 50 -6.708 -2.583 -8.127 39 HD11 LEU 50 1HD1 LEU 50 -5.830 -1.539 -5.811 40 HD12 LEU 50 2HD1 LEU 50 -5.886 -3.248 -5.376 41 HD13 LEU 50 3HD1 LEU 50 -7.337 -2.442 -5.968 42 HD21 LEU 50 3HD2 LEU 50 -4.940 -1.267 -8.533 43 HD22 LEU 50 1HD2 LEU 50 -4.016 -2.769 -8.519 44 HD23 LEU 50 2HD2 LEU 50 -4.101 -1.772 -7.067 45 H ASN 51 H ASN 51 -3.527 -6.538 -8.430 46 HA ASN 51 HA ASN 51 -5.199 -8.908 -8.394 47 HB2 ASN 51 1HB ASN 51 -4.080 -8.282 -10.792 48 HB3 ASN 51 2HB ASN 51 -2.799 -9.260 -10.084 49 HD21 ASN 51 2HD2 ASN 51 -2.916 -11.340 -10.510 50 HD22 ASN 51 1HD2 ASN 51 -4.365 -12.232 -10.858 51 H PHE 52 H PHE 52 -3.441 -10.898 -8.236 52 HA PHE 52 HA PHE 52 -2.255 -10.571 -5.686 53 HB2 PHE 52 1HB PHE 52 -1.664 -12.803 -7.640 54 HB3 PHE 52 2HB PHE 52 -1.541 -12.850 -5.881 55 HD1 PHE 52 HD1 PHE 52 -4.072 -11.670 -5.039 56 HD2 PHE 52 HD2 PHE 52 -3.252 -14.385 -8.213 57 HE1 PHE 52 HE1 PHE 52 -6.375 -12.511 -4.907 58 HE2 PHE 52 HE2 PHE 52 -5.557 -15.235 -8.084 59 HZ PHE 52 HZ PHE 52 -7.123 -14.296 -6.429 60 H GLY 53 H GLY 53 -0.256 -10.012 -5.085 61 HA2 GLY 53 1HA GLY 53 2.007 -9.558 -5.210 62 HA3 GLY 53 2HA GLY 53 2.024 -10.277 -6.814 63 H ASP 54 H ASP 54 -0.168 -7.684 -5.954 64 HA ASP 54 HA ASP 54 1.380 -5.869 -7.681 65 HB2 ASP 54 1HB ASP 54 -0.977 -6.753 -8.411 66 HB3 ASP 54 2HB ASP 54 -1.577 -5.568 -7.256 67 H ARG 55 H ARG 55 2.198 -4.159 -6.675 68 HA ARG 55 HA ARG 55 1.685 -3.568 -3.967 69 HB2 ARG 55 1HB ARG 55 2.997 -1.458 -4.429 70 HB3 ARG 55 2HB ARG 55 3.819 -2.961 -4.813 71 HG2 ARG 55 1HG ARG 55 2.323 -1.730 -7.032 72 HG3 ARG 55 2HG ARG 55 3.726 -0.830 -6.452 73 HD2 ARG 55 1HD ARG 55 4.605 -3.458 -6.585 74 HD3 ARG 55 2HD ARG 55 3.597 -3.267 -8.018 75 HE ARG 55 HE ARG 55 5.465 -1.118 -7.649 76 HH11 ARG 55 1HH1 ARG 55 5.041 -4.337 -8.962 77 HH12 ARG 55 2HH1 ARG 55 6.327 -4.174 -10.109 78 HH21 ARG 55 1HH2 ARG 55 7.166 -0.909 -9.162 79 HH22 ARG 55 2HH2 ARG 55 7.533 -2.227 -10.222 80 H ILE 56 H ILE 56 -0.017 -2.629 -3.109 81 HA ILE 56 HA ILE 56 -1.406 -0.519 -4.631 82 HB ILE 56 HB ILE 56 -3.552 -1.274 -3.734 83 HG12 ILE 56 1HG1 ILE 56 -2.044 -3.696 -2.713 84 HG13 ILE 56 2HG1 ILE 56 -2.649 -2.392 -1.696 85 HG21 ILE 56 1HG2 ILE 56 -2.313 -3.661 -5.050 86 HG22 ILE 56 2HG2 ILE 56 -2.479 -2.135 -5.918 87 HG23 ILE 56 3HG2 ILE 56 -3.910 -2.954 -5.294 88 HD11 ILE 56 3HD1 ILE 56 -3.985 -4.718 -2.511 89 HD12 ILE 56 1HD1 ILE 56 -4.774 -3.370 -3.327 90 HD13 ILE 56 2HD1 ILE 56 -4.624 -3.371 -1.572 91 H LEU 57 H LEU 57 -2.520 1.068 -3.351 92 HA LEU 57 HA LEU 57 -1.161 1.551 -0.809 93 HB2 LEU 57 1HB LEU 57 -1.926 3.203 -2.919 94 HB3 LEU 57 2HB LEU 57 -3.063 3.585 -1.641 95 HG LEU 57 HG LEU 57 -1.068 3.936 -0.122 96 HD11 LEU 57 1HD1 LEU 57 0.336 2.784 -2.179 97 HD12 LEU 57 2HD1 LEU 57 1.030 3.699 -0.841 98 HD13 LEU 57 3HD1 LEU 57 0.690 4.499 -2.375 99 HD21 LEU 57 3HD2 LEU 57 -2.370 5.766 -1.148 100 HD22 LEU 57 1HD2 LEU 57 -1.270 5.746 -2.526 101 HD23 LEU 57 2HD2 LEU 57 -0.671 6.179 -0.926 102 H VAL 58 H VAL 58 -2.231 1.822 1.143 103 HA VAL 58 HA VAL 58 -5.129 1.394 1.177 104 HB VAL 58 HB VAL 58 -4.142 -0.832 1.427 105 HG11 VAL 58 1HG1 VAL 58 -2.796 -1.402 3.384 106 HG12 VAL 58 2HG1 VAL 58 -2.782 0.292 3.872 107 HG13 VAL 58 3HG1 VAL 58 -1.990 -0.201 2.376 108 HG21 VAL 58 3HG2 VAL 58 -5.610 0.423 3.700 109 HG22 VAL 58 1HG2 VAL 58 -5.090 -1.257 3.827 110 HG23 VAL 58 2HG2 VAL 58 -6.161 -0.761 2.517 111 H LYS 59 H LYS 59 -6.142 2.638 2.622 112 HA LYS 59 HA LYS 59 -4.531 4.318 4.376 113 HB2 LYS 59 1HB LYS 59 -6.615 4.938 2.792 114 HB3 LYS 59 2HB LYS 59 -7.484 4.605 4.283 115 HG2 LYS 59 1HG LYS 59 -5.233 6.262 4.867 116 HG3 LYS 59 2HG LYS 59 -6.150 6.964 3.532 117 HD2 LYS 59 1HD LYS 59 -8.186 6.322 5.134 118 HD3 LYS 59 2HD LYS 59 -6.933 6.527 6.359 119 HE2 LYS 59 1HE LYS 59 -7.070 8.634 4.301 120 HE3 LYS 59 2HE LYS 59 -8.454 8.541 5.389 121 HZ1 LYS 59 3HZ LYS 59 -7.234 9.217 7.143 122 HZ2 LYS 59 1HZ LYS 59 -6.257 9.911 5.949 123 HZ3 LYS 59 2HZ LYS 59 -5.824 8.427 6.638 124 H ALA 60 H ALA 60 -4.118 3.618 6.364 125 HA ALA 60 HA ALA 60 -5.712 1.592 7.636 126 HB1 ALA 60 3HB ALA 60 -3.807 2.960 9.361 127 HB2 ALA 60 1HB ALA 60 -3.092 2.408 7.846 128 HB3 ALA 60 2HB ALA 60 -3.906 1.259 8.907 129 HA PRO 61 HA PRO 61 -8.491 3.955 10.112 130 HB2 PRO 61 1HB PRO 61 -8.169 2.900 12.623 131 HB3 PRO 61 2HB PRO 61 -9.089 2.118 11.334 132 HG2 PRO 61 1HG PRO 61 -6.282 1.611 12.235 133 HG3 PRO 61 2HG PRO 61 -7.540 0.447 11.780 134 HD2 PRO 61 1HD PRO 61 -5.553 1.112 10.098 135 HD3 PRO 61 2HD PRO 61 -7.193 0.769 9.512 136 H GLY 62 H GLY 62 -7.990 6.050 10.380 137 HA2 GLY 62 1HA GLY 62 -7.268 7.947 11.472 138 HA3 GLY 62 2HA GLY 62 -6.653 6.915 12.754 139 H TYR 63 H TYR 63 -5.625 6.330 9.487 140 HA TYR 63 HA TYR 63 -3.169 7.863 9.844 141 HB2 TYR 63 1HB TYR 63 -3.245 4.861 9.466 142 HB3 TYR 63 2HB TYR 63 -1.799 5.839 9.247 143 HD1 TYR 63 HD1 TYR 63 -1.086 7.295 11.293 144 HD2 TYR 63 HD2 TYR 63 -3.712 3.957 11.559 145 HE1 TYR 63 HE1 TYR 63 -0.586 7.100 13.691 146 HE2 TYR 63 HE2 TYR 63 -3.220 3.755 13.959 147 HH TYR 63 HH TYR 63 -0.677 5.040 15.433 148 HA PRO 64 HA PRO 64 -3.469 8.495 5.490 149 HB2 PRO 64 1HB PRO 64 -0.854 8.469 4.704 150 HB3 PRO 64 2HB PRO 64 -1.598 9.816 5.571 151 HG2 PRO 64 1HG PRO 64 0.110 7.597 6.623 152 HG3 PRO 64 2HG PRO 64 0.144 9.324 7.024 153 HD2 PRO 64 1HD PRO 64 -1.029 7.494 8.625 154 HD3 PRO 64 2HD PRO 64 -1.641 9.153 8.473 155 H TRP 65 H TRP 65 -2.243 7.618 3.334 156 HA TRP 65 HA TRP 65 -2.916 4.804 3.256 157 HB2 TRP 65 1HB TRP 65 -1.904 6.571 1.017 158 HB3 TRP 65 2HB TRP 65 -2.654 4.988 0.846 159 HD1 TRP 65 HD1 TRP 65 -3.620 8.522 2.133 160 HE1 TRP 65 HE1 TRP 65 -6.108 8.903 1.610 161 HE3 TRP 65 HE3 TRP 65 -4.746 3.943 0.152 162 HZ2 TRP 65 HZ2 TRP 65 -8.263 7.459 0.504 163 HZ3 TRP 65 HZ3 TRP 65 -7.047 3.530 -0.615 164 HH2 TRP 65 HH2 TRP 65 -8.767 5.250 -0.443 165 H TRP 66 H TRP 66 -1.526 3.135 3.228 166 HA TRP 66 HA TRP 66 1.351 3.759 3.138 167 HB2 TRP 66 1HB TRP 66 0.031 2.542 5.158 168 HB3 TRP 66 2HB TRP 66 0.467 1.134 4.192 169 HD1 TRP 66 HD1 TRP 66 2.705 0.118 4.880 170 HE1 TRP 66 HE1 TRP 66 4.895 0.990 5.915 171 HE3 TRP 66 HE3 TRP 66 1.512 5.075 5.250 172 HZ2 TRP 66 HZ2 TRP 66 5.969 3.450 6.778 173 HZ3 TRP 66 HZ3 TRP 66 3.180 6.620 6.186 174 HH2 TRP 66 HH2 TRP 66 5.366 5.820 6.925 175 HA PRO 67 HA PRO 67 1.646 1.319 -0.555 176 HB2 PRO 67 1HB PRO 67 4.292 0.893 -0.641 177 HB3 PRO 67 2HB PRO 67 3.609 2.509 -0.869 178 HG2 PRO 67 1HG PRO 67 4.834 1.298 1.583 179 HG3 PRO 67 2HG PRO 67 5.074 2.915 0.897 180 HD2 PRO 67 1HD PRO 67 3.394 2.399 2.986 181 HD3 PRO 67 2HD PRO 67 3.153 3.736 1.848 182 H ALA 68 H ALA 68 0.460 -0.514 0.246 183 HA ALA 68 HA ALA 68 2.082 -2.696 1.361 184 HB1 ALA 68 3HB ALA 68 -0.920 -2.550 1.078 185 HB2 ALA 68 1HB ALA 68 -0.025 -2.066 2.518 186 HB3 ALA 68 2HB ALA 68 0.009 -3.744 1.983 187 H LEU 69 H LEU 69 1.438 -4.944 0.495 188 HA LEU 69 HA LEU 69 1.140 -4.780 -2.437 189 HB2 LEU 69 1HB LEU 69 3.240 -5.900 -0.869 190 HB3 LEU 69 2HB LEU 69 2.417 -7.215 -1.684 191 HG LEU 69 HG LEU 69 3.122 -4.865 -3.350 192 HD11 LEU 69 1HD1 LEU 69 5.127 -6.589 -1.981 193 HD12 LEU 69 2HD1 LEU 69 5.197 -4.874 -2.379 194 HD13 LEU 69 3HD1 LEU 69 5.423 -6.082 -3.642 195 HD21 LEU 69 3HD2 LEU 69 2.094 -6.591 -4.524 196 HD22 LEU 69 1HD2 LEU 69 2.980 -7.843 -3.654 197 HD23 LEU 69 2HD2 LEU 69 3.809 -6.843 -4.847 198 H LEU 70 H LEU 70 -0.650 -5.679 -3.186 199 HA LEU 70 HA LEU 70 -2.466 -7.112 -1.585 200 HB2 LEU 70 1HB LEU 70 -2.688 -5.816 -3.916 201 HB3 LEU 70 2HB LEU 70 -2.578 -7.452 -4.532 202 HG LEU 70 HG LEU 70 -4.608 -6.572 -2.480 203 HD11 LEU 70 1HD1 LEU 70 -5.340 -5.390 -4.300 204 HD12 LEU 70 2HD1 LEU 70 -6.129 -6.940 -4.582 205 HD13 LEU 70 3HD1 LEU 70 -4.655 -6.530 -5.457 206 HD21 LEU 70 3HD2 LEU 70 -4.640 -8.817 -2.220 207 HD22 LEU 70 1HD2 LEU 70 -3.933 -9.125 -3.805 208 HD23 LEU 70 2HD2 LEU 70 -5.649 -8.743 -3.665 209 H LEU 71 H LEU 71 -2.571 -9.177 -1.027 210 HA LEU 71 HA LEU 71 -0.795 -11.092 -2.370 211 HB2 LEU 71 1HB LEU 71 -2.127 -11.167 0.337 212 HB3 LEU 71 2HB LEU 71 -1.205 -12.498 -0.334 213 HG LEU 71 HG LEU 71 0.274 -9.975 -0.332 214 HD11 LEU 71 1HD1 LEU 71 0.291 -9.420 1.843 215 HD12 LEU 71 2HD1 LEU 71 0.118 -11.090 2.383 216 HD13 LEU 71 3HD1 LEU 71 -1.300 -10.182 1.854 217 HD21 LEU 71 3HD2 LEU 71 0.891 -12.592 -0.539 218 HD22 LEU 71 1HD2 LEU 71 1.208 -12.325 1.176 219 HD23 LEU 71 2HD2 LEU 71 2.035 -11.348 -0.038 220 H ARG 72 H ARG 72 -4.096 -10.904 -1.009 221 HA ARG 72 HA ARG 72 -5.174 -12.343 -3.246 222 HB2 ARG 72 1HB ARG 72 -4.413 -13.787 -0.867 223 HB3 ARG 72 2HB ARG 72 -6.149 -13.890 -1.114 224 HG2 ARG 72 1HG ARG 72 -5.087 -14.351 -3.631 225 HG3 ARG 72 2HG ARG 72 -3.994 -15.194 -2.533 226 HD2 ARG 72 1HD ARG 72 -6.432 -15.878 -1.520 227 HD3 ARG 72 2HD ARG 72 -6.779 -15.778 -3.245 228 HE ARG 72 HE ARG 72 -5.538 -17.672 -3.569 229 HH11 ARG 72 1HH1 ARG 72 -4.805 -16.387 -0.396 230 HH12 ARG 72 2HH1 ARG 72 -3.871 -17.762 0.084 231 HH21 ARG 72 1HH2 ARG 72 -4.297 -19.485 -2.934 232 HH22 ARG 72 2HH2 ARG 72 -3.582 -19.523 -1.358 233 H ARG 73 H ARG 73 -7.514 -12.500 -3.197 234 HA ARG 73 HA ARG 73 -8.688 -10.346 -1.588 235 HB2 ARG 73 1HB ARG 73 -8.877 -10.364 -4.125 236 HB3 ARG 73 2HB ARG 73 -9.951 -11.744 -3.944 237 HG2 ARG 73 1HG ARG 73 -11.320 -10.234 -2.390 238 HG3 ARG 73 2HG ARG 73 -10.385 -8.908 -3.082 239 HD2 ARG 73 1HD ARG 73 -12.336 -9.027 -4.382 240 HD3 ARG 73 2HD ARG 73 -11.084 -9.800 -5.354 241 HE ARG 73 HE ARG 73 -12.600 -11.636 -3.735 242 HH11 ARG 73 1HH1 ARG 73 -12.476 -9.955 -6.807 243 HH12 ARG 73 2HH1 ARG 73 -13.477 -11.107 -7.619 244 HH21 ARG 73 1HH2 ARG 73 -13.925 -13.155 -4.814 245 HH22 ARG 73 2HH2 ARG 73 -14.301 -12.923 -6.489 246 H LYS 74 H LYS 74 -9.139 -11.335 0.347 247 HA LYS 74 HA LYS 74 -10.648 -13.828 0.351 248 HB2 LYS 74 1HB LYS 74 -10.443 -13.553 2.884 249 HB3 LYS 74 2HB LYS 74 -8.965 -13.862 1.985 250 HG2 LYS 74 1HG LYS 74 -8.218 -11.657 2.227 251 HG3 LYS 74 2HG LYS 74 -9.817 -11.077 2.698 252 HD2 LYS 74 1HD LYS 74 -8.198 -13.025 4.333 253 HD3 LYS 74 2HD LYS 74 -8.161 -11.277 4.575 254 HE2 LYS 74 1HE LYS 74 -10.878 -12.034 4.491 255 HE3 LYS 74 2HE LYS 74 -10.058 -13.194 5.536 256 HZ1 LYS 74 3HZ LYS 74 -9.122 -11.294 6.765 257 HZ2 LYS 74 1HZ LYS 74 -10.810 -11.348 6.836 258 HZ3 LYS 74 2HZ LYS 74 -10.041 -10.239 5.818 259 H GLU 75 H GLU 75 -12.736 -13.591 -0.081 260 HA GLU 75 HA GLU 75 -14.214 -11.300 0.968 261 HB2 GLU 75 1HB GLU 75 -14.341 -12.217 -1.459 262 HB3 GLU 75 2HB GLU 75 -15.371 -13.461 -0.765 263 HG2 GLU 75 1HG GLU 75 -16.591 -11.317 0.236 264 HG3 GLU 75 2HG GLU 75 -15.893 -10.587 -1.208 265 H THR 76 H THR 76 -15.331 -11.455 2.815 266 HA THR 76 HA THR 76 -16.391 -14.086 3.589 267 HB THR 76 HB THR 76 -14.430 -13.683 4.955 268 HG1 THR 76 HG1 THR 76 -15.401 -13.895 6.945 269 HG21 THR 76 3HG2 THR 76 -14.014 -11.414 5.039 270 HG22 THR 76 1HG2 THR 76 -14.603 -11.768 6.664 271 HG23 THR 76 2HG2 THR 76 -15.675 -11.021 5.481 272 H LYS 77 H LYS 77 -18.396 -14.131 4.501 273 HA LYS 77 HA LYS 77 -19.816 -11.554 4.691 274 HB2 LYS 77 1HB LYS 77 -21.879 -12.846 4.084 275 HB3 LYS 77 2HB LYS 77 -20.681 -12.743 2.801 276 HG2 LYS 77 1HG LYS 77 -20.238 -14.971 2.845 277 HG3 LYS 77 2HG LYS 77 -20.563 -15.115 4.574 278 HD2 LYS 77 1HD LYS 77 -22.316 -16.274 3.518 279 HD3 LYS 77 2HD LYS 77 -23.008 -14.721 3.985 280 HE2 LYS 77 1HE LYS 77 -22.046 -14.184 1.484 281 HE3 LYS 77 2HE LYS 77 -22.549 -15.866 1.323 282 HZ1 LYS 77 3HZ LYS 77 -24.410 -14.016 2.621 283 HZ2 LYS 77 1HZ LYS 77 -24.725 -15.339 1.612 284 HZ3 LYS 77 2HZ LYS 77 -24.213 -13.874 0.948 285 H ASP 78 H ASP 78 -22.052 -12.100 5.963 286 HA ASP 78 HA ASP 78 -23.048 -12.577 7.943 287 HB2 ASP 78 1HB ASP 78 -21.940 -14.928 7.349 288 HB3 ASP 78 2HB ASP 78 -20.960 -14.544 8.759 289 H SER 79 H SER 79 -22.323 -10.422 8.454 290 HA SER 79 HA SER 79 -20.002 -10.207 10.206 291 HB2 SER 79 1HB SER 79 -20.913 -8.515 8.306 292 HB3 SER 79 2HB SER 79 -21.715 -7.832 9.721 293 HG SER 79 HG SER 79 -18.932 -8.279 9.377 294 H LEU 80 H LEU 80 -22.188 -11.746 11.189 295 HA LEU 80 HA LEU 80 -23.430 -12.056 13.067 296 HB2 LEU 80 1HB LEU 80 -22.204 -9.580 14.244 297 HB3 LEU 80 2HB LEU 80 -22.711 -11.044 15.062 298 HG LEU 80 HG LEU 80 -20.431 -11.145 13.119 299 HD11 LEU 80 1HD1 LEU 80 -20.113 -10.448 16.029 300 HD12 LEU 80 2HD1 LEU 80 -20.047 -9.262 14.725 301 HD13 LEU 80 3HD1 LEU 80 -18.856 -10.561 14.799 302 HD21 LEU 80 3HD2 LEU 80 -19.945 -13.142 14.085 303 HD22 LEU 80 1HD2 LEU 80 -21.677 -13.108 14.412 304 HD23 LEU 80 2HD2 LEU 80 -20.534 -12.646 15.672 305 H ASN 81 H ASN 81 -24.438 -10.334 10.906 306 HA ASN 81 HA ASN 81 -26.256 -8.575 12.413 307 HB2 ASN 81 1HB ASN 81 -24.693 -7.969 10.225 308 HB3 ASN 81 2HB ASN 81 -26.260 -8.297 9.494 309 HD21 ASN 81 2HD2 ASN 81 -28.136 -7.209 10.691 310 HD22 ASN 81 1HD2 ASN 81 -27.872 -5.554 11.147 311 H THR 82 H THR 82 -26.082 -11.258 10.169 312 HA THR 82 HA THR 82 -27.626 -12.637 9.248 313 HB THR 82 HB THR 82 -29.276 -13.503 10.707 314 HG1 THR 82 HG1 THR 82 -30.353 -12.358 12.131 315 HG21 THR 82 3HG2 THR 82 -28.116 -14.075 12.575 316 HG22 THR 82 1HG2 THR 82 -27.498 -12.443 12.830 317 HG23 THR 82 2HG2 THR 82 -26.799 -13.465 11.572 318 H ASN 83 H ASN 83 -27.781 -9.829 8.457 319 HA ASN 83 HA ASN 83 -30.492 -9.877 7.367 320 HB2 ASN 83 1HB ASN 83 -29.360 -7.727 9.108 321 HB3 ASN 83 2HB ASN 83 -30.393 -7.250 7.767 322 HD21 ASN 83 2HD2 ASN 83 -30.930 -6.877 10.529 323 HD22 ASN 83 1HD2 ASN 83 -32.367 -7.776 10.904 324 H SER 84 H SER 84 -28.290 -10.631 5.985 325 HA SER 84 HA SER 84 -27.159 -10.320 4.045 326 HB2 SER 84 1HB SER 84 -29.427 -8.417 3.832 327 HB3 SER 84 2HB SER 84 -28.095 -8.190 2.699 328 HG SER 84 HG SER 84 -28.405 -10.248 1.936 329 H SER 85 H SER 85 -25.174 -9.832 4.980 330 HA SER 85 HA SER 85 -24.297 -7.090 4.561 331 HB2 SER 85 1HB SER 85 -24.265 -8.481 7.223 332 HB3 SER 85 2HB SER 85 -23.023 -7.292 6.830 333 HG SER 85 HG SER 85 -25.341 -6.756 7.798 334 H PHE 86 H PHE 86 -22.631 -7.298 3.213 335 HA PHE 86 HA PHE 86 -20.916 -9.668 3.394 336 HB2 PHE 86 1HB PHE 86 -21.570 -7.723 1.224 337 HB3 PHE 86 2HB PHE 86 -20.002 -8.520 1.181 338 HD1 PHE 86 HD1 PHE 86 -23.650 -9.152 1.276 339 HD2 PHE 86 HD2 PHE 86 -19.788 -10.715 0.403 340 HE1 PHE 86 HE1 PHE 86 -24.687 -11.121 0.230 341 HE2 PHE 86 HE2 PHE 86 -20.820 -12.686 -0.646 342 HZ PHE 86 HZ PHE 86 -23.270 -12.892 -0.735 343 H ASN 87 H ASN 87 -18.668 -9.524 3.578 344 HA ASN 87 HA ASN 87 -17.547 -6.873 4.138 345 HB2 ASN 87 1HB ASN 87 -17.118 -9.304 5.891 346 HB3 ASN 87 2HB ASN 87 -16.374 -7.725 6.113 347 HD21 ASN 87 2HD2 ASN 87 -17.423 -6.228 7.273 348 HD22 ASN 87 1HD2 ASN 87 -19.042 -6.401 7.880 349 H VAL 88 H VAL 88 -16.637 -7.111 2.028 350 HA VAL 88 HA VAL 88 -14.612 -9.192 1.694 351 HB VAL 88 HB VAL 88 -16.025 -8.859 -0.222 352 HG11 VAL 88 1HG1 VAL 88 -15.280 -5.975 0.089 353 HG12 VAL 88 2HG1 VAL 88 -16.877 -6.702 -0.085 354 HG13 VAL 88 3HG1 VAL 88 -15.793 -6.613 -1.472 355 HG21 VAL 88 3HG2 VAL 88 -14.400 -8.863 -1.845 356 HG22 VAL 88 1HG2 VAL 88 -13.434 -9.158 -0.400 357 HG23 VAL 88 2HG2 VAL 88 -13.500 -7.541 -1.103 358 H LEU 89 H LEU 89 -12.464 -8.832 1.691 359 HA LEU 89 HA LEU 89 -11.502 -6.062 1.867 360 HB2 LEU 89 1HB LEU 89 -10.282 -8.172 3.605 361 HB3 LEU 89 2HB LEU 89 -10.202 -6.430 3.760 362 HG LEU 89 HG LEU 89 -12.721 -8.015 4.242 363 HD11 LEU 89 1HD1 LEU 89 -11.460 -8.811 5.972 364 HD12 LEU 89 2HD1 LEU 89 -12.057 -7.317 6.693 365 HD13 LEU 89 3HD1 LEU 89 -10.427 -7.383 6.024 366 HD21 LEU 89 3HD2 LEU 89 -13.720 -6.069 4.756 367 HD22 LEU 89 1HD2 LEU 89 -12.444 -5.361 3.768 368 HD23 LEU 89 2HD2 LEU 89 -12.275 -5.408 5.522 369 H TYR 90 H TYR 90 -8.969 -6.123 1.876 370 HA TYR 90 HA TYR 90 -8.095 -8.029 -0.195 371 HB2 TYR 90 1HB TYR 90 -7.947 -5.089 -0.073 372 HB3 TYR 90 2HB TYR 90 -6.448 -5.880 -0.548 373 HD1 TYR 90 HD2 TYR 90 -7.515 -8.204 -2.046 374 HD2 TYR 90 HD1 TYR 90 -8.707 -4.121 -2.068 375 HE1 TYR 90 HE2 TYR 90 -8.374 -8.476 -4.322 376 HE2 TYR 90 HE1 TYR 90 -9.572 -4.381 -4.354 377 HH TYR 90 HH TYR 90 -10.468 -6.538 -5.751 378 H LYS 91 H LYS 91 -6.688 -9.415 0.682 379 HA LYS 91 HA LYS 91 -5.225 -8.875 3.064 380 HB2 LYS 91 1HB LYS 91 -5.462 -11.120 1.150 381 HB3 LYS 91 2HB LYS 91 -3.940 -11.027 2.025 382 HG2 LYS 91 1HG LYS 91 -6.008 -10.644 3.908 383 HG3 LYS 91 2HG LYS 91 -6.457 -12.021 2.903 384 HD2 LYS 91 1HD LYS 91 -3.680 -11.810 3.995 385 HD3 LYS 91 2HD LYS 91 -4.989 -12.386 5.026 386 HE2 LYS 91 1HE LYS 91 -5.256 -14.321 3.850 387 HE3 LYS 91 2HE LYS 91 -4.740 -13.595 2.328 388 HZ1 LYS 91 3HZ LYS 91 -3.235 -15.283 3.682 389 HZ2 LYS 91 1HZ LYS 91 -2.720 -13.850 4.421 390 HZ3 LYS 91 2HZ LYS 91 -2.574 -14.040 2.746 391 H VAL 92 H VAL 92 -3.934 -7.065 2.779 392 HA VAL 92 HA VAL 92 -1.832 -7.253 0.721 393 HB VAL 92 HB VAL 92 -1.575 -4.874 0.827 394 HG11 VAL 92 1HG1 VAL 92 -4.289 -5.988 0.440 395 HG12 VAL 92 2HG1 VAL 92 -3.228 -5.154 -0.692 396 HG13 VAL 92 3HG1 VAL 92 -4.142 -4.233 0.501 397 HG21 VAL 92 3HG2 VAL 92 -3.070 -3.496 2.306 398 HG22 VAL 92 1HG2 VAL 92 -1.827 -4.417 3.156 399 HG23 VAL 92 2HG2 VAL 92 -3.498 -4.984 3.148 400 H LEU 93 H LEU 93 0.326 -6.699 1.258 401 HA LEU 93 HA LEU 93 0.981 -7.133 4.099 402 HB2 LEU 93 1HB LEU 93 2.136 -8.058 1.579 403 HB3 LEU 93 2HB LEU 93 3.336 -7.375 2.659 404 HG LEU 93 HG LEU 93 1.418 -9.510 3.564 405 HD11 LEU 93 1HD1 LEU 93 3.113 -11.162 3.088 406 HD12 LEU 93 2HD1 LEU 93 4.176 -9.923 2.423 407 HD13 LEU 93 3HD1 LEU 93 2.667 -10.321 1.604 408 HD21 LEU 93 3HD2 LEU 93 4.150 -8.734 4.575 409 HD22 LEU 93 1HD2 LEU 93 3.022 -9.875 5.309 410 HD23 LEU 93 2HD2 LEU 93 2.633 -8.156 5.263 411 H PHE 94 H PHE 94 2.051 -5.561 5.236 412 HA PHE 94 HA PHE 94 2.529 -3.045 3.825 413 HB2 PHE 94 1HB PHE 94 2.283 -3.843 6.697 414 HB3 PHE 94 2HB PHE 94 3.128 -2.355 6.301 415 HD1 PHE 94 HD1 PHE 94 0.016 -3.956 4.941 416 HD2 PHE 94 HD2 PHE 94 1.806 -0.558 6.788 417 HE1 PHE 94 HE1 PHE 94 -2.122 -2.761 4.813 418 HE2 PHE 94 HE2 PHE 94 -0.337 0.638 6.661 419 HZ PHE 94 HZ PHE 94 -2.304 -0.463 5.676 420 H PHE 95 H PHE 95 4.538 -1.786 4.393 421 HA PHE 95 HA PHE 95 6.889 -3.436 4.947 422 HB2 PHE 95 1HB PHE 95 6.741 -1.680 2.487 423 HB3 PHE 95 2HB PHE 95 8.076 -2.721 2.966 424 HD1 PHE 95 HD2 PHE 95 4.653 -2.655 1.632 425 HD2 PHE 95 HD1 PHE 95 8.063 -5.052 2.484 426 HE1 PHE 95 HE2 PHE 95 3.702 -4.479 0.288 427 HE2 PHE 95 HE1 PHE 95 7.119 -6.880 1.137 428 HZ PHE 95 HZ PHE 95 4.933 -6.595 0.040 429 HA PRO 96 HA PRO 96 9.127 -2.927 4.455 430 HB2 PRO 96 1HB PRO 96 11.189 -2.240 6.282 431 HB3 PRO 96 2HB PRO 96 11.143 -1.927 4.548 432 HG2 PRO 96 1HG PRO 96 11.066 0.009 6.541 433 HG3 PRO 96 2HG PRO 96 10.573 0.246 4.856 434 HD2 PRO 96 1HD PRO 96 8.894 -0.250 7.273 435 HD3 PRO 96 2HD PRO 96 8.564 0.767 5.853 436 H ASP 97 H ASP 97 8.469 -2.067 7.801 437 HA ASP 97 HA ASP 97 9.506 -4.195 9.188 438 HB2 ASP 97 1HB ASP 97 7.261 -2.316 9.632 439 HB3 ASP 97 2HB ASP 97 7.267 -3.773 10.623 440 H PHE 98 H PHE 98 6.849 -4.317 6.973 441 HA PHE 98 HA PHE 98 5.671 -6.086 6.160 442 HB2 PHE 98 1HB PHE 98 7.058 -7.874 8.157 443 HB3 PHE 98 2HB PHE 98 6.286 -8.343 6.650 444 HD1 PHE 98 HD1 PHE 98 7.324 -7.047 4.523 445 HD2 PHE 98 HD2 PHE 98 9.341 -7.854 8.183 446 HE1 PHE 98 HE1 PHE 98 9.487 -6.878 3.364 447 HE2 PHE 98 HE2 PHE 98 11.507 -7.684 7.031 448 HZ PHE 98 HZ PHE 98 11.582 -7.195 4.619 449 H ASN 99 H ASN 99 3.853 -5.013 7.073 450 HA ASN 99 HA ASN 99 2.651 -6.514 9.295 451 HB2 ASN 99 1HB ASN 99 2.352 -3.537 8.961 452 HB3 ASN 99 2HB ASN 99 1.789 -4.527 10.301 453 HD21 ASN 99 2HD2 ASN 99 3.765 -5.941 11.173 454 HD22 ASN 99 1HD2 ASN 99 5.160 -4.988 11.577 455 H PHE 100 H PHE 100 1.751 -7.549 7.295 456 HA PHE 100 HA PHE 100 0.072 -6.395 5.468 457 HB2 PHE 100 1HB PHE 100 -1.167 -8.627 5.478 458 HB3 PHE 100 2HB PHE 100 0.563 -8.682 5.168 459 HD1 PHE 100 HD2 PHE 100 2.107 -9.309 7.034 460 HD2 PHE 100 HD1 PHE 100 -2.111 -9.780 7.278 461 HE1 PHE 100 HE2 PHE 100 2.396 -10.924 8.873 462 HE2 PHE 100 HE1 PHE 100 -1.837 -11.379 9.119 463 HZ PHE 100 HZ PHE 100 0.423 -11.961 9.917 464 H ALA 101 H ALA 101 -2.228 -6.274 5.281 465 HA ALA 101 HA ALA 101 -3.780 -6.190 7.751 466 HB1 ALA 101 3HB ALA 101 -4.494 -3.834 6.398 467 HB2 ALA 101 1HB ALA 101 -2.730 -3.849 6.468 468 HB3 ALA 101 2HB ALA 101 -3.674 -3.978 7.953 469 H TRP 102 H TRP 102 -6.036 -6.265 7.435 470 HA TRP 102 HA TRP 102 -6.864 -6.954 4.689 471 HB2 TRP 102 1HB TRP 102 -8.241 -7.956 7.179 472 HB3 TRP 102 2HB TRP 102 -8.367 -8.576 5.538 473 HD1 TRP 102 HD1 TRP 102 -5.118 -8.724 5.086 474 HE1 TRP 102 HE1 TRP 102 -3.846 -10.663 6.194 475 HE3 TRP 102 HE3 TRP 102 -8.519 -9.968 8.697 476 HZ2 TRP 102 HZ2 TRP 102 -4.233 -12.485 8.313 477 HZ3 TRP 102 HZ3 TRP 102 -7.989 -11.824 10.224 478 HH2 TRP 102 HH2 TRP 102 -5.890 -13.055 10.033 479 H VAL 103 H VAL 103 -7.847 -5.179 3.911 480 HA VAL 103 HA VAL 103 -10.106 -4.087 5.439 481 HB VAL 103 HB VAL 103 -9.523 -1.792 4.743 482 HG11 VAL 103 1HG1 VAL 103 -8.899 -2.585 6.966 483 HG12 VAL 103 2HG1 VAL 103 -7.718 -1.434 6.344 484 HG13 VAL 103 3HG1 VAL 103 -7.356 -3.159 6.333 485 HG21 VAL 103 3HG2 VAL 103 -7.829 -2.984 2.949 486 HG22 VAL 103 1HG2 VAL 103 -6.717 -2.383 4.180 487 HG23 VAL 103 2HG2 VAL 103 -7.827 -1.274 3.376 488 H LYS 104 H LYS 104 -11.632 -2.847 4.079 489 HA LYS 104 HA LYS 104 -12.322 -4.264 1.754 490 HB2 LYS 104 1HB LYS 104 -13.272 -1.726 3.015 491 HB3 LYS 104 2HB LYS 104 -13.804 -2.111 1.388 492 HG2 LYS 104 1HG LYS 104 -15.154 -3.776 2.074 493 HG3 LYS 104 2HG LYS 104 -14.066 -4.270 3.374 494 HD2 LYS 104 1HD LYS 104 -14.758 -2.062 4.500 495 HD3 LYS 104 2HD LYS 104 -16.098 -2.063 3.350 496 HE2 LYS 104 1HE LYS 104 -17.195 -3.334 4.816 497 HE3 LYS 104 2HE LYS 104 -16.094 -4.637 4.364 498 HZ1 LYS 104 3HZ LYS 104 -16.299 -4.105 6.815 499 HZ2 LYS 104 1HZ LYS 104 -15.426 -2.693 6.496 500 HZ3 LYS 104 2HZ LYS 104 -14.729 -4.205 6.199 501 H ARG 105 H ARG 105 -12.555 -3.414 -0.431 502 HA ARG 105 HA ARG 105 -10.131 -2.444 -1.481 503 HB2 ARG 105 1HB ARG 105 -12.720 -2.235 -2.989 504 HB3 ARG 105 2HB ARG 105 -11.111 -2.582 -3.602 505 HG2 ARG 105 1HG ARG 105 -11.819 -4.696 -3.681 506 HG3 ARG 105 2HG ARG 105 -11.521 -4.698 -1.940 507 HD2 ARG 105 1HD ARG 105 -13.681 -5.458 -1.977 508 HD3 ARG 105 2HD ARG 105 -13.966 -3.724 -1.856 509 HE ARG 105 HE ARG 105 -14.829 -3.738 -3.983 510 HH11 ARG 105 1HH1 ARG 105 -13.239 -6.799 -3.378 511 HH12 ARG 105 2HH1 ARG 105 -13.867 -7.549 -4.804 512 HH21 ARG 105 1HH2 ARG 105 -15.651 -4.730 -5.869 513 HH22 ARG 105 2HH2 ARG 105 -15.234 -6.373 -6.222 514 H ASN 106 H ASN 106 -12.938 -0.777 -0.297 515 HA ASN 106 HA ASN 106 -12.681 1.652 -1.690 516 HB2 ASN 106 1HB ASN 106 -14.037 2.635 0.086 517 HB3 ASN 106 2HB ASN 106 -14.688 1.072 -0.387 518 HD21 ASN 106 2HD2 ASN 106 -15.196 2.448 2.052 519 HD22 ASN 106 1HD2 ASN 106 -14.592 1.456 3.343 520 H SER 107 H SER 107 -11.153 0.466 1.268 521 HA SER 107 HA SER 107 -9.814 2.969 1.775 522 HB2 SER 107 1HB SER 107 -10.502 0.874 3.381 523 HB3 SER 107 2HB SER 107 -8.786 0.558 3.123 524 HG SER 107 HG SER 107 -9.973 2.918 4.153 525 H VAL 108 H VAL 108 -9.337 0.707 -0.547 526 HA VAL 108 HA VAL 108 -6.410 0.881 -0.468 527 HB VAL 108 HB VAL 108 -8.225 -0.949 -2.035 528 HG11 VAL 108 1HG1 VAL 108 -6.282 -0.438 -3.384 529 HG12 VAL 108 2HG1 VAL 108 -6.154 -2.083 -2.764 530 HG13 VAL 108 3HG1 VAL 108 -5.210 -0.789 -2.026 531 HG21 VAL 108 3HG2 VAL 108 -8.043 -1.488 0.348 532 HG22 VAL 108 1HG2 VAL 108 -6.288 -1.547 0.195 533 HG23 VAL 108 2HG2 VAL 108 -7.286 -2.721 -0.661 534 H LYS 109 H LYS 109 -5.259 1.531 -2.329 535 HA LYS 109 HA LYS 109 -6.779 2.792 -4.491 536 HB2 LYS 109 1HB LYS 109 -6.330 4.579 -2.895 537 HB3 LYS 109 2HB LYS 109 -4.624 4.155 -2.863 538 HG2 LYS 109 1HG LYS 109 -4.179 5.293 -4.735 539 HG3 LYS 109 2HG LYS 109 -5.654 4.750 -5.535 540 HD2 LYS 109 1HD LYS 109 -6.778 6.379 -3.778 541 HD3 LYS 109 2HD LYS 109 -5.184 7.134 -3.818 542 HE2 LYS 109 1HE LYS 109 -6.065 8.281 -5.548 543 HE3 LYS 109 2HE LYS 109 -5.625 6.835 -6.456 544 HZ1 LYS 109 3HZ LYS 109 -8.051 7.864 -6.509 545 HZ2 LYS 109 1HZ LYS 109 -8.250 6.840 -5.178 546 HZ3 LYS 109 2HZ LYS 109 -7.774 6.204 -6.670 547 HA PRO 110 HA PRO 110 -3.815 0.535 -6.943 548 HB2 PRO 110 1HB PRO 110 -4.024 2.144 -9.199 549 HB3 PRO 110 2HB PRO 110 -5.078 0.781 -8.820 550 HG2 PRO 110 1HG PRO 110 -5.519 3.702 -8.365 551 HG3 PRO 110 2HG PRO 110 -6.668 2.463 -8.906 552 HD2 PRO 110 1HD PRO 110 -6.691 3.355 -6.388 553 HD3 PRO 110 2HD PRO 110 -6.983 1.642 -6.751 554 H LEU 111 H LEU 111 -1.718 0.736 -6.490 555 HA LEU 111 HA LEU 111 -0.463 3.378 -6.547 556 HB2 LEU 111 1HB LEU 111 -0.162 2.021 -4.528 557 HB3 LEU 111 2HB LEU 111 0.553 0.740 -5.486 558 HG LEU 111 HG LEU 111 2.419 2.276 -6.076 559 HD11 LEU 111 1HD1 LEU 111 2.485 4.434 -5.495 560 HD12 LEU 111 2HD1 LEU 111 1.868 4.117 -3.875 561 HD13 LEU 111 3HD1 LEU 111 0.749 4.271 -5.230 562 HD21 LEU 111 3HD2 LEU 111 2.273 2.206 -3.101 563 HD22 LEU 111 1HD2 LEU 111 3.605 1.786 -4.176 564 HD23 LEU 111 2HD2 LEU 111 2.238 0.687 -3.996 565 H LEU 112 H LEU 112 1.336 3.851 -7.796 566 HA LEU 112 HA LEU 112 2.119 1.847 -9.801 567 HB2 LEU 112 1HB LEU 112 2.287 3.804 -11.428 568 HB3 LEU 112 2HB LEU 112 0.685 3.202 -11.050 569 HG LEU 112 HG LEU 112 1.779 5.531 -9.519 570 HD11 LEU 112 1HD1 LEU 112 2.116 6.536 -11.525 571 HD12 LEU 112 2HD1 LEU 112 0.383 6.828 -11.366 572 HD13 LEU 112 3HD1 LEU 112 0.966 5.499 -12.367 573 HD21 LEU 112 3HD2 LEU 112 -0.824 6.019 -9.929 574 HD22 LEU 112 1HD2 LEU 112 -0.224 5.057 -8.580 575 HD23 LEU 112 2HD2 LEU 112 -0.838 4.260 -10.028 576 H ASP 113 H ASP 113 4.157 2.507 -10.969 577 HA ASP 113 HA ASP 113 6.214 2.977 -9.081 578 HB2 ASP 113 1HB ASP 113 6.175 2.737 -12.080 579 HB3 ASP 113 2HB ASP 113 7.654 3.156 -11.222 580 H SER 114 H SER 114 4.639 5.017 -11.498 581 HA SER 114 HA SER 114 6.393 7.212 -11.349 582 HB2 SER 114 1HB SER 114 4.128 6.620 -12.807 583 HB3 SER 114 2HB SER 114 3.580 7.931 -11.763 584 HG SER 114 HG SER 114 5.005 8.134 -13.955 585 H GLU 115 H GLU 115 3.755 6.168 -9.286 586 HA GLU 115 HA GLU 115 3.675 8.662 -7.826 587 HB2 GLU 115 1HB GLU 115 2.260 6.030 -7.582 588 HB3 GLU 115 2HB GLU 115 2.222 7.173 -6.245 589 HG2 GLU 115 1HG GLU 115 1.406 8.882 -7.954 590 HG3 GLU 115 2HG GLU 115 1.128 7.505 -9.016 591 H ILE 116 H ILE 116 4.999 5.410 -7.317 592 HA ILE 116 HA ILE 116 5.888 5.931 -4.654 593 HB ILE 116 HB ILE 116 6.980 3.852 -6.557 594 HG12 ILE 116 1HG1 ILE 116 4.945 3.206 -4.470 595 HG13 ILE 116 2HG1 ILE 116 4.390 3.953 -5.963 596 HG21 ILE 116 1HG2 ILE 116 6.900 3.795 -3.549 597 HG22 ILE 116 2HG2 ILE 116 8.278 4.396 -4.469 598 HG23 ILE 116 3HG2 ILE 116 7.775 2.714 -4.633 599 HD11 ILE 116 3HD1 ILE 116 5.230 1.231 -5.444 600 HD12 ILE 116 1HD1 ILE 116 6.047 1.935 -6.839 601 HD13 ILE 116 2HD1 ILE 116 4.285 1.892 -6.777 602 H ALA 117 H ALA 117 7.423 5.997 -7.840 603 HA ALA 117 HA ALA 117 10.056 6.521 -7.175 604 HB1 ALA 117 3HB ALA 117 8.475 7.682 -9.466 605 HB2 ALA 117 1HB ALA 117 9.263 6.102 -9.458 606 HB3 ALA 117 2HB ALA 117 10.235 7.570 -9.374 607 H LYS 118 H LYS 118 7.586 8.926 -8.014 608 HA LYS 118 HA LYS 118 9.091 11.180 -7.258 609 HB2 LYS 118 1HB LYS 118 7.397 12.209 -8.291 610 HB3 LYS 118 2HB LYS 118 6.618 10.644 -8.463 611 HG2 LYS 118 1HG LYS 118 6.257 12.119 -5.916 612 HG3 LYS 118 2HG LYS 118 5.380 12.657 -7.353 613 HD2 LYS 118 1HD LYS 118 5.178 9.842 -7.264 614 HD3 LYS 118 2HD LYS 118 4.831 10.436 -5.636 615 HE2 LYS 118 1HE LYS 118 3.444 11.161 -8.207 616 HE3 LYS 118 2HE LYS 118 2.762 10.352 -6.798 617 HZ1 LYS 118 3HZ LYS 118 3.356 13.192 -7.201 618 HZ2 LYS 118 1HZ LYS 118 3.486 12.568 -5.633 619 HZ3 LYS 118 2HZ LYS 118 2.018 12.466 -6.467 620 H PHE 119 H PHE 119 6.678 9.239 -5.535 621 HA PHE 119 HA PHE 119 6.307 10.786 -3.268 622 HB2 PHE 119 1HB PHE 119 4.985 8.810 -3.498 623 HB3 PHE 119 2HB PHE 119 6.414 7.780 -3.560 624 HD1 PHE 119 HD1 PHE 119 7.800 7.494 -1.489 625 HD2 PHE 119 HD2 PHE 119 3.982 9.373 -1.448 626 HE1 PHE 119 HE1 PHE 119 7.664 7.151 0.944 627 HE2 PHE 119 HE2 PHE 119 3.842 9.034 0.985 628 HZ PHE 119 HZ PHE 119 5.691 7.926 2.175 629 H LEU 120 H LEU 120 8.762 8.236 -3.702 630 HA LEU 120 HA LEU 120 10.060 8.602 -1.258 631 HB2 LEU 120 1HB LEU 120 11.181 7.668 -3.896 632 HB3 LEU 120 2HB LEU 120 12.011 7.539 -2.356 633 HG LEU 120 HG LEU 120 9.309 6.356 -2.431 634 HD11 LEU 120 1HD1 LEU 120 10.147 5.751 -4.657 635 HD12 LEU 120 2HD1 LEU 120 10.042 4.347 -3.595 636 HD13 LEU 120 3HD1 LEU 120 11.608 5.089 -3.924 637 HD21 LEU 120 3HD2 LEU 120 11.248 4.551 -1.538 638 HD22 LEU 120 1HD2 LEU 120 10.164 5.536 -0.558 639 HD23 LEU 120 2HD2 LEU 120 11.772 6.132 -0.965 640 H GLY 121 H GLY 121 10.307 10.371 -4.274 641 HA2 GLY 121 1HA GLY 121 12.616 11.883 -3.304 642 HA3 GLY 121 2HA GLY 121 11.899 11.993 -4.904 643 H SER 122 H SER 122 9.758 12.064 -2.181 644 HA SER 122 HA SER 122 8.636 14.528 -2.888 645 HB2 SER 122 1HB SER 122 7.381 12.899 -1.583 646 HB3 SER 122 2HB SER 122 8.519 13.055 -0.243 647 HG SER 122 HG SER 122 6.856 15.123 -1.263 648 H SER 123 H SER 123 9.325 16.525 -2.620 649 HA SER 123 HA SER 123 11.482 17.052 -0.707 650 HB2 SER 123 1HB SER 123 10.508 18.934 -2.854 651 HB3 SER 123 2HB SER 123 12.058 18.949 -2.014 652 HG SER 123 HG SER 123 12.630 17.918 -3.784 653 H LYS 124 H LYS 124 8.128 17.539 -1.119 654 HA LYS 124 HA LYS 124 8.029 19.929 0.537 655 HB2 LYS 124 1HB LYS 124 5.532 19.661 0.226 656 HB3 LYS 124 2HB LYS 124 6.461 19.952 -1.238 657 HG2 LYS 124 1HG LYS 124 6.205 17.124 -0.722 658 HG3 LYS 124 2HG LYS 124 4.624 17.907 -0.784 659 HD2 LYS 124 1HD LYS 124 6.512 18.731 -2.883 660 HD3 LYS 124 2HD LYS 124 6.010 17.039 -2.951 661 HE2 LYS 124 1HE LYS 124 3.820 18.917 -2.456 662 HE3 LYS 124 2HE LYS 124 4.624 19.146 -4.009 663 HZ1 LYS 124 3HZ LYS 124 2.899 17.610 -4.373 664 HZ2 LYS 124 1HZ LYS 124 3.287 16.703 -2.999 665 HZ3 LYS 124 2HZ LYS 124 4.315 16.685 -4.342 666 H ARG 125 H ARG 125 6.732 16.592 0.710 667 HA ARG 125 HA ARG 125 6.965 16.741 3.615 668 HB2 ARG 125 1HB ARG 125 4.569 17.179 2.768 669 HB3 ARG 125 2HB ARG 125 4.557 15.479 2.316 670 HG2 ARG 125 1HG ARG 125 3.565 15.477 4.404 671 HG3 ARG 125 2HG ARG 125 5.236 15.043 4.762 672 HD2 ARG 125 1HD ARG 125 5.540 17.618 5.080 673 HD3 ARG 125 2HD ARG 125 3.788 17.612 5.270 674 HE ARG 125 HE ARG 125 5.740 16.645 7.139 675 HH11 ARG 125 1HH1 ARG 125 2.408 16.349 6.096 676 HH12 ARG 125 2HH1 ARG 125 1.853 15.749 7.621 677 HH21 ARG 125 1HH2 ARG 125 4.998 15.846 9.151 678 HH22 ARG 125 2HH2 ARG 125 3.322 15.464 9.354 679 H LYS 126 H LYS 126 8.582 15.361 3.802 680 HA LYS 126 HA LYS 126 8.135 12.594 2.964 681 HB2 LYS 126 1HB LYS 126 10.398 12.335 2.189 682 HB3 LYS 126 2HB LYS 126 9.669 13.691 1.345 683 HG2 LYS 126 1HG LYS 126 11.460 14.003 3.742 684 HG3 LYS 126 2HG LYS 126 12.039 14.023 2.076 685 HD2 LYS 126 1HD LYS 126 9.865 15.805 2.175 686 HD3 LYS 126 2HD LYS 126 10.839 16.134 3.610 687 HE2 LYS 126 1HE LYS 126 12.204 15.807 0.981 688 HE3 LYS 126 2HE LYS 126 11.345 17.310 1.310 689 HZ1 LYS 126 3HZ LYS 126 12.721 17.745 3.160 690 HZ2 LYS 126 1HZ LYS 126 13.766 17.278 1.913 691 HZ3 LYS 126 2HZ LYS 126 13.382 16.189 3.151 692 H SER 127 H SER 127 8.691 11.079 4.420 693 HA SER 127 HA SER 127 10.208 11.906 6.796 694 HB2 SER 127 1HB SER 127 7.913 10.018 7.131 695 HB3 SER 127 2HB SER 127 8.617 11.142 8.292 696 HG SER 127 HG SER 127 6.590 11.523 6.487 697 H LYS 128 H LYS 128 11.321 10.200 7.878 698 HA LYS 128 HA LYS 128 12.521 8.310 6.206 699 HB2 LYS 128 1HB LYS 128 12.898 9.193 8.825 700 HB3 LYS 128 2HB LYS 128 12.533 7.481 8.999 701 HG2 LYS 128 1HG LYS 128 14.653 8.566 7.159 702 HG3 LYS 128 2HG LYS 128 14.957 8.021 8.808 703 HD2 LYS 128 1HD LYS 128 15.227 5.963 8.004 704 HD3 LYS 128 2HD LYS 128 13.510 5.954 7.601 705 HE2 LYS 128 1HE LYS 128 13.899 6.211 5.400 706 HE3 LYS 128 2HE LYS 128 15.205 7.364 5.665 707 HZ1 LYS 128 3HZ LYS 128 16.716 5.580 6.090 708 HZ2 LYS 128 1HZ LYS 128 15.923 5.250 4.632 709 HZ3 LYS 128 2HZ LYS 128 15.477 4.430 6.044 710 H GLU 129 H GLU 129 9.887 7.934 8.558 711 HA GLU 129 HA GLU 129 9.549 5.148 8.212 712 HB2 GLU 129 1HB GLU 129 7.791 7.342 9.279 713 HB3 GLU 129 2HB GLU 129 7.179 5.703 9.102 714 HG2 GLU 129 1HG GLU 129 9.085 4.928 10.522 715 HG3 GLU 129 2HG GLU 129 9.466 6.625 10.819 716 H LEU 130 H LEU 130 8.246 7.959 6.527 717 HA LEU 130 HA LEU 130 6.318 6.471 5.017 718 HB2 LEU 130 1HB LEU 130 7.272 9.268 5.115 719 HB3 LEU 130 2HB LEU 130 6.672 8.734 3.560 720 HG LEU 130 HG LEU 130 4.951 9.871 4.894 721 HD11 LEU 130 1HD1 LEU 130 4.119 8.366 3.284 722 HD12 LEU 130 2HD1 LEU 130 3.223 8.035 4.766 723 HD13 LEU 130 3HD1 LEU 130 4.532 6.963 4.268 724 HD21 LEU 130 3HD2 LEU 130 4.016 8.312 6.799 725 HD22 LEU 130 1HD2 LEU 130 5.295 9.481 7.119 726 HD23 LEU 130 2HD2 LEU 130 5.696 7.782 6.875 727 H ILE 131 H ILE 131 9.457 7.958 4.182 728 HA ILE 131 HA ILE 131 9.539 7.070 1.535 729 HB ILE 131 HB ILE 131 11.893 7.514 3.370 730 HG12 ILE 131 1HG1 ILE 131 10.835 9.451 1.323 731 HG13 ILE 131 2HG1 ILE 131 10.190 9.425 2.961 732 HG21 ILE 131 1HG2 ILE 131 13.282 7.260 1.608 733 HG22 ILE 131 2HG2 ILE 131 12.133 7.957 0.468 734 HG23 ILE 131 3HG2 ILE 131 11.961 6.276 0.974 735 HD11 ILE 131 3HD1 ILE 131 12.104 10.261 3.874 736 HD12 ILE 131 1HD1 ILE 131 12.143 11.034 2.290 737 HD13 ILE 131 2HD1 ILE 131 13.132 9.607 2.599 738 H GLU 132 H GLU 132 10.917 5.565 4.464 739 HA GLU 132 HA GLU 132 12.053 3.328 3.278 740 HB2 GLU 132 1HB GLU 132 10.921 3.863 5.993 741 HB3 GLU 132 2HB GLU 132 11.397 2.226 5.570 742 HG2 GLU 132 1HG GLU 132 13.570 3.649 4.773 743 HG3 GLU 132 2HG GLU 132 13.031 4.568 6.177 744 H ALA 133 H ALA 133 8.696 3.981 4.086 745 HA ALA 133 HA ALA 133 7.724 1.349 3.762 746 HB1 ALA 133 3HB ALA 133 5.572 2.831 3.149 747 HB2 ALA 133 1HB ALA 133 6.558 4.045 3.962 748 HB3 ALA 133 2HB ALA 133 6.130 2.553 4.797 749 H TYR 134 H TYR 134 7.621 4.133 1.552 750 HA TYR 134 HA TYR 134 6.623 2.600 -0.625 751 HB2 TYR 134 1HB TYR 134 7.755 5.357 -0.348 752 HB3 TYR 134 2HB TYR 134 7.564 4.668 -1.956 753 HD1 TYR 134 HD2 TYR 134 5.571 5.038 1.194 754 HD2 TYR 134 HD1 TYR 134 5.584 5.110 -3.061 755 HE1 TYR 134 HE2 TYR 134 3.204 5.698 1.201 756 HE2 TYR 134 HE1 TYR 134 3.217 5.772 -3.063 757 HH TYR 134 HH TYR 134 1.294 5.757 -0.179 758 H GLU 135 H GLU 135 9.840 3.296 0.544 759 HA GLU 135 HA GLU 135 11.206 2.450 -1.823 760 HB2 GLU 135 1HB GLU 135 11.984 3.836 0.363 761 HB3 GLU 135 2HB GLU 135 12.584 2.239 0.790 762 HG2 GLU 135 1HG GLU 135 13.479 2.416 -1.739 763 HG3 GLU 135 2HG GLU 135 13.493 4.119 -1.282 764 H ALA 136 H ALA 136 9.885 0.861 0.989 765 HA ALA 136 HA ALA 136 11.343 -1.597 0.576 766 HB1 ALA 136 3HB ALA 136 8.986 -1.006 2.359 767 HB2 ALA 136 1HB ALA 136 10.686 -0.908 2.821 768 HB3 ALA 136 2HB ALA 136 9.974 -2.466 2.399 769 H SER 137 H SER 137 8.210 -0.284 -0.310 770 HA SER 137 HA SER 137 7.213 -2.835 -1.265 771 HB2 SER 137 1HB SER 137 5.933 -0.655 -0.319 772 HB3 SER 137 2HB SER 137 5.833 -0.331 -2.052 773 HG SER 137 HG SER 137 4.936 -2.468 -2.266 774 H LYS 138 H LYS 138 8.838 -0.035 -2.583 775 HA LYS 138 HA LYS 138 8.157 -0.301 -5.291 776 HB2 LYS 138 1HB LYS 138 9.342 1.639 -4.206 777 HB3 LYS 138 2HB LYS 138 10.807 0.671 -4.220 778 HG2 LYS 138 1HG LYS 138 11.232 1.283 -6.302 779 HG3 LYS 138 2HG LYS 138 9.667 0.672 -6.839 780 HD2 LYS 138 1HD LYS 138 8.659 2.726 -6.692 781 HD3 LYS 138 2HD LYS 138 9.754 3.296 -5.432 782 HE2 LYS 138 1HE LYS 138 10.804 2.755 -8.176 783 HE3 LYS 138 2HE LYS 138 9.921 4.248 -7.860 784 HZ1 LYS 138 3HZ LYS 138 11.953 3.669 -5.899 785 HZ2 LYS 138 1HZ LYS 138 11.637 5.104 -6.739 786 HZ3 LYS 138 2HZ LYS 138 12.569 3.890 -7.457 787 H THR 139 H THR 139 10.324 -2.153 -3.307 788 HA THR 139 HA THR 139 11.709 -3.346 -5.563 789 HB THR 139 HB THR 139 12.487 -4.819 -3.416 790 HG1 THR 139 HG1 THR 139 12.246 -3.777 -1.598 791 HG21 THR 139 3HG2 THR 139 13.509 -2.138 -4.299 792 HG22 THR 139 1HG2 THR 139 14.110 -3.737 -4.740 793 HG23 THR 139 2HG2 THR 139 14.322 -3.140 -3.096 794 HA PRO 140 HA PRO 140 8.322 -6.342 -5.956 795 HB2 PRO 140 1HB PRO 140 10.257 -7.449 -7.919 796 HB3 PRO 140 2HB PRO 140 8.541 -7.078 -8.118 797 HG2 PRO 140 1HG PRO 140 10.404 -5.507 -9.190 798 HG3 PRO 140 2HG PRO 140 8.939 -4.816 -8.467 799 HD2 PRO 140 1HD PRO 140 11.717 -4.955 -7.366 800 HD3 PRO 140 2HD PRO 140 10.523 -3.648 -7.256 801 HA PRO 141 HA PRO 141 11.908 -9.948 -5.399 802 HB2 PRO 141 1HB PRO 141 13.296 -7.974 -3.603 803 HB3 PRO 141 2HB PRO 141 13.958 -9.406 -4.414 804 HG2 PRO 141 1HG PRO 141 14.314 -7.027 -5.491 805 HG3 PRO 141 2HG PRO 141 13.869 -8.403 -6.520 806 HD2 PRO 141 1HD PRO 141 12.229 -6.091 -5.644 807 HD3 PRO 141 2HD PRO 141 12.114 -7.056 -7.126 808 H ASP 142 H ASP 142 10.921 -7.613 -2.842 809 HA ASP 142 HA ASP 142 10.699 -9.726 -0.895 810 HB2 ASP 142 1HB ASP 142 9.604 -7.874 0.504 811 HB3 ASP 142 2HB ASP 142 11.292 -7.669 0.059 812 H LEU 143 H LEU 143 9.248 -10.775 -2.707 813 HA LEU 143 HA LEU 143 6.674 -11.061 -1.593 814 HB2 LEU 143 1HB LEU 143 6.548 -8.850 -2.962 815 HB3 LEU 143 2HB LEU 143 6.549 -9.898 -4.363 816 HG LEU 143 HG LEU 143 4.289 -9.343 -3.885 817 HD11 LEU 143 1HD1 LEU 143 4.847 -11.743 -4.448 818 HD12 LEU 143 2HD1 LEU 143 3.281 -11.462 -3.689 819 HD13 LEU 143 3HD1 LEU 143 4.620 -12.097 -2.735 820 HD21 LEU 143 3HD2 LEU 143 4.888 -8.817 -1.417 821 HD22 LEU 143 1HD2 LEU 143 4.441 -10.498 -1.133 822 HD23 LEU 143 2HD2 LEU 143 3.264 -9.376 -1.812 823 H LYS 144 H LYS 144 7.728 -11.170 -4.995 824 HA LYS 144 HA LYS 144 6.888 -13.913 -5.223 825 HB2 LYS 144 1HB LYS 144 7.657 -13.730 -7.561 826 HB3 LYS 144 2HB LYS 144 6.560 -12.434 -7.112 827 HG2 LYS 144 1HG LYS 144 9.383 -11.775 -6.723 828 HG3 LYS 144 2HG LYS 144 8.948 -12.118 -8.396 829 HD2 LYS 144 1HD LYS 144 7.280 -10.269 -6.727 830 HD3 LYS 144 2HD LYS 144 8.747 -9.691 -7.520 831 HE2 LYS 144 1HE LYS 144 7.446 -9.321 -9.300 832 HE3 LYS 144 2HE LYS 144 7.478 -11.069 -9.527 833 HZ1 LYS 144 3HZ LYS 144 5.220 -9.991 -9.500 834 HZ2 LYS 144 1HZ LYS 144 5.441 -9.724 -7.844 835 HZ3 LYS 144 2HZ LYS 144 5.415 -11.302 -8.451 836 H GLU 145 H GLU 145 9.938 -12.229 -4.792 837 HA GLU 145 HA GLU 145 11.438 -14.714 -5.174 838 HB2 GLU 145 1HB GLU 145 12.459 -11.915 -4.658 839 HB3 GLU 145 2HB GLU 145 13.435 -13.313 -5.079 840 HG2 GLU 145 1HG GLU 145 11.255 -12.480 -6.925 841 HG3 GLU 145 2HG GLU 145 12.741 -11.538 -6.880 842 H GLU 146 H GLU 146 10.420 -15.614 -3.205 843 HA GLU 146 HA GLU 146 11.192 -14.470 -0.666 844 HB2 GLU 146 1HB GLU 146 9.006 -15.610 -0.999 845 HB3 GLU 146 2HB GLU 146 9.865 -17.127 -1.225 846 HG2 GLU 146 1HG GLU 146 10.352 -17.348 0.983 847 HG3 GLU 146 2HG GLU 146 10.426 -15.609 1.255 848 H SER 147 H SER 147 12.589 -15.382 0.851 849 HA SER 147 HA SER 147 14.530 -17.304 -0.253 850 HB2 SER 147 1HB SER 147 14.895 -15.003 1.667 851 HB3 SER 147 2HB SER 147 16.114 -16.260 1.454 852 HG SER 147 HG SER 147 16.260 -15.678 -0.728 853 H SER 148 H SER 148 15.774 -18.475 1.544 854 HA SER 148 HA SER 148 13.982 -19.223 3.752 855 HB2 SER 148 1HB SER 148 15.100 -20.962 1.622 856 HB3 SER 148 2HB SER 148 15.118 -21.612 3.261 857 HG SER 148 HG SER 148 12.802 -20.483 2.082 858 H THR 149 H THR 149 17.299 -19.402 2.462 859 HA THR 149 HA THR 149 18.613 -20.285 4.740 860 HB THR 149 HB THR 149 19.644 -18.294 2.703 861 HG1 THR 149 HG1 THR 149 20.161 -20.015 1.476 862 HG21 THR 149 3HG2 THR 149 21.606 -20.166 3.545 863 HG22 THR 149 1HG2 THR 149 20.924 -19.386 4.972 864 HG23 THR 149 2HG2 THR 149 21.619 -18.408 3.679 865 H ASP 150 H ASP 150 19.056 -19.424 6.668 866 HA ASP 150 HA ASP 150 19.122 -17.987 8.426 867 HB2 ASP 150 1HB ASP 150 19.816 -16.028 6.228 868 HB3 ASP 150 2HB ASP 150 19.905 -15.648 7.943 869 H LEU 151 H LEU 151 16.566 -18.529 7.349 870 HA LEU 151 HA LEU 151 15.158 -16.068 8.113 871 HB2 LEU 151 1HB LEU 151 15.224 -16.984 5.528 872 HB3 LEU 151 2HB LEU 151 13.757 -17.730 6.137 873 HG LEU 151 HG LEU 151 14.159 -14.808 6.595 874 HD11 LEU 151 1HD1 LEU 151 14.566 -15.683 4.089 875 HD12 LEU 151 2HD1 LEU 151 13.788 -14.148 4.472 876 HD13 LEU 151 3HD1 LEU 151 12.805 -15.561 4.085 877 HD21 LEU 151 3HD2 LEU 151 11.646 -14.944 6.085 878 HD22 LEU 151 1HD2 LEU 151 12.223 -15.629 7.604 879 HD23 LEU 151 2HD2 LEU 151 11.850 -16.689 6.245 880 H GLU 152 H GLU 152 13.564 -16.364 9.572 881 HA GLU 152 HA GLU 152 13.225 -18.949 10.749 882 HB2 GLU 152 1HB GLU 152 12.361 -16.192 11.340 883 HB3 GLU 152 2HB GLU 152 11.251 -17.445 11.875 884 HG2 GLU 152 1HG GLU 152 13.511 -18.489 12.811 885 HG3 GLU 152 2HG GLU 152 13.975 -16.789 12.818 Start of MODEL 13 1 H1 SER 45 1H SER 45 -14.670 6.724 -15.120 2 H2 SER 45 2H SER 45 -16.149 7.591 -15.076 3 H3 SER 45 3H SER 45 -15.763 6.617 -16.435 4 HA SER 45 HA SER 45 -16.382 5.749 -13.693 5 HB2 SER 45 1HB SER 45 -17.752 5.658 -16.367 6 HB3 SER 45 2HB SER 45 -18.126 4.444 -15.144 7 HG SER 45 HG SER 45 -19.353 5.882 -14.252 8 H ALA 46 H ALA 46 -13.991 4.977 -13.970 9 HA ALA 46 HA ALA 46 -14.097 2.157 -14.473 10 HB1 ALA 46 3HB ALA 46 -13.580 2.382 -16.673 11 HB2 ALA 46 1HB ALA 46 -11.943 2.503 -16.027 12 HB3 ALA 46 2HB ALA 46 -12.836 3.965 -16.449 13 H ASP 47 H ASP 47 -13.067 1.371 -12.750 14 HA ASP 47 HA ASP 47 -10.372 2.172 -12.137 15 HB2 ASP 47 1HB ASP 47 -12.635 3.222 -10.583 16 HB3 ASP 47 2HB ASP 47 -11.404 2.438 -9.599 17 H ASP 48 H ASP 48 -10.472 -0.162 -12.849 18 HA ASP 48 HA ASP 48 -10.676 -1.847 -10.462 19 HB2 ASP 48 1HB ASP 48 -12.033 -2.327 -13.099 20 HB3 ASP 48 2HB ASP 48 -11.580 -3.679 -12.064 21 H ARG 49 H ARG 49 -8.401 -1.755 -10.371 22 HA ARG 49 HA ARG 49 -7.099 -3.621 -12.205 23 HB2 ARG 49 1HB ARG 49 -6.749 -0.890 -12.495 24 HB3 ARG 49 2HB ARG 49 -5.360 -1.367 -11.529 25 HG2 ARG 49 1HG ARG 49 -4.730 -1.438 -13.822 26 HG3 ARG 49 2HG ARG 49 -4.844 -3.101 -13.240 27 HD2 ARG 49 1HD ARG 49 -7.157 -3.181 -14.200 28 HD3 ARG 49 2HD ARG 49 -6.849 -1.603 -14.924 29 HE ARG 49 HE ARG 49 -4.775 -3.087 -15.810 30 HH11 ARG 49 1HH1 ARG 49 -8.240 -3.608 -15.841 31 HH12 ARG 49 2HH1 ARG 49 -8.209 -4.551 -17.292 32 HH21 ARG 49 1HH2 ARG 49 -4.745 -4.332 -17.727 33 HH22 ARG 49 2HH2 ARG 49 -6.227 -4.963 -18.362 34 H LEU 50 H LEU 50 -7.951 -4.168 -9.638 35 HA LEU 50 HA LEU 50 -5.454 -4.197 -8.069 36 HB2 LEU 50 1HB LEU 50 -8.236 -4.609 -6.982 37 HB3 LEU 50 2HB LEU 50 -6.764 -4.325 -6.075 38 HG LEU 50 HG LEU 50 -7.701 -2.214 -7.967 39 HD11 LEU 50 1HD1 LEU 50 -9.547 -3.175 -6.299 40 HD12 LEU 50 2HD1 LEU 50 -9.410 -1.461 -6.694 41 HD13 LEU 50 3HD1 LEU 50 -8.716 -2.077 -5.193 42 HD21 LEU 50 3HD2 LEU 50 -5.539 -2.024 -6.803 43 HD22 LEU 50 1HD2 LEU 50 -6.385 -2.095 -5.256 44 HD23 LEU 50 2HD2 LEU 50 -6.664 -0.744 -6.354 45 H ASN 51 H ASN 51 -4.481 -6.088 -8.598 46 HA ASN 51 HA ASN 51 -5.998 -8.555 -8.097 47 HB2 ASN 51 1HB ASN 51 -4.493 -7.795 -10.563 48 HB3 ASN 51 2HB ASN 51 -4.468 -9.480 -10.053 49 HD21 ASN 51 2HD2 ASN 51 -6.014 -7.342 -11.980 50 HD22 ASN 51 1HD2 ASN 51 -7.562 -8.119 -12.101 51 H PHE 52 H PHE 52 -4.225 -10.485 -8.309 52 HA PHE 52 HA PHE 52 -2.581 -10.229 -6.041 53 HB2 PHE 52 1HB PHE 52 -2.179 -12.282 -8.222 54 HB3 PHE 52 2HB PHE 52 -1.778 -12.429 -6.511 55 HD1 PHE 52 HD2 PHE 52 -4.226 -11.527 -5.197 56 HD2 PHE 52 HD1 PHE 52 -3.720 -13.935 -8.672 57 HE1 PHE 52 HE2 PHE 52 -6.410 -12.578 -4.784 58 HE2 PHE 52 HE1 PHE 52 -5.905 -14.990 -8.261 59 HZ PHE 52 HZ PHE 52 -7.253 -14.313 -6.316 60 H GLY 53 H GLY 53 -0.501 -9.646 -5.740 61 HA2 GLY 53 1HA GLY 53 1.633 -8.924 -6.201 62 HA3 GLY 53 2HA GLY 53 1.471 -9.659 -7.790 63 H ASP 54 H ASP 54 -0.277 -7.002 -6.180 64 HA ASP 54 HA ASP 54 0.605 -5.206 -8.327 65 HB2 ASP 54 1HB ASP 54 -1.893 -6.208 -8.319 66 HB3 ASP 54 2HB ASP 54 -2.140 -4.825 -7.259 67 H ARG 55 H ARG 55 1.113 -3.173 -7.719 68 HA ARG 55 HA ARG 55 1.440 -2.640 -4.906 69 HB2 ARG 55 1HB ARG 55 2.161 -1.144 -7.420 70 HB3 ARG 55 2HB ARG 55 2.328 -0.399 -5.838 71 HG2 ARG 55 1HG ARG 55 4.448 -1.238 -6.343 72 HG3 ARG 55 2HG ARG 55 3.761 -2.399 -5.208 73 HD2 ARG 55 1HD ARG 55 4.153 -4.013 -6.684 74 HD3 ARG 55 2HD ARG 55 3.005 -3.254 -7.782 75 HE ARG 55 HE ARG 55 5.905 -3.074 -7.884 76 HH11 ARG 55 1HH1 ARG 55 2.834 -1.931 -9.121 77 HH12 ARG 55 2HH1 ARG 55 3.517 -1.306 -10.581 78 HH21 ARG 55 1HH2 ARG 55 6.800 -2.240 -9.809 79 HH22 ARG 55 2HH2 ARG 55 5.769 -1.482 -10.974 80 H ILE 56 H ILE 56 -0.175 -1.869 -3.696 81 HA ILE 56 HA ILE 56 -1.875 0.250 -4.819 82 HB ILE 56 HB ILE 56 -3.875 -0.740 -3.756 83 HG12 ILE 56 1HG1 ILE 56 -2.226 -3.256 -3.469 84 HG13 ILE 56 2HG1 ILE 56 -2.539 -2.156 -2.130 85 HG21 ILE 56 1HG2 ILE 56 -2.419 -2.188 -5.933 86 HG22 ILE 56 2HG2 ILE 56 -3.803 -1.103 -6.043 87 HG23 ILE 56 3HG2 ILE 56 -4.009 -2.732 -5.402 88 HD11 ILE 56 3HD1 ILE 56 -4.509 -3.092 -1.765 89 HD12 ILE 56 1HD1 ILE 56 -4.109 -4.298 -2.985 90 HD13 ILE 56 2HD1 ILE 56 -4.995 -2.843 -3.442 91 H LEU 57 H LEU 57 -2.861 1.646 -3.274 92 HA LEU 57 HA LEU 57 -1.318 1.847 -0.801 93 HB2 LEU 57 1HB LEU 57 -1.831 3.759 -2.525 94 HB3 LEU 57 2HB LEU 57 -3.356 3.862 -1.660 95 HG LEU 57 HG LEU 57 -2.067 4.215 0.455 96 HD11 LEU 57 1HD1 LEU 57 0.347 5.016 -1.004 97 HD12 LEU 57 2HD1 LEU 57 0.069 3.276 -0.929 98 HD13 LEU 57 3HD1 LEU 57 0.173 4.217 0.559 99 HD21 LEU 57 3HD2 LEU 57 -1.861 6.128 -1.845 100 HD22 LEU 57 1HD2 LEU 57 -1.265 6.549 -0.240 101 HD23 LEU 57 2HD2 LEU 57 -2.969 6.158 -0.473 102 H VAL 58 H VAL 58 -2.263 1.969 1.257 103 HA VAL 58 HA VAL 58 -5.117 1.258 1.423 104 HB VAL 58 HB VAL 58 -3.020 -0.024 3.169 105 HG11 VAL 58 1HG1 VAL 58 -5.345 0.073 4.015 106 HG12 VAL 58 2HG1 VAL 58 -4.768 -1.572 3.753 107 HG13 VAL 58 3HG1 VAL 58 -5.866 -0.826 2.591 108 HG21 VAL 58 3HG2 VAL 58 -2.974 -1.926 1.798 109 HG22 VAL 58 1HG2 VAL 58 -2.794 -0.570 0.690 110 HG23 VAL 58 2HG2 VAL 58 -4.351 -1.383 0.843 111 H LYS 59 H LYS 59 -6.249 2.218 3.028 112 HA LYS 59 HA LYS 59 -4.787 4.051 4.798 113 HB2 LYS 59 1HB LYS 59 -6.837 4.652 3.175 114 HB3 LYS 59 2HB LYS 59 -7.751 4.162 4.591 115 HG2 LYS 59 1HG LYS 59 -5.526 6.050 5.044 116 HG3 LYS 59 2HG LYS 59 -6.933 6.664 4.174 117 HD2 LYS 59 1HD LYS 59 -7.247 5.140 6.740 118 HD3 LYS 59 2HD LYS 59 -6.879 6.866 6.748 119 HE2 LYS 59 1HE LYS 59 -9.087 7.183 6.618 120 HE3 LYS 59 2HE LYS 59 -8.938 6.686 4.934 121 HZ1 LYS 59 3HZ LYS 59 -9.465 4.433 5.557 122 HZ2 LYS 59 1HZ LYS 59 -10.675 5.465 6.132 123 HZ3 LYS 59 2HZ LYS 59 -9.515 4.848 7.196 124 H ALA 60 H ALA 60 -4.327 3.115 6.692 125 HA ALA 60 HA ALA 60 -5.875 0.993 7.814 126 HB1 ALA 60 3HB ALA 60 -4.314 1.751 9.873 127 HB2 ALA 60 1HB ALA 60 -3.417 2.458 8.530 128 HB3 ALA 60 2HB ALA 60 -3.757 0.728 8.548 129 HA PRO 61 HA PRO 61 -9.017 3.122 10.090 130 HB2 PRO 61 1HB PRO 61 -8.302 1.329 12.359 131 HB3 PRO 61 2HB PRO 61 -9.871 1.608 11.598 132 HG2 PRO 61 1HG PRO 61 -8.529 -0.636 11.129 133 HG3 PRO 61 2HG PRO 61 -9.414 0.179 9.824 134 HD2 PRO 61 1HD PRO 61 -6.476 0.137 10.384 135 HD3 PRO 61 2HD PRO 61 -7.329 0.088 8.827 136 H GLY 62 H GLY 62 -8.182 5.155 10.461 137 HA2 GLY 62 1HA GLY 62 -7.757 6.788 12.136 138 HA3 GLY 62 2HA GLY 62 -6.954 5.555 13.094 139 H TYR 63 H TYR 63 -5.367 4.584 10.811 140 HA TYR 63 HA TYR 63 -3.285 6.626 10.922 141 HB2 TYR 63 1HB TYR 63 -3.175 3.934 11.262 142 HB3 TYR 63 2HB TYR 63 -2.749 4.056 9.560 143 HD1 TYR 63 HD1 TYR 63 -1.893 5.981 12.665 144 HD2 TYR 63 HD2 TYR 63 -0.490 3.960 9.193 145 HE1 TYR 63 HE1 TYR 63 0.422 6.532 13.286 146 HE2 TYR 63 HE2 TYR 63 1.824 4.503 9.805 147 HH TYR 63 HH TYR 63 3.096 5.055 11.920 148 HA PRO 64 HA PRO 