NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
21372 | 2hi6 | 7228 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H VAL 1 H VAL 1 4.737 14.803 -11.570 2 HA VAL 1 HA VAL 1 6.165 16.375 -9.580 3 HB VAL 1 HB VAL 1 3.480 15.018 -9.292 4 1HG1 VAL 1 1HG1 VAL 1 4.746 17.270 -7.727 5 2HG1 VAL 1 2HG1 VAL 1 4.581 15.600 -7.177 6 3HG1 VAL 1 3HG1 VAL 1 3.143 16.585 -7.455 7 1HG2 VAL 1 1HG2 VAL 1 3.399 16.604 -11.137 8 2HG2 VAL 1 2HG2 VAL 1 4.079 17.861 -10.105 9 3HG2 VAL 1 3HG2 VAL 1 2.480 17.201 -9.756 10 H LYS 2 H LYS 2 7.131 15.552 -7.821 11 HA LYS 2 HA LYS 2 6.861 12.681 -7.296 12 1HB LYS 2 1HB LYS 2 9.334 12.685 -6.750 13 2HB LYS 2 2HB LYS 2 8.934 12.838 -8.454 14 1HG LYS 2 1HG LYS 2 9.204 15.337 -8.155 15 2HG LYS 2 2HG LYS 2 9.917 14.972 -6.582 16 1HD LYS 2 1HD LYS 2 11.596 13.559 -7.709 17 2HD LYS 2 2HD LYS 2 10.897 14.008 -9.266 18 1HE LYS 2 1HE LYS 2 11.356 16.406 -8.662 19 2HE LYS 2 2HE LYS 2 12.269 15.806 -7.278 20 1HZ LYS 2 1HZ LYS 2 13.627 14.513 -8.912 21 2HZ LYS 2 2HZ LYS 2 13.801 16.196 -9.020 22 3HZ LYS 2 3HZ LYS 2 12.848 15.371 -10.153 23 H PHE 3 H PHE 3 6.041 12.464 -5.323 24 HA PHE 3 HA PHE 3 6.306 14.684 -3.441 25 1HB PHE 3 1HB PHE 3 4.534 12.237 -3.377 26 2HB PHE 3 2HB PHE 3 4.553 13.480 -2.136 27 HD1 PHE 3 HD1 PHE 3 3.241 12.471 -5.310 28 HD2 PHE 3 HD2 PHE 3 3.874 15.825 -2.764 29 HE1 PHE 3 HE1 PHE 3 1.530 13.733 -6.551 30 HE2 PHE 3 HE2 PHE 3 2.168 17.091 -4.003 31 HZ PHE 3 HZ PHE 3 0.992 16.047 -5.897 32 H ALA 4 H ALA 4 6.933 14.398 -1.288 33 HA ALA 4 HA ALA 4 8.642 12.061 -0.796 34 1HB ALA 4 1HB ALA 4 8.527 14.725 0.623 35 2HB ALA 4 2HB ALA 4 9.748 14.220 -0.546 36 3HB ALA 4 3HB ALA 4 9.627 13.401 1.012 37 H CYS 5 H CYS 5 7.958 10.534 0.584 38 HA CYS 5 HA CYS 5 5.669 11.207 2.312 39 1HB CYS 5 1HB CYS 5 6.233 8.542 0.997 40 2HB CYS 5 2HB CYS 5 4.827 8.951 1.972 41 HG CYS 5 HG CYS 5 5.110 9.122 -1.223 42 H ARG 6 H ARG 6 5.416 9.436 4.066 43 HA ARG 6 HA ARG 6 7.965 9.311 5.471 44 1HB ARG 6 1HB ARG 6 6.061 10.262 6.643 45 2HB ARG 6 2HB ARG 6 5.120 8.806 6.363 46 1HG ARG 6 1HG ARG 6 6.575 7.549 7.824 47 2HG ARG 6 2HG ARG 6 7.622 8.958 8.030 48 1HD ARG 6 1HD ARG 6 5.819 10.182 9.087 49 2HD ARG 6 2HD ARG 6 4.706 8.846 8.801 50 HE ARG 6 HE ARG 6 6.440 7.580 10.278 51 1HH1 ARG 6 1HH1 ARG 6 5.377 10.894 10.666 52 2HH1 ARG 6 2HH1 ARG 6 5.550 10.893 12.391 53 1HH2 ARG 6 1HH2 ARG 6 6.713 7.578 12.561 54 2HH2 ARG 6 2HH2 ARG 6 6.346 9.019 13.464 55 H ALA 7 H ALA 7 9.138 7.552 5.274 56 HA ALA 7 HA ALA 7 7.912 5.165 4.131 57 1HB ALA 7 1HB ALA 7 10.171 4.464 3.608 58 2HB ALA 7 2HB ALA 7 10.828 5.807 4.543 59 3HB ALA 7 3HB ALA 7 9.915 6.123 3.067 60 H ILE 8 H ILE 8 7.757 3.237 5.108 61 HA ILE 8 HA ILE 8 8.775 3.044 7.860 62 HB ILE 8 HB ILE 8 6.695 1.323 6.486 63 1HG1 ILE 8 1HG1 ILE 8 5.260 2.371 8.391 64 2HG1 ILE 8 2HG1 ILE 8 6.505 3.613 8.431 65 1HG2 ILE 8 1HG2 ILE 8 7.913 0.020 8.092 66 2HG2 ILE 8 2HG2 ILE 8 6.329 0.409 8.762 67 3HG2 ILE 8 3HG2 ILE 8 7.753 1.292 9.304 68 1HD1 ILE 8 1HD1 ILE 8 6.066 4.088 6.059 69 2HD1 ILE 8 2HD1 ILE 8 4.648 4.331 7.079 70 3HD1 ILE 8 3HD1 ILE 8 4.777 2.884 6.078 71 H THR 9 H THR 9 8.414 1.105 4.902 72 HA THR 9 HA THR 9 10.794 -0.426 5.676 73 HB THR 9 HB THR 9 10.122 -1.994 3.850 74 HG1 THR 9 HG1 THR 9 7.981 -1.731 3.005 75 1HG2 THR 9 1HG2 THR 9 8.182 -2.947 5.026 76 2HG2 THR 9 2HG2 THR 9 8.011 -1.449 5.941 77 3HG2 THR 9 3HG2 THR 9 9.451 -2.448 6.146 78 H ARG 10 H ARG 10 12.031 -1.139 3.492 79 HA ARG 10 HA ARG 10 12.520 1.377 2.031 80 1HB ARG 10 1HB ARG 10 14.572 -0.609 3.020 81 2HB ARG 10 2HB ARG 10 14.926 0.783 2.002 82 1HG ARG 10 1HG ARG 10 14.089 2.266 3.777 83 2HG ARG 10 2HG ARG 10 13.798 0.855 4.795 84 1HD ARG 10 1HD ARG 10 16.190 0.318 4.711 85 2HD ARG 10 2HD ARG 10 16.470 1.751 3.719 86 HE ARG 10 HE ARG 10 15.258 2.059 6.369 87 1HH1 ARG 10 1HH1 ARG 10 17.978 2.550 4.220 88 2HH1 ARG 10 2HH1 ARG 10 18.746 3.714 5.264 89 1HH2 ARG 10 1HH2 ARG 10 16.278 3.532 7.766 90 2HH2 ARG 10 2HH2 ARG 10 17.776 4.277 7.283 91 H GLY 11 H GLY 11 14.287 0.626 0.165 92 1HA GLY 11 1HA GLY 11 14.583 -0.893 -1.658 93 2HA GLY 11 2HA GLY 11 13.025 -1.612 -1.267 94 H ARG 12 H ARG 12 13.373 -0.999 -3.848 95 HA ARG 12 HA ARG 12 11.598 1.299 -4.158 96 1HB ARG 12 1HB ARG 12 12.879 2.374 -5.840 97 2HB ARG 12 2HB ARG 12 13.971 2.070 -4.503 98 1HG ARG 12 1HG ARG 12 13.814 0.499 -7.068 99 2HG ARG 12 2HG ARG 12 15.053 1.673 -6.637 100 1HD ARG 12 1HD ARG 12 14.519 -0.981 -5.310 101 2HD ARG 12 2HD ARG 12 15.900 -0.561 -6.316 102 HE ARG 12 HE ARG 12 15.485 0.943 -3.833 103 1HH1 ARG 12 1HH1 ARG 12 17.331 -1.422 -5.665 104 2HH1 ARG 12 2HH1 ARG 12 18.622 -1.486 -4.499 105 1HH2 ARG 12 1HH2 ARG 12 17.154 0.796 -2.281 106 2HH2 ARG 12 2HH2 ARG 12 18.522 -0.240 -2.591 107 H ALA 13 H ALA 13 10.169 1.160 -5.844 108 HA ALA 13 HA ALA 13 10.264 -1.310 -7.431 109 1HB ALA 13 1HB ALA 13 8.913 -1.807 -5.481 110 2HB ALA 13 2HB ALA 13 7.911 -1.749 -6.931 111 3HB ALA 13 3HB ALA 13 7.902 -0.396 -5.802 112 H GLU 14 H GLU 14 9.257 -1.240 -9.403 113 HA GLU 14 HA GLU 14 8.108 1.346 -10.205 114 1HB GLU 14 1HB GLU 14 9.178 1.149 -12.371 115 2HB GLU 14 2HB GLU 14 10.399 1.055 -11.112 116 1HG GLU 14 1HG GLU 14 9.246 -1.320 -12.567 117 2HG GLU 14 2HG GLU 14 10.758 -0.523 -12.985 118 H GLY 15 H GLY 15 6.060 1.162 -10.918 119 1HA GLY 15 1HA GLY 15 5.293 -0.995 -12.640 120 2HA GLY 15 2HA GLY 15 4.622 -1.167 -11.025 121 H GLU 16 H GLU 16 2.830 -1.033 -12.885 122 HA GLU 16 HA GLU 16 1.975 1.638 -13.488 123 1HB GLU 16 1HB GLU 16 1.444 -0.290 -14.928 124 2HB GLU 16 2HB GLU 16 0.488 -0.991 -13.632 125 1HG GLU 16 1HG GLU 16 -1.022 0.936 -13.727 126 2HG GLU 16 2HG GLU 16 -0.077 1.591 -15.066 127 H ALA 17 H ALA 17 0.464 2.854 -12.451 128 HA ALA 17 HA ALA 17 0.042 2.222 -9.669 129 1HB ALA 17 1HB ALA 17 -0.919 4.470 -9.528 130 2HB ALA 17 2HB ALA 17 -0.829 4.616 -11.282 131 3HB ALA 17 3HB ALA 17 0.651 4.489 -10.333 132 H LEU 18 H LEU 18 -1.657 1.253 -8.871 133 HA LEU 18 HA LEU 18 -4.198 1.303 -10.366 134 1HB LEU 18 1HB LEU 18 -2.927 -0.925 -10.132 135 2HB LEU 18 2HB LEU 18 -3.332 -0.844 -8.431 136 HG LEU 18 HG LEU 18 -5.415 -0.852 -10.617 137 1HD1 LEU 18 1HD1 LEU 18 -5.695 -3.223 -10.151 138 2HD1 LEU 18 2HD1 LEU 18 -4.345 -3.172 -9.018 139 3HD1 LEU 18 3HD1 LEU 18 -4.065 -2.886 -10.736 140 1HD2 LEU 18 1HD2 LEU 18 -6.916 -1.542 -8.823 141 2HD2 LEU 18 2HD2 LEU 18 -6.166 0.010 -8.448 142 3HD2 LEU 18 3HD2 LEU 18 -5.588 -1.463 -7.666 143 H VAL 19 H VAL 19 -5.747 2.404 -9.345 144 HA VAL 19 HA VAL 19 -5.470 2.756 -6.439 145 HB VAL 19 HB VAL 19 -5.251 4.828 -7.805 146 1HG1 VAL 19 1HG1 VAL 19 -6.807 4.361 -9.594 147 2HG1 VAL 19 2HG1 VAL 19 -7.240 5.862 -8.774 148 3HG1 VAL 19 3HG1 VAL 19 -8.155 4.388 -8.457 149 1HG2 VAL 19 1HG2 VAL 19 -6.750 6.182 -6.437 150 2HG2 VAL 19 2HG2 VAL 19 -5.898 4.954 -5.502 151 3HG2 VAL 19 3HG2 VAL 19 -7.591 4.716 -5.932 152 H THR 20 H THR 20 -6.935 1.751 -5.221 153 HA THR 20 HA THR 20 -9.242 0.578 -6.559 154 HB THR 20 HB THR 20 -7.737 -0.857 -5.176 155 HG1 THR 20 HG1 THR 20 -9.836 -1.416 -3.721 156 1HG2 THR 20 1HG2 THR 20 -7.908 -0.733 -2.745 157 2HG2 THR 20 2HG2 THR 20 -8.939 0.692 -2.882 158 3HG2 THR 20 3HG2 THR 20 -7.258 0.763 -3.413 159 H LYS 21 H LYS 21 -8.545 3.234 -4.783 160 HA LYS 21 HA LYS 21 -9.788 4.966 -4.058 161 1HB LYS 21 1HB LYS 21 -11.170 4.806 -5.942 162 2HB LYS 21 2HB LYS 21 -11.900 3.305 -5.399 163 1HG LYS 21 1HG LYS 21 -13.028 4.585 -3.587 164 2HG LYS 21 2HG LYS 21 -12.397 6.067 -4.313 165 1HD LYS 21 1HD LYS 21 -13.608 5.670 -6.339 166 2HD LYS 21 2HD LYS 21 -14.082 4.058 -5.800 167 1HE LYS 21 1HE LYS 21 -15.410 5.032 -4.010 168 2HE LYS 21 2HE LYS 21 -14.913 6.650 -4.503 169 1HZ LYS 21 1HZ LYS 21 -16.008 6.288 -6.635 170 2HZ LYS 21 2HZ LYS 21 -17.101 6.115 -5.349 171 3HZ LYS 21 3HZ LYS 21 -16.496 4.740 -6.140 172 H GLU 22 H GLU 22 -11.680 2.021 -3.277 173 HA GLU 22 HA GLU 22 -12.828 3.239 -0.967 174 1HB GLU 22 1HB GLU 22 -12.855 0.426 -2.038 175 2HB GLU 22 2HB GLU 22 -13.664 0.868 -0.540 176 1HG GLU 22 1HG GLU 22 -14.223 2.099 -3.231 177 2HG GLU 22 2HG GLU 22 -15.176 0.819 -2.480 178 H TYR 23 H TYR 23 -12.784 2.244 1.193 179 HA TYR 23 HA TYR 23 -10.051 1.985 2.101 180 1HB TYR 23 1HB TYR 23 -12.663 1.944 3.629 181 2HB TYR 23 2HB TYR 23 -11.071 1.924 4.367 182 HD1 TYR 23 HD1 TYR 23 -9.665 3.942 4.336 183 HD2 TYR 23 HD2 TYR 23 -13.623 3.965 2.772 184 HE1 TYR 23 HE1 TYR 23 -9.693 6.399 4.451 185 HE2 TYR 23 HE2 TYR 23 -13.656 6.420 2.875 186 HH TYR 23 HH TYR 23 -10.817 8.280 3.535 187 H ILE 24 H ILE 24 -9.671 -0.107 1.007 188 HA ILE 24 HA ILE 24 -10.920 -2.346 2.446 189 HB ILE 24 HB ILE 24 -10.081 -3.808 0.639 190 1HG1 ILE 24 1HG1 ILE 24 -9.372 -1.235 -0.780 191 2HG1 ILE 24 2HG1 ILE 24 -8.199 -2.350 -0.088 192 1HG2 ILE 24 1HG2 ILE 24 -12.360 -2.976 0.573 193 2HG2 ILE 24 2HG2 ILE 24 -11.702 -3.092 -1.059 194 3HG2 ILE 24 3HG2 ILE 24 -11.823 -1.520 -0.267 195 1HD1 ILE 24 1HD1 ILE 24 -8.981 -4.096 -1.627 196 2HD1 ILE 24 2HD1 ILE 24 -8.374 -2.673 -2.474 197 3HD1 ILE 24 3HD1 ILE 24 -10.110 -2.943 -2.337 198 H SER 25 H SER 25 -9.728 -3.727 3.626 199 HA SER 25 HA SER 25 -6.882 -3.061 3.904 200 1HB SER 25 1HB SER 25 -8.359 -2.626 5.897 201 2HB SER 25 2HB SER 25 -8.669 -4.358 5.977 202 HG SER 25 HG SER 25 -6.637 -3.018 7.013 203 H PHE 26 H PHE 26 -5.782 -5.106 5.071 204 HA PHE 26 HA PHE 26 -5.938 -7.118 2.989 205 1HB PHE 26 1HB PHE 26 -3.936 -6.718 5.215 206 2HB PHE 26 2HB PHE 26 -3.801 -7.925 3.937 207 HD1 PHE 26 HD1 PHE 26 -3.014 -4.623 4.910 208 HD2 PHE 26 HD2 PHE 26 -3.875 -7.033 1.510 209 HE1 PHE 26 HE1 PHE 26 -1.948 -2.948 3.458 210 HE2 PHE 26 HE2 PHE 26 -2.806 -5.366 0.053 211 HZ PHE 26 HZ PHE 26 -1.846 -3.320 1.027 212 H LEU 27 H LEU 27 -7.975 -6.920 5.097 213 HA LEU 27 HA LEU 27 -7.899 -9.235 6.733 214 1HB LEU 27 1HB LEU 27 -9.697 -7.144 6.178 215 2HB LEU 27 2HB LEU 27 -10.538 -8.596 5.676 216 HG LEU 27 HG LEU 27 -11.164 -8.055 7.930 217 1HD1 LEU 27 1HD1 LEU 27 -11.018 -10.414 7.443 218 2HD1 LEU 27 2HD1 LEU 27 -10.511 -10.115 9.105 219 3HD1 LEU 27 3HD1 LEU 27 -9.304 -10.421 7.858 220 1HD2 LEU 27 1HD2 LEU 27 -8.221 -8.138 8.561 221 2HD2 LEU 27 2HD2 LEU 27 -9.515 -8.008 9.752 222 3HD2 LEU 27 3HD2 LEU 27 -9.263 -6.715 8.579 223 H GLY 28 H GLY 28 -8.289 -8.637 3.407 224 1HA GLY 28 1HA GLY 28 -7.978 -11.215 2.483 225 2HA GLY 28 2HA GLY 28 -9.717 -10.946 2.584 226 H GLY 29 H GLY 29 -10.411 -10.562 0.562 227 1HA GLY 29 1HA GLY 29 -10.921 -9.003 -1.096 228 2HA GLY 29 2HA GLY 29 -9.493 -8.085 -0.650 229 H ILE 30 H ILE 30 -7.568 -10.066 -0.871 230 HA ILE 30 HA ILE 30 -7.544 -10.478 -3.793 231 HB ILE 30 HB ILE 30 -5.178 -10.299 -1.907 232 1HG1 ILE 30 1HG1 ILE 30 -6.235 -8.238 -3.855 233 2HG1 ILE 30 2HG1 ILE 30 -6.413 -8.155 -2.107 234 1HG2 ILE 30 1HG2 ILE 30 -3.862 -10.088 -3.975 235 2HG2 ILE 30 2HG2 ILE 30 -5.327 -10.352 -4.923 236 3HG2 ILE 30 3HG2 ILE 30 -4.706 -11.632 -3.882 237 1HD1 ILE 30 1HD1 ILE 30 -3.990 -8.016 -1.868 238 2HD1 ILE 30 2HD1 ILE 30 -4.614 -6.723 -2.893 239 3HD1 ILE 30 3HD1 ILE 30 -3.811 -8.116 -3.620 240 H ASP 31 H ASP 31 -7.244 -12.503 -4.591 241 HA ASP 31 HA ASP 31 -7.513 -14.775 -2.918 242 1HB ASP 31 1HB ASP 31 -8.222 -14.721 -5.306 243 2HB ASP 31 2HB ASP 31 -6.524 -14.685 -5.778 244 H LYS 32 H LYS 32 -6.038 -16.068 -1.996 245 HA LYS 32 HA LYS 32 -3.571 -14.914 -1.368 246 1HB LYS 32 1HB LYS 32 -3.159 -16.982 -0.097 247 2HB LYS 32 2HB LYS 32 -4.749 -16.301 0.205 248 1HG LYS 32 1HG LYS 32 -5.524 -17.982 -1.621 249 2HG LYS 32 2HG LYS 32 -4.003 -18.795 -1.252 250 1HD LYS 32 1HD LYS 32 -4.650 -18.871 1.127 251 2HD LYS 32 2HD LYS 32 -6.196 -18.128 0.709 252 1HE LYS 32 1HE LYS 32 -6.622 -20.444 0.850 253 2HE LYS 32 2HE LYS 32 -6.550 -20.076 -0.874 254 1HZ LYS 32 1HZ LYS 32 -5.321 -22.065 -0.458 255 2HZ LYS 32 2HZ LYS 32 -4.417 -21.328 0.773 256 3HZ LYS 32 3HZ LYS 32 -4.208 -20.841 -0.843 257 H GLU 33 H GLU 33 -4.346 -17.383 -3.773 258 HA GLU 33 HA GLU 33 -1.457 -17.622 -4.297 259 1HB GLU 33 1HB GLU 33 -3.676 -19.562 -4.504 260 2HB GLU 33 2HB GLU 33 -2.451 -19.641 -5.762 261 1HG GLU 33 1HG GLU 33 -1.771 -21.155 -4.119 262 2HG GLU 33 2HG GLU 33 -0.738 -19.748 -3.915 263 H THR 34 H THR 34 -4.554 -16.911 -5.760 264 HA THR 34 HA THR 34 -3.491 -16.914 -8.435 265 HB THR 34 HB THR 34 -6.125 -15.763 -7.708 266 HG1 THR 34 HG1 THR 34 -6.036 -17.737 -6.585 267 1HG2 THR 34 1HG2 THR 34 -5.420 -15.657 -10.041 268 2HG2 THR 34 2HG2 THR 34 -6.786 -16.756 -9.851 269 3HG2 THR 34 3HG2 THR 34 -5.156 -17.401 -10.044 270 H GLY 35 H GLY 35 -4.091 -14.549 -5.944 271 1HA GLY 35 1HA GLY 35 -3.330 -12.375 -5.797 272 2HA GLY 35 2HA GLY 35 -2.559 -12.581 -7.361 273 H ILE 36 H ILE 36 -5.893 -13.324 -7.161 274 HA ILE 36 HA ILE 36 -6.520 -10.980 -8.790 275 HB ILE 36 HB ILE 36 -8.146 -13.468 -8.217 276 1HG1 ILE 36 1HG1 ILE 36 -6.193 -13.891 -9.643 277 2HG1 ILE 36 2HG1 ILE 36 -7.694 -14.061 -10.549 278 1HG2 ILE 36 1HG2 ILE 36 -8.742 -11.152 -10.051 279 2HG2 ILE 36 2HG2 ILE 36 -9.626 -11.604 -8.594 280 3HG2 ILE 36 3HG2 ILE 36 -9.646 -12.666 -10.003 281 1HD1 ILE 36 1HD1 ILE 36 -7.349 -11.842 -11.512 282 2HD1 ILE 36 2HD1 ILE 36 -6.001 -12.924 -11.857 283 3HD1 ILE 36 3HD1 ILE 36 -5.842 -11.688 -10.609 284 H VAL 37 H VAL 37 -7.684 -9.311 -8.007 285 HA VAL 37 HA VAL 37 -8.528 -9.269 -5.282 286 HB VAL 37 HB VAL 37 -9.591 -7.062 -5.895 287 1HG1 VAL 37 1HG1 VAL 37 -7.458 -5.913 -6.162 288 2HG1 VAL 37 2HG1 VAL 37 -6.689 -7.431 -6.623 289 3HG1 VAL 37 3HG1 VAL 37 -7.333 -7.225 -4.993 290 1HG2 VAL 37 1HG2 VAL 37 -9.002 -6.077 -8.059 291 2HG2 VAL 37 2HG2 VAL 37 -10.045 -7.487 -8.244 292 3HG2 VAL 37 3HG2 VAL 37 -8.317 -7.618 -8.571 293 H LYS 38 H LYS 38 -10.141 -10.412 -4.619 294 HA LYS 38 HA LYS 38 -12.401 -11.039 -6.346 295 1HB LYS 38 1HB LYS 38 -11.722 -12.018 -3.567 296 2HB LYS 38 2HB LYS 38 -12.977 -12.667 -4.616 297 1HG LYS 38 1HG LYS 38 -10.039 -12.682 -5.276 298 2HG LYS 38 2HG LYS 38 -10.904 -14.032 -4.542 299 1HD LYS 38 1HD LYS 38 -11.730 -12.792 -7.159 300 2HD LYS 38 2HD LYS 38 -10.591 -14.136 -7.057 301 1HE LYS 38 1HE LYS 38 -13.383 -14.170 -5.912 302 2HE LYS 38 2HE LYS 38 -12.948 -14.832 -7.489 303 1HZ LYS 38 1HZ LYS 38 -13.024 -16.492 -5.651 304 2HZ LYS 38 2HZ LYS 38 -11.697 -15.709 -4.941 305 3HZ LYS 38 3HZ LYS 38 -11.536 -16.428 -6.466 306 H GLU 39 H GLU 39 -11.505 -8.804 -4.024 307 HA GLU 39 HA GLU 39 -14.116 -8.358 -2.888 308 1HB GLU 39 1HB GLU 39 -12.039 -7.882 -1.617 309 2HB GLU 39 2HB GLU 39 -11.633 -6.628 -2.780 310 1HG GLU 39 1HG GLU 39 -12.596 -5.752 -0.689 311 2HG GLU 39 2HG