64 -3.906 8.101 6.796 149 HB2 PRO 64 1HB PRO 64 -1.282 8.602 6.099 150 HB3 PRO 64 2HB PRO 64 -2.291 9.684 7.066 151 HG2 PRO 64 1HG PRO 64 -0.237 7.704 7.958 152 HG3 PRO 64 2HG PRO 64 -0.566 9.336 8.571 153 HD2 PRO 64 1HD PRO 64 -1.400 7.142 9.871 154 HD3 PRO 64 2HD PRO 64 -2.367 8.628 9.841 155 H TRP 65 H TRP 65 -3.038 7.767 4.509 156 HA TRP 65 HA TRP 65 -3.206 5.038 3.845 157 HB2 TRP 65 1HB TRP 65 -2.185 7.306 2.118 158 HB3 TRP 65 2HB TRP 65 -2.724 5.732 1.546 159 HD1 TRP 65 HD1 TRP 65 -4.107 8.985 3.064 160 HE1 TRP 65 HE1 TRP 65 -6.613 9.141 2.508 161 HE3 TRP 65 HE3 TRP 65 -4.756 4.385 0.921 162 HZ2 TRP 65 HZ2 TRP 65 -8.602 7.533 1.316 163 HZ3 TRP 65 HZ3 TRP 65 -6.994 3.775 0.097 164 HH2 TRP 65 HH2 TRP 65 -8.876 5.317 0.292 165 H TRP 66 H TRP 66 -1.719 3.483 3.511 166 HA TRP 66 HA TRP 66 1.130 4.240 3.569 167 HB2 TRP 66 1HB TRP 66 -0.070 3.010 5.644 168 HB3 TRP 66 2HB TRP 66 0.356 1.598 4.682 169 HD1 TRP 66 HD1 TRP 66 2.601 0.616 5.374 170 HE1 TRP 66 HE1 TRP 66 4.820 1.534 6.297 171 HE3 TRP 66 HE3 TRP 66 1.412 5.585 5.561 172 HZ2 TRP 66 HZ2 TRP 66 5.920 4.030 7.013 173 HZ3 TRP 66 HZ3 TRP 66 3.110 7.171 6.371 174 HH2 TRP 66 HH2 TRP 66 5.320 6.403 7.073 175 HA PRO 67 HA PRO 67 1.473 1.914 -0.192 176 HB2 PRO 67 1HB PRO 67 4.117 1.269 -0.102 177 HB3 PRO 67 2HB PRO 67 3.530 2.890 -0.489 178 HG2 PRO 67 1HG PRO 67 4.534 1.813 2.121 179 HG3 PRO 67 2HG PRO 67 4.911 3.356 1.333 180 HD2 PRO 67 1HD PRO 67 3.127 3.192 3.334 181 HD3 PRO 67 2HD PRO 67 2.909 4.323 1.983 182 H ALA 68 H ALA 68 0.646 -0.056 -0.439 183 HA ALA 68 HA ALA 68 1.899 -2.322 0.966 184 HB1 ALA 68 3HB ALA 68 -0.534 -1.374 1.709 185 HB2 ALA 68 1HB ALA 68 -0.012 -3.047 1.898 186 HB3 ALA 68 2HB ALA 68 -0.991 -2.580 0.506 187 H LEU 69 H LEU 69 0.912 -4.443 -0.039 188 HA LEU 69 HA LEU 69 0.660 -4.134 -2.951 189 HB2 LEU 69 1HB LEU 69 2.926 -5.203 -1.551 190 HB3 LEU 69 2HB LEU 69 2.182 -6.469 -2.508 191 HG LEU 69 HG LEU 69 2.589 -3.896 -3.902 192 HD11 LEU 69 1HD1 LEU 69 4.873 -3.929 -4.057 193 HD12 LEU 69 2HD1 LEU 69 4.994 -5.632 -3.614 194 HD13 LEU 69 3HD1 LEU 69 4.651 -4.421 -2.380 195 HD21 LEU 69 3HD2 LEU 69 3.568 -6.487 -4.937 196 HD22 LEU 69 1HD2 LEU 69 2.669 -5.204 -5.746 197 HD23 LEU 69 2HD2 LEU 69 1.827 -6.337 -4.690 198 H LEU 70 H LEU 70 -1.084 -5.158 -3.648 199 HA LEU 70 HA LEU 70 -2.724 -6.772 -2.070 200 HB2 LEU 70 1HB LEU 70 -3.046 -5.526 -4.422 201 HB3 LEU 70 2HB LEU 70 -2.823 -7.163 -5.006 202 HG LEU 70 HG LEU 70 -4.861 -6.515 -2.892 203 HD11 LEU 70 1HD1 LEU 70 -4.950 -5.369 -5.356 204 HD12 LEU 70 2HD1 LEU 70 -6.359 -5.755 -4.372 205 HD13 LEU 70 3HD1 LEU 70 -5.833 -6.870 -5.631 206 HD21 LEU 70 3HD2 LEU 70 -5.871 -8.584 -3.603 207 HD22 LEU 70 1HD2 LEU 70 -4.173 -8.870 -3.227 208 HD23 LEU 70 2HD2 LEU 70 -4.696 -8.752 -4.906 209 H LEU 71 H LEU 71 -2.613 -8.810 -1.453 210 HA LEU 71 HA LEU 71 -0.784 -10.630 -2.866 211 HB2 LEU 71 1HB LEU 71 -1.579 -10.310 -0.026 212 HB3 LEU 71 2HB LEU 71 -1.294 -11.946 -0.583 213 HG LEU 71 HG LEU 71 0.779 -9.869 -1.136 214 HD11 LEU 71 1HD1 LEU 71 1.817 -10.482 1.073 215 HD12 LEU 71 2HD1 LEU 71 0.253 -11.158 1.532 216 HD13 LEU 71 3HD1 LEU 71 0.399 -9.439 1.163 217 HD21 LEU 71 3HD2 LEU 71 0.633 -12.832 -0.825 218 HD22 LEU 71 1HD2 LEU 71 2.157 -12.004 -0.503 219 HD23 LEU 71 2HD2 LEU 71 1.396 -11.868 -2.088 220 H ARG 72 H ARG 72 -3.927 -10.665 -1.143 221 HA ARG 72 HA ARG 72 -5.099 -12.290 -3.214 222 HB2 ARG 72 1HB ARG 72 -3.979 -13.548 -0.893 223 HB3 ARG 72 2HB ARG 72 -5.726 -13.745 -0.874 224 HG2 ARG 72 1HG ARG 72 -4.539 -14.268 -3.485 225 HG3 ARG 72 2HG ARG 72 -3.944 -15.335 -2.213 226 HD2 ARG 72 1HD ARG 72 -6.861 -14.867 -2.287 227 HD3 ARG 72 2HD ARG 72 -6.185 -15.805 -3.618 228 HE ARG 72 HE ARG 72 -5.117 -16.992 -1.440 229 HH11 ARG 72 1HH1 ARG 72 -8.407 -16.162 -2.312 230 HH12 ARG 72 2HH1 ARG 72 -9.103 -17.475 -1.425 231 HH21 ARG 72 1HH2 ARG 72 -6.046 -18.722 -0.273 232 HH22 ARG 72 2HH2 ARG 72 -7.765 -18.926 -0.269 233 H ARG 73 H ARG 73 -7.383 -12.487 -3.056 234 HA ARG 73 HA ARG 73 -8.581 -10.541 -1.198 235 HB2 ARG 73 1HB ARG 73 -10.468 -10.457 -2.871 236 HB3 ARG 73 2HB ARG 73 -8.941 -9.786 -3.420 237 HG2 ARG 73 1HG ARG 73 -8.666 -11.360 -5.017 238 HG3 ARG 73 2HG ARG 73 -9.422 -12.628 -4.052 239 HD2 ARG 73 1HD ARG 73 -11.618 -11.414 -4.454 240 HD3 ARG 73 2HD ARG 73 -10.758 -10.471 -5.669 241 HE ARG 73 HE ARG 73 -10.798 -12.287 -7.063 242 HH11 ARG 73 1HH1 ARG 73 -11.616 -13.339 -3.823 243 HH12 ARG 73 2HH1 ARG 73 -12.083 -14.928 -4.322 244 HH21 ARG 73 1HH2 ARG 73 -11.410 -14.388 -7.716 245 HH22 ARG 73 2HH2 ARG 73 -11.963 -15.525 -6.534 246 H LYS 74 H LYS 74 -9.634 -11.426 0.431 247 HA LYS 74 HA LYS 74 -10.865 -14.071 0.070 248 HB2 LYS 74 1HB LYS 74 -10.861 -13.944 2.686 249 HB3 LYS 74 2HB LYS 74 -9.396 -14.370 1.817 250 HG2 LYS 74 1HG LYS 74 -8.359 -12.392 2.303 251 HG3 LYS 74 2HG LYS 74 -9.879 -11.510 2.473 252 HD2 LYS 74 1HD LYS 74 -10.292 -12.913 4.551 253 HD3 LYS 74 2HD LYS 74 -8.606 -13.416 4.424 254 HE2 LYS 74 1HE LYS 74 -7.807 -11.264 4.836 255 HE3 LYS 74 2HE LYS 74 -9.347 -10.513 4.426 256 HZ1 LYS 74 3HZ LYS 74 -8.529 -11.832 6.917 257 HZ2 LYS 74 1HZ LYS 74 -10.163 -11.873 6.479 258 HZ3 LYS 74 2HZ LYS 74 -9.383 -10.388 6.693 259 H GLU 75 H GLU 75 -13.001 -14.314 0.248 260 HA GLU 75 HA GLU 75 -14.596 -11.968 1.013 261 HB2 GLU 75 1HB GLU 75 -14.755 -13.712 -1.186 262 HB3 GLU 75 2HB GLU 75 -16.130 -14.111 -0.167 263 HG2 GLU 75 1HG GLU 75 -16.576 -11.589 -0.125 264 HG3 GLU 75 2HG GLU 75 -15.466 -11.515 -1.494 265 H THR 76 H THR 76 -15.161 -12.041 3.105 266 HA THR 76 HA THR 76 -16.154 -14.607 4.149 267 HB THR 76 HB THR 76 -14.025 -13.958 5.194 268 HG1 THR 76 HG1 THR 76 -16.187 -13.661 7.007 269 HG21 THR 76 3HG2 THR 76 -14.104 -11.558 5.063 270 HG22 THR 76 1HG2 THR 76 -13.930 -12.060 6.742 271 HG23 THR 76 2HG2 THR 76 -15.494 -11.511 6.144 272 H LYS 77 H LYS 77 -18.176 -14.652 4.890 273 HA LYS 77 HA LYS 77 -19.591 -12.083 5.143 274 HB2 LYS 77 1HB LYS 77 -21.664 -13.446 4.826 275 HB3 LYS 77 2HB LYS 77 -20.580 -13.444 3.443 276 HG2 LYS 77 1HG LYS 77 -19.920 -15.651 3.804 277 HG3 LYS 77 2HG LYS 77 -20.493 -15.646 5.473 278 HD2 LYS 77 1HD LYS 77 -22.028 -16.941 4.171 279 HD3 LYS 77 2HD LYS 77 -22.821 -15.421 4.591 280 HE2 LYS 77 1HE LYS 77 -22.397 -14.530 2.398 281 HE3 LYS 77 2HE LYS 77 -21.423 -15.936 1.969 282 HZ1 LYS 77 3HZ LYS 77 -23.943 -15.722 1.275 283 HZ2 LYS 77 1HZ LYS 77 -24.186 -16.412 2.801 284 HZ3 LYS 77 2HZ LYS 77 -23.250 -17.219 1.647 285 H ASP 78 H ASP 78 -21.232 -11.889 6.800 286 HA ASP 78 HA ASP 78 -20.538 -13.399 9.218 287 HB2 ASP 78 1HB ASP 78 -20.124 -10.850 9.109 288 HB3 ASP 78 2HB ASP 78 -21.871 -10.713 9.256 289 H SER 79 H SER 79 -23.172 -12.172 7.305 290 HA SER 79 HA SER 79 -25.365 -12.607 7.311 291 HB2 SER 79 1HB SER 79 -24.416 -14.885 6.839 292 HB3 SER 79 2HB SER 79 -24.604 -15.246 8.555 293 HG SER 79 HG SER 79 -26.798 -15.069 8.348 294 H LEU 80 H LEU 80 -24.248 -11.340 9.721 295 HA LEU 80 HA LEU 80 -26.283 -12.156 11.688 296 HB2 LEU 80 1HB LEU 80 -23.457 -11.765 11.951 297 HB3 LEU 80 2HB LEU 80 -24.289 -10.591 12.950 298 HG LEU 80 HG LEU 80 -25.033 -13.492 13.107 299 HD11 LEU 80 1HD1 LEU 80 -22.862 -13.890 13.608 300 HD12 LEU 80 2HD1 LEU 80 -23.366 -13.278 15.183 301 HD13 LEU 80 3HD1 LEU 80 -22.538 -12.211 14.047 302 HD21 LEU 80 3HD2 LEU 80 -25.270 -12.593 15.575 303 HD22 LEU 80 1HD2 LEU 80 -26.532 -12.325 14.376 304 HD23 LEU 80 2HD2 LEU 80 -25.388 -11.038 14.751 305 H ASN 81 H ASN 81 -24.864 -9.499 9.917 306 HA ASN 81 HA ASN 81 -25.792 -7.299 11.295 307 HB2 ASN 81 1HB ASN 81 -24.526 -7.719 8.889 308 HB3 ASN 81 2HB ASN 81 -26.078 -7.058 8.382 309 HD21 ASN 81 2HD2 ASN 81 -23.619 -6.467 10.889 310 HD22 ASN 81 1HD2 ASN 81 -23.616 -4.741 10.706 311 H THR 82 H THR 82 -27.505 -9.189 8.804 312 HA THR 82 HA THR 82 -30.021 -8.877 10.018 313 HB THR 82 HB THR 82 -30.084 -6.615 9.365 314 HG1 THR 82 HG1 THR 82 -32.012 -7.243 8.743 315 HG21 THR 82 3HG2 THR 82 -28.167 -6.894 7.660 316 HG22 THR 82 1HG2 THR 82 -29.396 -5.657 7.385 317 HG23 THR 82 2HG2 THR 82 -29.465 -7.180 6.500 318 H ASN 83 H ASN 83 -28.643 -9.050 6.719 319 HA ASN 83 HA ASN 83 -29.347 -11.764 6.360 320 HB2 ASN 83 1HB ASN 83 -31.440 -9.881 5.816 321 HB3 ASN 83 2HB ASN 83 -30.920 -10.602 4.296 322 HD21 ASN 83 2HD2 ASN 83 -30.544 -13.075 4.532 323 HD22 ASN 83 1HD2 ASN 83 -31.837 -13.932 5.313 324 H SER 84 H SER 84 -27.740 -12.457 5.122 325 HA SER 84 HA SER 84 -26.116 -12.583 3.540 326 HB2 SER 84 1HB SER 84 -28.251 -12.222 2.109 327 HB3 SER 84 2HB SER 84 -27.625 -10.591 1.864 328 HG SER 84 HG SER 84 -25.862 -11.413 0.842 329 H SER 85 H SER 85 -24.893 -11.327 5.245 330 HA SER 85 HA SER 85 -24.149 -8.663 4.253 331 HB2 SER 85 1HB SER 85 -24.241 -9.854 6.992 332 HB3 SER 85 2HB SER 85 -23.045 -8.602 6.658 333 HG SER 85 HG SER 85 -24.626 -7.164 6.285 334 H PHE 86 H PHE 86 -22.613 -9.135 2.767 335 HA PHE 86 HA PHE 86 -20.472 -10.989 3.362 336 HB2 PHE 86 1HB PHE 86 -21.334 -9.415 0.978 337 HB3 PHE 86 2HB PHE 86 -19.654 -9.933 1.065 338 HD1 PHE 86 HD2 PHE 86 -19.217 -12.429 1.453 339 HD2 PHE 86 HD1 PHE 86 -22.971 -10.862 0.203 340 HE1 PHE 86 HE2 PHE 86 -19.851 -14.643 0.593 341 HE2 PHE 86 HE1 PHE 86 -23.611 -13.074 -0.661 342 HZ PHE 86 HZ PHE 86 -22.049 -14.968 -0.471 343 H ASN 87 H ASN 87 -18.315 -10.483 3.630 344 HA ASN 87 HA ASN 87 -17.609 -7.645 3.892 345 HB2 ASN 87 1HB ASN 87 -17.559 -9.722 5.999 346 HB3 ASN 87 2HB ASN 87 -16.102 -8.743 5.876 347 HD21 ASN 87 2HD2 ASN 87 -18.862 -8.995 7.506 348 HD22 ASN 87 1HD2 ASN 87 -19.171 -7.326 7.872 349 H VAL 88 H VAL 88 -16.642 -7.979 1.824 350 HA VAL 88 HA VAL 88 -14.364 -9.796 1.699 351 HB VAL 88 HB VAL 88 -15.796 -9.810 -0.237 352 HG11 VAL 88 1HG1 VAL 88 -16.862 -7.726 -0.258 353 HG12 VAL 88 2HG1 VAL 88 -15.858 -7.728 -1.708 354 HG13 VAL 88 3HG1 VAL 88 -15.334 -6.846 -0.273 355 HG21 VAL 88 3HG2 VAL 88 -13.298 -8.350 -1.055 356 HG22 VAL 88 1HG2 VAL 88 -14.180 -9.591 -1.946 357 HG23 VAL 88 2HG2 VAL 88 -13.292 -10.017 -0.483 358 H LEU 89 H LEU 89 -12.282 -9.190 1.643 359 HA LEU 89 HA LEU 89 -11.651 -6.318 1.629 360 HB2 LEU 89 1HB LEU 89 -10.183 -8.212 3.431 361 HB3 LEU 89 2HB LEU 89 -10.246 -6.463 3.492 362 HG LEU 89 HG LEU 89 -12.632 -8.201 4.113 363 HD11 LEU 89 1HD1 LEU 89 -11.132 -8.858 5.764 364 HD12 LEU 89 2HD1 LEU 89 -12.010 -7.528 6.518 365 HD13 LEU 89 3HD1 LEU 89 -10.393 -7.260 5.868 366 HD21 LEU 89 3HD2 LEU 89 -12.919 -5.897 5.499 367 HD22 LEU 89 1HD2 LEU 89 -13.582 -6.171 3.889 368 HD23 LEU 89 2HD2 LEU 89 -12.054 -5.314 4.078 369 H TYR 90 H TYR 90 -9.109 -6.110 1.587 370 HA TYR 90 HA TYR 90 -8.111 -7.969 -0.473 371 HB2 TYR 90 1HB TYR 90 -8.218 -5.041 -0.370 372 HB3 TYR 90 2HB TYR 90 -6.624 -5.665 -0.778 373 HD1 TYR 90 HD2 TYR 90 -7.461 -8.128 -2.274 374 HD2 TYR 90 HD1 TYR 90 -8.905 -4.129 -2.434 375 HE1 TYR 90 HE2 TYR 90 -8.194 -8.492 -4.583 376 HE2 TYR 90 HE1 TYR 90 -9.642 -4.486 -4.753 377 HH TYR 90 HH TYR 90 -8.608 -6.760 -6.686 378 H LYS 91 H LYS 91 -6.712 -9.309 0.520 379 HA LYS 91 HA LYS 91 -5.156 -8.554 2.797 380 HB2 LYS 91 1HB LYS 91 -4.711 -10.938 0.989 381 HB3 LYS 91 2HB LYS 91 -4.161 -10.748 2.646 382 HG2 LYS 91 1HG LYS 91 -6.747 -10.508 3.113 383 HG3 LYS 91 2HG LYS 91 -6.860 -11.412 1.601 384 HD2 LYS 91 1HD LYS 91 -5.103 -12.307 3.873 385 HD3 LYS 91 2HD LYS 91 -6.803 -12.760 3.769 386 HE2 LYS 91 1HE LYS 91 -6.225 -14.448 2.446 387 HE3 LYS 91 2HE LYS 91 -5.711 -13.274 1.235 388 HZ1 LYS 91 3HZ LYS 91 -3.507 -13.261 2.254 389 HZ2 LYS 91 1HZ LYS 91 -3.937 -14.818 1.749 390 HZ3 LYS 91 2HZ LYS 91 -4.006 -14.412 3.389 391 H VAL 92 H VAL 92 -3.710 -6.958 2.475 392 HA VAL 92 HA VAL 92 -1.836 -7.240 0.216 393 HB VAL 92 HB VAL 92 -1.489 -4.818 0.327 394 HG11 VAL 92 1HG1 VAL 92 -4.181 -4.370 -0.024 395 HG12 VAL 92 2HG1 VAL 92 -4.019 -6.097 -0.340 396 HG13 VAL 92 3HG1 VAL 92 -3.056 -4.939 -1.256 397 HG21 VAL 92 3HG2 VAL 92 -3.612 -3.823 1.785 398 HG22 VAL 92 1HG2 VAL 92 -1.917 -3.815 2.276 399 HG23 VAL 92 2HG2 VAL 92 -2.984 -5.115 2.805 400 H LEU 93 H LEU 93 0.365 -6.560 0.554 401 HA LEU 93 HA LEU 93 1.256 -7.094 3.296 402 HB2 LEU 93 1HB LEU 93 2.105 -8.300 1.107 403 HB3 LEU 93 2HB LEU 93 3.125 -6.883 0.971 404 HG LEU 93 HG LEU 93 4.070 -7.375 3.209 405 HD11 LEU 93 1HD1 LEU 93 2.447 -9.910 3.000 406 HD12 LEU 93 2HD1 LEU 93 2.183 -8.601 4.151 407 HD13 LEU 93 3HD1 LEU 93 3.661 -9.560 4.229 408 HD21 LEU 93 3HD2 LEU 93 5.550 -8.195 1.718 409 HD22 LEU 93 1HD2 LEU 93 4.325 -9.116 0.845 410 HD23 LEU 93 2HD2 LEU 93 5.003 -9.750 2.343 411 H PHE 94 H PHE 94 2.198 -5.577 4.486 412 HA PHE 94 HA PHE 94 2.451 -2.893 3.365 413 HB2 PHE 94 1HB PHE 94 1.988 -4.033 6.067 414 HB3 PHE 94 2HB PHE 94 2.914 -2.540 6.000 415 HD1 PHE 94 HD2 PHE 94 -0.089 -3.819 4.159 416 HD2 PHE 94 HD1 PHE 94 1.625 -0.741 6.552 417 HE1 PHE 94 HE2 PHE 94 -2.174 -2.527 3.988 418 HE2 PHE 94 HE1 PHE 94 -0.458 0.552 6.384 419 HZ PHE 94 HZ PHE 94 -2.362 -0.339 5.101 420 H PHE 95 H PHE 95 4.327 -1.567 3.991 421 HA PHE 95 HA PHE 95 6.749 -3.044 4.687 422 HB2 PHE 95 1HB PHE 95 6.644 -1.265 2.243 423 HB3 PHE 95 2HB PHE 95 8.001 -2.243 2.790 424 HD1 PHE 95 HD2 PHE 95 4.617 -2.374 1.325 425 HD2 PHE 95 HD1 PHE 95 8.182 -4.524 2.206 426 HE1 PHE 95 HE2 PHE 95 3.845 -4.230 -0.090 427 HE2 PHE 95 HE1 PHE 95 7.416 -6.383 0.791 428 HZ PHE 95 HZ PHE 95 5.243 -6.239 -0.358 429 HA PRO 96 HA PRO 96 8.885 -2.584 4.831 430 HB2 PRO 96 1HB PRO 96 10.582 -2.146 6.859 431 HB3 PRO 96 2HB PRO 96 10.639 -1.174 5.383 432 HG2 PRO 96 1HG PRO 96 9.445 -0.515 8.046 433 HG3 PRO 96 2HG PRO 96 10.389 0.515 6.956 434 HD2 PRO 96 1HD PRO 96 7.641 0.549 7.142 435 HD3 PRO 96 2HD PRO 96 8.557 1.081 5.721 436 H ASP 97 H ASP 97 10.025 -3.933 6.940 437 HA ASP 97 HA ASP 97 9.690 -5.422 8.625 438 HB2 ASP 97 1HB ASP 97 8.233 -3.294 9.482 439 HB3 ASP 97 2HB ASP 97 6.976 -4.520 9.363 440 H PHE 98 H PHE 98 8.071 -5.356 5.829 441 HA PHE 98 HA PHE 98 6.672 -6.734 4.683 442 HB2 PHE 98 1HB PHE 98 8.404 -8.427 6.350 443 HB3 PHE 98 2HB PHE 98 6.946 -9.230 5.774 444 HD1 PHE 98 HD1 PHE 98 10.048 -7.544 4.748 445 HD2 PHE 98 HD2 PHE 98 6.660 -9.784 3.480 446 HE1 PHE 98 HE1 PHE 98 11.121 -7.920 2.566 447 HE2 PHE 98 HE2 PHE 98 7.729 -10.168 1.296 448 HZ PHE 98 HZ PHE 98 9.961 -9.237 0.837 449 H ASN 99 H ASN 99 5.443 -5.350 6.872 450 HA ASN 99 HA ASN 99 3.735 -7.092 8.342 451 HB2 ASN 99 1HB ASN 99 4.169 -4.220 8.086 452 HB3 ASN 99 2HB ASN 99 2.460 -4.612 8.229 453 HD21 ASN 99 2HD2 ASN 99 1.754 -5.786 10.091 454 HD22 ASN 99 1HD2 ASN 99 2.669 -5.716 11.564 455 H PHE 100 H PHE 100 1.164 -6.217 8.051 456 HA PHE 100 HA PHE 100 0.357 -6.113 5.306 457 HB2 PHE 100 1HB PHE 100 -1.067 -8.355 5.823 458 HB3 PHE 100 2HB PHE 100 0.464 -8.352 4.960 459 HD1 PHE 100 HD1 PHE 100 -1.219 -9.139 8.102 460 HD2 PHE 100 HD2 PHE 100 2.478 -9.168 6.001 461 HE1 PHE 100 HE1 PHE 100 -0.270 -10.629 9.802 462 HE2 PHE 100 HE2 PHE 100 3.438 -10.660 7.696 463 HZ PHE 100 HZ PHE 100 2.068 -11.396 9.601 464 H ALA 101 H ALA 101 -2.137 -6.554 5.186 465 HA ALA 101 HA ALA 101 -3.614 -5.953 7.573 466 HB1 ALA 101 3HB ALA 101 -4.484 -3.815 6.091 467 HB2 ALA 101 1HB ALA 101 -2.742 -3.797 5.810 468 HB3 ALA 101 2HB ALA 101 -3.371 -3.732 7.457 469 H TRP 102 H TRP 102 -5.956 -5.622 7.113 470 HA TRP 102 HA TRP 102 -6.818 -6.802 4.567 471 HB2 TRP 102 1HB TRP 102 -8.627 -7.983 6.082 472 HB3 TRP 102 2HB TRP 102 -7.050 -8.721 5.837 473 HD1 TRP 102 HD1 TRP 102 -5.341 -8.683 7.930 474 HE1 TRP 102 HE1 TRP 102 -5.754 -8.440 10.458 475 HE3 TRP 102 HE3 TRP 102 -10.115 -6.853 7.805 476 HZ2 TRP 102 HZ2 TRP 102 -7.832 -7.588 12.173 477 HZ3 TRP 102 HZ3 TRP 102 -11.243 -6.352 9.931 478 HH2 TRP 102 HH2 TRP 102 -10.122 -6.712 12.071 479 H VAL 103 H VAL 103 -7.866 -5.115 3.678 480 HA VAL 103 HA VAL 103 -10.151 -4.010 5.136 481 HB VAL 103 HB VAL 103 -9.586 -1.704 4.350 482 HG11 VAL 103 1HG1 VAL 103 -9.200 -2.474 6.669 483 HG12 VAL 103 2HG1 VAL 103 -8.071 -1.219 6.160 484 HG13 VAL 103 3HG1 VAL 103 -7.548 -2.901 6.222 485 HG21 VAL 103 3HG2 VAL 103 -6.723 -2.376 4.124 486 HG22 VAL 103 1HG2 VAL 103 -7.683 -1.179 3.254 487 HG23 VAL 103 2HG2 VAL 103 -7.736 -2.873 2.769 488 H LYS 104 H LYS 104 -11.678 -2.867 3.734 489 HA LYS 104 HA LYS 104 -12.104 -4.270 1.294 490 HB2 LYS 104 1HB LYS 104 -13.793 -3.119 2.965 491 HB3 LYS 104 2HB LYS 104 -13.548 -1.726 1.922 492 HG2 LYS 104 1HG LYS 104 -14.374 -2.907 0.024 493 HG3 LYS 104 2HG LYS 104 -14.406 -4.428 0.917 494 HD2 LYS 104 1HD LYS 104 -15.937 -2.253 2.159 495 HD3 LYS 104 2HD LYS 104 -16.542 -2.765 0.582 496 HE2 LYS 104 1HE LYS 104 -17.465 -4.567 1.493 497 HE3 LYS 104 2HE LYS 104 -15.895 -5.087 2.103 498 HZ1 LYS 104 3HZ LYS 104 -17.542 -4.836 3.874 499 HZ2 LYS 104 1HZ LYS 104 -17.724 -3.196 3.488 500 HZ3 LYS 104 2HZ LYS 104 -16.246 -3.767 4.081 501 H ARG 105 H ARG 105 -12.438 -3.231 -0.816 502 HA ARG 105 HA ARG 105 -10.189 -1.884 -1.751 503 HB2 ARG 105 1HB ARG 105 -12.914 -1.794 -3.045 504 HB3 ARG 105 2HB ARG 105 -11.354 -1.625 -3.837 505 HG2 ARG 105 1HG ARG 105 -11.462 -3.790 -4.293 506 HG3 ARG 105 2HG ARG 105 -11.211 -4.090 -2.572 507 HD2 ARG 105 1HD ARG 105 -13.161 -5.294 -3.395 508 HD3 ARG 105 2HD ARG 105 -13.626 -4.074 -2.209 509 HE ARG 105 HE ARG 105 -13.887 -2.839 -4.645 510 HH11 ARG 105 1HH1 ARG 105 -15.210 -5.722 -3.166 511 HH12 ARG 105 2HH1 ARG 105 -16.703 -5.634 -4.039 512 HH21 ARG 105 1HH2 ARG 105 -15.865 -2.723 -5.788 513 HH22 ARG 105 2HH2 ARG 105 -17.074 -3.933 -5.526 514 H ASN 106 H ASN 106 -13.065 -0.610 -0.281 515 HA ASN 106 HA ASN 106 -13.087 1.996 -1.276 516 HB2 ASN 106 1HB ASN 106 -14.085 0.678 1.198 517 HB3 ASN 106 2HB ASN 106 -13.983 2.434 1.204 518 HD21 ASN 106 2HD2 ASN 106 -15.986 -0.074 0.621 519 HD22 ASN 106 1HD2 ASN 106 -17.090 0.679 -0.488 520 H SER 107 H SER 107 -11.240 0.567 1.384 521 HA SER 107 HA SER 107 -9.941 3.122 1.922 522 HB2 SER 107 1HB SER 107 -10.695 1.119 3.600 523 HB3 SER 107 2HB SER 107 -8.997 0.713 3.347 524 HG SER 107 HG SER 107 -8.621 2.211 4.764 525 H VAL 108 H VAL 108 -9.540 1.314 -0.558 526 HA VAL 108 HA VAL 108 -6.598 1.294 -0.425 527 HB VAL 108 HB VAL 108 -8.328 -0.678 -1.916 528 HG11 VAL 108 1HG1 VAL 108 -5.502 -1.313 -1.576 529 HG12 VAL 108 2HG1 VAL 108 -5.780 0.123 -2.558 530 HG13 VAL 108 3HG1 VAL 108 -6.521 -1.411 -3.011 531 HG21 VAL 108 3HG2 VAL 108 -6.874 -2.175 -0.210 532 HG22 VAL 108 1HG2 VAL 108 -8.498 -1.589 0.139 533 HG23 VAL 108 2HG2 VAL 108 -7.096 -0.718 0.758 534 H LYS 109 H LYS 109 -5.537 2.293 -2.069 535 HA LYS 109 HA LYS 109 -7.134 3.193 -4.383 536 HB2 LYS 109 1HB LYS 109 -6.605 5.029 -2.764 537 HB3 LYS 109 2HB LYS 109 -4.896 4.748 -3.071 538 HG2 LYS 109 1HG LYS 109 -5.121 6.335 -4.625 539 HG3 LYS 109 2HG LYS 109 -5.860 5.064 -5.599 540 HD2 LYS 109 1HD LYS 109 -7.950 5.968 -4.042 541 HD3 LYS 109 2HD LYS 109 -7.050 7.442 -4.407 542 HE2 LYS 109 1HE LYS 109 -7.270 7.114 -6.737 543 HE3 LYS 109 2HE LYS 109 -7.820 5.453 -6.528 544 HZ1 LYS 109 3HZ LYS 109 -9.308 7.944 -6.305 545 HZ2 LYS 109 1HZ LYS 109 -9.703 6.744 -5.178 546 HZ3 LYS 109 2HZ LYS 109 -9.819 6.421 -6.833 547 HA PRO 110 HA PRO 110 -4.179 0.882 -6.798 548 HB2 PRO 110 1HB PRO 110 -4.932 2.864 -8.888 549 HB3 PRO 110 2HB PRO 110 -4.932 1.098 -8.958 550 HG2 PRO 110 1HG PRO 110 -7.216 2.449 -8.738 551 HG3 PRO 110 2HG PRO 110 -6.971 0.921 -7.873 552 HD2 PRO 110 1HD PRO 110 -6.904 3.720 -6.834 553 HD3 PRO 110 2HD PRO 110 -7.515 2.244 -6.062 554 H LEU 111 H LEU 111 -2.040 1.116 -6.782 555 HA LEU 111 HA LEU 111 -0.902 3.812 -7.149 556 HB2 LEU 111 1HB LEU 111 -0.669 2.118 -4.949 557 HB3 LEU 111 2HB LEU 111 0.852 1.924 -5.803 558 HG LEU 111 HG LEU 111 -0.254 4.621 -5.026 559 HD11 LEU 111 1HD1 LEU 111 1.983 3.587 -3.464 560 HD12 LEU 111 2HD1 LEU 111 0.478 2.703 -3.219 561 HD13 LEU 111 3HD1 LEU 111 0.531 4.442 -2.946 562 HD21 LEU 111 3HD2 LEU 111 1.370 5.125 -6.528 563 HD22 LEU 111 1HD2 LEU 111 2.241 3.614 -6.267 564 HD23 LEU 111 2HD2 LEU 111 2.392 4.930 -5.104 565 H LEU 112 H LEU 112 1.145 3.959 -8.236 566 HA LEU 112 HA LEU 112 1.815 1.619 -9.894 567 HB2 LEU 112 1HB LEU 112 2.484 3.427 -11.639 568 HB3 LEU 112 2HB LEU 112 0.807 2.939 -11.488 569 HG LEU 112 HG LEU 112 1.533 5.239 -9.810 570 HD11 LEU 112 1HD1 LEU 112 2.940 5.811 -11.663 571 HD12 LEU 112 2HD1 LEU 112 1.493 6.816 -11.725 572 HD13 LEU 112 3HD1 LEU 112 1.658 5.438 -12.814 573 HD21 LEU 112 3HD2 LEU 112 -0.592 6.033 -10.492 574 HD22 LEU 112 1HD2 LEU 112 -0.766 4.298 -10.234 575 HD23 LEU 112 2HD2 LEU 112 -0.637 4.936 -11.872 576 H ASP 113 H ASP 113 4.041 1.677 -10.778 577 HA ASP 113 HA ASP 113 5.935 2.107 -8.752 578 HB2 ASP 113 1HB ASP 113 6.018 0.586 -10.896 579 HB3 ASP 113 2HB ASP 113 6.796 1.994 -11.614 580 H SER 114 H SER 114 5.114 4.035 -11.618 581 HA SER 114 HA SER 114 7.150 5.953 -11.388 582 HB2 SER 114 1HB SER 114 4.556 5.761 -12.789 583 HB3 SER 114 2HB SER 114 5.085 7.406 -12.439 584 HG SER 114 HG SER 114 6.602 5.421 -13.793 585 H GLU 115 H GLU 115 4.101 5.573 -9.695 586 HA GLU 115 HA GLU 115 4.174 8.189 -8.487 587 HB2 GLU 115 1HB GLU 115 2.475 5.738 -8.134 588 HB3 GLU 115 2HB GLU 115 2.421 7.016 -6.929 589 HG2 GLU 115 1HG GLU 115 2.026 7.638 -9.824 590 HG3 GLU 115 2HG GLU 115 0.701 7.023 -8.839 591 H ILE 116 H ILE 116 4.977 4.882 -7.485 592 HA ILE 116 HA ILE 116 5.638 5.437 -4.811 593 HB ILE 116 HB ILE 116 6.779 3.275 -6.599 594 HG12 ILE 116 1HG1 ILE 116 4.556 3.035 -4.563 595 HG13 ILE 116 2HG1 ILE 116 4.259 3.320 -6.275 596 HG21 ILE 116 1HG2 ILE 116 7.752 4.044 -4.171 597 HG22 ILE 116 2HG2 ILE 116 7.904 2.427 -4.856 598 HG23 ILE 116 3HG2 ILE 116 6.606 2.782 -3.717 599 HD11 ILE 116 3HD1 ILE 116 5.259 1.217 -6.852 600 HD12 ILE 116 1HD1 ILE 116 4.040 0.955 -5.605 601 HD13 ILE 116 2HD1 ILE 116 5.751 0.948 -5.179 602 H ALA 117 H ALA 117 7.772 5.054 -7.649 603 HA ALA 117 HA ALA 117 10.183 5.762 -6.475 604 HB1 ALA 117 3HB ALA 117 9.575 4.988 -8.922 605 HB2 ALA 117 1HB ALA 117 11.040 5.917 -8.600 606 HB3 ALA 117 2HB ALA 117 9.607 6.724 -9.237 607 H LYS 118 H LYS 118 7.637 7.797 -7.836 608 HA LYS 118 HA LYS 118 8.972 10.270 -7.585 609 HB2 LYS 118 1HB LYS 118 6.550 9.424 -8.610 610 HB3 LYS 118 2HB LYS 118 6.082 10.424 -7.241 611 HG2 LYS 118 1HG LYS 118 6.396 12.205 -8.490 612 HG3 LYS 118 2HG LYS 118 8.119 11.810 -8.546 613 HD2 LYS 118 1HD LYS 118 7.871 10.596 -10.566 614 HD3 LYS 118 2HD LYS 118 6.111 10.583 -10.426 615 HE2 LYS 118 1HE LYS 118 6.299 13.149 -10.555 616 HE3 LYS 118 2HE LYS 118 7.927 12.856 -11.164 617 HZ1 LYS 118 3HZ LYS 118 6.558 11.222 -12.728 618 HZ2 LYS 118 1HZ LYS 118 6.825 12.847 -13.120 619 HZ3 LYS 118 2HZ LYS 118 5.352 12.372 -12.439 620 H PHE 119 H PHE 119 6.519 8.729 -5.524 621 HA PHE 119 HA PHE 119 6.332 10.591 -3.501 622 HB2 PHE 119 1HB PHE 119 4.894 8.690 -3.448 623 HB3 PHE 119 2HB PHE 119 6.252 7.574 -3.415 624 HD1 PHE 119 HD2 PHE 119 7.757 7.636 -1.305 625 HD2 PHE 119 HD1 PHE 119 3.839 9.298 -1.481 626 HE1 PHE 119 HE2 PHE 119 7.599 7.518 1.149 627 HE2 PHE 119 HE1 PHE 119 3.684 9.186 0.972 628 HZ PHE 119 HZ PHE 119 5.568 8.294 2.280 629 H LEU 120 H LEU 120 8.779 8.081 -3.933 630 HA LEU 120 HA LEU 120 10.185 8.664 -1.523 631 HB2 LEU 120 1HB LEU 120 11.008 7.190 -4.021 632 HB3 LEU 120 2HB LEU 120 11.985 7.282 -2.566 633 HG LEU 120 HG LEU 120 9.243 6.328 -2.116 634 HD11 LEU 120 1HD1 LEU 120 9.872 5.359 -4.374 635 HD12 LEU 120 2HD1 LEU 120 9.477 4.193 -3.111 636 HD13 LEU 120 3HD1 LEU 120 11.161 4.493 -3.541 637 HD21 LEU 120 3HD2 LEU 120 11.618 6.333 -0.757 638 HD22 LEU 120 1HD2 LEU 120 11.534 4.677 -1.353 639 HD23 LEU 120 2HD2 LEU 120 10.222 5.327 -0.370 640 H GLY 121 H GLY 121 10.454 9.725 -4.888 641 HA2 GLY 121 1HA GLY 121 12.919 11.161 -4.419 642 HA3 GLY 121 2HA GLY 121 11.964 11.171 -5.891 643 H SER 122 H SER 122 9.957 11.814 -3.264 644 HA SER 122 HA SER 122 9.366 14.421 -4.079 645 HB2 SER 122 1HB SER 122 8.648 12.704 -1.767 646 HB3 SER 122 2HB SER 122 8.436 14.438 -1.542 647 HG SER 122 HG SER 122 6.560 13.764 -2.428 648 H SER 123 H SER 123 10.810 16.030 -4.061 649 HA SER 123 HA SER 123 12.665 16.290 -1.815 650 HB2 SER 123 1HB SER 123 13.938 17.774 -3.210 651 HB3 SER 123 2HB SER 123 13.472 16.397 -4.206 652 HG SER 123 HG SER 123 11.808 17.672 -5.087 653 H LYS 124 H LYS 124 9.799 16.926 -1.530 654 HA LYS 124 HA LYS 124 10.077 19.751 -0.740 655 HB2 LYS 124 1HB LYS 124 7.607 19.972 -1.246 656 HB3 LYS 124 2HB LYS 124 8.668 19.818 -2.640 657 HG2 LYS 124 1HG LYS 124 7.828 17.212 -1.846 658 HG3 LYS 124 2HG LYS 124 6.412 18.256 -1.970 659 HD2 LYS 124 1HD LYS 124 8.515 18.090 -4.118 660 HD3 LYS 124 2HD LYS 124 7.102 17.031 -4.084 661 HE2 LYS 124 1HE LYS 124 6.219 18.674 -5.365 662 HE3 LYS 124 2HE LYS 124 5.878 19.392 -3.791 663 HZ1 LYS 124 3HZ LYS 124 7.141 20.681 -5.727 664 HZ2 LYS 124 1HZ LYS 124 8.481 19.998 -4.953 665 HZ3 LYS 124 2HZ LYS 124 7.419 20.996 -4.090 666 H ARG 125 H ARG 125 8.054 16.843 -0.256 667 HA ARG 125 HA ARG 125 8.156 17.340 2.620 668 HB2 ARG 125 1HB ARG 125 5.938 18.076 1.386 669 HB3 ARG 125 2HB ARG 125 5.594 16.352 1.428 670 HG2 ARG 125 1HG ARG 125 4.599 17.011 3.367 671 HG3 ARG 125 2HG ARG 125 6.211 16.620 3.969 672 HD2 ARG 125 1HD ARG 125 6.070 18.673 4.894 673 HD3 ARG 125 2HD ARG 125 6.578 19.200 3.292 674 HE ARG 125 HE ARG 125 4.506 20.119 2.971 675 HH11 ARG 125 1HH1 ARG 125 4.349 17.955 5.724 676 HH12 ARG 125 2HH1 ARG 125 2.750 18.442 6.170 677 HH21 ARG 125 1HH2 ARG 125 2.395 20.752 3.566 678 HH22 ARG 125 2HH2 ARG 125 1.639 20.028 4.945 679 H LYS 126 H LYS 126 9.420 15.680 3.111 680 HA LYS 126 HA LYS 126 8.418 12.987 2.556 681 HB2 LYS 126 1HB LYS 126 10.591 12.160 1.963 682 HB3 LYS 126 2HB LYS 126 10.238 13.545 0.942 683 HG2 LYS 126 1HG LYS 126 11.880 13.788 3.444 684 HG3 LYS 126 2HG LYS 126 12.587 13.355 1.888 685 HD2 LYS 126 1HD LYS 126 10.872 15.642 1.590 686 HD3 LYS 126 2HD LYS 126 12.043 15.930 2.877 687 HE2 LYS 126 1HE LYS 126 13.567 14.769 0.903 688 HE3 LYS 126 2HE LYS 126 12.425 15.754 -0.009 689 HZ1 LYS 126 3HZ LYS 126 13.132 17.693 1.091 690 HZ2 LYS 126 1HZ LYS 126 14.552 16.872 0.675 691 HZ3 LYS 126 2HZ LYS 126 13.986 16.829 2.269 692 H SER 127 H SER 127 8.680 11.512 4.185 693 HA SER 127 HA SER 127 10.010 12.467 6.639 694 HB2 SER 127 1HB SER 127 7.337 12.138 6.438 695 HB3 SER 127 2HB SER 127 7.798 10.497 6.892 696 HG SER 127 HG SER 127 7.651 11.413 8.820 697 H LYS 128 H LYS 128 11.190 10.948 7.835 698 HA LYS 128 HA LYS 128 12.493 8.927 6.416 699 HB2 LYS 128 1HB LYS 128 12.307 9.694 9.286 700 HB3 LYS 128 2HB LYS 128 12.910 8.080 8.930 701 HG2 LYS 128 1HG LYS 128 14.140 10.162 7.296 702 HG3 LYS 128 2HG LYS 128 14.410 10.367 9.029 703 HD2 LYS 128 1HD LYS 128 15.387 8.201 9.214 704 HD3 LYS 128 2HD LYS 128 14.887 7.770 7.578 705 HE2 LYS 128 1HE LYS 128 17.019 8.332 7.082 706 HE3 LYS 128 2HE LYS 128 16.344 9.959 7.037 707 HZ1 LYS 128 3HZ LYS 128 16.964 10.049 9.491 708 HZ2 LYS 128 1HZ LYS 128 18.231 10.129 8.372 709 HZ3 LYS 128 2HZ LYS 128 17.918 8.684 9.192 710 H GLU 129 H GLU 129 9.695 8.759 8.582 711 HA GLU 129 HA GLU 129 9.467 5.916 8.489 712 HB2 GLU 129 1HB GLU 129 7.285 6.248 9.542 713 HB3 GLU 129 2HB GLU 129 8.520 7.209 10.341 714 HG2 GLU 129 1HG GLU 129 7.527 8.940 8.451 715 HG3 GLU 129 2HG GLU 129 6.097 8.043 8.958 716 H LEU 130 H LEU 130 8.196 8.568 6.560 717 HA LEU 130 HA LEU 130 6.295 6.946 5.141 718 HB2 LEU 130 1HB LEU 130 7.231 9.758 5.016 719 HB3 LEU 130 2HB LEU 130 6.594 9.088 3.531 720 HG LEU 130 HG LEU 130 4.911 10.344 4.826 721 HD11 LEU 130 1HD1 LEU 130 4.489 7.407 4.361 722 HD12 LEU 130 2HD1 LEU 130 4.015 8.767 3.342 723 HD13 LEU 130 3HD1 LEU 130 3.185 8.479 4.871 724 HD21 LEU 130 3HD2 LEU 130 5.680 8.378 6.923 725 HD22 LEU 130 1HD2 LEU 130 4.004 8.918 6.844 726 HD23 LEU 130 2HD2 LEU 130 5.300 10.093 7.065 727 H ILE 131 H ILE 131 9.464 8.364 4.335 728 HA ILE 131 HA ILE 131 9.629 7.331 1.736 729 HB ILE 131 HB ILE 131 11.912 7.908 3.630 730 HG12 ILE 131 1HG1 ILE 131 10.903 9.691 1.421 731 HG13 ILE 131 2HG1 ILE 131 10.226 9.777 3.044 732 HG21 ILE 131 1HG2 ILE 131 13.329 7.335 2.006 733 HG22 ILE 131 2HG2 ILE 131 12.438 8.274 0.809 734 HG23 ILE 131 3HG2 ILE 131 11.955 6.615 1.167 735 HD11 ILE 131 3HD1 ILE 131 11.839 11.193 3.564 736 HD12 ILE 131 1HD1 ILE 131 12.632 10.933 2.011 737 HD13 ILE 131 2HD1 ILE 131 13.000 9.878 3.377 738 H GLU 132 H GLU 132 10.831 5.991 4.822 739 HA GLU 132 HA GLU 132 12.046 3.707 3.786 740 HB2 GLU 132 1HB GLU 132 11.980 2.790 5.986 741 HB3 GLU 132 2HB GLU 132 12.198 4.524 6.162 742 HG2 GLU 132 1HG GLU 132 9.921 4.826 6.792 743 HG3 GLU 132 2HG GLU 132 9.525 3.160 6.382 744 H ALA 133 H ALA 133 8.662 4.390 4.412 745 HA ALA 133 HA ALA 133 7.718 1.727 4.204 746 HB1 ALA 133 3HB ALA 133 6.141 3.055 5.170 747 HB2 ALA 133 1HB ALA 133 5.550 3.068 3.509 748 HB3 ALA 133 2HB ALA 133 6.493 4.428 4.120 749 H TYR 134 H TYR 134 7.710 4.398 1.861 750 HA TYR 134 HA TYR 134 6.790 2.778 -0.285 751 HB2 TYR 134 1HB TYR 134 7.764 5.544 0.030 752 HB3 TYR 134 2HB TYR 134 8.025 4.841 -1.561 753 HD1 TYR 134 HD1 TYR 134 5.325 5.287 0.989 754 HD2 TYR 134 HD2 TYR 134 6.326 4.948 -3.131 755 HE1 TYR 134 HE1 TYR 134 2.993 5.785 0.384 756 HE2 TYR 134 HE2 TYR 134 3.999 5.446 -3.743 757 HH TYR 134 HH TYR 134 2.037 6.652 -2.690 758 H GLU 135 H GLU 135 9.990 3.562 0.930 759 HA GLU 135 HA GLU 135 11.400 2.529 -1.331 760 HB2 GLU 135 1HB GLU 135 12.165 4.101 0.694 761 HB3 GLU 135 2HB GLU 135 12.685 2.555 1.352 762 HG2 GLU 135 1HG GLU 135 14.014 2.160 -0.675 763 HG3 GLU 135 2HG GLU 135 13.522 3.737 -1.287 764 H ALA 136 H ALA 136 10.018 1.158 1.560 765 HA ALA 136 HA ALA 136 11.472 -1.331 1.356 766 HB1 ALA 136 3HB ALA 136 10.756 -0.503 3.534 767 HB2 ALA 136 1HB ALA 136 10.042 -2.078 3.187 768 HB3 ALA 136 2HB ALA 136 9.070 -0.615 3.031 769 H SER 137 H SER 137 8.553 0.015 0.073 770 HA SER 137 HA SER 137 7.306 -2.499 -0.552 771 HB2 SER 137 1HB SER 137 6.692 0.310 -1.498 772 HB3 SER 137 2HB SER 137 5.701 -1.108 -1.845 773 HG SER 137 HG SER 137 4.789 -0.726 0.000 774 H LYS 138 H LYS 138 9.304 -0.142 -2.248 775 HA LYS 138 HA LYS 138 9.002 -1.062 -4.861 776 HB2 LYS 138 1HB LYS 138 10.421 0.934 -3.731 777 HB3 LYS 138 2HB LYS 138 11.722 -0.198 -4.070 778 HG2 LYS 138 1HG LYS 138 11.782 0.618 -6.127 779 HG3 LYS 138 2HG LYS 138 10.217 -0.144 -6.409 780 HD2 LYS 138 1HD LYS 138 9.110 1.820 -6.341 781 HD3 LYS 138 2HD LYS 138 10.083 2.432 -5.003 782 HE2 LYS 138 1HE LYS 138 10.894 2.342 -7.908 783 HE3 LYS 138 2HE LYS 138 10.409 3.776 -7.006 784 HZ1 LYS 138 3HZ LYS 138 12.622 3.983 -6.741 785 HZ2 LYS 138 1HZ LYS 138 12.933 2.337 -6.982 786 HZ3 LYS 138 2HZ LYS 138 12.395 2.885 -5.474 787 H THR 139 H THR 139 10.953 -2.343 -2.233 788 HA THR 139 HA THR 139 12.758 -4.001 -3.494 789 HB THR 139 HB THR 139 11.257 -5.072 -1.146 790 HG1 THR 139 HG1 THR 139 12.935 -2.785 -1.060 791 HG21 THR 139 3HG2 THR 139 14.145 -4.714 -0.974 792 HG22 THR 139 1HG2 THR 139 13.626 -5.772 -2.287 793 HG23 THR 139 2HG2 THR 139 13.145 -6.124 -0.628 794 HA PRO 140 HA PRO 140 9.886 -6.941 -5.382 795 HB2 PRO 140 1HB PRO 140 10.991 -6.898 -7.802 796 HB3 PRO 140 2HB PRO 140 10.111 -5.487 -7.205 797 HG2 PRO 140 1HG PRO 140 13.014 -5.856 -7.591 798 HG3 PRO 140 2HG PRO 140 12.075 -4.357 -7.513 799 HD2 PRO 140 1HD PRO 140 13.561 -5.697 -5.391 800 HD3 PRO 140 2HD PRO 140 12.803 -4.090 -5.375 801 HA PRO 141 HA PRO 141 13.688 -9.800 -5.058 802 HB2 PRO 141 1HB PRO 141 13.754 -10.570 -2.513 803 HB3 PRO 141 2HB PRO 141 14.427 -9.009 -3.010 804 HG2 PRO 141 1HG PRO 141 11.785 -9.607 -1.735 805 HG3 PRO 141 2HG PRO 141 12.949 -8.325 -1.354 806 HD2 PRO 141 1HD PRO 141 10.730 -7.965 -2.932 807 HD3 PRO 141 2HD PRO 141 12.201 -6.979 -3.031 808 H ASP 142 H ASP 142 10.672 -10.326 -3.190 809 HA ASP 142 HA ASP 142 10.577 -13.047 -4.320 810 HB2 ASP 142 1HB ASP 142 9.342 -12.163 -1.708 811 HB3 ASP 142 2HB ASP 142 9.453 -13.807 -2.330 812 H LEU 143 H LEU 143 8.298 -10.717 -2.836 813 HA LEU 143 HA LEU 143 5.985 -11.677 -3.992 814 HB2 LEU 143 1HB LEU 143 6.190 -9.921 -2.207 815 HB3 LEU 143 2HB LEU 143 6.535 -8.759 -3.474 816 HG LEU 143 HG LEU 143 4.322 -9.113 -4.442 817 HD11 LEU 143 1HD1 LEU 143 2.659 -10.475 -3.190 818 HD12 LEU 143 2HD1 LEU 143 3.982 -11.109 -2.211 819 HD13 LEU 143 3HD1 LEU 143 3.940 -11.423 -3.946 820 HD21 LEU 143 3HD2 LEU 143 3.027 -8.497 -2.193 821 HD22 LEU 143 1HD2 LEU 143 4.102 -7.368 -3.014 822 HD23 LEU 143 2HD2 LEU 143 4.682 -8.284 -1.624 823 H LYS 144 H LYS 144 8.097 -9.101 -5.289 824 HA LYS 144 HA LYS 144 6.623 -9.240 -7.819 825 HB2 LYS 144 1HB LYS 144 8.803 -7.279 -7.099 826 HB3 LYS 144 2HB LYS 144 7.633 -7.152 -8.403 827 HG2 LYS 144 1HG LYS 144 6.203 -6.093 -7.088 828 HG3 LYS 144 2HG LYS 144 6.263 -7.393 -5.896 829 HD2 LYS 144 1HD LYS 144 7.670 -6.259 -4.558 830 HD3 LYS 144 2HD LYS 144 8.633 -5.666 -5.912 831 HE2 LYS 144 1HE LYS 144 5.994 -4.470 -5.855 832 HE3 LYS 144 2HE LYS 144 6.871 -4.198 -4.350 833 HZ1 LYS 144 3HZ LYS 144 7.257 -2.457 -6.024 834 HZ2 LYS 144 1HZ LYS 144 7.953 -3.610 -7.052 835 HZ3 LYS 144 2HZ LYS 144 8.683 -3.246 -5.572 836 H GLU 145 H GLU 145 8.248 -11.454 -7.148 837 HA GLU 145 HA GLU 145 9.789 -11.703 -9.519 838 HB2 GLU 145 1HB GLU 145 11.156 -10.601 -7.290 839 HB3 GLU 145 2HB GLU 145 11.737 -12.248 -7.483 840 HG2 GLU 145 1HG GLU 145 11.683 -10.169 -9.658 841 HG3 GLU 145 2HG GLU 145 13.094 -10.595 -8.692 842 H GLU 146 H GLU 146 7.669 -13.145 -8.350 843 HA GLU 146 HA GLU 146 8.945 -15.763 -8.068 844 HB2 GLU 146 1HB GLU 146 8.430 -14.934 -5.788 845 HB3 GLU 146 2HB GLU 146 6.738 -14.800 -6.239 846 HG2 GLU 146 1HG GLU 146 6.388 -17.040 -6.148 847 HG3 GLU 146 2HG GLU 146 8.035 -17.431 -6.635 848 H SER 147 H SER 147 5.603 -14.471 -7.920 849 HA SER 147 HA SER 147 4.975 -16.043 -10.319 850 HB2 SER 147 1HB SER 147 2.717 -16.547 -9.131 851 HB3 SER 147 2HB SER 147 4.131 -17.510 -8.708 852 HG SER 147 HG SER 147 3.309 -16.896 -6.787 853 H SER 148 H SER 148 5.266 -13.761 -11.110 854 HA SER 148 HA SER 148 2.711 -12.616 -11.617 855 HB2 SER 148 1HB SER 148 3.760 -11.723 -9.250 856 HB3 SER 148 2HB SER 148 4.379 -10.519 -10.380 857 HG SER 148 HG SER 148 1.682 -11.225 -9.883 858 H THR 149 H THR 149 3.421 -12.983 -13.755 859 HA THR 149 HA THR 149 5.749 -11.480 -14.673 860 HB THR 149 HB THR 149 5.509 -13.826 -15.382 861 HG1 THR 149 HG1 THR 149 5.211 -12.044 -17.568 862 HG21 THR 149 3HG2 THR 149 3.693 -14.715 -16.283 863 HG22 THR 149 1HG2 THR 149 3.526 -13.391 -17.434 864 HG23 THR 149 2HG2 THR 149 2.843 -13.244 -15.815 865 H ASP 150 H ASP 150 5.637 -9.616 -15.699 866 HA ASP 150 HA ASP 150 3.027 -8.713 -16.726 867 HB2 ASP 150 1HB ASP 150 4.611 -7.556 -14.725 868 HB3 ASP 150 2HB ASP 150 4.857 -6.547 -16.146 869 H LEU 151 H LEU 151 6.554 -8.467 -17.165 870 HA LEU 151 HA LEU 151 6.177 -7.384 -19.848 871 HB2 LEU 151 1HB LEU 151 7.875 -6.452 -18.252 872 HB3 LEU 151 2HB LEU 151 8.760 -7.957 -18.395 873 HG LEU 151 HG LEU 151 8.147 -6.557 -20.936 874 HD11 LEU 151 1HD1 LEU 151 9.833 -4.902 -20.697 875 HD12 LEU 151 2HD1 LEU 151 10.329 -5.540 -19.130 876 HD13 LEU 151 3HD1 LEU 151 8.764 -4.746 -19.303 877 HD21 LEU 151 3HD2 LEU 151 10.787 -7.173 -20.927 878 HD22 LEU 151 1HD2 LEU 151 9.512 -8.275 -21.447 879 HD23 LEU 151 2HD2 LEU 151 10.159 -8.385 -19.810 880 H GLU 152 H GLU 152 7.097 -8.350 -21.718 881 HA GLU 152 HA GLU 152 7.684 -10.035 -23.132 882 HB2 GLU 152 1HB GLU 152 9.284 -10.487 -20.985 883 HB3 GLU 152 2HB GLU 152 8.378 -11.993 -21.023 884 HG2 GLU 152 1HG GLU 152 9.013 -12.156 -23.466 885 HG3 GLU 152 2HG GLU 152 10.137 -10.831 -23.165 Start of MODEL 14 1 H1 SER 45 1H SER 45 -7.645 -0.765 -23.074 2 H2 SER 45 2H SER 45 -9.112 -1.507 -23.561 3 H3 SER 45 3H SER 45 -8.100 -2.278 -22.407 4 HA SER 45 HA SER 45 -9.721 0.154 -22.107 5 HB2 SER 45 1HB SER 45 -10.586 -1.179 -20.157 6 HB3 SER 45 2HB SER 45 -10.899 -1.923 -21.723 7 HG SER 45 HG SER 45 -9.643 -2.977 -19.659 8 H ALA 46 H ALA 46 -9.694 0.615 -19.554 9 HA ALA 46 HA ALA 46 -6.862 0.940 -18.801 10 HB1 ALA 46 3HB ALA 46 -8.644 2.947 -19.361 11 HB2 ALA 46 1HB ALA 46 -7.175 3.118 -18.399 12 HB3 ALA 46 2HB ALA 46 -8.724 2.842 -17.602 13 H ASP 47 H ASP 47 -7.030 1.780 -16.262 14 HA ASP 47 HA ASP 47 -7.192 1.077 -14.115 15 HB2 ASP 47 1HB ASP 47 -9.897 0.499 -15.222 16 HB3 ASP 47 2HB ASP 47 -9.495 -0.188 -13.650 17 H ASP 48 H ASP 48 -5.883 -0.663 -16.015 18 HA ASP 48 HA ASP 48 -6.586 -3.363 -15.223 19 HB2 ASP 48 1HB ASP 48 -5.587 -2.393 -17.532 20 HB3 ASP 48 2HB ASP 48 -4.083 -2.850 -16.741 21 H ARG 49 H ARG 49 -6.173 -2.589 -12.921 22 HA ARG 49 HA ARG 49 -3.501 -3.456 -12.135 23 HB2 ARG 49 1HB ARG 49 -4.601 -0.723 -11.761 24 HB3 ARG 49 2HB ARG 49 -3.795 -1.427 -10.367 25 HG2 ARG 49 1HG ARG 49 -1.813 -0.950 -11.222 26 HG3 ARG 49 2HG ARG 49 -2.187 -1.851 -12.692 27 HD2 ARG 49 1HD ARG 49 -3.630 0.557 -12.859 28 HD3 ARG 49 2HD ARG 49 -2.025 0.991 -12.279 29 HE ARG 49 HE ARG 49 -1.985 -0.796 -14.530 30 HH11 ARG 49 1HH1 ARG 49 -2.175 2.578 -13.576 31 HH12 ARG 49 2HH1 ARG 49 -1.531 3.161 -15.074 32 HH21 ARG 49 1HH2 ARG 49 -1.143 -0.008 -16.500 33 HH22 ARG 49 2HH2 ARG 49 -0.948 1.697 -16.729 34 H LEU 50 H LEU 50 -3.531 -3.277 -9.495 35 HA LEU 50 HA LEU 50 -4.339 -4.125 -7.551 36 HB2 LEU 50 1HB LEU 50 -6.767 -3.105 -8.888 37 HB3 LEU 50 2HB LEU 50 -7.046 -4.288 -7.627 38 HG LEU 50 HG LEU 50 -5.239 -2.019 -6.977 39 HD11 LEU 50 1HD1 LEU 50 -7.265 -0.661 -6.352 40 HD12 LEU 50 2HD1 LEU 50 -8.210 -1.751 -7.367 41 HD13 LEU 50 3HD1 LEU 50 -6.926 -0.773 -8.079 42 HD21 LEU 50 3HD2 LEU 50 -6.042 -4.021 -5.500 43 HD22 LEU 50 1HD2 LEU 50 -7.496 -3.041 -5.313 44 HD23 LEU 50 2HD2 LEU 50 -5.930 -2.399 -4.816 45 H ASN 51 H ASN 51 -3.418 -6.163 -7.958 46 HA ASN 51 HA ASN 51 -5.356 -8.304 -8.205 47 HB2 ASN 51 1HB ASN 51 -3.274 -7.750 -10.280 48 HB3 ASN 51 2HB ASN 51 -3.643 -9.424 -9.891 49 HD21 ASN 51 2HD2 ASN 51 -4.516 -6.759 -11.718 50 HD22 ASN 51 1HD2 ASN 51 -6.064 -7.323 -12.269 51 H PHE 52 H PHE 52 -3.892 -10.513 -8.232 52 HA PHE 52 HA PHE 52 -2.704 -10.615 -5.672 53 HB2 PHE 52 1HB PHE 52 -2.489 -12.596 -7.954 54 HB3 PHE 52 2HB PHE 52 -2.044 -12.919 -6.278 55 HD1 PHE 52 HD2 PHE 52 -4.272 -11.700 -4.810 56 HD2 PHE 52 HD1 PHE 52 -4.274 -13.992 -8.397 57 HE1 PHE 52 HE2 PHE 52 -6.575 -12.425 -4.344 58 HE2 PHE 52 HE1 PHE 52 -6.577 -14.721 -7.933 59 HZ PHE 52 HZ PHE 52 -7.730 -13.939 -5.904 60 H GLY 53 H GLY 53 -0.776 -9.888 -5.069 61 HA2 GLY 53 1HA GLY 53 1.527 -9.622 -5.073 62 HA3 GLY 53 2HA GLY 53 1.585 -10.428 -6.632 63 H ASP 54 H ASP 54 -0.244 -7.530 -5.709 64 HA ASP 54 HA ASP 54 1.405 -5.963 -7.574 65 HB2 ASP 54 1HB ASP 54 -1.544 -6.321 -7.467 66 HB3 ASP 54 2HB ASP 54 -0.951 -4.703 -7.818 67 H ARG 55 H ARG 55 2.115 -4.057 -6.825 68 HA ARG 55 HA ARG 55 1.793 -3.383 -4.088 69 HB2 ARG 55 1HB ARG 55 3.143 -1.395 -4.610 70 HB3 ARG 55 2HB ARG 55 3.855 -2.856 -5.276 71 HG2 ARG 55 1HG ARG 55 2.515 -2.125 -7.424 72 HG3 ARG 55 2HG ARG 55 2.624 -0.538 -6.664 73 HD2 ARG 55 1HD ARG 55 4.653 -0.360 -7.560 74 HD3 ARG 55 2HD ARG 55 5.180 -1.593 -6.416 75 HE ARG 55 HE ARG 55 5.382 -3.040 -8.160 76 HH11 ARG 55 1HH1 ARG 55 3.222 -0.463 -9.145 77 HH12 ARG 55 2HH1 ARG 55 3.117 -1.008 -10.783 78 HH21 ARG 55 1HH2 ARG 55 5.236 -3.757 -10.323 79 HH22 ARG 55 2HH2 ARG 55 4.263 -2.879 -11.453 80 H ILE 56 H ILE 56 0.062 -2.496 -3.206 81 HA ILE 56 HA ILE 56 -1.408 -0.446 -4.739 82 HB ILE 56 HB ILE 56 -3.495 -1.209 -3.625 83 HG12 ILE 56 1HG1 ILE 56 -1.884 -3.660 -2.877 84 HG13 ILE 56 2HG1 ILE 56 -2.347 -2.401 -1.738 85 HG21 ILE 56 1HG2 ILE 56 -3.936 -2.964 -5.153 86 HG22 ILE 56 2HG2 ILE 56 -2.236 -3.427 -5.221 87 HG23 ILE 56 3HG2 ILE 56 -2.765 -1.904 -5.936 88 HD11 ILE 56 3HD1 ILE 56 -4.366 -3.275 -1.475 89 HD12 ILE 56 1HD1 ILE 56 -3.773 -4.680 -2.359 90 HD13 ILE 56 2HD1 ILE 56 -4.622 -3.396 -3.216 91 H LEU 57 H LEU 57 -2.615 1.111 -3.417 92 HA LEU 57 HA LEU 57 -1.169 1.667 -0.918 93 HB2 LEU 57 1HB LEU 57 -1.690 3.308 -3.060 94 HB3 LEU 57 2HB LEU 57 -2.952 3.760 -1.929 95 HG LEU 57 HG LEU 57 -1.215 4.173 -0.204 96 HD11 LEU 57 1HD1 LEU 57 1.094 4.167 -0.728 97 HD12 LEU 57 2HD1 LEU 57 0.775 3.884 -2.439 98 HD13 LEU 57 3HD1 LEU 57 0.452 2.613 -1.260 99 HD21 LEU 57 3HD2 LEU 57 -0.145 6.153 -1.544 100 HD22 LEU 57 1HD2 LEU 57 -1.869 6.147 -1.179 101 HD23 LEU 57 2HD2 LEU 57 -1.306 5.672 -2.780 102 H VAL 58 H VAL 58 -2.210 1.897 1.014 103 HA VAL 58 HA VAL 58 -5.142 1.646 1.020 104 HB VAL 58 HB VAL 58 -4.273 -0.583 1.426 105 HG11 VAL 58 1HG1 VAL 58 -3.005 0.078 4.000 106 HG12 VAL 58 2HG1 VAL 58 -2.120 0.578 2.560 107 HG13 VAL 58 3HG1 VAL 58 -2.555 -1.115 2.784 108 HG21 VAL 58 3HG2 VAL 58 -6.292 0.007 2.603 109 HG22 VAL 58 1HG2 VAL 58 -5.359 0.727 3.915 110 HG23 VAL 58 2HG2 VAL 58 -5.293 -1.010 3.640 111 H LYS 59 H LYS 59 -6.211 2.701 2.643 112 HA LYS 59 HA LYS 59 -4.592 4.522 4.284 113 HB2 LYS 59 1HB LYS 59 -6.196 5.607 2.795 114 HB3 LYS 59 2HB LYS 59 -7.504 4.650 3.474 115 HG2 LYS 59 1HG LYS 59 -7.778 6.644 4.567 116 HG3 LYS 59 2HG LYS 59 -6.781 5.756 5.719 117 HD2 LYS 59 1HD LYS 59 -4.991 7.101 5.405 118 HD3 LYS 59 2HD LYS 59 -5.315 7.306 3.683 119 HE2 LYS 59 1HE LYS 59 -7.175 8.837 4.264 120 HE3 LYS 59 2HE LYS 59 -6.722 8.692 5.962 121 HZ1 LYS 59 3HZ LYS 59 -4.396 9.377 4.709 122 HZ2 LYS 59 1HZ LYS 59 -5.400 10.423 5.579 123 HZ3 LYS 59 2HZ LYS 59 -5.557 10.300 3.901 124 H ALA 60 H ALA 60 -4.439 4.158 6.408 125 HA ALA 60 HA ALA 60 -6.069 2.090 7.633 126 HB1 ALA 60 3HB ALA 60 -4.532 2.944 9.661 127 HB2 ALA 60 1HB ALA 60 -3.549 3.482 8.300 128 HB3 ALA 60 2HB ALA 60 -3.980 1.781 8.455 129 HA PRO 61 HA PRO 61 -8.997 4.757 9.589 130 HB2 PRO 61 1HB PRO 61 -9.369 3.479 11.981 131 HB3 PRO 61 2HB PRO 61 -10.072 2.928 10.458 132 HG2 PRO 61 1HG PRO 61 -7.622 1.962 11.871 133 HG3 PRO 61 2HG PRO 61 -8.879 1.026 11.046 134 HD2 PRO 61 1HD PRO 61 -6.490 1.537 9.907 135 HD3 PRO 61 2HD PRO 61 -7.984 1.426 8.955 136 H GLY 62 H GLY 62 -7.744 6.622 9.870 137 HA2 GLY 62 1HA GLY 62 -7.345 8.261 11.612 138 HA3 GLY 62 2HA GLY 62 -6.692 6.968 12.604 139 H TYR 63 H TYR 63 -5.206 5.888 10.210 140 HA TYR 63 HA TYR 63 -2.961 7.779 10.354 141 HB2 TYR 63 1HB TYR 63 -3.146 4.803 10.059 142 HB3 TYR 63 2HB TYR 63 -1.722 5.642 9.452 143 HD1 TYR 63 HD2 TYR 63 -3.646 4.777 12.468 144 HD2 TYR 63 HD1 TYR 63 -0.103 6.590 10.965 145 HE1 TYR 63 HE2 TYR 63 -2.685 4.764 14.732 146 HE2 TYR 63 HE1 TYR 63 0.867 6.580 13.223 147 HH TYR 63 HH TYR 63 -0.234 4.759 15.694 148 HA PRO 64 HA PRO 64 -3.038 8.690 6.040 149 HB2 PRO 64 1HB PRO 64 -0.404 8.626 5.345 150 HB3 PRO 64 2HB PRO 64 -1.123 9.923 6.304 151 HG2 PRO 64 1HG PRO 64 0.451 7.546 7.212 152 HG3 PRO 64 2HG PRO 64 0.556 9.231 7.753 153 HD2 PRO 64 1HD PRO 64 -0.754 7.340 9.164 154 HD3 PRO 64 2HD PRO 64 -1.281 9.034 9.134 155 H TRP 65 H TRP 65 -1.766 7.926 3.862 156 HA TRP 65 HA TRP 65 -2.571 5.178 3.513 157 HB2 TRP 65 1HB TRP 65 -1.269 7.054 1.526 158 HB3 TRP 65 2HB TRP 65 -2.038 5.518 1.149 159 HD1 TRP 65 HD1 TRP 65 -2.952 9.061 2.385 160 HE1 TRP 65 HE1 TRP 65 -5.397 9.532 1.734 161 HE3 TRP 65 HE3 TRP 65 -4.193 4.473 0.494 162 HZ2 TRP 65 HZ2 TRP 65 -7.564 8.145 0.574 163 HZ3 TRP 65 HZ3 TRP 65 -6.473 4.130 -0.368 164 HH2 TRP 65 HH2 TRP 65 -8.123 5.930 -0.328 165 H TRP 66 H TRP 66 -1.256 3.432 2.923 166 HA TRP 66 HA TRP 66 1.649 3.837 3.115 167 HB2 TRP 66 1HB TRP 66 0.288 2.829 5.219 168 HB3 TRP 66 2HB TRP 66 0.582 1.345 4.318 169 HD1 TRP 66 HD1 TRP 66 2.843 0.218 4.754 170 HE1 TRP 66 HE1 TRP 66 5.073 0.924 5.823 171 HE3 TRP 66 HE3 TRP 66 1.836 5.169 5.527 172 HZ2 TRP 66 HZ2 TRP 66 6.249 3.273 6.858 173 HZ3 TRP 66 HZ3 TRP 66 3.570 6.577 6.556 174 HH2 TRP 66 HH2 TRP 66 5.734 5.645 7.200 175 HA PRO 67 HA PRO 67 1.664 1.226 -0.475 176 HB2 PRO 67 1HB PRO 67 4.281 0.606 -0.591 177 HB3 PRO 67 2HB PRO 67 3.690 2.239 -0.929 178 HG2 PRO 67 1HG PRO 67 4.924 1.147 1.571 179 HG3 PRO 67 2HG PRO 67 5.216 2.698 0.766 180 HD2 PRO 67 1HD PRO 67 3.589 2.412 2.939 181 HD3 PRO 67 2HD PRO 67 3.373 3.679 1.718 182 H ALA 68 H ALA 68 0.453 -0.564 0.148 183 HA ALA 68 HA ALA 68 1.942 -2.801 1.372 184 HB1 ALA 68 3HB ALA 68 -0.194 -1.756 2.474 185 HB2 ALA 68 1HB ALA 68 0.040 -3.504 2.457 186 HB3 ALA 68 2HB ALA 68 -1.043 -2.746 1.288 187 H LEU 69 H LEU 69 1.961 -4.785 0.315 188 HA LEU 69 HA LEU 69 1.012 -4.729 -2.451 189 HB2 LEU 69 1HB LEU 69 3.168 -6.093 -1.000 190 HB3 LEU 69 2HB LEU 69 2.342 -7.107 -2.165 191 HG LEU 69 HG LEU 69 3.094 -4.457 -3.185 192 HD11 LEU 69 1HD1 LEU 69 5.092 -4.598 -2.046 193 HD12 LEU 69 2HD1 LEU 69 5.481 -5.419 -3.556 194 HD13 LEU 69 3HD1 LEU 69 5.127 -6.359 -2.107 195 HD21 LEU 69 3HD2 LEU 69 4.062 -6.846 -4.539 196 HD22 LEU 69 1HD2 LEU 69 3.048 -5.537 -5.137 197 HD23 LEU 69 2HD2 LEU 69 2.325 -6.872 -4.240 198 H LEU 70 H LEU 70 -0.692 -5.830 -3.145 199 HA LEU 70 HA LEU 70 -2.411 -7.201 -1.354 200 HB2 LEU 70 1HB LEU 70 -2.787 -6.002 -3.721 201 HB3 LEU 70 2HB LEU 70 -2.684 -7.662 -4.274 202 HG LEU 70 HG LEU 70 -4.538 -7.016 -2.022 203 HD11 LEU 70 1HD1 LEU 70 -5.568 -5.472 -3.271 204 HD12 LEU 70 2HD1 LEU 70 -6.160 -6.845 -4.202 205 HD13 LEU 70 3HD1 LEU 70 -4.734 -5.963 -4.745 206 HD21 LEU 70 3HD2 LEU 70 -4.119 -9.156 -4.002 207 HD22 LEU 70 1HD2 LEU 70 -5.800 -8.743 -3.671 208 HD23 LEU 70 2HD2 LEU 70 -4.739 -9.236 -2.352 209 H LEU 71 H LEU 71 -2.608 -9.308 -0.846 210 HA LEU 71 HA LEU 71 -0.770 -11.191 -2.157 211 HB2 LEU 71 1HB LEU 71 -0.167 -11.264 0.051 212 HB3 LEU 71 2HB LEU 71 -1.780 -10.894 0.623 213 HG LEU 71 HG LEU 71 -2.472 -13.215 0.097 214 HD11 LEU 71 1HD1 LEU 71 -1.039 -13.910 -1.616 215 HD12 LEU 71 2HD1 LEU 71 -0.533 -14.847 -0.213 216 HD13 LEU 71 3HD1 LEU 71 0.406 -13.443 -0.720 217 HD21 LEU 71 3HD2 LEU 71 -0.044 -13.170 1.877 218 HD22 LEU 71 1HD2 LEU 71 -1.465 -14.208 2.006 219 HD23 LEU 71 2HD2 LEU 71 -1.600 -12.481 2.341 220 H ARG 72 H ARG 72 -4.022 -11.204 -0.629 221 HA ARG 72 HA ARG 72 -5.024 -12.794 -2.851 222 HB2 ARG 72 1HB ARG 72 -4.693 -13.812 -0.075 223 HB3 ARG 72 2HB ARG 72 -6.148 -14.275 -0.948 224 HG2 ARG 72 1HG ARG 72 -3.757 -14.597 -2.560 225 HG3 ARG 72 2HG ARG 72 -3.689 -15.525 -1.060 226 HD2 ARG 72 1HD ARG 72 -6.092 -16.263 -1.697 227 HD3 ARG 72 2HD ARG 72 -5.655 -15.711 -3.313 228 HE ARG 72 HE ARG 72 -3.602 -17.337 -2.648 229 HH11 ARG 72 1HH1 ARG 72 -7.080 -17.771 -2.639 230 HH12 ARG 72 2HH1 ARG 72 -6.990 -19.475 -2.929 231 HH21 ARG 72 1HH2 ARG 72 -3.494 -19.582 -3.033 232 HH22 ARG 72 2HH2 ARG 72 -4.956 -20.503 -3.151 233 H ARG 73 H ARG 73 -7.389 -13.134 -2.740 234 HA ARG 73 HA ARG 73 -8.723 -10.867 -1.409 235 HB2 ARG 73 1HB ARG 73 -8.580 -10.940 -3.987 236 HB3 ARG 73 2HB ARG 73 -9.755 -12.241 -3.883 237 HG2 ARG 73 1HG ARG 73 -10.419 -9.779 -2.399 238 HG3 ARG 73 2HG ARG 73 -10.413 -9.659 -4.160 239 HD2 ARG 73 1HD ARG 73 -11.774 -11.960 -3.859 240 HD3 ARG 73 2HD ARG 73 -12.224 -11.147 -2.361 241 HE ARG 73 HE ARG 73 -13.485 -9.668 -3.575 242 HH11 ARG 73 1HH1 ARG 73 -11.377 -11.407 -5.768 243 HH12 ARG 73 2HH1 ARG 73 -12.157 -10.808 -7.189 244 HH21 ARG 73 1HH2 ARG 73 -14.508 -8.878 -5.455 245 HH22 ARG 73 2HH2 ARG 73 -13.936 -9.372 -7.013 246 H LYS 74 H LYS 74 -9.838 -11.571 0.294 247 HA LYS 74 HA LYS 74 -11.193 -14.177 0.116 248 HB2 LYS 74 1HB LYS 74 -11.204 -13.934 2.693 249 HB3 LYS 74 2HB LYS 74 -9.710 -14.387 1.886 250 HG2 LYS 74 1HG LYS 74 -8.669 -12.448 2.406 251 HG3 LYS 74 2HG LYS 74 -10.155 -11.500 2.317 252 HD2 LYS 74 1HD LYS 74 -10.853 -12.226 4.468 253 HD3 LYS 74 2HD LYS 74 -9.593 -13.459 4.531 254 HE2 LYS 74 1HE LYS 74 -8.283 -11.012 4.092 255 HE3 LYS 74 2HE LYS 74 -9.489 -10.707 5.341 256 HZ1 