GLU 39 -13.529 -5.318 -2.120 312 H ASP 40 H ASP 40 -15.301 -6.368 -3.171 313 HA ASP 40 HA ASP 40 -15.270 -5.623 -6.008 314 1HB ASP 40 1HB ASP 40 -17.325 -6.653 -5.237 315 2HB ASP 40 2HB ASP 40 -17.458 -5.486 -3.926 316 H CYS 41 H CYS 41 -15.082 -3.580 -6.673 317 HA CYS 41 HA CYS 41 -15.575 -1.318 -4.992 318 1HB CYS 41 1HB CYS 41 -13.264 -0.363 -5.229 319 2HB CYS 41 2HB CYS 41 -13.350 -1.768 -4.171 320 HG CYS 41 HG CYS 41 -10.957 -1.816 -5.658 321 H GLU 42 H GLU 42 -13.677 -2.246 -7.831 322 HA GLU 42 HA GLU 42 -15.572 -1.318 -9.699 323 1HB GLU 42 1HB GLU 42 -14.797 0.905 -8.990 324 2HB GLU 42 2HB GLU 42 -13.135 0.444 -9.333 325 1HG GLU 42 1HG GLU 42 -13.633 0.240 -11.685 326 2HG GLU 42 2HG GLU 42 -15.337 0.579 -11.380 327 H ILE 43 H ILE 43 -12.079 -1.687 -9.177 328 HA ILE 43 HA ILE 43 -11.777 -2.946 -11.790 329 HB ILE 43 HB ILE 43 -9.582 -2.473 -9.777 330 1HG1 ILE 43 1HG1 ILE 43 -10.596 -0.530 -11.867 331 2HG1 ILE 43 2HG1 ILE 43 -10.846 -0.368 -10.131 332 1HG2 ILE 43 1HG2 ILE 43 -9.015 -3.888 -11.671 333 2HG2 ILE 43 2HG2 ILE 43 -8.185 -2.336 -11.800 334 3HG2 ILE 43 3HG2 ILE 43 -9.609 -2.660 -12.789 335 1HD1 ILE 43 1HD1 ILE 43 -9.053 1.066 -10.883 336 2HD1 ILE 43 2HD1 ILE 43 -8.197 -0.318 -11.560 337 3HD1 ILE 43 3HD1 ILE 43 -8.423 -0.189 -9.816 338 H LYS 44 H LYS 44 -13.338 -4.419 -10.127 339 HA LYS 44 HA LYS 44 -11.827 -6.433 -8.729 340 1HB LYS 44 1HB LYS 44 -13.994 -5.892 -7.873 341 2HB LYS 44 2HB LYS 44 -14.748 -6.137 -9.439 342 1HG LYS 44 1HG LYS 44 -14.305 -8.532 -9.282 343 2HG LYS 44 2HG LYS 44 -13.520 -8.285 -7.718 344 1HD LYS 44 1HD LYS 44 -15.580 -7.508 -6.751 345 2HD LYS 44 2HD LYS 44 -16.383 -7.548 -8.322 346 1HE LYS 44 1HE LYS 44 -16.116 -9.973 -8.398 347 2HE LYS 44 2HE LYS 44 -15.280 -9.937 -6.846 348 1HZ LYS 44 1HZ LYS 44 -17.221 -9.322 -5.733 349 2HZ LYS 44 2HZ LYS 44 -17.743 -10.508 -6.831 350 3HZ LYS 44 3HZ LYS 44 -18.021 -8.867 -7.157 351 H GLY 45 H GLY 45 -11.066 -8.299 -9.537 352 1HA GLY 45 1HA GLY 45 -11.547 -10.247 -10.980 353 2HA GLY 45 2HA GLY 45 -11.990 -9.096 -12.231 354 H GLU 46 H GLU 46 -9.555 -7.468 -11.147 355 HA GLU 46 HA GLU 46 -7.678 -8.748 -12.969 356 1HB GLU 46 1HB GLU 46 -7.871 -6.002 -11.791 357 2HB GLU 46 2HB GLU 46 -6.353 -6.566 -12.475 358 1HG GLU 46 1HG GLU 46 -7.674 -7.110 -14.569 359 2HG GLU 46 2HG GLU 46 -8.979 -6.160 -13.856 360 H SER 47 H SER 47 -5.310 -8.492 -12.361 361 HA SER 47 HA SER 47 -4.937 -9.555 -9.658 362 1HB SER 47 1HB SER 47 -2.736 -10.375 -10.643 363 2HB SER 47 2HB SER 47 -4.193 -11.116 -11.306 364 HG SER 47 HG SER 47 -3.100 -10.566 -13.086 365 H VAL 48 H VAL 48 -3.216 -8.815 -8.379 366 HA VAL 48 HA VAL 48 -2.327 -6.086 -9.022 367 HB VAL 48 HB VAL 48 -1.758 -5.921 -6.603 368 1HG1 VAL 48 1HG1 VAL 48 -4.603 -6.705 -7.223 369 2HG1 VAL 48 2HG1 VAL 48 -3.894 -5.100 -7.409 370 3HG1 VAL 48 3HG1 VAL 48 -4.076 -5.803 -5.802 371 1HG2 VAL 48 1HG2 VAL 48 -1.386 -8.284 -6.135 372 2HG2 VAL 48 2HG2 VAL 48 -3.087 -8.630 -6.447 373 3HG2 VAL 48 3HG2 VAL 48 -2.628 -7.635 -5.064 374 H ALA 49 H ALA 49 -1.167 -8.687 -9.971 375 HA ALA 49 HA ALA 49 1.233 -9.166 -8.529 376 1HB ALA 49 1HB ALA 49 0.017 -10.959 -9.673 377 2HB ALA 49 2HB ALA 49 1.689 -10.837 -10.221 378 3HB ALA 49 3HB ALA 49 0.383 -10.206 -11.225 379 H GLY 50 H GLY 50 2.410 -7.306 -8.555 380 1HA GLY 50 1HA GLY 50 4.520 -6.617 -9.369 381 2HA GLY 50 2HA GLY 50 4.053 -7.145 -10.974 382 H ARG 51 H ARG 51 1.791 -5.213 -9.235 383 HA ARG 51 HA ARG 51 2.712 -2.845 -10.695 384 1HB ARG 51 1HB ARG 51 0.372 -2.193 -11.019 385 2HB ARG 51 2HB ARG 51 0.729 -3.726 -11.791 386 1HG ARG 51 1HG ARG 51 -0.200 -4.641 -9.472 387 2HG ARG 51 2HG ARG 51 -1.056 -3.098 -9.520 388 1HD ARG 51 1HD ARG 51 -1.132 -5.307 -11.567 389 2HD ARG 51 2HD ARG 51 -2.447 -4.761 -10.533 390 HE ARG 51 HE ARG 51 -1.435 -2.712 -12.277 391 1HH1 ARG 51 1HH1 ARG 51 -3.666 -5.410 -12.012 392 2HH1 ARG 51 2HH1 ARG 51 -4.698 -4.852 -13.305 393 1HH2 ARG 51 1HH2 ARG 51 -2.774 -1.995 -14.020 394 2HH2 ARG 51 2HH2 ARG 51 -4.194 -2.919 -14.427 395 H ILE 52 H ILE 52 1.416 -0.834 -9.692 396 HA ILE 52 HA ILE 52 2.265 -0.898 -6.880 397 HB ILE 52 HB ILE 52 1.822 1.468 -8.713 398 1HG1 ILE 52 1HG1 ILE 52 3.786 0.172 -9.359 399 2HG1 ILE 52 2HG1 ILE 52 4.273 1.707 -8.651 400 1HG2 ILE 52 1HG2 ILE 52 1.376 2.022 -6.377 401 2HG2 ILE 52 2HG2 ILE 52 2.841 2.814 -6.955 402 3HG2 ILE 52 3HG2 ILE 52 2.959 1.389 -5.922 403 1HD1 ILE 52 1HD1 ILE 52 5.698 -0.099 -7.898 404 2HD1 ILE 52 2HD1 ILE 52 4.295 -0.968 -7.273 405 3HD1 ILE 52 3HD1 ILE 52 4.776 0.568 -6.551 406 H LEU 53 H LEU 53 0.821 -0.607 -5.260 407 HA LEU 53 HA LEU 53 -1.957 -0.091 -6.089 408 1HB LEU 53 1HB LEU 53 -0.736 -1.985 -4.191 409 2HB LEU 53 2HB LEU 53 -2.207 -1.213 -3.633 410 HG LEU 53 HG LEU 53 -2.618 -3.402 -4.698 411 1HD1 LEU 53 1HD1 LEU 53 -4.358 -1.697 -4.683 412 2HD1 LEU 53 2HD1 LEU 53 -4.439 -2.679 -6.147 413 3HD1 LEU 53 3HD1 LEU 53 -3.753 -1.054 -6.212 414 1HD2 LEU 53 1HD2 LEU 53 -2.379 -3.646 -7.112 415 2HD2 LEU 53 2HD2 LEU 53 -0.818 -3.353 -6.346 416 3HD2 LEU 53 3HD2 LEU 53 -1.636 -2.049 -7.206 417 H VAL 54 H VAL 54 -3.021 1.581 -5.284 418 HA VAL 54 HA VAL 54 -1.784 3.072 -3.061 419 HB VAL 54 HB VAL 54 -3.438 4.200 -5.327 420 1HG1 VAL 54 1HG1 VAL 54 -3.706 5.470 -3.275 421 2HG1 VAL 54 2HG1 VAL 54 -2.754 6.386 -4.443 422 3HG1 VAL 54 3HG1 VAL 54 -1.957 5.579 -3.092 423 1HG2 VAL 54 1HG2 VAL 54 -1.338 5.252 -6.064 424 2HG2 VAL 54 2HG2 VAL 54 -1.273 3.492 -6.145 425 3HG2 VAL 54 3HG2 VAL 54 -0.467 4.346 -4.828 426 H PHE 55 H PHE 55 -2.965 3.261 -1.288 427 HA PHE 55 HA PHE 55 -5.914 3.073 -1.457 428 1HB PHE 55 1HB PHE 55 -4.255 1.896 0.800 429 2HB PHE 55 2HB PHE 55 -5.988 1.749 0.570 430 HD1 PHE 55 HD1 PHE 55 -6.894 -0.022 -0.653 431 HD2 PHE 55 HD2 PHE 55 -2.707 0.704 -0.774 432 HE1 PHE 55 HE1 PHE 55 -6.556 -2.193 -1.753 433 HE2 PHE 55 HE2 PHE 55 -2.359 -1.464 -1.886 434 HZ PHE 55 HZ PHE 55 -4.286 -2.916 -2.373 435 HA PRO 56 HA PRO 56 -5.550 6.660 1.258 436 1HB PRO 56 1HB PRO 56 -8.122 6.734 2.137 437 2HB PRO 56 2HB PRO 56 -7.642 7.319 0.540 438 1HG PRO 56 1HG PRO 56 -8.921 4.733 1.310 439 2HG PRO 56 2HG PRO 56 -9.229 5.761 -0.099 440 1HD PRO 56 1HD PRO 56 -7.712 3.489 -0.181 441 2HD PRO 56 2HD PRO 56 -7.489 4.858 -1.286 442 H GLY 57 H GLY 57 -7.335 3.777 2.254 443 1HA GLY 57 1HA GLY 57 -5.745 3.233 4.510 444 2HA GLY 57 2HA GLY 57 -7.220 4.052 5.018 445 H GLY 58 H GLY 58 -7.208 1.714 6.065 446 1HA GLY 58 1HA GLY 58 -9.010 0.125 4.376 447 2HA GLY 58 2HA GLY 58 -7.624 -0.667 5.117 448 H LYS 59 H LYS 59 -10.759 -0.559 5.432 449 HA LYS 59 HA LYS 59 -11.100 0.151 8.177 450 1HB LYS 59 1HB LYS 59 -13.366 -0.706 7.925 451 2HB LYS 59 2HB LYS 59 -12.946 0.314 6.559 452 1HG LYS 59 1HG LYS 59 -12.414 -1.799 5.291 453 2HG LYS 59 2HG LYS 59 -13.148 -2.685 6.629 454 1HD LYS 59 1HD LYS 59 -14.484 -0.625 4.877 455 2HD LYS 59 2HD LYS 59 -14.775 -2.363 4.867 456 1HE LYS 59 1HE LYS 59 -15.275 -0.562 7.230 457 2HE LYS 59 2HE LYS 59 -16.507 -1.041 6.065 458 1HZ LYS 59 1HZ LYS 59 -16.512 -2.399 8.090 459 2HZ LYS 59 2HZ LYS 59 -14.945 -2.935 7.743 460 3HZ LYS 59 3HZ LYS 59 -16.228 -3.324 6.702 461 H GLY 60 H GLY 60 -11.192 -1.133 9.957 462 1HA GLY 60 1HA GLY 60 -11.072 -3.076 11.222 463 2HA GLY 60 2HA GLY 60 -10.955 -4.009 9.735 464 H SER 61 H SER 61 -8.937 -4.063 8.635 465 HA SER 61 HA SER 61 -6.718 -4.513 8.545 466 1HB SER 61 1HB SER 61 -6.549 -2.129 10.406 467 2HB SER 61 2HB SER 61 -5.200 -2.812 9.495 468 HG SER 61 HG SER 61 -7.155 -1.103 8.673 469 H THR 62 H THR 62 -8.301 -5.864 10.553 470 HA THR 62 HA THR 62 -6.752 -6.110 12.933 471 HB THR 62 HB THR 62 -8.764 -8.124 11.948 472 HG1 THR 62 HG1 THR 62 -10.375 -6.758 12.460 473 1HG2 THR 62 1HG2 THR 62 -9.238 -8.351 14.342 474 2HG2 THR 62 2HG2 THR 62 -8.025 -7.121 14.699 475 3HG2 THR 62 3HG2 THR 62 -7.536 -8.663 13.997 476 H VAL 63 H VAL 63 -6.659 -7.568 9.798 477 HA VAL 63 HA VAL 63 -4.357 -9.136 10.611 478 HB VAL 63 HB VAL 63 -6.430 -10.617 10.739 479 1HG1 VAL 63 1HG1 VAL 63 -7.244 -11.543 8.621 480 2HG1 VAL 63 2HG1 VAL 63 -6.271 -10.362 7.744 481 3HG1 VAL 63 3HG1 VAL 63 -7.594 -9.823 8.778 482 1HG2 VAL 63 1HG2 VAL 63 -4.212 -11.561 10.666 483 2HG2 VAL 63 2HG2 VAL 63 -4.171 -11.405 8.910 484 3HG2 VAL 63 3HG2 VAL 63 -5.301 -12.527 9.668 485 H GLY 64 H GLY 64 -3.057 -9.828 8.778 486 1HA GLY 64 1HA GLY 64 -3.365 -9.547 6.138 487 2HA GLY 64 2HA GLY 64 -3.179 -7.870 6.631 488 H SER 65 H SER 65 -1.394 -9.174 8.869 489 HA SER 65 HA SER 65 1.044 -8.431 7.670 490 1HB SER 65 1HB SER 65 0.598 -8.291 10.097 491 2HB SER 65 2HB SER 65 0.587 -10.050 10.186 492 HG SER 65 HG SER 65 2.825 -9.557 9.052 493 H TYR 66 H TYR 66 -0.655 -11.437 7.707 494 HA TYR 66 HA TYR 66 1.758 -12.942 7.035 495 1HB TYR 66 1HB TYR 66 -1.065 -13.860 7.593 496 2HB TYR 66 2HB TYR 66 0.254 -14.937 7.153 497 HD1 TYR 66 HD1 TYR 66 -1.509 -13.509 9.844 498 HD2 TYR 66 HD2 TYR 66 2.397 -14.757 8.689 499 HE1 TYR 66 HE1 TYR 66 -0.874 -13.705 12.212 500 HE2 TYR 66 HE2 TYR 66 3.036 -14.955 11.057 501 HH TYR 66 HH TYR 66 2.257 -13.921 13.270 502 H VAL 67 H VAL 67 -1.220 -11.795 5.561 503 HA VAL 67 HA VAL 67 -1.157 -13.591 3.361 504 HB VAL 67 HB VAL 67 -2.877 -12.174 2.331 505 1HG1 VAL 67 1HG1 VAL 67 -3.295 -12.729 5.265 506 2HG1 VAL 67 2HG1 VAL 67 -3.570 -13.845 3.927 507 3HG1 VAL 67 3HG1 VAL 67 -4.580 -12.411 4.100 508 1HG2 VAL 67 1HG2 VAL 67 -2.055 -9.982 3.011 509 2HG2 VAL 67 2HG2 VAL 67 -2.448 -10.345 4.692 510 3HG2 VAL 67 3HG2 VAL 67 -3.737 -10.201 3.495 511 H LEU 68 H LEU 68 0.207 -10.418 3.916 512 HA LEU 68 HA LEU 68 0.780 -9.715 1.265 513 1HB LEU 68 1HB LEU 68 2.248 -9.033 3.811 514 2HB LEU 68 2HB LEU 68 2.552 -8.267 2.262 515 HG LEU 68 HG LEU 68 -0.060 -8.167 3.777 516 1HD1 LEU 68 1HD1 LEU 68 1.678 -6.881 4.888 517 2HD1 LEU 68 2HD1 LEU 68 0.494 -5.810 4.138 518 3HD1 LEU 68 3HD1 LEU 68 2.061 -6.064 3.374 519 1HD2 LEU 68 1HD2 LEU 68 -0.382 -8.068 1.365 520 2HD2 LEU 68 2HD2 LEU 68 0.813 -6.776 1.248 521 3HD2 LEU 68 3HD2 LEU 68 -0.703 -6.500 2.106 522 H LEU 69 H LEU 69 2.550 -11.681 3.584 523 HA LEU 69 HA LEU 69 4.886 -11.971 1.981 524 1HB LEU 69 1HB LEU 69 4.888 -12.274 4.422 525 2HB LEU 69 2HB LEU 69 3.854 -13.680 4.249 526 HG LEU 69 HG LEU 69 5.662 -14.818 2.988 527 1HD1 LEU 69 1HD1 LEU 69 7.261 -12.376 3.728 528 2HD1 LEU 69 2HD1 LEU 69 6.816 -12.890 2.101 529 3HD1 LEU 69 3HD1 LEU 69 7.926 -13.867 3.063 530 1HD2 LEU 69 1HD2 LEU 69 5.413 -15.217 5.366 531 2HD2 LEU 69 2HD2 LEU 69 6.405 -13.804 5.730 532 3HD2 LEU 69 3HD2 LEU 69 7.122 -15.203 4.930 533 H ASN 70 H ASN 70 1.958 -13.900 2.483 534 HA ASN 70 HA ASN 70 2.743 -16.175 1.016 535 1HB ASN 70 1HB ASN 70 0.778 -16.052 2.569 536 2HB ASN 70 2HB ASN 70 -0.077 -15.136 1.330 537 1HD2 ASN 70 1HD2 ASN 70 -0.732 -16.183 -0.562 538 2HD2 ASN 70 2HD2 ASN 70 -0.799 -17.908 -0.674 539 H LEU 71 H LEU 71 0.979 -13.264 0.050 540 HA LEU 71 HA LEU 71 0.550 -13.984 -2.635 541 1HB LEU 71 1HB LEU 71 0.908 -11.244 -1.410 542 2HB LEU 71 2HB LEU 71 0.295 -11.547 -3.024 543 HG LEU 71 HG LEU 71 -1.055 -12.473 -0.485 544 1HD1 LEU 71 1HD1 LEU 71 -1.717 -10.155 -2.299 545 2HD1 LEU 71 2HD1 LEU 71 -1.054 -10.033 -0.670 546 3HD1 LEU 71 3HD1 LEU 71 -2.668 -10.698 -0.916 547 1HD2 LEU 71 1HD2 LEU 71 -1.543 -13.880 -2.409 548 2HD2 LEU 71 2HD2 LEU 71 -1.968 -12.454 -3.358 549 3HD2 LEU 71 3HD2 LEU 71 -2.953 -12.914 -1.969 550 H ARG 72 H ARG 72 3.252 -12.434 -1.006 551 HA ARG 72 HA ARG 72 4.593 -11.562 -3.338 552 1HB ARG 72 1HB ARG 72 4.906 -10.727 -0.969 553 2HB ARG 72 2HB ARG 72 5.863 -12.173 -0.678 554 1HG ARG 72 1HG ARG 72 7.317 -10.329 -1.151 555 2HG ARG 72 2HG ARG 72 7.394 -11.488 -2.477 556 1HD ARG 72 1HD ARG 72 6.143 -10.110 -3.903 557 2HD ARG 72 2HD ARG 72 5.552 -9.120 -2.569 558 HE ARG 72 HE ARG 72 7.995 -8.434 -2.351 559 1HH1 ARG 72 1HH1 ARG 72 6.469 -9.248 -5.402 560 2HH1 ARG 72 2HH1 ARG 72 7.541 -8.260 -6.350 561 1HH2 ARG 72 1HH2 ARG 72 9.400 -7.130 -3.585 562 2HH2 ARG 72 2HH2 ARG 72 9.226 -7.073 -5.310 563 H LYS 73 H LYS 73 4.901 -14.489 -1.340 564 HA LYS 73 HA LYS 73 7.125 -15.479 -2.845 565 1HB LYS 73 1HB LYS 73 6.851 -17.543 -1.570 566 2HB LYS 73 2HB LYS 73 6.804 -16.138 -0.517 567 1HG LYS 73 1HG LYS 73 4.301 -16.298 -0.583 568 2HG LYS 73 2HG LYS 73 4.498 -17.843 -1.409 569 1HD LYS 73 1HD LYS 73 5.806 -17.266 1.237 570 2HD LYS 73 2HD LYS 73 4.163 -17.890 1.129 571 1HE LYS 73 1HE LYS 73 5.606 -19.749 1.471 572 2HE LYS 73 2HE LYS 73 5.071 -19.807 -0.205 573 1HZ LYS 73 1HZ LYS 73 7.537 -20.204 0.348 574 2HZ LYS 73 2HZ LYS 73 7.633 -18.516 0.487 575 3HZ LYS 73 3HZ LYS 73 7.148 -19.225 -0.977 576 H ASN 74 H ASN 74 3.816 -15.330 -3.458 577 HA ASN 74 HA ASN 74 3.910 -17.506 -5.394 578 1HB ASN 74 1HB ASN 74 1.754 -15.806 -4.233 579 2HB ASN 74 2HB ASN 74 1.508 -16.471 -5.841 580 1HD2 ASN 74 1HD2 ASN 74 1.830 -17.168 -2.471 581 2HD2 ASN 74 2HD2 ASN 74 1.313 -18.821 -2.555 582 H GLY 75 H GLY 75 4.452 -14.171 -5.166 583 1HA GLY 75 1HA GLY 75 5.343 -12.775 -6.790 584 2HA GLY 75 2HA GLY 75 5.031 -14.017 -7.994 585 H VAL 76 H VAL 76 2.368 -13.363 -6.035 586 HA VAL 76 HA VAL 76 1.126 -11.878 -8.245 587 HB VAL 76 HB VAL 76 -1.036 -12.694 -7.365 588 1HG1 VAL 76 1HG1 VAL 76 0.968 -14.877 -7.915 589 2HG1 VAL 76 2HG1 VAL 76 0.135 -13.910 -9.131 590 3HG1 VAL 76 3HG1 VAL 76 -0.782 -15.002 -8.092 591 1HG2 VAL 76 1HG2 VAL 76 -0.398 -12.972 -5.023 592 2HG2 VAL 76 2HG2 VAL 76 0.669 -14.305 -5.466 593 3HG2 VAL 76 3HG2 VAL 76 -1.075 -14.462 -5.678 594 H ALA 77 H ALA 77 2.652 -11.023 -5.687 595 HA ALA 77 HA ALA 77 0.631 -9.366 -4.391 596 1HB ALA 77 1HB ALA 77 3.574 -9.674 -3.790 597 2HB ALA 77 2HB ALA 77 2.260 -10.533 -2.984 598 3HB ALA 77 3HB ALA 77 2.402 -8.783 -2.818 599 HA PRO 78 HA PRO 78 1.748 -5.617 -6.530 600 1HB PRO 78 1HB PRO 78 1.500 -3.817 -4.485 601 2HB PRO 78 2HB PRO 78 0.120 -4.495 -5.356 602 1HG PRO 78 1HG PRO 78 1.271 -5.294 -2.713 603 2HG PRO 78 2HG PRO 78 -0.429 -5.123 -3.189 604 1HD PRO 78 1HD PRO 78 0.778 -7.528 -3.040 605 2HD PRO 78 2HD PRO 78 -0.471 -7.172 -4.251 606 H LYS 79 H LYS 79 3.565 -4.331 -6.821 607 HA LYS 79 HA LYS 79 5.956 -5.203 -5.577 608 1HB LYS 79 1HB LYS 79 5.312 -2.920 -7.425 609 2HB LYS 79 2HB LYS 79 6.921 -3.172 -6.786 610 1HG LYS 79 1HG LYS 79 6.887 -5.454 -7.794 611 2HG LYS 79 2HG LYS 79 5.370 -5.007 -8.580 612 1HD LYS 79 1HD LYS 79 6.466 -3.157 -9.702 613 2HD LYS 79 2HD LYS 79 7.975 -3.518 -8.866 614 1HE LYS 79 1HE LYS 79 8.038 -5.711 -9.986 615 2HE LYS 79 2HE LYS 79 6.559 -5.291 -10.852 616 1HZ LYS 79 1HZ LYS 79 8.440 -4.855 -12.252 617 