LYS 74 3HZ LYS 74 -7.104 -11.624 5.910 257 HZ2 LYS 74 1HZ LYS 74 -7.846 -13.112 5.608 258 HZ3 LYS 74 2HZ LYS 74 -8.462 -12.086 6.800 259 H GLU 75 H GLU 75 -13.341 -14.231 0.158 260 HA GLU 75 HA GLU 75 -14.795 -11.766 0.823 261 HB2 GLU 75 1HB GLU 75 -14.934 -13.070 -1.475 262 HB3 GLU 75 2HB GLU 75 -16.080 -14.063 -0.586 263 HG2 GLU 75 1HG GLU 75 -16.842 -11.452 -0.033 264 HG3 GLU 75 2HG GLU 75 -16.411 -11.444 -1.742 265 H THR 76 H THR 76 -15.632 -11.753 2.818 266 HA THR 76 HA THR 76 -16.850 -14.241 3.814 267 HB THR 76 HB THR 76 -14.770 -13.850 5.027 268 HG1 THR 76 HG1 THR 76 -16.508 -14.684 6.220 269 HG21 THR 76 3HG2 THR 76 -15.945 -11.184 5.763 270 HG22 THR 76 1HG2 THR 76 -14.470 -11.484 4.845 271 HG23 THR 76 2HG2 THR 76 -14.552 -11.924 6.551 272 H LYS 77 H LYS 77 -18.929 -14.079 4.320 273 HA LYS 77 HA LYS 77 -20.115 -11.399 4.481 274 HB2 LYS 77 1HB LYS 77 -22.236 -12.457 3.950 275 HB3 LYS 77 2HB LYS 77 -21.021 -12.908 2.765 276 HG2 LYS 77 1HG LYS 77 -21.657 -15.008 3.094 277 HG3 LYS 77 2HG LYS 77 -20.853 -14.911 4.663 278 HD2 LYS 77 1HD LYS 77 -23.305 -13.730 5.127 279 HD3 LYS 77 2HD LYS 77 -23.692 -15.046 4.018 280 HE2 LYS 77 1HE LYS 77 -22.134 -15.323 6.587 281 HE3 LYS 77 2HE LYS 77 -23.836 -15.731 6.378 282 HZ1 LYS 77 3HZ LYS 77 -23.340 -17.601 5.208 283 HZ2 LYS 77 1HZ LYS 77 -21.943 -17.528 6.159 284 HZ3 LYS 77 2HZ LYS 77 -21.907 -16.978 4.561 285 H ASP 78 H ASP 78 -21.904 -11.061 5.993 286 HA ASP 78 HA ASP 78 -22.706 -10.910 8.109 287 HB2 ASP 78 1HB ASP 78 -23.225 -13.410 7.370 288 HB3 ASP 78 2HB ASP 78 -22.099 -13.776 8.670 289 H SER 79 H SER 79 -20.148 -10.038 7.925 290 HA SER 79 HA SER 79 -18.372 -11.267 9.777 291 HB2 SER 79 1HB SER 79 -18.047 -9.422 7.821 292 HB3 SER 79 2HB SER 79 -18.038 -8.374 9.241 293 HG SER 79 HG SER 79 -16.339 -9.597 10.078 294 H LEU 80 H LEU 80 -20.165 -8.172 9.996 295 HA LEU 80 HA LEU 80 -19.642 -7.937 12.804 296 HB2 LEU 80 1HB LEU 80 -21.464 -6.411 10.950 297 HB3 LEU 80 2HB LEU 80 -21.287 -6.029 12.652 298 HG LEU 80 HG LEU 80 -18.775 -6.147 11.093 299 HD11 LEU 80 1HD1 LEU 80 -19.659 -4.911 9.423 300 HD12 LEU 80 2HD1 LEU 80 -19.440 -3.597 10.578 301 HD13 LEU 80 3HD1 LEU 80 -21.019 -4.361 10.402 302 HD21 LEU 80 3HD2 LEU 80 -19.533 -3.838 12.769 303 HD22 LEU 80 1HD2 LEU 80 -18.022 -4.745 12.700 304 HD23 LEU 80 2HD2 LEU 80 -19.398 -5.389 13.597 305 H ASN 81 H ASN 81 -22.153 -9.374 10.890 306 HA ASN 81 HA ASN 81 -24.033 -10.526 11.397 307 HB2 ASN 81 1HB ASN 81 -22.264 -11.486 13.098 308 HB3 ASN 81 2HB ASN 81 -23.275 -10.674 14.290 309 HD21 ASN 81 2HD2 ASN 81 -22.753 -13.541 13.758 310 HD22 ASN 81 1HD2 ASN 81 -24.319 -14.253 13.537 311 H THR 82 H THR 82 -24.319 -7.799 11.318 312 HA THR 82 HA THR 82 -26.615 -7.435 13.056 313 HB THR 82 HB THR 82 -24.916 -6.430 14.423 314 HG1 THR 82 HG1 THR 82 -26.209 -4.309 13.061 315 HG21 THR 82 3HG2 THR 82 -23.362 -4.817 13.795 316 HG22 THR 82 1HG2 THR 82 -24.149 -4.520 12.248 317 HG23 THR 82 2HG2 THR 82 -23.278 -6.029 12.520 318 H ASN 83 H ASN 83 -24.564 -5.729 10.667 319 HA ASN 83 HA ASN 83 -26.698 -5.588 8.767 320 HB2 ASN 83 1HB ASN 83 -26.103 -3.249 10.492 321 HB3 ASN 83 2HB ASN 83 -26.297 -2.918 8.776 322 HD21 ASN 83 2HD2 ASN 83 -27.893 -2.908 11.573 323 HD22 ASN 83 1HD2 ASN 83 -29.503 -3.250 11.020 324 H SER 84 H SER 84 -24.101 -6.665 8.708 325 HA SER 84 HA SER 84 -22.435 -4.812 7.213 326 HB2 SER 84 1HB SER 84 -21.006 -7.050 7.070 327 HB3 SER 84 2HB SER 84 -21.035 -6.070 8.533 328 HG SER 84 HG SER 84 -21.821 -8.607 8.204 329 H SER 85 H SER 85 -23.213 -8.228 6.527 330 HA SER 85 HA SER 85 -23.775 -9.323 4.622 331 HB2 SER 85 1HB SER 85 -25.597 -7.368 4.784 332 HB3 SER 85 2HB SER 85 -24.818 -6.878 3.280 333 HG SER 85 HG SER 85 -25.982 -9.403 3.852 334 H PHE 86 H PHE 86 -22.019 -9.967 3.533 335 HA PHE 86 HA PHE 86 -20.373 -10.059 1.978 336 HB2 PHE 86 1HB PHE 86 -22.037 -7.818 0.938 337 HB3 PHE 86 2HB PHE 86 -20.419 -7.999 0.277 338 HD1 PHE 86 HD1 PHE 86 -23.022 -10.485 1.278 339 HD2 PHE 86 HD2 PHE 86 -20.564 -8.913 -1.823 340 HE1 PHE 86 HE1 PHE 86 -23.845 -12.223 -0.253 341 HE2 PHE 86 HE2 PHE 86 -21.385 -10.649 -3.359 342 HZ PHE 86 HZ PHE 86 -23.028 -12.308 -2.576 343 H ASN 87 H ASN 87 -18.670 -9.817 3.354 344 HA ASN 87 HA ASN 87 -17.492 -7.132 3.492 345 HB2 ASN 87 1HB ASN 87 -18.314 -8.797 5.661 346 HB3 ASN 87 2HB ASN 87 -16.555 -8.738 5.668 347 HD21 ASN 87 2HD2 ASN 87 -19.258 -6.491 5.121 348 HD22 ASN 87 1HD2 ASN 87 -18.623 -5.226 6.127 349 H VAL 88 H VAL 88 -16.405 -7.743 1.574 350 HA VAL 88 HA VAL 88 -14.364 -9.827 1.851 351 HB VAL 88 HB VAL 88 -15.402 -10.177 -0.185 352 HG11 VAL 88 1HG1 VAL 88 -16.836 -8.299 -0.354 353 HG12 VAL 88 2HG1 VAL 88 -15.873 -8.337 -1.832 354 HG13 VAL 88 3HG1 VAL 88 -15.474 -7.194 -0.551 355 HG21 VAL 88 3HG2 VAL 88 -13.698 -10.084 -1.667 356 HG22 VAL 88 1HG2 VAL 88 -12.801 -9.577 -0.236 357 HG23 VAL 88 2HG2 VAL 88 -13.391 -8.371 -1.380 358 H LEU 89 H LEU 89 -12.362 -9.323 2.330 359 HA LEU 89 HA LEU 89 -11.482 -6.534 1.973 360 HB2 LEU 89 1HB LEU 89 -10.154 -8.438 3.860 361 HB3 LEU 89 2HB LEU 89 -10.172 -6.686 3.887 362 HG LEU 89 HG LEU 89 -12.694 -8.235 4.391 363 HD11 LEU 89 1HD1 LEU 89 -12.182 -8.113 6.802 364 HD12 LEU 89 2HD1 LEU 89 -10.549 -7.577 6.405 365 HD13 LEU 89 3HD1 LEU 89 -11.091 -9.185 5.924 366 HD21 LEU 89 3HD2 LEU 89 -13.301 -6.048 4.266 367 HD22 LEU 89 1HD2 LEU 89 -11.705 -5.461 4.739 368 HD23 LEU 89 2HD2 LEU 89 -12.813 -6.087 5.961 369 H TYR 90 H TYR 90 -9.051 -6.327 1.829 370 HA TYR 90 HA TYR 90 -8.004 -8.353 -0.036 371 HB2 TYR 90 1HB TYR 90 -8.047 -5.408 -0.100 372 HB3 TYR 90 2HB TYR 90 -6.484 -6.120 -0.490 373 HD1 TYR 90 HD2 TYR 90 -7.434 -8.627 -1.833 374 HD2 TYR 90 HD1 TYR 90 -8.725 -4.591 -2.205 375 HE1 TYR 90 HE2 TYR 90 -8.205 -9.093 -4.110 376 HE2 TYR 90 HE1 TYR 90 -9.500 -5.047 -4.494 377 HH TYR 90 HH TYR 90 -10.047 -8.001 -5.697 378 H LYS 91 H LYS 91 -6.552 -9.603 0.973 379 HA LYS 91 HA LYS 91 -5.152 -8.816 3.322 380 HB2 LYS 91 1HB LYS 91 -4.742 -11.146 1.434 381 HB3 LYS 91 2HB LYS 91 -3.852 -10.939 2.934 382 HG2 LYS 91 1HG LYS 91 -6.141 -10.886 4.074 383 HG3 LYS 91 2HG LYS 91 -6.767 -11.522 2.550 384 HD2 LYS 91 1HD LYS 91 -4.577 -13.125 3.058 385 HD3 LYS 91 2HD LYS 91 -5.264 -12.861 4.661 386 HE2 LYS 91 1HE LYS 91 -7.503 -13.498 3.643 387 HE3 LYS 91 2HE LYS 91 -6.595 -14.045 2.235 388 HZ1 LYS 91 3HZ LYS 91 -5.843 -15.851 3.313 389 HZ2 LYS 91 1HZ LYS 91 -7.187 -15.604 4.310 390 HZ3 LYS 91 2HZ LYS 91 -5.662 -15.054 4.794 391 H VAL 92 H VAL 92 -3.871 -7.020 3.013 392 HA VAL 92 HA VAL 92 -1.846 -7.173 0.885 393 HB VAL 92 HB VAL 92 -1.605 -4.788 1.014 394 HG11 VAL 92 1HG1 VAL 92 -3.290 -5.172 -0.478 395 HG12 VAL 92 2HG1 VAL 92 -4.136 -4.150 0.685 396 HG13 VAL 92 3HG1 VAL 92 -4.348 -5.900 0.730 397 HG21 VAL 92 3HG2 VAL 92 -3.066 -3.436 2.527 398 HG22 VAL 92 1HG2 VAL 92 -1.830 -4.377 3.362 399 HG23 VAL 92 2HG2 VAL 92 -3.504 -4.933 3.352 400 H LEU 93 H LEU 93 0.313 -6.865 1.292 401 HA LEU 93 HA LEU 93 1.116 -7.196 4.094 402 HB2 LEU 93 1HB LEU 93 1.852 -8.729 2.087 403 HB3 LEU 93 2HB LEU 93 3.009 -7.445 1.789 404 HG LEU 93 HG LEU 93 3.814 -7.742 4.160 405 HD11 LEU 93 1HD1 LEU 93 3.234 -9.705 5.380 406 HD12 LEU 93 2HD1 LEU 93 2.265 -10.322 4.041 407 HD13 LEU 93 3HD1 LEU 93 1.732 -8.898 4.930 408 HD21 LEU 93 3HD2 LEU 93 4.062 -9.872 2.067 409 HD22 LEU 93 1HD2 LEU 93 4.913 -10.011 3.608 410 HD23 LEU 93 2HD2 LEU 93 5.226 -8.638 2.546 411 H PHE 94 H PHE 94 2.240 -5.685 5.144 412 HA PHE 94 HA PHE 94 2.689 -3.136 3.791 413 HB2 PHE 94 1HB PHE 94 2.379 -4.030 6.620 414 HB3 PHE 94 2HB PHE 94 3.317 -2.571 6.324 415 HD1 PHE 94 HD1 PHE 94 0.098 -4.020 5.045 416 HD2 PHE 94 HD2 PHE 94 2.151 -0.637 6.623 417 HE1 PHE 94 HE1 PHE 94 -1.971 -2.702 4.909 418 HE2 PHE 94 HE2 PHE 94 0.080 0.681 6.490 419 HZ PHE 94 HZ PHE 94 -1.982 -0.350 5.632 420 H PHE 95 H PHE 95 4.682 -1.920 4.164 421 HA PHE 95 HA PHE 95 7.051 -3.530 4.800 422 HB2 PHE 95 1HB PHE 95 6.903 -1.813 2.317 423 HB3 PHE 95 2HB PHE 95 8.205 -2.896 2.791 424 HD1 PHE 95 HD2 PHE 95 7.931 -5.321 2.613 425 HD2 PHE 95 HD1 PHE 95 4.928 -2.630 1.244 426 HE1 PHE 95 HE2 PHE 95 6.887 -7.141 1.332 427 HE2 PHE 95 HE1 PHE 95 3.883 -4.447 -0.039 428 HZ PHE 95 HZ PHE 95 4.860 -6.706 0.004 429 HA PRO 96 HA PRO 96 9.351 -2.920 4.172 430 HB2 PRO 96 1HB PRO 96 11.284 -2.215 6.189 431 HB3 PRO 96 2HB PRO 96 11.400 -2.022 4.435 432 HG2 PRO 96 1HG PRO 96 11.228 0.072 6.181 433 HG3 PRO 96 2HG PRO 96 10.655 0.138 4.504 434 HD2 PRO 96 1HD PRO 96 9.089 -0.290 7.025 435 HD3 PRO 96 2HD PRO 96 8.697 0.712 5.610 436 H ASP 97 H ASP 97 8.398 -2.301 7.474 437 HA ASP 97 HA ASP 97 9.452 -4.310 8.954 438 HB2 ASP 97 1HB ASP 97 6.789 -2.972 8.999 439 HB3 ASP 97 2HB ASP 97 7.019 -4.386 10.023 440 H PHE 98 H PHE 98 7.070 -4.739 6.429 441 HA PHE 98 HA PHE 98 6.388 -6.631 5.352 442 HB2 PHE 98 1HB PHE 98 7.935 -8.215 7.415 443 HB3 PHE 98 2HB PHE 98 7.292 -8.823 5.899 444 HD1 PHE 98 HD1 PHE 98 8.080 -7.029 3.877 445 HD2 PHE 98 HD2 PHE 98 10.216 -8.126 7.390 446 HE1 PHE 98 HE1 PHE 98 10.200 -6.470 2.759 447 HE2 PHE 98 HE2 PHE 98 12.339 -7.567 6.280 448 HZ PHE 98 HZ PHE 98 12.333 -6.737 3.961 449 H ASN 99 H ASN 99 4.878 -5.315 7.340 450 HA ASN 99 HA ASN 99 3.528 -7.379 8.885 451 HB2 ASN 99 1HB ASN 99 3.963 -4.673 9.289 452 HB3 ASN 99 2HB ASN 99 2.274 -4.728 8.803 453 HD21 ASN 99 2HD2 ASN 99 3.160 -3.928 11.329 454 HD22 ASN 99 1HD2 ASN 99 2.584 -5.072 12.499 455 H PHE 100 H PHE 100 0.861 -6.318 8.710 456 HA PHE 100 HA PHE 100 0.081 -6.299 5.942 457 HB2 PHE 100 1HB PHE 100 -1.530 -8.367 6.604 458 HB3 PHE 100 2HB PHE 100 0.005 -8.559 5.764 459 HD1 PHE 100 HD1 PHE 100 1.983 -9.325 6.959 460 HD2 PHE 100 HD2 PHE 100 -1.811 -9.076 8.863 461 HE1 PHE 100 HE1 PHE 100 2.809 -10.750 8.782 462 HE2 PHE 100 HE2 PHE 100 -0.996 -10.496 10.689 463 HZ PHE 100 HZ PHE 100 1.323 -11.339 10.651 464 H ALA 101 H ALA 101 -2.436 -6.539 5.830 465 HA ALA 101 HA ALA 101 -3.929 -5.725 8.117 466 HB1 ALA 101 3HB ALA 101 -4.355 -3.491 6.460 467 HB2 ALA 101 1HB ALA 101 -2.606 -3.675 6.609 468 HB3 ALA 101 2HB ALA 101 -3.607 -3.525 8.056 469 H TRP 102 H TRP 102 -5.990 -6.344 7.810 470 HA TRP 102 HA TRP 102 -6.843 -7.102 5.120 471 HB2 TRP 102 1HB TRP 102 -8.336 -7.506 7.720 472 HB3 TRP 102 2HB TRP 102 -8.627 -8.317 6.188 473 HD1 TRP 102 HD1 TRP 102 -5.117 -8.564 6.195 474 HE1 TRP 102 HE1 TRP 102 -4.244 -10.690 7.350 475 HE3 TRP 102 HE3 TRP 102 -9.321 -9.855 8.803 476 HZ2 TRP 102 HZ2 TRP 102 -5.211 -12.657 9.133 477 HZ3 TRP 102 HZ3 TRP 102 -9.263 -11.874 10.211 478 HH2 TRP 102 HH2 TRP 102 -7.250 -13.244 10.369 479 H VAL 103 H VAL 103 -7.603 -5.395 3.983 480 HA VAL 103 HA VAL 103 -9.794 -3.834 5.167 481 HB VAL 103 HB VAL 103 -7.804 -2.451 5.394 482 HG11 VAL 103 1HG1 VAL 103 -7.191 -3.513 2.791 483 HG12 VAL 103 2HG1 VAL 103 -6.149 -2.662 3.930 484 HG13 VAL 103 3HG1 VAL 103 -7.121 -1.751 2.774 485 HG21 VAL 103 3HG2 VAL 103 -8.689 -0.487 4.549 486 HG22 VAL 103 1HG2 VAL 103 -10.100 -1.543 4.594 487 HG23 VAL 103 2HG2 VAL 103 -9.261 -1.258 3.070 488 H LYS 104 H LYS 104 -11.318 -3.011 3.676 489 HA LYS 104 HA LYS 104 -11.753 -4.601 1.376 490 HB2 LYS 104 1HB LYS 104 -13.073 -2.217 2.584 491 HB3 LYS 104 2HB LYS 104 -13.460 -2.617 0.918 492 HG2 LYS 104 1HG LYS 104 -14.693 -4.391 1.497 493 HG3 LYS 104 2HG LYS 104 -13.562 -4.894 2.754 494 HD2 LYS 104 1HD LYS 104 -15.491 -2.591 3.016 495 HD3 LYS 104 2HD LYS 104 -15.797 -4.220 3.619 496 HE2 LYS 104 1HE LYS 104 -13.220 -3.285 4.500 497 HE3 LYS 104 2HE LYS 104 -14.474 -2.125 4.936 498 HZ1 LYS 104 3HZ LYS 104 -15.442 -3.573 6.362 499 HZ2 LYS 104 1HZ LYS 104 -13.872 -4.195 6.445 500 HZ3 LYS 104 2HZ LYS 104 -15.028 -4.945 5.464 501 H ARG 105 H ARG 105 -12.389 -3.374 -0.766 502 HA ARG 105 HA ARG 105 -9.945 -2.325 -1.824 503 HB2 ARG 105 1HB ARG 105 -12.569 -2.281 -3.288 504 HB3 ARG 105 2HB ARG 105 -10.947 -2.441 -3.944 505 HG2 ARG 105 1HG ARG 105 -11.412 -4.611 -4.092 506 HG3 ARG 105 2HG ARG 105 -11.146 -4.655 -2.348 507 HD2 ARG 105 1HD ARG 105 -13.220 -5.658 -2.541 508 HD3 ARG 105 2HD ARG 105 -13.653 -3.982 -2.212 509 HE ARG 105 HE ARG 105 -14.659 -3.913 -4.249 510 HH11 ARG 105 1HH1 ARG 105 -12.313 -6.512 -4.301 511 HH12 ARG 105 2HH1 ARG 105 -12.741 -7.033 -5.893 512 HH21 ARG 105 1HH2 ARG 105 -15.225 -4.609 -6.348 513 HH22 ARG 105 2HH2 ARG 105 -14.398 -5.956 -7.054 514 H ASN 106 H ASN 106 -12.851 -0.886 -0.562 515 HA ASN 106 HA ASN 106 -12.788 1.569 -1.920 516 HB2 ASN 106 1HB ASN 106 -14.021 2.467 0.102 517 HB3 ASN 106 2HB ASN 106 -14.759 1.088 -0.701 518 HD21 ASN 106 2HD2 ASN 106 -15.240 -0.653 0.478 519 HD22 ASN 106 1HD2 ASN 106 -14.744 -0.913 2.121 520 H SER 107 H SER 107 -11.171 0.570 1.089 521 HA SER 107 HA SER 107 -9.964 3.169 1.439 522 HB2 SER 107 1HB SER 107 -10.437 0.988 3.122 523 HB3 SER 107 2HB SER 107 -8.681 1.055 2.961 524 HG SER 107 HG SER 107 -10.391 2.768 4.243 525 H VAL 108 H VAL 108 -9.323 0.620 -0.613 526 HA VAL 108 HA VAL 108 -6.427 1.042 -0.616 527 HB VAL 108 HB VAL 108 -8.073 -0.999 -2.109 528 HG11 VAL 108 1HG1 VAL 108 -5.885 -2.111 -2.485 529 HG12 VAL 108 2HG1 VAL 108 -5.088 -0.688 -1.817 530 HG13 VAL 108 3HG1 VAL 108 -6.032 -0.556 -3.301 531 HG21 VAL 108 3HG2 VAL 108 -7.714 -2.520 -0.447 532 HG22 VAL 108 1HG2 VAL 108 -7.788 -1.046 0.520 533 HG23 VAL 108 2HG2 VAL 108 -6.227 -1.745 0.094 534 H LYS 109 H LYS 109 -5.315 1.542 -2.573 535 HA LYS 109 HA LYS 109 -6.913 2.556 -4.808 536 HB2 LYS 109 1HB LYS 109 -6.484 4.472 -3.322 537 HB3 LYS 109 2HB LYS 109 -4.759 4.144 -3.396 538 HG2 LYS 109 1HG LYS 109 -4.865 4.549 -5.858 539 HG3 LYS 109 2HG LYS 109 -6.540 5.058 -5.643 540 HD2 LYS 109 1HD LYS 109 -5.944 7.056 -4.819 541 HD3 LYS 109 2HD LYS 109 -4.684 6.358 -3.799 542 HE2 LYS 109 1HE LYS 109 -3.077 6.867 -5.265 543 HE3 LYS 109 2HE LYS 109 -4.011 6.248 -6.625 544 HZ1 LYS 109 3HZ LYS 109 -5.297 8.378 -6.525 545 HZ2 LYS 109 1HZ LYS 109 -3.679 8.544 -6.994 546 HZ3 LYS 109 2HZ LYS 109 -4.150 8.955 -5.423 547 HA PRO 110 HA PRO 110 -3.792 0.404 -7.134 548 HB2 PRO 110 1HB PRO 110 -4.108 1.672 -9.537 549 HB3 PRO 110 2HB PRO 110 -5.205 0.423 -8.938 550 HG2 PRO 110 1HG PRO 110 -5.499 3.402 -8.852 551 HG3 PRO 110 2HG PRO 110 -6.710 2.168 -9.250 552 HD2 PRO 110 1HD PRO 110 -6.626 3.347 -6.834 553 HD3 PRO 110 2HD PRO 110 -7.092 1.646 -7.029 554 H LEU 111 H LEU 111 -1.727 0.820 -6.636 555 HA LEU 111 HA LEU 111 -0.638 3.507 -6.975 556 HB2 LEU 111 1HB LEU 111 -0.269 2.211 -4.873 557 HB3 LEU 111 2HB LEU 111 0.669 1.054 -5.797 558 HG LEU 111 HG LEU 111 2.267 2.876 -6.375 559 HD11 LEU 111 1HD1 LEU 111 0.544 4.454 -4.473 560 HD12 LEU 111 2HD1 LEU 111 0.892 4.816 -6.163 561 HD13 LEU 111 3HD1 LEU 111 2.172 4.929 -4.958 562 HD21 LEU 111 3HD2 LEU 111 3.022 1.523 -4.654 563 HD22 LEU 111 1HD2 LEU 111 1.758 2.049 -3.545 564 HD23 LEU 111 2HD2 LEU 111 3.094 3.131 -3.936 565 H LEU 112 H LEU 112 1.268 3.934 -8.171 566 HA LEU 112 HA LEU 112 1.928 1.899 -10.197 567 HB2 LEU 112 1HB LEU 112 2.521 4.123 -11.548 568 HB3 LEU 112 2HB LEU 112 0.944 3.364 -11.610 569 HG LEU 112 HG LEU 112 1.363 5.438 -9.524 570 HD11 LEU 112 1HD1 LEU 112 2.361 6.667 -11.227 571 HD12 LEU 112 2HD1 LEU 112 0.665 7.144 -11.313 572 HD13 LEU 112 3HD1 LEU 112 1.314 5.980 -12.468 573 HD21 LEU 112 3HD2 LEU 112 -0.767 3.986 -10.301 574 HD22 LEU 112 1HD2 LEU 112 -0.976 5.411 -11.319 575 HD23 LEU 112 2HD2 LEU 112 -0.889 5.584 -9.566 576 H ASP 113 H ASP 113 4.088 2.441 -11.306 577 HA ASP 113 HA ASP 113 6.111 2.437 -9.318 578 HB2 ASP 113 1HB ASP 113 6.314 1.212 -11.464 579 HB3 ASP 113 2HB ASP 113 6.428 2.752 -12.312 580 H SER 114 H SER 114 5.214 4.815 -11.813 581 HA SER 114 HA SER 114 7.159 6.735 -11.238 582 HB2 SER 114 1HB SER 114 4.348 7.417 -12.117 583 HB3 SER 114 2HB SER 114 5.843 8.282 -12.482 584 HG SER 114 HG SER 114 5.210 7.038 -14.258 585 H GLU 115 H GLU 115 3.981 6.178 -9.764 586 HA GLU 115 HA GLU 115 3.954 8.521 -8.174 587 HB2 GLU 115 1HB GLU 115 2.499 5.899 -8.068 588 HB3 GLU 115 2HB GLU 115 2.379 7.007 -6.710 589 HG2 GLU 115 1HG GLU 115 1.833 7.970 -9.484 590 HG3 GLU 115 2HG GLU 115 0.604 7.081 -8.587 591 H ILE 116 H ILE 116 5.025 5.197 -7.479 592 HA ILE 116 HA ILE 116 5.729 5.571 -4.797 593 HB ILE 116 HB ILE 116 6.983 3.694 -6.814 594 HG12 ILE 116 1HG1 ILE 116 5.026 2.910 -4.677 595 HG13 ILE 116 2HG1 ILE 116 4.441 3.580 -6.196 596 HG21 ILE 116 1HG2 ILE 116 8.427 4.068 -4.869 597 HG22 ILE 116 2HG2 ILE 116 7.788 2.424 -4.903 598 HG23 ILE 116 3HG2 ILE 116 7.100 3.615 -3.801 599 HD11 ILE 116 3HD1 ILE 116 4.512 1.079 -6.051 600 HD12 ILE 116 1HD1 ILE 116 6.270 1.204 -6.054 601 HD13 ILE 116 2HD1 ILE 116 5.342 1.784 -7.438 602 H ALA 117 H ALA 117 7.814 5.665 -7.698 603 HA ALA 117 HA ALA 117 10.181 6.481 -6.495 604 HB1 ALA 117 3HB ALA 117 9.580 5.868 -8.992 605 HB2 ALA 117 1HB ALA 117 10.972 6.885 -8.612 606 HB3 ALA 117 2HB ALA 117 9.461 7.621 -9.153 607 H LYS 118 H LYS 118 7.401 8.362 -7.570 608 HA LYS 118 HA LYS 118 8.525 10.926 -7.147 609 HB2 LYS 118 1HB LYS 118 6.190 9.962 -8.248 610 HB3 LYS 118 2HB LYS 118 5.630 10.758 -6.783 611 HG2 LYS 118 1HG LYS 118 5.742 12.679 -7.843 612 HG3 LYS 118 2HG LYS 118 7.498 12.483 -7.923 613 HD2 LYS 118 1HD LYS 118 7.347 11.392 -10.050 614 HD3 LYS 118 2HD LYS 118 5.585 11.305 -9.940 615 HE2 LYS 118 1HE LYS 118 5.534 13.801 -9.951 616 HE3 LYS 118 2HE LYS 118 7.274 13.792 -10.235 617 HZ1 LYS 118 3HZ LYS 118 6.828 12.482 -12.275 618 HZ2 LYS 118 1HZ LYS 118 6.169 14.040 -12.315 619 HZ3 LYS 118 2HZ LYS 118 5.169 12.706 -12.024 620 H PHE 119 H PHE 119 6.269 8.985 -5.198 621 HA PHE 119 HA PHE 119 5.926 10.660 -3.036 622 HB2 PHE 119 1HB PHE 119 4.688 8.624 -3.110 623 HB3 PHE 119 2HB PHE 119 6.153 7.652 -3.170 624 HD1 PHE 119 HD1 PHE 119 7.678 7.721 -1.081 625 HD2 PHE 119 HD2 PHE 119 3.611 8.983 -1.091 626 HE1 PHE 119 HE1 PHE 119 7.580 7.413 1.359 627 HE2 PHE 119 HE2 PHE 119 3.514 8.683 1.350 628 HZ PHE 119 HZ PHE 119 5.504 7.896 2.566 629 H LEU 120 H LEU 120 8.578 8.381 -3.607 630 HA LEU 120 HA LEU 120 9.949 8.925 -1.188 631 HB2 LEU 120 1HB LEU 120 10.912 7.791 -3.810 632 HB3 LEU 120 2HB LEU 120 11.881 7.850 -2.348 633 HG LEU 120 HG LEU 120 9.256 6.574 -2.010 634 HD11 LEU 120 1HD1 LEU 120 9.892 5.843 -4.305 635 HD12 LEU 120 2HD1 LEU 120 9.810 4.526 -3.137 636 HD13 LEU 120 3HD1 LEU 120 11.377 5.166 -3.634 637 HD21 LEU 120 3HD2 LEU 120 11.103 4.836 -1.116 638 HD22 LEU 120 1HD2 LEU 120 10.507 6.200 -0.173 639 HD23 LEU 120 2HD2 LEU 120 12.033 6.330 -1.047 640 H GLY 121 H GLY 121 10.013 10.369 -4.406 641 HA2 GLY 121 1HA GLY 121 12.308 12.034 -3.766 642 HA3 GLY 121 2HA GLY 121 11.395 12.041 -5.264 643 H SER 122 H SER 122 9.387 12.210 -2.508 644 HA SER 122 HA SER 122 8.389 14.754 -3.175 645 HB2 SER 122 1HB SER 122 8.068 13.020 -0.725 646 HB3 SER 122 2HB SER 122 7.262 14.579 -0.881 647 HG SER 122 HG SER 122 6.462 13.656 -2.966 648 H SER 123 H SER 123 9.283 16.678 -2.855 649 HA SER 123 HA SER 123 11.252 16.990 -0.695 650 HB2 SER 123 1HB SER 123 11.690 19.190 -2.122 651 HB3 SER 123 2HB SER 123 12.390 17.640 -2.590 652 HG SER 123 HG SER 123 11.299 18.835 -4.301 653 H LYS 124 H LYS 124 8.326 17.128 -0.287 654 HA LYS 124 HA LYS 124 8.202 19.875 0.773 655 HB2 LYS 124 1HB LYS 124 5.712 19.775 0.351 656 HB3 LYS 124 2HB LYS 124 6.724 19.914 -1.082 657 HG2 LYS 124 1HG LYS 124 6.351 17.154 -0.580 658 HG3 LYS 124 2HG LYS 124 4.776 17.939 -0.453 659 HD2 LYS 124 1HD LYS 124 5.737 19.137 -2.673 660 HD3 LYS 124 2HD LYS 124 6.536 17.565 -2.790 661 HE2 LYS 124 1HE LYS 124 3.615 17.698 -2.181 662 HE3 LYS 124 2HE LYS 124 4.164 17.931 -3.841 663 HZ1 LYS 124 3HZ LYS 124 5.231 15.629 -2.394 664 HZ2 LYS 124 1HZ LYS 124 4.811 15.782 -4.026 665 HZ3 LYS 124 2HZ LYS 124 3.607 15.553 -2.860 666 H ARG 125 H ARG 125 6.635 16.673 0.992 667 HA ARG 125 HA ARG 125 6.780 16.873 3.897 668 HB2 ARG 125 1HB ARG 125 4.465 17.501 3.113 669 HB3 ARG 125 2HB ARG 125 4.312 15.868 2.476 670 HG2 ARG 125 1HG ARG 125 5.139 15.446 5.066 671 HG3 ARG 125 2HG ARG 125 4.072 16.842 5.207 672 HD2 ARG 125 1HD ARG 125 3.020 14.535 5.439 673 HD3 ARG 125 2HD ARG 125 2.238 15.668 4.344 674 HE ARG 125 HE ARG 125 2.774 14.294 2.579 675 HH11 ARG 125 1HH1 ARG 125 4.538 13.252 5.416 676 HH12 ARG 125 2HH1 ARG 125 5.073 11.775 4.694 677 HH21 ARG 125 1HH2 ARG 125 3.484 12.332 1.630 678 HH22 ARG 125 2HH2 ARG 125 4.476 11.251 2.548 679 H LYS 126 H LYS 126 8.247 15.367 4.202 680 HA LYS 126 HA LYS 126 7.625 12.630 3.398 681 HB2 LYS 126 1HB LYS 126 9.873 12.215 2.616 682 HB3 LYS 126 2HB LYS 126 9.195 13.574 1.735 683 HG2 LYS 126 1HG LYS 126 11.006 13.920 4.108 684 HG3 LYS 126 2HG LYS 126 11.599 13.791 2.453 685 HD2 LYS 126 1HD LYS 126 9.542 15.700 2.386 686 HD3 LYS 126 2HD LYS 126 10.493 16.068 3.826 687 HE2 LYS 126 1HE LYS 126 11.500 15.805 0.995 688 HE3 LYS 126 2HE LYS 126 11.373 17.286 1.939 689 HZ1 LYS 126 3HZ LYS 126 12.945 16.081 3.553 690 HZ2 LYS 126 1HZ LYS 126 13.594 16.713 2.124 691 HZ3 LYS 126 2HZ LYS 126 13.279 15.056 2.250 692 H SER 127 H SER 127 8.501 11.004 4.738 693 HA SER 127 HA SER 127 9.836 11.917 7.192 694 HB2 SER 127 1HB SER 127 7.269 11.501 7.397 695 HB3 SER 127 2HB SER 127 7.707 9.795 7.312 696 HG SER 127 HG SER 127 7.933 10.090 9.401 697 H LYS 128 H LYS 128 11.217 10.381 8.178 698 HA LYS 128 HA LYS 128 12.613 8.678 6.478 699 HB2 LYS 128 1HB LYS 128 12.478 9.005 9.440 700 HB3 LYS 128 2HB LYS 128 13.272 7.569 8.806 701 HG2 LYS 128 1HG LYS 128 14.063 10.146 7.605 702 HG3 LYS 128 2HG LYS 128 14.549 9.867 9.277 703 HD2 LYS 128 1HD LYS 128 16.339 8.997 8.093 704 HD3 LYS 128 2HD LYS 128 15.356 7.563 8.389 705 HE2 LYS 128 1HE LYS 128 16.096 7.547 6.100 706 HE3 LYS 128 2HE LYS 128 14.359 7.835 6.138 707 HZ1 LYS 128 3HZ LYS 128 15.607 10.325 6.208 708 HZ2 LYS 128 1HZ LYS 128 14.705 9.652 4.944 709 HZ3 LYS 128 2HZ LYS 128 16.381 9.432 4.998 710 H GLU 129 H GLU 129 10.078 7.884 8.844 711 HA GLU 129 HA GLU 129 10.092 5.095 8.351 712 HB2 GLU 129 1HB GLU 129 8.255 7.004 9.715 713 HB3 GLU 129 2HB GLU 129 7.613 5.429 9.272 714 HG2 GLU 129 1HG GLU 129 9.278 4.314 10.588 715 HG3 GLU 129 2HG GLU 129 10.099 5.838 10.915 716 H LEU 130 H LEU 130 8.459 7.801 6.807 717 HA LEU 130 HA LEU 130 6.659 6.149 5.297 718 HB2 LEU 130 1HB LEU 130 7.323 9.049 5.389 719 HB3 LEU 130 2HB LEU 130 6.564 8.433 3.935 720 HG LEU 130 HG LEU 130 5.223 7.629 6.425 721 HD11 LEU 130 1HD1 LEU 130 4.174 10.144 6.115 722 HD12 LEU 130 2HD1 LEU 130 5.907 10.422 5.956 723 HD13 LEU 130 3HD1 LEU 130 5.270 9.635 7.399 724 HD21 LEU 130 3HD2 LEU 130 4.276 7.160 4.242 725 HD22 LEU 130 1HD2 LEU 130 4.299 8.876 3.836 726 HD23 LEU 130 2HD2 LEU 130 3.241 8.289 5.118 727 H ILE 131 H ILE 131 9.641 7.948 4.531 728 HA ILE 131 HA ILE 131 9.744 7.289 1.812 729 HB ILE 131 HB ILE 131 12.085 7.764 3.660 730 HG12 ILE 131 1HG1 ILE 131 11.009 9.826 1.782 731 HG13 ILE 131 2HG1 ILE 131 10.150 9.548 3.293 732 HG21 ILE 131 1HG2 ILE 131 12.058 6.864 1.025 733 HG22 ILE 131 2HG2 ILE 131 13.435 7.521 1.910 734 HG23 ILE 131 3HG2 ILE 131 12.437 8.584 0.917 735 HD11 ILE 131 3HD1 ILE 131 12.797 10.765 2.808 736 HD12 ILE 131 1HD1 ILE 131 12.606 9.804 4.276 737 HD13 ILE 131 2HD1 ILE 131 11.549 11.183 3.980 738 H GLU 132 H GLU 132 11.377 5.702 4.566 739 HA GLU 132 HA GLU 132 12.576 3.628 3.153 740 HB2 GLU 132 1HB GLU 132 12.566 4.356 5.741 741 HB3 GLU 132 2HB GLU 132 11.477 2.977 5.831 742 HG2 GLU 132 1HG GLU 132 13.260 1.652 4.637 743 HG3 GLU 132 2HG GLU 132 14.334 3.023 4.912 744 H ALA 133 H ALA 133 9.276 4.011 4.271 745 HA ALA 133 HA ALA 133 8.408 1.354 3.913 746 HB1 ALA 133 3HB ALA 133 6.214 2.179 4.163 747 HB2 ALA 133 1HB ALA 133 6.677 3.791 3.614 748 HB3 ALA 133 2HB ALA 133 7.234 3.196 5.180 749 H TYR 134 H TYR 134 8.091 4.196 1.799 750 HA TYR 134 HA TYR 134 6.907 2.756 -0.342 751 HB2 TYR 134 1HB TYR 134 7.833 5.478 0.129 752 HB3 TYR 134 2HB TYR 134 8.160 4.939 -1.516 753 HD1 TYR 134 HD2 TYR 134 5.368 4.907 0.982 754 HD2 TYR 134 HD1 TYR 134 6.516 5.261 -3.099 755 HE1 TYR 134 HE2 TYR 134 3.033 5.379 0.373 756 HE2 TYR 134 HE1 TYR 134 4.184 5.735 -3.718 757 HH TYR 134 HH TYR 134 1.982 5.531 -2.935 758 H GLU 135 H GLU 135 10.220 3.426 0.574 759 HA GLU 135 HA GLU 135 11.473 2.655 -1.840 760 HB2 GLU 135 1HB GLU 135 12.591 3.907 0.005 761 HB3 GLU 135 2HB GLU 135 12.552 2.446 0.981 762 HG2 GLU 135 1HG GLU 135 13.799 1.457 -1.145 763 HG3 GLU 135 2HG GLU 135 14.265 3.145 -1.334 764 H ALA 136 H ALA 136 10.235 0.879 0.924 765 HA ALA 136 HA ALA 136 11.473 -1.617 0.329 766 HB1 ALA 136 3HB ALA 136 10.571 -1.036 2.551 767 HB2 ALA 136 1HB ALA 136 9.950 -2.569 1.937 768 HB3 ALA 136 2HB ALA 136 8.940 -1.123 1.887 769 H SER 137 H SER 137 8.448 -0.089 -0.657 770 HA SER 137 HA SER 137 7.416 -2.454 -1.929 771 HB2 SER 137 1HB SER 137 5.567 -1.068 -2.640 772 HB3 SER 137 2HB SER 137 5.941 -0.688 -0.961 773 HG SER 137 HG SER 137 5.604 1.162 -2.369 774 H LYS 138 H LYS 138 9.561 0.079 -2.860 775 HA LYS 138 HA LYS 138 9.132 0.282 -5.597 776 HB2 LYS 138 1HB LYS 138 11.620 0.554 -3.929 777 HB3 LYS 138 2HB LYS 138 11.659 0.781 -5.670 778 HG2 LYS 138 1HG LYS 138 9.561 2.294 -4.285 779 HG3 LYS 138 2HG LYS 138 11.212 2.750 -3.862 780 HD2 LYS 138 1HD LYS 138 10.415 4.097 -5.725 781 HD3 LYS 138 2HD LYS 138 11.730 3.042 -6.249 782 HE2 LYS 138 1HE LYS 138 8.973 1.997 -6.534 783 HE3 LYS 138 2HE LYS 138 9.435 3.316 -7.605 784 HZ1 LYS 138 3HZ LYS 138 11.550 1.676 -7.815 785 HZ2 LYS 138 1HZ LYS 138 10.226 1.664 -8.871 786 HZ3 LYS 138 2HZ LYS 138 10.303 0.557 -7.594 787 H THR 139 H THR 139 10.481 -2.376 -3.816 788 HA THR 139 HA THR 139 11.597 -3.593 -6.235 789 HB THR 139 HB THR 139 12.087 -5.435 -4.345 790 HG1 THR 139 HG1 THR 139 11.222 -4.451 -2.605 791 HG21 THR 139 3HG2 THR 139 14.244 -4.246 -3.847 792 HG22 THR 139 1HG2 THR 139 13.660 -2.936 -4.872 793 HG23 THR 139 2HG2 THR 139 13.901 -4.545 -5.551 794 HA PRO 140 HA PRO 140 7.518 -5.593 -6.659 795 HB2 PRO 140 1HB PRO 140 9.000 -6.774 -8.957 796 HB3 PRO 140 2HB PRO 140 7.396 -6.033 -8.914 797 HG2 PRO 140 1HG PRO 140 9.469 -4.735 -9.968 798 HG3 PRO 140 2HG PRO 140 8.243 -3.880 -9.012 799 HD2 PRO 140 1HD PRO 140 11.010 -4.710 -8.244 800 HD3 PRO 140 2HD PRO 140 10.110 -3.242 -7.818 801 HA PRO 141 HA PRO 141 10.027 -9.936 -6.777 802 HB2 PRO 141 1HB PRO 141 12.386 -8.747 -5.363 803 HB3 PRO 141 2HB PRO 141 12.323 -10.113 -6.490 804 HG2 PRO 141 1HG PRO 141 13.195 -7.795 -7.347 805 HG3 PRO 141 2HG PRO 141 12.044 -8.704 -8.348 806 HD2 PRO 141 1HD PRO 141 11.558 -6.344 -6.570 807 HD3 PRO 141 2HD PRO 141 10.908 -6.683 -8.188 808 H ASP 142 H ASP 142 10.955 -11.203 -4.751 809 HA ASP 142 HA ASP 142 10.554 -11.987 -2.667 810 HB2 ASP 142 1HB ASP 142 11.664 -9.610 -2.302 811 HB3 ASP 142 2HB ASP 142 10.089 -9.238 -1.613 812 H LEU 143 H LEU 143 8.411 -12.063 -4.330 813 HA LEU 143 HA LEU 143 6.241 -12.396 -2.595 814 HB2 LEU 143 1HB LEU 143 6.239 -9.907 -2.642 815 HB3 LEU 143 2HB LEU 143 5.977 -9.968 -4.373 816 HG LEU 143 HG LEU 143 3.844 -11.300 -3.819 817 HD11 LEU 143 1HD1 LEU 143 4.699 -10.370 -1.117 818 HD12 LEU 143 2HD1 LEU 143 3.955 -11.894 -1.605 819 HD13 LEU 143 3HD1 LEU 143 2.979 -10.428 -1.510 820 HD21 LEU 143 3HD2 LEU 143 2.582 -9.228 -3.439 821 HD22 LEU 143 1HD2 LEU 143 3.815 -9.037 -4.684 822 HD23 LEU 143 2HD2 LEU 143 4.090 -8.392 -3.066 823 H LYS 144 H LYS 144 6.978 -11.459 -5.962 824 HA LYS 144 HA LYS 144 4.874 -12.828 -7.193 825 HB2 LYS 144 1HB LYS 144 7.630 -12.207 -8.274 826 HB3 LYS 144 2HB LYS 144 6.271 -12.739 -9.249 827 HG2 LYS 144 1HG LYS 144 5.130 -10.732 -8.990 828 HG3 LYS 144 2HG LYS 144 6.061 -10.276 -7.561 829 HD2 LYS 144 1HD LYS 144 7.902 -9.627 -8.807 830 HD3 LYS 144 2HD LYS 144 7.445 -10.623 -10.190 831 HE2 LYS 144 1HE LYS 144 5.340 -8.922 -10.066 832 HE3 LYS 144 2HE LYS 144 6.634 -7.886 -9.471 833 HZ1 LYS 144 3HZ LYS 144 7.832 -8.933 -11.584 834 HZ2 LYS 144 1HZ LYS 144 6.893 -7.529 -11.674 835 HZ3 LYS 144 2HZ LYS 144 6.233 -9.017 -12.127 836 H GLU 145 H GLU 145 8.294 -13.898 -7.195 837 HA GLU 145 HA GLU 145 7.549 -16.594 -6.503 838 HB2 GLU 145 1HB GLU 145 7.302 -16.093 -9.137 839 HB3 GLU 145 2HB GLU 145 9.015 -16.492 -9.082 840 HG2 GLU 145 1HG GLU 145 7.970 -18.520 -7.622 841 HG3 GLU 145 2HG GLU 145 6.662 -18.212 -8.765 842 H GLU 146 H GLU 146 8.987 -16.308 -4.800 843 HA GLU 146 HA GLU 146 11.818 -15.984 -5.525 844 HB2 GLU 146 1HB GLU 146 10.203 -14.927 -3.387 845 HB3 GLU 146 2HB GLU 146 11.541 -15.855 -2.726 846 HG2 GLU 146 1HG GLU 146 12.799 -14.393 -4.640 847 HG3 GLU 146 2HG GLU 146 11.534 -13.281 -4.119 848 H SER 147 H SER 147 12.238 -18.111 -6.111 849 HA SER 147 HA SER 147 12.314 -20.002 -3.861 850 HB2 SER 147 1HB SER 147 10.490 -20.387 -5.722 851 HB3 SER 147 2HB SER 147 11.854 -21.031 -6.634 852 HG SER 147 HG SER 147 12.192 -22.538 -5.012 853 H SER 148 H SER 148 13.490 -19.555 -7.209 854 HA SER 148 HA SER 148 16.224 -19.815 -6.327 855 HB2 SER 148 1HB SER 148 16.479 -21.659 -8.244 856 HB3 SER 148 2HB SER 148 16.140 -22.091 -6.567 857 HG SER 148 HG SER 148 14.568 -23.131 -7.575 858 H THR 149 H THR 149 16.383 -17.720 -7.165 859 HA THR 149 HA THR 149 16.601 -17.620 -10.091 860 HB THR 149 HB THR 149 14.468 -16.576 -9.430 861 HG1 THR 149 HG1 THR 149 16.428 -14.720 -10.301 862 HG21 THR 149 3HG2 THR 149 15.435 -15.770 -7.164 863 HG22 THR 149 1HG2 THR 149 14.225 -14.799 -8.001 864 HG23 THR 149 2HG2 THR 149 15.928 -14.352 -8.091 865 H ASP 150 H ASP 150 18.642 -18.016 -8.118 866 HA ASP 150 HA ASP 150 20.768 -17.358 -7.678 867 HB2 ASP 150 1HB ASP 150 20.145 -15.285 -9.783 868 HB3 ASP 150 2HB ASP 150 21.726 -15.457 -9.030 869 H LEU 151 H LEU 151 22.075 -15.624 -6.638 870 HA LEU 151 HA LEU 151 20.455 -13.516 -5.406 871 HB2 LEU 151 1HB LEU 151 21.687 -15.817 -4.047 872 HB3 LEU 151 2HB LEU 151 22.012 -14.264 -3.301 873 HG LEU 151 HG LEU 151 19.345 -14.049 -3.638 874 HD11 LEU 151 1HD1 LEU 151 18.197 -16.058 -3.314 875 HD12 LEU 151 2HD1 LEU 151 19.668 -16.939 -2.902 876 HD13 LEU 151 3HD1 LEU 151 19.382 -16.429 -4.566 877 HD21 LEU 151 3HD2 LEU 151 20.029 -13.576 -1.526 878 HD22 LEU 151 1HD2 LEU 151 21.079 -14.989 -1.427 879 HD23 LEU 151 2HD2 LEU 151 19.337 -15.170 -1.225 880 H GLU 152 H GLU 152 23.765 -14.873 -5.552 881 HA GLU 152 HA GLU 152 25.799 -13.913 -5.858 882 HB2 GLU 152 1HB GLU 152 23.962 -12.133 -7.294 883 HB3 GLU 152 2HB GLU 152 25.446 -11.345 -6.779 884 HG2 GLU 152 1HG GLU 152 26.760 -13.032 -7.936 885 HG3 GLU 152 2HG GLU 152 25.283 -13.858 -8.429 Start of MODEL 15 1 H1 SER 45 1H SER 45 -3.440 8.819 -12.305 2 H2 SER 45 2H SER 45 -4.224 8.347 -10.852 3 H3 SER 45 3H SER 45 -4.615 9.845 -11.592 4 HA SER 45 HA SER 45 -6.331 8.325 -12.031 5 HB2 SER 45 1HB SER 45 -4.564 8.642 -14.475 6 HB3 SER 45 2HB SER 45 -6.317 8.457 -14.464 7 HG SER 45 HG SER 45 -4.784 10.689 -14.039 8 H ALA 46 H ALA 46 -6.013 6.331 -10.930 9 HA ALA 46 HA ALA 46 -4.993 4.192 -12.677 10 HB1 ALA 46 3HB ALA 46 -4.494 4.503 -9.721 11 HB2 ALA 46 1HB ALA 46 -3.299 4.494 -11.019 12 HB3 ALA 46 2HB ALA 46 -4.182 3.021 -10.623 13 H ASP 47 H ASP 47 -6.638 2.917 -13.216 14 HA ASP 47 HA ASP 47 -8.393 1.862 -11.170 15 HB2 ASP 47 1HB ASP 47 -9.278 4.117 -12.401 16 HB3 ASP 47 2HB ASP 47 -9.920 2.885 -13.482 17 H ASP 48 H ASP 48 -6.476 0.525 -12.568 18 HA ASP 48 HA ASP 48 -7.815 -0.881 -14.745 19 HB2 ASP 48 1HB ASP 48 -4.982 -0.850 -13.731 20 HB3 ASP 48 2HB ASP 48 -5.536 -2.092 -14.849 21 H ARG 49 H ARG 49 -8.334 -1.101 -11.715 22 HA ARG 49 HA ARG 49 -9.125 -2.679 -10.305 23 HB2 ARG 49 1HB ARG 49 -9.881 -3.583 -12.682 24 HB3 ARG 49 2HB ARG 49 -8.762 -4.878 -12.281 25 HG2 ARG 49 1HG ARG 49 -10.725 -5.721 -11.459 26 HG3 ARG 49 2HG ARG 49 -10.085 -4.916 -10.025 27 HD2 ARG 49 1HD ARG 49 -12.379 -4.321 -10.192 28 HD3 ARG 49 2HD ARG 49 -11.441 -2.904 -10.664 29 HE ARG 49 HE ARG 49 -11.934 -4.069 -13.034 30 HH11 ARG 49 1HH1 ARG 49 -14.049 -3.271 -10.357 31 HH12 ARG 49 2HH1 ARG 49 -15.436 -3.028 -11.365 32 HH21 ARG 49 1HH2 ARG 49 -13.767 -3.737 -14.357 33 HH22 ARG 49 2HH2 ARG 49 -15.276 -3.291 -13.632 34 H LEU 50 H LEU 50 -8.074 -3.516 -8.629 35 HA LEU 50 HA LEU 50 -5.305 -4.154 -8.759 36 HB2 LEU 50 1HB LEU 50 -7.068 -4.952 -6.466 37 HB3 LEU 50 2HB LEU 50 -5.382 -4.481 -6.437 38 HG LEU 50 HG LEU 50 -7.771 -2.673 -6.797 39 HD11 LEU 50 1HD1 LEU 50 -6.776 -3.643 -4.508 40 HD12 LEU 50 2HD1 LEU 50 -7.477 -2.030 -4.653 41 HD13 LEU 50 3HD1 LEU 50 -5.726 -2.240 -4.715 42 HD21 LEU 50 3HD2 LEU 50 -6.357 -1.469 -8.087 43 HD22 LEU 50 1HD2 LEU 50 -4.918 -2.262 -7.444 44 HD23 LEU 50 2HD2 LEU 50 -5.703 -0.976 -6.526 45 H ASN 51 H ASN 51 -4.403 -6.229 -7.830 46 HA ASN 51 HA ASN 51 -5.977 -8.617 -8.134 47 HB2 ASN 51 1HB ASN 51 -4.308 -7.644 -10.339 48 HB3 ASN 51 2HB ASN 51 -3.934 -9.297 -9.862 49 HD21 ASN 51 2HD2 ASN 51 -5.106 -8.373 -12.332 50 HD22 ASN 51 1HD2 ASN 51 -6.660 -9.138 -12.459 51 H PHE 52 H PHE 52 -4.281 -10.602 -8.168 52 HA PHE 52 HA PHE 52 -2.899 -10.425 -5.679 53 HB2 PHE 52 1HB PHE 52 -2.535 -12.640 -7.697 54 HB3 PHE 52 2HB PHE 52 -2.380 -12.729 -5.943 55 HD1 PHE 52 HD2 PHE 52 -4.837 -11.471 -5.007 56 HD2 PHE 52 HD1 PHE 52 -4.206 -14.113 -8.285 57 HE1 PHE 52 HE2 PHE 52 -7.175 -12.218 -4.852 58 HE2 PHE 52 HE1 PHE 52 -6.545 -14.864 -8.134 59 HZ PHE 52 HZ PHE 52 -8.032 -13.917 -6.416 60 H GLY 53 H GLY 53 -0.719 -10.347 -5.229 61 HA2 GLY 53 1HA GLY 53 1.509 -9.898 -5.550 62 HA3 GLY 53 2HA GLY 53 1.339 -10.598 -7.152 63 H ASP 54 H ASP 54 -0.448 -7.799 -5.950 64 HA ASP 54 HA ASP 54 1.063 -6.100 -7.814 65 HB2 ASP 54 1HB ASP 54 -1.563 -6.863 -8.154 66 HB3 ASP 54 2HB ASP 54 -1.721 -5.297 -7.364 67 H ARG 55 H ARG 55 1.792 -4.231 -7.028 68 HA ARG 55 HA ARG 55 1.560 -3.655 -4.240 69 HB2 ARG 55 1HB ARG 55 2.903 -1.594 -4.843 70 HB3 ARG 55 2HB ARG 55 3.650 -3.135 -5.229 71 HG2 ARG 55 1HG ARG 55 2.073 -2.011 -7.419 72 HG3 ARG 55 2HG ARG 55 3.432 -1.003 -6.920 73 HD2 ARG 55 1HD ARG 55 4.653 -3.388 -6.973 74 HD3 ARG 55 2HD ARG 55 3.408 -3.679 -8.186 75 HE ARG 55 HE ARG 55 5.699 -1.954 -8.421 76 HH11 ARG 55 1HH1 ARG 55 2.471 -2.602 -9.620 77 HH12 ARG 55 2HH1 ARG 55 2.758 -1.859 -11.155 78 HH21 ARG 55 1HH2 ARG 55 6.070 -0.968 -10.445 79 HH22 ARG 55 2HH2 ARG 55 4.803 -0.931 -11.626 80 H ILE 56 H ILE 56 0.032 -2.537 -3.252 81 HA ILE 56 HA ILE 56 -1.405 -0.433 -4.727 82 HB ILE 56 HB ILE 56 -3.520 -1.131 -3.621 83 HG12 ILE 56 1HG1 ILE 56 -1.962 -3.638 -2.931 84 HG13 ILE 56 2HG1 ILE 56 -2.500 -2.426 -1.773 85 HG21 ILE 56 1HG2 ILE 56 -3.826 -3.217 -5.062 86 HG22 ILE 56 2HG2 ILE 56 -2.146 -2.985 -5.542 87 HG23 ILE 56 3HG2 ILE 56 -3.340 -1.732 -5.879 88 HD11 ILE 56 3HD1 ILE 56 -3.870 -4.704 -2.652 89 HD12 ILE 56 1HD1 ILE 56 -4.729 -3.318 -3.322 90 HD13 ILE 56 2HD1 ILE 56 -4.457 -3.431 -1.583 91 H LEU 57 H LEU 57 -2.371 1.217 -3.401 92 HA LEU 57 HA LEU 57 -0.907 1.610 -0.903 93 HB2 LEU 57 1HB LEU 57 -1.500 3.322 -2.960 94 HB3 LEU 57 2HB LEU 57 -2.724 3.741 -1.775 95 HG LEU 57 HG LEU 57 -0.908 4.077 -0.095 96 HD11 LEU 57 1HD1 LEU 57 1.004 4.022 -2.401 97 HD12 LEU 57 2HD1 LEU 57 0.704 2.594 -1.414 98 HD13 LEU 57 3HD1 LEU 57 1.353 4.056 -0.673 99 HD21 LEU 57 3HD2 LEU 57 -0.645 5.747 -2.593 100 HD22 LEU 57 1HD2 LEU 57 -0.202 6.226 -0.954 101 HD23 LEU 57 2HD2 LEU 57 -1.893 5.945 -1.363 102 H VAL 58 H VAL 58 -1.822 1.649 1.080 103 HA VAL 58 HA VAL 58 -4.754 1.343 1.234 104 HB VAL 58 HB VAL 58 -2.697 -0.020 2.978 105 HG11 VAL 58 1HG1 VAL 58 -4.731 -1.288 3.786 106 HG12 VAL 58 2HG1 VAL 58 -5.703 -0.035 3.013 107 HG13 VAL 58 3HG1 VAL 58 -4.597 0.389 4.319 108 HG21 VAL 58 3HG2 VAL 58 -4.464 -1.782 1.549 109 HG22 VAL 58 1HG2 VAL 58 -2.702 -1.727 1.556 110 HG23 VAL 58 2HG2 VAL 58 -3.610 -0.724 0.426 111 H LYS 59 H LYS 59 -5.810 2.639 2.626 112 HA LYS 59 HA LYS 59 -4.194 4.393 4.348 113 HB2 LYS 59 1HB LYS 59 -6.008 5.127 2.476 114 HB3 LYS 59 2HB LYS 59 -7.044 5.043 3.893 115 HG2 LYS 59 1HG LYS 59 -4.490 6.484 4.228 116 HG3 LYS 59 2HG LYS 59 -5.691 7.237 3.177 117 HD2 LYS 59 1HD LYS 59 -7.348 6.828 5.085 118 HD3 LYS 59 2HD LYS 59 -5.926 6.523 6.086 119 HE2 LYS 59 1HE LYS 59 -5.109 8.722 5.756 120 HE3 LYS 59 2HE LYS 59 -6.264 9.032 4.461 121 HZ1 LYS 59 3HZ LYS 59 -8.050 9.005 6.042 122 HZ2 LYS 59 1HZ LYS 59 -6.872 10.094 6.579 123 HZ3 LYS 59 2HZ LYS 59 -7.006 8.568 7.300 124 H ALA 60 H ALA 60 -4.237 4.038 6.459 125 HA ALA 60 HA ALA 60 -6.437 2.445 7.595 126 HB1 ALA 60 3HB ALA 60 -3.544 2.581 8.090 127 HB2 ALA 60 1HB ALA 60 -4.670 1.237 8.289 128 HB3 ALA 60 2HB ALA 60 -4.545 2.476 9.539 129 HA PRO 61 HA PRO 61 -7.822 5.757 10.172 130 HB2 PRO 61 1HB PRO 61 -8.189 4.611 12.606 131 HB3 PRO 61 2HB PRO 61 -9.257 4.309 11.230 132 HG2 PRO 61 1HG PRO 61 -7.016 2.637 12.295 133 HG3 PRO 61 2HG PRO 61 -8.614 2.131 11.715 134 HD2 PRO 61 1HD PRO 61 -6.371 1.926 10.204 135 HD3 PRO 61 2HD PRO 61 -7.977 2.210 9.503 136 H GLY 62 H GLY 62 -6.534 7.403 10.729 137 HA2 GLY 62 1HA GLY 62 -5.273 8.563 12.377 138 HA3 GLY 62 2HA GLY 62 -4.659 7.022 12.952 139 H TYR 63 H TYR 63 -3.933 6.047 10.297 140 HA TYR 63 HA TYR 63 -1.557 7.730 9.864 141 HB2 TYR 63 1HB TYR 63 -1.953 4.766 9.404 142 HB3 TYR 63 2HB TYR 63 -0.491 5.653 8.994 143 HD1 TYR 63 HD2 TYR 63 0.706 6.878 10.941 144 HD2 TYR 63 HD1 TYR 63 -2.183 3.806 11.518 145 HE1 TYR 63 HE2 TYR 63 1.577 6.492 13.207 146 HE2 TYR 63 HE1 TYR 63 -1.317 3.412 13.786 147 HH TYR 63 HH TYR 63 -0.019 4.885 15.549 148 HA PRO 64 HA PRO 64 -2.881 8.547 5.722 149 HB2 PRO 64 1HB PRO 64 -0.493 8.914 4.481 150 HB3 PRO 64 2HB PRO 64 -1.181 10.089 5.607 151 HG2 PRO 64 1HG PRO 64 0.926 8.018 6.080 152 HG3 PRO 64 2HG PRO 64 0.866 9.701 6.635 153 HD2 PRO 64 1HD PRO 64 0.223 7.600 8.230 154 HD3 PRO 64 2HD PRO 64 -0.523 9.203 8.399 155 H TRP 65 H TRP 65 -2.024 7.913 3.328 156 HA TRP 65 HA TRP 65 -2.573 5.156 3.038 157 HB2 TRP 65 1HB TRP 65 -1.380 7.077 1.026 158 HB3 TRP 65 2HB TRP 65 -2.040 5.489 0.651 159 HD1 TRP 65 HD1 TRP 65 -3.178 8.976 1.840 160 HE1 TRP 65 HE1 TRP 65 -5.663 9.262 1.246 161 HE3 TRP 65 HE3 TRP 65 -4.146 4.266 0.093 162 HZ2 TRP 65 HZ2 TRP 65 -7.759 7.702 0.179 163 HZ3 TRP 65 HZ3 TRP 65 -6.419 3.747 -0.697 164 HH2 TRP 65 HH2 TRP 65 -8.187 5.432 -0.654 165 H TRP 66 H TRP 66 -1.258 3.486 3.384 166 HA TRP 66 HA TRP 66 1.645 3.929 3.261 167 HB2 TRP 66 1HB TRP 66 0.277 2.939 5.328 168 HB3 TRP 66 2HB TRP 66 0.523 1.438 4.441 169 HD1 TRP 66 HD1 TRP 66 2.772 0.254 4.820 170 HE1 TRP 66 HE1 TRP 66 5.016 0.886 5.910 171 HE3 TRP 66 HE3 TRP 66 1.866 5.202 5.740 172 HZ2 TRP 66 HZ2 TRP 66 6.235 3.172 7.019 173 HZ3 TRP 66 HZ3 TRP 66 3.630 6.540 6.814 174 HH2 TRP 66 HH2 TRP 66 5.769 5.542 7.432 175 HA PRO 67 HA PRO 67 1.871 1.416 -0.379 176 HB2 PRO 67 1HB PRO 67 4.515 0.833 -0.335 177 HB3 PRO 67 2HB PRO 67 3.897 2.436 -0.755 178 HG2 PRO 67 1HG PRO 67 5.014 1.457 1.844 179 HG3 PRO 67 2HG PRO 67 5.306 2.991 1.006 180 HD2 PRO 67 1HD PRO 67 3.588 2.759 3.089 181 HD3 PRO 67 2HD PRO 67 3.357 3.932 1.779 182 H ALA 68 H ALA 68 0.773 -0.457 -0.087 183 HA ALA 68 HA ALA 68 2.158 -2.667 1.306 184 HB1 ALA 68 3HB ALA 68 -0.076 -1.759 2.240 185 HB2 ALA 68 1HB ALA 68 0.130 -3.503 2.069 186 HB3 ALA 68 2HB ALA 68 -0.807 -2.603 0.875 187 H LEU 69 H LEU 69 1.230 -4.863 0.449 188 HA LEU 69 HA LEU 69 0.994 -4.739 -2.487 189 HB2 LEU 69 1HB LEU 69 3.094 -5.961 -0.882 190 HB3 LEU 69 2HB LEU 69 2.339 -7.114 -1.964 191 HG LEU 69 HG LEU 69 3.079 -4.532 -3.187 192 HD11 LEU 69 1HD1 LEU 69 5.208 -6.521 -2.422 193 HD12 LEU 69 2HD1 LEU 69 4.978 -4.948 -1.662 194 HD13 LEU 69 3HD1 LEU 69 5.422 -5.047 -3.364 195 HD21 LEU 69 3HD2 LEU 69 2.208 -6.877 -4.151 196 HD22 LEU 69 1HD2 LEU 69 3.951 -7.136 -4.267 197 HD23 LEU 69 2HD2 LEU 69 3.206 -5.758 -5.078 198 H LEU 70 H LEU 70 -0.746 -5.761 -3.215 199 HA LEU 70 HA LEU 70 -2.520 -7.157 -1.527 200 HB2 LEU 70 1HB LEU 70 -2.782 -5.980 -3.922 201 HB3 LEU 70 2HB LEU 70 -2.668 -7.648 -4.446 202 HG LEU 70 HG LEU 70 -4.609 -6.963 -2.281 203 HD11 LEU 70 1HD1 LEU 70 -4.675 -5.880 -4.980 204 HD12 LEU 70 2HD1 LEU 70 -5.645 -5.466 -3.566 205 HD13 LEU 70 3HD1 LEU 70 -6.106 -6.830 -4.584 206 HD21 LEU 70 3HD2 LEU 70 -5.899 -8.739 -3.551 207 HD22 LEU 70 1HD2 LEU 70 -4.425 -9.267 -2.740 208 HD23 LEU 70 2HD2 LEU 70 -4.425 -9.001 -4.483 209 H LEU 71 H LEU 71 -2.651 -9.210 -0.914 210 HA LEU 71 HA LEU 71 -0.836 -11.162 -2.162 211 HB2 LEU 71 1HB LEU 71 -2.035 -10.911 0.571 212 HB3 LEU 71 2HB LEU 71 -1.523 -12.481 -0.011 213 HG LEU 71 HG LEU 71 0.698 -10.974 -0.521 214 HD11 LEU 71 1HD1 LEU 71 -0.870 -9.595 1.519 215 HD12 LEU 71 2HD1 LEU 71 0.513 -9.039 0.577 216 HD13 LEU 71 3HD1 LEU 71 0.767 -9.996 2.035 217 HD21 LEU 71 3HD2 LEU 71 1.701 -12.375 0.957 218 HD22 LEU 71 1HD2 LEU 71 0.148 -13.204 0.834 219 HD23 LEU 71 2HD2 LEU 71 0.470 -12.132 2.196 220 H ARG 72 H ARG 72 -4.098 -11.080 -0.673 221 HA ARG 72 HA ARG 72 -5.182 -12.603 -2.883 222 HB2 ARG 72 1HB ARG 72 -4.505 -13.841 -0.320 223 HB3 ARG 72 2HB ARG 72 -6.180 -14.089 -0.793 224 HG2 ARG 72 1HG ARG 72 -4.453 -14.555 -3.035 225 HG3 ARG 72 2HG ARG 72 -3.924 -15.509 -1.647 226 HD2 ARG 72 1HD ARG 72 -6.682 -15.465 -2.868 227 HD3 ARG 72 2HD ARG 72 -5.508 -16.775 -2.963 228 HE ARG 72 HE ARG 72 -6.140 -16.130 -0.261 229 HH11 ARG 72 1HH1 ARG 72 -7.320 -17.855 -3.069 230 HH12 ARG 72 2HH1 ARG 72 -8.287 -18.950 -2.142 231 HH21 ARG 72 1HH2 ARG 72 -7.429 -17.576 0.956 232 HH22 ARG 72 2HH2 ARG 72 -8.352 -18.792 0.138 233 H ARG 73 H ARG 73 -7.455 -12.650 -2.958 234 HA ARG 73 HA ARG 73 -8.738 -10.619 -1.259 235 HB2 ARG 73 1HB ARG 73 -8.653 -10.319 -3.791 236 HB3 ARG 73 2HB ARG 73 -9.769 -11.671 -3.892 237 HG2 ARG 73 1HG ARG 73 -10.658 -9.622 -2.026 238 HG3 ARG 73 2HG ARG 73 -10.448 -9.018 -3.671 239 HD2 ARG 73 1HD ARG 73 -12.144 -11.347 -2.792 240 HD3 ARG 73 2HD ARG 73 -12.708 -9.794 -3.398 241 HE ARG 73 HE ARG 73 -11.772 -10.404 -5.565 242 HH11 ARG 73 1HH1 ARG 73 -12.219 -13.028 -3.269 243 HH12 ARG 73 2HH1 ARG 73 -12.304 -14.241 -4.499 244 HH21 ARG 73 1HH2 ARG 73 -11.874 -12.029 -7.166 245 HH22 ARG 73 2HH2 ARG 73 -12.105 -13.680 -6.699 246 H LYS 74 H LYS 74 -9.424 -11.821 0.470 247 HA LYS 74 HA LYS 74 -10.916 -14.283 -0.003 248 HB2 LYS 74 1HB LYS 74 -10.993 -14.313 2.559 249 HB3 LYS 74 2HB LYS 74 -9.430 -14.546 1.791 250 HG2 LYS 74 1HG LYS 74 -8.609 -12.559 2.528 251 HG3 LYS 74 2HG LYS 74 -10.191 -11.779 2.539 252 HD2 LYS 74 1HD LYS 74 -10.109 -13.953 4.435 253 HD3 LYS 74 2HD LYS 74 -8.798 -12.811 4.734 254 HE2 LYS 74 1HE LYS 74 -10.240 -11.060 5.166 255 HE3 LYS 74 2HE LYS 74 -11.559 -11.783 4.246 256 HZ1 LYS 74 3HZ LYS 74 -10.738 -12.263 7.010 257 HZ2 LYS 74 1HZ LYS 74 -11.353 -13.583 6.147 258 HZ3 LYS 74 2HZ LYS 74 -12.289 -12.189 6.341 259 H GLU 75 H GLU 75 -13.062 -14.469 0.122 260 HA GLU 75 HA GLU 75 -14.601 -12.073 0.859 261 HB2 GLU 75 1HB GLU 75 -14.679 -13.500 -1.470 262 HB3 GLU 75 2HB GLU 75 -15.989 -14.243 -0.566 263 HG2 GLU 75 1HG GLU 75 -16.785 -11.836 -0.149 264 HG3 GLU 75 2HG GLU 75 -15.700 -11.411 -1.473 265 H THR 76 H THR 76 -15.155 -12.256 2.964 266 HA THR 76 HA THR 76 -16.188 -14.838 3.907 267 HB THR 76 HB THR 76 -14.324 -13.864 5.203 268 HG1 THR 76 HG1 THR 76 -16.724 -13.802 6.710 269 HG21 THR 76 3HG2 THR 76 -15.037 -11.951 6.787 270 HG22 THR 76 1HG2 THR 76 -16.185 -11.555 5.507 271 HG23 THR 76 2HG2 THR 76 -14.456 -11.570 5.166 272 H LYS 77 H LYS 77 -18.215 -15.036 4.771 273 HA LYS 77 HA LYS 77 -19.912 -12.718 5.108 274 HB2 LYS 77 1HB LYS 77 -21.617 -13.481 3.506 275 HB3 LYS 77 2HB LYS 77 -20.099 -13.105 2.707 276 HG2 LYS 77 1HG LYS 77 -20.629 -15.923 3.513 277 HG3 LYS 77 2HG LYS 77 -21.454 -15.265 2.100 278 HD2 LYS 77 1HD LYS 77 -18.613 -14.632 2.129 279 HD3 LYS 77 2HD LYS 77 -18.919 -16.369 2.151 280 HE2 LYS 77 1HE LYS 77 -20.537 -15.930 0.224 281 HE3 LYS 77 2HE LYS 77 -19.787 -14.339 0.112 282 HZ1 LYS 77 3HZ LYS 77 -18.386 -15.383 -1.266 283 HZ2 LYS 77 1HZ LYS 77 -18.755 -16.926 -0.672 284 HZ3 LYS 77 2HZ LYS 77 -17.641 -15.947 0.145 285 H ASP 78 H ASP 78 -22.379 -13.940 5.210 286 HA ASP 78 HA ASP 78 -23.751 -15.145 6.561 287 HB2 ASP 78 1HB ASP 78 -22.064 -17.005 5.505 288 HB3 ASP 78 2HB ASP 78 -21.771 -17.238 7.224 289 H SER 79 H SER 79 -22.331 -13.069 7.744 290 HA SER 79 HA SER 79 -21.059 -13.823 10.164 291 HB2 SER 79 1HB SER 79 -21.337 -11.430 10.780 292 HB3 SER 79 2HB SER 79 -20.640 -11.649 9.175 293 HG SER 79 HG SER 79 -22.402 -10.062 9.393 294 H LEU 80 H LEU 80 -24.350 -13.759 9.246 295 HA LEU 80 HA LEU 80 -26.257 -14.266 10.347 296 HB2 LEU 80 1HB LEU 80 -24.380 -15.634 11.760 297 HB3 LEU 80 2HB LEU 80 -25.036 -14.598 13.012 298 HG LEU 80 HG LEU 80 -27.018 -16.023 11.341 299 HD11 LEU 80 1HD1 LEU 80 -26.686 -18.144 12.162 300 HD12 LEU 80 2HD1 LEU 80 -25.716 -17.584 13.524 301 HD13 LEU 80 3HD1 LEU 80 -25.028 -17.607 11.900 302 HD21 LEU 80 3HD2 LEU 80 -28.160 -16.226 13.476 303 HD22 LEU 80 1HD2 LEU 80 -27.657 -14.558 13.199 304 HD23 LEU 80 2HD2 LEU 80 -26.748 -15.579 14.312 305 H ASN 81 H ASN 81 -25.701 -11.648 9.984 306 HA ASN 81 HA ASN 81 -26.431 -10.337 12.514 307 HB2 ASN 81 1HB ASN 81 -25.181 -9.216 9.995 308 HB3 ASN 81 2HB ASN 81 -25.762 -8.217 11.322 309 HD21 ASN 81 2HD2 ASN 81 -23.543 -7.453 11.356 310 HD22 ASN 81 1HD2 ASN 81 -22.356 -8.358 12.244 311 H THR 82 H THR 82 -27.179 -10.327 9.021 312 HA THR 82 HA THR 82 -29.971 -9.717 9.689 313 HB THR 82 HB THR 82 -30.109 -8.055 7.898 314 HG1 THR 82 HG1 THR 82 -28.583 -8.455 6.451 315 HG21 THR 82 3HG2 THR 82 -27.737 -7.078 9.373 316 HG22 THR 82 1HG2 THR 82 -29.163 -7.520 10.312 317 HG23 THR 82 2HG2 THR 82 -29.284 -6.291 9.052 318 H ASN 83 H ASN 83 -28.426 -12.120 8.703 319 HA ASN 83 HA ASN 83 -28.665 -13.824 7.220 320 HB2 ASN 83 1HB ASN 83 -31.095 -13.330 8.043 321 HB3 ASN 83 2HB ASN 83 -31.332 -12.708 6.413 322 HD21 ASN 83 2HD2 ASN 83 -30.862 -15.516 8.372 323 HD22 ASN 83 1HD2 ASN 83 -31.138 -16.689 7.123 324 H SER 84 H SER 84 -27.609 -11.156 6.225 325 HA SER 84 HA SER 84 -27.142 -11.848 3.566 326 HB2 SER 84 1HB SER 84 -28.464 -10.005 2.429 327 HB3 SER 84 2HB SER 84 -29.421 -11.358 3.025 328 HG SER 84 HG SER 84 -30.093 -10.119 4.740 329 H SER 85 H SER 85 -25.106 -11.239 4.635 330 HA SER 85 HA SER 85 -24.433 -8.485 4.015 331 HB2 SER 85 1HB SER 85 -23.633 -9.472 6.743 332 HB3 SER 85 2HB SER 85 -23.667 -7.819 6.127 333 HG SER 85 HG SER 85 -25.483 -8.862 7.577 334 H PHE 86 H PHE 86 -22.734 -8.694 2.719 335 HA PHE 86 HA PHE 86 -20.820 -10.865 3.179 336 HB2 PHE 86 1HB PHE 86 -21.140 -9.008 0.809 337 HB3 PHE 86 2HB PHE 86 -19.955 -10.303 0.925 338 HD1 PHE 86 HD1 PHE 86 -20.658 -12.643 0.830 339 HD2 PHE 86 HD2 PHE 86 -23.444 -9.463 0.345 340 HE1 PHE 86 HE1 PHE 86 -22.288 -14.222 -0.116 341 HE2 PHE 86 HE2 PHE 86 -25.080 -11.037 -0.600 342 HZ PHE 86 HZ PHE 86 -24.505 -13.420 -0.831 343 H ASN 87 H ASN 87 -18.592 -10.487 3.386 344 HA ASN 87 HA ASN 87 -17.745 -7.705 3.739 345 HB2 ASN 87 1HB ASN 87 -18.285 -9.366 5.895 346 HB3 ASN 87 2HB ASN 87 -16.539 -9.493 5.711 347 HD21 ASN 87 2HD2 ASN 87 -19.082 -7.006 5.666 348 HD22 ASN 87 1HD2 ASN 87 -18.187 -5.843 6.593 349 H VAL 88 H VAL 88 -16.721 -8.034 1.703 350 HA VAL 88 HA VAL 88 -14.490 -9.928 1.648 351 HB VAL 88 HB VAL 88 -15.863 -9.960 -0.325 352 HG11 VAL 88 1HG1 VAL 88 -16.889 -7.819 -0.311 353 HG12 VAL 88 2HG1 VAL 88 -15.974 -7.942 -1.814 354 HG13 VAL 88 3HG1 VAL 88 -15.332 -7.002 -0.466 355 HG21 VAL 88 3HG2 VAL 88 -13.475 -10.323 -0.646 356 HG22 VAL 88 1HG2 VAL 88 -13.237 -8.595 -0.907 357 HG23 VAL 88 2HG2 VAL 88 -14.188 -9.536 -2.054 358 H LEU 89 H LEU 89 -12.381 -9.329 1.611 359 HA LEU 89 HA LEU 89 -11.755 -6.461 1.554 360 HB2 LEU 89 1HB LEU 89 -10.205 -8.136 3.449 361 HB3 LEU 89 2HB LEU 89 -10.613 -6.434 3.529 362 HG LEU 89 HG LEU 89 -12.808 -8.416 3.893 363 HD11 LEU 89 1HD1 LEU 89 -11.388 -7.655 6.350 364 HD12 LEU 89 2HD1 LEU 89 -10.564 -8.834 5.332 365 HD13 LEU 89 3HD1 LEU 89 -12.194 -9.162 5.921 366 HD21 LEU 89 3HD2 LEU 89 -13.473 -6.154 3.872 367 HD22 LEU 89 1HD2 LEU 89 -12.146 -5.673 4.928 368 HD23 LEU 89 2HD2 LEU 89 -13.475 -6.642 5.566 369 H TYR 90 H TYR 90 -9.238 -6.225 1.651 370 HA TYR 90 HA TYR 90 -8.080 -8.088 -0.320 371 HB2 TYR 90 1HB TYR 90 -8.139 -5.135 -0.149 372 HB3 TYR 90 2HB TYR 90 -6.589 -5.835 -0.601 373 HD1 TYR 90 HD2 TYR 90 -7.576 -8.203 -2.145 374 HD2 TYR 90 HD1 TYR 90 -8.817 -4.137 -2.166 375 HE1 TYR 90 HE2 TYR 90 -8.358 -8.465 -4.448 376 HE2 TYR 90 HE1 TYR 90 -9.604 -4.381 -4.477 377 HH TYR 90 HH TYR 90 -10.385 -6.295 -5.969 378 H LYS 91 H LYS 91 -6.786 -9.417 0.845 379 HA LYS 91 HA LYS 91 -5.383 -8.582 3.192 380 HB2 LYS 91 1HB LYS 91 -4.935 -11.053 1.501 381 HB3 LYS 91 2HB LYS 91 -4.382 -10.808 3.150 382 HG2 LYS 91 1HG LYS 91 -7.024 -10.429 3.493 383 HG3 LYS 91 2HG LYS 91 -7.044 -11.548 2.128 384 HD2 LYS 91 1HD LYS 91 -5.177 -12.299 4.255 385 HD3 LYS 91 2HD LYS 91 -6.864 -12.267 4.766 386 HE2 LYS 91 1HE LYS 91 -7.431 -14.031 3.460 387 HE3 LYS 91 2HE LYS 91 -6.316 -13.573 2.174 388 HZ1 LYS 91 3HZ LYS 91 -5.793 -15.148 4.608 389 HZ2 LYS 91 1HZ LYS 91 -4.525 -14.308 3.863 390 HZ3 LYS 91 2HZ LYS 91 -5.378 -15.489 3.005 391 H VAL 92 H VAL 92 -3.851 -7.035 2.930 392 HA VAL 92 HA VAL 92 -1.835 -7.464 0.821 393 HB VAL 92 HB VAL 92 -1.425 -5.072 0.790 394 HG11 VAL 92 1HG1 VAL 92 -4.050 -4.493 0.298 395 HG12 VAL 92 2HG1 VAL 92 -4.022 -6.249 0.149 396 HG13 VAL 92 3HG1 VAL 92 -2.943 -5.265 -0.837 397 HG21 VAL 92 3HG2 VAL 92 -3.423 -5.031 3.024 398 HG22 VAL 92 1HG2 VAL 92 -3.153 -3.612 2.016 399 HG23 VAL 92 2HG2 VAL 92 -1.823 -4.295 2.949 400 H LEU 93 H LEU 93 0.340 -6.811 1.255 401 HA LEU 93 HA LEU 93 1.097 -7.192 4.071 402 HB2 LEU 93 1HB LEU 93 2.088 -8.240 1.596 403 HB3 LEU 93 2HB LEU 93 3.360 -7.300 2.354 404 HG LEU 93 HG LEU 93 1.877 -9.362 3.947 405 HD11 LEU 93 1HD1 LEU 93 2.857 -10.203 1.658 406 HD12 LEU 93 2HD1 LEU 93 3.084 -11.130 3.139 407 HD13 LEU 93 3HD1 LEU 93 4.387 -10.109 2.531 408 HD21 LEU 93 3HD2 LEU 93 3.278 -8.064 5.293 409 HD22 LEU 93 1HD2 LEU 93 4.555 -8.012 4.077 410 HD23 LEU 93 2HD2 LEU 93 4.231 -9.508 4.953 411 H PHE 94 H PHE 94 2.159 -5.634 5.161 412 HA PHE 94 HA PHE 94 2.582 -3.083 3.788 413 HB2 PHE 94 1HB PHE 94 2.127 -3.942 6.600 414 HB3 PHE 94 2HB PHE 94 3.103 -2.497 6.359 415 HD1 PHE 94 HD1 PHE 94 0.094 -3.780 4.564 416 HD2 PHE 94 HD2 PHE 94 1.814 -0.679 6.917 417 HE1 PHE 94 HE1 PHE 94 -1.957 -2.448 4.301 418 HE2 PHE 94 HE2 PHE 94 -0.233 0.658 6.657 419 HZ PHE 94 HZ PHE 94 -2.122 -0.225 5.347 420 H PHE 95 H PHE 95 4.543 -1.812 4.295 421 HA PHE 95 HA PHE 95 6.899 -3.344 5.094 422 HB2 PHE 95 1HB PHE 95 6.923 -1.809 2.494 423 HB3 PHE 95 2HB PHE 95 8.145 -2.913 3.107 424 HD1 PHE 95 HD1 PHE 95 4.882 -2.640 1.474 425 HD2 PHE 95 HD2 PHE 95 7.893 -5.299 2.885 426 HE1 PHE 95 HE1 PHE 95 3.851 -4.475 0.204 427 HE2 PHE 95 HE2 PHE 95 6.865 -7.138 1.618 428 HZ PHE 95 HZ PHE 95 4.842 -6.729 0.276 429 HA PRO 96 HA PRO 96 9.186 -2.784 4.608 430 HB2 PRO 96 1HB PRO 96 11.048 -1.877 6.587 431 HB3 PRO 96 2HB PRO 96 11.197 -1.787 4.830 432 HG2 PRO 96 1HG PRO 96 10.920 0.391 6.495 433 HG3 PRO 96 2HG PRO 96 10.505 0.380 4.774 434 HD2 PRO 96 1HD PRO 96 8.720 0.126 7.159 435 HD3 PRO 96 2HD PRO 96 8.444 0.983 5.626 436 H ASP 97 H ASP 97 8.184 -1.734 7.805 437 HA ASP 97 HA ASP 97 9.124 -3.588 9.528 438 HB2 ASP 97 1HB ASP 97 7.186 -1.682 9.666 439 HB3 ASP 97 2HB ASP 97 6.226 -3.148 9.846 440 H PHE 98 H PHE 98 6.695 -4.188 7.069 441 HA PHE 98 HA PHE 98 5.913 -6.133 6.197 442 HB2 PHE 98 1HB PHE 98 8.241 -7.002 7.566 443 HB3 PHE 98 2HB PHE 98 6.960 -8.144 7.950 444 HD1 PHE 98 HD1 PHE 98 8.577 -6.427 5.076 445 HD2 PHE 98 HD2 PHE 98 6.435 -9.839 6.454 446 HE1 PHE 98 HE1 PHE 98 8.901 -7.511 2.889 447 HE2 PHE 98 HE2 PHE 98 6.757 -10.925 4.271 448 HZ PHE 98 HZ PHE 98 7.992 -9.764 2.486 449 H ASN 99 H ASN 99 3.933 -5.283 7.060 450 HA ASN 99 HA ASN 99 2.856 -6.950 9.240 451 HB2 ASN 99 1HB ASN 99 2.562 -4.007 8.746 452 HB3 ASN 99 2HB ASN 99 1.271 -4.888 9.549 453 HD21 ASN 99 2HD2 ASN 99 3.034 -2.772 10.555 454 HD22 ASN 99 1HD2 ASN 99 3.817 -3.437 11.954 455 H PHE 100 H PHE 100 0.246 -6.520 9.142 456 HA PHE 100 HA PHE 100 -0.550 -7.038 6.366 457 HB2 PHE 100 1HB PHE 100 -0.607 -8.848 8.457 458 HB3 PHE 100 2HB PHE 100 -2.269 -8.266 8.365 459 HD1 PHE 100 HD1 PHE 100 0.442 -9.196 6.009 460 HD2 PHE 100 HD2 PHE 100 -3.665 -9.492 7.055 461 HE1 PHE 100 HE1 PHE 100 0.053 -10.632 4.056 462 HE2 PHE 100 HE2 PHE 100 -4.071 -10.924 5.109 463 HZ PHE 100 HZ PHE 100 -2.210 -11.507 3.595 464 H ALA 101 H ALA 101 -2.885 -6.750 5.953 465 HA ALA 101 HA ALA 101 -4.508 -5.202 7.668 466 HB1 ALA 101 3HB ALA 101 -3.478 -3.222 7.318 467 HB2 ALA 101 1HB ALA 101 -4.444 -3.227 5.842 468 HB3 ALA 101 2HB ALA 101 -2.758 -3.745 5.796 469 H TRP 102 H TRP 102 -6.577 -5.376 7.072 470 HA TRP 102 HA TRP 102 -7.143 -6.415 4.373 471 HB2 TRP 102 1HB TRP 102 -9.353 -7.153 5.520 472 HB3 TRP 102 2HB TRP 102 -7.891 -8.083 5.818 473 HD1 TRP 102 HD1 TRP 102 -6.849 -7.974 8.288 474 HE1 TRP 102 HE1 TRP 102 -7.856 -7.261 10.547 475 HE3 TRP 102 HE3 TRP 102 -10.980 -5.485 6.589 476 HZ2 TRP 102 HZ2 TRP 102 -10.109 -5.836 11.485 477 HZ3 TRP 102 HZ3 TRP 102 -12.509 -4.478 8.231 478 HH2 TRP 102 HH2 TRP 102 -12.080 -4.650 10.630 479 H VAL 103 H VAL 103 -8.050 -5.006 3.036 480 HA VAL 103 HA VAL 103 -9.772 -2.893 4.167 481 HB VAL 103 HB VAL 103 -8.135 -2.645 1.650 482 HG11 VAL 103 1HG1 VAL 103 -9.886 -1.106 1.535 483 HG12 VAL 103 2HG1 VAL 103 -8.538 -0.171 2.181 484 HG13 VAL 103 3HG1 VAL 103 -9.806 -0.747 3.261 485 HG21 VAL 103 3HG2 VAL 103 -6.321 -2.114 2.818 486 HG22 VAL 103 1HG2 VAL 103 -7.153 -2.684 4.265 487 HG23 VAL 103 2HG2 VAL 103 -7.231 -0.982 3.818 488 H LYS 104 H LYS 104 -11.634 -2.303 3.018 489 HA LYS 104 HA LYS 104 -12.713 -4.427 1.358 490 HB2 LYS 104 1HB LYS 104 -13.865 -1.978 2.664 491 HB3 LYS 104 2HB LYS 104 -14.779 -2.854 1.446 492 HG2 LYS 104 1HG LYS 104 -14.705 -4.864 2.793 493 HG3 LYS 104 2HG LYS 104 -13.711 -4.040 3.999 494 HD2 LYS 104 1HD LYS 104 -15.767 -2.324 3.870 495 HD3 LYS 104 2HD LYS 104 -16.609 -3.818 3.446 496 HE2 LYS 104 1HE LYS 104 -16.432 -4.651 5.526 497 HE3 LYS 104 2HE LYS 104 -14.778 -4.073 5.720 498 HZ1 LYS 104 3HZ LYS 104 -16.056 -2.905 7.279 499 HZ2 LYS 104 1HZ LYS 104 -17.293 -2.578 6.171 500 HZ3 LYS 104 2HZ LYS 104 -15.798 -1.802 6.023 501 H ARG 105 H ARG 105 -10.590 -2.690 0.219 502 HA ARG 105 HA ARG 105 -10.076 -1.907 -1.850 503 HB2 ARG 105 1HB ARG 105 -13.006 -2.082 -2.542 504 HB3 ARG 105 2HB ARG 105 -11.653 -1.959 -3.658 505 HG2 ARG 105 1HG ARG 105 -11.454 -4.160 -3.723 506 HG3 ARG 105 2HG ARG 105 -11.276 -4.233 -1.970 507 HD2 ARG 105 1HD ARG 105 -13.147 -5.584 -2.586 508 HD3 ARG 105 2HD ARG 105 -13.756 -4.141 -1.780 509 HE ARG 105 HE ARG 105 -13.854 -3.468 -4.397 510 HH11 ARG 105 1HH1 ARG 105 -15.064 -6.213 -2.598 511 HH12 ARG 105 2HH1 ARG 105 -16.413 -6.469 -3.650 512 HH21 ARG 105 1HH2 ARG 105 -15.643 -3.807 -5.783 513 HH22 ARG 105 2HH2 ARG 105 -16.741 -5.105 -5.457 514 H ASN 106 H ASN 106 -12.602 -0.421 0.033 515 HA ASN 106 HA ASN 106 -12.785 2.005 -1.415 516 HB2 ASN 106 1HB ASN 106 -13.470 1.279 1.436 517 HB3 ASN 106 2HB ASN 106 -13.737 2.886 0.772 518 HD21 ASN 106 2HD2 ASN 106 -15.978 2.281 1.438 519 HD22 ASN 106 1HD2 ASN 106 -16.956 1.455 0.266 520 H SER 107 H SER 107 -10.815 0.973 1.344 521 HA SER 107 HA SER 107 -9.472 3.562 1.398 522 HB2 SER 107 1HB SER 107 -9.868 1.376 3.287 523 HB3 SER 107 2HB SER 107 -8.195 1.932 3.246 524 HG SER 107 HG SER 107 -8.990 3.392 4.561 525 H VAL 108 H VAL 108 -9.163 1.466 -0.815 526 HA VAL 108 HA VAL 108 -6.225 1.357 -0.722 527 HB VAL 108 HB VAL 108 -8.021 -0.718 -1.974 528 HG11 VAL 108 1HG1 VAL 108 -5.107 -0.214 -2.074 529 HG12 VAL 108 2HG1 VAL 108 -6.174 -0.951 -3.268 530 HG13 VAL 108 3HG1 VAL 108 -5.620 -1.889 -1.882 531 HG21 VAL 108 3HG2 VAL 108 -6.599 -2.054 -0.110 532 HG22 VAL 108 1HG2 VAL 108 -8.212 -1.396 0.165 533 HG23 VAL 108 2HG2 VAL 108 -6.791 -0.494 0.691 534 H LYS 109 H LYS 109 -5.114 1.806 -2.618 535 HA LYS 109 HA LYS 109 -6.663 2.448 -5.016 536 HB2 LYS 109 1HB LYS 109 -6.345 4.535 -3.616 537 HB3 LYS 109 2HB LYS 109 -4.619 4.375 -3.912 538 HG2 LYS 109 1HG LYS 109 -4.807 5.362 -5.884 539 HG3 LYS 109 2HG LYS 109 -6.050 4.221 -6.393 540 HD2 LYS 109 1HD LYS 109 -6.545 6.675 -4.709 541 HD3 LYS 109 2HD LYS 109 -6.810 6.577 -6.450 542 HE2 LYS 109 1HE LYS 109 -8.095 4.452 -4.873 543 HE3 LYS 109 2HE LYS 109 -8.704 6.077 -4.563 544 HZ1 LYS 109 3HZ LYS 109 -9.590 6.238 -6.624 545 HZ2 LYS 109 1HZ LYS 109 -9.638 4.551 -6.497 546 HZ3 LYS 109 2HZ LYS 109 -8.390 5.299 -7.360 547 HA PRO 110 HA PRO 110 -3.393 0.099 -6.925 548 HB2 PRO 110 1HB PRO 110 -3.664 1.307 -9.436 549 HB3 PRO 110 2HB PRO 110 -4.516 -0.136 -8.879 550 HG2 PRO 110 1HG PRO 110 -5.439 2.695 -8.970 551 HG3 PRO 110 2HG PRO 110 -6.355 1.204 -9.250 552 HD2 PRO 110 1HD PRO 110 -6.591 2.586 -6.968 553 HD3 PRO 110 2HD PRO 110 -6.641 0.811 -6.982 554 H LEU 111 H LEU 111 -1.296 0.509 -6.679 555 HA LEU 111 HA LEU 111 -0.323 3.254 -7.028 556 HB2 LEU 111 1HB LEU 111 0.001 2.045 -4.850 557 HB3 LEU 111 2HB LEU 111 1.060 0.931 -5.690 558 HG LEU 111 HG LEU 111 2.630 2.721 -6.171 559 HD11 LEU 111 1HD1 LEU 111 1.283 4.626 -6.473 560 HD12 LEU 111 2HD1 LEU 111 2.234 4.953 -5.026 561 HD13 LEU 111 3HD1 LEU 111 0.546 4.461 -4.880 562 HD21 LEU 111 3HD2 LEU 111 2.957 3.440 -3.636 563 HD22 LEU 111 1HD2 LEU 111 3.293 1.802 -4.197 564 HD23 LEU 111 2HD2 LEU 111 1.769 2.160 -3.386 565 H LEU 112 H LEU 112 1.310 3.781 -8.426 566 HA LEU 112 HA LEU 112 2.174 1.661 -10.280 567 HB2 LEU 112 1HB LEU 112 1.978 4.646 -10.661 568 HB3 LEU 112 2HB LEU 112 2.667 3.548 -11.839 569 HG LEU 112 HG LEU 112 -0.204 3.605 -10.912 570 HD11 LEU 112 1HD1 LEU 112 0.041 5.370 -12.389 571 HD12 LEU 112 2HD1 LEU 112 -0.451 4.049 -13.448 572 HD13 LEU 112 3HD1 LEU 112 1.246 4.523 -13.358 573 HD21 LEU 112 3HD2 LEU 112 -0.028 1.386 -11.378 574 HD22 LEU 112 1HD2 LEU 112 1.368 1.604 -12.436 575 HD23 LEU 112 2HD2 LEU 112 -0.251 1.979 -13.025 576 H ASP 113 H ASP 113 4.360 2.239 -11.360 577 HA ASP 113 HA ASP 113 6.341 2.266 -9.310 578 HB2 ASP 113 1HB ASP 113 6.288 1.351 -11.892 579 HB3 ASP 113 2HB ASP 113 7.285 2.796 -12.047 580 H SER 114 H SER 114 5.519 4.578 -11.892 581 HA SER 114 HA SER 114 7.406 6.532 -11.219 582 HB2 SER 114 1HB SER 114 4.674 6.927 -12.468 583 HB3 SER 114 2HB SER 114 5.993 8.097 -12.492 584 HG SER 114 HG SER 114 6.144 7.016 -14.391 585 H GLU 115 H GLU 115 4.096 6.012 -10.060 586 HA GLU 115 HA GLU 115 3.858 8.360 -8.534 587 HB2 GLU 115 1HB GLU 115 2.580 5.651 -8.067 588 HB3 GLU 115 2HB GLU 115 2.069 7.158 -7.317 589 HG2 GLU 115 1HG GLU 115 2.183 7.246 -10.243 590 HG3 GLU 115 2HG GLU 115 1.015 6.098 -9.588 591 H ILE 116 H ILE 116 5.024 5.115 -7.638 592 HA ILE 116 HA ILE 116 5.490 5.629 -4.917 593 HB ILE 116 HB ILE 116 6.918 3.698 -6.760 594 HG12 ILE 116 1HG1 ILE 116 4.944 2.931 -4.644 595 HG13 ILE 116 2HG1 ILE 116 4.358 3.537 -6.189 596 HG21 ILE 116 1HG2 ILE 116 8.272 4.255 -4.778 597 HG22 ILE 116 2HG2 ILE 116 7.729 2.577 -4.773 598 HG23 ILE 116 3HG2 ILE 116 6.931 3.765 -3.744 599 HD11 ILE 116 3HD1 ILE 116 6.007 1.082 -5.674 600 HD12 ILE 116 1HD1 ILE 116 5.746 1.749 -7.285 601 HD13 ILE 116 2HD1 ILE 116 4.374 1.183 -6.331 602 H ALA 117 H ALA 117 7.769 5.658 -7.667 603 HA ALA 117 HA ALA 117 10.021 6.610 -6.337 604 HB1 ALA 117 3HB ALA 117 9.638 5.852 -8.835 605 HB2 ALA 117 1HB ALA 117 10.959 6.942 -8.409 606 HB3 ALA 117 2HB ALA 117 9.469 7.586 -9.099 607 H LYS 118 H LYS 118 7.248 8.330 -7.642 608 HA LYS 118 HA LYS 118 8.285 10.948 -7.295 609 HB2 LYS 118 1HB LYS 118 6.075 9.862 -8.525 610 HB3 LYS 118 2HB LYS 118 5.378 10.715 -7.154 611 HG2 LYS 118 1HG LYS 118 5.531 12.583 -8.299 612 HG3 LYS 118 2HG LYS 118 7.291 12.429 -8.230 613 HD2 LYS 118 1HD LYS 118 7.371 11.304 -10.313 614 HD3 LYS 118 2HD LYS 118 5.627 11.023 -10.309 615 HE2 LYS 118 1HE LYS 118 5.594 12.803 -11.694 616 HE3 LYS 118 2HE LYS 118 5.686 13.723 -10.194 617 HZ1 LYS 118 3HZ LYS 118 7.359 14.105 -12.188 618 HZ2 LYS 118 1HZ LYS 118 8.214 12.879 -11.395 619 HZ3 LYS 118 2HZ LYS 118 7.828 14.309 -10.578 620 H PHE 119 H PHE 119 5.939 9.038 -5.424 621 HA PHE 119 HA PHE 119 5.355 10.810 -3.401 622 HB2 PHE 119 1HB PHE 119 4.250 8.673 -3.491 623 HB3 PHE 119 2HB PHE 119 5.770 7.815 -3.277 624 HD1 PHE 119 HD2 PHE 119 6.962 8.000 -1.065 625 HD2 PHE 119 HD1 PHE 119 2.950 9.301 -1.647 626 HE1 PHE 119 HE2 PHE 119 6.577 7.885 1.363 627 HE2 PHE 119 HE1 PHE 119 2.563 9.192 0.780 628 HZ PHE 119 HZ PHE 119 4.382 8.481 2.277 629 H LEU 120 H LEU 120 8.100 8.564 -3.526 630 HA LEU 120 HA LEU 120 9.245 9.385 -1.078 631 HB2 LEU 120 1HB LEU 120 10.506 8.083 -3.487 632 HB3 LEU 120 2HB LEU 120 11.290 8.274 -1.929 633 HG LEU 120 HG LEU 120 8.684 6.963 -1.745 634 HD11 LEU 120 1HD1 LEU 120 10.651 6.030 -3.726 635 HD12 LEU 120 2HD1 LEU 120 8.931 5.675 -3.574 636 HD13 LEU 120 3HD1 LEU 120 10.099 4.801 -2.587 637 HD21 LEU 120 3HD2 LEU 120 10.407 5.275 -0.623 638 HD22 LEU 120 1HD2 LEU 120 9.884 6.755 0.181 639 HD23 LEU 120 2HD2 LEU 120 11.436 6.705 -0.654 640 H GLY 121 H GLY 121 9.561 10.534 -4.405 641 HA2 GLY 121 1HA GLY 121 11.687 12.387 -3.664 642 HA3 GLY 121 2HA GLY 121 11.020 12.151 -5.270 643 H SER 122 H SER 122 8.736 12.548 -2.712 644 HA SER 122 HA SER 122 7.349 14.641 -3.787 645 HB2 SER 122 1HB SER 122 7.357 13.222 -1.312 646 HB3 SER 122 2HB SER 122 7.223 14.941 -0.948 647 HG SER 122 HG SER 122 5.466 13.259 -2.307 648 H SER 123 H SER 123 10.041 14.857 -1.483 649 HA SER 123 HA SER 123 11.457 16.535 -0.931 650 HB2 SER 123 1HB SER 123 10.657 17.155 -3.671 651 HB3 SER 123 2HB SER 123 11.140 18.586 -2.758 652 HG SER 123 HG SER 123 13.078 17.925 -3.263 653 H LYS 124 H LYS 124 8.334 16.720 -0.393 654 HA LYS 124 HA LYS 124 8.529 19.396 0.799 655 HB2 LYS 124 1HB LYS 124 6.362 20.020 0.189 656 HB3 LYS 124 2HB LYS 124 7.015 19.281 -1.265 657 HG2 LYS 124 1HG LYS 124 5.428 17.607 0.631 658 HG3 LYS 124 2HG LYS 124 4.596 18.730 -0.448 659 HD2 LYS 124 1HD LYS 124 6.616 16.733 -1.436 660 HD3 LYS 124 2HD LYS 124 4.899 16.353 -1.295 661 HE2 LYS 124 1HE LYS 124 6.149 18.517 -2.987 662 HE3 LYS 124 2HE LYS 124 5.399 17.028 -3.560 663 HZ1 LYS 124 3HZ LYS 124 3.318 17.902 -2.397 664 HZ2 LYS 124 1HZ LYS 124 3.772 18.643 -3.849 665 HZ3 LYS 124 2HZ LYS 124 4.100 19.402 -2.375 666 H ARG 125 H ARG 125 6.778 16.295 0.890 667 HA ARG 125 HA ARG 125 6.823 16.465 3.813 668 HB2 ARG 125 1HB ARG 125 4.550 17.100 2.777 669 HB3 ARG 125 2HB ARG 125 4.417 15.399 2.350 670 HG2 ARG 125 1HG ARG 125 3.444 15.172 4.342 671 HG3 ARG 125 2HG ARG 125 5.083 15.260 4.994 672 HD2 ARG 125 1HD ARG 125 4.740 17.790 5.043 673 HD3 ARG 125 2HD ARG 125 3.030 17.450 4.780 674 HE ARG 125 HE ARG 125 2.866 16.808 6.964 675 HH11 ARG 125 1HH1 ARG 125 6.249 16.792 6.064 676 HH12 ARG 125 2HH1 ARG 125 6.808 16.505 7.677 677 HH21 ARG 125 1HH2 ARG 125 3.608 16.426 9.092 678 HH22 ARG 125 2HH2 ARG 125 5.308 16.299 9.395 679 H LYS 126 H LYS 126 8.272 14.927 4.177 680 HA LYS 126 HA LYS 126 7.527 12.196 3.621 681 HB2 LYS 126 1HB LYS 126 9.258 11.572 2.233 682 HB3 LYS 126 2HB LYS 126 8.917 13.189 1.646 683 HG2 LYS 126 1HG LYS 126 11.137 12.460 3.546 684 HG3 LYS 126 2HG LYS 126 11.316 12.740 1.815 685 HD2 LYS 126 1HD LYS 126 10.180 14.815 3.674 686 HD3 LYS 126 2HD LYS 126 11.910 14.668 3.368 687 HE2 LYS 126 1HE LYS 126 10.824 14.657 0.838 688 HE3 LYS 126 2HE LYS 126 9.797 15.796 1.706 689 HZ1 LYS 126 3HZ LYS 126 11.405 17.254 1.224 690 HZ2 LYS 126 1HZ LYS 126 12.554 16.056 0.896 691 HZ3 LYS 126 2HZ LYS 126 12.266 16.538 2.491 692 H SER 127 H SER 127 7.922 11.004 5.346 693 HA SER 127 HA SER 127 9.895 11.958 7.304 694 HB2 SER 127 1HB SER 127 7.260 11.417 7.713 695 HB3 SER 127 2HB SER 127 7.983 9.864 8.137 696 HG SER 127 HG SER 127 7.958 12.158 9.537 697 H LYS 128 H LYS 128 11.258 10.397 8.378 698 HA LYS 128 HA LYS 128 12.600 8.645 6.725 699 HB2 LYS 128 1HB LYS 128 13.238 9.530 9.081 700 HB3 LYS 128 2HB LYS 128 12.403 8.102 9.678 701 HG2 LYS 128 1HG LYS 128 14.072 6.728 9.090 702 HG3 LYS 128 2HG LYS 128 14.339 7.552 7.553 703 HD2 LYS 128 1HD LYS 128 16.253 8.245 8.503 704 HD3 LYS 128 2HD LYS 128 15.225 9.421 9.323 705 HE2 LYS 128 1HE LYS 128 15.618 6.712 10.524 706 HE3 LYS 128 2HE LYS 128 16.887 7.924 10.687 707 HZ1 LYS 128 3HZ LYS 128 15.535 8.143 12.574 708 HZ2 LYS 128 1HZ LYS 128 14.100 8.061 11.682 709 HZ3 LYS 128 2HZ LYS 128 15.086 9.431 11.575 710 H GLU 129 H GLU 129 10.068 7.811 9.102 711 HA GLU 129 HA GLU 129 10.037 5.044 8.456 712 HB2 GLU 129 1HB GLU 129 7.777 5.070 9.605 713 HB3 GLU 129 2HB GLU 129 9.135 5.628 10.571 714 HG2 GLU 129 1HG GLU 129 7.833 7.801 9.154 715 HG3 GLU 129 2HG GLU 129 6.722 6.921 10.199 716 H LEU 130 H LEU 130 8.341 7.850 7.194 717 HA LEU 130 HA LEU 130 6.448 6.376 5.648 718 HB2 LEU 130 1HB LEU 130 6.142 8.738 6.382 719 HB3 LEU 130 2HB LEU 130 7.394 9.214 5.254 720 HG LEU 130 HG LEU 130 5.858 8.091 3.470 721 HD11 LEU 130 1HD1 LEU 130 3.412 8.665 4.279 722 HD12 LEU 130 2HD1 LEU 130 4.097 8.274 5.856 723 HD13 LEU 130 3HD1 LEU 130 4.129 7.079 4.558 724 HD21 LEU 130 3HD2 LEU 130 5.368 10.746 4.794 725 HD22 LEU 130 1HD2 LEU 130 4.563 10.257 3.302 726 HD23 LEU 130 2HD2 LEU 130 6.321 10.402 3.350 727 H ILE 131 H ILE 131 9.550 7.947 4.876 728 HA ILE 131 HA ILE 131 9.540 7.380 2.120 729 HB ILE 131 HB ILE 131 11.936 7.639 3.947 730 HG12 ILE 131 1HG1 ILE 131 11.144 9.849 2.141 731 HG13 ILE 131 2HG1 ILE 131 10.077 9.561 3.512 732 HG21 ILE 131 1HG2 ILE 131 13.266 7.375 2.179 733 HG22 ILE 131 2HG2 ILE 131 12.300 8.479 1.199 734 HG23 ILE 131 3HG2 ILE 131 11.850 6.777 1.313 735 HD11 ILE 131 3HD1 ILE 131 12.715 10.767 3.421 736 HD12 ILE 131 1HD1 ILE 131 12.576 9.515 4.653 737 HD13 ILE 131 2HD1 ILE 131 11.456 10.878 4.651 738 H GLU 132 H GLU 132 11.045 5.610 4.827 739 HA GLU 132 HA GLU 132 12.131 3.498 3.385 740 HB2 GLU 132 1HB GLU 132 11.013 3.638 6.180 741 HB3 GLU 132 2HB GLU 132 11.755 2.177 5.544 742 HG2 GLU 132 1HG GLU 132 13.835 3.407 5.157 743 HG3 GLU 132 2HG GLU 132 13.087 4.860 5.812 744 H ALA 133 H ALA 133 8.821 4.129 4.319 745 HA ALA 133 HA ALA 133 7.742 1.569 3.908 746 HB1 ALA 133 3HB ALA 133 5.683 2.552 4.161 747 HB2 ALA 133 1HB ALA 133 6.152 4.010 3.286 748 HB3 ALA 133 2HB ALA 133 6.717 3.752 4.936 749 H TYR 134 H TYR 134 7.653 4.405 1.765 750 HA TYR 134 HA TYR 134 6.663 2.950 -0.454 751 HB2 TYR 134 1HB TYR 134 7.601 5.686 0.045 752 HB3 TYR 134 2HB TYR 134 7.911 5.115 -1.591 753 HD1 TYR 134 HD2 TYR 134 5.135 5.174 0.917 754 HD2 TYR 134 HD1 TYR 134 6.271 5.417 -3.175 755 HE1 TYR 134 HE2 TYR 134 2.805 5.661 0.307 756 HE2 TYR 134 HE1 TYR 134 3.942 5.901 -3.796 757 HH TYR 134 HH TYR 134 1.721 6.989 -1.866 758 H GLU 135 H GLU 135 9.888 3.563 0.735 759 HA GLU 135 HA GLU 135 11.255 2.741 -1.631 760 HB2 GLU 135 1HB GLU 135 11.974 3.836 0.874 761 HB3 GLU 135 2HB GLU 135 12.825 2.304 0.738 762 HG2 GLU 135 1HG GLU 135 12.964 3.818 -1.719 763 HG3 GLU 135 2HG GLU 135 13.581 4.739 -0.351 764 H ALA 136 H ALA 136 9.884 1.098 1.128 765 HA ALA 136 HA ALA 136 11.293 -1.371 0.751 766 HB1 ALA 136 3HB ALA 136 8.684 -0.966 2.198 767 HB2 ALA 136 1HB ALA 136 10.264 -0.629 2.906 768 HB3 ALA 136 2HB ALA 136 9.849 -2.272 2.418 769 H SER 137 H SER 137 8.099 -0.140 -0.199 770 HA SER 137 HA SER 137 7.280 -2.590 -1.447 771 HB2 SER 137 1HB SER 137 5.713 -0.829 -0.508 772 HB3 SER 137 2HB SER 137 6.096 0.149 -1.924 773 HG SER 137 HG SER 137 4.455 -0.942 -2.716 774 H LYS 138 H LYS 138 9.205 0.091 -2.422 775 HA LYS 138 HA LYS 138 8.790 0.206 -5.169 776 HB2 LYS 138 1HB LYS 138 10.221 1.722 -3.701 777 HB3 LYS 138 2HB LYS 138 11.487 0.515 -3.862 778 HG2 LYS 138 1HG LYS 138 12.015 2.051 -5.506 779 HG3 LYS 138 2HG LYS 138 11.138 0.808 -6.400 780 HD2 LYS 138 1HD LYS 138 9.112 2.144 -6.324 781 HD3 LYS 138 2HD LYS 138 9.928 3.368 -5.348 782 HE2 LYS 138 1HE LYS 138 10.770 2.564 -8.130 783 HE3 LYS 138 2HE LYS 138 9.733 3.942 -7.766 784 HZ1 LYS 138 3HZ LYS 138 11.808 4.897 -7.888 785 HZ2 LYS 138 1HZ LYS 138 12.597 3.573 -7.190 786 HZ3 LYS 138 2HZ LYS 138 11.681 4.619 -6.226 787 H THR 139 H THR 139 10.264 -2.304 -3.313 788 HA THR 139 HA THR 139 11.511 -3.478 -5.693 789 HB THR 139 HB THR 139 12.133 -5.162 -3.612 790 HG1 THR 139 HG1 THR 139 12.398 -2.563 -2.540 791 HG21 THR 139 3HG2 THR 139 13.687 -4.175 -5.298 792 HG22 THR 139 1HG2 THR 139 14.330 -4.299 -3.661 793 HG23 THR 139 2HG2 THR 139 13.777 -2.739 -4.276 794 HA PRO 140 HA PRO 140 7.381 -5.639 -5.639 795 HB2 PRO 140 1HB PRO 140 8.146 -6.701 -8.177 796 HB3 PRO 140 2HB PRO 140 6.930 -5.471 -7.837 797 HG2 PRO 140 1HG PRO 140 9.700 -5.162 -8.779 798 HG3 PRO 140 2HG PRO 140 8.326 -4.058 -8.934 799 HD2 PRO 140 1HD PRO 140 10.415 -3.596 -7.268 800 HD3 PRO 140 2HD PRO 140 8.766 -3.031 -6.930 801 HA PRO 141 HA PRO 141 10.103 -9.760 -6.696 802 HB2 PRO 141 1HB PRO 141 12.485 -8.544 -5.350 803 HB3 PRO 141 2HB PRO 141 12.417 -9.805 -6.588 804 HG2 PRO 141 1HG PRO 141 13.026 -7.316 -7.262 805 HG3 PRO 141 2HG PRO 141 11.960 -8.293 -8.291 806 HD2 PRO 141 1HD PRO 141 11.291 -6.031 -6.479 807 HD3 PRO 141 2HD PRO 141 10.507 -6.543 -7.988 808 H ASP 142 H ASP 142 10.368 -7.618 -3.884 809 HA ASP 142 HA ASP 142 10.877 -9.345 -1.829 810 HB2 ASP 142 1HB ASP 142 10.121 -6.750 -1.942 811 HB3 ASP 142 2HB ASP 142 8.638 -7.470 -1.326 812 H LEU 143 H LEU 143 7.838 -8.939 -3.571 813 HA LEU 143 HA LEU 143 6.536 -10.934 -1.887 814 HB2 LEU 143 1HB LEU 143 5.278 -8.917 -2.430 815 HB3 LEU 143 2HB LEU 143 5.465 -9.239 -4.144 816 HG LEU 143 HG LEU 143 4.064 -11.224 -3.965 817 HD11 LEU 143 1HD1 LEU 143 2.851 -11.625 -1.798 818 HD12 LEU 143 2HD1 LEU 143 4.019 -10.548 -1.031 819 HD13 LEU 143 3HD1 LEU 143 4.563 -12.042 -1.794 820 HD21 LEU 143 3HD2 LEU 143 1.963 -10.143 -3.557 821 HD22 LEU 143 1HD2 LEU 143 3.049 -8.990 -4.329 822 HD23 LEU 143 2HD2 LEU 143 2.745 -8.887 -2.596 823 H LYS 144 H LYS 144 7.548 -10.467 -5.264 824 HA LYS 144 HA LYS 144 6.512 -13.008 -6.123 825 HB2 LYS 144 1HB LYS 144 8.468 -11.163 -7.512 826 HB3 LYS 144 2HB LYS 144 7.644 -12.529 -8.249 827 HG2 LYS 144 1HG LYS 144 6.037 -11.137 -8.863 828 HG3 LYS 144 2HG LYS 144 5.612 -10.958 -7.159 829 HD2 LYS 144 1HD LYS 144 7.372 -9.151 -7.037 830 HD3 LYS 144 2HD LYS 144 7.464 -9.237 -8.796 831 HE2 LYS 144 1HE LYS 144 5.961 -7.501 -8.416 832 HE3 LYS 144 2HE LYS 144 4.918 -8.884 -8.740 833 HZ1 LYS 144 3HZ LYS 144 4.282 -7.466 -6.789 834 HZ2 LYS 144 1HZ LYS 144 5.660 -8.044 -5.994 835 HZ3 LYS 144 2HZ LYS 144 4.436 -9.116 -6.458 836 H GLU 145 H GLU 145 7.671 -14.101 -4.252 837 HA GLU 145 HA GLU 145 9.870 -15.577 -5.302 838 HB2 GLU 145 1HB GLU 145 10.706 -13.266 -4.167 839 HB3 GLU 145 2HB GLU 145 10.697 -14.313 -2.754 840 HG2 GLU 145 1HG GLU 145 12.484 -15.475 -3.442 841 HG3 GLU 145 2HG GLU 145 11.959 -15.485 -5.123 842 H GLU 146 H GLU 146 7.278 -16.208 -4.338 843 HA GLU 146 HA GLU 146 7.847 -17.630 -1.826 844 HB2 GLU 146 1HB GLU 146 5.861 -16.005 -2.037 845 HB3 GLU 146 2HB GLU 146 5.105 -17.257 -3.012 846 HG2 GLU 146 1HG GLU 146 5.689 -18.781 -0.969 847 HG3 GLU 146 2HG GLU 146 5.747 -17.245 -0.106 848 H SER 147 H SER 147 5.686 -18.225 -4.617 849 HA SER 147 HA SER 147 5.258 -20.083 -5.849 850 HB2 SER 147 1HB SER 147 7.924 -21.263 -5.161 851 HB3 SER 147 2HB SER 147 7.072 -21.240 -6.704 852 HG SER 147 HG SER 147 7.524 -18.966 -6.784 853 H SER 148 H SER 148 5.507 -22.666 -5.734 854 HA SER 148 HA SER 148 5.188 -23.597 -2.984 855 HB2 SER 148 1HB SER 148 3.097 -24.535 -4.882 856 HB3 SER 148 2HB SER 148 2.995 -24.245 -3.148 857 HG SER 148 HG SER 148 2.540 -22.179 -3.498 858 H THR 149 H THR 149 7.222 -24.030 -5.022 859 HA THR 149 HA THR 149 8.473 -25.682 -5.940 860 HB THR 149 HB THR 149 7.028 -27.744 -4.319 861 HG1 THR 149 HG1 THR 149 7.211 -26.442 -2.669 862 HG21 THR 149 3HG2 THR 149 9.920 -27.468 -4.081 863 HG22 THR 149 1HG2 THR 149 9.362 -27.822 -5.715 864 HG23 THR 149 2HG2 THR 149 8.931 -28.898 -4.385 865 H ASP 150 H ASP 150 7.438 -25.380 -7.983 866 HA ASP 150 HA ASP 150 5.186 -26.919 -8.794 867 HB2 ASP 150 1HB ASP 150 5.615 -26.079 -11.018 868 HB3 ASP 150 2HB ASP 150 5.914 -24.781 -9.865 869 H LEU 151 H LEU 151 8.526 -27.701 -8.483 870 HA LEU 151 HA LEU 151 9.722 -29.587 -8.879 871 HB2 LEU 151 1HB LEU 151 6.921 -30.599 -9.046 872 HB3 LEU 151 2HB LEU 151 8.223 -31.655 -9.557 873 HG LEU 151 HG LEU 151 8.505 -30.356 -6.903 874 HD11 LEU 151 1HD1 LEU 151 7.063 -31.883 -5.797 875 HD12 LEU 151 2HD1 LEU 151 6.722 -32.745 -7.297 876 HD13 LEU 151 3HD1 LEU 151 6.118 -31.104 -7.067 877 HD21 LEU 151 3HD2 LEU 151 8.952 -33.223 -7.658 878 HD22 LEU 151 1HD2 LEU 151 9.711 -32.285 -6.374 879 HD23 LEU 151 2HD2 LEU 151 10.129 -31.971 -8.059 880 H GLU 152 H GLU 152 10.707 -28.610 -10.696 881 HA GLU 152 HA GLU 152 9.647 -28.963 -13.344 882 HB2 GLU 152 1HB GLU 152 12.464 -28.168 -12.589 883 HB3 GLU 152 2HB GLU 152 11.633 -27.847 -14.105 884 HG2 GLU 152 1HG GLU 152 10.027 -26.710 -12.114 885 HG3 GLU 152 2HG GLU 152 11.681 -26.304 -11.676 Start of MODEL 16 1 H1 SER 45 1H SER 45 -9.884 9.781 -10.839 2 H2 SER 45 2H SER 45 -11.113 10.973 -10.721 3 H3 SER 45 3H SER 45 -10.227 10.790 -12.181 4 HA SER 45 HA SER 45 -12.200 8.969 -10.988 5 HB2 SER 45 1HB SER 45 -13.141 10.758 -12.312 6 HB3 SER 45 2HB SER 45 -11.979 10.473 -13.609 7 HG SER 45 HG SER 45 -14.118 8.811 -12.778 8 H ALA 46 H ALA 46 -12.533 6.962 -12.088 9 HA ALA 46 HA ALA 46 -11.915 4.998 -13.039 10 HB1 ALA 46 3HB ALA 46 -10.654 4.994 -15.045 11 HB2 ALA 46 1HB ALA 46 -9.910 6.546 -14.660 12 HB3 ALA 46 2HB ALA 46 -11.629 6.463 -15.049 13 H ASP 47 H ASP 47 -11.067 3.990 -11.268 14 HA ASP 47 HA ASP 47 -8.134 3.919 -11.132 15 HB2 ASP 47 1HB ASP 47 -8.394 3.656 -8.606 16 HB3 ASP 47 2HB ASP 47 -8.650 5.269 -9.263 17 H ASP 48 H ASP 48 -9.780 2.089 -12.499 18 HA ASP 48 HA ASP 48 -9.872 -0.263 -10.756 19 HB2 ASP 48 1HB ASP 48 -11.721 0.571 -12.510 20 HB3 ASP 48 2HB ASP 48 -10.763 -0.444 -13.584 21 H ARG 49 H ARG 49 -7.762 -0.908 -10.587 22 HA ARG 49 HA ARG 49 -6.676 -2.365 -12.796 23 HB2 ARG 49 1HB ARG 49 -5.956 0.300 -12.737 24 HB3 ARG 49 2HB ARG 49 -4.620 -0.477 -11.904 25 HG2 ARG 49 1HG ARG 49 -3.996 -1.699 -13.767 26 HG3 ARG 49 2HG ARG 49 -5.585 -1.550 -14.521 27 HD2 ARG 49 1HD ARG 49 -5.113 0.460 -15.431 28 HD3 ARG 49 2HD ARG 49 -4.175 0.988 -14.035 29 HE ARG 49 HE ARG 49 -2.872 -1.032 -15.622 30 HH11 ARG 49 1HH1 ARG 49 -3.398 2.414 -15.237 31 HH12 ARG 49 2HH1 ARG 49 -1.944 2.852 -16.068 32 HH21 ARG 49 1HH2 ARG 49 -0.956 -0.438 -16.720 33 HH22 ARG 49 2HH2 ARG 49 -0.562 1.238 -16.908 34 H LEU 50 H LEU 50 -7.509 -3.017 -10.167 35 HA LEU 50 HA LEU 50 -5.028 -3.511 -8.692 36 HB2 LEU 50 1HB LEU 50 -7.851 -4.135 -7.838 37 HB3 LEU 50 2HB LEU 50 -6.421 -4.119 -6.826 38 HG LEU 50 HG LEU 50 -7.111 -1.573 -8.185 39 HD11 LEU 50 1HD1 LEU 50 -9.307 -2.344 -7.478 40 HD12 LEU 50 2HD1 LEU 50 -8.763 -0.998 -6.479 41 HD13 LEU 50 3HD1 LEU 50 -8.691 -2.645 -5.853 42 HD21 LEU 50 3HD2 LEU 50 -6.110 -2.355 -5.454 43 HD22 LEU 50 1HD2 LEU 50 -6.438 -0.694 -5.951 44 HD23 LEU 50 2HD2 LEU 50 -5.186 -1.628 -6.768 45 H ASN 51 H ASN 51 -4.275 -5.556 -8.211 46 HA ASN 51 HA ASN 51 -5.745 -7.911 -8.990 47 HB2 ASN 51 1HB ASN 51 -4.027 -8.749 -10.552 48 HB3 ASN 51 2HB ASN 51 -4.790 -7.277 -11.144 49 HD21 ASN 51 2HD2 ASN 51 -1.887 -8.821 -10.559 50 HD22 ASN 51 1HD2 ASN 51 -0.833 -7.449 -10.690 51 H PHE 52 H PHE 52 -4.101 -9.902 -8.798 52 HA PHE 52 HA PHE 52 -3.153 -9.803 -6.085 53 HB2 PHE 52 1HB PHE 52 -2.872 -12.071 -8.066 54 HB3 PHE 52 2HB PHE 52 -2.755 -12.173 -6.309 55 HD1 PHE 52 HD2 PHE 52 -5.039 -10.714 -5.352 56 HD2 PHE 52 HD1 PHE 52 -4.718 -13.269 -8.740 57 HE1 PHE 52 HE2 PHE 52 -7.448 -11.183 -5.222 58 HE2 PHE 52 HE1 PHE 52 -7.129 -13.742 -8.616 59 HZ PHE 52 HZ PHE 52 -8.498 -12.697 -6.856 60 H GLY 53 H GLY 53 -1.141 -9.544 -5.371 61 HA2 GLY 53 1HA GLY 53 1.173 -9.517 -5.349 62 HA3 GLY 53 2HA GLY 53 1.167 -10.152 -6.988 63 H ASP 54 H ASP 54 -0.659 -7.279 -6.206 64 HA ASP 54 HA ASP 54 1.344 -5.673 -7.649 65 HB2 ASP 54 1HB ASP 54 -1.020 -6.181 -8.695 66 HB3 ASP 54 2HB ASP 54 -1.550 -4.903 -7.607 67 H ARG 55 H ARG 55 2.154 -3.987 -6.609 68 HA ARG 55 HA ARG 55 1.531 -3.446 -3.918 69 HB2 ARG 55 1HB ARG 55 2.973 -1.383 -4.267 70 HB3 ARG 55 2HB ARG 55 3.735 -2.929 -4.598 71 HG2 ARG 55 1HG ARG 55 2.714 -2.206 -7.051 72 HG3 ARG 55 2HG ARG 55 3.239 -0.670 -6.362 73 HD2 ARG 55 1HD ARG 55 5.394 -1.181 -6.644 74 HD3 ARG 55 2HD ARG 55 5.186 -2.771 -5.913 75 HE ARG 55 HE ARG 55 5.147 -2.123 -8.734 76 HH11 ARG 55 1HH1 ARG 55 4.383 -4.495 -6.273 77 HH12 ARG 55 2HH1 ARG 55 4.366 -5.823 -7.382 78 HH21 ARG 55 1HH2 ARG 55 5.113 -3.876 -10.193 79 HH22 ARG 55 2HH2 ARG 55 4.781 -5.472 -9.609 80 H ILE 56 H ILE 56 -0.224 -2.502 -3.166 81 HA ILE 56 HA ILE 56 -1.454 -0.321 -4.726 82 HB ILE 56 HB ILE 56 -3.609 -0.921 -3.659 83 HG12 ILE 56 1HG1 ILE 56 -2.080 -3.357 -2.702 84 HG13 ILE 56 2HG1 ILE 56 -2.735 -2.083 -1.680 85 HG21 ILE 56 1HG2 ILE 56 -4.129 -2.657 -5.159 86 HG22 ILE 56 2HG2 ILE 56 -2.488 -3.300 -5.115 87 HG23 ILE 56 3HG2 ILE 56 -2.812 -1.764 -5.920 88 HD11 ILE 56 3HD1 ILE 56 -3.988 -4.452 -2.611 89 HD12 ILE 56 1HD1 ILE 56 -4.856 -3.063 -3.262 90 HD13 ILE 56 2HD1 ILE 56 -4.621 -3.219 -1.521 91 H LEU 57 H LEU 57 -2.455 1.399 -3.519 92 HA LEU 57 HA LEU 57 -1.042 1.922 -1.012 93 HB2 LEU 57 1HB LEU 57 -1.514 3.512 -3.192 94 HB3 LEU 57 2HB LEU 57 -2.779 4.028 -2.093 95 HG LEU 57 HG LEU 57 -1.043 4.454 -0.360 96 HD11 LEU 57 1HD1 LEU 57 1.024 4.279 -2.506 97 HD12 LEU 57 2HD1 LEU 57 0.576 2.835 -1.600 98 HD13 LEU 57 3HD1 LEU 57 1.216 4.244 -0.753 99 HD21 LEU 57 3HD2 LEU 57 -0.228 6.022 -2.756 100 HD22 LEU 57 1HD2 LEU 57 -0.614 6.568 -1.126 101 HD23 LEU 57 2HD2 LEU 57 -1.908 6.102 -2.229 102 H VAL 58 H VAL 58 -2.024 2.021 0.927 103 HA VAL 58 HA VAL 58 -4.951 2.141 1.004 104 HB VAL 58 HB VAL 58 -4.455 -0.214 1.135 105 HG11 VAL 58 1HG1 VAL 58 -2.436 0.647 3.152 106 HG12 VAL 58 2HG1 VAL 58 -2.285 -0.498 1.822 107 HG13 VAL 58 3HG1 VAL 58 -3.162 -0.953 3.281 108 HG21 VAL 58 3HG2 VAL 58 -5.081 -0.347 3.815 109 HG22 VAL 58 1HG2 VAL 58 -6.226 -0.173 2.485 110 HG23 VAL 58 2HG2 VAL 58 -5.650 1.253 3.344 111 H LYS 59 H LYS 59 -5.767 3.363 2.598 112 HA LYS 59 HA LYS 59 -3.891 4.761 4.331 113 HB2 LYS 59 1HB LYS 59 -5.764 5.847 2.922 114 HB3 LYS 59 2HB LYS 59 -6.852 5.267 4.176 115 HG2 LYS 59 1HG LYS 59 -4.633 6.620 5.377 116 HG3 LYS 59 2HG LYS 59 -5.367 7.643 4.141 117 HD2 LYS 59 1HD LYS 59 -7.605 6.954 5.247 118 HD3 LYS 59 2HD LYS 59 -6.595 6.489 6.616 119 HE2 LYS 59 1HE LYS 59 -5.585 8.881 6.304 120 HE3 LYS 59 2HE LYS 59 -7.101 9.196 5.459 121 HZ1 LYS 59 3HZ LYS 59 -7.252 9.779 7.797 122 HZ2 LYS 59 1HZ LYS 59 -6.853 8.197 8.246 123 HZ3 LYS 59 2HZ LYS 59 -8.307 8.507 7.438 124 H ALA 60 H ALA 60 -3.813 4.597 6.514 125 HA ALA 60 HA ALA 60 -5.383 2.446 7.740 126 HB1 ALA 60 3HB ALA 60 -2.721 3.608 8.191 127 HB2 ALA 60 1HB ALA 60 -3.295 1.956 8.420 128 HB3 ALA 60 2HB ALA 60 -3.607 3.177 9.655 129 HA PRO 61 HA PRO 61 -7.877 5.055 10.278 130 HB2 PRO 61 1HB PRO 61 -7.692 3.930 12.759 131 HB3 PRO 61 2HB PRO 61 -8.646 3.236 11.444 132 HG2 PRO 61 1HG PRO 61 -5.907 2.498 12.392 133 HG3 PRO 61 2HG PRO 61 -7.244 1.442 11.902 134 HD2 PRO 61 1HD PRO 61 -5.162 1.988 10.271 135 HD3 PRO 61 2HD PRO 61 -6.805 1.723 9.651 136 H GLY 62 H GLY 62 -6.834 7.030 10.299 137 HA2 GLY 62 1HA GLY 62 -6.144 8.768 11.803 138 HA3 GLY 62 2HA GLY 62 -5.235 7.569 12.708 139 H TYR 63 H TYR 63 -4.097 6.384 10.240 140 HA TYR 63 HA TYR 63 -2.016 8.410 9.809 141 HB2 TYR 63 1HB TYR 63 -2.026 5.409 9.458 142 HB3 TYR 63 2HB TYR 63 -0.694 6.437 8.941 143 HD1 TYR 63 HD2 TYR 63 -2.759 5.809 12.008 144 HD2 TYR 63 HD1 TYR 63 1.079 6.674 10.388 145 HE1 TYR 63 HE2 TYR 63 -1.782 5.660 14.260 146 HE2 TYR 63 HE1 TYR 63 2.067 6.525 12.634 147 HH TYR 63 HH TYR 63 1.256 5.179 14.917 148 HA PRO 64 HA PRO 64 -3.166 9.178 5.611 149 HB2 PRO 64 1HB PRO 64 -0.271 9.158 4.970 150 HB3 PRO 64 2HB PRO 64 -1.458 10.448 4.759 151 HG2 PRO 64 1HG PRO 64 0.382 10.587 6.677 152 HG3 PRO 64 2HG PRO 64 -1.275 11.154 6.963 153 HD2 PRO 64 1HD PRO 64 0.028 8.595 7.817 154 HD3 PRO 64 2HD PRO 64 -1.070 9.657 8.725 155 H TRP 65 H TRP 65 -2.142 8.502 3.268 156 HA TRP 65 HA TRP 65 -2.748 5.749 2.999 157 HB2 TRP 65 1HB TRP 65 -1.510 7.670 1.016 158 HB3 TRP 65 2HB TRP 65 -2.107 6.064 0.617 159 HD1 TRP 65 HD1 TRP 65 -3.359 9.534 1.679 160 HE1 TRP 65 HE1 TRP 65 -5.849 9.727 1.073 161 HE3 TRP 65 HE3 TRP 65 -4.200 4.722 0.163 162 HZ2 TRP 65 HZ2 TRP 65 -7.902 8.062 0.085 163 HZ3 TRP 65 HZ3 TRP 65 -6.459 4.105 -0.597 164 HH2 TRP 65 HH2 TRP 65 -8.269 5.742 -0.635 165 H TRP 66 H TRP 66 -1.501 4.006 3.116 166 HA TRP 66 HA TRP 66 1.423 4.376 3.137 167 HB2 TRP 66 1HB TRP 66 0.020 3.515 5.235 168 HB3 TRP 66 2HB TRP 66 0.188 1.974 4.398 169 HD1 TRP 66 HD1 TRP 66 2.386 0.699 4.789 170 HE1 TRP 66 HE1 TRP 66 4.654 1.251 5.873 171 HE3 TRP 66 HE3 TRP 66 1.704 5.701 5.592 172 HZ2 TRP 66 HZ2 TRP 66 5.973 3.507 6.931 173 HZ3 TRP 66 HZ3 TRP 66 3.526 6.984 6.639 174 HH2 TRP 66 HH2 TRP 66 5.617 5.905 7.286 175 HA PRO 67 HA PRO 67 1.517 1.659 -0.364 176 HB2 PRO 67 1HB PRO 67 4.127 1.037 -0.403 177 HB3 PRO 67 2HB PRO 67 3.551 2.660 -0.795 178 HG2 PRO 67 1HG PRO 67 4.714 1.628 1.767 179 HG3 PRO 67 2HG PRO 67 5.049 3.150 0.921 180 HD2 PRO 67 1HD PRO 67 3.361 2.962 3.053 181 HD3 PRO 67 2HD PRO 67 3.182 4.179 1.776 182 H ALA 68 H ALA 68 0.632 -0.299 -0.305 183 HA ALA 68 HA ALA 68 1.942 -2.402 1.295 184 HB1 ALA 68 3HB ALA 68 -0.476 -1.424 1.947 185 HB2 ALA 68 1HB ALA 68 0.001 -3.099 2.224 186 HB3 ALA 68 2HB ALA 68 -0.960 -2.678 0.805 187 H LEU 69 H LEU 69 1.126 -4.652 0.474 188 HA LEU 69 HA LEU 69 1.014 -4.596 -2.473 189 HB2 LEU 69 1HB LEU 69 3.132 -5.515 -0.898 190 HB3 LEU 69 2HB LEU 69 2.304 -6.968 -1.419 191 HG LEU 69 HG LEU 69 2.478 -5.571 -3.766 192 HD11 LEU 69 1HD1 LEU 69 3.880 -3.865 -2.611 193 HD12 LEU 69 2HD1 LEU 69 4.675 -4.654 -3.973 194 HD13 LEU 69 3HD1 LEU 69 5.083 -5.122 -2.323 195 HD21 LEU 69 3HD2 LEU 69 2.963 -7.911 -3.542 196 HD22 LEU 69 1HD2 LEU 69 4.401 -7.566 -2.579 197 HD23 LEU 69 2HD2 LEU 69 4.351 -7.117 -4.284 198 H LEU 70 H LEU 70 -0.786 -5.506 -3.210 199 HA LEU 70 HA LEU 70 -2.553 -7.001 -1.573 200 HB2 LEU 70 1HB LEU 70 -2.865 -5.603 -3.844 201 HB3 LEU 70 2HB LEU 70 -2.787 -7.219 -4.521 202 HG LEU 70 HG LEU 70 -4.677 -6.622 -2.269 203 HD11 LEU 70 1HD1 LEU 70 -5.773 -5.151 -3.531 204 HD12 LEU 70 2HD1 LEU 70 -6.187 -6.503 -4.584 205 HD13 LEU 70 3HD1 LEU 70 -4.778 -5.505 -4.943 206 HD21 LEU 70 3HD2 LEU 70 -4.134 -8.961 -3.122 207 HD22 LEU 70 1HD2 LEU 70 -5.002 -8.504 -4.587 208 HD23 LEU 70 2HD2 LEU 70 -5.837 -8.514 -3.034 209 H LEU 71 H LEU 71 -2.763 -9.142 -1.236 210 HA LEU 71 HA LEU 71 -0.925 -10.924 -2.685 211 HB2 LEU 71 1HB LEU 71 -2.205 -11.127 0.032 212 HB3 LEU 71 2HB LEU 71 -1.453 -12.504 -0.748 213 HG LEU 71 HG LEU 71 0.511 -10.565 -0.901 214 HD11 LEU 71 1HD1 LEU 71 0.670 -9.881 1.552 215 HD12 LEU 71 2HD1 LEU 71 -1.051 -10.251 1.642 216 HD13 LEU 71 3HD1 LEU 71 -0.474 -9.005 0.537 217 HD21 LEU 71 3HD2 LEU 71 0.501 -12.319 1.482 218 HD22 LEU 71 1HD2 LEU 71 1.739 -12.082 0.250 219 HD23 LEU 71 2HD2 LEU 71 0.343 -13.106 -0.089 220 H ARG 72 H ARG 72 -4.193 -11.020 -1.228 221 HA ARG 72 HA ARG 72 -5.254 -12.279 -3.607 222 HB2 ARG 72 1HB ARG 72 -4.688 -13.778 -1.136 223 HB3 ARG 72 2HB ARG 72 -6.301 -14.014 -1.791 224 HG2 ARG 72 1HG ARG 72 -4.095 -14.188 -3.733 225 HG3 ARG 72 2HG ARG 72 -4.154 -15.459 -2.510 226 HD2 ARG 72 1HD ARG 72 -5.997 -16.392 -3.392 227 HD3 ARG 72 2HD ARG 72 -6.748 -14.832 -3.726 228 HE ARG 72 HE ARG 72 -6.017 -15.013 -5.872 229 HH11 ARG 72 1HH1 ARG 72 -4.012 -17.085 -3.880 230 HH12 ARG 72 2HH1 ARG 72 -3.143 -17.746 -5.222 231 HH21 ARG 72 1HH2 ARG 72 -4.867 -15.891 -7.641 232 HH22 ARG 72 2HH2 ARG 72 -3.630 -17.070 -7.357 233 H ARG 73 H ARG 73 -7.582 -12.448 -3.602 234 HA ARG 73 HA ARG 73 -8.830 -10.495 -1.785 235 HB2 ARG 73 1HB ARG 73 -8.836 -10.041 -4.281 236 HB3 ARG 73 2HB ARG 73 -9.903 -11.427 -4.451 237 HG2 ARG 73 1HG ARG 73 -11.209 -10.017 -2.543 238 HG3 ARG 73 2HG ARG 73 -10.465 -8.717 -3.472 239 HD2 ARG 73 1HD ARG 73 -11.484 -10.533 -5.356 240 HD3 ARG 73 2HD ARG 73 -12.733 -10.359 -4.122 241 HE ARG 73 HE ARG 73 -11.903 -7.800 -4.722 242 HH11 ARG 73 1HH1 ARG 73 -13.334 -10.471 -6.477 243 HH12 ARG 73 2HH1 ARG 73 -14.147 -9.451 -7.613 244 HH21 ARG 73 1HH2 ARG 73 -12.976 -6.460 -6.227 245 HH22 ARG 73 2HH2 ARG 73 -13.944 -7.174 -7.472 246 H LYS 74 H LYS 74 -9.361 -11.855 -0.104 247 HA LYS 74 HA LYS 74 -10.894 -14.272 -0.633 248 HB2 LYS 74 1HB LYS 74 -10.830 -14.446 1.915 249 HB3 LYS 74 2HB LYS 74 -9.301 -14.595 1.061 250 HG2 LYS 74 1HG LYS 74 -8.469 -12.689 1.931 251 HG3 LYS 74 2HG LYS 74 -10.035 -11.877 1.936 252 HD2 LYS 74 1HD LYS 74 -10.590 -13.618 3.813 253 HD3 LYS 74 2HD LYS 74 -8.834 -13.701 3.971 254 HE2 LYS 74 1HE LYS 74 -9.672 -10.962 3.799 255 HE3 LYS 74 2HE LYS 74 -10.584 -11.785 5.063 256 HZ1 LYS 74 3HZ LYS 74 -7.768 -11.111 4.954 257 HZ2 LYS 74 1HZ LYS 74 -8.106 -12.652 5.563 258 HZ3 LYS 74 2HZ LYS 74 -8.790 -11.288 6.287 259 H GLU 75 H GLU 75 -13.027 -14.566 -0.211 260 HA GLU 75 HA GLU 75 -14.544 -12.201 0.683 261 HB2 GLU 75 1HB GLU 75 -14.757 -13.548 -1.710 262 HB3 GLU 75 2HB GLU 75 -16.049 -14.264 -0.756 263 HG2 GLU 75 1HG GLU 75 -16.798 -11.901 -0.251 264 HG3 GLU 75 2HG GLU 75 -15.674 -11.383 -1.506 265 H THR 76 H THR 76 -14.968 -12.514 2.801 266 HA THR 76 HA THR 76 -16.025 -15.140 3.611 267 HB THR 76 HB THR 76 -13.957 -14.517 4.776 268 HG1 THR 76 HG1 THR 76 -14.705 -14.978 6.788 269 HG21 THR 76 3HG2 THR 76 -15.499 -12.086 5.614 270 HG22 THR 76 1HG2 THR 76 -13.914 -12.171 4.844 271 HG23 THR 76 2HG2 THR 76 -14.113 -12.696 6.517 272 H LYS 77 H LYS 77 -17.794 -15.189 5.110 273 HA LYS 77 HA LYS 77 -19.341 -12.717 5.371 274 HB2 LYS 77 1HB LYS 77 -21.407 -13.949 4.656 275 HB3 LYS 77 2HB LYS 77 -20.249 -13.656 3.367 276 HG2 LYS 77 1HG LYS 77 -19.401 -16.044 3.931 277 HG3 LYS 77 2HG LYS 77 -20.974 -16.223 4.710 278 HD2 LYS 77 1HD LYS 77 -22.027 -16.421 2.751 279 HD3 LYS 77 2HD LYS 77 -21.184 -15.027 2.072 280 HE2 LYS 77 1HE LYS 77 -19.166 -16.695 1.955 281 HE3 LYS 77 2HE LYS 77 -20.434 -17.917 2.022 282 HZ1 LYS 77 3HZ LYS 77 -21.279 -17.277 -0.003 283 HZ2 LYS 77 1HZ LYS 77 -19.623 -17.027 -0.253 284 HZ3 LYS 77 2HZ LYS 77 -20.638 -15.715 0.078 285 H ASP 78 H ASP 78 -21.486 -13.347 6.670 286 HA ASP 78 HA ASP 78 -20.709 -14.055 9.245 287 HB2 ASP 78 1HB ASP 78 -22.818 -12.816 8.534 288 HB3 ASP 78 2HB ASP 78 -23.521 -14.395 8.195 289 H SER 79 H SER 79 -22.660 -16.019 6.988 290 HA SER 79 HA SER 79 -21.267 -18.415 7.512 291 HB2 SER 79 1HB SER 79 -23.530 -17.790 9.292 292 HB3 SER 79 2HB SER 79 -23.624 -19.379 8.532 293 HG SER 79 HG SER 79 -22.218 -19.989 9.956 294 H LEU 80 H LEU 80 -24.702 -17.580 6.998 295 HA LEU 80 HA LEU 80 -24.502 -18.639 4.273 296 HB2 LEU 80 1HB LEU 80 -26.276 -19.610 6.463 297 HB3 LEU 80 2HB LEU 80 -26.935 -19.546 4.841 298 HG LEU 80 HG LEU 80 -24.736 -20.876 4.239 299 HD11 LEU 80 1HD1 LEU 80 -23.509 -21.162 6.117 300 HD12 LEU 80 2HD1 LEU 80 -24.581 -22.545 6.324 301 HD13 LEU 80 3HD1 LEU 80 -24.907 -21.041 7.185 302 HD21 LEU 80 3HD2 LEU 80 -27.374 -21.753 5.258 303 HD22 LEU 80 1HD2 LEU 80 -26.129 -22.989 5.065 304 HD23 LEU 80 2HD2 LEU 80 -26.620 -22.008 3.684 305 H ASN 81 H ASN 81 -27.140 -17.490 6.372 306 HA ASN 81 HA ASN 81 -27.352 -14.983 4.989 307 HB2 ASN 81 1HB ASN 81 -28.808 -17.214 3.971 308 HB3 ASN 81 2HB ASN 81 -29.962 -16.103 4.701 309 HD21 ASN 81 2HD2 ASN 81 -28.090 -16.791 2.001 310 HD22 ASN 81 1HD2 ASN 81 -28.309 -15.293 1.152 311 H THR 82 H THR 82 -26.985 -15.799 7.710 312 HA THR 82 HA THR 82 -29.423 -15.608 9.166 313 HB THR 82 HB THR 82 -27.846 -15.122 11.117 314 HG1 THR 82 HG1 THR 82 -25.893 -14.615 10.594 315 HG21 THR 82 3HG2 THR 82 -28.577 -17.389 10.712 316 HG22 THR 82 1HG2 THR 82 -26.875 -17.368 11.178 317 HG23 THR 82 2HG2 THR 82 -27.326 -17.597 9.487 318 H ASN 83 H ASN 83 -26.745 -13.302 8.710 319 HA ASN 83 HA ASN 83 -28.568 -11.119 9.458 320 HB2 ASN 83 1HB ASN 83 -25.556 -11.310 9.456 321 HB3 ASN 83 2HB ASN 83 -26.420 -9.794 9.691 322 HD21 ASN 83 2HD2 ASN 83 -24.642 -11.052 11.532 323 HD22 ASN 83 1HD2 ASN 83 -25.559 -11.420 12.960 324 H SER 84 H SER 84 -26.745 -12.443 6.832 325 HA SER 84 HA SER 84 -26.571 -11.900 4.640 326 HB2 SER 84 1HB SER 84 -28.741 -9.857 5.159 327 HB3 SER 84 2HB SER 84 -28.308 -10.578 3.610 328 HG SER 84 HG SER 84 -29.938 -11.834 4.198 329 H SER 85 H SER 85 -24.477 -11.025 5.562 330 HA SER 85 HA SER 85 -24.090 -8.353 4.501 331 HB2 SER 85 1HB SER 85 -23.738 -9.051 7.395 332 HB3 SER 85 2HB SER 85 -22.651 -7.877 6.653 333 HG SER 85 HG SER 85 -25.210 -7.565 7.447 334 H PHE 86 H PHE 86 -22.661 -8.941 2.957 335 HA PHE 86 HA PHE 86 -20.685 -10.963 3.319 336 HB2 PHE 86 1HB PHE 86 -21.368 -9.007 1.178 337 HB3 PHE 86 2HB PHE 86 -19.745 -9.685 1.165 338 HD1 PHE 86 HD1 PHE 86 -23.118 -11.127 1.897 339 HD2 PHE 86 HD2 PHE 86 -19.566 -11.301 -0.444 340 HE1 PHE 86 HE1 PHE 86 -23.967 -13.136 0.762 341 HE2 PHE 86 HE2 PHE 86 -20.412 -13.310 -1.582 342 HZ PHE 86 HZ PHE 86 -22.614 -14.229 -0.981 343 H ASN 87 H ASN 87 -18.441 -10.763 3.528 344 HA ASN 87 HA ASN 87 -17.416 -8.111 4.247 345 HB2 ASN 87 1HB ASN 87 -17.333 -10.617 5.900 346 HB3 ASN 87 2HB ASN 87 -16.041 -9.431 6.040 347 HD21 ASN 87 2HD2 ASN 87 -19.244 -10.251 6.881 348 HD22 ASN 87 1HD2 ASN 87 -19.610 -8.824 7.801 349 H VAL 88 H VAL 88 -16.490 -8.185 2.124 350 HA VAL 88 HA VAL 88 -14.309 -10.119 1.769 351 HB VAL 88 HB VAL 88 -15.772 -9.993 -0.136 352 HG11 VAL 88 1HG1 VAL 88 -15.852 -7.807 -1.456 353 HG12 VAL 88 2HG1 VAL 88 -15.302 -7.034 0.030 354 HG13 VAL 88 3HG1 VAL 88 -16.832 -7.912 0.005 355 HG21 VAL 88 3HG2 VAL 88 -13.601 -8.462 -1.349 356 HG22 VAL 88 1HG2 VAL 88 -14.103 -10.132 -1.618 357 HG23 VAL 88 2HG2 VAL 88 -13.049 -9.737 -0.261 358 H LEU 89 H LEU 89 -12.211 -9.525 1.732 359 HA LEU 89 HA LEU 89 -11.569 -6.662 1.830 360 HB2 LEU 89 1HB LEU 89 -10.032 -8.507 3.593 361 HB3 LEU 89 2HB LEU 89 -10.301 -6.781 3.743 362 HG LEU 89 HG LEU 89 -12.515 -8.766 4.191 363 HD11 LEU 89 1HD1 LEU 89 -12.001 -8.938 6.460 364 HD12 LEU 89 2HD1 LEU 89 -10.855 -7.600 6.398 365 HD13 LEU 89 3HD1 LEU 89 -10.446 -9.145 5.655 366 HD21 LEU 89 3HD2 LEU 89 -13.653 -6.847 4.270 367 HD22 LEU 89 1HD2 LEU 89 -12.182 -5.877 4.346 368 HD23 LEU 89 2HD2 LEU 89 -12.857 -6.575 5.819 369 H TYR 90 H TYR 90 -9.171 -6.294 1.684 370 HA TYR 90 HA TYR 90 -8.031 -8.075 -0.363 371 HB2 TYR 90 1HB TYR 90 -8.057 -5.141 0.036 372 HB3 TYR 90 2HB TYR 90 -6.531 -5.816 -0.518 373 HD1 TYR 90 HD2 TYR 90 -7.675 -8.072 -2.187 374 HD2 TYR 90 HD1 TYR 90 -8.703 -3.954 -1.906 375 HE1 TYR 90 HE2 TYR 90 -8.536 -8.139 -4.479 376 HE2 TYR 90 HE1 TYR 90 -9.569 -4.008 -4.204 377 HH TYR 90 HH TYR 90 -9.133 -5.453 -6.306 378 H LYS 91 H LYS 91 -6.665 -9.479 0.614 379 HA LYS 91 HA LYS 91 -5.256 -8.883 3.018 380 HB2 LYS 91 1HB LYS 91 -4.733 -11.098 1.019 381 HB3 LYS 91 2HB LYS 91 -4.131 -11.032 2.670 382 HG2 LYS 91 1HG LYS 91 -6.778 -10.817 3.126 383 HG3 LYS 91 2HG LYS 91 -6.788 -11.778 1.645 384 HD2 LYS 91 1HD LYS 91 -4.785 -12.742 3.493 385 HD3 LYS 91 2HD LYS 91 -6.374 -12.693 4.255 386 HE2 LYS 91 1HE LYS 91 -5.770 -14.848 3.077 387 HE3 LYS 91 2HE LYS 91 -7.312 -14.124 2.624 388 HZ1 LYS 91 3HZ LYS 91 -4.920 -13.467 1.051 389 HZ2 LYS 91 1HZ LYS 91 -6.539 -13.541 0.565 390 HZ3 LYS 91 2HZ LYS 91 -5.662 -14.966 0.811 391 H VAL 92 H VAL 92 -4.052 -7.007 2.671 392 HA VAL 92 HA VAL 92 -1.912 -7.168 0.657 393 HB VAL 92 HB VAL 92 -1.726 -4.781 0.747 394 HG11 VAL 92 1HG1 VAL 92 -4.430 -5.955 0.376 395 HG12 VAL 92 2HG1 VAL 92 -3.351 -5.193 -0.792 396 HG13 VAL 92 3HG1 VAL 92 -4.268 -4.199 0.339 397 HG21 VAL 92 3HG2 VAL 92 -3.662 -4.944 3.052 398 HG22 VAL 92 1HG2 VAL 92 -3.308 -3.448 2.188 399 HG23 VAL 92 2HG2 VAL 92 -2.022 -4.291 3.055 400 H LEU 93 H LEU 93 0.223 -6.517 1.196 401 HA LEU 93 HA LEU 93 0.855 -6.889 4.045 402 HB2 LEU 93 1HB LEU 93 1.779 -8.356 1.990 403 HB3 LEU 93 2HB LEU 93 2.998 -7.095 2.012 404 HG LEU 93 HG LEU 93 2.521 -8.091 4.683 405 HD11 LEU 93 1HD1 LEU 93 2.095 -10.093 2.911 406 HD12 LEU 93 2HD1 LEU 93 2.759 -10.317 4.530 407 HD13 LEU 93 3HD1 LEU 93 3.840 -10.211 3.139 408 HD21 LEU 93 3HD2 LEU 93 4.895 -7.949 2.839 409 HD22 LEU 93 1HD2 LEU 93 4.985 -8.516 4.507 410 HD23 LEU 93 2HD2 LEU 93 4.482 -6.860 4.165 411 H PHE 94 H PHE 94 1.875 -5.321 5.156 412 HA PHE 94 HA PHE 94 2.400 -2.807 3.753 413 HB2 PHE 94 1HB PHE 94 1.918 -3.582 6.599 414 HB3 PHE 94 2HB PHE 94 2.816 -2.109 6.275 415 HD1 PHE 94 HD1 PHE 94 -0.274 -3.735 4.894 416 HD2 PHE 94 HD2 PHE 94 1.571 -0.217 6.434 417 HE1 PHE 94 HE1 PHE 94 -2.380 -2.503 4.604 418 HE2 PHE 94 HE2 PHE 94 -0.534 1.016 6.144 419 HZ PHE 94 HZ PHE 94 -2.513 -0.126 5.230 420 H PHE 95 H PHE 95 4.355 -1.559 4.304 421 HA PHE 95 HA PHE 95 6.648 -3.171 5.157 422 HB2 PHE 95 1HB PHE 95 6.775 -1.471 2.665 423 HB3 PHE 95 2HB PHE 95 7.976 -2.614 3.255 424 HD1 PHE 95 HD1 PHE 95 4.693 -2.269 1.637 425 HD2 PHE 95 HD2 PHE 95 7.795 -4.944 2.797 426 HE1 PHE 95 HE1 PHE 95 3.697 -4.027 0.235 427 HE2 PHE 95 HE2 PHE 95 6.803 -6.706 1.397 428 HZ PHE 95 HZ PHE 95 4.752 -6.249 0.113 429 HA PRO 96 HA PRO 96 8.778 -2.831 5.018 430 HB2 PRO 96 1HB PRO 96 10.908 -2.275 6.532 431 HB3 PRO 96 2HB PRO 96 10.620 -1.420 5.013 432 HG2 PRO 96 1HG PRO 96 10.235 -0.492 7.812 433 HG3 PRO 96 2HG PRO 96 10.700 0.429 6.373 434 HD2 PRO 96 1HD PRO 96 8.120 0.251 7.518 435 HD3 PRO 96 2HD PRO 96 8.547 0.978 5.960 436 H ASP 97 H ASP 97 10.140 -4.286 6.673 437 HA ASP 97 HA ASP 97 10.166 -5.725 8.423 438 HB2 ASP 97 1HB ASP 97 9.216 -3.254 9.583 439 HB3 ASP 97 2HB ASP 97 8.491 -4.640 10.391 440 H PHE 98 H PHE 98 7.533 -5.197 6.589 441 HA PHE 98 HA PHE 98 5.676 -6.410 6.109 442 HB2 PHE 98 1HB PHE 98 6.747 -8.353 8.163 443 HB3 PHE 98 2HB PHE 98 5.461 -8.688 7.013 444 HD1 PHE 98 HD2 PHE 98 6.765 -7.283 4.629 445 HD2 PHE 98 HD1 PHE 98 8.247 -10.035 7.516 446 HE1 PHE 98 HE2 PHE 98 8.429 -8.084 3.004 447 HE2 PHE 98 HE1 PHE 98 9.913 -10.842 5.897 448 HZ PHE 98 HZ PHE 98 10.007 -9.867 3.638 449 H ASN 99 H ASN 99 3.696 -5.810 6.661 450 HA ASN 99 HA ASN 99 2.676 -6.196 9.330 451 HB2 ASN 99 1HB ASN 99 3.862 -3.733 8.733 452 HB3 ASN 99 2HB ASN 99 2.130 -3.448 8.643 453 HD21 ASN 99 2HD2 ASN 99 4.699 -3.345 10.648 454 HD22 ASN 99 1HD2 ASN 99 3.895 -3.557 12.172 455 H PHE 100 H PHE 100 1.882 -7.355 7.032 456 HA PHE 100 HA PHE 100 0.023 -6.265 5.392 457 HB2 PHE 100 1HB PHE 100 -1.080 -8.574 5.399 458 HB3 PHE 100 2HB PHE 100 0.622 -8.490 4.967 459 HD1 PHE 100 HD2 PHE 100 2.344 -9.067 6.716 460 HD2 PHE 100 HD1 PHE 100 -1.807 -9.874 7.184 461 HE1 PHE 100 HE2 PHE 100 2.863 -10.737 8.449 462 HE2 PHE 100 HE1 PHE 100 -1.300 -11.527 8.919 463 HZ PHE 100 HZ PHE 100 1.042 -11.970 9.555 464 H ALA 101 H ALA 101 -2.258 -6.289 5.286 465 HA ALA 101 HA ALA 101 -3.816 -6.438 7.728 466 HB1 ALA 101 3HB ALA 101 -3.630 -4.254 8.183 467 HB2 ALA 101 1HB ALA 101 -4.635 -3.979 6.759 468 HB3 ALA 101 2HB ALA 101 -2.877 -3.911 6.626 469 H TRP 102 H TRP 102 -6.186 -5.828 7.205 470 HA TRP 