2HZ LYS 79 2HZ LYS 79 9.183 -3.907 -11.054 618 3HZ LYS 79 3HZ LYS 79 7.759 -3.370 -11.794 619 H ALA 80 H ALA 80 3.944 -2.316 -5.216 620 HA ALA 80 HA ALA 80 5.126 -1.802 -2.621 621 1HB ALA 80 1HB ALA 80 5.703 0.518 -3.112 622 2HB ALA 80 2HB ALA 80 5.253 0.280 -4.800 623 3HB ALA 80 3HB ALA 80 6.628 -0.592 -4.122 624 H ILE 81 H ILE 81 3.941 -0.206 -1.396 625 HA ILE 81 HA ILE 81 1.216 0.274 -2.396 626 HB ILE 81 HB ILE 81 1.900 -0.809 0.349 627 1HG1 ILE 81 1HG1 ILE 81 0.367 -2.144 -1.895 628 2HG1 ILE 81 2HG1 ILE 81 2.059 -2.463 -1.530 629 1HG2 ILE 81 1HG2 ILE 81 -0.517 -0.928 0.692 630 2HG2 ILE 81 2HG2 ILE 81 -0.781 -0.187 -0.886 631 3HG2 ILE 81 3HG2 ILE 81 0.007 0.731 0.398 632 1HD1 ILE 81 1HD1 ILE 81 0.542 -4.155 -0.614 633 2HD1 ILE 81 2HD1 ILE 81 -0.226 -2.908 0.369 634 3HD1 ILE 81 3HD1 ILE 81 1.465 -3.325 0.639 635 H ILE 82 H ILE 82 0.561 2.322 -2.081 636 HA ILE 82 HA ILE 82 2.054 3.961 -0.125 637 HB ILE 82 HB ILE 82 0.417 5.269 -2.253 638 1HG1 ILE 82 1HG1 ILE 82 1.721 3.555 -3.490 639 2HG1 ILE 82 2HG1 ILE 82 2.232 5.193 -3.880 640 1HG2 ILE 82 1HG2 ILE 82 3.092 5.957 -1.018 641 2HG2 ILE 82 2HG2 ILE 82 1.527 6.576 -0.483 642 3HG2 ILE 82 3HG2 ILE 82 2.136 6.985 -2.086 643 1HD1 ILE 82 1HD1 ILE 82 4.123 3.688 -3.652 644 2HD1 ILE 82 2HD1 ILE 82 3.636 3.312 -2.000 645 3HD1 ILE 82 3HD1 ILE 82 4.159 4.945 -2.416 646 H ASN 83 H ASN 83 0.929 4.792 1.542 647 HA ASN 83 HA ASN 83 -2.018 4.727 1.389 648 1HB ASN 83 1HB ASN 83 -0.286 3.946 3.746 649 2HB ASN 83 2HB ASN 83 -2.031 4.146 3.819 650 1HD2 ASN 83 1HD2 ASN 83 -2.423 2.975 1.162 651 2HD2 ASN 83 2HD2 ASN 83 -2.194 1.273 1.365 652 H LYS 84 H LYS 84 -3.110 6.235 2.796 653 HA LYS 84 HA LYS 84 -1.558 8.657 3.326 654 1HB LYS 84 1HB LYS 84 -3.961 8.495 2.225 655 2HB LYS 84 2HB LYS 84 -4.498 8.411 3.895 656 1HG LYS 84 1HG LYS 84 -2.749 10.621 2.852 657 2HG LYS 84 2HG LYS 84 -4.509 10.693 2.832 658 1HD LYS 84 1HD LYS 84 -4.609 10.585 5.217 659 2HD LYS 84 2HD LYS 84 -2.883 10.235 5.328 660 1HE LYS 84 1HE LYS 84 -3.348 12.567 5.883 661 2HE LYS 84 2HE LYS 84 -2.368 12.439 4.425 662 1HZ LYS 84 1HZ LYS 84 -4.026 14.052 4.028 663 2HZ LYS 84 2HZ LYS 84 -5.262 13.058 4.607 664 3HZ LYS 84 3HZ LYS 84 -4.490 12.684 3.142 665 H LYS 85 H LYS 85 -3.432 6.166 4.902 666 HA LYS 85 HA LYS 85 -1.975 6.682 7.377 667 1HB LYS 85 1HB LYS 85 -4.213 7.779 7.565 668 2HB LYS 85 2HB LYS 85 -4.966 6.217 7.286 669 1HG LYS 85 1HG LYS 85 -3.906 5.359 9.327 670 2HG LYS 85 2HG LYS 85 -3.205 6.952 9.617 671 1HD LYS 85 1HD LYS 85 -5.477 7.906 9.714 672 2HD LYS 85 2HD LYS 85 -6.144 6.291 9.477 673 1HE LYS 85 1HE LYS 85 -5.060 5.549 11.551 674 2HE LYS 85 2HE LYS 85 -4.430 7.180 11.794 675 1HZ LYS 85 1HZ LYS 85 -7.306 6.446 11.664 676 2HZ LYS 85 2HZ LYS 85 -6.690 8.003 11.936 677 3HZ LYS 85 3HZ LYS 85 -6.442 6.779 13.085 678 H THR 86 H THR 86 -0.801 4.860 7.400 679 HA THR 86 HA THR 86 -2.048 2.382 6.469 680 HB THR 86 HB THR 86 0.188 3.146 5.568 681 HG1 THR 86 HG1 THR 86 -0.076 1.067 5.138 682 1HG2 THR 86 1HG2 THR 86 2.177 2.644 6.925 683 2HG2 THR 86 2HG2 THR 86 1.138 2.285 8.304 684 3HG2 THR 86 3HG2 THR 86 1.201 3.920 7.647 685 H GLU 87 H GLU 87 -0.885 0.404 7.724 686 HA GLU 87 HA GLU 87 -1.443 0.853 10.580 687 1HB GLU 87 1HB GLU 87 -3.056 -0.589 8.900 688 2HB GLU 87 2HB GLU 87 -1.995 -1.843 9.526 689 1HG GLU 87 1HG GLU 87 -3.814 -0.023 11.080 690 2HG GLU 87 2HG GLU 87 -3.913 -1.775 10.918 691 H THR 88 H THR 88 -0.277 -0.457 12.039 692 HA THR 88 HA THR 88 2.412 -0.897 11.358 693 HB THR 88 HB THR 88 0.976 -2.087 13.733 694 HG1 THR 88 HG1 THR 88 0.592 -0.063 14.234 695 1HG2 THR 88 1HG2 THR 88 3.156 -1.821 14.830 696 2HG2 THR 88 2HG2 THR 88 3.831 -1.175 13.334 697 3HG2 THR 88 3HG2 THR 88 3.285 -2.851 13.404 698 H ILE 89 H ILE 89 -0.347 -3.124 11.617 699 HA ILE 89 HA ILE 89 1.158 -5.497 11.346 700 HB ILE 89 HB ILE 89 -0.955 -6.571 10.621 701 1HG1 ILE 89 1HG1 ILE 89 -2.977 -4.844 11.087 702 2HG1 ILE 89 2HG1 ILE 89 -1.814 -3.745 10.355 703 1HG2 ILE 89 1HG2 ILE 89 -2.168 -6.199 12.721 704 2HG2 ILE 89 2HG2 ILE 89 -1.155 -4.790 13.037 705 3HG2 ILE 89 3HG2 ILE 89 -0.432 -6.398 12.967 706 1HD1 ILE 89 1HD1 ILE 89 -3.311 -4.625 8.685 707 2HD1 ILE 89 2HD1 ILE 89 -2.893 -6.277 9.139 708 3HD1 ILE 89 3HD1 ILE 89 -1.680 -5.231 8.403 709 H ILE 90 H ILE 90 0.006 -3.185 9.016 710 HA ILE 90 HA ILE 90 0.477 -4.776 6.693 711 HB ILE 90 HB ILE 90 0.364 -1.759 6.963 712 1HG1 ILE 90 1HG1 ILE 90 -1.787 -3.728 6.146 713 2HG1 ILE 90 2HG1 ILE 90 -1.706 -2.903 7.699 714 1HG2 ILE 90 1HG2 ILE 90 0.143 -3.515 4.521 715 2HG2 ILE 90 2HG2 ILE 90 1.490 -2.449 4.923 716 3HG2 ILE 90 3HG2 ILE 90 -0.094 -1.767 4.553 717 1HD1 ILE 90 1HD1 ILE 90 -2.048 -1.585 5.018 718 2HD1 ILE 90 2HD1 ILE 90 -1.972 -0.759 6.575 719 3HD1 ILE 90 3HD1 ILE 90 -3.311 -1.850 6.219 720 H ALA 91 H ALA 91 2.292 -2.380 8.520 721 HA ALA 91 HA ALA 91 4.524 -2.138 6.858 722 1HB ALA 91 1HB ALA 91 5.690 -1.327 8.873 723 2HB ALA 91 2HB ALA 91 4.324 -1.858 9.853 724 3HB ALA 91 3HB ALA 91 4.107 -0.582 8.654 725 H VAL 92 H VAL 92 3.868 -4.387 9.517 726 HA VAL 92 HA VAL 92 6.387 -5.651 9.541 727 HB VAL 92 HB VAL 92 3.716 -6.861 10.284 728 1HG1 VAL 92 1HG1 VAL 92 6.530 -7.636 11.030 729 2HG1 VAL 92 2HG1 VAL 92 5.405 -8.558 10.032 730 3HG1 VAL 92 3HG1 VAL 92 5.070 -8.319 11.747 731 1HG2 VAL 92 1HG2 VAL 92 5.709 -5.391 12.009 732 2HG2 VAL 92 2HG2 VAL 92 4.234 -6.178 12.570 733 3HG2 VAL 92 3HG2 VAL 92 4.135 -4.779 11.500 734 H GLY 93 H GLY 93 3.357 -6.524 7.885 735 1HA GLY 93 1HA GLY 93 4.329 -8.836 6.612 736 2HA GLY 93 2HA GLY 93 2.964 -7.870 6.070 737 H ALA 94 H ALA 94 4.239 -5.464 5.539 738 HA ALA 94 HA ALA 94 5.231 -5.923 2.935 739 1HB ALA 94 1HB ALA 94 4.044 -3.882 3.591 740 2HB ALA 94 2HB ALA 94 5.610 -3.520 2.864 741 3HB ALA 94 3HB ALA 94 5.405 -3.422 4.613 742 H ALA 95 H ALA 95 6.816 -5.478 6.027 743 HA ALA 95 HA ALA 95 9.410 -4.938 4.995 744 1HB ALA 95 1HB ALA 95 8.787 -4.344 7.275 745 2HB ALA 95 2HB ALA 95 10.193 -5.408 7.265 746 3HB ALA 95 3HB ALA 95 8.606 -6.051 7.683 747 H MET 96 H MET 96 7.667 -7.870 5.795 748 HA MET 96 HA MET 96 9.999 -9.553 5.531 749 1HB MET 96 1HB MET 96 7.066 -10.209 5.825 750 2HB MET 96 2HB MET 96 8.343 -11.414 5.767 751 1HG MET 96 1HG MET 96 9.336 -10.446 7.787 752 2HG MET 96 2HG MET 96 8.034 -9.259 7.850 753 1HE MET 96 1HE MET 96 4.907 -11.513 8.540 754 2HE MET 96 2HE MET 96 5.515 -11.040 6.955 755 3HE MET 96 3HE MET 96 5.497 -9.870 8.275 756 H ALA 97 H ALA 97 7.284 -8.577 3.551 757 HA ALA 97 HA ALA 97 7.929 -10.509 1.479 758 1HB ALA 97 1HB ALA 97 5.808 -8.369 1.533 759 2HB ALA 97 2HB ALA 97 5.592 -10.039 2.056 760 3HB ALA 97 3HB ALA 97 5.945 -9.683 0.364 761 H GLU 98 H GLU 98 9.267 -7.660 2.315 762 HA GLU 98 HA GLU 98 10.366 -5.960 1.287 763 1HB GLU 98 1HB GLU 98 11.654 -7.890 0.400 764 2HB GLU 98 2HB GLU 98 10.599 -7.920 -1.006 765 1HG GLU 98 1HG GLU 98 11.361 -5.719 -1.663 766 2HG GLU 98 2HG GLU 98 12.355 -5.603 -0.210 767 H ILE 99 H ILE 99 8.002 -5.241 1.321 768 HA ILE 99 HA ILE 99 7.274 -4.325 -1.384 769 HB ILE 99 HB ILE 99 5.375 -4.912 0.900 770 1HG1 ILE 99 1HG1 ILE 99 5.711 -6.278 -1.784 771 2HG1 ILE 99 2HG1 ILE 99 6.227 -6.937 -0.236 772 1HG2 ILE 99 1HG2 ILE 99 4.664 -2.978 -0.413 773 2HG2 ILE 99 2HG2 ILE 99 3.596 -4.356 -0.684 774 3HG2 ILE 99 3HG2 ILE 99 4.803 -3.925 -1.895 775 1HD1 ILE 99 1HD1 ILE 99 4.142 -7.934 -0.967 776 2HD1 ILE 99 2HD1 ILE 99 3.388 -6.342 -1.043 777 3HD1 ILE 99 3HD1 ILE 99 3.904 -7.001 0.510 778 HA PRO 100 HA PRO 100 8.849 -0.577 0.772 779 1HB PRO 100 1HB PRO 100 8.062 0.770 -1.645 780 2HB PRO 100 2HB PRO 100 9.690 0.424 -1.064 781 1HG PRO 100 1HG PRO 100 8.060 -1.018 -3.045 782 2HG PRO 100 2HG PRO 100 9.818 -1.009 -2.823 783 1HD PRO 100 1HD PRO 100 8.293 -3.148 -2.204 784 2HD PRO 100 2HD PRO 100 9.756 -2.730 -1.287 785 H LEU 101 H LEU 101 7.452 0.094 2.257 786 HA LEU 101 HA LEU 101 4.743 0.913 1.437 787 1HB LEU 101 1HB LEU 101 5.217 -0.974 3.175 788 2HB LEU 101 2HB LEU 101 5.610 0.340 4.259 789 HG LEU 101 HG LEU 101 3.323 -0.500 4.585 790 1HD1 LEU 101 1HD1 LEU 101 3.378 2.304 3.492 791 2HD1 LEU 101 2HD1 LEU 101 3.817 1.826 5.132 792 3HD1 LEU 101 3HD1 LEU 101 2.159 1.624 4.568 793 1HD2 LEU 101 1HD2 LEU 101 2.856 -1.195 2.306 794 2HD2 LEU 101 2HD2 LEU 101 2.843 0.490 1.783 795 3HD2 LEU 101 3HD2 LEU 101 1.613 -0.096 2.903 796 H VAL 102 H VAL 102 4.438 3.038 1.369 797 HA VAL 102 HA VAL 102 5.863 4.715 3.315 798 HB VAL 102 HB VAL 102 6.044 6.515 1.609 799 1HG1 VAL 102 1HG1 VAL 102 7.480 3.952 0.925 800 2HG1 VAL 102 2HG1 VAL 102 7.978 5.141 2.127 801 3HG1 VAL 102 3HG1 VAL 102 7.968 5.569 0.416 802 1HG2 VAL 102 1HG2 VAL 102 5.226 4.332 -0.303 803 2HG2 VAL 102 2HG2 VAL 102 5.891 5.896 -0.774 804 3HG2 VAL 102 3HG2 VAL 102 4.338 5.813 0.054 805 H GLU 103 H GLU 103 4.748 6.451 4.118 806 HA GLU 103 HA GLU 103 1.867 6.456 3.522 807 1HB GLU 103 1HB GLU 103 2.578 5.767 5.822 808 2HB GLU 103 2HB GLU 103 3.265 7.369 6.042 809 1HG GLU 103 1HG GLU 103 1.091 8.377 5.852 810 2HG GLU 103 2HG GLU 103 0.367 6.814 5.474 811 H VAL 104 H VAL 104 1.061 8.204 2.589 812 HA VAL 104 HA VAL 104 2.778 10.569 2.362 813 HB VAL 104 HB VAL 104 2.084 9.598 0.250 814 1HG1 VAL 104 1HG1 VAL 104 0.021 8.535 1.013 815 2HG1 VAL 104 2HG1 VAL 104 -0.220 9.483 -0.454 816 3HG1 VAL 104 3HG1 VAL 104 -0.750 10.119 1.104 817 1HG2 VAL 104 1HG2 VAL 104 0.624 12.187 0.724 818 2HG2 VAL 104 2HG2 VAL 104 1.166 11.558 -0.832 819 3HG2 VAL 104 3HG2 VAL 104 2.347 12.038 0.388 820 H ARG 105 H ARG 105 2.180 12.540 3.098 821 HA ARG 105 HA ARG 105 -0.048 12.549 4.980 822 1HB ARG 105 1HB ARG 105 2.500 13.389 5.243 823 2HB ARG 105 2HB ARG 105 1.757 14.892 4.727 824 1HG ARG 105 1HG ARG 105 0.694 13.295 7.036 825 2HG ARG 105 2HG ARG 105 1.975 14.491 7.222 826 1HD ARG 105 1HD ARG 105 0.482 16.211 6.302 827 2HD ARG 105 2HD ARG 105 -0.797 15.004 6.151 828 HE ARG 105 HE ARG 105 -0.122 14.847 8.761 829 1HH1 ARG 105 1HH1 ARG 105 -1.034 17.535 6.696 830 2HH1 ARG 105 2HH1 ARG 105 -1.725 18.458 7.998 831 1HH2 ARG 105 1HH2 ARG 105 -1.015 16.073 10.459 832 2HH2 ARG 105 2HH2 ARG 105 -1.695 17.638 10.137 833 H ASP 106 H ASP 106 0.584 13.617 1.820 834 HA ASP 106 HA ASP 106 -1.363 15.804 2.089 835 1HB ASP 106 1HB ASP 106 1.037 16.241 1.212 836 2HB ASP 106 2HB ASP 106 0.450 15.502 -0.279 837 H GLU 107 H GLU 107 -3.145 15.886 0.837 838 HA GLU 107 HA GLU 107 -4.092 13.381 -0.160 839 1HB GLU 107 1HB GLU 107 -5.258 15.718 0.795 840 2HB GLU 107 2HB GLU 107 -5.714 15.676 -0.902 841 1HG GLU 107 1HG GLU 107 -7.423 14.588 0.318 842 2HG GLU 107 2HG GLU 107 -6.519 13.338 -0.537 843 H LYS 108 H LYS 108 -2.438 16.022 -1.596 844 HA LYS 108 HA LYS 108 -3.564 16.088 -4.144 845 1HB LYS 108 1HB LYS 108 -0.986 16.907 -2.950 846 2HB LYS 108 2HB LYS 108 -1.028 16.744 -4.700 847 1HG LYS 108 1HG LYS 108 -2.901 18.440 -3.067 848 2HG LYS 108 2HG LYS 108 -1.506 19.028 -3.972 849 1HD LYS 108 1HD LYS 108 -2.493 18.230 -6.046 850 2HD LYS 108 2HD LYS 108 -3.872 17.583 -5.159 851 1HE LYS 108 1HE LYS 108 -4.465 19.692 -6.176 852 2HE LYS 108 2HE LYS 108 -4.438 19.855 -4.422 853 1HZ LYS 108 1HZ LYS 108 -2.188 20.651 -6.187 854 2HZ LYS 108 2HZ LYS 108 -2.350 20.966 -4.528 855 3HZ LYS 108 3HZ LYS 108 -3.386 21.718 -5.639 856 H PHE 109 H PHE 109 -1.379 13.775 -2.752 857 HA PHE 109 HA PHE 109 -0.362 12.668 -5.125 858 1HB PHE 109 1HB PHE 109 0.587 12.113 -2.941 859 2HB PHE 109 2HB PHE 109 -0.913 11.320 -2.470 860 HD1 PHE 109 HD1 PHE 109 -1.125 9.040 -2.770 861 HD2 PHE 109 HD2 PHE 109 1.735 11.177 -5.090 862 HE1 PHE 109 HE1 PHE 109 -0.303 6.921 -3.712 863 HE2 PHE 109 HE2 PHE 109 2.560 9.062 -6.031 864 HZ PHE 109 HZ PHE 109 1.542 6.931 -5.341 865 H PHE 110 H PHE 110 -3.319 12.035 -3.304 866 HA PHE 110 HA PHE 110 -4.076 9.777 -4.897 867 1HB PHE 110 1HB PHE 110 -5.700 11.415 -2.943 868 2HB PHE 110 2HB PHE 110 -6.168 9.854 -3.610 869 HD1 PHE 110 HD1 PHE 110 -4.943 7.817 -2.967 870 HD2 PHE 110 HD2 PHE 110 -4.110 11.593 -1.190 871 HE1 PHE 110 HE1 PHE 110 -3.720 6.691 -1.153 872 HE2 PHE 110 HE2 PHE 110 -2.888 10.474 0.623 873 HZ PHE 110 HZ PHE 110 -2.683 8.023 0.641 874 H GLU 111 H GLU 111 -4.606 13.186 -5.028 875 HA GLU 111 HA GLU 111 -6.743 13.133 -6.921 876 1HB GLU 111 1HB GLU 111 -5.184 15.099 -5.506 877 2HB GLU 111 2HB GLU 111 -5.309 15.530 -7.204 878 1HG GLU 111 1HG GLU 111 -7.642 14.880 -5.423 879 2HG GLU 111 2HG GLU 111 -7.087 16.504 -5.814 880 H ALA 112 H ALA 112 -3.251 13.114 -7.067 881 HA ALA 112 HA ALA 112 -3.174 13.609 -9.913 882 1HB ALA 112 1HB ALA 112 -0.944 12.834 -8.041 883 2HB ALA 112 2HB ALA 112 -1.425 14.485 -8.433 884 3HB ALA 112 3HB ALA 112 -0.766 13.435 -9.688 885 H VAL 113 H VAL 113 -2.728 10.839 -7.741 886 HA VAL 113 HA VAL 113 -1.861 9.141 -9.889 887 HB VAL 113 HB VAL 113 -1.033 8.809 -7.576 888 1HG1 VAL 113 1HG1 VAL 113 -2.422 7.649 -5.934 889 2HG1 VAL 113 2HG1 VAL 113 -3.810 7.783 -7.014 890 3HG1 VAL 113 3HG1 VAL 113 -3.082 9.236 -6.333 891 1HG2 VAL 113 1HG2 VAL 113 -0.848 7.022 -9.191 892 2HG2 VAL 113 2HG2 VAL 113 -2.474 6.465 -8.799 893 3HG2 VAL 113 3HG2 VAL 113 -1.191 6.355 -7.594 894 H LYS 114 H LYS 114 -3.056 8.100 -11.253 895 HA LYS 114 HA LYS 114 -5.725 7.179 -10.453 896 1HB LYS 114 1HB LYS 114 -4.975 8.430 -13.110 897 2HB LYS 114 2HB LYS 114 -6.506 7.628 -12.786 898 1HG LYS 114 1HG LYS 114 -5.494 10.072 -11.340 899 2HG LYS 114 2HG LYS 114 -6.667 10.078 -12.661 900 1HD LYS 114 1HD LYS 114 -8.259 8.881 -11.361 901 2HD LYS 114 2HD LYS 114 -7.070 8.540 -10.104 902 1HE LYS 114 1HE LYS 114 -8.620 10.309 -9.432 903 2HE LYS 114 2HE LYS 114 -6.963 10.895 -9.537 904 1HZ LYS 114 1HZ LYS 114 -8.876 11.218 -11.772 905 2HZ LYS 114 2HZ LYS 114 -7.420 12.050 -11.501 906 3HZ LYS 114 3HZ LYS 114 -8.767 12.346 -10.513 907 H THR 115 H THR 115 -6.385 5.230 -11.551 908 HA THR 115 HA THR 115 -4.321 3.355 -11.741 909 HB THR 115 HB THR 115 -7.137 3.106 -12.828 910 HG1 THR 115 HG1 THR 115 -7.706 2.524 -10.812 911 1HG2 THR 115 1HG2 THR 115 -5.128 0.988 -12.044 912 2HG2 THR 115 2HG2 THR 115 -5.623 1.381 -13.690 913 3HG2 THR 115 3HG2 THR 115 -6.789 0.694 -12.559 914 H GLY 116 H GLY 116 -2.822 3.256 -13.378 915 1HA GLY 116 1HA GLY 116 -3.043 2.353 -15.804 916 2HA GLY 116 2HA GLY 116 -3.728 3.940 -16.093 917 H ASP 117 H ASP 117 -1.774 5.250 -14.236 918 HA ASP 117 HA ASP 117 0.306 5.423 -16.281 919 1HB ASP 117 1HB ASP 117 -1.054 7.395 -14.993 920 2HB ASP 117 2HB ASP 117 0.430 7.328 -14.041 921 H ARG 118 H ARG 118 2.464 6.451 -14.843 922 HA ARG 118 HA ARG 118 3.229 3.966 -13.450 923 1HB ARG 118 1HB ARG 