102 HA TRP 102 -6.843 -6.788 4.491 471 HB2 TRP 102 1HB TRP 102 -8.588 -7.158 6.929 472 HB3 TRP 102 2HB TRP 102 -8.741 -7.940 5.360 473 HD1 TRP 102 HD1 TRP 102 -5.566 -8.770 5.199 474 HE1 TRP 102 HE1 TRP 102 -4.788 -10.773 6.614 475 HE3 TRP 102 HE3 TRP 102 -9.368 -8.879 8.618 476 HZ2 TRP 102 HZ2 TRP 102 -5.668 -12.212 8.877 477 HZ3 TRP 102 HZ3 TRP 102 -9.323 -10.602 10.375 478 HH2 TRP 102 HH2 TRP 102 -7.510 -12.233 10.500 479 H VAL 103 H VAL 103 -7.746 -5.267 3.260 480 HA VAL 103 HA VAL 103 -9.374 -3.172 4.558 481 HB VAL 103 HB VAL 103 -7.923 -2.899 1.929 482 HG11 VAL 103 1HG1 VAL 103 -9.491 -1.246 1.848 483 HG12 VAL 103 2HG1 VAL 103 -8.232 -0.401 2.748 484 HG13 VAL 103 3HG1 VAL 103 -9.600 -1.111 3.604 485 HG21 VAL 103 3HG2 VAL 103 -6.030 -2.266 2.941 486 HG22 VAL 103 1HG2 VAL 103 -6.671 -3.098 4.358 487 HG23 VAL 103 2HG2 VAL 103 -6.890 -1.357 4.184 488 H LYS 104 H LYS 104 -11.285 -2.460 3.459 489 HA LYS 104 HA LYS 104 -12.539 -4.592 1.946 490 HB2 LYS 104 1HB LYS 104 -13.488 -2.162 3.376 491 HB3 LYS 104 2HB LYS 104 -14.496 -2.782 2.079 492 HG2 LYS 104 1HG LYS 104 -14.051 -5.061 3.402 493 HG3 LYS 104 2HG LYS 104 -13.914 -3.916 4.738 494 HD2 LYS 104 1HD LYS 104 -16.117 -3.476 4.735 495 HD3 LYS 104 2HD LYS 104 -16.196 -3.410 2.974 496 HE2 LYS 104 1HE LYS 104 -17.378 -5.311 3.186 497 HE3 LYS 104 2HE LYS 104 -15.793 -6.060 3.366 498 HZ1 LYS 104 3HZ LYS 104 -16.137 -6.467 5.535 499 HZ2 LYS 104 1HZ LYS 104 -17.774 -6.328 5.130 500 HZ3 LYS 104 2HZ LYS 104 -16.958 -5.015 5.810 501 H ARG 105 H ARG 105 -10.437 -2.844 0.669 502 HA ARG 105 HA ARG 105 -10.014 -2.168 -1.467 503 HB2 ARG 105 1HB ARG 105 -12.942 -2.367 -2.125 504 HB3 ARG 105 2HB ARG 105 -11.572 -2.457 -3.218 505 HG2 ARG 105 1HG ARG 105 -11.421 -4.657 -2.977 506 HG3 ARG 105 2HG ARG 105 -11.446 -4.536 -1.218 507 HD2 ARG 105 1HD ARG 105 -13.367 -5.733 -1.593 508 HD3 ARG 105 2HD ARG 105 -13.999 -4.091 -1.590 509 HE ARG 105 HE ARG 105 -13.630 -5.811 -3.930 510 HH11 ARG 105 1HH1 ARG 105 -14.774 -2.775 -2.584 511 HH12 ARG 105 2HH1 ARG 105 -15.689 -2.360 -3.990 512 HH21 ARG 105 1HH2 ARG 105 -14.849 -5.247 -5.774 513 HH22 ARG 105 2HH2 ARG 105 -15.733 -3.760 -5.798 514 H ASN 106 H ASN 106 -12.524 -0.680 0.407 515 HA ASN 106 HA ASN 106 -12.858 1.662 -1.147 516 HB2 ASN 106 1HB ASN 106 -13.329 1.336 1.823 517 HB3 ASN 106 2HB ASN 106 -14.033 2.557 0.769 518 HD21 ASN 106 2HD2 ASN 106 -15.351 0.596 2.473 519 HD22 ASN 106 1HD2 ASN 106 -16.364 -0.349 1.425 520 H SER 107 H SER 107 -10.782 0.851 1.610 521 HA SER 107 HA SER 107 -9.594 3.509 1.562 522 HB2 SER 107 1HB SER 107 -9.575 1.206 3.440 523 HB3 SER 107 2HB SER 107 -8.147 2.241 3.431 524 HG SER 107 HG SER 107 -9.371 3.360 4.757 525 H VAL 108 H VAL 108 -9.214 1.318 -0.587 526 HA VAL 108 HA VAL 108 -6.271 1.438 -0.608 527 HB VAL 108 HB VAL 108 -7.964 -0.797 -1.727 528 HG11 VAL 108 1HG1 VAL 108 -6.150 -1.555 -2.781 529 HG12 VAL 108 2HG1 VAL 108 -5.149 -1.354 -1.345 530 HG13 VAL 108 3HG1 VAL 108 -5.396 0.001 -2.443 531 HG21 VAL 108 3HG2 VAL 108 -7.673 -1.998 0.155 532 HG22 VAL 108 1HG2 VAL 108 -7.479 -0.413 0.902 533 HG23 VAL 108 2HG2 VAL 108 -6.058 -1.352 0.446 534 H LYS 109 H LYS 109 -5.276 1.941 -2.548 535 HA LYS 109 HA LYS 109 -6.979 2.420 -4.888 536 HB2 LYS 109 1HB LYS 109 -6.492 4.530 -3.458 537 HB3 LYS 109 2HB LYS 109 -4.866 4.412 -4.115 538 HG2 LYS 109 1HG LYS 109 -5.525 4.980 -6.228 539 HG3 LYS 109 2HG LYS 109 -7.159 4.349 -6.007 540 HD2 LYS 109 1HD LYS 109 -7.050 6.381 -4.167 541 HD3 LYS 109 2HD LYS 109 -6.087 7.020 -5.499 542 HE2 LYS 109 1HE LYS 109 -8.060 6.217 -6.979 543 HE3 LYS 109 2HE LYS 109 -8.968 6.201 -5.467 544 HZ1 LYS 109 3HZ LYS 109 -8.735 8.486 -5.215 545 HZ2 LYS 109 1HZ LYS 109 -9.012 8.313 -6.875 546 HZ3 LYS 109 2HZ LYS 109 -7.444 8.590 -6.303 547 HA PRO 110 HA PRO 110 -3.796 0.253 -7.076 548 HB2 PRO 110 1HB PRO 110 -4.368 2.092 -9.331 549 HB3 PRO 110 2HB PRO 110 -4.431 0.328 -9.275 550 HG2 PRO 110 1HG PRO 110 -6.664 1.789 -9.326 551 HG3 PRO 110 2HG PRO 110 -6.558 0.301 -8.367 552 HD2 PRO 110 1HD PRO 110 -6.429 3.150 -7.472 553 HD3 PRO 110 2HD PRO 110 -7.196 1.752 -6.689 554 H LEU 111 H LEU 111 -1.681 0.550 -6.800 555 HA LEU 111 HA LEU 111 -0.552 3.236 -7.254 556 HB2 LEU 111 1HB LEU 111 -0.441 2.445 -4.911 557 HB3 LEU 111 2HB LEU 111 0.476 1.050 -5.441 558 HG LEU 111 HG LEU 111 2.244 2.646 -6.273 559 HD11 LEU 111 1HD1 LEU 111 0.771 4.631 -6.378 560 HD12 LEU 111 2HD1 LEU 111 2.248 4.908 -5.456 561 HD13 LEU 111 3HD1 LEU 111 0.720 4.649 -4.616 562 HD21 LEU 111 3HD2 LEU 111 2.859 1.589 -4.329 563 HD22 LEU 111 1HD2 LEU 111 1.512 2.257 -3.408 564 HD23 LEU 111 2HD2 LEU 111 2.891 3.276 -3.817 565 H LEU 112 H LEU 112 1.482 3.398 -8.295 566 HA LEU 112 HA LEU 112 2.370 0.972 -9.702 567 HB2 LEU 112 1HB LEU 112 2.960 2.673 -11.598 568 HB3 LEU 112 2HB LEU 112 1.339 2.020 -11.463 569 HG LEU 112 HG LEU 112 1.853 4.575 -10.048 570 HD11 LEU 112 1HD1 LEU 112 1.656 5.917 -12.030 571 HD12 LEU 112 2HD1 LEU 112 1.539 4.479 -13.045 572 HD13 LEU 112 3HD1 LEU 112 3.045 4.845 -12.205 573 HD21 LEU 112 3HD2 LEU 112 -0.391 4.950 -10.433 574 HD22 LEU 112 1HD2 LEU 112 -0.340 3.192 -10.296 575 HD23 LEU 112 2HD2 LEU 112 -0.420 3.951 -11.887 576 H ASP 113 H ASP 113 4.595 1.189 -10.610 577 HA ASP 113 HA ASP 113 6.445 1.823 -8.613 578 HB2 ASP 113 1HB ASP 113 6.965 1.537 -11.581 579 HB3 ASP 113 2HB ASP 113 8.169 1.414 -10.303 580 H SER 114 H SER 114 5.510 3.635 -11.526 581 HA SER 114 HA SER 114 7.364 5.728 -11.242 582 HB2 SER 114 1HB SER 114 5.632 5.110 -13.178 583 HB3 SER 114 2HB SER 114 4.663 6.333 -12.359 584 HG SER 114 HG SER 114 5.907 7.366 -13.884 585 H GLU 115 H GLU 115 4.274 5.122 -9.695 586 HA GLU 115 HA GLU 115 4.076 7.777 -8.585 587 HB2 GLU 115 1HB GLU 115 2.541 5.220 -8.212 588 HB3 GLU 115 2HB GLU 115 2.295 6.576 -7.120 589 HG2 GLU 115 1HG GLU 115 1.905 6.619 -10.105 590 HG3 GLU 115 2HG GLU 115 0.632 6.553 -8.890 591 H ILE 116 H ILE 116 5.193 4.619 -7.497 592 HA ILE 116 HA ILE 116 5.552 5.264 -4.776 593 HB ILE 116 HB ILE 116 7.035 3.205 -6.428 594 HG12 ILE 116 1HG1 ILE 116 4.833 2.551 -4.509 595 HG13 ILE 116 2HG1 ILE 116 4.410 3.158 -6.105 596 HG21 ILE 116 1HG2 ILE 116 8.123 3.877 -4.271 597 HG22 ILE 116 2HG2 ILE 116 7.682 2.173 -4.382 598 HG23 ILE 116 3HG2 ILE 116 6.687 3.281 -3.438 599 HD11 ILE 116 3HD1 ILE 116 4.633 0.589 -5.620 600 HD12 ILE 116 1HD1 ILE 116 6.341 0.912 -5.921 601 HD13 ILE 116 2HD1 ILE 116 5.142 1.277 -7.161 602 H ALA 117 H ALA 117 7.929 5.043 -7.438 603 HA ALA 117 HA ALA 117 10.145 6.039 -6.089 604 HB1 ALA 117 3HB ALA 117 9.717 6.819 -8.935 605 HB2 ALA 117 1HB ALA 117 9.853 5.106 -8.534 606 HB3 ALA 117 2HB ALA 117 11.169 6.210 -8.140 607 H LYS 118 H LYS 118 7.516 7.727 -7.726 608 HA LYS 118 HA LYS 118 8.553 10.335 -7.522 609 HB2 LYS 118 1HB LYS 118 6.298 9.191 -8.621 610 HB3 LYS 118 2HB LYS 118 5.649 10.186 -7.325 611 HG2 LYS 118 1HG LYS 118 5.810 11.914 -8.677 612 HG3 LYS 118 2HG LYS 118 7.567 11.766 -8.546 613 HD2 LYS 118 1HD LYS 118 7.695 10.450 -10.515 614 HD3 LYS 118 2HD LYS 118 5.950 10.186 -10.540 615 HE2 LYS 118 1HE LYS 118 6.556 11.792 -12.243 616 HE3 LYS 118 2HE LYS 118 5.620 12.591 -10.980 617 HZ1 LYS 118 3HZ LYS 118 7.394 13.810 -10.307 618 HZ2 LYS 118 1HZ LYS 118 7.852 13.605 -11.922 619 HZ3 LYS 118 2HZ LYS 118 8.532 12.629 -10.720 620 H PHE 119 H PHE 119 6.173 8.641 -5.477 621 HA PHE 119 HA PHE 119 5.701 10.604 -3.594 622 HB2 PHE 119 1HB PHE 119 4.458 8.574 -3.444 623 HB3 PHE 119 2HB PHE 119 5.919 7.607 -3.286 624 HD1 PHE 119 HD2 PHE 119 7.270 7.803 -1.155 625 HD2 PHE 119 HD1 PHE 119 3.337 9.384 -1.551 626 HE1 PHE 119 HE2 PHE 119 7.046 7.844 1.296 627 HE2 PHE 119 HE1 PHE 119 3.111 9.432 0.899 628 HZ PHE 119 HZ PHE 119 4.970 8.661 2.318 629 H LEU 120 H LEU 120 8.361 8.262 -3.639 630 HA LEU 120 HA LEU 120 9.577 9.163 -1.252 631 HB2 LEU 120 1HB LEU 120 10.730 7.695 -3.619 632 HB3 LEU 120 2HB LEU 120 11.580 7.962 -2.108 633 HG LEU 120 HG LEU 120 8.943 6.695 -1.809 634 HD11 LEU 120 1HD1 LEU 120 10.151 4.448 -2.426 635 HD12 LEU 120 2HD1 LEU 120 11.088 5.489 -3.498 636 HD13 LEU 120 3HD1 LEU 120 9.335 5.399 -3.668 637 HD21 LEU 120 3HD2 LEU 120 10.459 6.991 0.058 638 HD22 LEU 120 1HD2 LEU 120 11.709 6.074 -0.780 639 HD23 LEU 120 2HD2 LEU 120 10.223 5.276 -0.269 640 H GLY 121 H GLY 121 9.854 10.120 -4.639 641 HA2 GLY 121 1HA GLY 121 12.065 11.929 -4.056 642 HA3 GLY 121 2HA GLY 121 11.338 11.637 -5.627 643 H SER 122 H SER 122 9.130 12.273 -3.043 644 HA SER 122 HA SER 122 8.153 14.613 -4.315 645 HB2 SER 122 1HB SER 122 7.499 13.109 -1.814 646 HB3 SER 122 2HB SER 122 6.900 14.758 -1.976 647 HG SER 122 HG SER 122 6.063 14.020 -4.079 648 H SER 123 H SER 123 7.671 16.562 -2.694 649 HA SER 123 HA SER 123 10.007 17.231 -1.096 650 HB2 SER 123 1HB SER 123 9.832 18.072 -3.772 651 HB3 SER 123 2HB SER 123 9.441 19.492 -2.802 652 HG SER 123 HG SER 123 11.394 19.148 -1.656 653 H LYS 124 H LYS 124 7.362 16.763 -0.265 654 HA LYS 124 HA LYS 124 6.633 19.446 0.690 655 HB2 LYS 124 1HB LYS 124 4.246 18.710 0.677 656 HB3 LYS 124 2HB LYS 124 4.962 18.883 -0.921 657 HG2 LYS 124 1HG LYS 124 5.438 16.240 -0.298 658 HG3 LYS 124 2HG LYS 124 3.834 16.543 0.374 659 HD2 LYS 124 1HD LYS 124 3.493 17.732 -1.972 660 HD3 LYS 124 2HD LYS 124 4.764 16.603 -2.447 661 HE2 LYS 124 1HE LYS 124 3.093 14.991 -1.016 662 HE3 LYS 124 2HE LYS 124 1.953 16.109 -1.765 663 HZ1 LYS 124 3HZ LYS 124 3.939 14.387 -3.140 664 HZ2 LYS 124 1HZ LYS 124 3.039 15.590 -3.922 665 HZ3 LYS 124 2HZ LYS 124 2.254 14.268 -3.216 666 H ARG 125 H ARG 125 6.089 15.968 1.282 667 HA ARG 125 HA ARG 125 6.573 16.443 4.126 668 HB2 ARG 125 1HB ARG 125 4.115 16.357 3.737 669 HB3 ARG 125 2HB ARG 125 4.306 14.750 3.051 670 HG2 ARG 125 1HG ARG 125 4.200 13.833 5.060 671 HG3 ARG 125 2HG ARG 125 5.539 14.829 5.631 672 HD2 ARG 125 1HD ARG 125 3.604 16.665 5.698 673 HD3 ARG 125 2HD ARG 125 2.611 15.226 5.911 674 HE ARG 125 HE ARG 125 3.480 14.975 8.017 675 HH11 ARG 125 1HH1 ARG 125 5.447 17.268 6.249 676 HH12 ARG 125 2HH1 ARG 125 6.361 17.747 7.636 677 HH21 ARG 125 1HH2 ARG 125 4.695 15.605 9.848 678 HH22 ARG 125 2HH2 ARG 125 5.933 16.802 9.682 679 H LYS 126 H LYS 126 8.468 15.434 4.248 680 HA LYS 126 HA LYS 126 8.611 12.628 3.364 681 HB2 LYS 126 1HB LYS 126 10.151 14.650 2.387 682 HB3 LYS 126 2HB LYS 126 11.155 14.081 3.710 683 HG2 LYS 126 1HG LYS 126 11.842 12.930 1.760 684 HG3 LYS 126 2HG LYS 126 10.960 11.777 2.760 685 HD2 LYS 126 1HD LYS 126 10.348 11.578 0.394 686 HD3 LYS 126 2HD LYS 126 8.974 12.073 1.382 687 HE2 LYS 126 1HE LYS 126 10.565 14.279 0.262 688 HE3 LYS 126 2HE LYS 126 9.730 13.281 -0.928 689 HZ1 LYS 126 3HZ LYS 126 7.676 13.634 0.426 690 HZ2 LYS 126 1HZ LYS 126 8.280 15.023 -0.322 691 HZ3 LYS 126 2HZ LYS 126 8.529 14.780 1.327 692 H SER 127 H SER 127 8.983 11.164 4.899 693 HA SER 127 HA SER 127 10.388 11.960 7.342 694 HB2 SER 127 1HB SER 127 8.754 11.146 8.815 695 HB3 SER 127 2HB SER 127 7.805 11.991 7.594 696 HG SER 127 HG SER 127 6.999 9.883 8.130 697 H LYS 128 H LYS 128 11.380 10.195 8.475 698 HA LYS 128 HA LYS 128 12.604 8.304 6.838 699 HB2 LYS 128 1HB LYS 128 13.209 9.155 9.247 700 HB3 LYS 128 2HB LYS 128 12.261 7.770 9.769 701 HG2 LYS 128 1HG LYS 128 14.042 6.487 9.504 702 HG3 LYS 128 2HG LYS 128 14.016 6.836 7.776 703 HD2 LYS 128 1HD LYS 128 15.748 8.273 7.915 704 HD3 LYS 128 2HD LYS 128 15.185 8.960 9.438 705 HE2 LYS 128 1HE LYS 128 16.697 6.378 9.055 706 HE3 LYS 128 2HE LYS 128 17.301 7.861 9.791 707 HZ1 LYS 128 3HZ LYS 128 16.723 6.792 11.672 708 HZ2 LYS 128 1HZ LYS 128 15.582 5.800 10.912 709 HZ3 LYS 128 2HZ LYS 128 15.181 7.391 11.325 710 H GLU 129 H GLU 129 9.867 7.916 9.074 711 HA GLU 129 HA GLU 129 9.478 5.161 8.614 712 HB2 GLU 129 1HB GLU 129 7.220 5.525 9.574 713 HB3 GLU 129 2HB GLU 129 8.505 6.208 10.561 714 HG2 GLU 129 1HG GLU 129 7.851 8.333 9.010 715 HG3 GLU 129 2HG GLU 129 6.292 7.528 9.161 716 H LEU 130 H LEU 130 8.298 8.040 6.937 717 HA LEU 130 HA LEU 130 6.440 6.554 5.317 718 HB2 LEU 130 1HB LEU 130 7.378 9.384 5.385 719 HB3 LEU 130 2HB LEU 130 6.607 8.795 3.927 720 HG LEU 130 HG LEU 130 5.205 8.344 6.516 721 HD11 LEU 130 1HD1 LEU 130 5.349 10.523 7.031 722 HD12 LEU 130 2HD1 LEU 130 4.150 10.721 5.754 723 HD13 LEU 130 3HD1 LEU 130 5.859 10.981 5.406 724 HD21 LEU 130 3HD2 LEU 130 3.273 8.377 5.201 725 HD22 LEU 130 1HD2 LEU 130 4.461 7.558 4.188 726 HD23 LEU 130 2HD2 LEU 130 4.068 9.252 3.892 727 H ILE 131 H ILE 131 9.636 8.036 4.718 728 HA ILE 131 HA ILE 131 9.818 7.301 2.019 729 HB ILE 131 HB ILE 131 12.116 7.561 3.962 730 HG12 ILE 131 1HG1 ILE 131 11.397 9.730 2.055 731 HG13 ILE 131 2HG1 ILE 131 10.363 9.533 3.466 732 HG21 ILE 131 1HG2 ILE 131 13.496 7.195 2.253 733 HG22 ILE 131 2HG2 ILE 131 12.618 8.320 1.215 734 HG23 ILE 131 3HG2 ILE 131 12.090 6.640 1.343 735 HD11 ILE 131 3HD1 ILE 131 11.816 10.671 4.678 736 HD12 ILE 131 1HD1 ILE 131 12.863 10.843 3.269 737 HD13 ILE 131 2HD1 ILE 131 13.055 9.461 4.347 738 H GLU 132 H GLU 132 11.169 5.644 4.885 739 HA GLU 132 HA GLU 132 12.214 3.424 3.581 740 HB2 GLU 132 1HB GLU 132 12.041 4.220 6.186 741 HB3 GLU 132 2HB GLU 132 10.944 2.846 6.172 742 HG2 GLU 132 1HG GLU 132 12.992 1.739 4.883 743 HG3 GLU 132 2HG GLU 132 13.877 2.944 5.816 744 H ALA 133 H ALA 133 8.916 4.217 4.396 745 HA ALA 133 HA ALA 133 7.778 1.654 4.114 746 HB1 ALA 133 3HB ALA 133 6.795 3.903 5.042 747 HB2 ALA 133 1HB ALA 133 5.740 2.686 4.321 748 HB3 ALA 133 2HB ALA 133 6.238 4.093 3.379 749 H TYR 134 H TYR 134 7.832 4.390 1.839 750 HA TYR 134 HA TYR 134 6.791 2.858 -0.310 751 HB2 TYR 134 1HB TYR 134 7.860 5.580 0.040 752 HB3 TYR 134 2HB TYR 134 8.081 4.902 -1.571 753 HD1 TYR 134 HD2 TYR 134 5.417 5.293 1.027 754 HD2 TYR 134 HD1 TYR 134 6.382 5.155 -3.113 755 HE1 TYR 134 HE2 TYR 134 3.091 5.866 0.469 756 HE2 TYR 134 HE1 TYR 134 4.060 5.726 -3.679 757 HH TYR 134 HH TYR 134 2.134 6.940 -2.518 758 H GLU 135 H GLU 135 10.040 3.477 0.842 759 HA GLU 135 HA GLU 135 11.395 2.482 -1.454 760 HB2 GLU 135 1HB GLU 135 12.176 3.763 0.847 761 HB3 GLU 135 2HB GLU 135 12.757 2.126 1.125 762 HG2 GLU 135 1HG GLU 135 13.700 2.390 -1.308 763 HG3 GLU 135 2HG GLU 135 13.575 4.107 -0.934 764 H ALA 136 H ALA 136 9.962 1.022 1.384 765 HA ALA 136 HA ALA 136 11.185 -1.562 0.946 766 HB1 ALA 136 3HB ALA 136 10.556 -0.704 3.204 767 HB2 ALA 136 1HB ALA 136 9.912 -2.302 2.830 768 HB3 ALA 136 2HB ALA 136 8.865 -0.887 2.745 769 H SER 137 H SER 137 8.251 0.090 0.049 770 HA SER 137 HA SER 137 6.851 -2.281 -0.785 771 HB2 SER 137 1HB SER 137 5.078 -0.857 -1.389 772 HB3 SER 137 2HB SER 137 5.808 -0.061 0.004 773 HG SER 137 HG SER 137 5.765 1.570 -1.364 774 H LYS 138 H LYS 138 9.177 -0.159 -2.192 775 HA LYS 138 HA LYS 138 8.562 -0.269 -4.898 776 HB2 LYS 138 1HB LYS 138 11.078 0.072 -3.341 777 HB3 LYS 138 2HB LYS 138 11.218 -0.249 -5.062 778 HG2 LYS 138 1HG LYS 138 9.564 1.985 -3.915 779 HG3 LYS 138 2HG LYS 138 11.243 2.161 -4.423 780 HD2 LYS 138 1HD LYS 138 9.796 0.876 -6.515 781 HD3 LYS 138 2HD LYS 138 8.893 2.303 -6.009 782 HE2 LYS 138 1HE LYS 138 11.655 2.115 -7.147 783 HE3 LYS 138 2HE LYS 138 10.303 3.120 -7.666 784 HZ1 LYS 138 3HZ LYS 138 10.612 4.221 -5.369 785 HZ2 LYS 138 1HZ LYS 138 11.682 4.616 -6.618 786 HZ3 LYS 138 2HZ LYS 138 12.156 3.531 -5.413 787 H THR 139 H THR 139 9.790 -2.769 -2.827 788 HA THR 139 HA THR 139 11.176 -4.512 -4.331 789 HB THR 139 HB THR 139 9.589 -6.314 -3.184 790 HG1 THR 139 HG1 THR 139 8.732 -5.298 -1.251 791 HG21 THR 139 3HG2 THR 139 10.931 -4.880 -1.053 792 HG22 THR 139 1HG2 THR 139 11.960 -5.131 -2.464 793 HG23 THR 139 2HG2 THR 139 11.196 -6.511 -1.673 794 HA PRO 140 HA PRO 140 8.547 -4.848 -8.025 795 HB2 PRO 140 1HB PRO 140 10.757 -6.755 -8.650 796 HB3 PRO 140 2HB PRO 140 10.040 -5.494 -9.656 797 HG2 PRO 140 1HG PRO 140 12.419 -5.123 -8.529 798 HG3 PRO 140 2HG PRO 140 11.242 -3.799 -8.627 799 HD2 PRO 140 1HD PRO 140 12.014 -5.480 -6.282 800 HD3 PRO 140 2HD PRO 140 11.589 -3.757 -6.347 801 HA PRO 141 HA PRO 141 8.682 -9.856 -7.294 802 HB2 PRO 141 1HB PRO 141 9.112 -9.362 -4.363 803 HB3 PRO 141 2HB PRO 141 9.509 -10.792 -5.333 804 HG2 PRO 141 1HG PRO 141 11.404 -9.057 -4.702 805 HG3 PRO 141 2HG PRO 141 11.342 -9.754 -6.332 806 HD2 PRO 141 1HD PRO 141 10.613 -7.024 -5.412 807 HD3 PRO 141 2HD PRO 141 11.276 -7.550 -6.970 808 H ASP 142 H ASP 142 6.759 -10.819 -6.981 809 HA ASP 142 HA ASP 142 4.641 -9.194 -5.777 810 HB2 ASP 142 1HB ASP 142 4.473 -11.621 -7.576 811 HB3 ASP 142 2HB ASP 142 3.086 -10.750 -6.941 812 H LEU 143 H LEU 143 3.500 -9.807 -4.029 813 HA LEU 143 HA LEU 143 2.829 -10.933 -2.187 814 HB2 LEU 143 1HB LEU 143 3.872 -13.509 -3.321 815 HB3 LEU 143 2HB LEU 143 2.514 -13.253 -2.244 816 HG LEU 143 HG LEU 143 2.594 -12.490 -5.166 817 HD11 LEU 143 1HD1 LEU 143 1.590 -14.435 -5.684 818 HD12 LEU 143 2HD1 LEU 143 0.696 -14.507 -4.165 819 HD13 LEU 143 3HD1 LEU 143 2.390 -14.995 -4.214 820 HD21 LEU 143 3HD2 LEU 143 0.055 -12.614 -3.654 821 HD22 LEU 143 1HD2 LEU 143 0.551 -11.539 -4.961 822 HD23 LEU 143 2HD2 LEU 143 1.109 -11.241 -3.316 823 H LYS 144 H LYS 144 5.738 -12.796 -3.135 824 HA LYS 144 HA LYS 144 7.657 -13.282 -2.021 825 HB2 LYS 144 1HB LYS 144 7.513 -10.599 -2.072 826 HB3 LYS 144 2HB LYS 144 7.498 -10.843 -0.332 827 HG2 LYS 144 1HG LYS 144 9.622 -11.835 -0.339 828 HG3 LYS 144 2HG LYS 144 9.584 -12.100 -2.083 829 HD2 LYS 144 1HD LYS 144 11.067 -10.256 -1.564 830 HD3 LYS 144 2HD LYS 144 9.652 -9.659 -2.431 831 HE2 LYS 144 1HE LYS 144 9.432 -9.679 0.508 832 HE3 LYS 144 2HE LYS 144 10.621 -8.559 -0.155 833 HZ1 LYS 144 3HZ LYS 144 7.829 -8.665 -1.145 834 HZ2 LYS 144 1HZ LYS 144 8.973 -7.441 -1.370 835 HZ3 LYS 144 2HZ LYS 144 8.286 -7.686 0.154 836 H GLU 145 H GLU 145 5.114 -14.162 -0.879 837 HA GLU 145 HA GLU 145 6.089 -15.037 1.683 838 HB2 GLU 145 1HB GLU 145 3.988 -12.952 1.475 839 HB3 GLU 145 2HB GLU 145 3.676 -14.260 2.605 840 HG2 GLU 145 1HG GLU 145 6.366 -13.191 2.849 841 HG3 GLU 145 2HG GLU 145 5.120 -11.975 3.111 842 H GLU 146 H GLU 146 3.150 -14.735 -0.299 843 HA GLU 146 HA GLU 146 2.220 -17.365 0.464 844 HB2 GLU 146 1HB GLU 146 0.784 -15.267 0.002 845 HB3 GLU 146 2HB GLU 146 1.031 -15.641 -1.696 846 HG2 GLU 146 1HG GLU 146 0.150 -17.939 -0.139 847 HG3 GLU 146 2HG GLU 146 -0.987 -16.594 -0.104 848 H SER 147 H SER 147 1.676 -19.021 -1.107 849 HA SER 147 HA SER 147 2.784 -18.942 -3.745 850 HB2 SER 147 1HB SER 147 4.684 -19.505 -1.928 851 HB3 SER 147 2HB SER 147 4.043 -21.128 -2.176 852 HG SER 147 HG SER 147 5.043 -19.367 -4.168 853 H SER 148 H SER 148 2.786 -21.358 -4.648 854 HA SER 148 HA SER 148 0.098 -22.345 -4.119 855 HB2 SER 148 1HB SER 148 0.506 -23.789 -6.115 856 HB3 SER 148 2HB SER 148 0.675 -22.066 -6.447 857 HG SER 148 HG SER 148 2.441 -23.972 -6.880 858 H THR 149 H THR 149 0.559 -23.209 -2.020 859 HA THR 149 HA THR 149 2.460 -25.257 -1.575 860 HB THR 149 HB THR 149 0.821 -25.732 0.430 861 HG1 THR 149 HG1 THR 149 -0.942 -24.570 -0.342 862 HG21 THR 149 3HG2 THR 149 2.771 -24.726 1.094 863 HG22 THR 149 1HG2 THR 149 1.581 -23.486 1.495 864 HG23 THR 149 2HG2 THR 149 2.548 -23.340 0.027 865 H ASP 150 H ASP 150 2.404 -27.384 -1.948 866 HA ASP 150 HA ASP 150 0.243 -28.517 -3.454 867 HB2 ASP 150 1HB ASP 150 1.603 -30.559 -3.484 868 HB3 ASP 150 2HB ASP 150 2.567 -29.150 -3.909 869 H LEU 151 H LEU 151 -0.430 -30.872 -2.787 870 HA LEU 151 HA LEU 151 -1.545 -30.675 -0.078 871 HB2 LEU 151 1HB LEU 151 -2.597 -31.491 -2.622 872 HB3 LEU 151 2HB LEU 151 -2.728 -32.820 -1.488 873 HG LEU 151 HG LEU 151 -3.659 -30.142 -0.584 874 HD11 LEU 151 1HD1 LEU 151 -4.827 -31.680 -2.826 875 HD12 LEU 151 2HD1 LEU 151 -4.875 -29.950 -2.485 876 HD13 LEU 151 3HD1 LEU 151 -5.946 -31.051 -1.617 877 HD21 LEU 151 3HD2 LEU 151 -5.448 -31.669 0.397 878 HD22 LEU 151 1HD2 LEU 151 -3.814 -31.835 1.036 879 HD23 LEU 151 2HD2 LEU 151 -4.429 -33.011 -0.126 880 H GLU 152 H GLU 152 -2.176 -33.144 0.627 881 HA GLU 152 HA GLU 152 0.403 -34.567 0.735 882 HB2 GLU 152 1HB GLU 152 -0.713 -33.579 2.862 883 HB3 GLU 152 2HB GLU 152 -1.817 -34.941 2.727 884 HG2 GLU 152 1HG GLU 152 0.426 -36.313 2.577 885 HG3 GLU 152 2HG GLU 152 1.077 -34.899 3.405 Start of MODEL 17 1 H1 SER 45 1H SER 45 -13.175 8.021 -16.532 2 H2 SER 45 2H SER 45 -12.044 9.002 -15.694 3 H3 SER 45 3H SER 45 -13.120 7.990 -14.820 4 HA SER 45 HA SER 45 -11.143 6.971 -16.737 5 HB2 SER 45 1HB SER 45 -9.699 6.515 -14.803 6 HB3 SER 45 2HB SER 45 -10.020 8.242 -14.936 7 HG SER 45 HG SER 45 -11.276 8.167 -13.178 8 H ALA 46 H ALA 46 -10.479 4.700 -15.708 9 HA ALA 46 HA ALA 46 -12.990 3.220 -15.456 10 HB1 ALA 46 3HB ALA 46 -10.317 1.915 -15.770 11 HB2 ALA 46 1HB ALA 46 -11.086 2.699 -17.149 12 HB3 ALA 46 2HB ALA 46 -11.900 1.372 -16.323 13 H ASP 47 H ASP 47 -12.619 1.059 -14.111 14 HA ASP 47 HA ASP 47 -11.202 1.648 -11.618 15 HB2 ASP 47 1HB ASP 47 -13.176 0.902 -10.292 16 HB3 ASP 47 2HB ASP 47 -13.457 2.401 -11.169 17 H ASP 48 H ASP 48 -10.709 -0.211 -13.841 18 HA ASP 48 HA ASP 48 -11.132 -2.798 -12.513 19 HB2 ASP 48 1HB ASP 48 -11.748 -2.236 -15.034 20 HB3 ASP 48 2HB ASP 48 -10.050 -2.613 -15.293 21 H ARG 49 H ARG 49 -9.301 -1.479 -11.179 22 HA ARG 49 HA ARG 49 -6.681 -2.364 -12.195 23 HB2 ARG 49 1HB ARG 49 -7.112 -0.393 -9.951 24 HB3 ARG 49 2HB ARG 49 -5.648 -0.672 -10.880 25 HG2 ARG 49 1HG ARG 49 -8.132 0.373 -12.191 26 HG3 ARG 49 2HG ARG 49 -7.022 1.447 -11.343 27 HD2 ARG 49 1HD ARG 49 -6.191 -0.428 -13.552 28 HD3 ARG 49 2HD ARG 49 -6.640 1.256 -13.811 29 HE ARG 49 HE ARG 49 -4.557 0.893 -11.855 30 HH11 ARG 49 1HH1 ARG 49 -5.249 1.297 -15.268 31 HH12 ARG 49 2HH1 ARG 49 -3.674 1.909 -15.641 32 HH21 ARG 49 1HH2 ARG 49 -2.472 1.694 -12.365 33 HH22 ARG 49 2HH2 ARG 49 -2.101 2.131 -13.998 34 H LEU 50 H LEU 50 -5.180 -2.523 -9.971 35 HA LEU 50 HA LEU 50 -4.632 -3.756 -8.143 36 HB2 LEU 50 1HB LEU 50 -7.607 -4.072 -7.737 37 HB3 LEU 50 2HB LEU 50 -6.363 -4.455 -6.565 38 HG LEU 50 HG LEU 50 -5.848 -1.804 -7.152 39 HD11 LEU 50 1HD1 LEU 50 -8.024 -0.675 -6.871 40 HD12 LEU 50 2HD1 LEU 50 -8.829 -2.232 -7.068 41 HD13 LEU 50 3HD1 LEU 50 -7.897 -1.547 -8.399 42 HD21 LEU 50 3HD2 LEU 50 -7.706 -2.503 -4.929 43 HD22 LEU 50 1HD2 LEU 50 -6.290 -1.451 -4.928 44 HD23 LEU 50 2HD2 LEU 50 -6.087 -3.202 -4.950 45 H ASN 51 H ASN 51 -3.671 -5.643 -8.532 46 HA ASN 51 HA ASN 51 -5.323 -7.950 -9.282 47 HB2 ASN 51 1HB ASN 51 -2.763 -7.121 -10.668 48 HB3 ASN 51 2HB ASN 51 -3.566 -8.669 -10.904 49 HD21 ASN 51 2HD2 ASN 51 -5.227 -8.806 -12.311 50 HD22 ASN 51 1HD2 ASN 51 -5.881 -7.455 -13.185 51 H PHE 52 H PHE 52 -3.798 -10.011 -9.258 52 HA PHE 52 HA PHE 52 -2.848 -10.246 -6.578 53 HB2 PHE 52 1HB PHE 52 -2.696 -12.154 -8.923 54 HB3 PHE 52 2HB PHE 52 -2.192 -12.564 -7.284 55 HD1 PHE 52 HD2 PHE 52 -4.314 -11.367 -5.660 56 HD2 PHE 52 HD1 PHE 52 -4.547 -13.460 -9.359 57 HE1 PHE 52 HE2 PHE 52 -6.614 -12.054 -5.123 58 HE2 PHE 52 HE1 PHE 52 -6.847 -14.149 -8.827 59 HZ PHE 52 HZ PHE 52 -7.882 -13.447 -6.708 60 H GLY 53 H GLY 53 -0.916 -9.653 -5.847 61 HA2 GLY 53 1HA GLY 53 1.407 -9.568 -5.742 62 HA3 GLY 53 2HA GLY 53 1.479 -10.201 -7.380 63 H ASP 54 H ASP 54 0.171 -7.261 -5.815 64 HA ASP 54 HA ASP 54 1.856 -5.617 -7.530 65 HB2 ASP 54 1HB ASP 54 -1.154 -5.605 -7.528 66 HB3 ASP 54 2HB ASP 54 -0.237 -4.168 -7.976 67 H ARG 55 H ARG 55 1.503 -3.232 -6.926 68 HA ARG 55 HA ARG 55 1.477 -3.062 -3.999 69 HB2 ARG 55 1HB ARG 55 2.689 -0.934 -4.281 70 HB3 ARG 55 2HB ARG 55 3.530 -2.281 -5.031 71 HG2 ARG 55 1HG ARG 55 1.928 -1.215 -7.052 72 HG3 ARG 55 2HG ARG 55 2.588 0.177 -6.196 73 HD2 ARG 55 1HD ARG 55 4.160 -0.319 -7.870 74 HD3 ARG 55 2HD ARG 55 4.848 -0.970 -6.382 75 HE ARG 55 HE ARG 55 3.372 -2.984 -7.664 76 HH11 ARG 55 1HH1 ARG 55 6.328 -1.160 -8.096 77 HH12 ARG 55 2HH1 ARG 55 7.111 -2.413 -8.995 78 HH21 ARG 55 1HH2 ARG 55 4.413 -4.632 -8.839 79 HH22 ARG 55 2HH2 ARG 55 6.028 -4.385 -9.414 80 H ILE 56 H ILE 56 -0.289 -2.347 -3.061 81 HA ILE 56 HA ILE 56 -1.895 -0.274 -4.418 82 HB ILE 56 HB ILE 56 -3.931 -1.243 -3.481 83 HG12 ILE 56 1HG1 ILE 56 -3.334 -3.838 -2.780 84 HG13 ILE 56 2HG1 ILE 56 -1.994 -2.941 -2.074 85 HG21 ILE 56 1HG2 ILE 56 -2.300 -3.187 -5.106 86 HG22 ILE 56 2HG2 ILE 56 -3.326 -1.892 -5.723 87 HG23 ILE 56 3HG2 ILE 56 -4.047 -3.268 -4.886 88 HD11 ILE 56 3HD1 ILE 56 -3.478 -2.878 -0.356 89 HD12 ILE 56 1HD1 ILE 56 -4.883 -2.869 -1.421 90 HD13 ILE 56 2HD1 ILE 56 -3.936 -1.399 -1.201 91 H LEU 57 H LEU 57 -3.035 1.192 -3.053 92 HA LEU 57 HA LEU 57 -1.707 1.606 -0.475 93 HB2 LEU 57 1HB LEU 57 -2.381 3.333 -2.519 94 HB3 LEU 57 2HB LEU 57 -3.643 3.622 -1.338 95 HG LEU 57 HG LEU 57 -1.859 4.036 0.373 96 HD11 LEU 57 1HD1 LEU 57 0.290 4.746 -1.256 97 HD12 LEU 57 2HD1 LEU 57 -0.195 3.139 -1.800 98 HD13 LEU 57 3HD1 LEU 57 0.214 3.410 -0.107 99 HD21 LEU 57 3HD2 LEU 57 -1.571 6.270 -0.236 100 HD22 LEU 57 1HD2 LEU 57 -3.049 5.793 -1.073 101 HD23 LEU 57 2HD2 LEU 57 -1.527 5.894 -1.958 102 H VAL 58 H VAL 58 -2.836 1.811 1.468 103 HA VAL 58 HA VAL 58 -5.724 1.269 1.405 104 HB VAL 58 HB VAL 58 -5.449 -0.292 3.350 105 HG11 VAL 58 1HG1 VAL 58 -5.482 -2.062 1.958 106 HG12 VAL 58 2HG1 VAL 58 -3.972 -1.609 1.172 107 HG13 VAL 58 3HG1 VAL 58 -5.477 -0.818 0.710 108 HG21 VAL 58 3HG2 VAL 58 -2.939 0.585 3.563 109 HG22 VAL 58 1HG2 VAL 58 -2.647 -0.829 2.550 110 HG23 VAL 58 2HG2 VAL 58 -3.438 -1.014 4.116 111 H LYS 59 H LYS 59 -6.902 2.202 3.045 112 HA LYS 59 HA LYS 59 -5.469 4.157 4.688 113 HB2 LYS 59 1HB LYS 59 -7.304 4.983 3.272 114 HB3 LYS 59 2HB LYS 59 -8.421 3.896 4.082 115 HG2 LYS 59 1HG LYS 59 -8.879 5.733 5.291 116 HG3 LYS 59 2HG LYS 59 -7.465 5.217 6.211 117 HD2 LYS 59 1HD LYS 59 -6.222 6.657 4.351 118 HD3 LYS 59 2HD LYS 59 -7.785 7.477 4.314 119 HE2 LYS 59 1HE LYS 59 -7.640 7.842 6.734 120 HE3 LYS 59 2HE LYS 59 -6.071 7.037 6.758 121 HZ1 LYS 59 3HZ LYS 59 -5.410 8.814 5.058 122 HZ2 LYS 59 1HZ LYS 59 -5.552 9.282 6.678 123 HZ3 LYS 59 2HZ LYS 59 -6.785 9.649 5.582 124 H ALA 60 H ALA 60 -5.308 3.977 6.846 125 HA ALA 60 HA ALA 60 -6.862 1.846 8.173 126 HB1 ALA 60 3HB ALA 60 -4.660 1.123 8.302 127 HB2 ALA 60 1HB ALA 60 -4.893 1.941 9.848 128 HB3 ALA 60 2HB ALA 60 -4.033 2.754 8.542 129 HA PRO 61 HA PRO 61 -8.607 4.879 10.870 130 HB2 PRO 61 1HB PRO 61 -8.887 3.462 13.175 131 HB3 PRO 61 2HB PRO 61 -9.923 3.219 11.764 132 HG2 PRO 61 1HG PRO 61 -7.553 1.635 12.672 133 HG3 PRO 61 2HG PRO 61 -9.103 1.061 12.033 134 HD2 PRO 61 1HD PRO 61 -6.860 1.187 10.524 135 HD3 PRO 61 2HD PRO 61 -8.481 1.428 9.844 136 H GLY 62 H GLY 62 -7.044 6.436 11.164 137 HA2 GLY 62 1HA GLY 62 -5.972 7.628 12.994 138 HA3 GLY 62 2HA GLY 62 -5.336 6.087 13.545 139 H TYR 63 H TYR 63 -4.613 5.240 10.804 140 HA TYR 63 HA TYR 63 -2.248 6.965 10.460 141 HB2 TYR 63 1HB TYR 63 -2.569 4.002 9.956 142 HB3 TYR 63 2HB TYR 63 -1.139 4.929 9.523 143 HD1 TYR 63 HD2 TYR 63 -0.117 6.330 11.564 144 HD2 TYR 63 HD1 TYR 63 -2.535 2.849 11.953 145 HE1 TYR 63 HE2 TYR 63 0.823 5.932 13.802 146 HE2 TYR 63 HE1 TYR 63 -1.600 2.443 14.190 147 HH TYR 63 HH TYR 63 -0.519 3.827 16.017 148 HA PRO 64 HA PRO 64 -3.812 8.066 6.445 149 HB2 PRO 64 1HB PRO 64 -0.928 8.376 5.794 150 HB3 PRO 64 2HB PRO 64 -2.250 9.538 5.632 151 HG2 PRO 64 1HG PRO 64 -0.459 9.792 7.578 152 HG3 PRO 64 2HG PRO 64 -2.174 10.133 7.877 153 HD2 PRO 64 1HD PRO 64 -0.560 7.724 8.622 154 HD3 PRO 64 2HD PRO 64 -1.811 8.575 9.551 155 H TRP 65 H TRP 65 -3.102 7.632 4.060 156 HA TRP 65 HA TRP 65 -3.294 4.869 3.590 157 HB2 TRP 65 1HB TRP 65 -2.376 6.985 1.631 158 HB3 TRP 65 2HB TRP 65 -3.023 5.399 1.230 159 HD1 TRP 65 HD1 TRP 65 -4.143 8.797 2.648 160 HE1 TRP 65 HE1 TRP 65 -6.680 9.028 2.291 161 HE3 TRP 65 HE3 TRP 65 -5.143 4.117 0.839 162 HZ2 TRP 65 HZ2 TRP 65 -8.821 7.443 1.364 163 HZ3 TRP 65 HZ3 TRP 65 -7.463 3.559 0.238 164 HH2 TRP 65 HH2 TRP 65 -9.263 5.188 0.497 165 H TRP 66 H TRP 66 -1.812 3.295 3.399 166 HA TRP 66 HA TRP 66 1.025 4.084 3.247 167 HB2 TRP 66 1HB TRP 66 -0.097 2.857 5.367 168 HB3 TRP 66 2HB TRP 66 0.337 1.446 4.407 169 HD1 TRP 66 HD1 TRP 66 2.642 0.533 4.990 170 HE1 TRP 66 HE1 TRP 66 4.855 1.510 5.865 171 HE3 TRP 66 HE3 TRP 66 1.300 5.461 5.288 172 HZ2 TRP 66 HZ2 TRP 66 5.890 4.025 6.594 173 HZ3 TRP 66 HZ3 TRP 66 2.968 7.087 6.077 174 HH2 TRP 66 HH2 TRP 66 5.218 6.380 6.711 175 HA PRO 67 HA PRO 67 1.239 1.634 -0.437 176 HB2 PRO 67 1HB PRO 67 3.906 1.279 -0.620 177 HB3 PRO 67 2HB PRO 67 3.143 2.848 -0.903 178 HG2 PRO 67 1HG PRO 67 4.527 1.831 1.549 179 HG3 PRO 67 2HG PRO 67 4.651 3.418 0.773 180 HD2 PRO 67 1HD PRO 67 3.108 2.953 2.962 181 HD3 PRO 67 2HD PRO 67 2.718 4.188 1.751 182 H ALA 68 H ALA 68 0.247 -0.293 0.073 183 HA ALA 68 HA ALA 68 1.905 -2.405 1.299 184 HB1 ALA 68 3HB ALA 68 -0.491 -1.665 2.151 185 HB2 ALA 68 1HB ALA 68 0.024 -3.350 2.181 186 HB3 ALA 68 2HB ALA 68 -1.018 -2.769 0.880 187 H LEU 69 H LEU 69 1.257 -4.664 0.385 188 HA LEU 69 HA LEU 69 1.053 -4.450 -2.550 189 HB2 LEU 69 1HB LEU 69 3.143 -5.569 -0.949 190 HB3 LEU 69 2HB LEU 69 2.379 -6.865 -1.847 191 HG LEU 69 HG LEU 69 2.812 -4.677 -3.632 192 HD11 LEU 69 1HD1 LEU 69 5.325 -5.564 -2.230 193 HD12 LEU 69 2HD1 LEU 69 4.536 -4.009 -1.968 194 HD13 LEU 69 3HD1 LEU 69 5.184 -4.411 -3.557 195 HD21 LEU 69 3HD2 LEU 69 2.706 -6.755 -4.605 196 HD22 LEU 69 1HD2 LEU 69 3.694 -7.513 -3.358 197 HD23 LEU 69 2HD2 LEU 69 4.447 -6.482 -4.574 198 H LEU 70 H LEU 70 -0.726 -5.348 -3.315 199 HA LEU 70 HA LEU 70 -2.517 -6.865 -1.775 200 HB2 LEU 70 1HB LEU 70 -2.690 -5.532 -4.121 201 HB3 LEU 70 2HB LEU 70 -2.659 -7.186 -4.704 202 HG LEU 70 HG LEU 70 -4.574 -6.405 -2.536 203 HD11 LEU 70 1HD1 LEU 70 -5.117 -4.761 -4.101 204 HD12 LEU 70 2HD1 LEU 70 -6.233 -6.079 -4.452 205 HD13 LEU 70 3HD1 LEU 70 -4.815 -5.830 -5.470 206 HD21 LEU 70 3HD2 LEU 70 -4.000 -8.744 -4.055 207 HD22 LEU 70 1HD2 LEU 70 -5.626 -8.194 -4.461 208 HD23 LEU 70 2HD2 LEU 70 -5.199 -8.518 -2.782 209 H LEU 71 H LEU 71 -2.584 -8.933 -1.256 210 HA LEU 71 HA LEU 71 -0.791 -10.792 -2.650 211 HB2 LEU 71 1HB LEU 71 -2.190 -11.349 -0.050 212 HB3 LEU 71 2HB LEU 71 -0.758 -12.120 -0.703 213 HG LEU 71 HG LEU 71 -0.752 -9.221 0.107 214 HD11 LEU 71 1HD1 LEU 71 -1.399 -11.055 1.920 215 HD12 LEU 71 2HD1 LEU 71 -0.353 -9.685 2.289 216 HD13 LEU 71 3HD1 LEU 71 0.351 -11.266 1.945 217 HD21 LEU 71 3HD2 LEU 71 1.632 -9.529 0.239 218 HD22 LEU 71 1HD2 LEU 71 1.066 -10.071 -1.341 219 HD23 LEU 71 2HD2 LEU 71 1.468 -11.253 -0.096 220 H ARG 72 H ARG 72 -4.145 -10.474 -1.488 221 HA ARG 72 HA ARG 72 -5.222 -11.877 -3.688 222 HB2 ARG 72 1HB ARG 72 -4.388 -13.500 -1.433 223 HB3 ARG 72 2HB ARG 72 -6.113 -13.655 -1.732 224 HG2 ARG 72 1HG ARG 72 -4.693 -13.795 -4.214 225 HG3 ARG 72 2HG ARG 72 -4.003 -14.938 -3.061 226 HD2 ARG 72 1HD ARG 72 -6.014 -16.091 -2.813 227 HD3 ARG 72 2HD ARG 72 -6.971 -14.752 -3.445 228 HE ARG 72 HE ARG 72 -6.601 -15.530 -5.566 229 HH11 ARG 72 1HH1 ARG 72 -4.351 -17.101 -3.392 230 HH12 ARG 72 2HH1 ARG 72 -3.785 -18.219 -4.584 231 HH21 ARG 72 1HH2 ARG 72 -5.849 -17.005 -7.138 232 HH22 ARG 72 2HH2 ARG 72 -4.636 -18.164 -6.713 233 H ARG 73 H ARG 73 -7.595 -12.472 -3.288 234 HA ARG 73 HA ARG 73 -8.797 -10.444 -1.517 235 HB2 ARG 73 1HB ARG 73 -10.786 -10.646 -3.142 236 HB3 ARG 73 2HB ARG 73 -9.376 -9.747 -3.677 237 HG2 ARG 73 1HG ARG 73 -8.655 -11.555 -5.058 238 HG3 ARG 73 2HG ARG 73 -9.880 -12.630 -4.380 239 HD2 ARG 73 1HD ARG 73 -11.634 -11.475 -5.447 240 HD3 ARG 73 2HD ARG 73 -10.604 -10.090 -5.815 241 HE ARG 73 HE ARG 73 -9.537 -12.331 -7.096 242 HH11 ARG 73 1HH1 ARG 73 -12.407 -10.328 -7.268 243 HH12 ARG 73 2HH1 ARG 73 -12.651 -10.612 -8.957 244 HH21 ARG 73 1HH2 ARG 73 -9.867 -12.698 -9.321 245 HH22 ARG 73 2HH2 ARG 73 -11.211 -11.956 -10.121 246 H LYS 74 H LYS 74 -9.538 -11.435 0.252 247 HA LYS 74 HA LYS 74 -10.763 -14.088 -0.033 248 HB2 LYS 74 1HB LYS 74 -10.552 -13.985 2.576 249 HB3 LYS 74 2HB LYS 74 -9.156 -14.375 1.585 250 HG2 LYS 74 1HG LYS 74 -8.240 -12.207 1.853 251 HG3 LYS 74 2HG LYS 74 -9.739 -11.590 2.554 252 HD2 LYS 74 1HD LYS 74 -8.416 -13.881 3.912 253 HD3 LYS 74 2HD LYS 74 -7.658 -12.293 4.054 254 HE2 LYS 74 1HE LYS 74 -9.059 -11.993 5.779 255 HE3 LYS 74 2HE LYS 74 -10.279 -11.707 4.540 256 HZ1 LYS 74 3HZ LYS 74 -10.683 -14.190 4.638 257 HZ2 LYS 74 1HZ LYS 74 -11.198 -13.291 5.974 258 HZ3 LYS 74 2HZ LYS 74 -9.770 -14.195 6.062 259 H GLU 75 H GLU 75 -12.874 -13.897 -0.403 260 HA GLU 75 HA GLU 75 -14.440 -11.786 0.825 261 HB2 GLU 75 1HB GLU 75 -14.650 -13.313 -1.527 262 HB3 GLU 75 2HB GLU 75 -16.013 -13.799 -0.530 263 HG2 GLU 75 1HG GLU 75 -16.577 -11.377 -0.274 264 HG3 GLU 75 2HG GLU 75 -15.330 -11.029 -1.468 265 H THR 76 H THR 76 -15.768 -11.998 2.554 266 HA THR 76 HA THR 76 -16.414 -14.687 3.506 267 HB THR 76 HB THR 76 -14.385 -13.956 4.714 268 HG1 THR 76 HG1 THR 76 -16.672 -14.004 6.393 269 HG21 THR 76 3HG2 THR 76 -14.457 -11.643 4.901 270 HG22 THR 76 1HG2 THR 76 -14.774 -12.215 6.537 271 HG23 THR 76 2HG2 THR 76 -16.106 -11.647 5.528 272 H LYS 77 H LYS 77 -18.346 -14.900 4.520 273 HA LYS 77 HA LYS 77 -19.986 -12.474 4.847 274 HB2 LYS 77 1HB LYS 77 -20.392 -14.617 3.033 275 HB3 LYS 77 2HB LYS 77 -21.618 -14.772 4.283 276 HG2 LYS 77 1HG LYS 77 -21.258 -12.055 3.243 277 HG3 LYS 77 2HG LYS 77 -21.842 -13.229 2.067 278 HD2 LYS 77 1HD LYS 77 -23.087 -12.637 4.752 279 HD3 LYS 77 2HD LYS 77 -23.692 -12.096 3.189 280 HE2 LYS 77 1HE LYS 77 -24.915 -13.950 3.135 281 HE3 LYS 77 2HE LYS 77 -23.413 -14.840 2.896 282 HZ1 LYS 77 3HZ LYS 77 -23.693 -15.802 4.854 283 HZ2 LYS 77 1HZ LYS 77 -25.171 -15.005 5.046 284 HZ3 LYS 77 2HZ LYS 77 -23.753 -14.309 5.642 285 H ASP 78 H ASP 78 -22.029 -13.061 6.193 286 HA ASP 78 HA ASP 78 -21.271 -13.698 8.779 287 HB2 ASP 78 1HB ASP 78 -23.442 -12.574 7.840 288 HB3 ASP 78 2HB ASP 78 -24.081 -14.215 7.868 289 H SER 79 H SER 79 -22.298 -15.827 6.198 290 HA SER 79 HA SER 79 -21.296 -18.130 7.489 291 HB2 SER 79 1HB SER 79 -23.529 -19.352 7.604 292 HB3 SER 79 2HB SER 79 -23.252 -18.134 8.848 293 HG SER 79 HG SER 79 -24.699 -16.819 7.914 294 H LEU 80 H LEU 80 -24.210 -18.059 5.469 295 HA LEU 80 HA LEU 80 -22.966 -18.181 2.962 296 HB2 LEU 80 1HB LEU 80 -22.435 -20.494 4.252 297 HB3 LEU 80 2HB LEU 80 -23.970 -20.913 3.523 298 HG LEU 80 HG LEU 80 -22.232 -21.659 2.061 299 HD11 LEU 80 1HD1 LEU 80 -23.343 -19.110 0.896 300 HD12 LEU 80 2HD1 LEU 80 -24.232 -20.630 1.018 301 HD13 LEU 80 3HD1 LEU 80 -22.788 -20.533 0.012 302 HD21 LEU 80 3HD2 LEU 80 -20.366 -20.377 2.763 303 HD22 LEU 80 1HD2 LEU 80 -21.150 -18.862 2.314 304 HD23 LEU 80 2HD2 LEU 80 -20.634 -19.992 1.062 305 H ASN 81 H ASN 81 -24.920 -16.693 3.335 306 HA ASN 81 HA ASN 81 -27.392 -18.089 2.535 307 HB2 ASN 81 1HB ASN 81 -26.873 -16.006 4.513 308 HB3 ASN 81 2HB ASN 81 -28.148 -15.554 3.389 309 HD21 ASN 81 2HD2 ASN 81 -27.125 -17.908 5.769 310 HD22 ASN 81 1HD2 ASN 81 -28.707 -18.550 6.087 311 H THR 82 H THR 82 -25.162 -15.504 1.813 312 HA THR 82 HA THR 82 -24.864 -14.136 0.055 313 HB THR 82 HB THR 82 -25.338 -14.903 -2.100 314 HG1 THR 82 HG1 THR 82 -27.549 -16.274 -0.986 315 HG21 THR 82 3HG2 THR 82 -23.905 -16.507 -1.067 316 HG22 THR 82 1HG2 THR 82 -25.050 -17.351 -2.108 317 HG23 THR 82 2HG2 THR 82 -25.281 -17.352 -0.359 318 H ASN 83 H ASN 83 -27.320 -13.849 1.878 319 HA ASN 83 HA ASN 83 -28.511 -11.693 0.325 320 HB2 ASN 83 1HB ASN 83 -30.780 -12.363 0.824 321 HB3 ASN 83 2HB ASN 83 -29.950 -13.687 0.019 322 HD21 ASN 83 2HD2 ASN 83 -31.423 -12.595 2.964 323 HD22 ASN 83 1HD2 ASN 83 -31.389 -14.127 3.780 324 H SER 84 H SER 84 -26.674 -11.917 2.675 325 HA SER 84 HA SER 84 -28.320 -10.420 4.606 326 HB2 SER 84 1HB SER 84 -25.988 -12.275 5.135 327 HB3 SER 84 2HB SER 84 -26.674 -11.192 6.348 328 HG SER 84 HG SER 84 -28.073 -12.709 6.686 329 H SER 85 H SER 85 -24.799 -10.805 4.597 330 HA SER 85 HA SER 85 -24.301 -8.207 3.477 331 HB2 SER 85 1HB SER 85 -24.051 -8.680 6.450 332 HB3 SER 85 2HB SER 85 -23.132 -7.421 5.622 333 HG SER 85 HG SER 85 -25.207 -6.625 4.871 334 H PHE 86 H PHE 86 -22.430 -8.345 2.442 335 HA PHE 86 HA PHE 86 -20.588 -10.508 3.130 336 HB2 PHE 86 1HB PHE 86 -20.547 -8.732 0.688 337 HB3 PHE 86 2HB PHE 86 -19.633 -10.215 0.934 338 HD1 PHE 86 HD1 PHE 86 -23.105 -8.912 0.628 339 HD2 PHE 86 HD2 PHE 86 -20.496 -12.253 0.255 340 HE1 PHE 86 HE1 PHE 86 -24.918 -10.207 -0.412 341 HE2 PHE 86 HE2 PHE 86 -22.305 -13.553 -0.786 342 HZ PHE 86 HZ PHE 86 -24.519 -12.530 -1.123 343 H ASN 87 H ASN 87 -18.378 -10.184 3.431 344 HA ASN 87 HA ASN 87 -17.486 -7.417 3.814 345 HB2 ASN 87 1HB ASN 87 -18.150 -8.933 5.948 346 HB3 ASN 87 2HB ASN 87 -16.475 -9.430 5.748 347 HD21 ASN 87 2HD2 ASN 87 -16.711 -8.351 7.999 348 HD22 ASN 87 1HD2 ASN 87 -16.252 -6.678 8.056 349 H VAL 88 H VAL 88 -16.453 -7.738 1.776 350 HA VAL 88 HA VAL 88 -14.295 -9.699 1.676 351 HB VAL 88 HB VAL 88 -15.680 -9.487 -0.320 352 HG11 VAL 88 1HG1 VAL 88 -16.458 -7.289 -0.358 353 HG12 VAL 88 2HG1 VAL 88 -15.336 -7.361 -1.717 354 HG13 VAL 88 3HG1 VAL 88 -14.836 -6.614 -0.202 355 HG21 VAL 88 3HG2 VAL 88 -13.924 -9.329 -1.961 356 HG22 VAL 88 1HG2 VAL 88 -13.288 -10.107 -0.511 357 HG23 VAL 88 2HG2 VAL 88 -12.911 -8.416 -0.843 358 H LEU 89 H LEU 89 -12.154 -9.204 1.608 359 HA LEU 89 HA LEU 89 -11.377 -6.379 1.795 360 HB2 LEU 89 1HB LEU 89 -10.000 -8.395 3.521 361 HB3 LEU 89 2HB LEU 89 -10.082 -6.652 3.701 362 HG LEU 89 HG LEU 89 -12.565 -8.290 4.052 363 HD11 LEU 89 1HD1 LEU 89 -12.081 -8.908 6.213 364 HD12 LEU 89 2HD1 LEU 89 -10.801 -7.707 6.387 365 HD13 LEU 89 3HD1 LEU 89 -10.526 -9.157 5.422 366 HD21 LEU 89 3HD2 LEU 89 -12.354 -6.226 5.926 367 HD22 LEU 89 1HD2 LEU 89 -13.359 -6.260 4.478 368 HD23 LEU 89 2HD2 LEU 89 -11.745 -5.554 4.415 369 H TYR 90 H TYR 90 -8.826 -6.322 1.846 370 HA TYR 90 HA TYR 90 -7.854 -8.155 -0.248 371 HB2 TYR 90 1HB TYR 90 -7.868 -5.216 -0.110 372 HB3 TYR 90 2HB TYR 90 -6.311 -5.909 -0.551 373 HD1 TYR 90 HD2 TYR 90 -7.264 -8.311 -2.061 374 HD2 TYR 90 HD1 TYR 90 -8.566 -4.263 -2.147 375 HE1 TYR 90 HE2 TYR 90 -8.051 -8.621 -4.361 376 HE2 TYR 90 HE1 TYR 90 -9.358 -4.563 -4.455 377 HH TYR 90 HH TYR 90 -8.665 -6.244 -6.435 378 H LYS 91 H LYS 91 -6.581 -9.547 0.878 379 HA LYS 91 HA LYS 91 -5.040 -8.790 3.141 380 HB2 LYS 91 1HB LYS 91 -3.880 -11.025 2.745 381 HB3 LYS 91 2HB LYS 91 -5.610 -11.076 3.042 382 HG2 LYS 91 1HG LYS 91 -6.104 -11.685 0.873 383 HG3 LYS 91 2HG LYS 91 -4.604 -11.014 0.235 384 HD2 LYS 91 1HD LYS 91 -3.644 -13.013 0.363 385 HD3 LYS 91 2HD LYS 91 -3.931 -13.046 2.102 386 HE2 LYS 91 1HE LYS 91 -6.226 -13.678 0.336 387 HE3 LYS 91 2HE LYS 91 -4.935 -14.875 0.435 388 HZ1 LYS 91 3HZ LYS 91 -6.799 -15.129 2.075 389 HZ2 LYS 91 1HZ LYS 91 -6.237 -13.726 2.837 390 HZ3 LYS 91 2HZ LYS 91 -5.246 -15.094 2.745 391 H VAL 92 H VAL 92 -3.707 -7.085 2.706 392 HA VAL 92 HA VAL 92 -1.712 -7.453 0.573 393 HB VAL 92 HB VAL 92 -1.448 -5.060 0.491 394 HG11 VAL 92 1HG1 VAL 92 -3.854 -6.427 -0.124 395 HG12 VAL 92 2HG1 VAL 92 -3.160 -5.015 -0.918 396 HG13 VAL 92 3HG1 VAL 92 -4.281 -4.806 0.428 397 HG21 VAL 92 3HG2 VAL 92 -1.733 -4.520 2.843 398 HG22 VAL 92 1HG2 VAL 92 -3.443 -4.943 2.755 399 HG23 VAL 92 2HG2 VAL 92 -2.832 -3.553 1.860 400 H LEU 93 H LEU 93 0.460 -6.695 0.945 401 HA LEU 93 HA LEU 93 1.303 -7.152 3.718 402 HB2 LEU 93 1HB LEU 93 2.576 -7.524 1.049 403 HB3 LEU 93 2HB LEU 93 3.624 -7.155 2.405 404 HG LEU 93 HG LEU 93 1.735 -9.509 2.247 405 HD11 LEU 93 1HD1 LEU 93 3.848 -9.443 0.767 406 HD12 LEU 93 2HD1 LEU 93 3.548 -10.869 1.761 407 HD13 LEU 93 3HD1 LEU 93 4.724 -9.662 2.282 408 HD21 LEU 93 3HD2 LEU 93 1.953 -8.912 4.528 409 HD22 LEU 93 1HD2 LEU 93 3.682 -8.612 4.358 410 HD23 LEU 93 2HD2 LEU 93 3.057 -10.259 4.260 411 H PHE 94 H PHE 94 2.234 -5.605 4.899 412 HA PHE 94 HA PHE 94 2.453 -2.925 3.749 413 HB2 PHE 94 1HB PHE 94 1.974 -4.065 6.435 414 HB3 PHE 94 2HB PHE 94 2.966 -2.615 6.407 415 HD1 PHE 94 HD1 PHE 94 -0.178 -3.860 4.811 416 HD2 PHE 94 HD2 PHE 94 1.872 -0.641 6.695 417 HE1 PHE 94 HE1 PHE 94 -2.207 -2.479 4.655 418 HE2 PHE 94 HE2 PHE 94 -0.149 0.745 6.540 419 HZ PHE 94 HZ PHE 94 -2.195 -0.173 5.522 420 H PHE 95 H PHE 95 4.314 -1.586 4.236 421 HA PHE 95 HA PHE 95 6.756 -2.961 5.045 422 HB2 PHE 95 1HB PHE 95 6.765 -1.347 2.501 423 HB3 PHE 95 2HB PHE 95 7.990 -2.461 3.093 424 HD1 PHE 95 HD2 PHE 95 4.733 -2.171 1.436 425 HD2 PHE 95 HD1 PHE 95 7.793 -4.825 2.744 426 HE1 PHE 95 HE2 PHE 95 3.755 -3.967 0.074 427 HE2 PHE 95 HE1 PHE 95 6.818 -6.626 1.384 428 HZ PHE 95 HZ PHE 95 4.795 -6.199 0.048 429 HA PRO 96 HA PRO 96 8.838 -2.482 5.065 430 HB2 PRO 96 1HB PRO 96 10.741 -1.748 6.789 431 HB3 PRO 96 2HB PRO 96 10.580 -0.956 5.220 432 HG2 PRO 96 1HG PRO 96 9.747 0.001 7.921 433 HG3 PRO 96 2HG PRO 96 10.431 0.914 6.565 434 HD2 PRO 96 1HD PRO 96 7.722 0.762 7.232 435 HD3 PRO 96 2HD PRO 96 8.382 1.316 5.683 436 H ASP 97 H ASP 97 10.241 -3.500 7.206 437 HA ASP 97 HA ASP 97 10.147 -4.708 9.127 438 HB2 ASP 97 1HB ASP 97 8.424 -2.571 9.688 439 HB3 ASP 97 2HB ASP 97 7.533 -4.017 10.148 440 H PHE 98 H PHE 98 8.192 -5.086 6.545 441 HA PHE 98 HA PHE 98 6.838 -6.713 5.737 442 HB2 PHE 98 1HB PHE 98 8.817 -8.060 7.459 443 HB3 PHE 98 2HB PHE 98 7.405 -9.024 7.044 444 HD1 PHE 98 HD2 PHE 98 6.918 -9.578 4.715 445 HD2 PHE 98 HD1 PHE 98 10.442 -7.457 5.809 446 HE1 PHE 98 HE2 PHE 98 7.897 -10.074 2.513 447 HE2 PHE 98 HE1 PHE 98 11.423 -7.944 3.608 448 HZ PHE 98 HZ PHE 98 10.152 -9.259 1.957 449 H ASN 99 H ASN 99 4.862 -5.874 6.443 450 HA ASN 99 HA ASN 99 3.594 -7.456 8.568 451 HB2 ASN 99 1HB ASN 99 3.989 -4.561 8.518 452 HB3 ASN 99 2HB ASN 99 2.295 -5.005 8.703 453 HD21 ASN 99 2HD2 ASN 99 2.080 -6.984 10.300 454 HD22 ASN 99 1HD2 ASN 99 2.904 -6.754 11.811 455 H PHE 100 H PHE 100 1.023 -6.510 8.401 456 HA PHE 100 HA PHE 100 0.168 -6.261 5.672 457 HB2 PHE 100 1HB PHE 100 -1.353 -8.437 6.126 458 HB3 PHE 100 2HB PHE 100 0.184 -8.499 5.275 459 HD1 PHE 100 HD1 PHE 100 2.195 -9.323 6.414 460 HD2 PHE 100 HD2 PHE 100 -1.630 -9.422 8.273 461 HE1 PHE 100 HE1 PHE 100 3.046 -10.929 8.065 462 HE2 PHE 100 HE2 PHE 100 -0.786 -11.026 9.928 463 HZ PHE 100 HZ PHE 100 1.557 -11.783 9.827 464 H ALA 101 H ALA 101 -2.340 -6.543 5.590 465 HA ALA 101 HA ALA 101 -3.855 -6.108 7.940 466 HB1 ALA 101 3HB ALA 101 -4.410 -3.631 7.011 467 HB2 ALA 101 1HB ALA 101 -2.691 -3.739 6.634 468 HB3 ALA 101 2HB ALA 101 -3.245 -3.965 8.293 469 H TRP 102 H TRP 102 -5.961 -6.500 7.524 470 HA TRP 102 HA TRP 102 -6.748 -6.978 4.769 471 HB2 TRP 102 1HB TRP 102 -8.379 -7.354 7.293 472 HB3 TRP 102 2HB TRP 102 -8.740 -8.005 5.698 473 HD1 TRP 102 HD1 TRP 102 -6.049 -9.332 4.895 474 HE1 TRP 102 HE1 TRP 102 -5.133 -11.363 6.183 475 HE3 TRP 102 HE3 TRP 102 -8.585 -8.722 9.296 476 HZ2 TRP 102 HZ2 TRP 102 -5.447 -12.553 8.724 477 HZ3 TRP 102 HZ3 TRP 102 -8.219 -10.351 11.103 478 HH2 TRP 102 HH2 TRP 102 -6.683 -12.226 10.821 479 H VAL 103 H VAL 103 -7.269 -5.186 3.651 480 HA VAL 103 HA VAL 103 -9.143 -3.272 4.892 481 HB VAL 103 HB VAL 103 -7.171 -2.642 2.702 482 HG11 VAL 103 1HG1 VAL 103 -8.753 -1.007 2.502 483 HG12 VAL 103 2HG1 VAL 103 -7.715 -0.275 3.726 484 HG13 VAL 103 3HG1 VAL 103 -9.207 -1.084 4.205 485 HG21 VAL 103 3HG2 VAL 103 -6.307 -1.246 4.874 486 HG22 VAL 103 1HG2 VAL 103 -5.623 -2.774 4.319 487 HG23 VAL 103 2HG2 VAL 103 -6.826 -2.762 5.608 488 H LYS 104 H LYS 104 -10.873 -2.515 3.671 489 HA LYS 104 HA LYS 104 -11.762 -4.272 1.571 490 HB2 LYS 104 1HB LYS 104 -13.020 -1.780 2.731 491 HB3 LYS 104 2HB LYS 104 -13.794 -2.841 1.568 492 HG2 LYS 104 1HG LYS 104 -13.448 -4.693 3.285 493 HG3 LYS 104 2HG LYS 104 -13.097 -3.394 4.427 494 HD2 LYS 104 1HD LYS 104 -15.377 -2.459 3.350 495 HD3 LYS 104 2HD LYS 104 -15.654 -4.193 3.175 496 HE2 LYS 104 1HE LYS 104 -15.076 -4.427 5.609 497 HE3 LYS 104 2HE LYS 104 -15.078 -2.667 5.710 498 HZ1 LYS 104 3HZ LYS 104 -17.337 -4.502 5.255 499 HZ2 LYS 104 1HZ LYS 104 -17.430 -2.906 4.699 500 HZ3 LYS 104 2HZ LYS 104 -17.209 -3.217 6.347 501 H ARG 105 H ARG 105 -12.452 -3.577 -0.541 502 HA ARG 105 HA ARG 105 -10.551 -2.176 -1.995 503 HB2 ARG 105 1HB ARG 105 -13.333 -3.086 -2.538 504 HB3 ARG 105 2HB ARG 105 -12.619 -1.933 -3.657 505 HG2 ARG 105 1HG ARG 105 -11.145 -3.434 -4.488 506 HG3 ARG 105 2HG ARG 105 -10.970 -4.278 -2.948 507 HD2 ARG 105 1HD ARG 105 -12.075 -5.809 -4.324 508 HD3 ARG 105 2HD ARG 105 -13.355 -5.111 -3.333 509 HE ARG 105 HE ARG 105 -13.374 -3.559 -5.551 510 HH11 ARG 105 1HH1 ARG 105 -13.510 -7.029 -5.075 511 HH12 ARG 105 2HH1 ARG 105 -14.449 -7.310 -6.500 512 HH21 ARG 105 1HH2 ARG 105 -14.621 -3.945 -7.431 513 HH22 ARG 105 2HH2 ARG 105 -15.078 -5.566 -7.834 514 H ASN 106 H ASN 106 -13.341 -0.946 -0.278 515 HA ASN 106 HA ASN 106 -13.492 1.573 -1.574 516 HB2 ASN 106 1HB ASN 106 -14.831 2.283 0.377 517 HB3 ASN 106 2HB ASN 106 -15.382 0.752 -0.287 518 HD21 ASN 106 2HD2 ASN 106 -13.609 2.263 2.344 519 HD22 ASN 106 1HD2 ASN 106 -13.796 0.950 3.466 520 H SER 107 H SER 107 -11.641 0.357 1.161 521 HA SER 107 HA SER 107 -10.496 3.012 1.605 522 HB2 SER 107 1HB SER 107 -10.697 0.525 3.227 523 HB3 SER 107 2HB SER 107 -9.268 1.530 3.476 524 HG SER 107 HG SER 107 -11.748 1.920 4.375 525 H VAL 108 H VAL 108 -9.927 1.138 -0.736 526 HA VAL 108 HA VAL 108 -6.996 1.064 -0.419 527 HB VAL 108 HB VAL 108 -8.700 -0.749 -2.125 528 HG11 VAL 108 1HG1 VAL 108 -6.675 -1.892 -2.735 529 HG12 VAL 108 2HG1 VAL 108 -5.720 -0.839 -1.693 530 HG13 VAL 108 3HG1 VAL 108 -6.501 -0.182 -3.130 531 HG21 VAL 108 3HG2 VAL 108 -6.961 -1.932 -0.093 532 HG22 VAL 108 1HG2 VAL 108 -8.630 -2.307 -0.515 533 HG23 VAL 108 2HG2 VAL 108 -8.273 -0.954 0.560 534 H LYS 109 H LYS 109 -5.736 1.872 -2.075 535 HA LYS 109 HA LYS 109 -7.137 3.142 -4.334 536 HB2 LYS 109 1HB LYS 109 -6.529 4.865 -2.724 537 HB3 LYS 109 2HB LYS 109 -4.871 4.285 -2.691 538 HG2 LYS 109 1HG LYS 109 -4.481 5.884 -4.194 539 HG3 LYS 109 2HG LYS 109 -5.238 4.787 -5.350 540 HD2 LYS 109 1HD LYS 109 -7.443 5.866 -4.729 541 HD3 LYS 109 2HD LYS 109 -6.500 7.087 -3.871 542 HE2 LYS 109 1HE LYS 109 -5.948 8.136 -5.766 543 HE3 LYS 109 2HE LYS 109 -5.529 6.627 -6.574 544 HZ1 LYS 109 3HZ LYS 109 -8.145 6.397 -6.612 545 HZ2 LYS 109 1HZ LYS 109 -7.308 7.245 -7.814 546 HZ3 LYS 109 2HZ LYS 109 -8.062 8.087 -6.557 547 HA PRO 110 HA PRO 110 -4.225 0.784 -6.752 548 HB2 PRO 110 1HB PRO 110 -4.548 2.085 -9.123 549 HB3 PRO 110 2HB PRO 110 -5.711 0.913 -8.495 550 HG2 PRO 110 1HG PRO 110 -5.789 3.904 -8.391 551 HG3 PRO 110 2HG PRO 110 -7.099 2.761 -8.746 552 HD2 PRO 110 1HD PRO 110 -6.818 3.931 -6.328 553 HD3 PRO 110 2HD PRO 110 -7.458 2.287 -6.517 554 H LEU 111 H LEU 111 -2.155 1.176 -6.137 555 HA LEU 111 HA LEU 111 -0.956 3.788 -6.597 556 HB2 LEU 111 1HB LEU 111 -0.645 1.876 -4.626 557 HB3 LEU 111 2HB LEU 111 0.803 1.676 -5.599 558 HG LEU 111 HG LEU 111 1.223 4.144 -5.324 559 HD11 LEU 111 1HD1 LEU 111 -1.190 3.847 -3.585 560 HD12 LEU 111 2HD1 LEU 111 -0.807 5.104 -4.759 561 HD13 LEU 111 3HD1 LEU 111 0.038 5.056 -3.213 562 HD21 LEU 111 3HD2 LEU 111 1.751 3.840 -2.780 563 HD22 LEU 111 1HD2 LEU 111 2.596 2.872 -3.988 564 HD23 LEU 111 2HD2 LEU 111 1.255 2.176 -3.082 565 H LEU 112 H LEU 112 1.097 4.023 -7.710 566 HA LEU 112 HA LEU 112 1.613 1.924 -9.703 567 HB2 LEU 112 1HB LEU 112 2.202 4.011 -11.213 568 HB3 LEU 112 2HB LEU 112 0.581 3.352 -11.138 569 HG LEU 112 HG LEU 112 1.116 5.465 -9.162 570 HD11 LEU 112 1HD1 LEU 112 0.710 7.185 -11.060 571 HD12 LEU 112 2HD1 LEU 112 1.419 5.945 -12.095 572 HD13 LEU 112 3HD1 LEU 112 2.345 6.604 -10.749 573 HD21 LEU 112 3HD2 LEU 112 -1.095 5.843 -9.384 574 HD22 LEU 112 1HD2 LEU 112 -1.084 4.229 -10.095 575 HD23 LEU 112 2HD2 LEU 112 -1.065 5.652 -11.137 576 H ASP 113 H ASP 113 3.732 2.182 -10.798 577 HA ASP 113 HA ASP 113 5.812 2.439 -8.869 578 HB2 ASP 113 1HB ASP 113 5.909 2.068 -11.870 579 HB3 ASP 113 2HB ASP 113 7.325 2.014 -10.828 580 H SER 114 H SER 114 4.709 4.408 -11.583 581 HA SER 114 HA SER 114 6.769 6.294 -11.637 582 HB2 SER 114 1HB SER 114 3.832 6.589 -12.312 583 HB3 SER 114 2HB SER 114 5.060 7.798 -12.692 584 HG SER 114 HG SER 114 5.944 6.466 -14.154 585 H GLU 115 H GLU 115 4.044 5.951 -9.451 586 HA GLU 115 HA GLU 115 4.381 8.592 -8.343 587 HB2 GLU 115 1HB GLU 115 2.307 8.268 -7.595 588 HB3 GLU 115 2HB GLU 115 2.320 6.730 -8.434 589 HG2 GLU 115 1HG GLU 115 2.875 5.548 -6.494 590 HG3 GLU 115 2HG GLU 115 3.294 7.020 -5.617 591 H ILE 116 H ILE 116 4.893 5.256 -7.217 592 HA ILE 116 HA ILE 116 6.018 5.955 -4.724 593 HB ILE 116 HB ILE 116 6.598 3.462 -6.335 594 HG12 ILE 116 1HG1 ILE 116 4.523 3.801 -4.165 595 HG13 ILE 116 2HG1 ILE 116 4.149 3.975 -5.876 596 HG21 ILE 116 1HG2 ILE 116 7.653 2.593 -4.541 597 HG22 ILE 116 2HG2 ILE 116 6.574 3.382 -3.392 598 HG23 ILE 116 3HG2 ILE 116 7.902 4.285 -4.117 599 HD11 ILE 116 3HD1 ILE 116 3.937 1.788 -6.094 600 HD12 ILE 116 1HD1 ILE 116 4.164 1.634 -4.352 601 HD13 ILE 116 2HD1 ILE 116 5.551 1.520 -5.435 602 H ALA 117 H ALA 117 7.429 5.496 -7.916 603 HA ALA 117 HA ALA 117 10.149 5.524 -7.281 604 HB1 ALA 117 3HB ALA 117 8.776 6.668 -9.714 605 HB2 ALA 117 1HB ALA 117 9.283 4.988 -9.510 606 HB3 ALA 117 2HB ALA 117 10.492 6.270 -9.588 607 H LYS 118 H LYS 118 8.156 8.228 -8.433 608 HA LYS 118 HA LYS 118 10.064 10.234 -7.876 609 HB2 LYS 118 1HB LYS 118 8.635 11.428 -9.109 610 HB3 LYS 118 2HB LYS 118 7.563 10.036 -9.127 611 HG2 LYS 118 1HG LYS 118 7.457 11.890 -6.805 612 HG3 LYS 118 2HG LYS 118 6.703 12.362 -8.334 613 HD2 LYS 118 1HD LYS 118 5.935 9.715 -7.957 614 HD3 LYS 118 2HD LYS 118 5.817 10.447 -6.353 615 HE2 LYS 118 1HE LYS 118 4.596 12.371 -7.608 616 HE3 LYS 118 2HE LYS 118 4.364 11.161 -8.868 617 HZ1 LYS 118 3HZ LYS 118 3.602 9.834 -6.646 618 HZ2 LYS 118 1HZ LYS 118 2.546 10.637 -7.697 619 HZ3 LYS 118 2HZ LYS 118 3.086 11.405 -6.292 620 H PHE 119 H PHE 119 7.332 8.924 -6.059 621 HA PHE 119 HA PHE 119 7.063 10.746 -4.015 622 HB2 PHE 119 1HB PHE 119 5.605 8.844 -4.030 623 HB3 PHE 119 2HB PHE 119 6.956 7.724 -3.897 624 HD1 PHE 119 HD2 PHE 119 8.240 7.606 -1.751 625 HD2 PHE 119 HD1 PHE 119 4.587 9.761 -2.110 626 HE1 PHE 119 HE2 PHE 119 7.994 7.589 0.698 627 HE2 PHE 119 HE1 PHE 119 4.341 9.753 0.338 628 HZ PHE 119 HZ PHE 119 6.051 8.666 1.737 629 H LEU 120 H LEU 120 9.326 8.001 -4.036 630 HA LEU 120 HA LEU 120 10.589 8.618 -1.620 631 HB2 LEU 120 1HB LEU 120 11.608 7.156 -4.047 632 HB3 LEU 120 2HB LEU 120 12.461 7.236 -2.517 633 HG LEU 120 HG LEU 120 9.650 6.251 -2.489 634 HD11 LEU 120 1HD1 LEU 120 10.789 5.118 -4.414 635 HD12 LEU 120 2HD1 LEU 120 10.259 4.035 -3.128 636 HD13 LEU 120 3HD1 LEU 120 11.960 4.475 -3.263 637 HD21 LEU 120 3HD2 LEU 120 10.308 6.001 -0.375 638 HD22 LEU 120 1HD2 LEU 120 12.007 6.235 -0.789 639 HD23 LEU 120 2HD2 LEU 120 11.274 4.641 -0.945 640 H GLY 121 H GLY 121 11.164 9.746 -4.907 641 HA2 GLY 121 1HA GLY 121 13.495 11.295 -4.026 642 HA3 GLY 121 2HA GLY 121 12.976 11.062 -5.689 643 H SER 122 H SER 122 10.643 11.927 -3.242 644 HA SER 122 HA SER 122 9.855 14.252 -4.668 645 HB2 SER 122 1HB SER 122 9.008 12.894 -2.148 646 HB3 SER 122 2HB SER 122 8.519 14.568 -2.389 647 HG SER 122 HG SER 122 7.258 12.559 -3.293 648 H SER 123 H SER 123 9.466 16.324 -3.366 649 HA SER 123 HA SER 123 11.680 16.990 -1.586 650 HB2 SER 123 1HB SER 123 12.235 17.475 -4.081 651 HB3 SER 123 2HB SER 123 11.119 18.828 -3.897 652 HG SER 123 HG SER 123 13.420 18.339 -2.301 653 H LYS 124 H LYS 124 8.666 16.766 -1.434 654 HA LYS 124 HA LYS 124 8.214 19.440 -0.299 655 HB2 LYS 124 1HB LYS 124 5.921 19.446 -1.025 656 HB3 LYS 124 2HB LYS 124 6.963 19.207 -2.421 657 HG2 LYS 124 1HG LYS 124 6.245 16.654 -1.397 658 HG3 LYS 124 2HG LYS 124 4.783 17.626 -1.544 659 HD2 LYS 124 1HD LYS 124 4.892 17.688 -3.800 660 HD3 LYS 124 2HD LYS 124 6.654 17.788 -3.813 661 HE2 LYS 124 1HE LYS 124 6.424 15.297 -2.936 662 HE3 LYS 124 2HE LYS 124 4.880 15.405 -3.779 663 HZ1 LYS 124 3HZ LYS 124 5.877 15.455 -5.783 664 HZ2 LYS 124 1HZ LYS 124 7.145 14.693 -4.960 665 HZ3 LYS 124 2HZ LYS 124 7.202 16.359 -5.247 666 H ARG 125 H ARG 125 7.214 16.028 -0.250 667 HA ARG 125 HA ARG 125 6.831 16.276 2.641 668 HB2 ARG 125 1HB ARG 125 4.613 16.348 1.387 669 HB3 ARG 125 2HB ARG 125 4.939 14.691 0.901 670 HG2 ARG 125 1HG ARG 125 3.922 14.059 2.761 671 HG3 ARG 125 2HG ARG 125 5.323 14.669 3.644 672 HD2 ARG 125 1HD ARG 125 3.380 16.733 2.890 673 HD3 ARG 125 2HD ARG 125 2.745 15.512 3.989 674 HE ARG 125 HE ARG 125 4.709 17.528 4.578 675 HH11 ARG 125 1HH1 ARG 125 3.450 14.397 5.520 676 HH12 ARG 125 2HH1 ARG 125 3.997 14.532 7.156 677 HH21 ARG 125 1HH2 ARG 125 5.437 17.692 6.739 678 HH22 ARG 125 2HH2 ARG 125 5.123 16.400 7.848 679 H LYS 126 H LYS 126 8.547 15.135 3.234 680 HA LYS 126 HA LYS 126 8.585 12.306 2.557 681 HB2 LYS 126 1HB LYS 126 10.771 12.211 1.767 682 HB3 LYS 126 2HB LYS 126 10.142 13.664 1.009 683 HG2 LYS 126 1HG LYS 126 11.901 13.571 3.456 684 HG3 LYS 126 2HG LYS 126 12.424 13.964 1.821 685 HD2 LYS 126 1HD LYS 126 10.446 15.534 3.477 686 HD3 LYS 126 2HD LYS 126 12.120 15.983 3.159 687 HE2 LYS 126 1HE LYS 126 11.476 15.877 0.681 688 HE3 LYS 126 2HE LYS 126 9.808 15.885 1.249 689 HZ1 LYS 126 3HZ LYS 126 10.564 17.950 2.569 690 HZ2 LYS 126 1HZ LYS 126 10.250 18.112 0.917 691 HZ3 LYS 126 2HZ LYS 126 11.844 18.003 1.464 692 H SER 127 H SER 127 8.873 11.081 4.282 693 HA SER 127 HA SER 127 10.282 12.199 6.607 694 HB2 SER 127 1HB SER 127 8.565 11.784 8.056 695 HB3 SER 127 2HB SER 127 7.592 11.985 6.601 696 HG SER 127 HG SER 127 6.951 10.091 7.526 697 H LYS 128 H LYS 128 11.271 10.598 8.001 698 HA LYS 128 HA LYS 128 12.586 8.552 6.624 699 HB2 LYS 128 1HB LYS 128 12.258 9.213 9.526 700 HB3 LYS 128 2HB LYS 128 12.985 7.676 9.080 701 HG2 LYS 128 1HG LYS 128 14.434 9.282 7.519 702 HG3 LYS 128 2HG LYS 128 14.035 10.425 8.802 703 HD2 LYS 128 1HD LYS 128 16.086 9.426 9.428 704 HD3 LYS 128 2HD LYS 128 14.850 8.676 10.438 705 HE2 LYS 128 1HE LYS 128 16.222 6.906 9.709 706 HE3 LYS 128 2HE LYS 128 14.773 6.816 8.712 707 HZ1 LYS 128 3HZ LYS 128 15.907 7.372 6.854 708 HZ2 LYS 128 1HZ LYS 128 17.214 6.721 7.710 709 HZ3 LYS 128 2HZ LYS 128 16.988 8.395 7.660 710 H GLU 129 H GLU 129 9.630 8.490 8.536 711 HA GLU 129 HA GLU 129 9.368 5.629 8.439 712 HB2 GLU 129 1HB GLU 129 7.638 7.887 9.386 713 HB3 GLU 129 2HB GLU 129 6.938 6.291 9.165 714 HG2 GLU 129 1HG GLU 129 8.204 5.353 10.856 715 HG3 GLU 129 2HG GLU 129 9.419 6.627 10.791 716 H LEU 130 H LEU 130 8.220 8.370 6.538 717 HA LEU 130 HA LEU 130 6.369 6.765 5.005 718 HB2 LEU 130 1HB LEU 130 6.957 9.574 5.291 719 HB3 LEU 130 2HB LEU 130 6.887 9.138 3.595 720 HG LEU 130 HG LEU 130 4.694 8.633 5.611 721 HD11 LEU 130 1HD1 LEU 130 5.213 11.045 4.883 722 HD12 LEU 130 2HD1 LEU 130 3.552 10.467 4.750 723 HD13 LEU 130 3HD1 LEU 130 4.574 10.554 3.315 724 HD21 LEU 130 3HD2 LEU 130 5.067 7.120 3.476 725 HD22 LEU 130 1HD2 LEU 130 4.293 8.484 2.668 726 HD23 LEU 130 2HD2 LEU 130 3.454 7.640 3.969 727 H ILE 131 H ILE 131 9.542 8.273 4.381 728 HA ILE 131 HA ILE 131 9.786 7.464 1.710 729 HB ILE 131 HB ILE 131 12.000 7.844 3.734 730 HG12 ILE 131 1HG1 ILE 131 11.361 9.848 1.620 731 HG13 ILE 131 2HG1 ILE 131 10.290 9.761 3.014 732 HG21 ILE 131 1HG2 ILE 131 12.779 8.434 1.053 733 HG22 ILE 131 2HG2 ILE 131 12.082 6.813 1.106 734 HG23 ILE 131 3HG2 ILE 131 13.437 7.226 2.159 735 HD11 ILE 131 3HD1 ILE 131 13.205 10.447 2.938 736 HD12 ILE 131 1HD1 ILE 131 12.396 9.975 4.432 737 HD13 ILE 131 2HD1 ILE 131 11.857 11.405 3.552 738 H GLU 132 H GLU 132 11.125 5.932 4.642 739 HA GLU 132 HA GLU 132 12.189 3.673 3.429 740 HB2 GLU 132 1HB GLU 132 11.260 4.343 6.171 741 HB3 GLU 132 2HB GLU 132 11.493 2.641 5.802 742 HG2 GLU 132 1HG GLU 132 13.490 3.552 6.794 743 HG3 GLU 132 2HG GLU 132 13.799 3.113 5.114 744 H ALA 133 H ALA 133 8.894 4.492 4.139 745 HA ALA 133 HA ALA 133 7.747 1.919 4.005 746 HB1 ALA 133 3HB ALA 133 6.262 4.334 3.091 747 HB2 ALA 133 1HB ALA 133 6.764 4.219 4.777 748 HB3 ALA 133 2HB ALA 133 5.711 2.983 4.088 749 H TYR 134 H TYR 134 7.829 4.523 1.574 750 HA TYR 134 HA TYR 134 6.836 2.860 -0.498 751 HB2 TYR 134 1HB TYR 134 8.122 5.575 -0.455 752 HB3 TYR 134 2HB TYR 134 7.820 4.756 -1.988 753 HD1 TYR 134 HD2 TYR 134 5.967 5.463 1.193 754 HD2 TYR 134 HD1 TYR 134 5.842 5.279 -3.055 755 HE1 TYR 134 HE2 TYR 134 3.637 6.247 1.234 756 HE2 TYR 134 HE1 TYR 134 3.511 6.062 -3.025 757 HH TYR 134 HH TYR 134 1.589 6.025 -0.377 758 H GLU 135 H GLU 135 10.041 3.460 0.718 759 HA GLU 135 HA GLU 135 11.401 2.350 -1.549 760 HB2 GLU 135 1HB GLU 135 12.198 3.849 0.600 761 HB3 GLU 135 2HB GLU 135 12.777 2.252 1.053 762 HG2 GLU 135 1HG GLU 135 13.784 2.198 -1.321 763 HG3 GLU 135 2HG GLU 135 13.548 3.945 -1.283 764 H ALA 136 H ALA 136 9.966 1.130 1.384 765 HA ALA 136 HA ALA 136 11.239 -1.458 1.192 766 HB1 ALA 136 3HB ALA 136 10.604 -0.421 3.363 767 HB2 ALA 136 1HB ALA 136 9.973 -2.051 3.132 768 HB3 ALA 136 2HB ALA 136 8.911 -0.656 2.927 769 H SER 137 H SER 137 8.209 0.027 0.226 770 HA SER 137 HA SER 137 6.950 -2.482 -0.441 771 HB2 SER 137 1HB SER 137 6.022 0.214 -1.418 772 HB3 SER 137 2HB SER 137 5.063 -1.227 -1.081 773 HG SER 137 HG SER 137 4.739 -0.265 0.764 774 H LYS 138 H LYS 138 8.820 -0.028 -2.123 775 HA LYS 138 HA LYS 138 8.160 -0.844 -4.762 776 HB2 LYS 138 1HB LYS 138 9.281 1.345 -3.943 777 HB3 LYS 138 2HB LYS 138 10.779 0.431 -4.034 778 HG2 LYS 138 1HG LYS 138 10.865 0.578 -6.259 779 HG3 LYS 138 2HG LYS 138 9.151 0.196 -6.438 780 HD2 LYS 138 1HD LYS 138 8.510 2.399 -6.343 781 HD3 LYS 138 2HD LYS 138 9.912 2.880 -5.386 782 HE2 LYS 138 1HE LYS 138 10.229 1.949 -8.216 783 HE3 LYS 138 2HE LYS 138 9.764 3.612 -7.864 784 HZ1 LYS 138 3HZ LYS 138 11.988 3.888 -7.843 785 HZ2 LYS 138 1HZ LYS 138 12.315 2.273 -7.464 786 HZ3 LYS 138 2HZ LYS 138 11.852 3.350 -6.245 787 H THR 139 H THR 139 10.441 -2.012 -2.397 788 HA THR 139 HA THR 139 12.343 -3.318 -3.887 789 HB THR 139 HB THR 139 11.146 -4.725 -1.533 790 HG1 THR 139 HG1 THR 139 12.557 -2.264 -1.428 791 HG21 THR 139 3HG2 THR 139 13.090 -5.790 -2.178 792 HG22 THR 139 1HG2 THR 139 13.628 -4.717 -0.887 793 HG23 THR 139 2HG2 THR 139 13.912 -4.279 -2.570 794 HA PRO 140 HA PRO 140 9.635 -6.002 -6.368 795 HB2 PRO 140 1HB PRO 140 12.326 -6.858 -7.306 796 HB3 PRO 140 2HB PRO 140 10.900 -6.402 -8.243 797 HG2 PRO 140 1HG PRO 140 12.967 -4.740 -8.028 798 HG3 PRO 140 2HG PRO 140 11.301 -4.131 -7.995 799 HD2 PRO 140 1HD PRO 140 13.223 -4.524 -5.737 800 HD3 PRO 140 2HD PRO 140 12.042 -3.224 -6.002 801 HA PRO 141 HA PRO 141 12.469 -9.864 -4.766 802 HB2 PRO 141 1HB PRO 141 13.170 -8.273 -2.317 803 HB3 PRO 141 2HB PRO 141 14.036 -9.628 -3.060 804 HG2 PRO 141 1HG PRO 141 14.875 -7.169 -3.485 805 HG3 PRO 141 2HG PRO 141 14.808 -8.320 -4.834 806 HD2 PRO 141 1HD PRO 141 13.004 -6.035 -4.202 807 HD3 PRO 141 2HD PRO 141 13.505 -6.674 -5.778 808 H ASP 142 H ASP 142 10.641 -7.570 -2.754 809 HA ASP 142 HA ASP 142 9.646 -9.338 -0.851 810 HB2 ASP 142 1HB ASP 142 8.453 -6.830 -2.033 811 HB3 ASP 142 2HB ASP 142 7.688 -7.710 -0.716 812 H LEU 143 H LEU 143 8.237 -8.437 -4.001 813 HA LEU 143 HA LEU 143 6.489 -10.800 -3.782 814 HB2 LEU 143 1HB LEU 143 5.337 -8.577 -3.807 815 HB3 LEU 143 2HB LEU 143 5.983 -8.307 -5.411 816 HG LEU 143 HG LEU 143 3.587 -9.059 -5.310 817 HD11 LEU 143 1HD1 LEU 143 3.720 -10.219 -7.297 818 HD12 LEU 143 2HD1 LEU 143 5.188 -11.075 -6.823 819 HD13 LEU 143 3HD1 LEU 143 5.263 -9.366 -7.256 820 HD21 LEU 143 3HD2 LEU 143 4.496 -11.854 -4.927 821 HD22 LEU 143 1HD2 LEU 143 2.948 -11.101 -4.547 822 HD23 LEU 143 2HD2 LEU 143 4.334 -10.845 -3.489 823 H LYS 144 H LYS 144 7.400 -8.741 -6.541 824 HA LYS 144 HA LYS 144 8.289 -9.196 -8.572 825 HB2 LYS 144 1HB LYS 144 9.824 -10.812 -6.692 826 HB3 LYS 144 2HB LYS 144 9.807 -11.505 -8.309 827 HG2 LYS 144 1HG LYS 144 10.618 -9.378 -9.222 828 HG3 LYS 144 2HG LYS 144 10.656 -8.704 -7.592 829 HD2 LYS 144 1HD LYS 144 12.557 -9.790 -7.050 830 HD3 LYS 144 2HD LYS 144 12.089 -11.252 -7.921 831 HE2 LYS 144 1HE LYS 144 12.769 -10.317 -10.006 832 HE3 LYS 144 2HE LYS 144 12.998 -8.725 -9.283 833 HZ1 LYS 144 3HZ LYS 144 14.749 -9.829 -7.860 834 HZ2 LYS 144 1HZ LYS 144 15.126 -9.646 -9.499 835 HZ3 LYS 144 2HZ LYS 144 14.647 -11.156 -8.905 836 H GLU 145 H GLU 145 8.139 -12.582 -7.494 837 HA GLU 145 HA GLU 145 5.895 -13.059 -9.318 838 HB2 GLU 145 1HB GLU 145 8.394 -13.596 -10.179 839 HB3 GLU 145 2HB GLU 145 8.046 -15.101 -9.339 840 HG2 GLU 145 1HG GLU 145 5.865 -14.239 -11.056 841 HG3 GLU 145 2HG GLU 145 7.374 -14.494 -11.930 842 H GLU 146 H GLU 146 4.366 -14.213 -8.332 843 HA GLU 146 HA GLU 146 5.158 -16.045 -6.168 844 HB2 GLU 146 1HB GLU 146 3.972 -13.709 -5.632 845 HB3 GLU 146 2HB GLU 146 2.535 -14.664 -5.971 846 HG2 GLU 146 1HG GLU 146 4.433 -15.984 -4.187 847 HG3 GLU 146 2HG GLU 146 3.783 -14.473 -3.553 848 H SER 147 H SER 147 5.039 -17.662 -7.888 849 HA SER 147 HA SER 147 2.299 -18.664 -8.184 850 HB2 SER 147 1HB SER 147 4.250 -18.147 -10.416 851 HB3 SER 147 2HB SER 147 2.986 -19.366 -10.575 852 HG SER 147 HG SER 147 2.607 -16.607 -10.012 853 H SER 148 H SER 148 3.049 -20.061 -6.455 854 HA SER 148 HA SER 148 4.090 -22.535 -7.486 855 HB2 SER 148 1HB SER 148 5.806 -22.448 -5.410 856 HB3 SER 148 2HB SER 148 6.254 -21.954 -7.043 857 HG SER 148 HG SER 148 5.330 -20.232 -4.977 858 H THR 149 H THR 149 2.122 -23.388 -6.812 859 HA THR 149 HA THR 149 1.138 -23.070 -4.150 860 HB THR 149 HB THR 149 -0.527 -24.746 -4.767 861 HG1 THR 149 HG1 THR 149 0.248 -26.247 -6.029 862 HG21 THR 149 3HG2 THR 149 -1.173 -23.733 -7.101 863 HG22 THR 149 1HG2 THR 149 0.070 -22.556 -6.676 864 HG23 THR 149 2HG2 THR 149 -1.320 -22.793 -5.617 865 H ASP 150 H ASP 150 3.275 -25.331 -5.718 866 HA ASP 150 HA ASP 150 3.118 -27.490 -3.949 867 HB2 ASP 150 1HB ASP 150 4.290 -27.439 -6.179 868 HB3 ASP 150 2HB ASP 150 5.606 -26.572 -5.397 869 H LEU 151 H LEU 151 4.537 -28.152 -2.240 870 HA LEU 151 HA LEU 151 6.214 -26.131 -0.990 871 HB2 LEU 151 1HB LEU 151 3.625 -26.236 -0.190 872 HB3 LEU 151 2HB LEU 151 4.341 -27.408 0.900 873 HG LEU 151 HG LEU 151 5.458 -24.630 0.593 874 HD11 LEU 151 1HD1 LEU 151 3.758 -25.264 2.920 875 HD12 LEU 151 2HD1 LEU 151 2.929 -24.984 1.390 876 HD13 LEU 151 3HD1 LEU 151 3.989 -23.744 2.059 877 HD21 LEU 151 3HD2 LEU 151 6.581 -26.760 1.762 878 HD22 LEU 151 1HD2 LEU 151 5.598 -26.183 3.107 879 HD23 LEU 151 2HD2 LEU 151 6.787 -25.115 2.365 880 H GLU 152 H GLU 152 8.037 -27.083 -0.353 881 HA GLU 152 HA GLU 152 7.945 -29.772 0.795 882 HB2 GLU 152 1HB GLU 152 9.894 -29.041 -1.397 883 HB3 GLU 152 2HB GLU 152 9.748 -30.596 -0.590 884 HG2 GLU 152 1HG GLU 152 7.360 -30.640 -1.506 885 HG3 GLU 152 2HG GLU 152 7.882 -29.327 -2.560 Start of MODEL 18 1 H1 SER 45 1H SER 45 -1.879 -3.459 -21.830 2 H2 SER 45 2H SER 45 -1.417 -2.617 -20.406 3 H3 SER 45 3H SER 45 -2.148 -1.771 -21.708 4 HA SER 45 HA SER 45 -4.191 -2.759 -21.365 5 HB2 SER 45 1HB SER 45 -2.632 -4.907 -20.454 6 HB3 SER 45 2HB SER 45 -3.581 -4.409 -19.053 7 HG SER 45 HG SER 45 -5.454 -4.585 -20.373 8 H ALA 46 H ALA 46 -5.503 -2.842 -19.110 9 HA ALA 46 HA ALA 46 -4.732 -0.375 -17.736 10 HB1 ALA 46 3HB ALA 46 -7.329 -1.895 -17.860 11 HB2 ALA 46 1HB ALA 46 -6.951 -0.343 -18.607 12 HB3 ALA 46 2HB ALA 46 -7.075 -0.469 -16.853 13 H ASP 47 H ASP 47 -5.451 -0.304 -15.349 14 HA ASP 47 HA ASP 47 -5.284 -2.744 -13.850 15 HB2 ASP 47 1HB ASP 47 -3.195 -2.081 -12.614 16 HB3 ASP 47 2HB ASP 47 -2.928 -2.559 -14.287 17 H ASP 48 H ASP 48 -7.175 -0.656 -14.004 18 HA ASP 48 HA ASP 48 -6.818 0.878 -11.541 19 HB2 ASP 48 1HB ASP 48 -8.791 2.149 -12.276 20 HB3 ASP 48 2HB ASP 48 -7.549 2.112 -13.523 21 H ARG 49 H ARG 49 -7.484 -2.085 -11.698 22 HA ARG 49 HA ARG 49 -9.770 -1.951 -9.864 23 HB2 ARG 49 1HB ARG 49 -9.448 -4.081 -11.985 24 HB3 ARG 49 2HB ARG 49 -10.757 -3.958 -10.820 25 HG2 ARG 49 1HG ARG 49 -11.905 -2.595 -12.136 26 HG3 ARG 49 2HG ARG 49 -10.519 -1.528 -12.354 27 HD2 ARG 49 1HD ARG 49 -11.163 -4.025 -13.914 28 HD3 ARG 49 2HD ARG 49 -11.211 -2.365 -14.499 29 HE ARG 49 HE ARG 49 -8.842 -2.316 -14.475 30 HH11 ARG 49 1HH1 ARG 49 -10.137 -5.482 -13.676 31 HH12 ARG 49 2HH1 ARG 49 -8.667 -6.311 -14.056 32 HH21 ARG 49 1HH2 ARG 49 -6.911 -3.432 -14.973 33 HH22 ARG 49 2HH2 ARG 49 -6.841 -5.152 -14.787 34 H LEU 50 H LEU 50 -6.757 -2.311 -9.677 35 HA LEU 50 HA LEU 50 -5.258 -3.462 -8.420 36 HB2 LEU 50 1HB LEU 50 -7.857 -4.111 -7.097 37 HB3 LEU 50 2HB LEU 50 -6.403 -4.933 -6.568 38 HG LEU 50 HG LEU 50 -5.371 -2.664 -6.185 39 HD11 LEU 50 1HD1 LEU 50 -8.218 -1.729 -6.517 40 HD12 LEU 50 2HD1 LEU 50 -6.887 -1.380 -7.620 41 HD13 LEU 50 3HD1 LEU 50 -6.852 -0.755 -5.972 42 HD21 LEU 50 3HD2 LEU 50 -7.736 -2.714 -4.440 43 HD22 LEU 50 1HD2 LEU 50 -6.021 -2.754 -4.036 44 HD23 LEU 50 2HD2 LEU 50 -6.839 -4.227 -4.551 45 H ASN 51 H ASN 51 -4.620 -5.765 -7.646 46 HA ASN 51 HA ASN 51 -5.762 -8.004 -8.963 47 HB2 ASN 51 1HB ASN 51 -3.742 -6.458 -10.413 48 HB3 ASN 51 2HB ASN 51 -3.316 -8.156 -10.242 49 HD21 ASN 51 2HD2 ASN 51 -5.486 -9.562 -10.545 50 HD22 ASN 51 1HD2 ASN 51 -6.293 -9.227 -12.045 51 H PHE 52 H PHE 52 -4.043 -9.900 -8.967 52 HA PHE 52 HA PHE 52 -3.096 -10.091 -6.252 53 HB2 PHE 52 1HB PHE 52 -2.818 -12.094 -8.507 54 HB3 PHE 52 2HB PHE 52 -2.582 -12.411 -6.787 55 HD1 PHE 52 HD2 PHE 52 -4.889 -11.049 -5.595 56 HD2 PHE 52 HD1 PHE 52 -4.622 -13.406 -9.131 57 HE1 PHE 52 HE2 PHE 52 -7.267 -11.635 -5.381 58 HE2 PHE 52 HE1 PHE 52 -7.002 -13.995 -8.921 59 HZ PHE 52 HZ PHE 52 -8.327 -13.110 -7.044 60 H GLY 53 H GLY 53 -1.141 -9.522 -5.585 61 HA2 GLY 53 1HA GLY 53 1.167 -9.362 -5.549 62 HA3 GLY 53 2HA GLY 53 1.211 -10.111 -7.138 63 H ASP 54 H ASP 54 -0.378 -7.130 -6.023 64 HA ASP 54 HA ASP 54 1.384 -5.578 -7.779 65 HB2 ASP 54 1HB ASP 54 -1.174 -6.191 -8.516 66 HB3 ASP 54 2HB ASP 54 -1.416 -4.662 -7.679 67 H ARG 55 H ARG 55 1.953 -3.598 -7.018 68 HA ARG 55 HA ARG 55 1.696 -3.067 -4.257 69 HB2 ARG 55 1HB ARG 55 2.608 -1.286 -6.524 70 HB3 ARG 55 2HB ARG 55 2.736 -0.856 -4.825 71 HG2 ARG 55 1HG ARG 55 4.765 -1.761 -4.906 72 HG3 ARG 55 2HG ARG 55 3.944 -3.324 -4.925 73 HD2 ARG 55 1HD ARG 55 3.941 -2.280 -7.571 74 HD3 ARG 55 2HD ARG 55 5.578 -2.148 -6.931 75 HE ARG 55 HE ARG 55 4.376 -4.715 -6.474 76 HH11 ARG 55 1HH1 ARG 55 6.164 -2.776 -8.780 77 HH12 ARG 55 2HH1 ARG 55 6.831 -4.147 -9.598 78 HH21 ARG 55 1HH2 ARG 55 5.249 -6.513 -7.561 79 HH22 ARG 55 2HH2 ARG 55 6.312 -6.270 -8.907 80 H ILE 56 H ILE 56 0.023 -2.263 -3.196 81 HA ILE 56 HA ILE 56 -1.725 -0.317 -4.553 82 HB ILE 56 HB ILE 56 -3.685 -1.282 -3.443 83 HG12 ILE 56 1HG1 ILE 56 -3.002 -3.854 -2.742 84 HG13 ILE 56 2HG1 ILE 56 -1.626 -2.928 -2.148 85 HG21 ILE 56 1HG2 ILE 56 -3.738 -3.456 -4.751 86 HG22 ILE 56 2HG2 ILE 56 -2.084 -3.082 -5.236 87 HG23 ILE 56 3HG2 ILE 56 -3.398 -1.986 -5.665 88 HD11 ILE 56 3HD1 ILE 56 -3.598 -1.400 -1.214 89 HD12 ILE 56 1HD1 ILE 56 -2.939 -2.773 -0.325 90 HD13 ILE 56 2HD1 ILE 56 -4.432 -2.953 -1.248 91 H LEU 57 H LEU 57 -2.757 1.216 -3.191 92 HA LEU 57 HA LEU 57 -1.293 1.693 -0.697 93 HB2 LEU 57 1HB LEU 57 -2.053 3.363 -2.783 94 HB3 LEU 57 2HB LEU 57 -3.187 3.753 -1.506 95 HG LEU 57 HG LEU 57 -1.303 4.218 0.017 96 HD11 LEU 57 1HD1 LEU 57 0.199 2.692 -1.638 97 HD12 LEU 57 2HD1 LEU 57 0.858 3.838 -0.472 98 HD13 LEU 57 3HD1 LEU 57 0.669 4.308 -2.161 99 HD21 LEU 57 3HD2 LEU 57 -1.782 5.688 -2.503 100 HD22 LEU 57 1HD2 LEU 57 -0.359 6.153 -1.574 101 HD23 LEU 57 2HD2 LEU 57 -1.955 6.214 -0.830 102 H VAL 58 H VAL 58 -2.290 1.892 1.285 103 HA VAL 58 HA VAL 58 -5.199 1.420 1.380 104 HB VAL 58 HB VAL 58 -3.208 0.089 3.225 105 HG11 VAL 58 1HG1 VAL 58 -6.158 -0.430 2.886 106 HG12 VAL 58 2HG1 VAL 58 -5.468 0.579 4.157 107 HG13 VAL 58 3HG1 VAL 58 -5.078 -1.138 4.087 108 HG21 VAL 58 3HG2 VAL 58 -2.845 -1.179 1.376 109 HG22 VAL 58 1HG2 VAL 58 -4.405 -0.778 0.657 110 HG23 VAL 58 2HG2 VAL 58 -4.312 -1.974 1.948 111 H LYS 59 H LYS 59 -6.306 2.462 3.002 112 HA LYS 59 HA LYS 59 -4.760 4.437 4.536 113 HB2 LYS 59 1HB LYS 59 -6.475 5.372 3.065 114 HB3 LYS 59 2HB LYS 59 -7.702 4.375 3.833 115 HG2 LYS 59 1HG LYS 59 -7.841 5.702 5.661 116 HG3 LYS 59 2HG LYS 59 -6.137 6.155 5.602 117 HD2 LYS 59 1HD LYS 59 -6.902 7.384 3.393 118 HD3 LYS 59 2HD LYS 59 -8.476 7.344 4.192 119 HE2 LYS 59 1HE LYS 59 -7.667 9.338 4.976 120 HE3 LYS 59 2HE LYS 59 -7.096 8.249 6.238 121 HZ1 LYS 59 3HZ LYS 59 -4.976 8.112 4.876 122 HZ2 LYS 59 1HZ LYS 59 -5.265 9.567 5.689 123 HZ3 LYS 59 2HZ LYS 59 -5.549 9.457 4.026 124 H ALA 60 H ALA 60 -4.774 4.455 6.721 125 HA ALA 60 HA ALA 60 -6.341 2.360 8.078 126 HB1 ALA 60 3HB ALA 60 -3.704 2.470 8.082 127 HB2 ALA 60 1HB ALA 60 -4.601 1.977 9.517 128 HB3 ALA 60 2HB ALA 60 -3.985 3.624 9.385 129 HA PRO 61 HA PRO 61 -8.607 5.328 10.434 130 HB2 PRO 61 1HB PRO 61 -8.548 4.215 12.947 131 HB3 PRO 61 2HB PRO 61 -9.619 3.680 11.650 132 HG2 PRO 61 1HG PRO 61 -7.019 2.519 12.561 133 HG3 PRO 61 2HG PRO 61 -8.509 1.688 12.076 134 HD2 PRO 61 1HD PRO 61 -6.398 1.888 10.425 135 HD3 PRO 61 2HD PRO 61 -8.065 1.942 9.818 136 H GLY 62 H GLY 62 -7.734 7.270 10.812 137 HA2 GLY 62 1HA GLY 62 -6.603 8.944 11.921 138 HA3 GLY 62 2HA GLY 62 -6.207 7.772 13.167 139 H TYR 63 H TYR 63 -5.372 7.217 9.816 140 HA TYR 63 HA TYR 63 -2.657 8.172 10.164 141 HB2 TYR 63 1HB TYR 63 -3.157 5.602 10.949 142 HB3 TYR 63 2HB TYR 63 -2.714 5.365 9.263 143 HD1 TYR 63 HD1 TYR 63 -1.401 7.806 11.772 144 HD2 TYR 63 HD2 TYR 63 -0.584 4.443 9.292 145 HE1 TYR 63 HE1 TYR 63 0.976 7.938 12.382 146 HE2 TYR 63 HE2 TYR 63 1.795 4.568 9.898 147 HH TYR 63 HH TYR 63 3.222 7.178 11.234 148 HA PRO 64 HA PRO 64 -3.140 8.932 5.831 149 HB2 PRO 64 1HB PRO 64 -0.517 8.971 5.062 150 HB3 PRO 64 2HB PRO 64 -1.309 10.301 5.913 151 HG2 PRO 64 1HG PRO 64 0.454 8.142 6.998 152 HG3 PRO 64 2HG PRO 64 0.430 9.871 7.388 153 HD2 PRO 64 1HD PRO 64 -0.701 8.019 8.990 154 HD3 PRO 64 2HD PRO 64 -1.371 9.652 8.816 155 H TRP 65 H TRP 65 -2.376 8.066 3.654 156 HA TRP 65 HA TRP 65 -2.862 5.284 3.539 157 HB2 TRP 65 1HB TRP 65 -1.786 7.155 1.417 158 HB3 TRP 65 2HB TRP 65 -2.317 5.504 1.120 159 HD1 TRP 65 HD1 TRP 65 -3.735 8.935 2.165 160 HE1 TRP 65 HE1 TRP 65 -6.236 8.994 1.561 161 HE3 TRP 65 HE3 TRP 65 -4.313 4.096 0.614 162 HZ2 TRP 65 HZ2 TRP 65 -8.193 7.226 0.559 163 HZ3 TRP 65 HZ3 TRP 65 -6.534 3.362 -0.154 164 HH2 TRP 65 HH2 TRP 65 -8.433 4.896 -0.180 165 H TRP 66 H TRP 66 -1.512 3.550 3.070 166 HA TRP 66 HA TRP 66 1.382 4.082 3.231 167 HB2 TRP 66 1HB TRP 66 -0.014 2.947 5.259 168 HB3 TRP 66 2HB TRP 66 0.419 1.512 4.334 169 HD1 TRP 66 HD1 TRP 66 2.610 0.470 5.114 170 HE1 TRP 66 HE1 TRP 66 4.795 1.324 6.173 171 HE3 TRP 66 HE3 TRP 66 1.523 5.459 5.306 172 HZ2 TRP 66 HZ2 TRP 66 5.904 3.784 6.987 173 HZ3 TRP 66 HZ3 TRP 66 3.204 6.997 6.235 174 HH2 TRP 66 HH2 TRP 66 5.353 6.171 7.049 175 HA PRO 67 HA PRO 67 1.619 1.583 -0.423 176 HB2 PRO 67 1HB PRO 67 4.247 1.005 -0.438 177 HB3 PRO 67 2HB PRO 67 3.646 2.638 -0.747 178 HG2 PRO 67 1HG PRO 67 4.774 1.480 1.774 179 HG3 PRO 67 2HG PRO 67 5.087 3.058 1.030 180 HD2 PRO 67 1HD PRO 67 3.365 2.701 3.109 181 HD3 PRO 67 2HD PRO 67 3.183 3.989 1.906 182 H ALA 68 H ALA 68 0.506 -0.292 -0.133 183 HA ALA 68 HA ALA 68 1.889 -2.511 1.241 184 HB1 ALA 68 3HB ALA 68 -1.071 -2.097 0.808 185 HB2 ALA 68 1HB ALA 68 -0.199 -1.914 2.331 186 HB3 ALA 68 2HB ALA 68 -0.333 -3.504 1.578 187 H LEU 69 H LEU 69 1.044 -4.712 0.333 188 HA LEU 69 HA LEU 69 0.897 -4.561 -2.605 189 HB2 LEU 69 1HB LEU 69 3.034 -5.607 -1.016 190 HB3 LEU 69 2HB LEU 69 2.281 -6.931 -1.883 191 HG LEU 69 HG LEU 69 2.934 -4.487 -3.442 192 HD11 LEU 69 1HD1 LEU 69 5.063 -6.501 -2.769 193 HD12 LEU 69 2HD1 LEU 69 4.911 -4.947 -1.950 194 HD13 LEU 69 3HD1 LEU 69 5.228 -5.001 -3.681 195 HD21 LEU 69 3HD2 LEU 69 3.448 -7.346 -4.168 196 HD22 LEU 69 1HD2 LEU 69 3.125 -5.970 -5.221 197 HD23 LEU 69 2HD2 LEU 69 1.824 -6.666 -4.256 198 H LEU 70 H LEU 70 -0.888 -5.505 -3.307 199 HA LEU 70 HA LEU 70 -2.584 -7.066 -1.679 200 HB2 LEU 70 1HB LEU 70 -3.069 -5.658 -3.826 201 HB3 LEU 70 2HB LEU 70 -2.717 -7.155 -4.667 202 HG LEU 70 HG LEU 70 -4.786 -7.013 -2.485 203 HD11 LEU 70 1HD1 LEU 70 -6.114 -5.815 -3.794 204 HD12 LEU 70 2HD1 LEU 70 -6.062 -7.116 -4.982 205 HD13 LEU 70 3HD1 LEU 70 -4.903 -5.791 -5.075 206 HD21 LEU 70 3HD2 LEU 70 -4.368 -9.238 -2.871 207 HD22 LEU 70 1HD2 LEU 70 -3.968 -8.982 -4.571 208 HD23 LEU 70 2HD2 LEU 70 -5.650 -8.933 -4.042 209 H LEU 71 H LEU 71 -2.706 -9.193 -1.306 210 HA LEU 71 HA LEU 71 -0.856 -10.951 -2.769 211 HB2 LEU 71 1HB LEU 71 -2.168 -11.323 -0.073 212 HB3 LEU 71 2HB LEU 71 -1.107 -12.486 -0.843 213 HG LEU 71 HG LEU 71 -0.009 -9.759 -0.476 214 HD11 LEU 71 1HD1 LEU 71 -1.322 -10.859 1.676 215 HD12 LEU 71 2HD1 LEU 71 -0.027 -9.665 1.750 216 HD13 LEU 71 3HD1 LEU 71 0.347 -11.380 1.913 217 HD21 LEU 71 3HD2 LEU 71 1.994 -11.102 0.130 218 HD22 LEU 71 1HD2 LEU 71 1.365 -11.444 -1.481 219 HD23 LEU 71 2HD2 LEU 71 1.048 -12.563 -0.155 220 H ARG 72 H ARG 72 -4.103 -11.087 -1.258 221 HA ARG 72 HA ARG 72 -5.180 -12.379 -3.603 222 HB2 ARG 72 1HB ARG 72 -4.431 -13.898 -1.219 223 HB3 ARG 72 2HB ARG 72 -6.108 -14.132 -1.691 224 HG2 ARG 72 1HG ARG 72 -4.019 -14.321 -3.797 225 HG3 ARG 72 2HG ARG 72 -4.171 -15.645 -2.641 226 HD2 ARG 72 1HD ARG 72 -6.336 -14.553 -4.431 227 HD3 ARG 72 2HD ARG 72 -5.513 -16.103 -4.602 228 HE ARG 72 HE ARG 72 -6.577 -16.260 -2.127 229 HH11 ARG 72 1HH1 ARG 72 -7.941 -15.451 -5.247 230 HH12 ARG 72 2HH1 ARG 72 -9.520 -16.030 -4.844 231 HH21 ARG 72 1HH2 ARG 72 -8.664 -17.022 -1.601 232 HH22 ARG 72 2HH2 ARG 72 -9.932 -16.921 -2.777 233 H ARG 73 H ARG 73 -7.484 -12.538 -3.599 234 HA ARG 73 HA ARG 73 -8.736 -10.606 -1.781 235 HB2 ARG 73 1HB ARG 73 -8.872 -10.445 -4.363 236 HB3 ARG 73 2HB ARG 73 -10.031 -11.763 -4.237 237 HG2 ARG 73 1HG ARG 73 -11.080 -10.088 -2.427 238 HG3 ARG 73 2HG ARG 73 -10.304 -8.918 -3.496 239 HD2 ARG 73 1HD ARG 73 -11.945 -11.088 -4.709 240 HD3 ARG 73 2HD ARG 73 -12.772 -9.749 -3.918 241 HE ARG 73 HE ARG 73 -11.982 -8.301 -5.562 242 HH11 ARG 73 1HH1 ARG 73 -10.750 -11.544 -6.069 243 HH12 ARG 73 2HH1 ARG 73 -10.227 -11.224 -7.685 244 HH21 ARG 73 1HH2 ARG 73 -11.286 -7.892 -7.697 245 HH22 ARG 73 2HH2 ARG 73 -10.530 -9.154 -8.609 246 H LYS 74 H LYS 74 -9.518 -11.578 -0.008 247 HA LYS 74 HA LYS 74 -10.817 -14.197 -0.272 248 HB2 LYS 74 1HB LYS 74 -10.723 -14.079 2.305 249 HB3 LYS 74 2HB LYS 74 -9.230 -14.360 1.423 250 HG2 LYS 74 1HG LYS 74 -8.417 -12.240 1.855 251 HG3 LYS 74 2HG LYS 74 -10.022 -11.580 2.179 252 HD2 LYS 74 1HD LYS 74 -9.168 -13.745 3.981 253 HD3 LYS 74 2HD LYS 74 -8.232 -12.255 4.098 254 HE2 LYS 74 1HE LYS 74 -10.398 -11.018 4.324 255 HE3 LYS 74 2HE LYS 74 -11.209 -12.580 4.430 256 HZ1 LYS 74 3HZ LYS 74 -10.746 -11.619 6.616 257 HZ2 LYS 74 1HZ LYS 74 -9.088 -11.632 6.285 258 HZ3 LYS 74 2HZ LYS 74 -9.940 -13.089 6.403 259 H GLU 75 H GLU 75 -12.944 -14.440 -0.074 260 HA GLU 75 HA GLU 75 -14.547 -12.117 0.763 261 HB2 GLU 75 1HB GLU 75 -14.712 -13.534 -1.556 262 HB3 GLU 75 2HB GLU 75 -15.893 -14.382 -0.570 263 HG2 GLU 75 1HG GLU 75 -16.705 -11.915 -0.066 264 HG3 GLU 75 2HG GLU 75 -15.931 -11.610 -1.620 265 H THR 76 H THR 76 -14.952 -12.308 2.895 266 HA THR 76 HA THR 76 -15.853 -14.925 3.889 267 HB THR 76 HB THR 76 -13.849 -14.100 5.006 268 HG1 THR 76 HG1 THR 76 -14.584 -14.796 6.837 269 HG21 THR 76 3HG2 THR 76 -14.028 -12.137 6.535 270 HG22 THR 76 1HG2 THR 76 -15.509 -11.691 5.690 271 HG23 THR 76 2HG2 THR 76 -13.979 -11.741 4.817 272 H LYS 77 H LYS 77 -17.846 -15.170 4.683 273 HA LYS 77 HA LYS 77 -19.629 -12.859 4.595 274 HB2 LYS 77 1HB LYS 77 -21.449 -14.535 4.727 275 HB3 LYS 77 2HB LYS 77 -20.376 -14.801 3.361 276 HG2 LYS 77 1HG LYS 77 -19.342 -16.310 5.503 277 HG3 LYS 77 2HG LYS 77 -21.084 -16.584 5.475 278 HD2 LYS 77 1HD LYS 77 -20.980 -17.764 3.571 279 HD3 LYS 77 2HD LYS 77 -19.852 -16.630 2.824 280 HE2 LYS 77 1HE LYS 77 -18.451 -18.406 2.987 281 HE3 LYS 77 2HE LYS 77 -18.202 -17.742 4.602 282 HZ1 LYS 77 3HZ LYS 77 -19.619 -19.339 5.542 283 HZ2 LYS 77 1HZ LYS 77 -18.660 -20.205 4.448 284 HZ3 LYS 77 2HZ LYS 77 -20.254 -19.806 4.044 285 H ASP 78 H ASP 78 -21.327 -12.688 6.291 286 HA ASP 78 HA ASP 78 -20.100 -12.973 8.927 287 HB2 ASP 78 1HB ASP 78 -21.922 -11.436 9.659 288 HB3 ASP 78 2HB ASP 78 -20.903 -10.763 8.397 289 H SER 79 H SER 79 -21.499 -15.190 7.355 290 HA SER 79 HA SER 79 -22.899 -16.940 7.719 291 HB2 SER 79 1HB SER 79 -21.311 -16.733 9.869 292 HB3 SER 79 2HB SER 79 -22.871 -16.509 10.662 293 HG SER 79 HG SER 79 -23.429 -18.521 10.179 294 H LEU 80 H LEU 80 -24.236 -14.524 7.180 295 HA LEU 80 HA LEU 80 -26.316 -13.620 7.167 296 HB2 LEU 80 1HB LEU 80 -26.762 -16.242 7.273 297 HB3 LEU 80 2HB LEU 80 -27.449 -15.813 8.828 298 HG LEU 80 HG LEU 80 -28.687 -13.983 7.299 299 HD11 LEU 80 1HD1 LEU 80 -28.072 -14.416 5.159 300 HD12 LEU 80 2HD1 LEU 80 -29.416 -15.550 5.277 301 HD13 LEU 80 3HD1 LEU 80 -27.760 -16.122 5.472 302 HD21 LEU 80 3HD2 LEU 80 -30.517 -15.812 7.065 303 HD22 LEU 80 1HD2 LEU 80 -30.011 -15.289 8.670 304 HD23 LEU 80 2HD2 LEU 80 -29.397 -16.801 8.002 305 H ASN 81 H ASN 81 -25.098 -12.154 8.706 306 HA ASN 81 HA ASN 81 -25.584 -12.243 11.486 307 HB2 ASN 81 1HB ASN 81 -23.967 -10.757 9.871 308 HB3 ASN 81 2HB ASN 81 -25.199 -9.573 10.286 309 HD21 ASN 81 2HD2 ASN 81 -23.551 -8.416 11.399 310 HD22 ASN 81 1HD2 ASN 81 -23.054 -8.907 12.989 311 H THR 82 H THR 82 -27.282 -10.666 8.809 312 HA THR 82 HA THR 82 -29.652 -10.437 10.472 313 HB THR 82 HB THR 82 -28.722 -8.306 10.946 314 HG1 THR 82 HG1 THR 82 -30.492 -7.841 8.785 315 HG21 THR 82 3HG2 THR 82 -27.154 -8.389 8.871 316 HG22 THR 82 1HG2 THR 82 -27.685 -6.842 9.528 317 HG23 THR 82 2HG2 THR 82 -28.465 -7.504 8.090 318 H ASN 83 H ASN 83 -28.316 -9.552 7.265 319 HA ASN 83 HA ASN 83 -30.542 -10.976 6.013 320 HB2 ASN 83 1HB ASN 83 -30.048 -8.058 5.856 321 HB3 ASN 83 2HB ASN 83 -30.412 -8.856 4.332 322 HD21 ASN 83 2HD2 ASN 83 -31.970 -6.906 5.807 323 HD22 ASN 83 1HD2 ASN 83 -33.499 -7.656 6.138 324 H SER 84 H SER 84 -27.831 -11.720 6.308 325 HA SER 84 HA SER 84 -26.101 -12.597 5.133 326 HB2 SER 84 1HB SER 84 -28.308 -13.130 3.630 327 HB3 SER 84 2HB SER 84 -27.321 -12.241 2.470 328 HG SER 84 HG SER 84 -25.628 -13.729 2.908 329 H SER 85 H SER 85 -24.724 -10.859 5.582 330 HA SER 85 HA SER 85 -24.281 -9.038 3.313 331 HB2 SER 85 1HB SER 85 -25.136 -8.106 5.625 332 HB3 SER 85 2HB SER 85 -23.444 -8.283 6.089 333 HG SER 85 HG SER 85 -22.945 -6.643 4.866 334 H PHE 86 H PHE 86 -22.613 -9.950 2.271 335 HA PHE 86 HA PHE 86 -20.527 -11.402 3.532 336 HB2 PHE 86 1HB PHE 86 -21.075 -10.417 0.777 337 HB3 PHE 86 2HB PHE 86 -19.410 -10.833 1.166 338 HD1 PHE 86 HD2 PHE 86 -22.867 -12.173 1.183 339 HD2 PHE 86 HD1 PHE 86 -18.704 -13.051 1.142 340 HE1 PHE 86 HE2 PHE 86 -23.376 -14.547 0.789 341 HE2 PHE 86 HE1 PHE 86 -19.204 -15.426 0.746 342 HZ PHE 86 HZ PHE 86 -21.543 -16.177 0.569 343 H ASN 87 H ASN 87 -18.256 -10.848 3.587 344 HA ASN 87 HA ASN 87 -17.695 -7.969 3.681 345 HB2 ASN 87 1HB ASN 87 -16.844 -9.989 5.772 346 HB3 ASN 87 2HB ASN 87 -16.390 -8.288 5.744 347 HD21 ASN 87 2HD2 ASN 87 -17.679 -6.850 6.708 348 HD22 ASN 87 1HD2 ASN 87 -19.250 -7.204 7.356 349 H VAL 88 H VAL 88 -16.715 -8.354 1.616 350 HA VAL 88 HA VAL 88 -14.383 -10.080 1.522 351 HB VAL 88 HB VAL 88 -15.758 -10.067 -0.446 352 HG11 VAL 88 1HG1 VAL 88 -15.806 -7.931 -1.860 353 HG12 VAL 88 2HG1 VAL 88 -15.373 -7.095 -0.370 354 HG13 VAL 88 3HG1 VAL 88 -16.873 -8.017 -0.459 355 HG21 VAL 88 3HG2 VAL 88 -14.058 -10.108 -1.938 356 HG22 VAL 88 1HG2 VAL 88 -13.087 -9.901 -0.481 357 HG23 VAL 88 2HG2 VAL 88 -13.476 -8.506 -1.487 358 H LEU 89 H LEU 89 -12.302 -9.459 1.529 359 HA LEU 89 HA LEU 89 -11.688 -6.585 1.592 360 HB2 LEU 89 1HB LEU 89 -10.354 -8.557 3.430 361 HB3 LEU 89 2HB LEU 89 -10.267 -6.808 3.480 362 HG LEU 89 HG LEU 89 -12.781 -8.372 4.051 363 HD11 LEU 89 1HD1 LEU 89 -10.776 -8.713 5.631 364 HD12 LEU 89 2HD1 LEU 89 -12.337 -8.280 6.324 365 HD13 LEU 89 3HD1 LEU 89 -11.088 -7.051 6.134 366 HD21 LEU 89 3HD2 LEU 89 -12.347 -5.644 5.084 367 HD22 LEU 89 1HD2 LEU 89 -13.808 -6.401 4.455 368 HD23 LEU 89 2HD2 LEU 89 -12.588 -5.785 3.343 369 H TYR 90 H TYR 90 -9.131 -6.388 1.677 370 HA TYR 90 HA TYR 90 -8.067 -8.159 -0.425 371 HB2 TYR 90 1HB TYR 90 -8.049 -5.222 -0.109 372 HB3 TYR 90 2HB TYR 90 -6.520 -5.932 -0.621 373 HD1 TYR 90 HD2 TYR 90 -7.552 -8.203 -2.259 374 HD2 TYR 90 HD1 TYR 90 -8.772 -4.133 -2.066 375 HE1 TYR 90 HE2 TYR 90 -8.386 -8.352 -4.557 376 HE2 TYR 90 HE1 TYR 90 -9.610 -4.270 -4.373 377 HH TYR 90 HH TYR 90 -10.472 -6.527 -5.885 378 H LYS 91 H LYS 91 -6.706 -9.560 0.517 379 HA LYS 91 HA LYS 91 -5.268 -8.978 2.917 380 HB2 LYS 91 1HB LYS 91 -5.078 -11.250 0.934 381 HB3 LYS 91 2HB LYS 91 -4.109 -11.168 2.399 382 HG2 LYS 91 1HG LYS 91 -6.988 -10.830 2.834 383 HG3 LYS 91 2HG LYS 91 -6.517 -12.402 2.183 384 HD2 LYS 91 1HD LYS 91 -4.685 -11.693 4.245 385 HD3 LYS 91 2HD LYS 91 -6.326 -11.472 4.854 386 HE2 LYS 91 1HE LYS 91 -6.860 -13.768 4.039 387 HE3 LYS 91 2HE LYS 91 -5.156 -13.968 3.633 388 HZ1 LYS 91 3HZ LYS 91 -4.693 -13.443 6.036 389 HZ2 LYS 91 1HZ LYS 91 -5.452 -14.928 5.744 390 HZ3 LYS 91 2HZ LYS 91 -6.351 -13.618 6.320 391 H VAL 92 H VAL 92 -4.033 -7.138 2.494 392 HA VAL 92 HA VAL 92 -1.897 -7.429 0.492 393 HB VAL 92 HB VAL 92 -1.664 -5.032 0.506 394 HG11 VAL 92 1HG1 VAL 92 -4.393 -4.643 0.211 395 HG12 VAL 92 2HG1 VAL 92 -4.159 -6.357 -0.129 396 HG13 VAL 92 3HG1 VAL 92 -3.258 -5.147 -1.041 397 HG21 VAL 92 3HG2 VAL 92 -2.029 -4.480 2.798 398 HG22 VAL 92 1HG2 VAL 92 -3.685 -5.090 2.743 399 HG23 VAL 92 2HG2 VAL 92 -3.253 -3.631 1.854 400 H LEU 93 H LEU 93 0.248 -6.719 1.021 401 HA LEU 93 HA LEU 93 0.903 -7.144 3.857 402 HB2 LEU 93 1HB LEU 93 2.196 -7.860 1.314 403 HB3 LEU 93 2HB LEU 93 3.293 -7.238 2.530 404 HG LEU 93 HG LEU 93 1.387 -9.461 3.190 405 HD11 LEU 93 1HD1 LEU 93 4.143 -10.194 2.453 406 HD12 LEU 93 2HD1 LEU 93 3.079 -9.758 1.116 407 HD13 LEU 93 3HD1 LEU 93 2.628 -11.065 2.211 408 HD21 LEU 93 3HD2 LEU 93 2.770 -8.117 4.899 409 HD22 LEU 93 1HD2 LEU 93 4.150 -9.011 4.260 410 HD23 LEU 93 2HD2 LEU 93 2.799 -9.879 4.991 411 H PHE 94 H PHE 94 1.862 -5.557 5.045 412 HA PHE 94 HA PHE 94 2.273 -2.987 3.691 413 HB2 PHE 94 1HB PHE 94 1.748 -3.816 6.498 414 HB3 PHE 94 2HB PHE 94 2.656 -2.335 6.246 415 HD1 PHE 94 HD1 PHE 94 -0.367 -3.924 4.699 416 HD2 PHE 94 HD2 PHE 94 1.400 -0.451 6.417 417 HE1 PHE 94 HE1 PHE 94 -2.463 -2.686 4.346 418 HE2 PHE 94 HE2 PHE 94 -0.690 0.791 6.064 419 HZ PHE 94 HZ PHE 94 -2.627 -0.326 5.030 420 H PHE 95 H PHE 95 4.165 -1.652 4.305 421 HA PHE 95 HA PHE 95 6.504 -3.168 5.173 422 HB2 PHE 95 1HB PHE 95 6.636 -1.547 2.635 423 HB3 PHE 95 2HB PHE 95 7.816 -2.693 3.260 424 HD1 PHE 95 HD2 PHE 95 7.443 -5.095 3.065 425 HD2 PHE 95 HD1 PHE 95 4.701 -2.287 1.422 426 HE1 PHE 95 HE2 PHE 95 6.423 -6.883 1.721 427 HE2 PHE 95 HE1 PHE 95 3.674 -4.070 0.079 428 HZ PHE 95 HZ PHE 95 4.534 -6.373 0.227 429 HA PRO 96 HA PRO 96 8.634 -2.774 5.036 430 HB2 PRO 96 1HB PRO 96 10.519 -2.017 6.992 431 HB3 PRO 96 2HB PRO 96 10.641 -1.757 5.250 432 HG2 PRO 96 1HG PRO 96 10.368 0.230 7.220 433 HG3 PRO 96 2HG PRO 96 10.190 0.449 5.474 434 HD2 PRO 96 1HD PRO 96 8.103 0.143 7.569 435 HD3 PRO 96 2HD PRO 96 8.057 1.057 6.047 436 H ASP 97 H ASP 97 9.920 -4.211 6.801 437 HA ASP 97 HA ASP 97 9.843 -5.627 8.569 438 HB2 ASP 97 1HB ASP 97 7.831 -3.717 9.771 439 HB3 ASP 97 2HB ASP 97 8.696 -4.994 10.621 440 H PHE 98 H PHE 98 7.347 -5.188 6.472 441 HA PHE 98 HA PHE 98 5.582 -6.454 5.819 442 HB2 PHE 98 1HB PHE 98 6.856 -8.499 7.648 443 HB3 PHE 98 2HB PHE 98 5.594 -8.845 6.473 444 HD1 PHE 98 HD1 PHE 98 9.100 -7.676 6.820 445 HD2 PHE 98 HD2 PHE 98 6.117 -9.273 4.238 446 HE1 PHE 98 HE1 PHE 98 10.811 -8.086 5.099 447 HE2 PHE 98 HE2 PHE 98 7.822 -9.685 2.515 448 HZ PHE 98 HZ PHE 98 10.174 -9.093 2.944 449 H ASN 99 H ASN 99 3.799 -5.416 6.605 450 HA ASN 99 HA ASN 99 2.691 -6.459 9.120 451 HB2 ASN 99 1HB ASN 99 2.610 -3.545 8.346 452 HB3 ASN 99 2HB ASN 99 1.954 -4.263 9.810 453 HD21 ASN 99 2HD2 ASN 99 4.463 -2.542 8.608 454 HD22 ASN 99 1HD2 ASN 99 5.673 -2.926 9.792 455 H PHE 100 H PHE 100 1.874 -7.533 6.868 456 HA PHE 100 HA PHE 100 -0.012 -6.470 5.240 457 HB2 PHE 100 1HB PHE 100 -1.056 -8.756 5.170 458 HB3 PHE 100 2HB PHE 100 0.683 -8.729 4.917 459 HD1 PHE 100 HD2 PHE 100 2.189 -9.286 6.869 460 HD2 PHE 100 HD1 PHE 100 -1.999 -10.034 6.872 461 HE1 PHE 100 HE2 PHE 100 2.484 -10.925 8.685 462 HE2 PHE 100 HE1 PHE 100 -1.716 -11.663 8.689 463 HZ PHE 100 HZ PHE 100 0.530 -12.115 9.597 464 H ALA 101 H ALA 101 -2.282 -6.373 5.183 465 HA ALA 101 HA ALA 101 -3.738 -6.546 7.708 466 HB1 ALA 101 3HB ALA 101 -4.703 -4.176 6.713 467 HB2 ALA 101 1HB ALA 101 -2.972 -4.050 6.393 468 HB3 ALA 101 2HB ALA 101 -3.547 -4.336 8.036 469 H TRP 102 H TRP 102 -6.070 -6.426 7.430 470 HA TRP 102 HA TRP 102 -6.919 -7.224 4.721 471 HB2 TRP 102 1HB TRP 102 -8.885 -8.289 6.154 472 HB3 TRP 102 2HB TRP 102 -7.377 -9.153 5.885 473 HD1 TRP 102 HD1 TRP 102 -5.566 -9.024 8.004 474 HE1 TRP 102 HE1 TRP 102 -6.040 -9.006 10.531 475 HE3 TRP 102 HE3 TRP 102 -10.473 -7.588 7.901 476 HZ2 TRP 102 HZ2 TRP 102 -8.208 -8.461 12.256 477 HZ3 TRP 102 HZ3 TRP 102 -11.674 -7.344 10.033 478 HH2 TRP 102 HH2 TRP 102 -10.564 -7.771 12.165 479 H VAL 103 H VAL 103 -7.811 -5.456 3.827 480 HA VAL 103 HA VAL 103 -9.975 -4.124 5.307 481 HB VAL 103 HB VAL 103 -9.295 -1.944 4.359 482 HG11 VAL 103 1HG1 VAL 103 -8.664 -2.194 6.579 483 HG12 VAL 103 2HG1 VAL 103 -7.157 -1.738 5.785 484 HG13 VAL 103 3HG1 VAL 103 -7.457 -3.424 6.203 485 HG21 VAL 103 3HG2 VAL 103 -7.854 -1.901 2.663 486 HG22 VAL 103 1HG2 VAL 103 -7.422 -3.592 2.914 487 HG23 VAL 103 2HG2 VAL 103 -6.579 -2.326 3.805 488 H LYS 104 H LYS 104 -11.484 -2.929 3.916 489 HA LYS 104 HA LYS 104 -12.247 -4.483 1.654 490 HB2 LYS 104 1HB LYS 104 -13.741 -3.145 3.287 491 HB3 LYS 104 2HB LYS 104 -13.350 -1.757 2.281 492 HG2 LYS 104 1HG LYS 104 -14.550 -2.535 0.493 493 HG3 LYS 104 2HG LYS 104 -14.380 -4.225 0.975 494 HD2 LYS 104 1HD LYS 104 -15.795 -3.144 3.063 495 HD3 LYS 104 2HD LYS 104 -16.434 -2.267 1.673 496 HE2 LYS 104 1HE LYS 104 -16.207 -5.269 1.819 497 HE3 LYS 104 2HE LYS 104 -17.664 -4.370 2.241 498 HZ1 LYS 104 3HZ LYS 104 -17.952 -5.035 0.031 499 HZ2 LYS 104 1HZ LYS 104 -16.374 -4.615 -0.412 500 HZ3 LYS 104 2HZ LYS 104 -17.510 -3.406 -0.078 501 H ARG 105 H ARG 105 -12.748 -3.503 -0.487 502 HA ARG 105 HA ARG 105 -10.422 -2.469 -1.690 503 HB2 ARG 105 1HB ARG 105 -13.177 -2.327 -2.900 504 HB3 ARG 105 2HB ARG 105 -11.636 -2.452 -3.732 505 HG2 ARG 105 1HG ARG 105 -11.470 -4.697 -3.392 506 HG3 ARG 105 2HG ARG 105 -12.394 -4.657 -1.891 507 HD2 ARG 105 1HD ARG 105 -13.484 -4.389 -4.690 508 HD3 ARG 105 2HD ARG 105 -13.659 -5.781 -3.623 509 HE ARG 105 HE ARG 105 -14.703 -3.403 -2.443 510 HH11 ARG 105 1HH1 ARG 105 -15.431 -5.944 -4.735 511 HH12 ARG 105 2HH1 ARG 105 -17.145 -5.761 -4.585 512 HH21 ARG 105 1HH2 ARG 105 -16.969 -3.153 -2.260 513 HH22 ARG 105 2HH2 ARG 105 -18.018 -4.177 -3.183 514 H ASN 106 H ASN 106 -13.133 -0.876 -0.214 515 HA ASN 106 HA ASN 106 -12.877 1.618 -1.558 516 HB2 ASN 106 1HB ASN 106 -14.229 2.526 0.354 517 HB3 ASN 106 2HB ASN 106 -14.968 1.171 -0.488 518 HD21 ASN 106 2HD2 ASN 106 -13.156 2.091 2.392 519 HD22 ASN 106 1HD2 ASN 106 -13.739 0.793 3.387 520 H SER 107 H SER 107 -11.351 0.225 1.282 521 HA SER 107 HA SER 107 -10.071 2.749 1.965 522 HB2 SER 107 1HB SER 107 -9.564 0.043 3.219 523 HB3 SER 107 2HB SER 107 -9.204 1.631 3.898 524 HG SER 107 HG SER 107 -11.369 1.993 4.180 525 H VAL 108 H VAL 108 -9.551 0.883 -0.520 526 HA VAL 108 HA VAL 108 -6.621 0.999 -0.315 527 HB VAL 108 HB VAL 108 -8.311 -1.103 -1.665 528 HG11 VAL 108 1HG1 VAL 108 -5.352 -0.581 -1.824 529 HG12 VAL 108 2HG1 VAL 108 -6.505 -0.761 -3.146 530 HG13 VAL 108 3HG1 VAL 108 -6.059 -2.160 -2.171 531 HG21 VAL 108 3HG2 VAL 108 -6.588 -2.436 -0.076 532 HG22 VAL 108 1HG2 VAL 108 -8.202 -1.934 0.423 533 HG23 VAL 108 2HG2 VAL 108 -6.802 -0.955 0.856 534 H LYS 109 H LYS 109 -5.506 1.756 -2.093 535 HA LYS 109 HA LYS 109 -7.076 2.623 -4.427 536 HB2 LYS 109 1HB LYS 109 -6.720 4.557 -2.950 537 HB3 LYS 109 2HB LYS 109 -4.987 4.262 -2.973 538 HG2 LYS 109 1HG LYS 109 -5.027 5.831 -4.581 539 HG3 LYS 109 2HG LYS 109 -5.444 4.460 -5.610 540 HD2 LYS 109 1HD LYS 109 -7.889 5.044 -4.944 541 HD3 LYS 109 2HD LYS 109 -7.209 6.612 -4.507 542 HE2 LYS 109 1HE LYS 109 -6.870 7.209 -6.653 543 HE3 LYS 109 2HE LYS 109 -6.393 5.584 -7.139 544 HZ1 LYS 109 3HZ LYS 109 -9.212 6.181 -6.511 545 HZ2 LYS 109 1HZ LYS 109 -8.574 4.957 -7.491 546 HZ3 LYS 109 2HZ LYS 109 -8.580 6.558 -8.033 547 HA PRO 110 HA PRO 110 -3.971 0.401 -6.717 548 HB2 PRO 110 1HB PRO 110 -4.535 2.429 -8.817 549 HB3 PRO 110 2HB PRO 110 -4.576 0.666 -8.916 550 HG2 PRO 110 1HG PRO 110 -6.831 2.086 -8.836 551 HG3 PRO 110 2HG PRO 110 -6.696 0.532 -7.997 552 HD2 PRO 110 1HD PRO 110 -6.629 3.300 -6.882 553 HD3 PRO 110 2HD PRO 110 -7.335 1.823 -6.197 554 H LEU 111 H LEU 111 -1.823 0.606 -6.595 555 HA LEU 111 HA LEU 111 -0.659 3.310 -6.690 556 HB2 LEU 111 1HB LEU 111 -0.465 1.942 -4.547 557 HB3 LEU 111 2HB LEU 111 0.613 0.885 -5.435 558 HG LEU 111 HG LEU 111 2.135 2.795 -5.828 559 HD11 LEU 111 1HD1 LEU 111 1.727 4.804 -4.298 560 HD12 LEU 111 2HD1 LEU 111 0.053 4.251 -4.233 561 HD13 LEU 111 3HD1 LEU 111 0.777 4.695 -5.778 562 HD21 LEU 111 3HD2 LEU 111 2.695 3.109 -3.309 563 HD22 LEU 111 1HD2 LEU 111 2.823 1.508 -4.036 564 HD23 LEU 111 2HD2 LEU 111 1.414 1.921 -3.061 565 H LEU 112 H LEU 112 1.324 3.615 -7.807 566 HA LEU 112 HA LEU 112 2.075 1.455 -9.654 567 HB2 LEU 112 1HB LEU 112 2.505 3.452 -11.301 568 HB3 LEU 112 2HB LEU 112 0.919 2.721 -11.165 569 HG LEU 112 HG LEU 112 1.537 5.095 -9.466 570 HD11 LEU 112 1HD1 LEU 112 0.391 5.649 -12.128 571 HD12 LEU 112 2HD1 LEU 112 2.122 5.317 -12.074 572 HD13 LEU 112 3HD1 LEU 112 1.447 6.632 -11.114 573 HD21 LEU 112 3HD2 LEU 112 -0.564 4.009 -9.102 574 HD22 LEU 112 1HD2 LEU 112 -0.922 4.012 -10.829 575 HD23 LEU 112 2HD2 LEU 112 -0.872 5.532 -9.935 576 H ASP 113 H ASP 113 4.206 1.972 -10.775 577 HA ASP 113 HA ASP 113 6.180 2.402 -8.786 578 HB2 ASP 113 1HB ASP 113 6.146 1.661 -11.637 579 HB3 ASP 113 2HB ASP 113 7.592 2.522 -11.114 580 H SER 114 H SER 114 4.934 4.400 -11.430 581 HA SER 114 HA SER 114 6.850 6.452 -11.261 582 HB2 SER 114 1HB SER 114 5.495 7.663 -12.705 583 HB3 SER 114 2HB SER 114 4.963 6.015 -13.030 584 HG SER 114 HG SER 114 3.152 7.272 -12.728 585 H GLU 115 H GLU 115 3.983 5.756 -9.364 586 HA GLU 115 HA GLU 115 3.942 8.320 -8.059 587 HB2 GLU 115 1HB GLU 115 2.441 5.755 -7.753 588 HB3 GLU 115 2HB GLU 115 2.424 6.900 -6.420 589 HG2 GLU 115 1HG GLU 115 1.894 8.403 -8.724 590 HG3 GLU 115 2HG GLU 115 0.933 6.932 -8.866 591 H ILE 116 H ILE 116 5.026 5.051 -7.170 592 HA ILE 116 HA ILE 116 5.911 5.786 -4.565 593 HB ILE 116 HB ILE 116 6.892 3.456 -6.225 594 HG12 ILE 116 1HG1 ILE 116 4.724 3.260 -4.158 595 HG13 ILE 116 2HG1 ILE 116 4.323 3.738 -5.803 596 HG21 ILE 116 1HG2 ILE 116 6.669 3.329 -3.277 597 HG22 ILE 116 2HG2 ILE 116 7.956 4.336 -3.937 598 HG23 ILE 116 3HG2 ILE 116 7.874 2.627 -4.356 599 HD11 ILE 116 3HD1 ILE 116 5.958 1.457 -5.995 600 HD12 ILE 116 1HD1 ILE 116 4.238 1.606 -6.360 601 HD13 ILE 116 2HD1 ILE 116 4.759 1.136 -4.742 602 H ALA 117 H ALA 117 7.444 5.568 -7.728 603 HA ALA 117 HA ALA 117 10.119 5.932 -7.054 604 HB1 ALA 117 3HB ALA 117 10.386 6.802 -9.328 605 HB2 ALA 117 1HB ALA 117 8.637 6.995 -9.457 606 HB3 ALA 117 2HB ALA 117 9.339 5.380 -9.311 607 H LYS 118 H LYS 118 7.820 8.409 -8.139 608 HA LYS 118 HA LYS 118 9.444 10.623 -7.523 609 HB2 LYS 118 1HB LYS 118 7.832 11.664 -8.669 610 HB3 LYS 118 2HB LYS 118 6.964 10.138 -8.734 611 HG2 LYS 118 1HG LYS 118 6.642 11.831 -6.317 612 HG3 LYS 118 2HG LYS 118 5.828 12.306 -7.813 613 HD2 LYS 118 1HD LYS 118 5.396 9.562 -7.606 614 HD3 LYS 118 2HD LYS 118 5.188 10.177 -5.964 615 HE2 LYS 118 1HE LYS 118 3.890 11.650 -8.202 616 HE3 LYS 118 2HE LYS 118 3.182 10.125 -7.678 617 HZ1 LYS 118 3HZ LYS 118 2.875 10.964 -5.502 618 HZ2 LYS 118 1HZ LYS 118 2.288 12.149 -6.556 619 HZ3 LYS 118 2HZ LYS 118 3.795 12.349 -5.815 620 H PHE 119 H PHE 119 6.909 8.943 -5.716 621 HA PHE 119 HA PHE 119 6.555 10.660 -3.580 622 HB2 PHE 119 1HB PHE 119 5.185 8.704 -3.675 623 HB3 PHE 119 2HB PHE 119 6.586 7.637 -3.630 624 HD1 PHE 119 HD1 PHE 119 7.927 7.470 -1.523 625 HD2 PHE 119 HD2 PHE 119 4.169 9.465 -1.686 626 HE1 PHE 119 HE1 PHE 119 7.751 7.327 0.925 627 HE2 PHE 119 HE2 PHE 119 3.991 9.326 0.765 628 HZ PHE 119 HZ PHE 119 5.789 8.257 2.067 629 H LEU 120 H LEU 120 8.944 8.022 -3.763 630 HA LEU 120 HA LEU 120 10.210 8.546 -1.330 631 HB2 LEU 120 1HB LEU 120 11.318 7.346 -3.864 632 HB3 LEU 120 2HB LEU 120 12.146 7.334 -2.316 633 HG LEU 120 HG LEU 120 9.398 6.227 -2.353 634 HD11 LEU 120 1HD1 LEU 120 10.798 4.003 -3.001 635 HD12 LEU 120 2HD1 LEU 120 11.590 5.196 -4.030 636 HD13 LEU 120 3HD1 LEU 120 9.849 4.944 -4.151 637 HD21 LEU 120 3HD2 LEU 120 11.925 5.929 -0.860 638 HD22 LEU 120 1HD2 LEU 120 10.946 4.474 -1.038 639 HD23 LEU 120 2HD2 LEU 120 10.256 5.913 -0.291 640 H GLY 121 H GLY 121 10.561 10.058 -4.468 641 HA2 GLY 121 1HA GLY 121 12.936 11.530 -3.631 642 HA3 GLY 121 2HA GLY 121 12.180 11.590 -5.213 643 H SER 122 H SER 122 10.028 11.905 -2.548 644 HA SER 122 HA SER 122 9.117 14.436 -3.330 645 HB2 SER 122 1HB SER 122 7.772 12.823 -2.009 646 HB3 SER 122 2HB SER 122 8.813 13.119 -0.617 647 HG SER 122 HG SER 122 7.231 14.528 -0.276 648 H SER 123 H SER 123 10.184 16.294 -3.215 649 HA SER 123 HA SER 123 12.223 16.685 -1.166 650 HB2 SER 123 1HB SER 123 12.921 18.618 -2.487 651 HB3 SER 123 2HB SER 123 12.781 17.193 -3.518 652 HG SER 123 HG SER 123 11.556 18.451 -4.677 653 H LYS 124 H LYS 124 8.955 17.384 -1.578 654 HA LYS 124 HA LYS 124 9.041 19.898 -0.103 655 HB2 LYS 124 1HB LYS 124 6.544 19.837 -0.432 656 HB3 LYS 124 2HB LYS 124 7.498 19.908 -1.907 657 HG2 LYS 124 1HG LYS 124 7.017 17.173 -1.204 658 HG3 LYS 124 2HG LYS 124 5.493 18.064 -1.235 659 HD2 LYS 124 1HD LYS 124 6.484 19.011 -3.484 660 HD3 LYS 124 2HD LYS 124 7.436 17.522 -3.427 661 HE2 LYS 124 1HE LYS 124 4.527 17.293 -2.913 662 HE3 LYS 124 2HE LYS 124 5.019 17.661 -4.566 663 HZ1 LYS 124 3HZ LYS 124 5.112 15.410 -4.647 664 HZ2 LYS 124 1HZ LYS 124 5.437 15.235 -2.996 665 HZ3 LYS 124 2HZ LYS 124 6.675 15.679 -4.059 666 H ARG 125 H ARG 125 7.480 16.700 0.262 667 HA ARG 125 HA ARG 125 7.685 17.021 3.157 668 HB2 ARG 125 1HB ARG 125 5.344 17.570 2.208 669 HB3 ARG 125 2HB ARG 125 5.213 15.843 1.906 670 HG2 ARG 125 1HG ARG 125 4.188 16.091 3.962 671 HG3 ARG 125 2HG ARG 125 5.822 15.588 4.400 672 HD2 ARG 125 1HD ARG 125 5.168 17.402 5.825 673 HD3 ARG 125 2HD ARG 125 6.413 17.978 4.718 674 HE ARG 125 HE ARG 125 4.103 18.637 3.460 675 HH11 ARG 125 1HH1 ARG 125 5.326 19.236 6.685 676 HH12 ARG 125 2HH1 ARG 125 4.481 20.735 6.863 677 HH21 ARG 125 1HH2 ARG 125 2.997 20.625 3.700 678 HH22 ARG 125 2HH2 ARG 125 3.161 21.522 5.171 679 H LYS 126 H LYS 126 9.194 15.533 3.472 680 HA