118 4.338 4.197 -15.596 924 2HB ARG 118 2HB ARG 118 4.906 5.803 -15.159 925 1HG ARG 118 1HG ARG 118 6.328 4.892 -13.447 926 2HG ARG 118 2HG ARG 118 5.681 3.272 -13.722 927 1HD ARG 118 1HD ARG 118 7.857 3.543 -14.788 928 2HD ARG 118 2HD ARG 118 6.591 3.287 -15.987 929 HE ARG 118 HE ARG 118 7.068 6.062 -15.543 930 1HH1 ARG 118 1HH1 ARG 118 8.284 3.224 -17.203 931 2HH1 ARG 118 2HH1 ARG 118 9.133 4.136 -18.420 932 1HH2 ARG 118 1HH2 ARG 118 8.189 7.267 -17.155 933 2HH2 ARG 118 2HH2 ARG 118 9.098 6.434 -18.374 934 H VAL 119 H VAL 119 3.825 4.104 -11.416 935 HA VAL 119 HA VAL 119 4.884 6.669 -10.422 936 HB VAL 119 HB VAL 119 3.242 4.661 -8.859 937 1HG1 VAL 119 1HG1 VAL 119 4.908 5.715 -7.452 938 2HG1 VAL 119 2HG1 VAL 119 3.304 6.335 -7.060 939 3HG1 VAL 119 3HG1 VAL 119 4.414 7.309 -8.021 940 1HG2 VAL 119 1HG2 VAL 119 1.535 6.401 -8.758 941 2HG2 VAL 119 2HG2 VAL 119 1.884 5.954 -10.430 942 3HG2 VAL 119 3HG2 VAL 119 2.535 7.452 -9.761 943 H VAL 120 H VAL 120 6.945 6.524 -9.887 944 HA VAL 120 HA VAL 120 8.148 3.927 -9.343 945 HB VAL 120 HB VAL 120 9.456 6.652 -9.489 946 1HG1 VAL 120 1HG1 VAL 120 11.547 5.400 -9.688 947 2HG1 VAL 120 2HG1 VAL 120 10.664 3.887 -9.487 948 3HG1 VAL 120 3HG1 VAL 120 10.733 5.050 -8.163 949 1HG2 VAL 120 1HG2 VAL 120 9.259 4.469 -11.560 950 2HG2 VAL 120 2HG2 VAL 120 10.243 5.927 -11.704 951 3HG2 VAL 120 3HG2 VAL 120 8.485 6.054 -11.627 952 H VAL 121 H VAL 121 8.054 3.183 -7.346 953 HA VAL 121 HA VAL 121 7.792 5.069 -5.129 954 HB VAL 121 HB VAL 121 7.515 2.064 -5.087 955 1HG1 VAL 121 1HG1 VAL 121 6.397 2.424 -2.942 956 2HG1 VAL 121 2HG1 VAL 121 6.700 4.154 -3.072 957 3HG1 VAL 121 3HG1 VAL 121 8.051 3.034 -2.911 958 1HG2 VAL 121 1HG2 VAL 121 5.096 2.460 -5.052 959 2HG2 VAL 121 2HG2 VAL 121 5.836 3.050 -6.541 960 3HG2 VAL 121 3HG2 VAL 121 5.382 4.186 -5.271 961 H ASN 122 H ASN 122 9.668 5.740 -4.330 962 HA ASN 122 HA ASN 122 11.827 3.759 -4.006 963 1HB ASN 122 1HB ASN 122 12.352 5.739 -5.443 964 2HB ASN 122 2HB ASN 122 12.042 6.784 -4.062 965 1HD2 ASN 122 1HD2 ASN 122 14.472 6.206 -5.725 966 2HD2 ASN 122 2HD2 ASN 122 15.703 5.803 -4.570 967 H ALA 123 H ALA 123 11.461 2.905 -2.032 968 HA ALA 123 HA ALA 123 10.582 4.600 0.163 969 1HB ALA 123 1HB ALA 123 10.346 2.527 1.413 970 2HB ALA 123 2HB ALA 123 11.102 1.633 0.093 971 3HB ALA 123 3HB ALA 123 9.538 2.414 -0.150 972 H ASP 124 H ASP 124 13.498 3.566 -1.154 973 HA ASP 124 HA ASP 124 15.130 3.379 1.146 974 1HB ASP 124 1HB ASP 124 15.897 4.487 -1.570 975 2HB ASP 124 2HB ASP 124 17.003 3.892 -0.339 976 H GLU 125 H GLU 125 14.235 6.054 -0.961 977 HA GLU 125 HA GLU 125 15.428 8.005 0.843 978 1HB GLU 125 1HB GLU 125 13.985 8.400 -1.786 979 2HB GLU 125 2HB GLU 125 14.909 9.617 -0.917 980 1HG GLU 125 1HG GLU 125 16.096 7.070 -1.988 981 2HG GLU 125 2HG GLU 125 16.069 8.592 -2.876 982 H GLY 126 H GLY 126 12.304 6.790 -0.146 983 1HA GLY 126 1HA GLY 126 10.280 7.089 1.030 984 2HA GLY 126 2HA GLY 126 10.996 8.465 1.863 985 H TYR 127 H TYR 127 10.203 7.479 -1.466 986 HA TYR 127 HA TYR 127 9.115 10.135 -1.989 987 1HB TYR 127 1HB TYR 127 11.778 9.410 -2.660 988 2HB TYR 127 2HB TYR 127 10.861 9.447 -4.160 989 HD1 TYR 127 HD1 TYR 127 10.020 11.516 -5.047 990 HD2 TYR 127 HD2 TYR 127 12.067 11.442 -1.319 991 HE1 TYR 127 HE1 TYR 127 10.240 13.963 -5.128 992 HE2 TYR 127 HE2 TYR 127 12.291 13.891 -1.386 993 HH TYR 127 HH TYR 127 12.306 15.702 -3.097 994 H VAL 128 H VAL 128 7.623 10.149 -3.618 995 HA VAL 128 HA VAL 128 7.308 7.663 -5.160 996 HB VAL 128 HB VAL 128 4.833 8.261 -5.294 997 1HG1 VAL 128 1HG1 VAL 128 5.639 6.397 -3.968 998 2HG1 VAL 128 2HG1 VAL 128 4.340 7.226 -3.112 999 3HG1 VAL 128 3HG1 VAL 128 6.015 7.481 -2.627 1000 1HG2 VAL 128 1HG2 VAL 128 4.999 10.569 -4.490 1001 2HG2 VAL 128 2HG2 VAL 128 5.561 9.985 -2.924 1002 3HG2 VAL 128 3HG2 VAL 128 3.925 9.615 -3.467 1003 H GLU 129 H GLU 129 8.004 8.077 -7.128 1004 HA GLU 129 HA GLU 129 7.768 10.790 -8.194 1005 1HB GLU 129 1HB GLU 129 9.332 8.445 -9.281 1006 2HB GLU 129 2HB GLU 129 9.456 10.120 -9.804 1007 1HG GLU 129 1HG GLU 129 10.331 10.743 -7.610 1008 2HG GLU 129 2HG GLU 129 10.201 9.065 -7.084 1009 H LEU 130 H LEU 130 5.904 11.125 -9.230 1010 HA LEU 130 HA LEU 130 4.630 9.035 -10.764 1011 1HB LEU 130 1HB LEU 130 3.253 10.660 -9.580 1012 2HB LEU 130 2HB LEU 130 3.996 11.976 -10.470 1013 HG LEU 130 HG LEU 130 3.031 10.999 -12.572 1014 1HD1 LEU 130 1HD1 LEU 130 1.194 9.406 -12.355 1015 2HD1 LEU 130 2HD1 LEU 130 1.523 9.260 -10.627 1016 3HD1 LEU 130 3HD1 LEU 130 2.720 8.716 -11.801 1017 1HD2 LEU 130 1HD2 LEU 130 1.044 11.750 -10.429 1018 2HD2 LEU 130 2HD2 LEU 130 0.786 11.840 -12.172 1019 3HD2 LEU 130 3HD2 LEU 130 1.983 12.881 -11.404 1020 H ILE 131 H ILE 131 5.412 8.482 -12.684 1021 HA ILE 131 HA ILE 131 6.680 10.588 -14.311 1022 HB ILE 131 HB ILE 131 7.237 7.650 -14.569 1023 1HG1 ILE 131 1HG1 ILE 131 7.943 8.407 -12.322 1024 2HG1 ILE 131 2HG1 ILE 131 9.321 7.997 -13.337 1025 1HG2 ILE 131 1HG2 ILE 131 9.210 8.411 -15.801 1026 2HG2 ILE 131 2HG2 ILE 131 8.704 10.083 -15.562 1027 3HG2 ILE 131 3HG2 ILE 131 7.716 8.993 -16.535 1028 1HD1 ILE 131 1HD1 ILE 131 8.320 10.782 -12.786 1029 2HD1 ILE 131 2HD1 ILE 131 9.726 10.356 -13.762 1030 3HD1 ILE 131 3HD1 ILE 131 9.718 10.016 -12.031 1031 H GLU 132 H GLU 132 5.589 11.116 -15.984 1032 HA GLU 132 HA GLU 132 3.106 9.861 -16.535 1033 1HB GLU 132 1HB GLU 132 4.541 12.148 -17.877 1034 2HB GLU 132 2HB GLU 132 2.889 11.660 -18.245 1035 1HG GLU 132 1HG GLU 132 2.074 12.404 -16.232 1036 2HG GLU 132 2HG GLU 132 3.633 12.262 -15.422 Start of MODEL 2 1 H VAL 1 H VAL 1 4.928 13.809 -12.231 2 HA VAL 1 HA VAL 1 5.344 16.238 -10.613 3 HB VAL 1 HB VAL 1 2.975 14.384 -10.303 4 1HG1 VAL 1 1HG1 VAL 1 2.111 16.149 -8.837 5 2HG1 VAL 1 2HG1 VAL 1 3.597 17.068 -9.075 6 3HG1 VAL 1 3HG1 VAL 1 3.648 15.508 -8.252 7 1HG2 VAL 1 1HG2 VAL 1 1.608 16.215 -11.226 8 2HG2 VAL 1 2HG2 VAL 1 2.747 15.567 -12.407 9 3HG2 VAL 1 3HG2 VAL 1 3.084 17.104 -11.609 10 H LYS 2 H LYS 2 6.280 15.871 -8.636 11 HA LYS 2 HA LYS 2 6.676 13.055 -7.881 12 1HB LYS 2 1HB LYS 2 8.746 15.243 -7.631 13 2HB LYS 2 2HB LYS 2 8.955 13.548 -7.213 14 1HG LYS 2 1HG LYS 2 8.536 13.006 -9.628 15 2HG LYS 2 2HG LYS 2 8.619 14.739 -9.954 16 1HD LYS 2 1HD LYS 2 10.876 14.790 -8.990 17 2HD LYS 2 2HD LYS 2 10.785 13.052 -8.714 18 1HE LYS 2 1HE LYS 2 10.318 12.896 -11.240 19 2HE LYS 2 2HE LYS 2 10.945 14.543 -11.309 20 1HZ LYS 2 1HZ LYS 2 12.350 12.087 -10.440 21 2HZ LYS 2 2HZ LYS 2 12.949 13.638 -10.099 22 3HZ LYS 2 3HZ LYS 2 12.767 13.133 -11.706 23 H PHE 3 H PHE 3 6.741 12.599 -5.680 24 HA PHE 3 HA PHE 3 6.045 14.830 -3.884 25 1HB PHE 3 1HB PHE 3 4.768 12.082 -3.890 26 2HB PHE 3 2HB PHE 3 4.451 13.352 -2.718 27 HD1 PHE 3 HD1 PHE 3 3.774 12.104 -6.059 28 HD2 PHE 3 HD2 PHE 3 3.175 15.348 -3.365 29 HE1 PHE 3 HE1 PHE 3 1.944 12.939 -7.475 30 HE2 PHE 3 HE2 PHE 3 1.346 16.186 -4.780 31 HZ PHE 3 HZ PHE 3 0.727 14.981 -6.834 32 H ALA 4 H ALA 4 6.457 14.351 -1.605 33 HA ALA 4 HA ALA 4 8.632 12.403 -1.255 34 1HB ALA 4 1HB ALA 4 8.035 14.878 0.370 35 2HB ALA 4 2HB ALA 4 9.291 14.733 -0.858 36 3HB ALA 4 3HB ALA 4 9.387 13.773 0.619 37 H CYS 5 H CYS 5 8.248 10.705 0.025 38 HA CYS 5 HA CYS 5 5.932 10.839 1.834 39 1HB CYS 5 1HB CYS 5 5.813 8.324 1.444 40 2HB CYS 5 2HB CYS 5 5.328 9.348 0.099 41 HG CYS 5 HG CYS 5 6.910 8.287 -1.613 42 H ARG 6 H ARG 6 6.110 9.127 3.615 43 HA ARG 6 HA ARG 6 8.764 9.468 4.792 44 1HB ARG 6 1HB ARG 6 6.882 10.206 6.128 45 2HB ARG 6 2HB ARG 6 6.124 8.626 5.996 46 1HG ARG 6 1HG ARG 6 7.872 7.630 7.317 47 2HG ARG 6 2HG ARG 6 8.746 9.164 7.375 48 1HD ARG 6 1HD ARG 6 7.053 10.183 8.676 49 2HD ARG 6 2HD ARG 6 5.931 8.858 8.384 50 HE ARG 6 HE ARG 6 8.394 8.355 9.899 51 1HH1 ARG 6 1HH1 ARG 6 4.898 8.525 9.719 52 2HH1 ARG 6 2HH1 ARG 6 4.655 7.789 11.277 53 1HH2 ARG 6 1HH2 ARG 6 8.063 7.363 11.957 54 2HH2 ARG 6 2HH2 ARG 6 6.442 7.103 12.520 55 H ALA 7 H ALA 7 10.172 7.893 4.863 56 HA ALA 7 HA ALA 7 9.580 5.367 3.673 57 1HB ALA 7 1HB ALA 7 12.086 6.277 5.080 58 2HB ALA 7 2HB ALA 7 11.739 6.484 3.362 59 3HB ALA 7 3HB ALA 7 11.927 4.864 4.036 60 H ILE 8 H ILE 8 8.288 4.060 4.837 61 HA ILE 8 HA ILE 8 8.890 3.572 7.656 62 HB ILE 8 HB ILE 8 6.607 2.558 5.947 63 1HG1 ILE 8 1HG1 ILE 8 6.476 4.963 6.320 64 2HG1 ILE 8 2HG1 ILE 8 5.239 4.143 7.263 65 1HG2 ILE 8 1HG2 ILE 8 7.078 0.989 7.724 66 2HG2 ILE 8 2HG2 ILE 8 5.593 1.868 8.093 67 3HG2 ILE 8 3HG2 ILE 8 7.096 2.293 8.909 68 1HD1 ILE 8 1HD1 ILE 8 7.859 5.180 8.319 69 2HD1 ILE 8 2HD1 ILE 8 6.608 4.372 9.266 70 3HD1 ILE 8 3HD1 ILE 8 6.281 5.939 8.524 71 H THR 9 H THR 9 8.629 1.866 4.572 72 HA THR 9 HA THR 9 10.102 -0.388 5.750 73 HB THR 9 HB THR 9 9.304 -1.650 3.713 74 HG1 THR 9 HG1 THR 9 7.466 0.508 3.469 75 1HG2 THR 9 1HG2 THR 9 7.169 -0.534 5.539 76 2HG2 THR 9 2HG2 THR 9 8.207 -1.918 5.885 77 3HG2 THR 9 3HG2 THR 9 7.037 -2.002 4.571 78 H ARG 10 H ARG 10 11.019 -1.502 3.313 79 HA ARG 10 HA ARG 10 12.772 0.576 2.222 80 1HB ARG 10 1HB ARG 10 13.774 -2.105 3.202 81 2HB ARG 10 2HB ARG 10 14.744 -0.780 2.565 82 1HG ARG 10 1HG ARG 10 14.329 0.563 4.461 83 2HG ARG 10 2HG ARG 10 13.058 -0.510 5.034 84 1HD ARG 10 1HD ARG 10 14.947 -2.279 5.144 85 2HD ARG 10 2HD ARG 10 16.022 -0.881 5.103 86 HE ARG 10 HE ARG 10 13.941 -0.628 7.063 87 1HH1 ARG 10 1HH1 ARG 10 17.173 -1.863 6.477 88 2HH1 ARG 10 2HH1 ARG 10 17.536 -2.068 8.166 89 1HH2 ARG 10 1HH2 ARG 10 14.423 -0.853 9.260 90 2HH2 ARG 10 2HH2 ARG 10 15.961 -1.488 9.761 91 H GLY 11 H GLY 11 13.979 -0.267 0.259 92 1HA GLY 11 1HA GLY 11 14.027 -1.834 -1.571 93 2HA GLY 11 2HA GLY 11 12.392 -2.324 -1.147 94 H ARG 12 H ARG 12 13.119 -1.604 -3.770 95 HA ARG 12 HA ARG 12 11.296 0.637 -4.137 96 1HB ARG 12 1HB ARG 12 12.818 1.799 -5.696 97 2HB ARG 12 2HB ARG 12 13.436 1.766 -4.053 98 1HG ARG 12 1HG ARG 12 14.928 -0.084 -4.663 99 2HG ARG 12 2HG ARG 12 14.322 -0.006 -6.320 100 1HD ARG 12 1HD ARG 12 15.122 2.297 -6.506 101 2HD ARG 12 2HD ARG 12 15.719 2.227 -4.848 102 HE ARG 12 HE ARG 12 17.001 0.163 -5.984 103 1HH1 ARG 12 1HH1 ARG 12 16.602 3.500 -7.010 104 2HH1 ARG 12 2HH1 ARG 12 18.118 3.538 -7.867 105 1HH2 ARG 12 1HH2 ARG 12 18.983 0.229 -7.067 106 2HH2 ARG 12 2HH2 ARG 12 19.477 1.682 -7.888 107 H ALA 13 H ALA 13 10.447 0.812 -6.279 108 HA ALA 13 HA ALA 13 11.091 -1.138 -8.281 109 1HB ALA 13 1HB ALA 13 9.015 -2.381 -8.253 110 2HB ALA 13 2HB ALA 13 8.441 -1.444 -6.874 111 3HB ALA 13 3HB ALA 13 9.815 -2.532 -6.688 112 H GLU 14 H GLU 14 9.619 -0.981 -10.160 113 HA GLU 14 HA GLU 14 8.113 1.548 -10.272 114 1HB GLU 14 1HB GLU 14 10.201 1.874 -11.506 115 2HB GLU 14 2HB GLU 14 9.923 0.389 -12.410 116 1HG GLU 14 1HG GLU 14 7.810 1.466 -13.280 117 2HG GLU 14 2HG GLU 14 8.399 2.974 -12.584 118 H GLY 15 H GLY 15 6.045 1.252 -10.920 119 1HA GLY 15 1HA GLY 15 5.401 -0.893 -12.757 120 2HA GLY 15 2HA GLY 15 4.758 -1.098 -11.135 121 H GLU 16 H GLU 16 2.907 -1.079 -12.892 122 HA GLU 16 HA GLU 16 1.912 1.498 -13.617 123 1HB GLU 16 1HB GLU 16 1.374 -0.589 -14.850 124 2HB GLU 16 2HB GLU 16 0.468 -1.154 -13.453 125 1HG GLU 16 1HG GLU 16 -1.035 0.795 -13.696 126 2HG GLU 16 2HG GLU 16 -0.164 1.237 -15.167 127 H ALA 17 H ALA 17 0.388 2.735 -12.623 128 HA ALA 17 HA ALA 17 0.054 2.323 -9.794 129 1HB ALA 17 1HB ALA 17 -1.054 4.503 -11.559 130 2HB ALA 17 2HB ALA 17 0.501 4.550 -10.729 131 3HB ALA 17 3HB ALA 17 -0.994 4.509 -9.796 132 H LEU 18 H LEU 18 -1.535 1.245 -8.908 133 HA LEU 18 HA LEU 18 -4.148 1.180 -10.264 134 1HB LEU 18 1HB LEU 18 -2.861 -1.025 -9.988 135 2HB LEU 18 2HB LEU 18 -3.151 -0.857 -8.270 136 HG LEU 18 HG LEU 18 -5.407 -0.929 -10.269 137 1HD1 LEU 18 1HD1 LEU 18 -5.629 -3.306 -9.781 138 2HD1 LEU 18 2HD1 LEU 18 -4.166 -3.248 -8.797 139 3HD1 LEU 18 3HD1 LEU 18 -4.074 -2.958 -10.535 140 1HD2 LEU 18 1HD2 LEU 18 -5.982 -0.079 -8.056 141 2HD2 LEU 18 2HD2 LEU 18 -5.261 -1.504 -7.307 142 3HD2 LEU 18 3HD2 LEU 18 -6.700 -1.671 -8.312 143 H VAL 19 H VAL 19 -5.619 2.377 -9.227 144 HA VAL 19 HA VAL 19 -4.966 3.212 -6.497 145 HB VAL 19 HB VAL 19 -5.137 5.033 -8.108 146 1HG1 VAL 19 1HG1 VAL 19 -7.257 5.629 -9.164 147 2HG1 VAL 19 2HG1 VAL 19 -7.993 4.163 -8.517 148 3HG1 VAL 19 3HG1 VAL 19 -6.690 4.048 -9.699 149 1HG2 VAL 19 1HG2 VAL 19 -7.449 5.044 -6.177 150 2HG2 VAL 19 2HG2 VAL 19 -6.682 6.460 -6.898 151 3HG2 VAL 19 3HG2 VAL 19 -5.775 5.437 -5.785 152 H THR 20 H THR 20 -6.137 2.553 -4.847 153 HA THR 20 HA THR 20 -8.613 1.100 -5.403 154 HB THR 20 HB THR 20 -7.151 1.287 -2.765 155 HG1 THR 20 HG1 THR 20 -6.496 -0.042 -5.065 156 1HG2 THR 20 1HG2 THR 20 -9.462 0.513 -2.619 157 2HG2 THR 20 2HG2 THR 20 -8.345 -0.811 -2.288 158 3HG2 THR 20 3HG2 THR 20 -9.146 -0.704 -3.858 159 H LYS 21 H LYS 21 -10.119 2.643 -5.687 160 HA LYS 21 HA LYS 21 -10.330 4.937 -3.951 161 1HB LYS 21 1HB LYS 21 -12.267 5.512 -5.369 162 2HB LYS 21 2HB LYS 21 -10.838 5.150 -6.329 163 1HG LYS 21 1HG LYS 21 -11.716 2.871 -6.704 164 2HG LYS 21 2HG LYS 21 -13.181 3.324 -5.835 165 1HD LYS 21 1HD LYS 21 -13.591 5.094 -7.496 166 2HD LYS 21 2HD LYS 21 -12.143 4.586 -8.372 167 1HE LYS 21 1HE LYS 21 -14.035 3.596 -9.448 168 2HE LYS 21 2HE LYS 21 -13.166 2.320 -8.597 169 1HZ LYS 21 1HZ LYS 21 -15.470 2.019 -8.193 170 2HZ LYS 21 2HZ LYS 21 -15.684 3.647 -7.762 171 3HZ LYS 21 3HZ LYS 21 -14.801 2.615 -6.745 172 H GLU 22 H GLU 22 -11.143 1.811 -3.565 173 HA GLU 22 HA GLU 22 -13.723 2.318 -2.271 174 1HB GLU 22 1HB GLU 22 -12.437 -0.321 -2.984 175 2HB GLU 22 2HB GLU 22 -14.064 -0.092 -2.365 176 1HG GLU 22 1HG GLU 22 -13.053 0.909 -5.019 177 2HG GLU 22 2HG GLU 22 -14.037 -0.533 -4.769 178 H TYR 23 H TYR 23 -13.864 2.297 -0.122 179 HA TYR 23 HA TYR 23 -11.603 1.457 1.492 180 1HB TYR 23 1HB TYR 23 -14.311 2.587 2.254 181 2HB TYR 23 2HB TYR 23 -13.056 2.162 3.415 182 HD1 TYR 23 HD1 TYR 23 -11.094 3.541 3.692 183 HD2 TYR 23 HD2 TYR 23 -14.040 4.521 0.779 184 HE1 TYR 23 HE1 TYR 23 -10.102 5.778 3.448 185 HE2 TYR 23 HE2 TYR 23 -13.054 6.757 0.530 186 HH TYR 23 HH TYR 23 -11.677 8.295 1.669 187 H ILE 24 H ILE 24 -11.381 -0.706 1.566 188 HA ILE 24 HA ILE 24 -13.843 -2.296 1.858 189 HB ILE 24 HB ILE 24 -12.554 -4.116 0.613 190 1HG1 ILE 24 1HG1 ILE 24 -10.943 -3.071 -1.111 191 2HG1 ILE 24 2HG1 ILE 24 -10.826 -1.719 0.006 192 1HG2 ILE 24 1HG2 ILE 24 -13.216 -3.206 -1.576 193 2HG2 ILE 24 2HG2 ILE 24 -13.428 -1.623 -0.830 194 3HG2 ILE 24 3HG2 ILE 24 -14.451 -2.972 -0.338 195 1HD1 ILE 24 1HD1 ILE 24 -10.082 -4.575 0.601 196 2HD1 ILE 24 2HD1 ILE 24 -9.971 -3.225 1.731 197 3HD1 ILE 24 3HD1 ILE 24 -8.967 -3.246 