LYS 126 HA LYS 126 8.553 12.764 2.769 681 HB2 LYS 126 1HB LYS 126 10.839 12.307 2.120 682 HB3 LYS 126 2HB LYS 126 10.206 13.624 1.148 683 HG2 LYS 126 1HG LYS 126 11.897 14.083 3.588 684 HG3 LYS 126 2HG LYS 126 12.577 13.868 1.975 685 HD2 LYS 126 1HD LYS 126 10.495 15.779 1.775 686 HD3 LYS 126 2HD LYS 126 11.493 16.226 3.160 687 HE2 LYS 126 1HE LYS 126 12.735 15.498 0.534 688 HE3 LYS 126 2HE LYS 126 12.114 17.122 0.818 689 HZ1 LYS 126 3HZ LYS 126 13.921 15.962 2.815 690 HZ2 LYS 126 1HZ LYS 126 13.732 17.575 2.338 691 HZ3 LYS 126 2HZ LYS 126 14.587 16.496 1.356 692 H SER 127 H SER 127 8.929 11.289 4.331 693 HA SER 127 HA SER 127 10.417 12.142 6.723 694 HB2 SER 127 1HB SER 127 8.382 10.350 7.558 695 HB3 SER 127 2HB SER 127 8.540 12.062 7.954 696 HG SER 127 HG SER 127 7.186 12.577 6.318 697 H LYS 128 H LYS 128 11.496 10.475 7.857 698 HA LYS 128 HA LYS 128 12.615 8.446 6.312 699 HB2 LYS 128 1HB LYS 128 12.841 9.366 9.009 700 HB3 LYS 128 2HB LYS 128 12.679 7.614 9.039 701 HG2 LYS 128 1HG LYS 128 14.717 7.282 8.174 702 HG3 LYS 128 2HG LYS 128 14.564 8.617 7.031 703 HD2 LYS 128 1HD LYS 128 15.911 9.826 8.320 704 HD3 LYS 128 2HD LYS 128 14.696 9.771 9.598 705 HE2 LYS 128 1HE LYS 128 15.842 8.242 10.789 706 HE3 LYS 128 2HE LYS 128 16.330 7.343 9.353 707 HZ1 LYS 128 3HZ LYS 128 17.597 9.780 10.474 708 HZ2 LYS 128 1HZ LYS 128 17.966 9.172 8.938 709 HZ3 LYS 128 2HZ LYS 128 18.279 8.239 10.313 710 H GLU 129 H GLU 129 9.970 8.284 8.676 711 HA GLU 129 HA GLU 129 9.500 5.512 8.449 712 HB2 GLU 129 1HB GLU 129 7.264 6.042 9.432 713 HB3 GLU 129 2HB GLU 129 8.617 6.699 10.343 714 HG2 GLU 129 1HG GLU 129 7.774 8.637 8.433 715 HG3 GLU 129 2HG GLU 129 6.363 8.056 9.311 716 H LEU 130 H LEU 130 8.341 8.288 6.603 717 HA LEU 130 HA LEU 130 6.369 6.784 5.154 718 HB2 LEU 130 1HB LEU 130 7.363 9.562 5.164 719 HB3 LEU 130 2HB LEU 130 6.800 8.985 3.610 720 HG LEU 130 HG LEU 130 5.054 10.186 4.854 721 HD11 LEU 130 1HD1 LEU 130 4.263 8.628 3.269 722 HD12 LEU 130 2HD1 LEU 130 3.309 8.370 4.729 723 HD13 LEU 130 3HD1 LEU 130 4.617 7.259 4.323 724 HD21 LEU 130 3HD2 LEU 130 5.363 9.855 7.103 725 HD22 LEU 130 1HD2 LEU 130 5.689 8.133 6.922 726 HD23 LEU 130 2HD2 LEU 130 4.038 8.737 6.785 727 H ILE 131 H ILE 131 9.560 8.141 4.298 728 HA ILE 131 HA ILE 131 9.639 7.157 1.683 729 HB ILE 131 HB ILE 131 11.998 7.556 3.525 730 HG12 ILE 131 1HG1 ILE 131 11.269 9.554 1.451 731 HG13 ILE 131 2HG1 ILE 131 10.239 9.490 2.877 732 HG21 ILE 131 1HG2 ILE 131 13.351 7.100 1.806 733 HG22 ILE 131 2HG2 ILE 131 12.363 8.021 0.672 734 HG23 ILE 131 3HG2 ILE 131 11.940 6.353 1.059 735 HD11 ILE 131 3HD1 ILE 131 11.705 10.904 3.771 736 HD12 ILE 131 1HD1 ILE 131 12.930 10.544 2.556 737 HD13 ILE 131 2HD1 ILE 131 12.750 9.497 3.963 738 H GLU 132 H GLU 132 10.962 5.719 4.671 739 HA GLU 132 HA GLU 132 12.015 3.400 3.573 740 HB2 GLU 132 1HB GLU 132 10.903 4.081 6.268 741 HB3 GLU 132 2HB GLU 132 11.346 2.417 5.913 742 HG2 GLU 132 1HG GLU 132 13.608 2.997 5.544 743 HG3 GLU 132 2HG GLU 132 13.233 4.720 5.534 744 H ALA 133 H ALA 133 8.689 4.244 4.264 745 HA ALA 133 HA ALA 133 7.598 1.638 4.102 746 HB1 ALA 133 3HB ALA 133 6.024 4.022 3.267 747 HB2 ALA 133 1HB ALA 133 6.572 3.902 4.937 748 HB3 ALA 133 2HB ALA 133 5.542 2.642 4.257 749 H TYR 134 H TYR 134 7.608 4.285 1.733 750 HA TYR 134 HA TYR 134 6.616 2.664 -0.372 751 HB2 TYR 134 1HB TYR 134 7.819 5.399 -0.214 752 HB3 TYR 134 2HB TYR 134 7.645 4.632 -1.790 753 HD1 TYR 134 HD1 TYR 134 5.610 5.278 1.287 754 HD2 TYR 134 HD2 TYR 134 5.683 5.002 -2.957 755 HE1 TYR 134 HE1 TYR 134 3.258 5.989 1.205 756 HE2 TYR 134 HE2 TYR 134 3.333 5.713 -3.051 757 HH TYR 134 HH TYR 134 1.347 5.897 -0.257 758 H GLU 135 H GLU 135 9.828 3.297 0.834 759 HA GLU 135 HA GLU 135 11.191 2.286 -1.476 760 HB2 GLU 135 1HB GLU 135 11.932 3.604 0.911 761 HB3 GLU 135 2HB GLU 135 12.764 2.055 0.922 762 HG2 GLU 135 1HG GLU 135 12.890 3.421 -1.650 763 HG3 GLU 135 2HG GLU 135 13.626 4.326 -0.329 764 H ALA 136 H ALA 136 9.787 0.909 1.402 765 HA ALA 136 HA ALA 136 11.191 -1.601 1.179 766 HB1 ALA 136 3HB ALA 136 8.749 -0.902 2.803 767 HB2 ALA 136 1HB ALA 136 10.421 -0.759 3.349 768 HB3 ALA 136 2HB ALA 136 9.746 -2.346 2.983 769 H SER 137 H SER 137 8.062 -0.304 0.208 770 HA SER 137 HA SER 137 7.057 -2.848 -0.704 771 HB2 SER 137 1HB SER 137 5.551 -1.088 0.182 772 HB3 SER 137 2HB SER 137 5.970 -0.063 -1.192 773 HG SER 137 HG SER 137 4.619 -2.555 -1.241 774 H LYS 138 H LYS 138 8.666 -0.076 -2.138 775 HA LYS 138 HA LYS 138 8.084 -0.492 -4.828 776 HB2 LYS 138 1HB LYS 138 9.296 1.476 -3.833 777 HB3 LYS 138 2HB LYS 138 10.736 0.473 -3.755 778 HG2 LYS 138 1HG LYS 138 11.227 0.967 -5.855 779 HG3 LYS 138 2HG LYS 138 9.669 0.338 -6.397 780 HD2 LYS 138 1HD LYS 138 8.636 2.433 -6.229 781 HD3 LYS 138 2HD LYS 138 9.917 3.079 -5.203 782 HE2 LYS 138 1HE LYS 138 10.691 2.164 -7.911 783 HE3 LYS 138 2HE LYS 138 9.720 3.632 -7.812 784 HZ1 LYS 138 3HZ LYS 138 11.775 4.534 -7.611 785 HZ2 LYS 138 1HZ LYS 138 12.460 3.151 -6.923 786 HZ3 LYS 138 2HZ LYS 138 11.523 4.191 -5.976 787 H THR 139 H THR 139 10.662 -1.906 -2.848 788 HA THR 139 HA THR 139 12.278 -3.181 -4.574 789 HB THR 139 HB THR 139 11.260 -4.923 -2.401 790 HG1 THR 139 HG1 THR 139 11.202 -3.323 -1.057 791 HG21 THR 139 3HG2 THR 139 13.289 -5.638 -3.326 792 HG22 THR 139 1HG2 THR 139 13.710 -4.873 -1.794 793 HG23 THR 139 2HG2 THR 139 13.966 -4.008 -3.309 794 HA PRO 140 HA PRO 140 9.230 -5.331 -7.206 795 HB2 PRO 140 1HB PRO 140 11.462 -6.478 -8.579 796 HB3 PRO 140 2HB PRO 140 10.374 -5.211 -9.139 797 HG2 PRO 140 1HG PRO 140 13.079 -4.987 -8.041 798 HG3 PRO 140 2HG PRO 140 12.155 -3.826 -8.999 799 HD2 PRO 140 1HD PRO 140 12.704 -3.516 -6.339 800 HD3 PRO 140 2HD PRO 140 11.297 -2.797 -7.149 801 HA PRO 141 HA PRO 141 11.767 -9.578 -6.199 802 HB2 PRO 141 1HB PRO 141 12.808 -8.331 -3.674 803 HB3 PRO 141 2HB PRO 141 13.478 -9.665 -4.625 804 HG2 PRO 141 1HG PRO 141 14.508 -7.246 -4.853 805 HG3 PRO 141 2HG PRO 141 14.259 -8.243 -6.298 806 HD2 PRO 141 1HD PRO 141 12.722 -5.884 -5.339 807 HD3 PRO 141 2HD PRO 141 13.042 -6.428 -6.996 808 H ASP 142 H ASP 142 10.349 -7.337 -3.835 809 HA ASP 142 HA ASP 142 9.326 -9.083 -1.968 810 HB2 ASP 142 1HB ASP 142 9.173 -6.445 -2.251 811 HB3 ASP 142 2HB ASP 142 7.570 -6.841 -2.860 812 H LEU 143 H LEU 143 8.106 -8.408 -5.202 813 HA LEU 143 HA LEU 143 6.348 -10.724 -4.990 814 HB2 LEU 143 1HB LEU 143 5.168 -8.442 -4.460 815 HB3 LEU 143 2HB LEU 143 5.210 -8.232 -6.197 816 HG LEU 143 HG LEU 143 3.090 -9.105 -5.735 817 HD11 LEU 143 1HD1 LEU 143 3.078 -11.353 -6.728 818 HD12 LEU 143 2HD1 LEU 143 4.831 -11.420 -6.557 819 HD13 LEU 143 3HD1 LEU 143 4.093 -10.222 -7.621 820 HD21 LEU 143 3HD2 LEU 143 2.651 -11.019 -4.320 821 HD22 LEU 143 1HD2 LEU 143 3.556 -9.799 -3.424 822 HD23 LEU 143 2HD2 LEU 143 4.379 -11.234 -4.036 823 H LYS 144 H LYS 144 6.633 -8.069 -7.358 824 HA LYS 144 HA LYS 144 7.186 -8.026 -9.561 825 HB2 LYS 144 1HB LYS 144 9.130 -9.721 -8.312 826 HB3 LYS 144 2HB LYS 144 8.765 -10.360 -9.910 827 HG2 LYS 144 1HG LYS 144 9.246 -8.153 -10.881 828 HG3 LYS 144 2HG LYS 144 9.668 -7.556 -9.276 829 HD2 LYS 144 1HD LYS 144 11.758 -8.147 -9.877 830 HD3 LYS 144 2HD LYS 144 11.227 -9.766 -9.417 831 HE2 LYS 144 1HE LYS 144 12.311 -9.821 -11.587 832 HE3 LYS 144 2HE LYS 144 10.601 -10.210 -11.749 833 HZ1 LYS 144 3HZ LYS 144 11.696 -8.550 -13.381 834 HZ2 LYS 144 1HZ LYS 144 11.502 -7.433 -12.126 835 HZ3 LYS 144 2HZ LYS 144 10.152 -8.218 -12.777 836 H GLU 145 H GLU 145 7.142 -9.370 -11.659 837 HA GLU 145 HA GLU 145 4.615 -10.574 -11.892 838 HB2 GLU 145 1HB GLU 145 5.805 -9.489 -13.766 839 HB3 GLU 145 2HB GLU 145 6.970 -10.805 -13.779 840 HG2 GLU 145 1HG GLU 145 5.671 -11.836 -15.245 841 HG3 GLU 145 2HG GLU 145 4.478 -12.043 -13.964 842 H GLU 146 H GLU 146 7.773 -11.918 -11.243 843 HA GLU 146 HA GLU 146 8.477 -13.988 -10.650 844 HB2 GLU 146 1HB GLU 146 6.588 -13.827 -9.048 845 HB3 GLU 146 2HB GLU 146 5.537 -14.570 -10.245 846 HG2 GLU 146 1HG GLU 146 7.577 -16.369 -10.105 847 HG3 GLU 146 2HG GLU 146 7.496 -15.781 -8.446 848 H SER 147 H SER 147 9.052 -14.106 -12.955 849 HA SER 147 HA SER 147 7.464 -16.120 -14.402 850 HB2 SER 147 1HB SER 147 8.532 -15.240 -16.460 851 HB3 SER 147 2HB SER 147 7.611 -14.002 -15.607 852 HG SER 147 HG SER 147 9.387 -12.900 -15.529 853 H SER 148 H SER 148 8.414 -17.986 -15.073 854 HA SER 148 HA SER 148 11.313 -18.272 -14.758 855 HB2 SER 148 1HB SER 148 9.604 -20.536 -13.818 856 HB3 SER 148 2HB SER 148 11.232 -20.075 -13.320 857 HG SER 148 HG SER 148 9.777 -19.580 -11.680 858 H THR 149 H THR 149 8.394 -20.110 -15.711 859 HA THR 149 HA THR 149 9.869 -20.997 -18.105 860 HB THR 149 HB THR 149 8.564 -23.070 -18.045 861 HG1 THR 149 HG1 THR 149 6.925 -23.315 -16.755 862 HG21 THR 149 3HG2 THR 149 9.663 -24.166 -16.337 863 HG22 THR 149 1HG2 THR 149 9.586 -22.773 -15.259 864 HG23 THR 149 2HG2 THR 149 10.695 -22.765 -16.630 865 H ASP 150 H ASP 150 9.165 -19.540 -19.586 866 HA ASP 150 HA ASP 150 6.269 -19.493 -20.126 867 HB2 ASP 150 1HB ASP 150 8.117 -17.255 -19.631 868 HB3 ASP 150 2HB ASP 150 7.108 -17.060 -21.059 869 H LEU 151 H LEU 151 5.875 -18.521 -22.405 870 HA LEU 151 HA LEU 151 7.851 -18.746 -24.407 871 HB2 LEU 151 1HB LEU 151 6.704 -21.222 -23.580 872 HB3 LEU 151 2HB LEU 151 6.121 -20.866 -25.195 873 HG LEU 151 HG LEU 151 9.049 -20.651 -24.618 874 HD11 LEU 151 1HD1 LEU 151 7.501 -23.193 -25.053 875 HD12 LEU 151 2HD1 LEU 151 8.593 -22.798 -23.726 876 HD13 LEU 151 3HD1 LEU 151 9.234 -23.048 -25.350 877 HD21 LEU 151 3HD2 LEU 151 9.101 -21.473 -27.010 878 HD22 LEU 151 1HD2 LEU 151 8.416 -19.868 -26.757 879 HD23 LEU 151 2HD2 LEU 151 7.352 -21.248 -27.031 880 H GLU 152 H GLU 152 4.385 -19.149 -23.727 881 HA GLU 152 HA GLU 152 3.814 -17.216 -25.862 882 HB2 GLU 152 1HB GLU 152 2.753 -19.984 -25.582 883 HB3 GLU 152 2HB GLU 152 1.647 -18.737 -26.141 884 HG2 GLU 152 1HG GLU 152 4.102 -18.517 -27.580 885 HG3 GLU 152 2HG GLU 152 3.548 -20.188 -27.632 Start of MODEL 19 1 H1 SER 45 1H SER 45 -15.527 6.506 -10.593 2 H2 SER 45 2H SER 45 -16.904 5.906 -9.762 3 H3 SER 45 3H SER 45 -16.778 5.719 -11.464 4 HA SER 45 HA SER 45 -14.896 4.549 -9.528 5 HB2 SER 45 1HB SER 45 -17.192 3.176 -10.948 6 HB3 SER 45 2HB SER 45 -16.124 2.484 -9.725 7 HG SER 45 HG SER 45 -17.323 3.339 -8.226 8 H ALA 46 H ALA 46 -13.317 5.360 -11.101 9 HA ALA 46 HA ALA 46 -13.183 3.637 -13.490 10 HB1 ALA 46 3HB ALA 46 -12.170 5.386 -14.728 11 HB2 ALA 46 1HB ALA 46 -11.996 6.391 -13.289 12 HB3 ALA 46 2HB ALA 46 -13.599 6.068 -13.952 13 H ASP 47 H ASP 47 -12.056 3.395 -10.686 14 HA ASP 47 HA ASP 47 -9.361 2.674 -11.523 15 HB2 ASP 47 1HB ASP 47 -10.022 4.742 -9.494 16 HB3 ASP 47 2HB ASP 47 -8.723 3.625 -9.090 17 H ASP 48 H ASP 48 -11.032 0.740 -11.332 18 HA ASP 48 HA ASP 48 -10.587 -0.458 -8.680 19 HB2 ASP 48 1HB ASP 48 -13.064 -0.573 -10.403 20 HB3 ASP 48 2HB ASP 48 -12.757 -1.735 -9.116 21 H ARG 49 H ARG 49 -8.626 -1.270 -9.712 22 HA ARG 49 HA ARG 49 -9.138 -3.827 -11.016 23 HB2 ARG 49 1HB ARG 49 -7.248 -3.343 -12.649 24 HB3 ARG 49 2HB ARG 49 -8.773 -2.522 -12.950 25 HG2 ARG 49 1HG ARG 49 -7.939 -0.457 -12.332 26 HG3 ARG 49 2HG ARG 49 -6.633 -1.158 -11.374 27 HD2 ARG 49 1HD ARG 49 -5.362 -0.635 -13.150 28 HD3 ARG 49 2HD ARG 49 -6.032 -2.113 -13.836 29 HE ARG 49 HE ARG 49 -7.712 0.108 -14.385 30 HH11 ARG 49 1HH1 ARG 49 -4.690 -1.367 -15.367 31 HH12 ARG 49 2HH1 ARG 49 -4.754 -0.720 -16.971 32 HH21 ARG 49 1HH2 ARG 49 -7.789 0.958 -16.500 33 HH22 ARG 49 2HH2 ARG 49 -6.513 0.600 -17.613 34 H LEU 50 H LEU 50 -8.522 -4.617 -8.926 35 HA LEU 50 HA LEU 50 -5.609 -4.531 -8.475 36 HB2 LEU 50 1HB LEU 50 -7.653 -4.989 -6.311 37 HB3 LEU 50 2HB LEU 50 -5.943 -4.653 -6.124 38 HG LEU 50 HG LEU 50 -8.020 -2.698 -7.120 39 HD11 LEU 50 1HD1 LEU 50 -8.410 -2.881 -4.840 40 HD12 LEU 50 2HD1 LEU 50 -7.279 -1.532 -4.945 41 HD13 LEU 50 3HD1 LEU 50 -6.704 -3.128 -4.465 42 HD21 LEU 50 3HD2 LEU 50 -5.065 -2.648 -7.041 43 HD22 LEU 50 1HD2 LEU 50 -5.894 -1.185 -6.514 44 HD23 LEU 50 2HD2 LEU 50 -6.188 -1.832 -8.127 45 H ASN 51 H ASN 51 -4.562 -6.433 -8.394 46 HA ASN 51 HA ASN 51 -6.140 -8.900 -8.111 47 HB2 ASN 51 1HB ASN 51 -4.407 -8.066 -10.367 48 HB3 ASN 51 2HB ASN 51 -4.237 -9.735 -9.837 49 HD21 ASN 51 2HD2 ASN 51 -5.561 -11.154 -10.732 50 HD22 ASN 51 1HD2 ASN 51 -7.079 -10.788 -11.487 51 H PHE 52 H PHE 52 -4.453 -10.845 -7.993 52 HA PHE 52 HA PHE 52 -3.006 -10.451 -5.574 53 HB2 PHE 52 1HB PHE 52 -2.638 -12.836 -7.384 54 HB3 PHE 52 2HB PHE 52 -2.510 -12.760 -5.627 55 HD1 PHE 52 HD2 PHE 52 -5.027 -11.338 -4.960 56 HD2 PHE 52 HD1 PHE 52 -4.258 -14.464 -7.745 57 HE1 PHE 52 HE2 PHE 52 -7.364 -12.079 -4.770 58 HE2 PHE 52 HE1 PHE 52 -6.595 -15.209 -7.558 59 HZ PHE 52 HZ PHE 52 -8.152 -14.016 -6.069 60 H GLY 53 H GLY 53 -1.003 -9.751 -5.278 61 HA2 GLY 53 1HA GLY 53 1.283 -9.517 -5.640 62 HA3 GLY 53 2HA GLY 53 1.095 -10.318 -7.193 63 H ASP 54 H ASP 54 -0.643 -7.460 -6.019 64 HA ASP 54 HA ASP 54 0.727 -5.835 -8.053 65 HB2 ASP 54 1HB ASP 54 -1.717 -6.651 -8.562 66 HB3 ASP 54 2HB ASP 54 -2.174 -5.395 -7.418 67 H ARG 55 H ARG 55 1.488 -3.935 -7.335 68 HA ARG 55 HA ARG 55 1.397 -3.276 -4.588 69 HB2 ARG 55 1HB ARG 55 2.573 -1.204 -5.230 70 HB3 ARG 55 2HB ARG 55 3.303 -2.630 -5.950 71 HG2 ARG 55 1HG ARG 55 1.487 -1.780 -7.860 72 HG3 ARG 55 2HG ARG 55 2.160 -0.285 -7.210 73 HD2 ARG 55 1HD ARG 55 3.426 -1.136 -9.145 74 HD3 ARG 55 2HD ARG 55 4.403 -1.038 -7.684 75 HE ARG 55 HE ARG 55 3.406 -3.495 -8.949 76 HH11 ARG 55 1HH1 ARG 55 5.453 -1.952 -6.543 77 HH12 ARG 55 2HH1 ARG 55 6.350 -3.392 -6.209 78 HH21 ARG 55 1HH2 ARG 55 4.592 -5.387 -8.486 79 HH22 ARG 55 2HH2 ARG 55 5.860 -5.340 -7.309 80 H ILE 56 H ILE 56 -0.112 -2.265 -3.456 81 HA ILE 56 HA ILE 56 -1.909 -0.379 -4.832 82 HB ILE 56 HB ILE 56 -3.803 -1.191 -3.483 83 HG12 ILE 56 1HG1 ILE 56 -3.162 -3.743 -2.701 84 HG13 ILE 56 2HG1 ILE 56 -1.685 -2.868 -2.314 85 HG21 ILE 56 1HG2 ILE 56 -4.087 -3.388 -4.676 86 HG22 ILE 56 2HG2 ILE 56 -2.445 -3.179 -5.287 87 HG23 ILE 56 3HG2 ILE 56 -3.698 -2.007 -5.701 88 HD11 ILE 56 3HD1 ILE 56 -2.780 -2.557 -0.372 89 HD12 ILE 56 1HD1 ILE 56 -4.370 -2.681 -1.118 90 HD13 ILE 56 2HD1 ILE 56 -3.449 -1.183 -1.253 91 H LEU 57 H LEU 57 -2.953 1.172 -3.438 92 HA LEU 57 HA LEU 57 -1.351 1.747 -1.030 93 HB2 LEU 57 1HB LEU 57 -1.611 3.348 -3.135 94 HB3 LEU 57 2HB LEU 57 -3.081 3.814 -2.299 95 HG LEU 57 HG LEU 57 -1.674 4.324 -0.279 96 HD11 LEU 57 1HD1 LEU 57 0.247 2.887 -1.123 97 HD12 LEU 57 2HD1 LEU 57 0.663 4.447 -0.418 98 HD13 LEU 57 3HD1 LEU 57 0.655 4.248 -2.170 99 HD21 LEU 57 3HD2 LEU 57 -1.500 5.794 -2.868 100 HD22 LEU 57 1HD2 LEU 57 -0.573 6.374 -1.484 101 HD23 LEU 57 2HD2 LEU 57 -2.329 6.235 -1.373 102 H VAL 58 H VAL 58 -2.334 1.411 0.862 103 HA VAL 58 HA VAL 58 -5.280 1.619 0.969 104 HB VAL 58 HB VAL 58 -4.586 -0.691 1.259 105 HG11 VAL 58 1HG1 VAL 58 -2.565 0.500 3.002 106 HG12 VAL 58 2HG1 VAL 58 -2.548 -1.023 2.116 107 HG13 VAL 58 3HG1 VAL 58 -3.351 -0.924 3.681 108 HG21 VAL 58 3HG2 VAL 58 -5.521 0.593 3.822 109 HG22 VAL 58 1HG2 VAL 58 -5.605 -1.133 3.467 110 HG23 VAL 58 2HG2 VAL 58 -6.530 0.014 2.496 111 H LYS 59 H LYS 59 -6.214 2.693 2.695 112 HA LYS 59 HA LYS 59 -4.397 4.375 4.251 113 HB2 LYS 59 1HB LYS 59 -6.317 5.340 2.897 114 HB3 LYS 59 2HB LYS 59 -7.398 4.615 4.077 115 HG2 LYS 59 1HG LYS 59 -6.530 5.970 5.827 116 HG3 LYS 59 2HG LYS 59 -5.218 6.553 4.799 117 HD2 LYS 59 1HD LYS 59 -6.946 7.572 3.307 118 HD3 LYS 59 2HD LYS 59 -8.165 7.127 4.503 119 HE2 LYS 59 1HE LYS 59 -7.509 8.732 5.968 120 HE3 LYS 59 2HE LYS 59 -5.814 8.614 5.507 121 HZ1 LYS 59 3HZ LYS 59 -7.896 10.336 4.469 122 HZ2 LYS 59 1HZ LYS 59 -6.901 9.646 3.288 123 HZ3 LYS 59 2HZ LYS 59 -6.223 10.574 4.527 124 H ALA 60 H ALA 60 -3.829 3.645 6.188 125 HA ALA 60 HA ALA 60 -5.334 1.648 7.593 126 HB1 ALA 60 3HB ALA 60 -3.519 2.402 9.415 127 HB2 ALA 60 1HB ALA 60 -2.746 3.030 7.959 128 HB3 ALA 60 2HB ALA 60 -3.146 1.317 8.075 129 HA PRO 61 HA PRO 61 -7.838 4.148 10.235 130 HB2 PRO 61 1HB PRO 61 -7.725 2.835 12.611 131 HB3 PRO 61 2HB PRO 61 -8.626 2.227 11.219 132 HG2 PRO 61 1HG PRO 61 -5.914 1.448 12.208 133 HG3 PRO 61 2HG PRO 61 -7.221 0.417 11.601 134 HD2 PRO 61 1HD PRO 61 -5.082 1.121 10.091 135 HD3 PRO 61 2HD PRO 61 -6.690 0.826 9.398 136 H GLY 62 H GLY 62 -7.018 6.132 10.632 137 HA2 GLY 62 1HA GLY 62 -6.277 7.684 12.283 138 HA3 GLY 62 2HA GLY 62 -5.280 6.419 12.980 139 H TYR 63 H TYR 63 -4.101 5.565 10.474 140 HA TYR 63 HA TYR 63 -2.258 7.818 10.084 141 HB2 TYR 63 1HB TYR 63 -1.815 4.896 9.444 142 HB3 TYR 63 2HB TYR 63 -0.608 6.175 9.399 143 HD1 TYR 63 HD2 TYR 63 -0.033 7.338 11.612 144 HD2 TYR 63 HD1 TYR 63 -2.177 3.668 11.406 145 HE1 TYR 63 HE2 TYR 63 0.553 6.869 13.953 146 HE2 TYR 63 HE1 TYR 63 -1.598 3.190 13.746 147 HH TYR 63 HH TYR 63 0.427 3.972 15.340 148 HA PRO 64 HA PRO 64 -3.528 8.518 5.912 149 HB2 PRO 64 1HB PRO 64 -0.648 8.820 5.260 150 HB3 PRO 64 2HB PRO 64 -1.974 9.967 5.048 151 HG2 PRO 64 1HG PRO 64 -0.172 10.316 6.973 152 HG3 PRO 64 2HG PRO 64 -1.886 10.675 7.259 153 HD2 PRO 64 1HD PRO 64 -0.281 8.290 8.103 154 HD3 PRO 64 2HD PRO 64 -1.504 9.203 9.012 155 H TRP 65 H TRP 65 -2.603 7.976 3.553 156 HA TRP 65 HA TRP 65 -2.905 5.215 3.190 157 HB2 TRP 65 1HB TRP 65 -1.719 7.246 1.283 158 HB3 TRP 65 2HB TRP 65 -2.260 5.631 0.842 159 HD1 TRP 65 HD1 TRP 65 -3.652 9.030 1.976 160 HE1 TRP 65 HE1 TRP 65 -6.122 9.169 1.279 161 HE3 TRP 65 HE3 TRP 65 -4.284 4.256 0.254 162 HZ2 TRP 65 HZ2 TRP 65 -8.085 7.482 0.155 163 HZ3 TRP 65 HZ3 TRP 65 -6.489 3.602 -0.615 164 HH2 TRP 65 HH2 TRP 65 -8.350 5.182 -0.660 165 H TRP 66 H TRP 66 -1.495 3.549 2.795 166 HA TRP 66 HA TRP 66 1.381 4.130 3.051 167 HB2 TRP 66 1HB TRP 66 0.006 3.048 5.089 168 HB3 TRP 66 2HB TRP 66 0.377 1.579 4.192 169 HD1 TRP 66 HD1 TRP 66 2.626 0.505 4.761 170 HE1 TRP 66 HE1 TRP 66 4.813 1.282 5.875 171 HE3 TRP 66 HE3 TRP 66 1.517 5.461 5.367 172 HZ2 TRP 66 HZ2 TRP 66 5.916 3.672 6.876 173 HZ3 TRP 66 HZ3 TRP 66 3.200 6.923 6.407 174 HH2 TRP 66 HH2 TRP 66 5.359 6.042 7.135 175 HA PRO 67 HA PRO 67 1.740 1.638 -0.590 176 HB2 PRO 67 1HB PRO 67 4.375 1.037 -0.485 177 HB3 PRO 67 2HB PRO 67 3.784 2.653 -0.890 178 HG2 PRO 67 1HG PRO 67 4.812 1.612 1.721 179 HG3 PRO 67 2HG PRO 67 5.156 3.155 0.922 180 HD2 PRO 67 1HD PRO 67 3.369 2.922 2.944 181 HD3 PRO 67 2HD PRO 67 3.189 4.112 1.643 182 H ALA 68 H ALA 68 0.523 -0.185 -0.158 183 HA ALA 68 HA ALA 68 1.908 -2.423 1.182 184 HB1 ALA 68 3HB ALA 68 -0.018 -3.034 2.167 185 HB2 ALA 68 1HB ALA 68 -0.987 -2.672 0.735 186 HB3 ALA 68 2HB ALA 68 -0.514 -1.375 1.834 187 H LEU 69 H LEU 69 1.049 -4.624 0.294 188 HA LEU 69 HA LEU 69 0.776 -4.472 -2.635 189 HB2 LEU 69 1HB LEU 69 2.984 -5.531 -1.131 190 HB3 LEU 69 2HB LEU 69 2.222 -6.820 -2.042 191 HG LEU 69 HG LEU 69 2.821 -4.286 -3.481 192 HD11 LEU 69 1HD1 LEU 69 4.857 -4.736 -2.161 193 HD12 LEU 69 2HD1 LEU 69 5.108 -4.913 -3.896 194 HD13 LEU 69 3HD1 LEU 69 4.939 -6.345 -2.881 195 HD21 LEU 69 3HD2 LEU 69 1.983 -5.668 -5.033 196 HD22 LEU 69 1HD2 LEU 69 2.318 -7.111 -4.081 197 HD23 LEU 69 2HD2 LEU 69 3.599 -6.372 -5.039 198 H LEU 70 H LEU 70 -1.011 -5.454 -3.281 199 HA LEU 70 HA LEU 70 -2.690 -6.959 -1.630 200 HB2 LEU 70 1HB LEU 70 -2.986 -5.787 -4.032 201 HB3 LEU 70 2HB LEU 70 -2.843 -7.456 -4.546 202 HG LEU 70 HG LEU 70 -4.894 -6.377 -2.609 203 HD11 LEU 70 1HD1 LEU 70 -5.768 -7.631 -5.103 204 HD12 LEU 70 2HD1 LEU 70 -4.885 -6.121 -5.323 205 HD13 LEU 70 3HD1 LEU 70 -6.327 -6.157 -4.311 206 HD21 LEU 70 3HD2 LEU 70 -4.078 -9.117 -3.364 207 HD22 LEU 70 1HD2 LEU 70 -5.811 -8.801 -3.290 208 HD23 LEU 70 2HD2 LEU 70 -4.803 -8.516 -1.874 209 H LEU 71 H LEU 71 -2.677 -9.010 -0.986 210 HA LEU 71 HA LEU 71 -0.831 -10.884 -2.294 211 HB2 LEU 71 1HB LEU 71 -2.026 -10.802 0.465 212 HB3 LEU 71 2HB LEU 71 -1.274 -12.251 -0.168 213 HG LEU 71 HG LEU 71 0.088 -9.588 0.249 214 HD11 LEU 71 1HD1 LEU 71 -0.120 -12.081 1.843 215 HD12 LEU 71 2HD1 LEU 71 -0.003 -10.404 2.371 216 HD13 LEU 71 3HD1 LEU 71 1.436 -11.253 1.808 217 HD21 LEU 71 3HD2 LEU 71 1.033 -12.176 -0.944 218 HD22 LEU 71 1HD2 LEU 71 2.151 -11.028 -0.209 219 HD23 LEU 71 2HD2 LEU 71 1.173 -10.543 -1.594 220 H ARG 72 H ARG 72 -4.081 -10.926 -0.765 221 HA ARG 72 HA ARG 72 -5.120 -12.481 -2.967 222 HB2 ARG 72 1HB ARG 72 -4.061 -13.896 -0.847 223 HB3 ARG 72 2HB ARG 72 -5.774 -13.832 -0.461 224 HG2 ARG 72 1HG ARG 72 -5.160 -14.547 -3.242 225 HG3 ARG 72 2HG ARG 72 -4.621 -15.707 -2.026 226 HD2 ARG 72 1HD ARG 72 -6.723 -16.319 -1.491 227 HD3 ARG 72 2HD ARG 72 -7.349 -14.676 -1.643 228 HE ARG 72 HE ARG 72 -6.718 -15.724 -4.194 229 HH11 ARG 72 1HH1 ARG 72 -9.102 -16.010 -1.641 230 HH12 ARG 72 2HH1 ARG 72 -10.367 -16.504 -2.711 231 HH21 ARG 72 1HH2 ARG 72 -8.391 -16.378 -5.598 232 HH22 ARG 72 2HH2 ARG 72 -9.963 -16.716 -4.957 233 H ARG 73 H ARG 73 -7.430 -12.757 -2.908 234 HA ARG 73 HA ARG 73 -8.751 -10.707 -1.261 235 HB2 ARG 73 1HB ARG 73 -8.807 -10.505 -3.794 236 HB3 ARG 73 2HB ARG 73 -9.827 -11.935 -3.799 237 HG2 ARG 73 1HG ARG 73 -11.272 -10.542 -2.117 238 HG3 ARG 73 2HG ARG 73 -10.434 -9.176 -2.855 239 HD2 ARG 73 1HD ARG 73 -12.193 -9.299 -4.285 240 HD3 ARG 73 2HD ARG 73 -11.135 -10.464 -5.079 241 HE ARG 73 HE ARG 73 -12.887 -11.632 -3.116 242 HH11 ARG 73 1HH1 ARG 73 -12.583 -10.664 -6.470 243 HH12 ARG 73 2HH1 ARG 73 -13.816 -11.744 -7.021 244 HH21 ARG 73 1HH2 ARG 73 -14.519 -13.051 -3.854 245 HH22 ARG 73 2HH2 ARG 73 -14.916 -13.097 -5.539 246 H LYS 74 H LYS 74 -9.629 -11.615 0.484 247 HA LYS 74 HA LYS 74 -10.930 -14.237 0.220 248 HB2 LYS 74 1HB LYS 74 -10.917 -14.059 2.813 249 HB3 LYS 74 2HB LYS 74 -9.428 -14.453 1.969 250 HG2 LYS 74 1HG LYS 74 -8.439 -12.484 2.501 251 HG3 LYS 74 2HG LYS 74 -9.960 -11.590 2.502 252 HD2 LYS 74 1HD LYS 74 -10.350 -13.260 4.600 253 HD3 LYS 74 2HD LYS 74 -8.604 -13.021 4.688 254 HE2 LYS 74 1HE LYS 74 -8.802 -10.865 5.307 255 HE3 LYS 74 2HE LYS 74 -10.170 -10.577 4.235 256 HZ1 LYS 74 3HZ LYS 74 -11.665 -11.384 5.804 257 HZ2 LYS 74 1HZ LYS 74 -10.576 -10.483 6.732 258 HZ3 LYS 74 2HZ LYS 74 -10.471 -12.170 6.707 259 H GLU 75 H GLU 75 -13.027 -14.113 -0.181 260 HA GLU 75 HA GLU 75 -14.590 -11.868 0.841 261 HB2 GLU 75 1HB GLU 75 -14.658 -12.734 -1.592 262 HB3 GLU 75 2HB GLU 75 -15.626 -14.053 -0.952 263 HG2 GLU 75 1HG GLU 75 -16.657 -11.567 0.006 264 HG3 GLU 75 2HG GLU 75 -16.472 -11.492 -1.744 265 H THR 76 H THR 76 -15.345 -12.149 2.853 266 HA THR 76 HA THR 76 -16.191 -14.821 3.700 267 HB THR 76 HB THR 76 -14.603 -13.553 5.132 268 HG1 THR 76 HG1 THR 76 -16.970 -13.786 6.617 269 HG21 THR 76 3HG2 THR 76 -14.928 -11.402 5.521 270 HG22 THR 76 1HG2 THR 76 -16.248 -11.869 6.593 271 HG23 THR 76 2HG2 THR 76 -16.580 -11.469 4.908 272 H LYS 77 H LYS 77 -18.195 -15.023 4.972 273 HA LYS 77 HA LYS 77 -20.236 -13.007 4.449 274 HB2 LYS 77 1HB LYS 77 -21.784 -14.661 3.498 275 HB3 LYS 77 2HB LYS 77 -20.349 -14.475 2.502 276 HG2 LYS 77 1HG LYS 77 -19.428 -16.535 3.443 277 HG3 LYS 77 2HG LYS 77 -20.870 -16.724 4.442 278 HD2 LYS 77 1HD LYS 77 -21.249 -16.390 1.514 279 HD3 LYS 77 2HD LYS 77 -20.602 -17.929 2.083 280 HE2 LYS 77 1HE LYS 77 -22.777 -18.475 2.301 281 HE3 LYS 77 2HE LYS 77 -22.643 -17.589 3.818 282 HZ1 LYS 77 3HZ LYS 77 -23.365 -15.577 2.528 283 HZ2 LYS 77 1HZ LYS 77 -24.545 -16.776 2.714 284 HZ3 LYS 77 2HZ LYS 77 -23.733 -16.611 1.241 285 H ASP 78 H ASP 78 -22.466 -14.141 5.324 286 HA ASP 78 HA ASP 78 -23.653 -14.734 7.163 287 HB2 ASP 78 1HB ASP 78 -22.371 -16.903 6.739 288 HB3 ASP 78 2HB ASP 78 -21.290 -16.399 8.031 289 H SER 79 H SER 79 -22.905 -12.350 7.532 290 HA SER 79 HA SER 79 -21.164 -11.987 9.813 291 HB2 SER 79 1HB SER 79 -22.819 -9.700 8.963 292 HB3 SER 79 2HB SER 79 -21.077 -9.804 9.201 293 HG SER 79 HG SER 79 -20.831 -10.563 7.165 294 H LEU 80 H LEU 80 -24.528 -10.952 9.182 295 HA LEU 80 HA LEU 80 -25.520 -12.086 11.604 296 HB2 LEU 80 1HB LEU 80 -26.224 -9.817 12.557 297 HB3 LEU 80 2HB LEU 80 -24.564 -10.325 12.789 298 HG LEU 80 HG LEU 80 -24.305 -8.884 10.507 299 HD11 LEU 80 1HD1 LEU 80 -26.325 -7.342 12.111 300 HD12 LEU 80 2HD1 LEU 80 -26.754 -8.284 10.685 301 HD13 LEU 80 3HD1 LEU 80 -25.631 -6.934 10.543 302 HD21 LEU 80 3HD2 LEU 80 -22.788 -8.346 12.108 303 HD22 LEU 80 1HD2 LEU 80 -23.993 -8.305 13.395 304 HD23 LEU 80 2HD2 LEU 80 -23.852 -6.948 12.277 305 H ASN 81 H ASN 81 -26.154 -12.014 8.751 306 HA ASN 81 HA ASN 81 -28.903 -10.966 8.913 307 HB2 ASN 81 1HB ASN 81 -26.874 -10.704 6.744 308 HB3 ASN 81 2HB ASN 81 -28.558 -10.903 6.274 309 HD21 ASN 81 2HD2 ASN 81 -26.523 -8.999 8.472 310 HD22 ASN 81 1HD2 ASN 81 -27.416 -7.523 8.281 311 H THR 82 H THR 82 -26.766 -13.427 7.533 312 HA THR 82 HA THR 82 -27.107 -15.525 6.777 313 HB THR 82 HB THR 82 -28.563 -16.934 7.966 314 HG1 THR 82 HG1 THR 82 -30.184 -14.654 8.348 315 HG21 THR 82 3HG2 THR 82 -27.943 -14.629 9.783 316 HG22 THR 82 1HG2 THR 82 -26.970 -16.073 9.510 317 HG23 THR 82 2HG2 THR 82 -28.530 -16.202 10.320 318 H ASN 83 H ASN 83 -28.029 -13.429 5.121 319 HA ASN 83 HA ASN 83 -29.910 -14.933 3.486 320 HB2 ASN 83 1HB ASN 83 -30.417 -12.122 4.455 321 HB3 ASN 83 2HB ASN 83 -31.151 -12.741 2.981 322 HD21 ASN 83 2HD2 ASN 83 -32.235 -14.967 3.312 323 HD22 ASN 83 1HD2 ASN 83 -33.225 -15.102 4.734 324 H SER 84 H SER 84 -28.168 -11.832 3.641 325 HA SER 84 HA SER 84 -26.536 -12.504 1.402 326 HB2 SER 84 1HB SER 84 -28.861 -11.782 0.448 327 HB3 SER 84 2HB SER 84 -28.317 -10.152 0.847 328 HG SER 84 HG SER 84 -27.645 -10.531 -1.215 329 H SER 85 H SER 85 -25.053 -11.994 3.143 330 HA SER 85 HA SER 85 -24.332 -9.175 3.096 331 HB2 SER 85 1HB SER 85 -25.726 -9.399 5.114 332 HB3 SER 85 2HB SER 85 -24.677 -10.691 5.699 333 HG SER 85 HG SER 85 -24.131 -8.659 6.606 334 H PHE 86 H PHE 86 -22.420 -9.418 2.102 335 HA PHE 86 HA PHE 86 -20.508 -11.370 3.207 336 HB2 PHE 86 1HB PHE 86 -20.461 -10.121 0.451 337 HB3 PHE 86 2HB PHE 86 -19.424 -11.412 1.040 338 HD1 PHE 86 HD1 PHE 86 -22.990 -10.610 0.321 339 HD2 PHE 86 HD2 PHE 86 -20.017 -13.632 0.711 340 HE1 PHE 86 HE1 PHE 86 -24.576 -12.280 -0.545 341 HE2 PHE 86 HE2 PHE 86 -21.597 -15.304 -0.155 342 HZ PHE 86 HZ PHE 86 -23.879 -14.631 -0.785 343 H ASN 87 H ASN 87 -18.291 -10.719 3.422 344 HA ASN 87 HA ASN 87 -17.810 -7.824 3.338 345 HB2 ASN 87 1HB ASN 87 -17.047 -9.613 5.663 346 HB3 ASN 87 2HB ASN 87 -16.673 -7.901 5.511 347 HD21 ASN 87 2HD2 ASN 87 -18.892 -6.690 4.807 348 HD22 ASN 87 1HD2 ASN 87 -20.179 -6.979 5.936 349 H VAL 88 H VAL 88 -16.668 -8.328 1.398 350 HA VAL 88 HA VAL 88 -14.335 -10.027 1.531 351 HB VAL 88 HB VAL 88 -15.545 -9.963 -0.555 352 HG11 VAL 88 1HG1 VAL 88 -16.589 -7.947 -0.832 353 HG12 VAL 88 2HG1 VAL 88 -15.218 -7.731 -1.920 354 HG13 VAL 88 3HG1 VAL 88 -15.183 -7.021 -0.308 355 HG21 VAL 88 3HG2 VAL 88 -13.121 -8.502 -1.389 356 HG22 VAL 88 1HG2 VAL 88 -13.718 -10.089 -1.875 357 HG23 VAL 88 2HG2 VAL 88 -12.874 -9.898 -0.339 358 H LEU 89 H LEU 89 -12.255 -9.432 1.742 359 HA LEU 89 HA LEU 89 -11.598 -6.571 1.809 360 HB2 LEU 89 1HB LEU 89 -10.376 -8.413 3.827 361 HB3 LEU 89 2HB LEU 89 -10.506 -6.665 3.860 362 HG LEU 89 HG LEU 89 -12.917 -8.448 4.138 363 HD11 LEU 89 1HD1 LEU 89 -10.985 -8.747 5.877 364 HD12 LEU 89 2HD1 LEU 89 -12.658 -8.609 6.412 365 HD13 LEU 89 3HD1 LEU 89 -11.586 -7.212 6.500 366 HD21 LEU 89 3HD2 LEU 89 -14.073 -6.565 4.649 367 HD22 LEU 89 1HD2 LEU 89 -12.837 -5.830 3.631 368 HD23 LEU 89 2HD2 LEU 89 -12.681 -5.773 5.387 369 H TYR 90 H TYR 90 -9.571 -6.034 1.097 370 HA TYR 90 HA TYR 90 -8.167 -8.098 -0.392 371 HB2 TYR 90 1HB TYR 90 -8.316 -5.151 -0.456 372 HB3 TYR 90 2HB TYR 90 -6.730 -5.824 -0.822 373 HD1 TYR 90 HD1 TYR 90 -7.618 -8.363 -2.170 374 HD2 TYR 90 HD2 TYR 90 -8.965 -4.349 -2.581 375 HE1 TYR 90 HE1 TYR 90 -8.347 -8.848 -4.459 376 HE2 TYR 90 HE2 TYR 90 -9.699 -4.827 -4.877 377 HH TYR 90 HH TYR 90 -10.438 -7.194 -6.119 378 H LYS 91 H LYS 91 -6.805 -9.314 0.773 379 HA LYS 91 HA LYS 91 -5.409 -8.331 3.076 380 HB2 LYS 91 1HB LYS 91 -5.238 -10.903 1.503 381 HB3 LYS 91 2HB LYS 91 -4.206 -10.574 2.887 382 HG2 LYS 91 1HG LYS 91 -6.466 -10.117 4.108 383 HG3 LYS 91 2HG LYS 91 -7.142 -11.076 2.790 384 HD2 LYS 91 1HD LYS 91 -4.769 -12.104 4.286 385 HD3 LYS 91 2HD LYS 91 -6.369 -12.227 5.015 386 HE2 LYS 91 1HE LYS 91 -7.112 -13.735 3.463 387 HE3 LYS 91 2HE LYS 91 -6.044 -13.127 2.199 388 HZ1 LYS 91 3HZ LYS 91 -5.634 -15.416 3.465 389 HZ2 LYS 91 1HZ LYS 91 -4.753 -14.393 4.485 390 HZ3 LYS 91 2HZ LYS 91 -4.373 -14.478 2.839 391 H VAL 92 H VAL 92 -3.941 -6.764 2.695 392 HA VAL 92 HA VAL 92 -1.966 -7.218 0.556 393 HB VAL 92 HB VAL 92 -1.591 -4.831 0.485 394 HG11 VAL 92 1HG1 VAL 92 -3.236 -4.854 -1.003 395 HG12 VAL 92 2HG1 VAL 92 -4.350 -4.387 0.281 396 HG13 VAL 92 3HG1 VAL 92 -4.107 -6.092 -0.097 397 HG21 VAL 92 3HG2 VAL 92 -3.621 -4.661 2.717 398 HG22 VAL 92 1HG2 VAL 92 -2.996 -3.281 1.815 399 HG23 VAL 92 2HG2 VAL 92 -1.909 -4.245 2.813 400 H LEU 93 H LEU 93 0.241 -6.622 0.940 401 HA LEU 93 HA LEU 93 1.034 -7.052 3.729 402 HB2 LEU 93 1HB LEU 93 1.908 -8.309 1.506 403 HB3 LEU 93 2HB LEU 93 3.076 -7.004 1.583 404 HG LEU 93 HG LEU 93 3.698 -7.703 3.865 405 HD11 LEU 93 1HD1 LEU 93 1.560 -8.716 4.506 406 HD12 LEU 93 2HD1 LEU 93 2.913 -9.818 4.760 407 HD13 LEU 93 3HD1 LEU 93 1.850 -10.033 3.370 408 HD21 LEU 93 3HD2 LEU 93 3.850 -9.844 1.749 409 HD22 LEU 93 1HD2 LEU 93 4.824 -9.806 3.218 410 HD23 LEU 93 2HD2 LEU 93 4.996 -8.530 2.011 411 H PHE 94 H PHE 94 2.053 -5.549 4.886 412 HA PHE 94 HA PHE 94 2.395 -2.909 3.663 413 HB2 PHE 94 1HB PHE 94 1.898 -3.945 6.396 414 HB3 PHE 94 2HB PHE 94 2.899 -2.503 6.296 415 HD1 PHE 94 HD1 PHE 94 -0.290 -3.796 4.797 416 HD2 PHE 94 HD2 PHE 94 1.819 -0.507 6.498 417 HE1 PHE 94 HE1 PHE 94 -2.308 -2.405 4.611 418 HE2 PHE 94 HE2 PHE 94 -0.200 0.884 6.312 419 HZ PHE 94 HZ PHE 94 -2.266 -0.064 5.369 420 H PHE 95 H PHE 95 4.295 -1.597 4.240 421 HA PHE 95 HA PHE 95 6.719 -3.103 4.916 422 HB2 PHE 95 1HB PHE 95 6.563 -1.316 2.475 423 HB3 PHE 95 2HB PHE 95 7.934 -2.289 2.989 424 HD1 PHE 95 HD2 PHE 95 7.782 -4.777 2.864 425 HD2 PHE 95 HD1 PHE 95 4.838 -2.223 1.155 426 HE1 PHE 95 HE2 PHE 95 6.975 -6.641 1.477 427 HE2 PHE 95 HE1 PHE 95 4.024 -4.083 -0.233 428 HZ PHE 95 HZ PHE 95 5.093 -6.296 -0.074 429 HA PRO 96 HA PRO 96 9.060 -2.235 4.356 430 HB2 PRO 96 1HB PRO 96 10.636 -1.719 6.753 431 HB3 PRO 96 2HB PRO 96 11.060 -1.452 5.058 432 HG2 PRO 96 1HG PRO 96 10.594 0.576 6.800 433 HG3 PRO 96 2HG PRO 96 10.261 0.696 5.064 434 HD2 PRO 96 1HD PRO 96 8.370 0.213 7.331 435 HD3 PRO 96 2HD PRO 96 8.155 1.211 5.877 436 H ASP 97 H ASP 97 7.941 -1.992 7.697 437 HA ASP 97 HA ASP 97 8.684 -4.516 8.620 438 HB2 ASP 97 1HB ASP 97 6.784 -2.429 9.435 439 HB3 ASP 97 2HB ASP 97 6.272 -4.050 9.886 440 H PHE 98 H PHE 98 8.239 -6.391 7.687 441 HA PHE 98 HA PHE 98 6.261 -6.899 5.793 442 HB2 PHE 98 1HB PHE 98 8.070 -8.582 7.456 443 HB3 PHE 98 2HB PHE 98 6.709 -9.384 6.683 444 HD1 PHE 98 HD2 PHE 98 6.517 -9.393 4.221 445 HD2 PHE 98 HD1 PHE 98 9.952 -7.839 6.199 446 HE1 PHE 98 HE2 PHE 98 7.788 -9.535 2.118 447 HE2 PHE 98 HE1 PHE 98 11.226 -7.978 4.098 448 HZ PHE 98 HZ PHE 98 10.146 -8.828 2.056 449 H ASN 99 H ASN 99 4.362 -5.979 6.710 450 HA ASN 99 HA ASN 99 2.946 -7.818 8.516 451 HB2 ASN 99 1HB ASN 99 3.549 -5.025 8.935 452 HB3 ASN 99 2HB ASN 99 1.808 -5.249 8.838 453 HD21 ASN 99 2HD2 ASN 99 1.333 -7.597 10.012 454 HD22 ASN 99 1HD2 ASN 99 1.872 -7.588 11.662 455 H PHE 100 H PHE 100 0.429 -6.656 8.391 456 HA PHE 100 HA PHE 100 -0.276 -6.121 5.654 457 HB2 PHE 100 1HB PHE 100 -1.984 -8.178 5.874 458 HB3 PHE 100 2HB PHE 100 -0.399 -8.337 5.128 459 HD1 PHE 100 HD1 PHE 100 1.472 -9.304 6.418 460 HD2 PHE 100 HD2 PHE 100 -2.525 -9.312 7.871 461 HE1 PHE 100 HE1 PHE 100 2.069 -11.055 8.041 462 HE2 PHE 100 HE2 PHE 100 -1.940 -11.054 9.496 463 HZ PHE 100 HZ PHE 100 0.363 -11.933 9.585 464 H ALA 101 H ALA 101 -2.771 -6.150 5.443 465 HA ALA 101 HA ALA 101 -4.188 -5.539 7.894 466 HB1 ALA 101 3HB ALA 101 -3.030 -3.462 6.266 467 HB2 ALA 101 1HB ALA 101 -3.866 -3.337 7.814 468 HB3 ALA 101 2HB ALA 101 -4.788 -3.313 6.310 469 H TRP 102 H TRP 102 -6.200 -6.297 7.719 470 HA TRP 102 HA TRP 102 -7.219 -7.058 5.101 471 HB2 TRP 102 1HB TRP 102 -8.341 -7.523 7.877 472 HB3 TRP 102 2HB TRP 102 -9.018 -8.178 6.390 473 HD1 TRP 102 HD1 TRP 102 -5.485 -8.499 5.819 474 HE1 TRP 102 HE1 TRP 102 -4.597 -10.816 6.497 475 HE3 TRP 102 HE3 TRP 102 -9.427 -10.082 8.670 476 HZ2 TRP 102 HZ2 TRP 102 -5.452 -13.025 8.032 477 HZ3 TRP 102 HZ3 TRP 102 -9.309 -12.310 9.707 478 HH2 TRP 102 HH2 TRP 102 -7.364 -13.750 9.393 479 H VAL 103 H VAL 103 -8.092 -5.408 3.991 480 HA VAL 103 HA VAL 103 -10.330 -3.969 5.197 481 HB VAL 103 HB VAL 103 -8.379 -2.518 5.571 482 HG11 VAL 103 1HG1 VAL 103 -6.745 -2.605 4.057 483 HG12 VAL 103 2HG1 VAL 103 -7.714 -1.469 3.118 484 HG13 VAL 103 3HG1 VAL 103 -7.821 -3.199 2.794 485 HG21 VAL 103 3HG2 VAL 103 -10.741 -1.687 4.901 486 HG22 VAL 103 1HG2 VAL 103 -9.958 -1.207 3.395 487 HG23 VAL 103 2HG2 VAL 103 -9.400 -0.544 4.930 488 H LYS 104 H LYS 104 -11.818 -3.110 3.679 489 HA LYS 104 HA LYS 104 -12.071 -4.623 1.295 490 HB2 LYS 104 1HB LYS 104 -13.553 -2.087 2.005 491 HB3 LYS 104 2HB LYS 104 -14.062 -3.317 0.859 492 HG2 LYS 104 1HG LYS 104 -14.635 -4.820 2.526 493 HG3 LYS 104 2HG LYS 104 -13.630 -4.016 3.734 494 HD2 LYS 104 1HD LYS 104 -15.165 -2.288 4.037 495 HD3 LYS 104 2HD LYS 104 -15.977 -2.614 2.504 496 HE2 LYS 104 1HE LYS 104 -17.466 -3.448 4.082 497 HE3 LYS 104 2HE LYS 104 -16.588 -4.882 3.553 498 HZ1 LYS 104 3HZ LYS 104 -16.404 -5.178 5.771 499 HZ2 LYS 104 1HZ LYS 104 -16.558 -3.533 6.135 500 HZ3 LYS 104 2HZ LYS 104 -15.075 -4.147 5.600 501 H ARG 105 H ARG 105 -12.487 -3.553 -0.869 502 HA ARG 105 HA ARG 105 -10.151 -2.318 -1.808 503 HB2 ARG 105 1HB ARG 105 -12.804 -2.145 -3.225 504 HB3 ARG 105 2HB ARG 105 -11.196 -2.185 -3.931 505 HG2 ARG 105 1HG ARG 105 -11.603 -4.343 -4.294 506 HG3 ARG 105 2HG ARG 105 -11.288 -4.558 -2.572 507 HD2 ARG 105 1HD ARG 105 -13.332 -5.556 -2.694 508 HD3 ARG 105 2HD ARG 105 -13.844 -3.894 -2.397 509 HE ARG 105 HE ARG 105 -13.608 -4.582 -5.187 510 HH11 ARG 105 1HH1 ARG 105 -15.729 -4.536 -2.400 511 HH12 ARG 105 2HH1 ARG 105 -17.178 -4.524 -3.347 512 HH21 ARG 105 1HH2 ARG 105 -15.527 -4.573 -6.433 513 HH22 ARG 105 2HH2 ARG 105 -17.064 -4.546 -5.635 514 H ASN 106 H ASN 106 -13.023 -0.942 -0.416 515 HA ASN 106 HA ASN 106 -13.063 1.604 -1.516 516 HB2 ASN 106 1HB ASN 106 -14.788 0.722 0.012 517 HB3 ASN 106 2HB ASN 106 -13.652 0.839 1.352 518 HD21 ASN 106 2HD2 ASN 106 -14.275 2.441 2.614 519 HD22 ASN 106 1HD2 ASN 106 -14.753 4.025 2.084 520 H SER 107 H SER 107 -11.287 0.526 1.399 521 HA SER 107 HA SER 107 -9.943 3.060 1.650 522 HB2 SER 107 1HB SER 107 -10.460 0.939 3.382 523 HB3 SER 107 2HB SER 107 -8.710 0.902 3.157 524 HG SER 107 HG SER 107 -8.649 3.089 3.777 525 H VAL 108 H VAL 108 -9.464 0.473 -0.394 526 HA VAL 108 HA VAL 108 -6.553 0.802 -0.511 527 HB VAL 108 HB VAL 108 -8.313 -1.227 -1.887 528 HG11 VAL 108 1HG1 VAL 108 -6.084 -2.403 -2.215 529 HG12 VAL 108 2HG1 VAL 108 -5.340 -0.852 -1.827 530 HG13 VAL 108 3HG1 VAL 108 -6.403 -0.995 -3.227 531 HG21 VAL 108 3HG2 VAL 108 -7.482 -2.843 -0.294 532 HG22 VAL 108 1HG2 VAL 108 -8.243 -1.503 0.562 533 HG23 VAL 108 2HG2 VAL 108 -6.485 -1.609 0.477 534 H LYS 109 H LYS 109 -5.530 1.167 -2.582 535 HA LYS 109 HA LYS 109 -7.200 2.125 -4.769 536 HB2 LYS 109 1HB LYS 109 -5.332 3.854 -3.172 537 HB3 LYS 109 2HB LYS 109 -5.671 4.217 -4.858 538 HG2 LYS 109 1HG LYS 109 -8.171 3.997 -4.022 539 HG3 LYS 109 2HG LYS 109 -7.428 4.411 -2.478 540 HD2 LYS 109 1HD LYS 109 -7.753 6.530 -3.182 541 HD3 LYS 109 2HD LYS 109 -6.266 6.246 -4.089 542 HE2 LYS 109 1HE LYS 109 -7.833 5.358 -5.938 543 HE3 LYS 109 2HE LYS 109 -9.106 6.196 -5.051 544 HZ1 LYS 109 3HZ LYS 109 -7.884 7.427 -6.928 545 HZ2 LYS 109 1HZ LYS 109 -6.632 7.616 -5.806 546 HZ3 LYS 109 2HZ LYS 109 -8.165 8.251 -5.478 547 HA PRO 110 HA PRO 110 -3.972 0.472 -7.273 548 HB2 PRO 110 1HB PRO 110 -3.940 2.126 -9.424 549 HB3 PRO 110 2HB PRO 110 -5.248 0.977 -9.119 550 HG2 PRO 110 1HG PRO 110 -5.137 3.914 -8.548 551 HG3 PRO 110 2HG PRO 110 -6.464 2.958 -9.233 552 HD2 PRO 110 1HD PRO 110 -6.398 3.712 -6.632 553 HD3 PRO 110 2HD PRO 110 -7.149 2.197 -7.171 554 H LEU 111 H LEU 111 -1.854 0.521 -6.953 555 HA LEU 111 HA LEU 111 -0.506 3.123 -6.662 556 HB2 LEU 111 1HB LEU 111 -0.569 0.991 -4.926 557 HB3 LEU 111 2HB LEU 111 0.942 0.731 -5.774 558 HG LEU 111 HG LEU 111 0.202 3.278 -4.327 559 HD11 LEU 111 1HD1 LEU 111 1.889 0.927 -3.498 560 HD12 LEU 111 2HD1 LEU 111 0.458 1.566 -2.694 561 HD13 LEU 111 3HD1 LEU 111 1.950 2.503 -2.710 562 HD21 LEU 111 3HD2 LEU 111 2.623 3.752 -4.568 563 HD22 LEU 111 1HD2 LEU 111 1.759 3.701 -6.102 564 HD23 LEU 111 2HD2 LEU 111 2.757 2.337 -5.613 565 H LEU 112 H LEU 112 1.306 3.582 -7.880 566 HA LEU 112 HA LEU 112 2.200 1.514 -9.773 567 HB2 LEU 112 1HB LEU 112 2.612 3.625 -11.307 568 HB3 LEU 112 2HB LEU 112 1.083 2.772 -11.294 569 HG LEU 112 HG LEU 112 1.242 4.974 -9.354 570 HD11 LEU 112 1HD1 LEU 112 2.503 6.100 -10.995 571 HD12 LEU 112 2HD1 LEU 112 0.841 6.658 -11.199 572 HD13 LEU 112 3HD1 LEU 112 1.513 5.460 -12.306 573 HD21 LEU 112 3HD2 LEU 112 -0.852 3.961 -9.641 574 HD22 LEU 112 1HD2 LEU 112 -0.710 3.959 -11.399 575 HD23 LEU 112 2HD2 LEU 112 -0.964 5.477 -10.535 576 H ASP 113 H ASP 113 4.349 1.977 -10.734 577 HA ASP 113 HA ASP 113 6.250 2.491 -8.692 578 HB2 ASP 113 1HB ASP 113 6.566 2.093 -11.670 579 HB3 ASP 113 2HB ASP 113 7.925 2.256 -10.563 580 H SER 114 H SER 114 5.213 4.355 -11.535 581 HA SER 114 HA SER 114 7.089 6.426 -11.329 582 HB2 SER 114 1HB SER 114 5.004 7.758 -12.381 583 HB3 SER 114 2HB SER 114 5.980 6.628 -13.318 584 HG SER 114 HG SER 114 4.289 5.404 -13.510 585 H GLU 115 H GLU 115 4.167 5.802 -9.508 586 HA GLU 115 HA GLU 115 4.090 8.447 -8.354 587 HB2 GLU 115 1HB GLU 115 2.003 7.853 -7.770 588 HB3 GLU 115 2HB GLU 115 2.275 6.359 -8.650 589 HG2 GLU 115 1HG GLU 115 2.899 5.208 -6.674 590 HG3 GLU 115 2HG GLU 115 2.911 6.701 -5.736 591 H ILE 116 H ILE 116 4.944 5.167 -7.282 592 HA ILE 116 HA ILE 116 5.674 5.776 -4.651 593 HB ILE 116 HB ILE 116 6.892 3.651 -6.430 594 HG12 ILE 116 1HG1 ILE 116 4.782 3.216 -4.330 595 HG13 ILE 116 2HG1 ILE 116 4.344 3.655 -5.976 596 HG21 ILE 116 1HG2 ILE 116 8.096 2.905 -4.695 597 HG22 ILE 116 2HG2 ILE 116 6.784 3.169 -3.548 598 HG23 ILE 116 3HG2 ILE 116 7.836 4.506 -4.010 599 HD11 ILE 116 3HD1 ILE 116 4.405 1.167 -5.291 600 HD12 ILE 116 1HD1 ILE 116 6.151 1.333 -5.477 601 HD13 ILE 116 2HD1 ILE 116 5.084 1.651 -6.846 602 H ALA 117 H ALA 117 7.748 5.519 -7.548 603 HA ALA 117 HA ALA 117 10.166 6.296 -6.422 604 HB1 ALA 117 3HB ALA 117 10.957 6.517 -8.569 605 HB2 ALA 117 1HB ALA 117 9.486 7.299 -9.146 606 HB3 ALA 117 2HB ALA 117 9.511 5.555 -8.874 607 H LYS 118 H LYS 118 7.540 8.259 -7.749 608 HA LYS 118 HA LYS 118 8.766 10.776 -7.430 609 HB2 LYS 118 1HB LYS 118 6.392 9.850 -8.486 610 HB3 LYS 118 2HB LYS 118 5.867 10.787 -7.093 611 HG2 LYS 118 1HG LYS 118 6.112 12.621 -8.272 612 HG3 LYS 118 2HG LYS 118 7.845 12.296 -8.365 613 HD2 LYS 118 1HD LYS 118 7.619 11.141 -10.420 614 HD3 LYS 118 2HD LYS 118 5.864 11.037 -10.251 615 HE2 LYS 118 1HE LYS 118 5.693 12.892 -11.470 616 HE3 LYS 118 2HE LYS 118 6.478 13.772 -10.160 617 HZ1 LYS 118 3HZ LYS 118 8.623 13.290 -11.172 618 HZ2 LYS 118 1HZ LYS 118 7.621 14.115 -12.259 619 HZ3 LYS 118 2HZ LYS 118 7.869 12.450 -12.431 620 H PHE 119 H PHE 119 6.436 9.044 -5.384 621 HA PHE 119 HA PHE 119 6.132 10.873 -3.335 622 HB2 PHE 119 1HB PHE 119 4.800 8.876 -3.341 623 HB3 PHE 119 2HB PHE 119 6.227 7.851 -3.242 624 HD1 PHE 119 HD1 PHE 119 7.620 7.945 -1.112 625 HD2 PHE 119 HD2 PHE 119 3.696 9.569 -1.405 626 HE1 PHE 119 HE1 PHE 119 7.415 7.882 1.341 627 HE2 PHE 119 HE2 PHE 119 3.491 9.515 1.047 628 HZ PHE 119 HZ PHE 119 5.358 8.674 2.411 629 H LEU 120 H LEU 120 8.684 8.437 -3.716 630 HA LEU 120 HA LEU 120 10.012 9.112 -1.291 631 HB2 LEU 120 1HB LEU 120 10.966 7.644 -3.739 632 HB3 LEU 120 2HB LEU 120 11.881 7.794 -2.249 633 HG LEU 120 HG LEU 120 9.152 6.752 -1.914 634 HD11 LEU 120 1HD1 LEU 120 11.248 5.051 -3.264 635 HD12 LEU 120 2HD1 LEU 120 9.810 5.699 -4.053 636 HD13 LEU 120 3HD1 LEU 120 9.646 4.535 -2.739 637 HD21 LEU 120 3HD2 LEU 120 11.741 5.545 -0.993 638 HD22 LEU 120 1HD2 LEU 120 10.145 5.444 -0.253 639 HD23 LEU 120 2HD2 LEU 120 11.045 6.957 -0.200 640 H GLY 121 H GLY 121 10.056 10.406 -4.518 641 HA2 GLY 121 1HA GLY 121 12.554 11.848 -4.086 642 HA3 GLY 121 2HA GLY 121 11.572 11.871 -5.541 643 H SER 122 H SER 122 9.642 12.327 -2.790 644 HA SER 122 HA SER 122 9.290 15.128 -3.466 645 HB2 SER 122 1HB SER 122 7.340 15.075 -2.043 646 HB3 SER 122 2HB SER 122 7.336 13.614 -3.028 647 HG SER 122 HG SER 122 7.414 13.865 -0.335 648 H SER 123 H SER 123 11.613 15.436 -2.724 649 HA SER 123 HA SER 123 12.437 15.360 -0.079 650 HB2 SER 123 1HB SER 123 13.830 17.481 -0.896 651 HB3 SER 123 2HB SER 123 14.193 15.855 -1.468 652 HG SER 123 HG SER 123 12.693 17.867 -2.794 653 H LYS 124 H LYS 124 10.165 17.498 -1.564 654 HA LYS 124 HA LYS 124 10.358 19.724 0.131 655 HB2 LYS 124 1HB LYS 124 8.005 20.175 -0.571 656 HB3 LYS 124 2HB LYS 124 9.109 19.885 -1.908 657 HG2 LYS 124 1HG LYS 124 8.102 17.373 -1.309 658 HG3 LYS 124 2HG LYS 124 6.718 18.452 -1.137 659 HD2 LYS 124 1HD LYS 124 7.403 19.420 -3.393 660 HD3 LYS 124 2HD LYS 124 8.471 18.021 -3.539 661 HE2 LYS 124 1HE LYS 124 6.641 16.510 -3.462 662 HE3 LYS 124 2HE LYS 124 5.524 17.784 -2.979 663 HZ1 LYS 124 3HZ LYS 124 5.430 18.632 -5.091 664 HZ2 LYS 124 1HZ LYS 124 5.605 16.984 -5.430 665 HZ3 LYS 124 2HZ LYS 124 6.939 18.017 -5.544 666 H ARG 125 H ARG 125 8.151 16.911 0.319 667 HA ARG 125 HA ARG 125 8.019 17.293 3.213 668 HB2 ARG 125 1HB ARG 125 5.987 18.299 2.104 669 HB3 ARG 125 2HB ARG 125 5.580 16.684 1.537 670 HG2 ARG 125 1HG ARG 125 5.998 16.371 4.266 671 HG3 ARG 125 2HG ARG 125 5.135 17.903 4.118 672 HD2 ARG 125 1HD ARG 125 4.165 15.575 2.540 673 HD3 ARG 125 2HD ARG 125 3.859 15.593 4.276 674 HE ARG 125 HE ARG 125 3.060 18.061 3.377 675 HH11 ARG 125 1HH1 ARG 125 2.202 14.741 2.655 676 HH12 ARG 125 2HH1 ARG 125 0.571 15.127 2.228 677 HH21 ARG 125 1HH2 ARG 125 0.902 18.561 2.810 678 HH22 ARG 125 2HH2 ARG 125 -0.167 17.291 2.314 679 H LYS 126 H LYS 126 9.126 15.543 3.773 680 HA LYS 126 HA LYS 126 8.018 12.925 3.079 681 HB2 LYS 126 1HB LYS 126 10.507 13.946 2.119 682 HB3 LYS 126 2HB LYS 126 10.843 12.642 3.248 683 HG2 LYS 126 1HG LYS 126 9.349 11.170 1.970 684 HG3 LYS 126 2HG LYS 126 9.081 12.476 0.812 685 HD2 LYS 126 1HD LYS 126 11.790 11.327 1.469 686 HD3 LYS 126 2HD LYS 126 10.798 10.799 0.109 687 HE2 LYS 126 1HE LYS 126 11.080 12.776 -1.038 688 HE3 LYS 126 2HE LYS 126 11.407 13.702 0.424 689 HZ1 LYS 126 3HZ LYS 126 13.340 11.634 -0.269 690 HZ2 LYS 126 1HZ LYS 126 13.590 13.177 0.377 691 HZ3 LYS 126 2HZ LYS 126 13.296 12.989 -1.277 692 H SER 127 H SER 127 8.329 11.305 4.644 693 HA SER 127 HA SER 127 9.447 12.240 7.210 694 HB2 SER 127 1HB SER 127 6.831 11.725 6.848 695 HB3 SER 127 2HB SER 127 7.386 10.095 7.226 696 HG SER 127 HG SER 127 7.055 10.882 9.190 697 H LYS 128 H LYS 128 10.789 10.835 8.308 698 HA LYS 128 HA LYS 128 12.307 9.006 6.908 699 HB2 LYS 128 1HB LYS 128 12.691 10.078 9.238 700 HB3 LYS 128 2HB LYS 128 11.839 8.669 9.858 701 HG2 LYS 128 1HG LYS 128 13.609 7.343 9.585 702 HG3 LYS 128 2HG LYS 128 13.955 7.984 7.978 703 HD2 LYS 128 1HD LYS 128 15.542 9.353 8.760 704 HD3 LYS 128 2HD LYS 128 14.523 9.901 10.092 705 HE2 LYS 128 1HE LYS 128 15.087 7.875 11.349 706 HE3 LYS 128 2HE LYS 128 16.108 7.335 10.016 707 HZ1 LYS 128 3HZ LYS 128 16.666 9.985 11.097 708 HZ2 LYS 128 1HZ LYS 128 17.731 8.790 10.551 709 HZ3 LYS 128 2HZ LYS 128 17.047 8.672 12.092 710 H GLU 129 H GLU 129 9.521 8.335 9.025 711 HA GLU 129 HA GLU 129 9.589 5.523 8.636 712 HB2 GLU 129 1HB GLU 129 7.624 7.461 9.776 713 HB3 GLU 129 2HB GLU 129 7.066 5.842 9.376 714 HG2 GLU 129 1HG GLU 129 8.909 4.938 10.793 715 HG3 GLU 129 2HG GLU 129 9.254 6.593 11.295 716 H LEU 130 H LEU 130 8.118 8.174 6.853 717 HA LEU 130 HA LEU 130 6.425 6.456 5.278 718 HB2 LEU 130 1HB LEU 130 7.073 9.364 5.301 719 HB3 LEU 130 2HB LEU 130 6.395 8.679 3.839 720 HG LEU 130 HG LEU 130 4.934 7.997 6.303 721 HD11 LEU 130 1HD1 LEU 130 3.785 10.341 6.044 722 HD12 LEU 130 2HD1 LEU 130 5.381 10.819 5.464 723 HD13 LEU 130 3HD1 LEU 130 5.197 10.134 7.079 724 HD21 LEU 130 3HD2 LEU 130 3.028 8.325 4.904 725 HD22 LEU 130 1HD2 LEU 130 4.236 7.449 3.961 726 HD23 LEU 130 2HD2 LEU 130 3.990 9.177 3.696 727 H ILE 131 H ILE 131 9.567 8.038 4.831 728 HA ILE 131 HA ILE 131 9.874 7.460 2.100 729 HB ILE 131 HB ILE 131 12.048 7.700 4.187 730 HG12 ILE 131 1HG1 ILE 131 11.021 9.774 2.242 731 HG13 ILE 131 2HG1 ILE 131 10.562 9.703 3.937 732 HG21 ILE 131 1HG2 ILE 131 13.505 7.200 2.589 733 HG22 ILE 131 2HG2 ILE 131 12.872 8.501 1.582 734 HG23 ILE 131 3HG2 ILE 131 12.170 6.885 1.481 735 HD11 ILE 131 3HD1 ILE 131 12.225 11.279 3.969 736 HD12 ILE 131 1HD1 ILE 131 13.164 10.471 2.714 737 HD13 ILE 131 2HD1 ILE 131 13.129 9.814 4.351 738 H GLU 132 H GLU 132 11.261 5.714 4.899 739 HA GLU 132 HA GLU 132 12.318 3.566 3.503 740 HB2 GLU 132 1HB GLU 132 12.144 4.252 6.145 741 HB3 GLU 132 2HB GLU 132 11.092 2.846 6.079 742 HG2 GLU 132 1HG GLU 132 13.136 1.916 6.582 743 HG3 GLU 132 2HG GLU 132 13.053 1.723 4.833 744 H ALA 133 H ALA 133 9.015 4.229 4.446 745 HA ALA 133 HA ALA 133 7.905 1.683 4.057 746 HB1 ALA 133 3HB ALA 133 6.882 3.824 5.096 747 HB2 ALA 133 1HB ALA 133 5.833 2.708 4.222 748 HB3 ALA 133 2HB ALA 133 6.394 4.188 3.441 749 H TYR 134 H TYR 134 7.956 4.485 1.860 750 HA TYR 134 HA TYR 134 6.915 2.978 -0.324 751 HB2 TYR 134 1HB TYR 134 7.951 5.722 0.057 752 HB3 TYR 134 2HB TYR 134 8.081 5.076 -1.576 753 HD1 TYR 134 HD1 TYR 134 5.565 5.373 1.181 754 HD2 TYR 134 HD2 TYR 134 6.294 5.362 -3.009 755 HE1 TYR 134 HE1 TYR 134 3.205 5.928 0.774 756 HE2 TYR 134 HE2 TYR 134 3.937 5.917 -3.429 757 HH TYR 134 HH TYR 134 1.604 6.209 -0.773 758 H GLU 135 H GLU 135 10.152 3.609 0.843 759 HA GLU 135 HA GLU 135 11.481 2.690 -1.519 760 HB2 GLU 135 1HB GLU 135 12.286 4.048 0.731 761 HB3 GLU 135 2HB GLU 135 12.970 2.451 0.996 762 HG2 GLU 135 1HG GLU 135 14.421 2.623 -0.738 763 HG3 GLU 135 2HG GLU 135 13.348 3.653 -1.682 764 H ALA 136 H ALA 136 10.144 1.170 1.329 765 HA ALA 136 HA ALA 136 11.564 -1.321 0.966 766 HB1 ALA 136 3HB ALA 136 10.840 -0.574 3.191 767 HB2 ALA 136 1HB ALA 136 10.185 -2.158 2.771 768 HB3 ALA 136 2HB ALA 136 9.158 -0.727 2.682 769 H SER 137 H SER 137 8.419 0.015 0.119 770 HA SER 137 HA SER 137 7.332 -2.467 -0.828 771 HB2 SER 137 1HB SER 137 5.408 -1.205 -1.459 772 HB3 SER 137 2HB SER 137 5.977 -0.525 0.064 773 HG SER 137 HG SER 137 7.059 1.098 -1.237 774 H LYS 138 H LYS 138 9.334 0.002 -2.196 775 HA LYS 138 HA LYS 138 8.683 -0.135 -4.900 776 HB2 LYS 138 1HB LYS 138 10.359 1.397 -3.655 777 HB3 LYS 138 2HB LYS 138 11.526 0.118 -3.958 778 HG2 LYS 138 1HG LYS 138 11.937 1.245 -5.845 779 HG3 LYS 138 2HG LYS 138 10.475 0.453 -6.437 780 HD2 LYS 138 1HD LYS 138 9.223 2.357 -6.299 781 HD3 LYS 138 2HD LYS 138 10.138 2.985 -4.925 782 HE2 LYS 138 1HE LYS 138 11.568 2.758 -7.511 783 HE3 LYS 138 2HE LYS 138 10.327 4.004 -7.390 784 HZ1 LYS 138 3HZ LYS 138 12.433 4.920 -6.759 785 HZ2 LYS 138 1HZ LYS 138 12.699 3.690 -5.629 786 HZ3 LYS 138 2HZ LYS 138 11.466 4.820 -5.375 787 H THR 139 H THR 139 10.942 -2.152 -3.035 788 HA THR 139 HA THR 139 12.161 -3.673 -4.938 789 HB THR 139 HB THR 139 10.999 -4.946 -2.475 790 HG1 THR 139 HG1 THR 139 13.266 -3.245 -2.590 791 HG21 THR 139 3HG2 THR 139 13.264 -5.528 -4.257 792 HG22 THR 139 1HG2 THR 139 12.273 -6.607 -3.272 793 HG23 THR 139 2HG2 THR 139 13.578 -5.685 -2.527 794 HA PRO 140 HA PRO 140 8.480 -5.337 -7.077 795 HB2 PRO 140 1HB PRO 140 10.675 -6.398 -8.783 796 HB3 PRO 140 2HB PRO 140 9.207 -5.531 -9.246 797 HG2 PRO 140 1HG PRO 140 11.567 -4.308 -9.302 798 HG3 PRO 140 2HG PRO 140 10.114 -3.456 -8.745 799 HD2 PRO 140 1HD PRO 140 12.347 -4.646 -7.140 800 HD3 PRO 140 2HD PRO 140 11.480 -3.116 -6.901 801 HA PRO 141 HA PRO 141 10.699 -9.818 -6.736 802 HB2 PRO 141 1HB PRO 141 12.487 -8.937 -4.502 803 HB3 PRO 141 2HB PRO 141 12.762 -10.178 -5.735 804 HG2 PRO 141 1HG PRO 141 13.951 -7.845 -5.959 805 HG3 PRO 141 2HG PRO 141 13.211 -8.589 -7.393 806 HD2 PRO 141 1HD PRO 141 12.195 -6.360 -5.675 807 HD3 PRO 141 2HD PRO 141 12.137 -6.538 -7.439 808 H ASP 142 H ASP 142 10.826 -11.302 -4.649 809 HA ASP 142 HA ASP 142 9.771 -12.187 -2.858 810 HB2 ASP 142 1HB ASP 142 10.672 -9.904 -1.952 811 HB3 ASP 142 2HB ASP 142 8.967 -9.464 -1.912 812 H LEU 143 H LEU 143 8.275 -11.080 -5.376 813 HA LEU 143 HA LEU 143 5.794 -12.225 -4.872 814 HB2 LEU 143 1HB LEU 143 5.795 -9.908 -3.538 815 HB3 LEU 143 2HB LEU 143 5.352 -9.285 -5.110 816 HG LEU 143 HG LEU 143 3.363 -10.667 -5.159 817 HD11 LEU 143 1HD1 LEU 143 3.841 -12.668 -4.114 818 HD12 LEU 143 2HD1 LEU 143 2.818 -11.873 -2.919 819 HD13 LEU 143 3HD1 LEU 143 4.569 -11.884 -2.711 820 HD21 LEU 143 3HD2 LEU 143 2.165 -9.290 -3.842 821 HD22 LEU 143 1HD2 LEU 143 3.714 -8.484 -3.609 822 HD23 LEU 143 2HD2 LEU 143 3.134 -9.641 -2.412 823 H LYS 144 H LYS 144 6.548 -9.166 -6.579 824 HA LYS 144 HA LYS 144 6.455 -8.593 -8.778 825 HB2 LYS 144 1HB LYS 144 8.137 -10.796 -8.552 826 HB3 LYS 144 2HB LYS 144 7.079 -11.211 -9.894 827 HG2 LYS 144 1HG LYS 144 7.844 -9.488 -11.212 828 HG3 LYS 144 2HG LYS 144 8.353 -8.516 -9.831 829 HD2 LYS 144 1HD LYS 144 10.381 -9.229 -10.689 830 HD3 LYS 144 2HD LYS 144 10.064 -10.439 -9.447 831 HE2 LYS 144 1HE LYS 144 9.056 -10.956 -12.199 832 HE3 LYS 144 2HE LYS 144 10.787 -11.112 -11.909 833 HZ1 LYS 144 3HZ LYS 144 10.350 -12.728 -10.196 834 HZ2 LYS 144 1HZ LYS 144 9.576 -13.213 -11.620 835 HZ3 LYS 144 2HZ LYS 144 8.680 -12.528 -10.362 836 H GLU 145 H GLU 145 5.739 -9.938 -11.107 837 HA GLU 145 HA GLU 145 2.874 -10.212 -10.685 838 HB2 GLU 145 1HB GLU 145 4.631 -9.615 -12.996 839 HB3 GLU 145 2HB GLU 145 3.141 -10.476 -13.353 840 HG2 GLU 145 1HG GLU 145 1.896 -8.685 -12.160 841 HG3 GLU 145 2HG GLU 145 3.414 -7.801 -12.008 842 H GLU 146 H GLU 146 5.565 -12.255 -11.029 843 HA GLU 146 HA GLU 146 5.888 -14.440 -11.567 844 HB2 GLU 146 1HB GLU 146 4.475 -15.980 -10.324 845 HB3 GLU 146 2HB GLU 146 4.862 -14.577 -9.344 846 HG2 GLU 146 1HG GLU 146 2.693 -13.752 -9.446 847 HG3 GLU 146 2HG GLU 146 2.291 -14.710 -10.870 848 H SER 147 H SER 147 4.753 -13.072 -13.736 849 HA SER 147 HA SER 147 3.431 -15.299 -15.083 850 HB2 SER 147 1HB SER 147 1.558 -13.926 -14.415 851 HB3 SER 147 2HB SER 147 2.353 -12.470 -15.014 852 HG SER 147 HG SER 147 1.056 -13.006 -16.654 853 H SER 148 H SER 148 4.624 -15.741 -16.825 854 HA SER 148 HA SER 148 5.508 -13.584 -18.562 855 HB2 SER 148 1HB SER 148 7.396 -13.849 -17.010 856 HB3 SER 148 2HB SER 148 7.476 -15.567 -17.393 857 HG SER 148 HG SER 148 8.394 -15.121 -19.270 858 H THR 149 H THR 149 6.310 -17.041 -18.173 859 HA THR 149 HA THR 149 6.511 -18.677 -19.769 860 HB THR 149 HB THR 149 4.350 -19.130 -18.869 861 HG1 THR 149 HG1 THR 149 4.847 -20.282 -20.775 862 HG21 THR 149 3HG2 THR 149 3.252 -17.086 -20.779 863 HG22 THR 149 1HG2 THR 149 3.241 -17.019 -19.018 864 HG23 THR 149 2HG2 THR 149 2.279 -18.233 -19.860 865 H ASP 150 H ASP 150 7.918 -17.329 -21.126 866 HA ASP 150 HA ASP 150 6.650 -16.552 -23.668 867 HB2 ASP 150 1HB ASP 150 8.672 -15.172 -24.049 868 HB3 ASP 150 2HB ASP 150 7.798 -14.699 -22.597 869 H LEU 151 H LEU 151 7.489 -17.285 -25.625 870 HA LEU 151 HA LEU 151 9.751 -19.135 -25.573 871 HB2 LEU 151 1HB LEU 151 6.935 -19.858 -26.229 872 HB3 LEU 151 2HB LEU 151 8.218 -20.607 -27.159 873 HG LEU 151 HG LEU 151 8.476 -20.703 -24.202 874 HD11 LEU 151 1HD1 LEU 151 6.821 -22.842 -25.380 875 HD12 LEU 151 2HD1 LEU 151 6.024 -21.288 -25.131 876 HD13 LEU 151 3HD1 LEU 151 6.775 -22.122 -23.770 877 HD21 LEU 151 3HD2 LEU 151 10.200 -21.856 -25.129 878 HD22 LEU 151 1HD2 LEU 151 9.288 -22.273 -26.579 879 HD23 LEU 151 2HD2 LEU 151 9.014 -23.160 -25.080 880 H GLU 152 H GLU 152 10.898 -17.593 -26.776 881 HA GLU 152 HA GLU 152 9.987 -17.257 -29.562 882 HB2 GLU 152 1HB GLU 152 10.045 -15.185 -27.995 883 HB3 GLU 152 2HB GLU 152 11.789 -15.280 -28.188 884 HG2 GLU 152 1HG GLU 152 11.653 -14.877 -30.510 885 HG3 GLU 152 2HG GLU 152 9.910 -15.134 -30.528 Start of MODEL 20 1 H1 SER 45 1H SER 45 -19.634 -7.556 -13.395 2 H2 SER 45 2H SER 45 -20.796 -6.294 -13.411 3 H3 SER 45 3H SER 45 -21.075 -7.707 -12.479 4 HA SER 45 HA SER 45 -20.445 -6.067 -10.998 5 HB2 SER 45 1HB SER 45 -19.306 -8.413 -10.993 6 HB3 SER 45 2HB SER 45 -17.860 -7.531 -11.485 7 HG SER 45 HG SER 45 -17.783 -6.546 -9.571 8 H ALA 46 H ALA 46 -19.128 -4.329 -10.354 9 HA ALA 46 HA ALA 46 -17.532 -3.132 -12.525 10 HB1 ALA 46 3HB ALA 46 -19.561 -1.961 -10.704 11 HB2 ALA 46 1HB ALA 46 -19.203 -1.591 -12.392 12 HB3 ALA 46 2HB ALA 46 -18.166 -0.964 -11.111 13 H ASP 47 H ASP 47 -15.775 -1.701 -11.813 14 HA ASP 47 HA ASP 47 -13.840 -1.324 -10.686 15 HB2 ASP 47 1HB ASP 47 -15.799 -0.769 -8.918 16 HB3 ASP 47 2HB ASP 47 -14.975 -2.057 -8.046 17 H ASP 48 H ASP 48 -14.117 -3.880 -11.766 18 HA ASP 48 HA ASP 48 -13.212 -5.791 -9.784 19 HB2 ASP 48 1HB ASP 48 -14.758 -6.157 -11.907 20 HB3 ASP 48 2HB ASP 48 -13.211 -6.402 -12.708 21 H ARG 49 H ARG 49 -11.309 -4.348 -9.345 22 HA ARG 49 HA ARG 49 -9.091 -4.981 -11.179 23 HB2 ARG 49 1HB ARG 49 -9.990 -2.474 -10.644 24 HB3 ARG 49 2HB ARG 49 -8.788 -2.655 -9.375 25 HG2 ARG 49 1HG ARG 49 -7.389 -1.862 -10.938 26 HG3 ARG 49 2HG ARG 49 -7.378 -3.532 -11.507 27 HD2 ARG 49 1HD ARG 49 -8.900 -3.071 -13.232 28 HD3 ARG 49 2HD ARG 49 -9.401 -1.547 -12.502 29 HE ARG 49 HE ARG 49 -7.152 -1.985 -14.232 30 HH11 ARG 49 1HH1 ARG 49 -8.441 0.083 -11.710 31 HH12 ARG 49 2HH1 ARG 49 -7.479 1.446 -12.165 32 HH21 ARG 49 1HH2 ARG 49 -5.884 -0.179 -14.824 33 HH22 ARG 49 2HH2 ARG 49 -6.027 1.299 -13.934 34 H LEU 50 H LEU 50 -6.918 -4.425 -9.715 35 HA LEU 50 HA LEU 50 -5.541 -5.101 -8.038 36 HB2 LEU 50 1HB LEU 50 -8.144 -5.362 -6.545 37 HB3 LEU 50 2HB LEU 50 -6.591 -5.703 -5.815 38 HG LEU 50 HG LEU 50 -5.962 -3.294 -6.535 39 HD11 LEU 50 1HD1 LEU 50 -8.339 -2.021 -6.226 40 HD12 LEU 50 2HD1 LEU 50 -8.815 -3.411 -7.202 41 HD13 LEU 50 3HD1 LEU 50 -7.553 -2.319 -7.775 42 HD21 LEU 50 3HD2 LEU 50 -8.036 -3.261 -4.413 43 HD22 LEU 50 1HD2 LEU 50 -6.403 -2.598 -4.413 44 HD23 LEU 50 2HD2 LEU 50 -6.650 -4.330 -4.204 45 H ASN 51 H ASN 51 -4.544 -6.902 -8.697 46 HA ASN 51 HA ASN 51 -5.986 -9.461 -8.483 47 HB2 ASN 51 1HB ASN 51 -4.092 -8.371 -10.466 48 HB3 ASN 51 2HB ASN 51 -3.806 -10.049 -10.012 49 HD21 ASN 51 2HD2 ASN 51 -6.658 -8.003 -10.659 50 HD22 ASN 51 1HD2 ASN 51 -7.418 -9.131 -11.741 51 H PHE 52 H PHE 52 -4.274 -11.354 -8.291 52 HA PHE 52 HA PHE 52 -3.133 -11.105 -5.697 53 HB2 PHE 52 1HB PHE 52 -2.736 -13.319 -7.726 54 HB3 PHE 52 2HB PHE 52 -2.399 -13.415 -5.996 55 HD1 PHE 52 HD2 PHE 52 -4.752 -12.168 -4.812 56 HD2 PHE 52 HD1 PHE 52 -4.449 -14.812 -8.133 57 HE1 PHE 52 HE2 PHE 52 -7.051 -12.935 -4.408 58 HE2 PHE 52 HE1 PHE 52 -6.749 -15.584 -7.731 59 HZ PHE 52 HZ PHE 52 -8.053 -14.648 -5.866 60 H GLY 53 H GLY 53 -1.221 -10.324 -5.139 61 HA2 GLY 53 1HA GLY 53 1.064 -9.963 -5.183 62 HA3 GLY 53 2HA GLY 53 1.137 -10.820 -6.715 63 H ASP 54 H ASP 54 -0.726 -7.939 -5.783 64 HA ASP 54 HA ASP 54 0.762 -6.409 -7.807 65 HB2 ASP 54 1HB ASP 54 -1.724 -7.182 -8.288 66 HB3 ASP 54 2HB ASP 54 -2.117 -5.802 -7.270 67 H ARG 55 H ARG 55 1.577 -4.530 -7.133 68 HA ARG 55 HA ARG 55 1.442 -3.768 -4.407 69 HB2 ARG 55 1HB ARG 55 2.478 -2.259 -6.815 70 HB3 ARG 55 2HB ARG 55 2.707 -1.748 -5.149 71 HG2 ARG 55 1HG ARG 55 3.714 -4.189 -4.931 72 HG3 ARG 55 2HG ARG 55 3.992 -3.951 -6.656 73 HD2 ARG 55 1HD ARG 55 4.793 -1.564 -5.437 74 HD3 ARG 55 2HD ARG 55 5.412 -2.849 -4.401 75 HE ARG 55 HE ARG 55 6.909 -3.390 -6.038 76 HH11 ARG 55 1HH1 ARG 55 4.378 -1.426 -7.460 77 HH12 ARG 55 2HH1 ARG 55 5.164 -1.308 -8.998 78 HH21 ARG 55 1HH2 ARG 55 7.926 -3.249 -8.070 79 HH22 ARG 55 2HH2 ARG 55 7.183 -2.337 -9.343 80 H ILE 56 H ILE 56 -0.202 -2.822 -3.433 81 HA ILE 56 HA ILE 56 -1.711 -0.743 -4.873 82 HB ILE 56 HB ILE 56 -3.782 -1.496 -3.730 83 HG12 ILE 56 1HG1 ILE 56 -2.220 -4.011 -3.089 84 HG13 ILE 56 2HG1 ILE 56 -2.572 -2.753 -1.906 85 HG21 ILE 56 1HG2 ILE 56 -3.646 -2.130 -5.972 86 HG22 ILE 56 2HG2 ILE 56 -4.016 -3.637 -5.134 87 HG23 ILE 56 3HG2 ILE 56 -2.367 -3.307 -5.663 88 HD11 ILE 56 3HD1 ILE 56 -4.114 -4.956 -2.443 89 HD12 ILE 56 1HD1 ILE 56 -4.942 -3.666 -3.311 90 HD13 ILE 56 2HD1 ILE 56 -4.635 -3.509 -1.582 91 H LEU 57 H LEU 57 -2.582 0.930 -3.596 92 HA LEU 57 HA LEU 57 -1.152 1.337 -1.079 93 HB2 LEU 57 1HB LEU 57 -1.382 3.029 -3.061 94 HB3 LEU 57 2HB LEU 57 -2.950 3.367 -2.349 95 HG LEU 57 HG LEU 57 -1.641 3.781 -0.161 96 HD11 LEU 57 1HD1 LEU 57 0.613 4.313 -2.069 97 HD12 LEU 57 2HD1 LEU 57 0.474 2.800 -1.175 98 HD13 LEU 57 3HD1 LEU 57 0.636 4.326 -0.305 99 HD21 LEU 57 3HD2 LEU 57 -1.641 5.576 -2.568 100 HD22 LEU 57 1HD2 LEU 57 -1.024 6.116 -1.006 101 HD23 LEU 57 2HD2 LEU 57 -2.707 5.609 -1.161 102 H VAL 58 H VAL 58 -2.148 1.590 0.894 103 HA VAL 58 HA VAL 58 -5.083 1.399 0.970 104 HB VAL 58 HB VAL 58 -4.257 -0.857 1.301 105 HG11 VAL 58 1HG1 VAL 58 -2.184 -1.013 2.138 106 HG12 VAL 58 2HG1 VAL 58 -2.998 -1.011 3.702 107 HG13 VAL 58 3HG1 VAL 58 -2.328 0.485 3.056 108 HG21 VAL 58 3HG2 VAL 58 -6.233 -0.113 2.564 109 HG22 VAL 58 1HG2 VAL 58 -5.188 0.317 3.920 110 HG23 VAL 58 2HG2 VAL 58 -5.326 -1.366 3.411 111 H LYS 59 H LYS 59 -6.086 2.449 2.659 112 HA LYS 59 HA LYS 59 -4.343 4.148 4.313 113 HB2 LYS 59 1HB LYS 59 -6.354 4.918 2.648 114 HB3 LYS 59 2HB LYS 59 -7.218 4.790 4.171 115 HG2 LYS 59 1HG LYS 59 -4.642 6.271 4.135 116 HG3 LYS 59 2HG LYS 59 -6.062 7.030 3.416 117 HD2 LYS 59 1HD LYS 59 -6.076 5.862 6.189 118 HD3 LYS 59 2HD LYS 59 -5.615 7.534 5.864 119 HE2 LYS 59 1HE LYS 59 -7.787 8.005 6.078 120 HE3 LYS 59 2HE LYS 59 -7.972 7.281 4.483 121 HZ1 LYS 59 3HZ LYS 59 -8.745 6.252 7.088 122 HZ2 LYS 59 1HZ LYS 59 -8.091 5.113 6.021 123 HZ3 LYS 59 2HZ LYS 59 -9.455 6.007 5.573 124 H ALA 60 H ALA 60 -4.446 4.090 6.488 125 HA ALA 60 HA ALA 60 -6.243 2.102 7.694 126 HB1 ALA 60 3HB ALA 60 -4.207 1.445 8.445 127 HB2 ALA 60 1HB ALA 60 -4.541 2.651 9.688 128 HB3 ALA 60 2HB ALA 60 -3.514 3.061 8.315 129 HA PRO 61 HA PRO 61 -8.608 5.215 9.756 130 HB2 PRO 61 1HB PRO 61 -9.251 3.939 12.080 131 HB3 PRO 61 2HB PRO 61 -10.010 3.569 10.529 132 HG2 PRO 61 1HG PRO 61 -7.797 2.141 11.944 133 HG3 PRO 61 2HG PRO 61 -9.187 1.468 11.073 134 HD2 PRO 61 1HD PRO 61 -6.712 1.592 9.989 135 HD3 PRO 61 2HD PRO 61 -8.187 1.740 9.012 136 H GLY 62 H GLY 62 -7.077 6.815 10.138 137 HA2 GLY 62 1HA GLY 62 -6.528 8.144 12.192 138 HA3 GLY 62 2HA GLY 62 -5.737 6.688 12.769 139 H TYR 63 H TYR 63 -4.693 6.117 10.006 140 HA TYR 63 HA TYR 63 -2.622 8.217 9.901 141 HB2 TYR 63 1HB TYR 63 -2.104 5.296 9.336 142 HB3 TYR 63 2HB TYR 63 -0.921 6.581 9.536 143 HD1 TYR 63 HD1 TYR 63 -1.647 7.884 12.008 144 HD2 TYR 63 HD2 TYR 63 -1.826 3.747 11.021 145 HE1 TYR 63 HE1 TYR 63 -1.429 7.309 14.390 146 HE2 TYR 63 HE2 TYR 63 -1.611 3.165 13.399 147 HH TYR 63 HH TYR 63 -2.155 4.383 15.656 148 HA PRO 64 HA PRO 64 -3.357 8.720 5.582 149 HB2 PRO 64 1HB PRO 64 -0.424 8.552 5.151 150 HB3 PRO 64 2HB PRO 64 -1.548 9.855 4.747 151 HG2 PRO 64 1HG PRO 64 0.141 10.104 6.785 152 HG3 PRO 64 2HG PRO 64 -1.519 10.720 6.904 153 HD2 PRO 64 1HD PRO 64 -0.341 8.210 8.042 154 HD3 PRO 64 2HD PRO 64 -1.481 9.355 8.780 155 H TRP 65 H TRP 65 -2.254 7.875 3.350 156 HA TRP 65 HA TRP 65 -2.838 5.070 3.295 157 HB2 TRP 65 1HB TRP 65 -1.768 6.835 1.081 158 HB3 TRP 65 2HB TRP 65 -2.465 5.231 0.883 159 HD1 TRP 65 HD1 TRP 65 -3.541 8.775 2.008 160 HE1 TRP 65 HE1 TRP 65 -6.036 9.064 1.462 161 HE3 TRP 65 HE3 TRP 65 -4.552 4.058 0.299 162 HZ2 TRP 65 HZ2 TRP 65 -8.154 7.504 0.442 163 HZ3 TRP 65 HZ3 TRP 65 -6.840 3.542 -0.442 164 HH2 TRP 65 HH2 TRP 65 -8.603 5.231 -0.371 165 H TRP 66 H TRP 66 -1.486 3.369 3.220 166 HA TRP 66 HA TRP 66 1.408 3.927 3.158 167 HB2 TRP 66 1HB TRP 66 0.157 2.959 5.299 168 HB3 TRP 66 2HB TRP 66 0.369 1.440 4.434 169 HD1 TRP 66 HD1 TRP 66 2.673 0.299 4.635 170 HE1 TRP 66 HE1 TRP 66 4.944 0.950 5.656 171 HE3 TRP 66 HE3 TRP 66 1.707 5.202 5.723 172 HZ2 TRP 66 HZ2 TRP 66 6.160 3.228 6.777 173 HZ3 TRP 66 HZ3 TRP 66 3.485 6.547 6.764 174 HH2 TRP 66 HH2 TRP 66 5.668 5.576 7.272 175 HA PRO 67 HA PRO 67 1.555 1.329 -0.426 176 HB2 PRO 67 1HB PRO 67 4.197 0.765 -0.478 177 HB3 PRO 67 2HB PRO 67 3.561 2.363 -0.884 178 HG2 PRO 67 1HG PRO 67 4.776 1.403 1.678 179 HG3 PRO 67 2HG PRO 67 5.042 2.929 0.818 180 HD2 PRO 67 1HD PRO 67 3.394 2.718 2.964 181 HD3 PRO 67 2HD PRO 67 3.120 3.881 1.654 182 H ALA 68 H ALA 68 0.593 -0.611 -0.242 183 HA ALA 68 HA ALA 68 2.029 -2.739 1.219 184 HB1 ALA 68 3HB ALA 68 -0.888 -3.038 0.842 185 HB2 ALA 68 1HB ALA 68 -0.367 -1.799 1.986 186 HB3 ALA 68 2HB ALA 68 0.137 -3.473 2.211 187 H LEU 69 H LEU 69 1.176 -4.982 0.397 188 HA LEU 69 HA LEU 69 0.921 -4.904 -2.540 189 HB2 LEU 69 1HB LEU 69 3.157 -5.785 -1.082 190 HB3 LEU 69 2HB LEU 69 2.356 -7.242 -1.637 191 HG LEU 69 HG LEU 69 2.605 -5.247 -3.747 192 HD11 LEU 69 1HD1 LEU 69 5.038 -5.543 -4.046 193 HD12 LEU 69 2HD1 LEU 69 5.116 -6.306 -2.459 194 HD13 LEU 69 3HD1 LEU 69 4.630 -4.617 -2.602 195 HD21 LEU 69 3HD2 LEU 69 3.541 -7.194 -4.945 196 HD22 LEU 69 1HD2 LEU 69 1.986 -7.537 -4.190 197 HD23 LEU 69 2HD2 LEU 69 3.474 -8.120 -3.445 198 H LEU 70 H LEU 70 -0.878 -5.897 -3.182 199 HA LEU 70 HA LEU 70 -2.551 -7.376 -1.475 200 HB2 LEU 70 1HB LEU 70 -3.011 -6.144 -3.751 201 HB3 LEU 70 2HB LEU 70 -2.694 -7.729 -4.436 202 HG LEU 70 HG LEU 70 -4.641 -7.626 -2.203 203 HD11 LEU 70 1HD1 LEU 70 -6.259 -7.158 -4.359 204 HD12 LEU 70 2HD1 LEU 70 -4.930 -6.029 -4.625 205 HD13 LEU 70 3HD1 LEU 70 -5.840 -5.982 -3.115 206 HD21 LEU 70 3HD2 LEU 70 -5.159 -8.968 -4.789 207 HD22 LEU 70 1HD2 LEU 70 -5.446 -9.528 -3.142 208 HD23 LEU 70 2HD2 LEU 70 -3.819 -9.585 -3.822 209 H LEU 71 H LEU 71 -2.599 -9.443 -0.893 210 HA LEU 71 HA LEU 71 -0.784 -11.310 -2.254 211 HB2 LEU 71 1HB LEU 71 -0.104 -11.336 -0.064 212 HB3 LEU 71 2HB LEU 71 -1.707 -10.998 0.556 213 HG LEU 71 HG LEU 71 -2.366 -13.332 0.103 214 HD11 LEU 71 1HD1 LEU 71 -0.340 -13.431 -1.659 215 HD12 LEU 71 2HD1 LEU 71 -1.061 -14.863 -0.923 216 HD13 LEU 71 3HD1 LEU 71 0.434 -14.192 -0.269 217 HD21 LEU 71 3HD2 LEU 71 -1.026 -14.352 1.890 218 HD22 LEU 71 1HD2 LEU 71 -1.556 -12.722 2.307 219 HD23 LEU 71 2HD2 LEU 71 0.110 -13.005 1.795 220 H ARG 72 H ARG 72 -3.971 -11.335 -0.613 221 HA ARG 72 HA ARG 72 -4.992 -13.053 -2.744 222 HB2 ARG 72 1HB ARG 72 -4.663 -13.820 0.098 223 HB3 ARG 72 2HB ARG 72 -6.184 -14.271 -0.662 224 HG2 ARG 72 1HG ARG 72 -3.864 -14.895 -2.309 225 HG3 ARG 72 2HG ARG 72 -3.843 -15.704 -0.742 226 HD2 ARG 72 1HD ARG 72 -6.481 -15.878 -1.779 227 HD3 ARG 72 2HD ARG 72 -5.364 -16.347 -3.061 228 HE ARG 72 HE ARG 72 -4.790 -18.220 -1.853 229 HH11 ARG 72 1HH1 ARG 72 -6.716 -16.091 0.154 230 HH12 ARG 72 2HH1 ARG 72 -6.936 -17.264 1.406 231 HH21 ARG 72 1HH2 ARG 72 -5.069 -19.760 -0.185 232 HH22 ARG 72 2HH2 ARG 72 -5.995 -19.345 1.216 233 H ARG 73 H ARG 73 -7.388 -13.366 -2.566 234 HA ARG 73 HA ARG 73 -8.665 -10.910 -1.549 235 HB2 ARG 73 1HB ARG 73 -8.605 -11.137 -4.037 236 HB3 ARG 73 2HB ARG 73 -9.545 -12.616 -3.889 237 HG2 ARG 73 1HG ARG 73 -11.251 -11.134 -2.638 238 HG3 ARG 73 2HG ARG 73 -10.387 -9.791 -3.387 239 HD2 ARG 73 1HD ARG 73 -12.109 -10.258 -4.889 240 HD3 ARG 73 2HD ARG 73 -10.707 -11.066 -5.588 241 HE ARG 73 HE ARG 73 -11.687 -13.110 -5.161 242 HH11 ARG 73 1HH1 ARG 73 -13.556 -10.575 -3.618 243 HH12 ARG 73 2HH1 ARG 73 -14.905 -11.605 -3.282 244 HH21 ARG 73 1HH2 ARG 73 -13.470 -14.466 -4.692 245 HH22 ARG 73 2HH2 ARG 73 -14.854 -13.812 -3.883 246 H LYS 74 H LYS 74 -9.669 -11.425 0.304 247 HA LYS 74 HA LYS 74 -11.157 -13.960 0.439 248 HB2 LYS 74 1HB LYS 74 -11.112 -13.426 2.972 249 HB3 LYS 74 2HB LYS 74 -9.654 -14.032 2.205 250 HG2 LYS 74 1HG LYS 74 -8.526 -12.098 2.501 251 HG3 LYS 74 2HG LYS 74 -9.964 -11.098 2.304 252 HD2 LYS 74 1HD LYS 74 -9.920 -12.812 4.702 253 HD3 LYS 74 2HD LYS 74 -8.721 -11.518 4.668 254 HE2 LYS 74 1HE LYS 74 -10.265 -9.941 5.010 255 HE3 LYS 74 2HE LYS 74 -11.347 -10.624 3.798 256 HZ1 LYS 74 3HZ LYS 74 -12.539 -10.851 5.741 257 HZ2 LYS 74 1HZ LYS 74 -11.180 -11.223 6.679 258 HZ3 LYS 74 2HZ LYS 74 -11.815 -12.375 5.614 259 H GLU 75 H GLU 75 -13.290 -13.879 0.386 260 HA GLU 75 HA GLU 75 -14.640 -11.357 1.096 261 HB2 GLU 75 1HB GLU 75 -14.808 -11.813 -1.280 262 HB3 GLU 75 2HB GLU 75 -15.393 -13.438 -0.962 263 HG2 GLU 75 1HG GLU 75 -17.356 -12.359 0.202 264 HG3 GLU 75 2HG GLU 75 -16.806 -10.834 -0.487 265 H THR 76 H THR 76 -15.433 -11.642 3.111 266 HA THR 76 HA THR 76 -16.803 -14.175 3.718 267 HB THR 76 HB THR 76 -14.961 -13.686 5.235 268 HG1 THR 76 HG1 THR 76 -17.386 -13.195 6.612 269 HG21 THR 76 3HG2 THR 76 -15.180 -11.795 6.855 270 HG22 THR 76 1HG2 THR 76 -16.394 -11.106 5.778 271 HG23 THR 76 2HG2 THR 76 -14.741 -11.336 5.210 272 H LYS 77 H LYS 77 -18.938 -14.201 4.074 273 HA LYS 77 HA LYS 77 -20.421 -11.739 3.730 274 HB2 LYS 77 1HB LYS 77 -22.410 -13.222 3.712 275 HB3 LYS 77 2HB LYS 77 -21.196 -13.675 2.525 276 HG2 LYS 77 1HG LYS 77 -20.632 -15.121 4.889 277 HG3 LYS 77 2HG LYS 77 -22.366 -15.257 4.584 278 HD2 LYS 77 1HD LYS 77 -20.190 -15.839 2.574 279 HD3 LYS 77 2HD LYS 77 -21.071 -17.054 3.501 280 HE2 LYS 77 1HE LYS 77 -23.187 -16.096 2.484 281 HE3 LYS 77 2HE LYS 77 -22.141 -15.186 1.395 282 HZ1 LYS 77 3HZ LYS 77 -21.262 -17.213 0.518 283 HZ2 LYS 77 1HZ LYS 77 -22.950 -17.312 0.462 284 HZ3 LYS 77 2HZ LYS 77 -22.094 -18.144 1.659 285 H ASP 78 H ASP 78 -22.521 -11.599 5.145 286 HA ASP 78 HA ASP 78 -22.411 -12.451 7.837 287 HB2 ASP 78 1HB ASP 78 -21.047 -9.934 7.160 288 HB3 ASP 78 2HB ASP 78 -22.224 -9.783 8.460 289 H SER 79 H SER 79 -24.533 -12.953 6.965 290 HA SER 79 HA SER 79 -26.368 -10.710 6.629 291 HB2 SER 79 1HB SER 79 -26.970 -13.668 6.427 292 HB3 SER 79 2HB SER 79 -27.973 -12.336 5.849 293 HG SER 79 HG SER 79 -26.465 -11.903 4.274 294 H LEU 80 H LEU 80 -25.246 -11.109 9.245 295 HA LEU 80 HA LEU 80 -27.722 -11.660 10.737 296 HB2 LEU 80 1HB LEU 80 -24.968 -12.308 11.784 297 HB3 LEU 80 2HB LEU 80 -26.512 -12.715 12.507 298 HG LEU 80 HG LEU 80 -26.675 -13.962 10.064 299 HD11 LEU 80 1HD1 LEU 80 -24.688 -14.866 9.405 300 HD12 LEU 80 2HD1 LEU 80 -23.966 -14.737 11.009 301 HD13 LEU 80 3HD1 LEU 80 -24.122 -13.303 9.993 302 HD21 LEU 80 3HD2 LEU 80 -25.537 -15.247 12.534 303 HD22 LEU 80 1HD2 LEU 80 -26.558 -15.975 11.294 304 HD23 LEU 80 2HD2 LEU 80 -27.229 -14.770 12.393 305 H ASN 81 H ASN 81 -26.667 -9.134 9.756 306 HA ASN 81 HA ASN 81 -26.032 -7.800 12.303 307 HB2 ASN 81 1HB ASN 81 -24.246 -7.659 10.580 308 HB3 ASN 81 2HB ASN 81 -25.380 -6.857 9.501 309 HD21 ASN 81 2HD2 ASN 81 -23.342 -5.403 9.745 310 HD22 ASN 81 1HD2 ASN 81 -23.497 -4.130 10.916 311 H THR 82 H THR 82 -27.465 -6.939 9.132 312 HA THR 82 HA THR 82 -29.756 -5.807 10.564 313 HB THR 82 HB THR 82 -29.703 -3.757 9.271 314 HG1 THR 82 HG1 THR 82 -27.222 -4.543 8.166 315 HG21 THR 82 3HG2 THR 82 -28.485 -3.460 11.238 316 HG22 THR 82 1HG2 THR 82 -27.455 -2.816 9.961 317 HG23 THR 82 2HG2 THR 82 -27.123 -4.408 10.641 318 H ASN 83 H ASN 83 -28.545 -6.144 7.211 319 HA ASN 83 HA ASN 83 -30.679 -7.925 6.508 320 HB2 ASN 83 1HB ASN 83 -31.678 -5.553 6.488 321 HB3 ASN 83 2HB ASN 83 -30.678 -5.278 5.064 322 HD21 ASN 83 2HD2 ASN 83 -33.677 -6.082 6.038 323 HD22 ASN 83 1HD2 ASN 83 -34.212 -6.985 4.655 324 H SER 84 H SER 84 -28.616 -9.045 6.111 325 HA SER 84 HA SER 84 -27.053 -9.944 4.737 326 HB2 SER 84 1HB SER 84 -28.393 -8.486 2.456 327 HB3 SER 84 2HB SER 84 -27.484 -9.995 2.394 328 HG SER 84 HG SER 84 -30.022 -9.832 2.565 329 H SER 85 H SER 85 -25.232 -8.919 5.493 330 HA SER 85 HA SER 85 -24.295 -6.651 3.871 331 HB2 SER 85 1HB SER 85 -23.923 -7.016 6.854 332 HB3 SER 85 2HB SER 85 -23.166 -5.748 5.889 333 HG SER 85 HG SER 85 -25.300 -5.037 5.350 334 H PHE 86 H PHE 86 -22.801 -7.554 2.596 335 HA PHE 86 HA PHE 86 -21.124 -9.720 3.409 336 HB2 PHE 86 1HB PHE 86 -21.711 -8.311 0.964 337 HB3 PHE 86 2HB PHE 86 -19.969 -8.468 1.156 338 HD1 PHE 86 HD1 PHE 86 -19.033 -10.801 1.611 339 HD2 PHE 86 HD2 PHE 86 -22.984 -10.092 0.195 340 HE1 PHE 86 HE1 PHE 86 -19.149 -13.116 0.784 341 HE2 PHE 86 HE2 PHE 86 -23.107 -12.405 -0.631 342 HZ PHE 86 HZ PHE 86 -21.188 -13.920 -0.338 343 H ASN 87 H ASN 87 -18.793 -9.679 3.547 344 HA ASN 87 HA ASN 87 -17.618 -7.067 4.177 345 HB2 ASN 87 1HB ASN 87 -17.887 -9.420 5.983 346 HB3 ASN 87 2HB ASN 87 -16.357 -8.552 6.026 347 HD21 ASN 87 2HD2 ASN 87 -18.807 -8.841 7.851 348 HD22 ASN 87 1HD2 ASN 87 -19.143 -7.204 8.322 349 H VAL 88 H VAL 88 -16.652 -7.301 2.083 350 HA VAL 88 HA VAL 88 -14.647 -9.424 1.819 351 HB VAL 88 HB VAL 88 -16.096 -9.112 -0.106 352 HG11 VAL 88 1HG1 VAL 88 -16.655 -6.766 0.156 353 HG12 VAL 88 2HG1 VAL 88 -16.002 -7.058 -1.454 354 HG13 VAL 88 3HG1 VAL 88 -14.994 -6.306 -0.219 355 HG21 VAL 88 3HG2 VAL 88 -13.443 -9.473 -0.197 356 HG22 VAL 88 1HG2 VAL 88 -13.571 -8.011 -1.174 357 HG23 VAL 88 2HG2 VAL 88 -14.464 -9.461 -1.632 358 H LEU 89 H LEU 89 -12.503 -9.069 1.781 359 HA LEU 89 HA LEU 89 -11.522 -6.302 1.855 360 HB2 LEU 89 1HB LEU 89 -10.286 -8.314 3.689 361 HB3 LEU 89 2HB LEU 89 -10.257 -6.566 3.776 362 HG LEU 89 HG LEU 89 -12.754 -8.172 4.297 363 HD11 LEU 89 1HD1 LEU 89 -11.671 -8.936 6.110 364 HD12 LEU 89 2HD1 LEU 89 -11.951 -7.314 6.740 365 HD13 LEU 89 3HD1 LEU 89 -10.404 -7.716 5.997 366 HD21 LEU 89 3HD2 LEU 89 -12.458 -5.652 5.666 367 HD22 LEU 89 1HD2 LEU 89 -13.742 -6.203 4.593 368 HD23 LEU 89 2HD2 LEU 89 -12.297 -5.448 3.923 369 H TYR 90 H TYR 90 -8.975 -6.414 1.930 370 HA TYR 90 HA TYR 90 -8.071 -8.440 -0.010 371 HB2 TYR 90 1HB TYR 90 -8.010 -5.497 -0.165 372 HB3 TYR 90 2HB TYR 90 -6.490 -6.288 -0.574 373 HD1 TYR 90 HD1 TYR 90 -7.476 -8.765 -1.848 374 HD2 TYR 90 HD2 TYR 90 -8.822 -4.749 -2.224 375 HE1 TYR 90 HE1 TYR 90 -8.329 -9.269 -4.085 376 HE2 TYR 90 HE2 TYR 90 -9.682 -5.242 -4.471 377 HH TYR 90 HH TYR 90 -10.123 -8.324 -5.642 378 H LYS 91 H LYS 91 -6.614 -9.688 0.985 379 HA LYS 91 HA LYS 91 -5.150 -8.845 3.290 380 HB2 LYS 91 1HB LYS 91 -4.524 -11.252 1.573 381 HB3 LYS 91 2HB LYS 91 -4.150 -11.016 3.275 382 HG2 LYS 91 1HG LYS 91 -6.799 -10.828 3.429 383 HG3 LYS 91 2HG LYS 91 -6.684 -11.825 1.977 384 HD2 LYS 91 1HD LYS 91 -4.903 -13.073 3.598 385 HD3 LYS 91 2HD LYS 91 -6.073 -12.480 4.780 386 HE2 LYS 91 1HE LYS 91 -7.700 -13.874 4.064 387 HE3 LYS 91 2HE LYS 91 -7.220 -13.736 2.374 388 HZ1 LYS 91 3HZ LYS 91 -6.890 -15.955 3.675 389 HZ2 LYS 91 1HZ LYS 91 -5.472 -15.208 4.216 390 HZ3 LYS 91 2HZ LYS 91 -5.731 -15.438 2.560 391 H VAL 92 H VAL 92 -3.787 -7.162 2.917 392 HA VAL 92 HA VAL 92 -1.822 -7.471 0.745 393 HB VAL 92 HB VAL 92 -1.500 -5.067 0.794 394 HG11 VAL 92 1HG1 VAL 92 -4.162 -6.250 0.333 395 HG12 VAL 92 2HG1 VAL 92 -3.097 -5.375 -0.764 396 HG13 VAL 92 3HG1 VAL 92 -4.089 -4.490 0.392 397 HG21 VAL 92 3HG2 VAL 92 -1.835 -4.544 3.102 398 HG22 VAL 92 1HG2 VAL 92 -3.510 -5.098 3.043 399 HG23 VAL 92 2HG2 VAL 92 -3.030 -3.643 2.169 400 H LEU 93 H LEU 93 0.358 -6.924 1.102 401 HA LEU 93 HA LEU 93 1.228 -7.326 3.873 402 HB2 LEU 93 1HB LEU 93 2.532 -7.747 1.202 403 HB3 LEU 93 2HB LEU 93 3.512 -7.589 2.648 404 HG LEU 93 HG LEU 93 1.347 -9.667 2.304 405 HD11 LEU 93 1HD1 LEU 93 4.283 -9.737 1.711 406 HD12 LEU 93 2HD1 LEU 93 2.934 -10.297 0.723 407 HD13 LEU 93 3HD1 LEU 93 3.406 -11.198 2.164 408 HD21 LEU 93 3HD2 LEU 93 3.604 -9.580 4.295 409 HD22 LEU 93 1HD2 LEU 93 2.210 -10.660 4.277 410 HD23 LEU 93 2HD2 LEU 93 1.994 -8.946 4.632 411 H PHE 94 H PHE 94 2.262 -5.774 4.980 412 HA PHE 94 HA PHE 94 2.521 -3.152 3.708 413 HB2 PHE 94 1HB PHE 94 2.167 -4.157 6.472 414 HB3 PHE 94 2HB PHE 94 3.130 -2.696 6.306 415 HD1 PHE 94 HD2 PHE 94 -0.065 -4.065 4.905 416 HD2 PHE 94 HD1 PHE 94 2.000 -0.739 6.583 417 HE1 PHE 94 HE2 PHE 94 -2.124 -2.725 4.782 418 HE2 PHE 94 HE1 PHE 94 -0.057 0.600 6.466 419 HZ PHE 94 HZ PHE 94 -2.122 -0.390 5.564 420 H PHE 95 H PHE 95 4.396 -1.790 4.194 421 HA PHE 95 HA PHE 95 6.886 -3.258 4.721 422 HB2 PHE 95 1HB PHE 95 6.523 -1.354 2.391 423 HB3 PHE 95 2HB PHE 95 7.977 -2.257 2.792 424 HD1 PHE 95 HD2 PHE 95 7.775 -4.834 2.792 425 HD2 PHE 95 HD1 PHE 95 4.999 -2.233 0.879 426 HE1 PHE 95 HE2 PHE 95 7.020 -6.692 1.368 427 HE2 PHE 95 HE1 PHE 95 4.239 -4.088 -0.547 428 HZ PHE 95 HZ PHE 95 5.250 -6.321 -0.304 429 HA PRO 96 HA PRO 96 9.129 -2.398 4.191 430 HB2 PRO 96 1HB PRO 96 10.940 -1.854 6.371 431 HB3 PRO 96 2HB PRO 96 11.121 -1.451 4.662 432 HG2 PRO 96 1HG PRO 96 10.746 0.399 6.645 433 HG3 PRO 96 2HG PRO 96 10.303 0.656 4.949 434 HD2 PRO 96 1HD PRO 96 8.574 -0.076 7.275 435 HD3 PRO 96 2HD PRO 96 8.230 1.009 5.912 436 H ASP 97 H ASP 97 8.598 -2.105 7.694 437 HA ASP 97 HA ASP 97 9.414 -4.634 8.499 438 HB2 ASP 97 1HB ASP 97 7.581 -4.325 10.326 439 HB3 ASP 97 2HB ASP 97 8.930 -3.203 10.284 440 H PHE 98 H PHE 98 8.857 -6.375 7.380 441 HA PHE 98 HA PHE 98 6.738 -6.978 5.855 442 HB2 PHE 98 1HB PHE 98 8.439 -8.718 7.605 443 HB3 PHE 98 2HB PHE 98 7.118 -9.422 6.678 444 HD1 PHE 98 HD2 PHE 98 7.144 -9.302 4.214 445 HD2 PHE 98 HD1 PHE 98 10.454 -8.035 6.567 446 HE1 PHE 98 HE2 PHE 98 8.592 -9.424 2.233 447 HE2 PHE 98 HE1 PHE 98 11.910 -8.153 4.589 448 HZ PHE 98 HZ PHE 98 10.982 -8.852 2.419 449 H ASN 99 H ASN 99 4.881 -6.072 6.630 450 HA ASN 99 HA ASN 99 3.503 -7.587 8.749 451 HB2 ASN 99 1HB ASN 99 4.015 -4.731 8.560 452 HB3 ASN 99 2HB ASN 99 2.289 -5.062 8.648 453 HD21 ASN 99 2HD2 ASN 99 5.315 -5.151 10.313 454 HD22 ASN 99 1HD2 ASN 99 4.678 -5.570 11.873 455 H PHE 100 H PHE 100 0.964 -6.639 8.489 456 HA PHE 100 HA PHE 100 0.155 -6.495 5.744 457 HB2 PHE 100 1HB PHE 100 -1.349 -8.685 6.274 458 HB3 PHE 100 2HB PHE 100 0.181 -8.735 5.406 459 HD1 PHE 100 HD1 PHE 100 -1.523 -9.475 8.543 460 HD2 PHE 100 HD2 PHE 100 2.181 -9.580 6.458 461 HE1 PHE 100 HE1 PHE 100 -0.608 -10.970 10.256 462 HE2 PHE 100 HE2 PHE 100 3.106 -11.088 8.166 463 HZ PHE 100 HZ PHE 100 1.713 -11.785 10.072 464 H ALA 101 H ALA 101 -2.349 -6.840 5.633 465 HA ALA 101 HA ALA 101 -3.865 -6.268 7.975 466 HB1 ALA 101 3HB ALA 101 -4.511 -3.942 6.671 467 HB2 ALA 101 1HB ALA 101 -2.762 -4.030 6.453 468 HB3 ALA 101 2HB ALA 101 -3.451 -4.067 8.075 469 H TRP 102 H TRP 102 -6.128 -6.187 7.571 470 HA TRP 102 HA TRP 102 -6.892 -7.010 4.844 471 HB2 TRP 102 1HB TRP 102 -8.350 -7.808 7.368 472 HB3 TRP 102 2HB TRP 102 -8.552 -8.469 5.750 473 HD1 TRP 102 HD1 TRP 102 -5.353 -8.897 5.222 474 HE1 TRP 102 HE1 TRP 102 -4.199 -10.880 6.384 475 HE3 TRP 102 HE3 TRP 102 -8.720 -9.706 8.986 476 HZ2 TRP 102 HZ2 TRP 102 -4.657 -12.569 8.599 477 HZ3 TRP 102 HZ3 TRP 102 -8.285 -11.527 10.584 478 HH2 TRP 102 HH2 TRP 102 -6.295 -12.927 10.392 479 H VAL 103 H VAL 103 -7.803 -5.285 3.905 480 HA VAL 103 HA VAL 103 -10.021 -3.959 5.307 481 HB VAL 103 HB VAL 103 -9.347 -1.776 4.380 482 HG11 VAL 103 1HG1 VAL 103 -8.767 -2.265 6.659 483 HG12 VAL 103 2HG1 VAL 103 -7.437 -1.383 5.909 484 HG13 VAL 103 3HG1 VAL 103 -7.316 -3.125 6.149 485 HG21 VAL 103 3HG2 VAL 103 -6.593 -2.743 3.837 486 HG22 VAL 103 1HG2 VAL 103 -7.493 -1.410 3.112 487 HG23 VAL 103 2HG2 VAL 103 -7.826 -3.069 2.619 488 H LYS 104 H LYS 104 -11.472 -2.757 3.813 489 HA LYS 104 HA LYS 104 -12.100 -4.377 1.540 490 HB2 LYS 104 1HB LYS 104 -13.298 -1.705 2.292 491 HB3 LYS 104 2HB LYS 104 -14.003 -2.917 1.233 492 HG2 LYS 104 1HG LYS 104 -13.933 -4.454 3.293 493 HG3 LYS 104 2HG LYS 104 -13.706 -2.963 4.209 494 HD2 LYS 104 1HD LYS 104 -16.025 -3.337 4.223 495 HD3 LYS 104 2HD LYS 104 -15.774 -2.099 2.991 496 HE2 LYS 104 1HE LYS 104 -15.729 -4.942 2.130 497 HE3 LYS 104 2HE LYS 104 -17.288 -4.246 2.566 498 HZ1 LYS 104 3HZ LYS 104 -15.660 -3.782 0.241 499 HZ2 LYS 104 1HZ LYS 104 -16.204 -2.352 0.961 500 HZ3 LYS 104 2HZ LYS 104 -17.315 -3.526 0.468 501 H ARG 105 H ARG 105 -12.496 -3.461 -0.642 502 HA ARG 105 HA ARG 105 -10.182 -2.337 -1.748 503 HB2 ARG 105 1HB ARG 105 -12.972 -2.425 -2.905 504 HB3 ARG 105 2HB ARG 105 -11.508 -2.076 -3.815 505 HG2 ARG 105 1HG ARG 105 -11.379 -4.245 -4.245 506 HG3 ARG 105 2HG ARG 105 -10.962 -4.480 -2.547 507 HD2 ARG 105 1HD ARG 105 -12.796 -5.935 -3.185 508 HD3 ARG 105 2HD ARG 105 -13.335 -4.743 -2.005 509 HE ARG 105 HE ARG 105 -13.964 -3.590 -4.369 510 HH11 ARG 105 1HH1 ARG 105 -14.616 -6.758 -3.032 511 HH12 ARG 105 2HH1 ARG 105 -16.127 -6.932 -3.858 512 HH21 ARG 105 1HH2 ARG 105 -15.963 -3.822 -5.454 513 HH22 ARG 105 2HH2 ARG 105 -16.891 -5.267 -5.232 514 H ASN 106 H ASN 106 -13.013 -0.827 -0.400 515 HA ASN 106 HA ASN 106 -12.934 1.680 -1.625 516 HB2 ASN 106 1HB ASN 106 -13.734 1.015 1.216 517 HB3 ASN 106 2HB ASN 106 -14.122 2.507 0.371 518 HD21 ASN 106 2HD2 ASN 106 -15.695 0.136 1.501 519 HD22 ASN 106 1HD2 ASN 106 -16.791 -0.262 0.214 520 H SER 107 H SER 107 -11.123 0.437 1.158 521 HA SER 107 HA SER 107 -9.787 3.002 1.508 522 HB2 SER 107 1HB SER 107 -8.603 1.702 3.386 523 HB3 SER 107 2HB SER 107 -10.330 2.002 3.576 524 HG SER 107 HG SER 107 -9.232 -0.400 2.525 525 H VAL 108 H VAL 108 -9.410 0.898 -0.795 526 HA VAL 108 HA VAL 108 -6.469 0.911 -0.695 527 HB VAL 108 HB VAL 108 -8.246 -1.173 -1.966 528 HG11 VAL 108 1HG1 VAL 108 -6.213 -0.845 -3.255 529 HG12 VAL 108 2HG1 VAL 108 -6.159 -2.390 -2.410 530 HG13 VAL 108 3HG1 VAL 108 -5.238 -1.017 -1.795 531 HG21 VAL 108 3HG2 VAL 108 -6.325 -1.899 0.158 532 HG22 VAL 108 1HG2 VAL 108 -7.939 -2.527 -0.179 533 HG23 VAL 108 2HG2 VAL 108 -7.749 -0.991 0.664 534 H LYS 109 H LYS 109 -5.376 1.296 -2.676 535 HA LYS 109 HA LYS 109 -6.982 2.065 -4.993 536 HB2 LYS 109 1HB LYS 109 -4.981 3.913 -3.682 537 HB3 LYS 109 2HB LYS 109 -5.771 4.208 -5.224 538 HG2 LYS 109 1HG LYS 109 -7.964 4.112 -4.006 539 HG3 LYS 109 2HG LYS 109 -7.040 4.088 -2.504 540 HD2 LYS 109 1HD LYS 109 -7.426 6.340 -2.712 541 HD3 LYS 109 2HD LYS 109 -5.886 6.204 -3.561 542 HE2 LYS 109 1HE LYS 109 -6.792 6.852 -5.493 543 HE3 LYS 109 2HE LYS 109 -8.131 5.717 -5.326 544 HZ1 LYS 109 3HZ LYS 109 -9.425 7.271 -4.244 545 HZ2 LYS 109 1HZ LYS 109 -8.608 8.236 -5.370 546 HZ3 LYS 109 2HZ LYS 109 -8.108 8.212 -3.755 547 HA PRO 110 HA PRO 110 -3.733 0.296 -7.382 548 HB2 PRO 110 1HB PRO 110 -3.819 2.540 -9.284 549 HB3 PRO 110 2HB PRO 110 -4.228 0.841 -9.535 550 HG2 PRO 110 1HG PRO 110 -6.115 2.754 -9.456 551 HG3 PRO 110 2HG PRO 110 -6.406 1.120 -8.829 552 HD2 PRO 110 1HD PRO 110 -5.779 3.640 -7.337 553 HD3 PRO 110 2HD PRO 110 -6.939 2.354 -6.941 554 H LEU 111 H LEU 111 -1.636 0.279 -6.919 555 HA LEU 111 HA LEU 111 -0.228 2.838 -6.566 556 HB2 LEU 111 1HB LEU 111 -0.407 0.664 -4.874 557 HB3 LEU 111 2HB LEU 111 1.149 0.428 -5.645 558 HG LEU 111 HG LEU 111 0.302 2.915 -4.156 559 HD11 LEU 111 1HD1 LEU 111 2.154 0.667 -3.378 560 HD12 LEU 111 2HD1 LEU 111 0.602 1.058 -2.637 561 HD13 LEU 111 3HD1 LEU 111 1.957 2.176 -2.489 562 HD21 LEU 111 3HD2 LEU 111 2.971 2.132 -5.315 563 HD22 LEU 111 1HD2 LEU 111 2.626 3.589 -4.383 564 HD23 LEU 111 2HD2 LEU 111 1.888 3.358 -5.967 565 H LEU 112 H LEU 112 1.427 3.364 -7.896 566 HA LEU 112 HA LEU 112 2.495 1.257 -9.660 567 HB2 LEU 112 1HB LEU 112 2.662 2.936 -11.457 568 HB3 LEU 112 2HB LEU 112 1.010 2.616 -10.972 569 HG LEU 112 HG LEU 112 2.364 4.927 -9.689 570 HD11 LEU 112 1HD1 LEU 112 3.018 5.055 -12.082 571 HD12 LEU 112 2HD1 LEU 112 1.991 6.387 -11.551 572 HD13 LEU 112 3HD1 LEU 112 1.305 5.071 -12.504 573 HD21 LEU 112 3HD2 LEU 112 0.224 5.776 -9.512 574 HD22 LEU 112 1HD2 LEU 112 -0.061 4.042 -9.379 575 HD23 LEU 112 2HD2 LEU 112 -0.367 4.871 -10.904 576 H ASP 113 H ASP 113 4.607 1.921 -10.695 577 HA ASP 113 HA ASP 113 6.485 2.555 -8.662 578 HB2 ASP 113 1HB ASP 113 6.940 2.376 -11.647 579 HB3 ASP 113 2HB ASP 113 8.181 2.315 -10.400 580 H SER 114 H SER 114 5.186 4.362 -11.419 581 HA SER 114 HA SER 114 6.921 6.562 -11.290 582 HB2 SER 114 1HB SER 114 5.022 5.909 -13.025 583 HB3 SER 114 2HB SER 114 4.059 7.002 -12.029 584 HG SER 114 HG SER 114 5.454 8.654 -12.498 585 H GLU 115 H GLU 115 4.149 5.714 -9.327 586 HA GLU 115 HA GLU 115 3.984 8.348 -8.130 587 HB2 GLU 115 1HB GLU 115 1.950 7.663 -7.458 588 HB3 GLU 115 2HB GLU 115 2.230 6.208 -8.398 589 HG2 GLU 115 1HG GLU 115 3.006 5.029 -6.477 590 HG3 GLU 115 2HG GLU 115 2.977 6.495 -5.501 591 H ILE 116 H ILE 116 4.981 5.093 -7.166 592 HA ILE 116 HA ILE 116 5.804 5.644 -4.560 593 HB ILE 116 HB ILE 116 6.975 3.609 -6.469 594 HG12 ILE 116 1HG1 ILE 116 5.044 3.006 -4.248 595 HG13 ILE 116 2HG1 ILE 116 4.449 3.564 -5.807 596 HG21 ILE 116 1HG2 ILE 116 8.559 3.765 -4.786 597 HG22 ILE 116 2HG2 ILE 116 7.521 2.459 -4.220 598 HG23 ILE 116 3HG2 ILE 116 7.353 4.075 -3.540 599 HD11 ILE 116 3HD1 ILE 116 5.361 0.950 -5.013 600 HD12 ILE 116 1HD1 ILE 116 6.229 1.529 -6.435 601 HD13 ILE 116 2HD1 ILE 116 4.467 1.447 -6.449 602 H ALA 117 H ALA 117 7.768 5.510 -7.539 603 HA ALA 117 HA ALA 117 10.206 6.334 -6.476 604 HB1 ALA 117 3HB ALA 117 9.469 5.590 -8.919 605 HB2 ALA 117 1HB ALA 117 10.930 6.539 -8.637 606 HB3 ALA 117 2HB ALA 117 9.450 7.334 -9.173 607 H LYS 118 H LYS 118 7.448 8.213 -7.627 608 HA LYS 118 HA LYS 118 8.649 10.761 -7.396 609 HB2 LYS 118 1HB LYS 118 6.242 9.793 -8.336 610 HB3 LYS 118 2HB LYS 118 5.774 10.738 -6.928 611 HG2 LYS 118 1HG LYS 118 5.981 12.579 -8.102 612 HG3 LYS 118 2HG LYS 118 7.698 12.223 -8.331 613 HD2 LYS 118 1HD LYS 118 7.187 10.905 -10.309 614 HD3 LYS 118 2HD LYS 118 5.457 11.164 -10.061 615 HE2 LYS 118 1HE LYS 118 5.889 12.781 -11.631 616 HE3 LYS 118 2HE LYS 118 6.160 13.701 -10.151 617 HZ1 LYS 118 3HZ LYS 118 8.421 12.303 -11.420 618 HZ2 LYS 118 1HZ LYS 118 8.424 13.691 -10.451 619 HZ3 LYS 118 2HZ LYS 118 7.896 13.780 -12.055 620 H PHE 119 H PHE 119 6.377 9.048 -5.244 621 HA PHE 119 HA PHE 119 6.226 10.918 -3.201 622 HB2 PHE 119 1HB PHE 119 4.823 8.982 -3.111 623 HB3 PHE 119 2HB PHE 119 6.206 7.897 -3.118 624 HD1 PHE 119 HD2 PHE 119 7.699 7.836 -1.072 625 HD2 PHE 119 HD1 PHE 119 3.890 9.739 -1.106 626 HE1 PHE 119 HE2 PHE 119 7.620 7.713 1.386 627 HE2 PHE 119 HE1 PHE 119 3.811 9.624 1.351 628 HZ PHE 119 HZ PHE 119 5.681 8.609 2.590 629 H LEU 120 H LEU 120 8.655 8.392 -3.692 630 HA LEU 120 HA LEU 120 10.179 9.042 -1.376 631 HB2 LEU 120 1HB LEU 120 10.894 7.526 -3.883 632 HB3 LEU 120 2HB LEU 120 11.938 7.659 -2.479 633 HG LEU 120 HG LEU 120 9.209 6.671 -1.945 634 HD11 LEU 120 1HD1 LEU 120 11.021 5.373 -3.880 635 HD12 LEU 120 2HD1 LEU 120 9.275 5.230 -3.683 636 HD13 LEU 120 3HD1 LEU 120 10.358 4.326 -2.627 637 HD21 LEU 120 3HD2 LEU 120 10.264 6.175 -0.061 638 HD22 LEU 120 1HD2 LEU 120 11.812 6.644 -0.758 639 HD23 LEU 120 2HD2 LEU 120 11.229 4.991 -0.940 640 H GLY 121 H GLY 121 10.179 10.110 -4.737 641 HA2 GLY 121 1HA GLY 121 12.668 11.570 -4.458 642 HA3 GLY 121 2HA GLY 121 11.621 11.539 -5.865 643 H SER 122 H SER 122 9.871 12.211 -3.017 644 HA SER 122 HA SER 122 9.223 14.825 -3.869 645 HB2 SER 122 1HB SER 122 7.814 13.159 -2.467 646 HB3 SER 122 2HB SER 122 8.711 13.791 -1.087 647 HG SER 122 HG SER 122 6.994 15.188 -2.852 648 H SER 123 H SER 123 9.272 16.652 -2.190 649 HA SER 123 HA SER 123 11.597 16.769 -0.488 650 HB2 SER 123 1HB SER 123 12.653 18.672 -1.694 651 HB3 SER 123 2HB SER 123 12.667 17.180 -2.634 652 HG SER 123 HG SER 123 11.371 19.560 -3.120 653 H LYS 124 H LYS 124 8.734 17.157 -0.123 654 HA LYS 124 HA LYS 124 8.792 19.944 0.838 655 HB2 LYS 124 1HB LYS 124 6.281 19.964 0.414 656 HB3 LYS 124 2HB LYS 124 7.320 20.054 -1.002 657 HG2 LYS 124 1HG LYS 124 6.730 17.311 -0.394 658 HG3 LYS 124 2HG LYS 124 5.238 18.248 -0.516 659 HD2 LYS 124 1HD LYS 124 6.420 19.210 -2.664 660 HD3 LYS 124 2HD LYS 124 7.321 17.691 -2.570 661 HE2 LYS 124 1HE LYS 124 5.185 16.464 -2.522 662 HE3 LYS 124 2HE LYS 124 4.321 17.992 -2.696 663 HZ1 LYS 124 3HZ LYS 124 6.373 17.329 -4.678 664 HZ2 LYS 124 1HZ LYS 124 4.934 18.201 -4.865 665 HZ3 LYS 124 2HZ LYS 124 4.893 16.513 -4.761 666 H ARG 125 H ARG 125 6.996 16.867 1.169 667 HA ARG 125 HA ARG 125 7.172 17.157 4.066 668 HB2 ARG 125 1HB ARG 125 4.929 17.963 3.410 669 HB3 ARG 125 2HB ARG 125 4.627 16.440 2.588 670 HG2 ARG 125 1HG ARG 125 3.583 15.989 4.546 671 HG3 ARG 125 2HG ARG 125 5.210 15.465 4.990 672 HD2 ARG 125 1HD ARG 125 5.581 17.812 5.860 673 HD3 ARG 125 2HD ARG 125 3.848 18.068 5.659 674 HE ARG 125 HE ARG 125 3.947 15.823 7.148 675 HH11 ARG 125 1HH1 ARG 125 5.464 18.964 7.516 676 HH12 ARG 125 2HH1 ARG 125 5.517 18.871 9.243 677 HH21 ARG 125 1HH2 ARG 125 4.020 15.713 9.427 678 HH22 ARG 125 2HH2 ARG 125 4.699 17.028 10.328 679 H LYS 126 H LYS 126 8.554 15.533 4.366 680 HA LYS 126 HA LYS 126 7.645 12.845 3.670 681 HB2 LYS 126 1HB LYS 126 9.799 12.175 2.851 682 HB3 LYS 126 2HB LYS 126 9.286 13.601 1.961 683 HG2 LYS 126 1HG LYS 126 10.815 14.988 3.097 684 HG3 LYS 126 2HG LYS 126 11.134 13.758 4.323 685 HD2 LYS 126 1HD LYS 126 12.989 13.521 2.995 686 HD3 LYS 126 2HD LYS 126 11.903 12.344 2.252 687 HE2 LYS 126 1HE LYS 126 11.209 14.151 0.643 688 HE3 LYS 126 2HE LYS 126 12.510 15.142 1.303 689 HZ1 LYS 126 3HZ LYS 126 12.795 12.537 -0.094 690 HZ2 LYS 126 1HZ LYS 126 14.071 13.351 0.664 691 HZ3 LYS 126 2HZ LYS 126 13.284 14.053 -0.660 692 H SER 127 H SER 127 8.444 11.172 5.007 693 HA SER 127 HA SER 127 9.811 12.053 7.458 694 HB2 SER 127 1HB SER 127 7.562 10.042 7.485 695 HB3 SER 127 2HB SER 127 8.289 10.881 8.854 696 HG SER 127 HG SER 127 7.413 12.843 7.917 697 H LYS 128 H LYS 128 11.043 10.409 8.536 698 HA LYS 128 HA LYS 128 12.501 8.715 6.879 699 HB2 LYS 128 1HB LYS 128 12.852 9.532 9.397 700 HB3 LYS 128 2HB LYS 128 12.201 7.935 9.740 701 HG2 LYS 128 1HG LYS 128 14.092 7.444 7.798 702 HG3 LYS 128 2HG LYS 128 14.829 8.712 8.780 703 HD2 LYS 128 1HD LYS 128 15.086 7.355 10.560 704 HD3 LYS 128 2HD LYS 128 13.530 6.561 10.308 705 HE2 LYS 128 1HE LYS 128 14.968 5.668 8.166 706 HE3 LYS 128 2HE LYS 128 16.216 5.797 9.403 707 HZ1 LYS 128 3HZ LYS 128 14.923 4.382 10.843 708 HZ2 LYS 128 1HZ LYS 128 15.157 3.605 9.358 709 HZ3 LYS 128 2HZ LYS 128 13.662 4.310 9.718 710 H GLU 129 H GLU 129 9.843 7.873 9.102 711 HA GLU 129 HA GLU 129 9.776 5.125 8.464 712 HB2 GLU 129 1HB GLU 129 7.491 5.166 9.446 713 HB3 GLU 129 2HB GLU 129 8.702 5.910 10.477 714 HG2 GLU 129 1HG GLU 129 7.957 8.119 9.794 715 HG3 GLU 129 2HG GLU 129 6.780 7.397 8.698 716 H LEU 130 H LEU 130 8.242 7.950 7.016 717 HA LEU 130 HA LEU 130 6.486 6.499 5.305 718 HB2 LEU 130 1HB LEU 130 7.316 9.319 5.635 719 HB3 LEU 130 2HB LEU 130 6.806 8.874 4.020 720 HG LEU 130 HG LEU 130 4.970 9.838 5.311 721 HD11 LEU 130 1HD1 LEU 130 3.451 7.685 5.180 722 HD12 LEU 130 2HD1 LEU 130 4.857 7.039 4.334 723 HD13 LEU 130 3HD1 LEU 130 4.053 8.488 3.730 724 HD21 LEU 130 3HD2 LEU 130 5.529 9.267 7.546 725 HD22 LEU 130 1HD2 LEU 130 5.503 7.542 7.184 726 HD23 LEU 130 2HD2 LEU 130 4.001 8.467 7.180 727 H ILE 131 H ILE 131 9.612 8.123 4.736 728 HA ILE 131 HA ILE 131 9.843 7.445 2.027 729 HB ILE 131 HB ILE 131 12.093 7.833 4.007 730 HG12 ILE 131 1HG1 ILE 131 11.220 9.937 2.076 731 HG13 ILE 131 2HG1 ILE 131 10.245 9.685 3.519 732 HG21 ILE 131 1HG2 ILE 131 13.509 7.468 2.331 733 HG22 ILE 131 2HG2 ILE 131 12.679 8.652 1.321 734 HG23 ILE 131 3HG2 ILE 131 12.142 6.971 1.331 735 HD11 ILE 131 3HD1 ILE 131 13.014 10.724 3.255 736 HD12 ILE 131 1HD1 ILE 131 12.563 9.867 4.729 737 HD13 ILE 131 2HD1 ILE 131 11.674 11.308 4.240 738 H GLU 132 H GLU 132 11.199 5.799 4.892 739 HA GLU 132 HA GLU 132 12.419 3.679 3.567 740 HB2 GLU 132 1HB GLU 132 11.776 4.348 6.268 741 HB3 GLU 132 2HB GLU 132 11.312 2.675 5.987 742 HG2 GLU 132 1HG GLU 132 13.933 3.340 4.907 743 HG3 GLU 132 2HG GLU 132 13.814 3.562 6.652 744 H ALA 133 H ALA 133 9.058 4.196 4.435 745 HA ALA 133 HA ALA 133 8.086 1.595 4.013 746 HB1 ALA 133 3HB ALA 133 6.001 2.500 4.251 747 HB2 ALA 133 1HB ALA 133 6.394 3.929 3.296 748 HB3 ALA 133 2HB ALA 133 6.966 3.793 4.959 749 H TYR 134 H TYR 134 8.087 4.397 1.835 750 HA TYR 134 HA TYR 134 7.171 2.894 -0.397 751 HB2 TYR 134 1HB TYR 134 8.238 5.651 -0.006 752 HB3 TYR 134 2HB TYR 134 8.201 4.989 -1.639 753 HD1 TYR 134 HD1 TYR 134 5.914 5.117 1.324 754 HD2 TYR 134 HD2 TYR 134 6.350 5.533 -2.882 755 HE1 TYR 134 HE1 TYR 134 3.534 5.705 1.144 756 HE2 TYR 134 HE2 TYR 134 3.970 6.122 -3.079 757 HH TYR 134 HH TYR 134 1.921 5.954 -1.914 758 H GLU 135 H GLU 135 10.320 3.539 0.961 759 HA GLU 135 HA GLU 135 11.858 2.827 -1.318 760 HB2 GLU 135 1HB GLU 135 12.414 3.039 1.619 761 HB3 GLU 135 2HB GLU 135 13.587 2.244 0.577 762 HG2 GLU 135 1HG GLU 135 13.318 4.423 -0.854 763 HG3 GLU 135 2HG GLU 135 12.760 5.096 0.676 764 H ALA 136 H ALA 136 10.288 1.032 1.259 765 HA ALA 136 HA ALA 136 11.554 -1.476 0.582 766 HB1 ALA 136 3HB ALA 136 9.271 -0.761 2.406 767 HB2 ALA 136 1HB ALA 136 10.913 -1.226 2.846 768 HB3 ALA 136 2HB ALA 136 9.818 -2.418 2.149 769 H SER 137 H SER 137 8.509 0.157 -0.121 770 HA SER 137 HA SER 137 7.362 -2.101 -1.490 771 HB2 SER 137 1HB SER 137 5.503 -0.602 -1.999 772 HB3 SER 137 2HB SER 137 5.945 -0.473 -0.297 773 HG SER 137 HG SER 137 5.744 1.484 -2.002 774 H LYS 138 H LYS 138 9.461 0.486 -2.355 775 HA LYS 138 HA LYS 138 8.855 0.947 -5.022 776 HB2 LYS 138 1HB LYS 138 10.523 2.218 -3.708 777 HB3 LYS 138 2HB LYS 138 11.608 0.838 -3.777 778 HG2 LYS 138 1HG LYS 138 12.362 2.331 -5.423 779 HG3 LYS 138 2HG LYS 138 11.514 1.053 -6.295 780 HD2 LYS 138 1HD LYS 138 9.464 2.622 -6.120 781 HD3 LYS 138 2HD LYS 138 10.653 3.874 -5.764 782 HE2 LYS 138 1HE LYS 138 10.441 2.184 -8.247 783 HE3 LYS 138 2HE LYS 138 10.218 3.927 -8.110 784 HZ1 LYS 138 3HZ LYS 138 12.640 3.925 -7.314 785 HZ2 LYS 138 1HZ LYS 138 12.350 3.697 -8.966 786 HZ3 LYS 138 2HZ LYS 138 12.728 2.374 -7.983 787 H THR 139 H THR 139 10.314 -1.872 -3.587 788 HA THR 139 HA THR 139 11.859 -3.127 -5.338 789 HB THR 139 HB THR 139 11.007 -4.211 -3.334 790 HG1 THR 139 HG1 THR 139 11.297 -6.134 -4.158 791 HG21 THR 139 3HG2 THR 139 8.876 -4.647 -2.886 792 HG22 THR 139 1HG2 THR 139 8.599 -5.337 -4.484 793 HG23 THR 139 2HG2 THR 139 8.484 -3.595 -4.245 794 HA PRO 140 HA PRO 140 9.559 -2.535 -9.236 795 HB2 PRO 140 1HB PRO 140 12.103 -3.774 -10.171 796 HB3 PRO 140 2HB PRO 140 11.250 -2.352 -10.781 797 HG2 PRO 140 1HG PRO 140 13.450 -2.070 -9.322 798 HG3 PRO 140 2HG PRO 140 12.072 -0.975 -9.099 799 HD2 PRO 140 1HD PRO 140 12.954 -3.280 -7.410 800 HD3 PRO 140 2HD PRO 140 12.301 -1.705 -6.916 801 HA PRO 141 HA PRO 141 10.510 -7.390 -10.155 802 HB2 PRO 141 1HB PRO 141 10.722 -7.926 -7.214 803 HB3 PRO 141 2HB PRO 141 11.422 -8.822 -8.572 804 HG2 PRO 141 1HG PRO 141 12.937 -7.177 -7.170 805 HG3 PRO 141 2HG PRO 141 13.069 -7.205 -8.940 806 HD2 PRO 141 1HD PRO 141 11.767 -5.194 -7.167 807 HD3 PRO 141 2HD PRO 141 12.634 -4.957 -8.696 808 H ASP 142 H ASP 142 8.758 -8.711 -10.337 809 HA ASP 142 HA ASP 142 6.349 -7.903 -8.887 810 HB2 ASP 142 1HB ASP 142 5.124 -9.190 -10.608 811 HB3 ASP 142 2HB ASP 142 6.154 -7.954 -11.313 812 H LEU 143 H LEU 143 6.157 -8.924 -6.987 813 HA LEU 143 HA LEU 143 5.815 -10.573 -5.465 814 HB2 LEU 143 1HB LEU 143 5.331 -11.980 -8.010 815 HB3 LEU 143 2HB LEU 143 5.774 -13.015 -6.666 816 HG LEU 143 HG LEU 143 3.667 -11.033 -6.068 817 HD11 LEU 143 1HD1 LEU 143 3.331 -13.150 -8.152 818 HD12 LEU 143 2HD1 LEU 143 2.771 -11.478 -8.155 819 HD13 LEU 143 3HD1 LEU 143 1.981 -12.670 -7.124 820 HD21 LEU 143 3HD2 LEU 143 3.009 -12.583 -4.552 821 HD22 LEU 143 1HD2 LEU 143 4.665 -13.150 -4.765 822 HD23 LEU 143 2HD2 LEU 143 3.345 -13.941 -5.626 823 H LYS 144 H LYS 144 7.027 -11.926 -4.163 824 HA LYS 144 HA LYS 144 9.593 -12.882 -5.193 825 HB2 LYS 144 1HB LYS 144 9.208 -10.954 -2.916 826 HB3 LYS 144 2HB LYS 144 10.635 -11.974 -3.021 827 HG2 LYS 144 1HG LYS 144 11.586 -10.603 -4.480 828 HG3 LYS 144 2HG LYS 144 10.170 -10.647 -5.530 829 HD2 LYS 144 1HD LYS 144 10.249 -8.951 -3.050 830 HD3 LYS 144 2HD LYS 144 10.891 -8.376 -4.589 831 HE2 LYS 144 1HE LYS 144 8.777 -7.613 -4.852 832 HE3 LYS 144 2HE LYS 144 8.500 -9.258 -5.416 833 HZ1 LYS 144 3HZ LYS 144 6.901 -8.320 -3.694 834 HZ2 LYS 144 1HZ LYS 144 8.149 -8.525 -2.571 835 HZ3 LYS 144 2HZ LYS 144 7.529 -9.862 -3.397 836 H GLU 145 H GLU 145 10.235 -14.781 -4.349 837 HA GLU 145 HA GLU 145 10.193 -16.744 -3.222 838 HB2 GLU 145 1HB GLU 145 9.883 -14.727 -1.222 839 HB3 GLU 145 2HB GLU 145 8.868 -16.093 -0.787 840 HG2 GLU 145 1HG GLU 145 10.650 -17.518 -0.529 841 HG3 GLU 145 2HG GLU 145 11.685 -16.594 -1.615 842 H GLU 146 H GLU 146 7.922 -15.940 -4.888 843 HA GLU 146 HA GLU 146 6.071 -17.997 -4.042 844 HB2 GLU 146 1HB GLU 146 5.490 -15.431 -3.259 845 HB3 GLU 146 2HB GLU 146 4.637 -15.541 -4.792 846 HG2 GLU 146 1HG GLU 146 2.977 -16.425 -3.608 847 HG3 GLU 146 2HG GLU 146 3.952 -17.893 -3.582 848 H SER 147 H SER 147 5.279 -19.068 -5.778 849 HA SER 147 HA SER 147 6.192 -18.377 -8.386 850 HB2 SER 147 1HB SER 147 4.253 -20.490 -7.429 851 HB3 SER 147 2HB SER 147 4.774 -20.332 -9.107 852 HG SER 147 HG SER 147 5.983 -21.664 -7.239 853 H SER 148 H SER 148 2.800 -19.029 -7.476 854 HA SER 148 HA SER 148 1.749 -16.537 -8.191 855 HB2 SER 148 1HB SER 148 2.586 -17.747 -10.469 856 HB3 SER 148 2HB SER 148 0.942 -18.380 -10.367 857 HG SER 148 HG SER 148 0.517 -16.523 -11.299 858 H THR 149 H THR 149 -0.220 -16.419 -7.299 859 HA THR 149 HA THR 149 -1.481 -18.887 -6.402 860 HB THR 149 HB THR 149 -2.643 -16.208 -5.790 861 HG1 THR 149 HG1 THR 149 -0.738 -15.574 -5.146 862 HG21 THR 149 3HG2 THR 149 -2.607 -18.873 -4.597 863 HG22 THR 149 1HG2 THR 149 -3.809 -17.588 -4.488 864 HG23 THR 149 2HG2 THR 149 -2.385 -17.551 -3.450 865 H ASP 150 H ASP 150 -2.277 -19.654 -8.398 866 HA ASP 150 HA ASP 150 -4.836 -18.479 -9.135 867 HB2 ASP 150 1HB ASP 150 -2.732 -17.723 -10.639 868 HB3 ASP 150 2HB ASP 150 -3.144 -19.225 -11.457 869 H LEU 151 H LEU 151 -6.188 -20.134 -8.886 870 HA LEU 151 HA LEU 151 -5.548 -22.684 -10.176 871 HB2 LEU 151 1HB LEU 151 -6.629 -23.821 -8.135 872 HB3 LEU 151 2HB LEU 151 -4.962 -23.292 -8.015 873 HG LEU 151 HG LEU 151 -5.905 -21.166 -6.913 874 HD11 LEU 151 1HD1 LEU 151 -8.052 -21.516 -5.744 875 HD12 LEU 151 2HD1 LEU 151 -8.290 -22.994 -6.675 876 HD13 LEU 151 3HD1 LEU 151 -8.224 -21.435 -7.496 877 HD21 LEU 151 3HD2 LEU 151 -6.485 -23.382 -5.080 878 HD22 LEU 151 1HD2 LEU 151 -5.313 -22.070 -4.948 879 HD23 LEU 151 2HD2 LEU 151 -4.933 -23.498 -5.909 880 H GLU 152 H GLU 152 -7.544 -24.156 -10.165 881 HA GLU 152 HA GLU 152 -9.777 -22.588 -11.159 882 HB2 GLU 152 1HB GLU 152 -8.714 -25.229 -11.629 883 HB3 GLU 152 2HB GLU 152 -10.432 -25.321 -11.272 884 HG2 GLU 152 1HG GLU 152 -11.031 -24.255 -13.175 885 HG3 GLU 152 2HG GLU 152 -9.581 -23.257 -13.209
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