0.280 198 H SER 25 H SER 25 -13.337 -4.596 2.578 199 HA SER 25 HA SER 25 -11.863 -4.454 5.044 200 1HB SER 25 1HB SER 25 -12.614 -6.844 5.275 201 2HB SER 25 2HB SER 25 -13.931 -5.696 5.035 202 HG SER 25 HG SER 25 -12.882 -6.729 2.703 203 H PHE 26 H PHE 26 -9.782 -4.934 5.293 204 HA PHE 26 HA PHE 26 -8.292 -5.986 3.039 205 1HB PHE 26 1HB PHE 26 -7.590 -4.005 4.512 206 2HB PHE 26 2HB PHE 26 -7.188 -5.199 5.739 207 HD1 PHE 26 HD1 PHE 26 -4.993 -5.864 5.860 208 HD2 PHE 26 HD2 PHE 26 -6.557 -4.592 2.112 209 HE1 PHE 26 HE1 PHE 26 -2.776 -6.166 4.836 210 HE2 PHE 26 HE2 PHE 26 -4.343 -4.891 1.083 211 HZ PHE 26 HZ PHE 26 -2.450 -5.681 2.445 212 H LEU 27 H LEU 27 -10.136 -7.720 4.453 213 HA LEU 27 HA LEU 27 -8.726 -9.568 6.088 214 1HB LEU 27 1HB LEU 27 -11.241 -9.212 5.925 215 2HB LEU 27 2HB LEU 27 -11.191 -10.094 4.417 216 HG LEU 27 HG LEU 27 -11.921 -11.338 6.545 217 1HD1 LEU 27 1HD1 LEU 27 -11.465 -12.454 4.426 218 2HD1 LEU 27 2HD1 LEU 27 -10.911 -13.420 5.795 219 3HD1 LEU 27 3HD1 LEU 27 -9.748 -12.516 4.823 220 1HD2 LEU 27 1HD2 LEU 27 -10.116 -10.557 7.987 221 2HD2 LEU 27 2HD2 LEU 27 -8.933 -11.360 6.955 222 3HD2 LEU 27 3HD2 LEU 27 -10.109 -12.317 7.857 223 H GLY 28 H GLY 28 -8.996 -9.012 2.714 224 1HA GLY 28 1HA GLY 28 -6.823 -10.579 1.994 225 2HA GLY 28 2HA GLY 28 -8.259 -11.563 1.737 226 H GLY 29 H GLY 29 -9.385 -11.296 -0.084 227 1HA GLY 29 1HA GLY 29 -10.410 -10.030 -1.795 228 2HA GLY 29 2HA GLY 29 -9.237 -8.751 -1.509 229 H ILE 30 H ILE 30 -6.879 -9.936 -1.685 230 HA ILE 30 HA ILE 30 -6.709 -10.622 -4.507 231 HB ILE 30 HB ILE 30 -4.548 -10.147 -2.435 232 1HG1 ILE 30 1HG1 ILE 30 -4.117 -8.138 -3.991 233 2HG1 ILE 30 2HG1 ILE 30 -5.727 -8.440 -4.623 234 1HG2 ILE 30 1HG2 ILE 30 -2.972 -10.141 -4.314 235 2HG2 ILE 30 2HG2 ILE 30 -4.279 -10.615 -5.399 236 3HG2 ILE 30 3HG2 ILE 30 -3.762 -11.707 -4.116 237 1HD1 ILE 30 1HD1 ILE 30 -5.757 -6.692 -2.949 238 2HD1 ILE 30 2HD1 ILE 30 -5.032 -7.783 -1.768 239 3HD1 ILE 30 3HD1 ILE 30 -6.654 -8.101 -2.384 240 H ASP 31 H ASP 31 -6.428 -12.660 -5.244 241 HA ASP 31 HA ASP 31 -6.397 -14.820 -3.346 242 1HB ASP 31 1HB ASP 31 -7.707 -15.030 -5.407 243 2HB ASP 31 2HB ASP 31 -6.232 -14.909 -6.365 244 H LYS 32 H LYS 32 -4.804 -16.237 -2.918 245 HA LYS 32 HA LYS 32 -2.167 -15.284 -2.966 246 1HB LYS 32 1HB LYS 32 -1.563 -17.448 -1.956 247 2HB LYS 32 2HB LYS 32 -2.961 -16.723 -1.177 248 1HG LYS 32 1HG LYS 32 -3.581 -18.586 -3.369 249 2HG LYS 32 2HG LYS 32 -2.815 -19.311 -1.955 250 1HD LYS 32 1HD LYS 32 -4.553 -18.501 -0.522 251 2HD LYS 32 2HD LYS 32 -5.245 -17.535 -1.818 252 1HE LYS 32 1HE LYS 32 -5.074 -20.547 -1.824 253 2HE LYS 32 2HE LYS 32 -6.504 -19.626 -1.359 254 1HZ LYS 32 1HZ LYS 32 -6.739 -20.310 -3.621 255 2HZ LYS 32 2HZ LYS 32 -5.222 -19.691 -4.038 256 3HZ LYS 32 3HZ LYS 32 -6.480 -18.633 -3.623 257 H GLU 33 H GLU 33 -3.884 -17.267 -5.238 258 HA GLU 33 HA GLU 33 -1.392 -18.414 -6.246 259 1HB GLU 33 1HB GLU 33 -4.272 -19.032 -6.899 260 2HB GLU 33 2HB GLU 33 -2.893 -19.824 -7.649 261 1HG GLU 33 1HG GLU 33 -2.189 -20.674 -5.480 262 2HG GLU 33 2HG GLU 33 -3.560 -19.873 -4.714 263 H THR 34 H THR 34 -4.167 -16.510 -7.425 264 HA THR 34 HA THR 34 -2.709 -16.137 -9.942 265 HB THR 34 HB THR 34 -4.939 -15.244 -10.762 266 HG1 THR 34 HG1 THR 34 -6.688 -16.265 -9.348 267 1HG2 THR 34 1HG2 THR 34 -5.870 -17.495 -11.054 268 2HG2 THR 34 2HG2 THR 34 -4.787 -18.102 -9.800 269 3HG2 THR 34 3HG2 THR 34 -4.126 -17.479 -11.311 270 H GLY 35 H GLY 35 -3.602 -14.417 -7.111 271 1HA GLY 35 1HA GLY 35 -3.121 -12.243 -6.497 272 2HA GLY 35 2HA GLY 35 -2.310 -12.041 -8.042 273 H ILE 36 H ILE 36 -5.522 -13.197 -8.101 274 HA ILE 36 HA ILE 36 -6.408 -10.770 -9.415 275 HB ILE 36 HB ILE 36 -7.808 -13.406 -8.957 276 1HG1 ILE 36 1HG1 ILE 36 -5.908 -13.595 -10.478 277 2HG1 ILE 36 2HG1 ILE 36 -7.418 -13.769 -11.364 278 1HG2 ILE 36 1HG2 ILE 36 -9.447 -12.622 -10.625 279 2HG2 ILE 36 2HG2 ILE 36 -8.675 -11.037 -10.615 280 3HG2 ILE 36 3HG2 ILE 36 -9.459 -11.647 -9.156 281 1HD1 ILE 36 1HD1 ILE 36 -5.831 -12.418 -12.598 282 2HD1 ILE 36 2HD1 ILE 36 -5.716 -11.293 -11.244 283 3HD1 ILE 36 3HD1 ILE 36 -7.235 -11.458 -12.126 284 H VAL 37 H VAL 37 -7.702 -9.266 -8.536 285 HA VAL 37 HA VAL 37 -8.435 -9.442 -5.780 286 HB VAL 37 HB VAL 37 -9.674 -7.279 -6.234 287 1HG1 VAL 37 1HG1 VAL 37 -7.432 -7.317 -5.309 288 2HG1 VAL 37 2HG1 VAL 37 -7.606 -5.972 -6.438 289 3HG1 VAL 37 3HG1 VAL 37 -6.744 -7.430 -6.930 290 1HG2 VAL 37 1HG2 VAL 37 -8.349 -7.569 -8.930 291 2HG2 VAL 37 2HG2 VAL 37 -9.138 -6.112 -8.323 292 3HG2 VAL 37 3HG2 VAL 37 -10.085 -7.571 -8.614 293 H LYS 38 H LYS 38 -9.987 -10.680 -5.109 294 HA LYS 38 HA LYS 38 -12.292 -11.271 -6.778 295 1HB LYS 38 1HB LYS 38 -11.494 -12.327 -4.091 296 2HB LYS 38 2HB LYS 38 -12.853 -12.894 -5.053 297 1HG LYS 38 1HG LYS 38 -11.098 -13.330 -6.885 298 2HG LYS 38 2HG LYS 38 -9.929 -13.213 -5.564 299 1HD LYS 38 1HD LYS 38 -11.555 -14.818 -4.372 300 2HD LYS 38 2HD LYS 38 -12.110 -15.189 -5.996 301 1HE LYS 38 1HE LYS 38 -9.873 -15.830 -6.663 302 2HE LYS 38 2HE LYS 38 -9.243 -15.378 -5.079 303 1HZ LYS 38 1HZ LYS 38 -11.189 -17.556 -5.626 304 2HZ LYS 38 2HZ LYS 38 -10.623 -17.113 -4.093 305 3HZ LYS 38 3HZ LYS 38 -9.553 -17.758 -5.239 306 H GLU 39 H GLU 39 -11.423 -9.050 -4.413 307 HA GLU 39 HA GLU 39 -13.854 -8.759 -2.998 308 1HB GLU 39 1HB GLU 39 -11.719 -7.825 -2.183 309 2HB GLU 39 2HB GLU 39 -11.694 -6.706 -3.538 310 1HG GLU 39 1HG GLU 39 -12.428 -5.589 -1.523 311 2HG GLU 39 2HG GLU 39 -13.734 -5.651 -2.706 312 H ASP 40 H ASP 40 -15.605 -7.438 -3.371 313 HA ASP 40 HA ASP 40 -16.224 -7.188 -6.139 314 1HB ASP 40 1HB ASP 40 -17.890 -7.837 -4.413 315 2HB ASP 40 2HB ASP 40 -17.824 -6.195 -3.776 316 H CYS 41 H CYS 41 -16.186 -5.533 -7.433 317 HA CYS 41 HA CYS 41 -16.516 -2.839 -6.927 318 1HB CYS 41 1HB CYS 41 -14.140 -2.034 -7.150 319 2HB CYS 41 2HB CYS 41 -14.476 -2.841 -5.622 320 HG CYS 41 HG CYS 41 -13.249 -5.240 -6.349 321 H GLU 42 H GLU 42 -15.298 -1.546 -8.891 322 HA GLU 42 HA GLU 42 -15.995 -2.999 -11.286 323 1HB GLU 42 1HB GLU 42 -14.576 -0.338 -11.126 324 2HB GLU 42 2HB GLU 42 -15.488 -0.982 -12.484 325 1HG GLU 42 1HG GLU 42 -17.169 0.249 -11.724 326 2HG GLU 42 2HG GLU 42 -17.342 -0.977 -10.468 327 H ILE 43 H ILE 43 -13.314 -2.884 -9.347 328 HA ILE 43 HA ILE 43 -11.359 -3.242 -11.486 329 HB ILE 43 HB ILE 43 -10.859 -3.275 -8.505 330 1HG1 ILE 43 1HG1 ILE 43 -10.700 -0.911 -10.389 331 2HG1 ILE 43 2HG1 ILE 43 -11.976 -1.172 -9.205 332 1HG2 ILE 43 1HG2 ILE 43 -8.571 -2.641 -9.159 333 2HG2 ILE 43 2HG2 ILE 43 -9.041 -2.755 -10.854 334 3HG2 ILE 43 3HG2 ILE 43 -9.051 -4.197 -9.840 335 1HD1 ILE 43 1HD1 ILE 43 -9.062 -0.723 -8.623 336 2HD1 ILE 43 2HD1 ILE 43 -10.301 -1.058 -7.414 337 3HD1 ILE 43 3HD1 ILE 43 -10.381 0.423 -8.370 338 H LYS 44 H LYS 44 -13.470 -5.095 -9.684 339 HA LYS 44 HA LYS 44 -11.981 -7.321 -8.913 340 1HB LYS 44 1HB LYS 44 -14.325 -6.867 -8.250 341 2HB LYS 44 2HB LYS 44 -14.853 -7.302 -9.864 342 1HG LYS 44 1HG LYS 44 -13.288 -9.246 -8.217 343 2HG LYS 44 2HG LYS 44 -15.012 -9.023 -7.924 344 1HD LYS 44 1HD LYS 44 -13.833 -9.706 -10.616 345 2HD LYS 44 2HD LYS 44 -14.439 -10.907 -9.475 346 1HE LYS 44 1HE LYS 44 -16.089 -8.627 -10.556 347 2HE LYS 44 2HE LYS 44 -16.063 -10.241 -11.262 348 1HZ LYS 44 1HZ LYS 44 -16.942 -11.148 -9.242 349 2HZ LYS 44 2HZ LYS 44 -17.934 -9.867 -9.720 350 3HZ LYS 44 3HZ LYS 44 -16.837 -9.656 -8.449 351 H GLY 45 H GLY 45 -11.027 -8.880 -9.954 352 1HA GLY 45 1HA GLY 45 -10.997 -10.493 -11.792 353 2HA GLY 45 2HA GLY 45 -11.605 -9.212 -12.831 354 H GLU 46 H GLU 46 -9.755 -7.268 -11.483 355 HA GLU 46 HA GLU 46 -7.559 -7.554 -13.259 356 1HB GLU 46 1HB GLU 46 -8.521 -5.586 -11.321 357 2HB GLU 46 2HB GLU 46 -6.767 -5.659 -11.443 358 1HG GLU 46 1HG GLU 46 -8.501 -5.447 -13.876 359 2HG GLU 46 2HG GLU 46 -8.018 -4.027 -12.953 360 H SER 47 H SER 47 -5.295 -7.431 -12.561 361 HA SER 47 HA SER 47 -4.823 -9.249 -10.288 362 1HB SER 47 1HB SER 47 -2.775 -9.972 -11.611 363 2HB SER 47 2HB SER 47 -4.332 -10.450 -12.290 364 HG SER 47 HG SER 47 -4.167 -8.620 -13.687 365 H VAL 48 H VAL 48 -3.545 -8.515 -8.715 366 HA VAL 48 HA VAL 48 -2.362 -5.880 -9.036 367 HB VAL 48 HB VAL 48 -1.932 -5.965 -6.632 368 1HG1 VAL 48 1HG1 VAL 48 -4.720 -6.854 -7.362 369 2HG1 VAL 48 2HG1 VAL 48 -4.110 -5.199 -7.409 370 3HG1 VAL 48 3HG1 VAL 48 -4.256 -6.042 -5.865 371 1HG2 VAL 48 1HG2 VAL 48 -1.421 -8.340 -6.410 372 2HG2 VAL 48 2HG2 VAL 48 -3.102 -8.744 -6.759 373 3HG2 VAL 48 3HG2 VAL 48 -2.695 -7.865 -5.286 374 H ALA 49 H ALA 49 -1.342 -8.818 -9.814 375 HA ALA 49 HA ALA 49 1.180 -9.075 -8.583 376 1HB ALA 49 1HB ALA 49 0.186 -10.278 -11.165 377 2HB ALA 49 2HB ALA 49 -0.016 -10.973 -9.555 378 3HB ALA 49 3HB ALA 49 1.598 -10.803 -10.247 379 H GLY 50 H GLY 50 2.143 -7.073 -8.789 380 1HA GLY 50 1HA GLY 50 4.137 -6.252 -9.903 381 2HA GLY 50 2HA GLY 50 3.383 -6.663 -11.435 382 H ARG 51 H ARG 51 1.198 -5.271 -9.273 383 HA ARG 51 HA ARG 51 1.414 -2.699 -10.700 384 1HB ARG 51 1HB ARG 51 -0.987 -3.543 -9.091 385 2HB ARG 51 2HB ARG 51 -0.905 -2.411 -10.433 386 1HG ARG 51 1HG ARG 51 -0.457 -5.365 -10.745 387 2HG ARG 51 2HG ARG 51 -2.039 -4.604 -10.892 388 1HD ARG 51 1HD ARG 51 0.279 -3.639 -12.522 389 2HD ARG 51 2HD ARG 51 -0.635 -5.061 -13.020 390 HE ARG 51 HE ARG 51 -1.456 -2.325 -13.208 391 1HH1 ARG 51 1HH1 ARG 51 -2.667 -5.602 -12.825 392 2HH1 ARG 51 2HH1 ARG 51 -4.183 -5.271 -13.619 393 1HH2 ARG 51 1HH2 ARG 51 -3.433 -1.902 -14.275 394 2HH2 ARG 51 2HH2 ARG 51 -4.626 -3.181 -14.415 395 H ILE 52 H ILE 52 1.117 -0.746 -9.426 396 HA ILE 52 HA ILE 52 1.898 -1.110 -6.614 397 HB ILE 52 HB ILE 52 2.113 1.322 -8.399 398 1HG1 ILE 52 1HG1 ILE 52 4.197 -0.495 -7.168 399 2HG1 ILE 52 2HG1 ILE 52 3.764 -0.419 -8.870 400 1HG2 ILE 52 1HG2 ILE 52 3.260 2.409 -6.531 401 2HG2 ILE 52 2HG2 ILE 52 2.936 1.005 -5.514 402 3HG2 ILE 52 3HG2 ILE 52 1.600 1.992 -6.106 403 1HD1 ILE 52 1HD1 ILE 52 5.036 1.796 -7.282 404 2HD1 ILE 52 2HD1 ILE 52 4.609 1.858 -8.992 405 3HD1 ILE 52 3HD1 ILE 52 5.852 0.736 -8.433 406 H LEU 53 H LEU 53 0.380 -0.888 -5.130 407 HA LEU 53 HA LEU 53 -2.207 0.158 -5.974 408 1HB LEU 53 1HB LEU 53 -1.306 -1.700 -3.825 409 2HB LEU 53 2HB LEU 53 -2.808 -0.827 -3.602 410 HG LEU 53 HG LEU 53 -3.702 -1.821 -5.663 411 1HD1 LEU 53 1HD1 LEU 53 -1.626 -2.115 -6.894 412 2HD1 LEU 53 2HD1 LEU 53 -2.508 -3.639 -6.775 413 3HD1 LEU 53 3HD1 LEU 53 -1.105 -3.347 -5.744 414 1HD2 LEU 53 1HD2 LEU 53 -4.073 -2.921 -3.515 415 2HD2 LEU 53 2HD2 LEU 53 -2.587 -3.846 -3.729 416 3HD2 LEU 53 3HD2 LEU 53 -3.946 -4.097 -4.823 417 H VAL 54 H VAL 54 -2.898 2.065 -5.413 418 HA VAL 54 HA VAL 54 -1.770 3.342 -3.004 419 HB VAL 54 HB VAL 54 -2.843 4.685 -5.495 420 1HG1 VAL 54 1HG1 VAL 54 -1.585 5.892 -3.028 421 2HG1 VAL 54 2HG1 VAL 54 -3.296 5.971 -3.451 422 3HG1 VAL 54 3HG1 VAL 54 -2.097 6.768 -4.469 423 1HG2 VAL 54 1HG2 VAL 54 -0.022 4.462 -4.438 424 2HG2 VAL 54 2HG2 VAL 54 -0.519 5.418 -5.835 425 3HG2 VAL 54 3HG2 VAL 54 -0.661 3.660 -5.873 426 H PHE 55 H PHE 55 -3.229 3.068 -1.443 427 HA PHE 55 HA PHE 55 -5.922 4.099 -1.946 428 1HB PHE 55 1HB PHE 55 -6.893 2.330 -0.483 429 2HB PHE 55 2HB PHE 55 -6.249 1.719 -1.997 430 HD1 PHE 55 HD1 PHE 55 -5.970 1.682 1.624 431 HD2 PHE 55 HD2 PHE 55 -4.207 0.365 -2.021 432 HE1 PHE 55 HE1 PHE 55 -4.674 -0.003 2.864 433 HE2 PHE 55 HE2 PHE 55 -2.906 -1.318 -0.786 434 HZ PHE 55 HZ PHE 55 -3.138 -1.506 1.657 435 HA PRO 56 HA PRO 56 -5.305 6.427 1.771 436 1HB PRO 56 1HB PRO 56 -8.119 5.881 2.486 437 2HB PRO 56 2HB PRO 56 -7.315 7.422 2.177 438 1HG PRO 56 1HG PRO 56 -9.052 6.385 0.427 439 2HG PRO 56 2HG PRO 56 -7.614 7.277 -0.109 440 1HD PRO 56 1HD PRO 56 -8.091 4.320 -0.019 441 2HD PRO 56 2HD PRO 56 -7.289 5.296 -1.270 442 H GLY 57 H GLY 57 -7.437 3.603 2.263 443 1HA GLY 57 1HA GLY 57 -5.735 2.338 4.122 444 2HA GLY 57 2HA GLY 57 -6.966 3.250 4.989 445 H GLY 58 H GLY 58 -6.937 0.590 5.363 446 1HA GLY 58 1HA GLY 58 -9.100 -0.443 3.651 447 2HA GLY 58 2HA GLY 58 -7.919 -1.454 4.471 448 H LYS 59 H LYS 59 -9.682 1.307 5.771 449 HA LYS 59 HA LYS 59 -11.270 1.549 7.365 450 1HB LYS 59 1HB LYS 59 -11.925 -1.326 6.721 451 2HB LYS 59 2HB LYS 59 -12.930 -0.251 7.682 452 1HG LYS 59 1HG LYS 59 -13.185 1.225 5.734 453 2HG LYS 59 2HG LYS 59 -12.214 0.104 4.775 454 1HD LYS 59 1HD LYS 59 -14.504 -0.368 4.313 455 2HD LYS 59 2HD LYS 59 -13.891 -1.676 5.325 456 1HE LYS 59 1HE LYS 59 -14.839 -0.435 7.305 457 2HE LYS 59 2HE LYS 59 -15.635 0.633 6.150 458 1HZ LYS 59 1HZ LYS 59 -17.191 -1.023 6.731 459 2HZ LYS 59 2HZ LYS 59 -16.067 -2.272 6.530 460 3HZ LYS 59 3HZ LYS 59 -16.646 -1.436 5.177 461 H GLY 60 H GLY 60 -8.570 -0.034 7.887 462 1HA GLY 60 1HA GLY 60 -7.447 -0.630 9.806 463 2HA GLY 60 2HA GLY 60 -8.827 -0.034 10.715 464 H SER 61 H SER 61 -8.688 -2.650 8.326 465 HA SER 61 HA SER 61 -9.903 -4.429 10.281 466 1HB SER 61 1HB SER 61 -9.941 -5.970 8.169 467 2HB SER 61 2HB SER 61 -11.058 -4.609 8.275 468 HG SER 61 HG SER 61 -9.700 -3.423 6.931 469 H THR 62 H THR 62 -8.847 -6.018 11.279 470 HA THR 62 HA THR 62 -5.976 -6.022 10.975 471 HB THR 62 HB THR 62 -6.088 -7.399 13.123 472 HG1 THR 62 HG1 THR 62 -8.000 -7.560 14.145 473 1HG2 THR 62 1HG2 THR 62 -6.486 -5.413 14.508 474 2HG2 THR 62 2HG2 THR 62 -7.208 -4.595 13.125 475 3HG2 THR 62 3HG2 THR 62 -5.501 -5.029 13.098 476 H VAL 63 H VAL 63 -6.405 -7.154 8.919 477 HA VAL 63 HA VAL 63 -7.054 -9.767 8.522 478 HB VAL 63 HB VAL 63 -6.247 -8.342 6.731 479 1HG1 VAL 63 1HG1 VAL 63 -3.502 -8.692 7.918 480 2HG1 VAL 63 2HG1 VAL 63 -4.451 -7.205 7.918 481 3HG1 VAL 63 3HG1 VAL 63 -3.880 -7.887 6.394 482 1HG2 VAL 63 1HG2 VAL 63 -6.212 -10.758 6.380 483 2HG2 VAL 63 2HG2 VAL 63 -4.562 -10.829 6.999 484 3HG2 VAL 63 3HG2 VAL 63 -4.906 -9.964 5.499 485 H GLY 64 H GLY 64 -4.165 -8.603 10.154 486 1HA GLY 64 1HA GLY 64 -3.170 -9.895 11.907 487 2HA GLY 64 2HA GLY 64 -3.687 -11.353 11.074 488 H SER 65 H SER 65 -2.642 -9.530 8.666 489 HA SER 65 HA SER 65 -0.829 -9.423 7.336 490 1HB SER 65 1HB SER 65 1.291 -8.829 8.287 491 2HB SER 65 2HB SER 65 0.044 -8.074 9.272 492 HG SER 65 HG SER 65 0.329 -10.157 10.572 493 H TYR 66 H TYR 66 1.803 -10.607 7.846 494 HA TYR 66 HA TYR 66 2.989 -12.510 7.559 495 1HB TYR 66 1HB TYR 66 0.499 -13.929 8.513 496 2HB TYR 66 2HB TYR 66 2.046 -14.708 8.219 497 HD1 TYR 66 HD1 TYR 66 4.077 -13.736 9.572 498 HD2 TYR 66 HD2 TYR 66 -0.002 -13.169 10.625 499 HE1 TYR 66 HE1 TYR 66 4.746 -13.274 11.894 500 HE2 TYR 66 HE2 TYR 66 0.651 -12.701 12.946 501 HH TYR 66 HH TYR 66 3.923 -12.183 13.873 502 H VAL 67 H VAL 67 -0.344 -13.068 6.433 503 HA VAL 67 HA VAL 67 0.320 -14.956 4.478 504 HB VAL 67 HB VAL 67 -1.923 -14.532 3.532 505 1HG1 VAL 67 1HG1 VAL 67 -1.679 -16.056 5.399 506 2HG1 VAL 67 2HG1 VAL 67 -3.184 -15.149 5.558 507 3HG1 VAL 67 3HG1 VAL 67 -1.784 -14.714 6.538 508 1HG2 VAL 67 1HG2 VAL 67 -2.043 -12.325 5.588 509 2HG2 VAL 67 2HG2 VAL 67 -3.403 -12.905 4.626 510 3HG2 VAL 67 3HG2 VAL 67 -2.036 -12.116 3.837 511 H LEU 68 H LEU 68 0.726 -11.561 4.393 512 HA LEU 68 HA LEU 68 0.493 -11.100 1.618 513 1HB LEU 68 1HB LEU 68 2.131 -9.697 3.727 514 2HB LEU 68 2HB LEU 68 2.041 -9.150 2.066 515 HG LEU 68 HG LEU 68 -0.514 -9.052 2.459 516 1HD1 LEU 68 1HD1 LEU 68 -1.158 -8.589 4.777 517 2HD1 LEU 68 2HD1 LEU 68 0.465 -9.032 5.307 518 3HD1 LEU 68 3HD1 LEU 68 -0.581 -10.243 4.566 519 1HD2 LEU 68 1HD2 LEU 68 1.348 -7.106 3.816 520 2HD2 LEU 68 2HD2 LEU 68 -0.322 -6.782 3.357 521 3HD2 LEU 68 3HD2 LEU 68 0.889 -7.096 2.112 522 H LEU 69 H LEU 69 2.991 -12.525 3.570 523 HA LEU 69 HA LEU 69 5.167 -12.254 1.810 524 1HB LEU 69 1HB LEU 69 5.422 -12.946 4.143 525 2HB LEU 69 2HB LEU 69 4.554 -14.433 3.818 526 HG LEU 69 HG LEU 69 6.380 -15.120 2.276 527 1HD1 LEU 69 1HD1 LEU 69 7.763 -12.669 3.351 528 2HD1 LEU 69 2HD1 LEU 69 7.222 -12.919 1.689 529 3HD1 LEU 69 3HD1 LEU 69 8.505 -13.926 2.360 530 1HD2 LEU 69 1HD2 LEU 69 7.982 -15.666 4.034 531 2HD2 LEU 69 2HD2 LEU 69 6.323 -15.889 4.593 532 3HD2 LEU 69 3HD2 LEU 69 7.239 -14.466 5.092 533 H ASN 70 H ASN 70 2.589 -14.651 2.054 534 HA ASN 70 HA ASN 70 3.506 -16.553 0.210 535 1HB ASN 70 1HB ASN 70 1.502 -16.741 1.752 536 2HB ASN 70 2HB ASN 70 0.619 -15.762 0.584 537 1HD2 ASN 70 1HD2 ASN 70 0.319 -18.557 1.502 538 2HD2 ASN 70 2HD2 ASN 70 0.337 -19.516 0.065 539 H LEU 71 H LEU 71 1.486 -13.684 -0.233 540 HA LEU 71 HA LEU 71 1.018 -13.882 -2.967 541 1HB LEU 71 1HB LEU 71 1.398 -11.353 -1.361 542 2HB LEU 71 2HB LEU 71 0.580 -11.480 -2.906 543 HG LEU 71 HG LEU 71 -0.358 -12.754 -0.332 544 1HD1 LEU 71 1HD1 LEU 71 -1.357 -10.331 -1.817 545 2HD1 LEU 71 2HD1 LEU 71 -0.563 -10.344 -0.243 546 3HD1 LEU 71 3HD1 LEU 71 -2.152 -11.084 -0.436 547 1HD2 LEU 71 1HD2 LEU 71 -1.009 -14.031 -2.297 548 2HD2 LEU 71 2HD2 LEU 71 -1.659 -12.572 -3.045 549 3HD2 LEU 71 3HD2 LEU 71 -2.406 -13.224 -1.584 550 H ARG 72 H ARG 72 3.703 -12.372 -1.219 551 HA ARG 72 HA ARG 72 4.908 -11.311 -3.578 552 1HB ARG 72 1HB ARG 72 5.149 -10.513 -1.128 553 2HB ARG 72 2HB ARG 72 6.352 -11.784 -0.983 554 1HG ARG 72 1HG ARG 72 6.521 -9.649 -3.091 555 2HG ARG 72 2HG ARG 72 7.208 -9.455 -1.479 556 1HD ARG 72 1HD ARG 72 8.538 -11.511 -1.854 557 2HD ARG 72 2HD ARG 72 7.909 -11.582 -3.497 558 HE ARG 72 HE ARG 72 9.393 -9.205 -2.611 559 1HH1 ARG 72 1HH1 ARG 72 9.076 -11.988 -4.699 560 2HH1 ARG 72 2HH1 ARG 72 10.463 -11.595 -5.667 561 1HH2 ARG 72 1HH2 ARG 72 11.244 -8.678 -3.857 562 2HH2 ARG 72 2HH2 ARG 72 11.691 -9.705 -5.195 563 H LYS 73 H LYS 73 5.479 -14.178 -1.578 564 HA LYS 73 HA LYS 73 7.781 -15.090 -2.873 565 1HB LYS 73 1HB LYS 73 6.795 -15.863 -0.677 566 2HB LYS 73 2HB LYS 73 5.624 -16.780 -1.609 567 1HG LYS 73 1HG LYS 73 8.534 -17.203 -2.090 568 2HG LYS 73 2HG LYS 73 7.758 -17.907 -0.675 569 1HD LYS 73 1HD LYS 73 6.133 -19.032 -2.120 570 2HD LYS 73 2HD LYS 73 6.903 -18.319 -3.539 571 1HE LYS 73 1HE LYS 73 8.236 -20.193 -1.586 572 2HE LYS 73 2HE LYS 73 7.586 -20.662 -3.156 573 1HZ LYS 73 1HZ LYS 73 9.957 -20.321 -3.280 574 2HZ LYS 73 2HZ LYS 73 9.807 -18.744 -2.688 575 3HZ LYS 73 3HZ LYS 73 9.168 -19.140 -4.204 576 H ASN 74 H ASN 74 4.379 -15.362 -3.666 577 HA ASN 74 HA ASN 74 4.884 -17.317 -5.749 578 1HB ASN 74 1HB ASN 74 2.793 -17.290 -4.324 579 2HB ASN 74 2HB ASN 74 2.306 -15.838 -5.195 580 1HD2 ASN 74 1HD2 ASN 74 0.477 -16.881 -5.989 581 2HD2 ASN 74 2HD2 ASN 74 0.579 -18.037 -7.272 582 H GLY 75 H GLY 75 4.773 -13.918 -5.419 583 1HA GLY 75 1HA GLY 75 5.491 -12.370 -7.009 584 2HA GLY 75 2HA GLY 75 5.350 -13.612 -8.246 585 H VAL 76 H VAL 76 2.715 -13.077 -6.082 586 HA VAL 76 HA VAL 76 1.211 -11.829 -8.287 587 HB VAL 76 HB VAL 76 -0.823 -12.818 -7.287 588 1HG1 VAL 76 1HG1 VAL 76 0.320 -13.973 -9.103 589 2HG1 VAL 76 2HG1 VAL 76 -0.394 -15.127 -7.978 590 3HG1 VAL 76 3HG1 VAL 76 1.341 -14.816 -7.940 591 1HG2 VAL 76 1HG2 VAL 76 -0.621 -14.561 -5.589 592 2HG2 VAL 76 2HG2 VAL 76 -0.055 -13.005 -4.982 593 3HG2 VAL 76 3HG2 VAL 76 1.108 -14.240 -5.462 594 H ALA 77 H ALA 77 2.780 -10.853 -5.802 595 HA ALA 77 HA ALA 77 0.733 -9.316 -4.415 596 1HB ALA 77 1HB ALA 77 2.569 -8.589 -2.968 597 2HB ALA 77 2HB ALA 77 3.724 -9.432 -4.003 598 3HB ALA 77 3HB ALA 77 2.518 -10.347 -3.097 599 HA PRO 78 HA PRO 78 1.531 -5.527 -6.622 600 1HB PRO 78 1HB PRO 78 1.466 -3.676 -4.627 601 2HB PRO 78 2HB PRO 78 0.013 -4.443 -5.276 602 1HG PRO 78 1HG PRO 78 1.537 -5.073 -2.786 603 2HG PRO 78 2HG PRO 78 -0.216 -5.013 -3.040 604 1HD PRO 78 1HD PRO 78 1.184 -7.335 -2.967 605 2HD PRO 78 2HD PRO 78 -0.281 -7.129 -3.949 606 H LYS 79 H LYS 79 3.223 -4.116 -7.122 607 HA LYS 79 HA LYS 79 5.803 -4.887 -6.210 608 1HB LYS 79 1HB LYS 79 4.782 -2.722 -8.018 609 2HB LYS 79 2HB LYS 79 6.468 -2.755 -7.528 610 1HG LYS 79 1HG LYS 79 6.635 -5.054 -8.451 611 2HG LYS 79 2HG LYS 79 4.984 -4.880 -9.056 612 1HD LYS 79 1HD LYS 79 5.635 -3.028 -10.447 613 2HD LYS 79 2HD LYS 79 7.253 -3.017 -9.745 614 1HE LYS 79 1HE LYS 79 7.634 -5.278 -10.665 615 2HE LYS 79 2HE LYS 79 6.041 -5.214 -11.421 616 1HZ LYS 79 1HZ LYS 79 8.229 -3.280 -11.960 617 2HZ LYS 79 2HZ LYS 79 6.739 -3.376 -12.767 618 3HZ LYS 79 3HZ LYS 79 7.879 -4.620 -12.937 619 H ALA 80 H ALA 80 3.564 -2.366 -5.373 620 HA ALA 80 HA ALA 80 5.014 -1.746 -2.992 621 1HB ALA 80 1HB ALA 80 6.300 -0.411 -4.599 622 2HB ALA 80 2HB ALA 80 5.428 0.608 -3.454 623 3HB ALA 80 3HB ALA 80 4.817 0.406 -5.097 624 H ILE 81 H ILE 81 3.822 -0.401 -1.574 625 HA ILE 81 HA ILE 81 1.095 0.293 -2.450 626 HB ILE 81 HB ILE 81 1.829 -0.947 0.212 627 1HG1 ILE 81 1HG1 ILE 81 0.131 -2.020 -2.053 628 2HG1 ILE 81 2HG1 ILE 81 1.750 -2.576 -1.646 629 1HG2 ILE 81 1HG2 ILE 81 0.089 0.731 0.459 630 2HG2 ILE 81 2HG2 ILE 81 -0.588 -0.883 0.671 631 3HG2 ILE 81 3HG2 ILE 81 -0.839 -0.012 -0.843 632 1HD1 ILE 81 1HD1 ILE 81 0.943 -3.375 0.503 633 2HD1 ILE 81 2HD1 ILE 81 0.030 -4.093 -0.825 634 3HD1 ILE 81 3HD1 ILE 81 -0.673 -2.783 0.123 635 H ILE 82 H ILE 82 0.600 2.371 -2.047 636 HA ILE 82 HA ILE 82 2.214 3.795 -0.025 637 HB ILE 82 HB ILE 82 0.878 5.246 -2.293 638 1HG1 ILE 82 1HG1 ILE 82 2.297 3.485 -3.328 639 2HG1 ILE 82 2HG1 ILE 82 2.903 5.107 -3.638 640 1HG2 ILE 82 1HG2 ILE 82 1.731 6.533 -0.404 641 2HG2 ILE 82 2HG2 ILE 82 2.653 6.882 -1.867 642 3HG2 ILE 82 3HG2 ILE 82 3.333 5.826 -0.629 643 1HD1 ILE 82 1HD1 ILE 82 4.720 3.600 -3.149 644 2HD1 ILE 82 2HD1 ILE 82 3.972 3.160 -1.614 645 3HD1 ILE 82 3HD1 ILE 82 4.568 4.800 -1.865 646 H ASN 83 H ASN 83 1.065 4.484 1.672 647 HA ASN 83 HA ASN 83 -1.851 4.778 1.327 648 1HB ASN 83 1HB ASN 83 -0.336 3.692 3.709 649 2HB ASN 83 2HB ASN 83 -2.053 4.073 3.724 650 1HD2 ASN 83 1HD2 ASN 83 -2.433 3.133 0.976 651 2HD2 ASN 83 2HD2 ASN 83 -2.389 1.406 1.067 652 H LYS 84 H LYS 84 -2.880 6.233 2.912 653 HA LYS 84 HA LYS 84 -1.326 8.623 3.318 654 1HB LYS 84 1HB LYS 84 -3.769 8.624 2.715 655 2HB LYS 84 2HB LYS 84 -4.113 8.004 4.322 656 1HG LYS 84 1HG LYS 84 -3.187 10.006 5.323 657 2HG LYS 84 2HG LYS 84 -2.763 10.627 3.726 658 1HD LYS 84 1HD LYS 84 -5.141 10.639 3.114 659 2HD LYS 84 2HD LYS 84 -5.550 10.045 4.726 660 1HE LYS 84 1HE LYS 84 -4.546 12.063 5.700 661 2HE LYS 84 2HE LYS 84 -4.189 12.657 4.078 662 1HZ LYS 84 1HZ LYS 84 -6.522 12.768 3.596 663 2HZ LYS 84 2HZ LYS 84 -6.233 13.602 5.048 664 3HZ LYS 84 3HZ LYS 84 -6.916 12.052 5.082 665 H LYS 85 H LYS 85 -2.920 6.215 5.366 666 HA LYS 85 HA LYS 85 -0.876 6.776 7.397 667 1HB LYS 85 1HB LYS 85 -2.479 6.177 9.158 668 2HB LYS 85 2HB LYS 85 -3.031 7.567 8.242 669 1HG LYS 85 1HG LYS 85 -4.737 6.369 7.211 670 2HG LYS 85 2HG LYS 85 -3.992 4.811 7.578 671 1HD LYS 85 1HD LYS 85 -4.416 5.223 9.981 672 2HD LYS 85 2HD LYS 85 -5.245 6.718 9.551 673 1HE LYS 85 1HE LYS 85 -6.953 5.530 8.392 674 2HE LYS 85 2HE LYS 85 -6.059 4.014 8.509 675 1HZ LYS 85 1HZ LYS 85 -6.375 4.028 10.892 676 2HZ LYS 85 2HZ LYS 85 -7.881 4.152 10.115 677 3HZ LYS 85 3HZ LYS 85 -7.177 5.524 10.814 678 H THR 86 H THR 86 0.506 5.128 7.359 679 HA THR 86 HA THR 86 -0.493 2.456 6.782 680 HB THR 86 HB THR 86 1.524 3.037 5.605 681 HG1 THR 86 HG1 THR 86 1.877 0.984 5.965 682 1HG2 THR 86 1HG2 THR 86 2.785 3.520 8.303 683 2HG2 THR 86 2HG2 THR 86 2.406 4.750 7.097 684 3HG2 THR 86 3HG2 THR 86 3.628 3.526 6.755 685 H GLU 87 H GLU 87 -1.147 1.212 8.358 686 HA GLU 87 HA GLU 87 -0.386 1.914 11.088 687 1HB GLU 87 1HB GLU 87 -2.635 0.121 10.157 688 2HB GLU 87 2HB GLU 87 -2.371 0.715 11.793 689 1HG GLU 87 1HG GLU 87 -2.653 3.033 10.920 690 2HG GLU 87 2HG GLU 87 -3.099 2.337 9.366 691 H THR 88 H THR 88 -0.387 -0.071 12.607 692 HA THR 88 HA THR 88 2.066 -1.251 12.146 693 HB THR 88 HB THR 88 -0.035 -2.316 14.031 694 HG1 THR 88 HG1 THR 88 1.500 0.048 14.031 695 1HG2 THR 88 1HG2 THR 88 2.010 -3.672 13.821 696 2HG2 THR 88 2HG2 THR 88 1.887 -2.917 15.410 697 3HG2 THR 88 3HG2 THR 88 2.982 -2.247 14.200 698 H ILE 89 H ILE 89 -1.158 -2.764 11.847 699 HA ILE 89 HA ILE 89 -0.327 -5.371 11.341 700 HB ILE 89 HB ILE 89 -2.508 -5.584 10.036 701 1HG1 ILE 89 1HG1 ILE 89 -2.834 -2.738 11.027 702 2HG1 ILE 89 2HG1 ILE 89 -2.707 -3.230 9.343 703 1HG2 ILE 89 1HG2 ILE 89 -2.324 -6.225 12.350 704 2HG2 ILE 89 2HG2 ILE 89 -3.864 -5.404 12.088 705 3HG2 ILE 89 3HG2 ILE 89 -2.529 -4.550 12.865 706 1HD1 ILE 89 1HD1 ILE 89 -4.925 -3.979 11.233 707 2HD1 ILE 89 2HD1 ILE 89 -4.804 -4.452 9.539 708 3HD1 ILE 89 3HD1 ILE 89 -5.005 -2.753 9.968 709 H ILE 90 H ILE 90 -0.849 -2.736 9.023 710 HA ILE 90 HA ILE 90 -0.294 -4.415 6.759 711 HB ILE 90 HB ILE 90 -0.376 -1.393 6.807 712 1HG1 ILE 90 1HG1 ILE 90 -2.644 -3.337 6.313 713 2HG1 ILE 90 2HG1 ILE 90 -2.438 -2.380 7.776 714 1HG2 ILE 90 1HG2 ILE 90 -0.845 -3.377 4.584 715 2HG2 ILE 90 2HG2 ILE 90 0.602 -2.393 4.798 716 3HG2 ILE 90 3HG2 ILE 90 -0.944 -1.622 4.446 717 1HD1 ILE 90 1HD1 ILE 90 -2.848 -1.258 5.012 718 2HD1 ILE 90 2HD1 ILE 90 -2.742 -0.344 6.517 719 3HD1 ILE 90 3HD1 ILE 90 -4.098 -1.435 6.244 720 H ALA 91 H ALA 91 1.440 -1.986 8.634 721 HA ALA 91 HA ALA 91 3.695 -1.708 7.006 722 1HB ALA 91 1HB ALA 91 3.515 -1.467 10.005 723 2HB ALA 91 2HB ALA 91 3.182 -0.189 8.836 724 3HB ALA 91 3HB ALA 91 4.814 -0.837 8.994 725 H VAL 92 H VAL 92 3.196 -3.865 9.800 726 HA VAL 92 HA VAL 92 5.743 -5.088 9.653 727 HB VAL 92 HB VAL 92 3.179 -6.169 10.838 728 1HG1 VAL 92 1HG1 VAL 92 6.033 -7.037 11.290 729 2HG1 VAL 92 2HG1 VAL 92 4.795 -7.952 10.430 730 3HG1 VAL 92 3HG1 VAL 92 4.621 -7.641 12.158 731 1HG2 VAL 92 1HG2 VAL 92 4.087 -5.370 12.966 732 2HG2 VAL 92 2HG2 VAL 92 3.862 -4.046 11.822 733 3HG2 VAL 92 3HG2 VAL 92 5.476 -4.690 12.117 734 H GLY 93 H GLY 93 2.590 -5.967 8.302 735 1HA GLY 93 1HA GLY 93 3.312 -8.479 7.271 736 2HA GLY 93 2HA GLY 93 2.003 -7.471 6.673 737 H ALA 94 H ALA 94 3.413 -5.269 5.741 738 HA ALA 94 HA ALA 94 4.307 -6.289 3.225 739 1HB ALA 94 1HB ALA 94 4.378 -3.462 4.273 740 2HB ALA 94 2HB ALA 94 3.023 -4.208 3.424 741 3HB ALA 94 3HB ALA 94 4.558 -3.959 2.589 742 H ALA 95 H ALA 95 5.898 -5.017 6.084 743 HA ALA 95 HA ALA 95 8.433 -4.559 4.954 744 1HB ALA 95 1HB ALA 95 9.271 -4.529 7.213 745 2HB ALA 95 2HB ALA 95 7.815 -5.334 7.798 746 3HB ALA 95 3HB ALA 95 7.717 -3.696 7.151 747 H MET 96 H MET 96 6.996 -7.440 6.394 748 HA MET 96 HA MET 96 9.423 -8.944 6.309 749 1HB MET 96 1HB MET 96 6.554 -9.824 6.644 750 2HB MET 96 2HB MET 96 7.946 -10.886 6.817 751 1HG MET 96 1HG MET 96 8.762 -9.492 8.657 752 2HG MET 96 2HG MET 96 7.340 -8.464 8.496 753 1HE MET 96 1HE MET 96 4.847 -9.306 8.960 754 2HE MET 96 2HE MET 96 4.448 -10.939 9.492 755 3HE MET 96 3HE MET 96 5.063 -10.668 7.860 756 H ALA 97 H ALA 97 6.556 -8.757 4.240 757 HA ALA 97 HA ALA 97 7.378 -10.866 2.510 758 1HB ALA 97 1HB ALA 97 5.030 -10.280 2.842 759 2HB ALA 97 2HB ALA 97 5.481 -10.196 1.138 760 3HB ALA 97 3HB ALA 97 5.313 -8.714 2.082 761 H GLU 98 H GLU 98 8.360 -7.639 2.775 762 HA GLU 98 HA GLU 98 9.655 -6.263 1.521 763 1HB GLU 98 1HB GLU 98 10.882 -8.378 0.878 764 2HB GLU 98 2HB GLU 98 9.865 -8.451 -0.554 765 1HG GLU 98 1HG GLU 98 10.704 -6.121 -1.094 766 2HG GLU 98 2HG GLU 98 11.907 -6.375 0.170 767 H ILE 99 H ILE 99 7.242 -5.612 1.477 768 HA ILE 99 HA ILE 99 6.535 -5.020 -1.326 769 HB ILE 99 HB ILE 99 4.608 -5.210 0.999 770 1HG1 ILE 99 1HG1 ILE 99 4.988 -7.095 -1.341 771 2HG1 ILE 99 2HG1 ILE 99 5.489 -7.424 0.314 772 1HG2 ILE 99 1HG2 ILE 99 2.872 -4.971 -0.697 773 2HG2 ILE 99 2HG2 ILE 99 4.101 -4.843 -1.954 774 3HG2 ILE 99 3HG2 ILE 99 3.964 -3.585 -0.724 775 1HD1 ILE 99 1HD1 ILE 99 3.402 -8.552 -0.236 776 2HD1 ILE 99 2HD1 ILE 99 2.654 -6.998 -0.609 777 3HD1 ILE 99 3HD1 ILE 99 3.167 -7.358 1.041 778 HA PRO 100 HA PRO 100 8.258 -1.110 0.380 779 1HB PRO 100 1HB PRO 100 7.226 -0.455 -2.357 780 2HB PRO 100 2HB PRO 100 8.708 0.088 -1.557 781 1HG PRO 100 1HG PRO 100 8.760 -1.884 -3.355 782 2HG PRO 100 2HG PRO 100 9.792 -1.926 -1.917 783 1HD PRO 100 1HD PRO 100 7.402 -3.538 -2.561 784 2HD PRO 100 2HD PRO 100 8.753 -3.908 -1.475 785 H LEU 101 H LEU 101 6.954 -0.321 1.867 786 HA LEU 101 HA LEU 101 4.372 0.828 1.048 787 1HB LEU 101 1HB LEU 101 3.868 -1.192 2.213 788 2HB LEU 101 2HB LEU 101 5.041 -0.841 3.465 789 HG LEU 101 HG LEU 101 3.608 1.052 4.216 790 1HD1 LEU 101 1HD1 LEU 101 2.424 1.484 2.127 791 2HD1 LEU 101 2HD1 LEU 101 1.299 1.164 3.446 792 3HD1 LEU 101 3HD1 LEU 101 1.629 -0.086 2.247 793 1HD2 LEU 101 1HD2 LEU 101 2.291 -1.655 4.145 794 2HD2 LEU 101 2HD2 LEU 101 1.930 -0.357 5.283 795 3HD2 LEU 101 3HD2 LEU 101 3.518 -1.125 5.295 796 H VAL 102 H VAL 102 4.319 2.926 1.411 797 HA VAL 102 HA VAL 102 5.702 4.019 3.757 798 HB VAL 102 HB VAL 102 6.376 6.014 2.418 799 1HG1 VAL 102 1HG1 VAL 102 8.015 4.301 2.940 800 2HG1 VAL 102 2HG1 VAL 102 8.312 4.956 1.330 801 3HG1 VAL 102 3HG1 VAL 102 7.540 3.381 1.512 802 1HG2 VAL 102 1HG2 VAL 102 6.442 5.862 -0.016 803 2HG2 VAL 102 2HG2 VAL 102 4.785 5.740 0.577 804 3HG2 VAL 102 3HG2 VAL 102 5.641 4.290 0.050 805 H GLU 103 H GLU 103 4.932 6.306 4.213 806 HA GLU 103 HA GLU 103 2.077 6.492 3.531 807 1HB GLU 103 1HB GLU 103 1.832 7.766 5.669 808 2HB GLU 103 2HB GLU 103 2.279 6.078 5.871 809 1HG GLU 103 1HG GLU 103 4.505 6.634 6.423 810 2HG GLU 103 2HG GLU 103 4.288 8.308 5.908 811 H VAL 104 H VAL 104 1.241 8.358 2.835 812 HA VAL 104 HA VAL 104 3.118 10.550 2.274 813 HB VAL 104 HB VAL 104 1.296 11.311 0.657 814 1HG1 VAL 104 1HG1 VAL 104 2.696 8.682 0.176 815 2HG1 VAL 104 2HG1 VAL 104 3.369 10.290 -0.092 816 3HG1 VAL 104 3HG1 VAL 104 2.022 9.723 -1.078 817 1HG2 VAL 104 1HG2 VAL 104 -0.531 9.975 1.561 818 2HG2 VAL 104 2HG2 VAL 104 0.325 8.495 1.130 819 3HG2 VAL 104 3HG2 VAL 104 -0.245 9.584 -0.135 820 H ARG 105 H ARG 105 2.647 12.633 2.877 821 HA ARG 105 HA ARG 105 0.861 12.806 5.159 822 1HB ARG 105 1HB ARG 105 3.256 13.667 5.140 823 2HB ARG 105 2HB ARG 105 2.681 14.966 4.104 824 1HG ARG 105 1HG ARG 105 2.761 15.772 6.347 825 2HG ARG 105 2HG ARG 105 1.066 15.594 5.886 826 1HD ARG 105 1HD ARG 105 1.475 14.757 8.152 827 2HD ARG 105 2HD ARG 105 0.954 13.465 7.069 828 HE ARG 105 HE ARG 105 3.805 13.890 7.674 829 1HH1 ARG 105 1HH1 ARG 105 0.971 11.819 7.644 830 2HH1 ARG 105 2HH1 ARG 105 1.879 10.380 7.996 831 1HH2 ARG 105 1HH2 ARG 105 4.989 11.995 8.110 832 2HH2 ARG 105 2HH2 ARG 105 4.148 10.469 8.266 833 H ASP 106 H ASP 106 0.965 13.834 1.857 834 HA ASP 106 HA ASP 106 -1.095 15.858 2.388 835 1HB ASP 106 1HB ASP 106 1.122 16.448 1.190 836 2HB ASP 106 2HB ASP 106 0.414 15.634 -0.201 837 H GLU 107 H GLU 107 -3.014 15.832 1.378 838 HA GLU 107 HA GLU 107 -4.014 13.338 0.442 839 1HB GLU 107 1HB GLU 107 -5.233 15.223 1.714 840 2HB GLU 107 2HB GLU 107 -5.395 15.999 0.147 841 1HG GLU 107 1HG GLU 107 -7.406 14.863 0.489 842 2HG GLU 107 2HG GLU 107 -6.496 13.855 -0.637 843 H LYS 108 H LYS 108 -2.562 16.059 -1.102 844 HA LYS 108 HA LYS 108 -3.846 15.917 -3.603 845 1HB LYS 108 1HB LYS 108 -1.261 17.087 -2.667 846 2HB LYS 108 2HB LYS 108 -1.663 17.065 -4.377 847 1HG LYS 108 1HG LYS 108 -3.803 18.222 -3.802 848 2HG LYS 108 2HG LYS 108 -3.186 18.392 -2.158 849 1HD LYS 108 1HD LYS 108 -1.356 19.738 -2.909 850 2HD LYS 108 2HD LYS 108 -1.747 19.418 -4.601 851 1HE LYS 108 1HE LYS 108 -3.499 20.888 -2.641 852 2HE LYS 108 2HE LYS 108 -2.498 21.643 -3.880 853 1HZ LYS 108 1HZ LYS 108 -4.859 21.392 -4.512 854 2HZ LYS 108 2HZ LYS 108 -4.678 19.705 -4.458 855 3HZ LYS 108 3HZ LYS 108 -3.796 20.617 -5.578 856 H PHE 109 H PHE 109 -1.468 13.895 -2.197 857 HA PHE 109 HA PHE 109 -0.310 12.815 -4.518 858 1HB PHE 109 1HB PHE 109 0.504 12.308 -2.239 859 2HB PHE 109 2HB PHE 109 -0.978 11.416 -1.913 860 HD1 PHE 109 HD1 PHE 109 1.975 11.486 -4.154 861 HD2 PHE 109 HD2 PHE 109 -1.114 9.146 -2.396 862 HE1 PHE 109 HE1 PHE 109 3.018 9.450 -5.047 863 HE2 PHE 109 HE2 PHE 109 -0.073 7.102 -3.288 864 HZ PHE 109 HZ PHE 109 1.995 7.251 -4.614 865 H PHE 110 H PHE 110 -3.248 11.996 -2.735 866 HA PHE 110 HA PHE 110 -4.045 9.923 -4.550 867 1HB PHE 110 1HB PHE 110 -5.705 11.358 -2.465 868 2HB PHE 110 2HB PHE 110 -6.059 9.798 -3.204 869 HD1 PHE 110 HD1 PHE 110 -4.108 11.570 -0.713 870 HD2 PHE 110 HD2 PHE 110 -4.748 7.818 -2.608 871 HE1 PHE 110 HE1 PHE 110 -2.831 10.460 1.066 872 HE2 PHE 110 HE2 PHE 110 -3.474 6.696 -0.827 873 HZ PHE 110 HZ PHE 110 -2.507 8.022 1.011 874 H GLU 111 H GLU 111 -4.664 13.313 -4.106 875 HA GLU 111 HA GLU 111 -6.840 13.736 -5.753 876 1HB GLU 111 1HB GLU 111 -5.857 15.408 -4.257 877 2HB GLU 111 2HB GLU 111 -4.412 15.464 -5.254 878 1HG GLU 111 1HG GLU 111 -5.869 16.240 -7.127 879 2HG GLU 111 2HG GLU 111 -7.167 16.396 -5.947 880 H ALA 112 H ALA 112 -3.384 13.605 -6.536 881 HA ALA 112 HA ALA 112 -3.911 14.231 -9.319 882 1HB ALA 112 1HB ALA 112 -2.011 15.256 -8.184 883 2HB ALA 112 2HB ALA 112 -1.493 14.285 -9.562 884 3HB ALA 112 3HB ALA 112 -1.302 13.662 -7.924 885 H VAL 113 H VAL 113 -3.362 11.382 -7.411 886 HA VAL 113 HA VAL 113 -2.197 9.872 -9.550 887 HB VAL 113 HB VAL 113 -1.771 9.413 -7.115 888 1HG1 VAL 113 1HG1 VAL 113 -4.469 8.076 -7.230 889 2HG1 VAL 113 2HG1 VAL 113 -4.090 9.546 -6.334 890 3HG1 VAL 113 3HG1 VAL 113 -3.329 8.020 -5.886 891 1HG2 VAL 113 1HG2 VAL 113 -1.112 7.837 -8.848 892 2HG2 VAL 113 2HG2 VAL 113 -2.708 7.092 -8.800 893 3HG2 VAL 113 3HG2 VAL 113 -1.642 6.983 -7.399 894 H LYS 114 H LYS 114 -3.085 8.484 -10.935 895 HA LYS 114 HA LYS 114 -5.850 7.618 -10.581 896 1HB LYS 114 1HB LYS 114 -4.722 8.956 -13.027 897 2HB LYS 114 2HB LYS 114 -6.054 7.814 -13.152 898 1HG LYS 114 1HG LYS 114 -7.339 9.214 -11.562 899 2HG LYS 114 2HG LYS 114 -6.026 10.394 -11.605 900 1HD LYS 114 1HD LYS 114 -6.345 10.716 -13.969 901 2HD LYS 114 2HD LYS 114 -7.569 9.448 -14.012 902 1HE LYS 114 1HE LYS 114 -8.614 11.638 -14.015 903 2HE LYS 114 2HE LYS 114 -8.989 10.774 -12.528 904 1HZ LYS 114 1HZ LYS 114 -8.415 13.133 -12.189 905 2HZ LYS 114 2HZ LYS 114 -6.856 12.823 -12.786 906 3HZ LYS 114 3HZ LYS 114 -7.380 12.079 -11.351 907 H THR 115 H THR 115 -6.308 5.646 -11.875 908 HA THR 115 HA THR 115 -3.987 3.934 -11.732 909 HB THR 115 HB THR 115 -6.226 3.199 -10.894 910 HG1 THR 115 HG1 THR 115 -4.393 1.815 -12.074 911 1HG2 THR 115 1HG2 THR 115 -7.881 2.372 -12.503 912 2HG2 THR 115 2HG2 THR 115 -6.904 2.998 -13.832 913 3HG2 THR 115 3HG2 THR 115 -7.633 4.110 -12.672 914 H GLY 116 H GLY 116 -2.911 2.984 -13.405 915 1HA GLY 116 1HA GLY 116 -2.974 2.220 -15.747 916 2HA GLY 116 2HA GLY 116 -3.797 3.724 -16.128 917 H ASP 117 H ASP 117 -1.958 5.185 -14.256 918 HA ASP 117 HA ASP 117 0.135 5.646 -16.202 919 1HB ASP 117 1HB ASP 117 -0.710 7.071 -13.692 920 2HB ASP 117 2HB ASP 117 0.814 7.452 -14.488 921 H ARG 118 H ARG 118 2.280 6.425 -14.705 922 HA ARG 118 HA ARG 118 3.103 3.859 -13.516 923 1HB ARG 118 1HB ARG 118 4.233 4.177 -15.603 924 2HB ARG 118 2HB ARG 118 4.668 5.826 -15.179 925 1HG ARG 118 1HG ARG 118 6.113 4.983 -13.395 926 2HG ARG 118 2HG ARG 118 5.690 3.329 -13.846 927 1HD ARG 118 1HD ARG 118 7.857 4.078 -14.772 928 2HD ARG 118 2HD ARG 118 6.691 3.606 -16.008 929 HE ARG 118 HE ARG 118 6.267 6.198 -15.988 930 1HH1 ARG 118 1HH1 ARG 118 9.353 4.589 -15.616 931 2HH1 ARG 118 2HH1 ARG 118 10.220 5.782 -16.539 932 1HH2 ARG 118 1HH2 ARG 118 7.427 7.782 -17.184 933 2HH2 ARG 118 2HH2 ARG 118 9.140 7.589 -17.425 934 H VAL 119 H VAL 119 3.953 3.854 -11.554 935 HA VAL 119 HA VAL 119 4.802 6.418 -10.380 936 HB VAL 119 HB VAL 119 3.417 4.116 -8.986 937 1HG1 VAL 119 1HG1 VAL 119 4.506 6.675 -7.808 938 2HG1 VAL 119 2HG1 VAL 119 5.168 5.059 -7.561 939 3HG1 VAL 119 3HG1 VAL 119 3.566 5.457 -6.947 940 1HG2 VAL 119 1HG2 VAL 119 1.673 5.761 -8.503 941 2HG2 VAL 119 2HG2 VAL 119 1.909 5.566 -10.240 942 3HG2 VAL 119 3HG2 VAL 119 2.567 6.977 -9.416 943 H VAL 120 H VAL 120 6.841 6.466 -9.702 944 HA VAL 120 HA VAL 120 8.309 3.934 -9.437 945 HB VAL 120 HB VAL 120 9.406 6.752 -9.597 946 1HG1 VAL 120 1HG1 VAL 120 11.565 5.662 -9.948 947 2HG1 VAL 120 2HG1 VAL 120 10.805 4.081 -9.754 948 3HG1 VAL 120 3HG1 VAL 120 10.866 5.204 -8.394 949 1HG2 VAL 120 1HG2 VAL 120 8.330 6.103 -11.685 950 2HG2 VAL 120 2HG2 VAL 120 9.272 4.612 -11.719 951 3HG2 VAL 120 3HG2 VAL 120 10.081 6.172 -11.876 952 H VAL 121 H VAL 121 8.443 3.165 -7.434 953 HA VAL 121 HA VAL 121 8.259 5.061 -5.189 954 HB VAL 121 HB VAL 121 7.633 2.102 -5.218 955 1HG1 VAL 121 1HG1 VAL 121 7.216 4.145 -3.040 956 2HG1 VAL 121 2HG1 VAL 121 8.454 2.889 -3.045 957 3HG1 VAL 121 3HG1 VAL 121 6.747 2.446 -2.979 958 1HG2 VAL 121 1HG2 VAL 121 5.787 4.489 -5.102 959 2HG2 VAL 121 2HG2 VAL 121 5.296 2.798 -4.983 960 3HG2 VAL 121 3HG2 VAL 121 5.996 3.409 -6.481 961 H ASN 122 H ASN 122 9.925 5.303 -3.881 962 HA ASN 122 HA ASN 122 11.910 3.140 -3.695 963 1HB ASN 122 1HB ASN 122 12.834 4.912 -5.133 964 2HB ASN 122 2HB ASN 122 12.532 6.102 -3.871 965 1HD2 ASN 122 1HD2 ASN 122 14.753 6.616 -3.903 966 2HD2 ASN 122 2HD2 ASN 122 15.917 5.604 -3.116 967 H ALA 123 H ALA 123 11.457 2.377 -1.717 968 HA ALA 123 HA ALA 123 10.563 4.156 0.385 969 1HB ALA 123 1HB ALA 123 11.005 1.173 0.440 970 2HB ALA 123 2HB ALA 123 9.485 1.979 0.052 971 3HB ALA 123 3HB ALA 123 10.174 2.131 1.669 972 H ASP 124 H ASP 124 13.546 2.973 -0.687 973 HA ASP 124 HA ASP 124 14.840 2.924 1.888 974 1HB ASP 124 1HB ASP 124 15.634 2.438 -0.903 975 2HB ASP 124 2HB ASP 124 16.890 3.168 0.092 976 H GLU 125 H GLU 125 13.738 5.357 -0.086 977 HA GLU 125 HA GLU 125 15.571 7.302 1.153 978 1HB GLU 125 1HB GLU 125 16.085 7.031 -1.238 979 2HB GLU 125 2HB GLU 125 14.419 7.399 -1.643 980 1HG GLU 125 1HG GLU 125 14.688 9.656 -0.791 981 2HG GLU 125 2HG GLU 125 16.344 9.289 -0.313 982 H GLY 126 H GLY 126 12.346 6.337 0.476 983 1HA GLY 126 1HA GLY 126 10.332 7.226 1.207 984 2HA GLY 126 2HA GLY 126 11.227 8.556 1.941 985 H TYR 127 H TYR 127 10.491 7.264 -1.288 986 HA TYR 127 HA TYR 127 10.158 9.992 -2.281 987 1HB TYR 127 1HB TYR 127 12.573 9.339 -2.441 988 2HB TYR 127 2HB TYR 127 12.097 8.002 -3.477 989 HD1 TYR 127 HD1 TYR 127 11.722 8.327 -5.793 990 HD2 TYR 127 HD2 TYR 127 12.241 11.682 -3.229 991 HE1 TYR 127 HE1 TYR 127 11.987 9.781 -7.757 992 HE2 TYR 127 HE2 TYR 127 12.498 13.144 -5.185 993 HH TYR 127 HH TYR 127 13.282 12.828 -7.605 994 H VAL 128 H VAL 128 8.649 10.109 -3.854 995 HA VAL 128 HA VAL 128 7.950 7.678 -5.313 996 HB VAL 128 HB VAL 128 6.323 7.733 -3.538 997 1HG1 VAL 128 1HG1 VAL 128 4.772 9.615 -3.233 998 2HG1 VAL 128 2HG1 VAL 128 5.694 10.547 -4.414 999 3HG1 VAL 128 3HG1 VAL 128 6.444 10.059 -2.895 1000 1HG2 VAL 128 1HG2 VAL 128 5.534 7.006 -5.708 1001 2HG2 VAL 128 2HG2 VAL 128 5.126 8.666 -6.141 1002 3HG2 VAL 128 3HG2 VAL 128 4.248 7.851 -4.847 1003 H GLU 129 H GLU 129 7.816 8.004 -7.397 1004 HA GLU 129 HA GLU 129 7.671 10.779 -8.378 1005 1HB GLU 129 1HB GLU 129 9.886 9.711 -8.636 1006 2HB GLU 129 2HB GLU 129 9.141 8.410 -9.553 1007 1HG GLU 129 1HG GLU 129 8.533 9.964 -11.310 1008 2HG GLU 129 2HG GLU 129 9.199 11.305 -10.376 1009 H LEU 130 H LEU 130 5.931 11.221 -9.596 1010 HA LEU 130 HA LEU 130 4.477 8.970 -10.808 1011 1HB LEU 130 1HB LEU 130 3.122 10.246 -9.254 1012 2HB LEU 130 2HB LEU 130 3.540 11.742 -10.069 1013 HG LEU 130 HG LEU 130 2.426 10.697 -12.143 1014 1HD1 LEU 130 1HD1 LEU 130 2.292 8.425 -11.307 1015 2HD1 LEU 130 2HD1 LEU 130 0.689 9.060 -11.681 1016 3HD1 LEU 130 3HD1 LEU 130 1.228 8.955 -10.004 1017 1HD2 LEU 130 1HD2 LEU 130 1.490 12.581 -10.921 1018 2HD2 LEU 130 2HD2 LEU 130 0.756 11.478 -9.755 1019 3HD2 LEU 130 3HD2 LEU 130 0.217 11.472 -11.435 1020 H ILE 131 H ILE 131 4.482 8.769 -12.942 1021 HA ILE 131 HA ILE 131 4.975 11.183 -14.560 1022 HB ILE 131 HB ILE 131 5.702 8.403 -15.452 1023 1HG1 ILE 131 1HG1 ILE 131 8.118 9.393 -15.193 1024 2HG1 ILE 131 2HG1 ILE 131 7.359 10.451 -14.010 1025 1HG2 ILE 131 1HG2 ILE 131 6.397 11.122 -16.532 1026 2HG2 ILE 131 2HG2 ILE 131 5.249 9.979 -17.230 1027 3HG2 ILE 131 3HG2 ILE 131 6.968 9.586 -17.184 1028 1HD1 ILE 131 1HD1 ILE 131 8.379 8.532 -12.946 1029 2HD1 ILE 131 2HD1 ILE 131 7.399 7.443 -13.927 1030 3HD1 ILE 131 3HD1 ILE 131 6.628 8.497 -12.739 1031 H GLU 132 H GLU 132 3.366 11.714 -15.782 1032 HA GLU 132 HA GLU 132 1.094 9.951 -16.020 1033 1HB GLU 132 1HB GLU 132 -0.029 11.885 -17.059 1034 2HB GLU 132 2HB GLU 132 0.609 12.228 -15.461 1035 1HG GLU 132 1HG GLU 132 2.076 12.946 -17.970 1036 2HG GLU 132 2HG GLU 132 0.876 13.992 -17.236 Start of MODEL 3 1 H VAL 1 H VAL 1 5.000 14.805 -11.020 2 HA VAL 1 HA VAL 1 6.371 16.891 -9.455 3 HB VAL 1 HB VAL 1 3.668 15.727 -8.762 4 1HG1 VAL 1 1HG1 VAL 1 5.250 17.971 -7.518 5 2HG1 VAL 1 2HG1 VAL 1 4.972 16.375 -6.822 6 3HG1 VAL 1 3HG1 VAL 1 3.620 17.484 -7.052 7 1HG2 VAL 1 1HG2 VAL 1 3.478 17.178 -10.719 8 2HG2 VAL 1 2HG2 VAL 1 4.312 18.467 -9.851 9 3HG2 VAL 1 3HG2 VAL 1 2.727 17.916 -9.306 10 H LYS 2 H LYS 2 7.531 16.167 -7.773 11 HA LYS 2 HA LYS 2 7.477 13.281 -7.224 12 1HB LYS 2 1HB LYS 2 9.562 15.287 -6.346 13 2HB LYS 2 2HB LYS 2 9.686 13.534 -6.306 14 1HG LYS 2 1HG LYS 2 9.622 13.493 -8.760 15 2HG LYS 2 2HG LYS 2 9.558 15.257 -8.769 16 1HD LYS 2 1HD LYS 2 11.714 15.243 -7.482 17 2HD LYS 2 2HD LYS 2 11.797 13.503 -7.771 18 1HE LYS 2 1HE LYS 2 13.126 14.663 -9.419 19 2HE LYS 2 2HE LYS 2 11.719 13.945 -10.203 20 1HZ LYS 2 1HZ LYS 2 11.983 16.794 -9.390 21 2HZ LYS 2 2HZ LYS 2 10.634 16.110 -10.155 22 3HZ LYS 2 3HZ LYS 2 12.115 16.206 -10.976 23 H PHE 3 H PHE 3 6.129 12.794 -5.608 24 HA PHE 3 HA PHE 3 5.553 14.768 -3.551 25 1HB PHE 3 1HB PHE 3 4.438 11.980 -3.867 26 2HB PHE 3 2HB PHE 3 3.812 13.241 -2.818 27 HD1 PHE 3 HD1 PHE 3 2.597 15.139 -3.735 28 HD2 PHE 3 HD2 PHE 3 4.001 11.987 -6.227 29 HE1 PHE 3 HE1 PHE 3 1.101 15.900 -5.532 30 HE2 PHE 3 HE2 PHE 3 2.507 12.742 -8.032 31 HZ PHE 3 HZ PHE 3 1.055 14.703 -7.684 32 H ALA 4 H ALA 4 6.029 14.557 -1.406 33 HA ALA 4 HA ALA 4 8.219 12.736 -0.793 34 1HB ALA 4 1HB ALA 4 8.451 15.108 -0.213 35 2HB ALA 4 2HB ALA 4 8.524 14.078 1.216 36 3HB ALA 4 3HB ALA 4 7.052 14.979 0.852 37 H CYS 5 H CYS 5 7.987 10.945 0.368 38 HA CYS 5 HA CYS 5 5.507 10.599 1.919 39 1HB CYS 5 1HB CYS 5 7.084 8.342 0.709 40 2HB CYS 5 2HB CYS 5 5.424 8.328 1.288 41 HG CYS 5 HG CYS 5 5.554 10.528 -1.097 42 H ARG 6 H ARG 6 5.722 9.216 3.810 43 HA ARG 6 HA ARG 6 8.435 9.328 4.929 44 1HB ARG 6 1HB ARG 6 6.790 10.477 6.284 45 2HB ARG 6 2HB ARG 6 5.755 9.056 6.302 46 1HG ARG 6 1HG ARG 6 7.098 7.933 7.799 47 2HG ARG 6 2HG ARG 6 8.529 8.877 7.383 48 1HD ARG 6 1HD ARG 6 6.118 10.008 8.789 49 2HD ARG 6 2HD ARG 6 7.547 9.397 9.624 50 HE ARG 6 HE ARG 6 8.285 11.313 7.672 51 1HH1 ARG 6 1HH1 ARG 6 6.743 11.101 10.807 52 2HH1 ARG 6 2HH1 ARG 6 7.349 12.637 11.355 53 1HH2 ARG 6 1HH2 ARG 6 9.067 13.326 8.360 54 2HH2 ARG 6 2HH2 ARG 6 8.645 13.930 9.938 55 H ALA 7 H ALA 7 9.564 7.548 4.915 56 HA ALA 7 HA ALA 7 8.422 5.117 3.981 57 1HB ALA 7 1HB ALA 7 11.208 5.608 5.004 58 2HB ALA 7 2HB ALA 7 10.671 5.880 3.347 59 3HB ALA 7 3HB ALA 7 10.668 4.249 4.017 60 H ILE 8 H ILE 8 7.795 3.364 5.037 61 HA ILE 8 HA ILE 8 8.286 3.237 7.934 62 HB ILE 8 HB ILE 8 6.228 1.721 6.312 63 1HG1 ILE 8 1HG1 ILE 8 5.722 4.126 6.369 64 2HG1 ILE 8 2HG1 ILE 8 4.568 3.219 7.340 65 1HG2 ILE 8 1HG2 ILE 8 6.938 0.540 8.329 66 2HG2 ILE 8 2HG2 ILE 8 5.277 1.111 8.479 67 3HG2 ILE 8 3HG2 ILE 8 6.579 1.969 9.300 68 1HD1 ILE 8 1HD1 ILE 8 5.241 5.289 8.433 69 2HD1 ILE 8 2HD1 ILE 8 6.924 4.761 8.405 70 3HD1 ILE 8 3HD1 ILE 8 5.737 3.878 9.365 71 H THR 9 H THR 9 8.107 1.202 5.019 72 HA THR 9 HA THR 9 10.275 -0.430 6.156 73 HB THR 9 HB THR 9 9.519 -2.255 4.646 74 HG1 THR 9 HG1 THR 9 7.800 -2.018 3.380 75 1HG2 THR 9 1HG2 THR 9 8.799 -2.250 6.976 76 2HG2 THR 9 2HG2 THR 9 7.520 -2.881 5.941 77 3HG2 THR 9 3HG2 THR 9 7.417 -1.235 6.565 78 H ARG 10 H ARG 10 11.426 -1.597 4.140 79 HA ARG 10 HA ARG 10 12.327 0.643 2.472 80 1HB ARG 10 1HB ARG 10 13.680 -1.987 3.086 81 2HB ARG 10 2HB ARG 10 14.353 -0.708 2.088 82 1HG ARG 10 1HG ARG 10 14.415 0.785 3.991 83 2HG ARG 10 2HG ARG 10 13.673 -0.455 5.008 84 1HD ARG 10 1HD ARG 10 15.597 -1.935 4.513 85 2HD ARG 10 2HD ARG 10 16.346 -0.608 3.629 86 HE ARG 10 HE ARG 10 16.332 0.625 5.784 87 1HH1 ARG 10 1HH1 ARG 10 16.129 -2.868 5.761 88 2HH1 ARG 10 2HH1 ARG 10 16.904 -3.060 7.305 89 1HH2 ARG 10 1HH2 ARG 10 17.318 0.389 7.855 90 2HH2 ARG 10 2HH2 ARG 10 17.591 -1.206 8.486 91 H GLY 11 H GLY 11 13.153 -0.014 0.275 92 1HA GLY 11 1HA GLY 11 12.888 -1.976 -1.344 93 2HA GLY 11 2HA GLY 11 11.178 -1.794 -0.975 94 H ARG 12 H ARG 12 12.494 -1.554 -3.536 95 HA ARG 12 HA ARG 12 11.483 1.109 -4.212 96 1HB ARG 12 1HB ARG 12 13.975 1.207 -4.114 97 2HB ARG 12 2HB ARG 12 14.041 -0.055 -5.334 98 1HG ARG 12 1HG ARG 12 12.820 1.449 -6.881 99 2HG ARG 12 2HG ARG 12 12.930 2.722 -5.663 100 1HD ARG 12 1HD ARG 12 14.706 2.989 -7.279 101 2HD ARG 12 2HD ARG 12 15.385 2.522 -5.719 102 HE ARG 12 HE ARG 12 14.924 0.528 -7.849 103 1HH1 ARG 12 1HH1 ARG 12 17.032 2.101 -5.523 104 2HH1 ARG 12 2HH1 ARG 12 18.369 1.024 -5.823 105 1HH2 ARG 12 1HH2 ARG 12 16.656 -0.892 -8.221 106 2HH2 ARG 12 2HH2 ARG 12 18.146 -0.695 -7.350 107 H ALA 13 H ALA 13 10.151 1.057 -5.965 108 HA ALA 13 HA ALA 13 10.233 -1.270 -7.721 109 1HB ALA 13 1HB ALA 13 7.895 -1.821 -7.368 110 2HB ALA 13 2HB ALA 13 7.771 -0.573 -6.131 111 3HB ALA 13 3HB ALA 13 8.805 -1.978 -5.867 112 H GLU 14 H GLU 14 8.691 -1.076 -9.525 113 HA GLU 14 HA GLU 14 7.609 1.560 -10.056 114 1HB GLU 14 1HB GLU 14 8.840 1.827 -12.161 115 2HB GLU 14 2HB GLU 14 9.947 1.771 -10.795 116 1HG GLU 14 1HG GLU 14 10.383 -0.599 -11.275 117 2HG GLU 14 2HG GLU 14 9.333 -0.486 -12.684 118 H GLY 15 H GLY 15 6.017 1.516 -11.662 119 1HA GLY 15 1HA GLY 15 5.673 -0.229 -13.712 120 2HA GLY 15 2HA GLY 15 4.996 -1.092 -12.339 121 H GLU 16 H GLU 16 3.086 -0.928 -13.794 122 HA GLU 16 HA GLU 16 1.730 1.491 -14.186 123 1HB GLU 16 1HB GLU 16 0.663 -1.329 -13.908 124 2HB GLU 16 2HB GLU 16 -0.219 0.029 -14.568 125 1HG GLU 16 1HG GLU 16 2.331 -1.009 -15.755 126 2HG GLU 16 2HG GLU 16 0.732 -1.561 -16.246 127 H ALA 17 H ALA 17 0.583 2.700 -12.830 128 HA ALA 17 HA ALA 17 0.469 1.967 -10.045 129 1HB ALA 17 1HB ALA 17 1.030 4.252 -10.740 130 2HB ALA 17 2HB ALA 17 -0.390 4.211 -9.695 131 3HB ALA 17 3HB ALA 17 -0.581 4.431 -11.435 132 H LEU 18 H LEU 18 -1.120 0.909 -9.151 133 HA LEU 18 HA LEU 18 -3.792 0.994 -10.375 134 1HB LEU 18 1HB LEU 18 -2.521 -1.229 -9.904 135 2HB LEU 18 2HB LEU 18 -2.900 -0.914 -8.222 136 HG LEU 18 HG LEU 18 -5.329 -0.848 -8.860 137 1HD1 LEU 18 1HD1 LEU 18 -5.955 -1.859 -11.000 138 2HD1 LEU 18 2HD1 LEU 18 -4.254 -1.913 -11.466 139 3HD1 LEU 18 3HD1 LEU 18 -5.051 -0.360 -11.221 140 1HD2 LEU 18 1HD2 LEU 18 -4.322 -2.826 -7.839 141 2HD2 LEU 18 2HD2 LEU 18 -3.842 -3.415 -9.430 142 3HD2 LEU 18 3HD2 LEU 18 -5.552 -3.279 -9.019 143 H VAL 19 H VAL 19 -5.010 2.516 -9.438 144 HA VAL 19 HA VAL 19 -4.431 3.191 -6.628 145 HB VAL 19 HB VAL 19 -5.653 4.995 -8.725 146 1HG1 VAL 19 1HG1 VAL 19 -4.688 5.559 -5.922 147 2HG1 VAL 19 2HG1 VAL 19 -6.367 5.547 -6.464 148 3HG1 VAL 19 3HG1 VAL 19 -5.251 6.771 -7.071 149 1HG2 VAL 19 1HG2 VAL 19 -2.844 4.922 -7.624 150 2HG2 VAL 19 2HG2 VAL 19 -3.497 6.192 -8.656 151 3HG2 VAL 19 3HG2 VAL 19 -3.334 4.550 -9.279 152 H THR 20 H THR 20 -5.891 2.453 -5.289 153 HA THR 20 HA THR 20 -8.677 2.226 -6.184 154 HB THR 20 HB THR 20 -7.364 0.932 -3.783 155 HG1 THR 20 HG1 THR 20 -6.991 0.336 -6.281 156 1HG2 THR 20 1HG2 THR 20 -9.363 -0.517 -3.808 157 2HG2 THR 20 2HG2 THR 20 -10.033 0.456 -5.116 158 3HG2 THR 20 3HG2 THR 20 -9.775 1.176 -3.527 159 H LYS 21 H LYS 21 -9.847 3.948 -5.637 160 HA LYS 21 HA LYS 21 -9.058 5.606 -3.385 161 1HB LYS 21 1HB LYS 21 -11.239 5.917 -5.454 162 2HB LYS 21 2HB LYS 21 -10.897 7.096 -4.196 163 1HG LYS 21 1HG LYS 21 -8.631 7.391 -5.100 164 2HG LYS 21 2HG LYS 21 -9.012 6.241 -6.385 165 1HD LYS 21 1HD LYS 21 -10.774 7.704 -7.200 166 2HD LYS 21 2HD LYS 21 -10.471 8.833 -5.877 167 1HE LYS 21 1HE LYS 21 -8.506 8.090 -8.046 168 2HE LYS 21 2HE LYS 21 -9.441 9.583 -7.975 169 1HZ LYS 21 1HZ LYS 21 -7.371 8.711 -6.039 170 2HZ LYS 21 2HZ LYS 21 -8.329 10.090 -5.849 171 3HZ LYS 21 3HZ LYS 21 -7.241 9.984 -7.142 172 H GLU 22 H GLU 22 -10.155 2.912 -2.971 173 HA GLU 22 HA GLU 22 -12.523 3.601 -1.362 174 1HB GLU 22 1HB GLU 22 -12.963 1.971 -3.190 175 2HB GLU 22 2HB GLU 22 -11.747 0.914 -2.500 176 1HG GLU 22 1HG GLU 22 -14.024 0.203 -1.964 177 2HG GLU 22 2HG GLU 22 -13.073 0.568 -0.530 178 H TYR 23 H TYR 23 -12.705 2.479 0.657 179 HA TYR 23 HA TYR 23 -10.084 1.950 1.881 180 1HB TYR 23 1HB TYR 23 -12.724 2.683 3.175 181 2HB TYR 23 2HB TYR 23 -11.222 2.387 4.042 182 HD1 TYR 23 HD1 TYR 23 -12.928 4.682 1.699 183 HD2 TYR 23 HD2 TYR 23 -9.557 4.083 4.219 184 HE1 TYR 23 HE1 TYR 23 -12.349 7.059 1.475 185 HE2 TYR 23 HE2 TYR 23 -8.965 6.460 4.003 186 HH TYR 23 HH TYR 23 -11.105 8.769 2.659 187 H ILE 24 H ILE 24 -9.779 -0.185 1.461 188 HA ILE 24 HA ILE 24 -11.970 -2.057 1.734 189 HB ILE 24 HB ILE 24 -10.389 -3.758 0.958 190 1HG1 ILE 24 1HG1 ILE 24 -8.368 -1.506 0.818 191 2HG1 ILE 24 2HG1 ILE 24 -8.360 -2.782 2.034 192 1HG2 ILE 24 1HG2 ILE 24 -11.633 -2.445 -0.677 193 2HG2 ILE 24 2HG2 ILE 24 -10.039 -2.873 -1.296 194 3HG2 ILE 24 3HG2 ILE 24 -10.344 -1.240 -0.705 195 1HD1 ILE 24 1HD1 ILE 24 -8.046 -3.176 -0.936 196 2HD1 ILE 24 2HD1 ILE 24 -8.006 -4.444 0.290 197 3HD1 ILE 24 3HD1 ILE 24 -6.749 -3.207 0.260 198 H SER 25 H SER 25 -11.385 -4.217 2.806 199 HA SER 25 HA SER 25 -10.302 -3.591 5.466 200 1HB SER 25 1HB SER 25 -11.749 -5.521 6.227 201 2HB SER 25 2HB SER 25 -12.625 -4.110 5.641 202 HG SER 25 HG SER 25 -12.517 -5.385 3.513 203 H PHE 26 H PHE 26 -8.464 -4.526 6.023 204 HA PHE 26 HA PHE 26 -7.332 -6.597 4.366 205 1HB PHE 26 1HB PHE 26 -6.291 -5.156 6.809 206 2HB PHE 26 2HB PHE 26 -5.392 -6.419 5.974 207 HD1 PHE 26 HD1 PHE 26 -6.703 -2.999 5.727 208 HD2 PHE 26 HD2 PHE 26 -4.342 -6.011 3.875 209 HE1 PHE 26 HE1 PHE 26 -5.806 -1.325 4.164 210 HE2 PHE 26 HE2 PHE 26 -3.437 -4.345 2.306 211 HZ PHE 26 HZ PHE 26 -4.168 -1.999 2.451 212 H LEU 27 H LEU 27 -9.350 -7.862 5.058 213 HA LEU 27 HA LEU 27 -8.550 -9.644 7.269 214 1HB LEU 27 1HB LEU 27 -11.304 -8.922 6.259 215 2HB LEU 27 2HB LEU 27 -11.014 -10.334 7.251 216 HG LEU 27 HG LEU 27 -11.837 -8.652 8.693 217 1HD1 LEU 27 1HD1 LEU 27 -9.996 -8.287 10.249 218 2HD1 LEU 27 2HD1 LEU 27 -8.845 -8.752 8.996 219 3HD1 LEU 27 3HD1 LEU 27 -10.000 -9.933 9.614 220 1HD2 LEU 27 1HD2 LEU 27 -11.489 -6.706 7.287 221 2HD2 LEU 27 2HD2 LEU 27 -9.749 -6.799 7.561 222 3HD2 LEU 27 3HD2 LEU 27 -10.833 -6.428 8.902 223 H GLY 28 H GLY 28 -10.473 -9.600 4.275 224 1HA GLY 28 1HA GLY 28 -8.855 -11.786 3.221 225 2HA GLY 28 2HA GLY 28 -10.579 -12.094 3.406 226 H GLY 29 H GLY 29 -8.845 -9.172 2.411 227 1HA GLY 29 1HA GLY 29 -10.762 -8.662 0.349 228 2HA GLY 29 2HA GLY 29 -9.325 -7.712 0.691 229 H ILE 30 H ILE 30 -7.277 -9.404 0.252 230 HA ILE 30 HA ILE 30 -7.503 -9.814 -2.639 231 HB ILE 30 HB ILE 30 -5.020 -9.640 -0.914 232 1HG1 ILE 30 1HG1 ILE 30 -6.227 -7.581 -2.780 233 2HG1 ILE 30 2HG1 ILE 30 -6.328 -7.526 -1.023 234 1HG2 ILE 30 1HG2 ILE 30 -3.825 -9.397 -3.038 235 2HG2 ILE 30 2HG2 ILE 30 -5.336 -9.635 -3.916 236 3HG2 ILE 30 3HG2 ILE 30 -4.665 -10.945 -2.943 237 1HD1 ILE 30 1HD1 ILE 30 -3.893 -7.345 -0.896 238 2HD1 ILE 30 2HD1 ILE 30 -4.606 -6.038 -1.842 239 3HD1 ILE 30 3HD1 ILE 30 -3.807 -7.382 -2.658 240 H ASP 31 H ASP 31 -7.274 -11.760 -3.566 241 HA ASP 31 HA ASP 31 -7.362 -14.161 -2.059 242 1HB ASP 31 1HB ASP 31 -8.340 -13.928 -4.319 243 2HB ASP 31 2HB ASP 31 -6.723 -13.748 -4.993 244 H LYS 32 H LYS 32 -5.775 -15.610 -1.530 245 HA LYS 32 HA LYS 32 -3.200 -14.497 -1.094 246 1HB LYS 32 1HB LYS 32 -2.723 -16.447 0.137 247 2HB LYS 32 2HB LYS 32 -4.451 -16.197 0.351 248 1HG LYS 32 1HG LYS 32 -4.874 -17.875 -1.440 249 2HG LYS 32 2HG LYS 32 -3.140 -18.157 -1.523 250 1HD LYS 32 1HD LYS 32 -4.680 -18.469 1.037 251 2HD LYS 32 2HD LYS 32 -4.485 -19.790 -0.117 252 1HE LYS 32 1HE LYS 32 -2.050 -19.588 0.077 253 2HE LYS 32 2HE LYS 32 -2.253 -18.273 1.235 254 1HZ LYS 32 1HZ LYS 32 -3.324 -21.011 1.658 255 2HZ LYS 32 2HZ LYS 32 -3.235 -19.749 2.792 256 3HZ LYS 32 3HZ LYS 32 -1.814 -20.495 2.239 257 H GLU 33 H GLU 33 -4.497 -16.412 -3.646 258 HA GLU 33 HA GLU 33 -1.818 -17.391 -4.373 259 1HB GLU 33 1HB GLU 33 -3.543 -19.081 -3.771 260 2HB GLU 33 2HB GLU 33 -4.525 -18.514 -5.111 261 1HG GLU 33 1HG GLU 33 -2.626 -19.095 -6.614 262 2HG GLU 33 2HG GLU 33 -1.856 -19.875 -5.237 263 H THR 34 H THR 34 -4.759 -15.920 -5.579 264 HA THR 34 HA THR 34 -3.608 -15.710 -8.257 265 HB THR 34 HB THR 34 -6.302 -14.695 -7.762 266 HG1 THR 34 HG1 THR 34 -6.172 -16.597 -6.404 267 1HG2 THR 34 1HG2 THR 34 -5.375 -14.847 -10.012 268 2HG2 THR 34 2HG2 THR 34 -6.752 -15.938 -9.837 269 3HG2 THR 34 3HG2 THR 34 -5.110 -16.578 -9.788 270 H GLY 35 H GLY 35 -4.026 -13.837 -5.459 271 1HA GLY 35 1HA GLY 35 -3.565 -11.627 -5.013 272 2HA GLY 35 2HA GLY 35 -2.891 -11.514 -6.633 273 H ILE 36 H ILE 36 -6.125 -12.606 -6.260 274 HA ILE 36 HA ILE 36 -7.090 -10.300 -7.741 275 HB ILE 36 HB ILE 36 -8.479 -12.853 -6.895 276 1HG1 ILE 36 1HG1 ILE 36 -6.693 -13.139 -8.589 277 2HG1 ILE 36 2HG1 ILE 36 -8.290 -13.538 -9.207 278 1HG2 ILE 36 1HG2 ILE 36 -10.282 -12.198 -8.425 279 2HG2 ILE 36 2HG2 ILE 36 -9.482 -10.649 -8.685 280 3HG2 ILE 36 3HG2 ILE 36 -10.097 -11.065 -7.086 281 1HD1 ILE 36 1HD1 ILE 36 -8.398 -11.403 -10.354 282 2HD1 ILE 36 2HD1 ILE 36 -6.963 -12.312 -10.834 283 3HD1 ILE 36 3HD1 ILE 36 -6.817 -10.966 -9.705 284 H VAL 37 H VAL 37 -8.089 -8.626 -6.792 285 HA VAL 37 HA VAL 37 -8.750 -8.615 -4.012 286 HB VAL 37 HB VAL 37 -9.642 -6.659 -6.149 287 1HG1 VAL 37 1HG1 VAL 37 -10.946 -6.505 -4.089 288 2HG1 VAL 37 2HG1 VAL 37 -9.917 -5.088 -4.293 289 3HG1 VAL 37 3HG1 VAL 37 -9.460 -6.352 -3.151 290 1HG2 VAL 37 1HG2 VAL 37 -7.224 -6.813 -6.125 291 2HG2 VAL 37 2HG2 VAL 37 -7.202 -6.603 -4.374 292 3HG2 VAL 37 3HG2 VAL 37 -7.737 -5.282 -5.414 293 H LYS 38 H LYS 38 -10.423 -9.627 -3.177 294 HA LYS 38 HA LYS 38 -12.643 -10.454 -4.859 295 1HB LYS 38 1HB LYS 38 -11.987 -11.089 -1.975 296 2HB LYS 38 2HB LYS 38 -13.297 -11.811 -2.897 297 1HG LYS 38 1HG LYS 38 -10.408 -12.032 -3.706 298 2HG LYS 38 2HG LYS 38 -11.218 -13.202 -2.660 299 1HD LYS 38 1HD LYS 38 -12.823 -13.691 -4.412 300 2HD LYS 38 2HD LYS 38 -12.101 -12.460 -5.450 301 1HE LYS 38 1HE LYS 38 -10.053 -13.700 -5.603 302 2HE LYS 38 2HE LYS 38 -10.613 -14.868 -4.405 303 1HZ LYS 38 1HZ LYS 38 -12.150 -15.759 -5.904 304 2HZ LYS 38 2HZ LYS 38 -10.756 -15.532 -6.842 305 3HZ LYS 38 3HZ LYS 38 -12.049 -14.441 -6.965 306 H GLU 39 H GLU 39 -11.963 -8.176 -2.303 307 HA GLU 39 HA GLU 39 -14.634 -7.739 -1.472 308 1HB GLU 39 1HB GLU 39 -12.547 -7.024 -0.221 309 2HB GLU 39 2HB GLU 39 -12.399 -5.706 -1.375 310 1HG GLU 39 1HG GLU 39 -14.546 -4.815 -0.683 311 2HG GLU 39 2HG GLU 39 -14.773 -6.168 0.421 312 H ASP 40 H ASP 40 -16.236 -6.722 -2.451 313 HA ASP 40 HA ASP 40 -15.865 -5.881 -5.148 314 1HB ASP 40 1HB ASP 40 -17.870 -7.097 -4.477 315 2HB ASP 40 2HB ASP 40 -18.328 -5.781 -3.398 316 H CYS 41 H CYS 41 -16.048 -3.916 -6.074 317 HA CYS 41 HA CYS 41 -16.822 -1.532 -4.795 318 1HB CYS 41 1HB CYS 41 -14.765 -1.755 -3.517 319 2HB CYS 41 2HB CYS 41 -13.839 -2.003 -4.995 320 HG CYS 41 HG CYS 41 -15.496 0.902 -4.275 321 H GLU 42 H GLU 42 -14.067 -2.178 -6.919 322 HA GLU 42 HA GLU 42 -15.532 -1.516 -9.308 323 1HB GLU 42 1HB GLU 42 -15.035 0.731 -8.523 324 2HB GLU 42 2HB GLU 42 -13.351 0.303 -8.262 325 1HG GLU 42 1HG GLU 42 -13.652 1.648 -10.271 326 2HG GLU 42 2HG GLU 42 -13.011 0.050 -10.640 327 H ILE 43 H ILE 43 -12.282 -1.759 -7.906 328 HA ILE 43 HA ILE 43 -11.269 -3.107 -10.243 329 HB ILE 43 HB ILE 43 -9.200 -3.420 -8.705 330 1HG1 ILE 43 1HG1 ILE 43 -9.017 -1.612 -6.982 331 2HG1 ILE 43 2HG1 ILE 43 -10.737 -1.319 -7.157 332 1HG2 ILE 43 1HG2 ILE 43 -9.226 -1.932 -10.577 333 2HG2 ILE 43 2HG2 ILE 43 -8.483 -1.104 -9.208 334 3HG2 ILE 43 3HG2 ILE 43 -10.144 -0.731 -9.668 335 1HD1 ILE 43 1HD1 ILE 43 -10.230 -2.658 -5.191 336 2HD1 ILE 43 2HD1 ILE 43 -9.486 -3.885 -6.217 337 3HD1 ILE 43 3HD1 ILE 43 -11.214 -3.555 -6.347 338 H LYS 44 H LYS 44 -13.400 -4.216 -8.341 339 HA LYS 44 HA LYS 44 -12.358 -6.545 -7.123 340 1HB LYS 44 1HB LYS 44 -14.525 -5.508 -6.548 341 2HB LYS 44 2HB LYS 44 -15.166 -5.984 -8.108 342 1HG LYS 44 1HG LYS 44 -14.134 -8.008 -6.145 343 2HG LYS 44 2HG LYS 44 -15.775 -7.374 -6.045 344 1HD LYS 44 1HD LYS 44 -14.568 -8.784 -8.424 345 2HD LYS 44 2HD LYS 44 -15.689 -9.495 -7.262 346 1HE LYS 44 1HE LYS 44 -16.283 -7.132 -9.038 347 2HE LYS 44 2HE LYS 44 -16.787 -8.789 -9.360 348 1HZ LYS 44 1HZ LYS 44 -18.623 -7.732 -8.389 349 2HZ LYS 44 2HZ LYS 44 -17.696 -6.989 -7.185 350 3HZ LYS 44 3HZ LYS 44 -17.960 -8.667 -7.137 351 H GLY 45 H GLY 45 -11.715 -8.356 -7.989 352 1HA GLY 45 1HA GLY 45 -12.011 -10.215 -9.484 353 2HA GLY 45 2HA GLY 45 -12.693 -9.105 -10.664 354 H GLU 46 H GLU 46 -10.354 -7.232 -9.824 355 HA GLU 46 HA GLU 46 -8.495 -8.313 -11.766 356 1HB GLU 46 1HB GLU 46 -8.980 -5.653 -10.538 357 2HB GLU 46 2HB GLU 46 -7.370 -6.000 -11.158 358 1HG GLU 46 1HG GLU 46 -9.907 -6.293 -12.739 359 2HG GLU 46 2HG GLU 46 -8.845 -4.889 -12.781 360 H SER 47 H SER 47 -6.204 -8.265 -11.397 361 HA SER 47 HA SER 47 -5.545 -9.169 -8.693 362 1HB SER 47 1HB SER 47 -3.464 -10.065 -10.021 363 2HB SER 47 2HB SER 47 -5.008 -10.912 -10.129 364 HG SER 47 HG SER 47 -5.388 -9.955 -12.103 365 H VAL 48 H VAL 48 -3.458 -8.639 -7.830 366 HA VAL 48 HA VAL 48 -2.603 -5.928 -8.600 367 HB VAL 48 HB VAL 48 -1.735 -5.741 -6.290 368 1HG1 VAL 48 1HG1 VAL 48 -4.642 -6.526 -6.509 369 2HG1 VAL 48 2HG1 VAL 48 -3.962 -4.922 -6.785 370 3HG1 VAL 48 3HG1 VAL 48 -3.929 -5.628 -5.169 371 1HG2 VAL 48 1HG2 VAL 48 -2.355 -7.430 -4.620 372 2HG2 VAL 48 2HG2 VAL 48 -1.291 -8.099 -5.858 373 3HG2 VAL 48 3HG2 VAL 48 -3.019 -8.445 -5.902 374 H ALA 49 H ALA 49 -1.693 -8.544 -9.708 375 HA ALA 49 HA ALA 49 0.860 -9.159 -8.624 376 1HB ALA 49 1HB ALA 49 1.029 -10.756 -10.466 377 2HB ALA 49 2HB ALA 49 -0.425 -10.073 -11.194 378 3HB ALA 49 3HB ALA 49 -0.520 -10.890 -9.634 379 H GLY 50 H GLY 50 2.045 -7.304 -8.736 380 1HA GLY 50 1HA GLY 50 4.014 -6.514 -9.791 381 2HA GLY 50 2HA GLY 50 3.337 -6.965 -11.346 382 H ARG 51 H ARG 51 1.324 -5.236 -9.153 383 HA ARG 51 HA ARG 51 1.623 -2.854 -10.851 384 1HB ARG 51 1HB ARG 51 -0.770 -3.946 -9.374 385 2HB ARG 51 2HB ARG 51 -0.731 -2.326 -10.061 386 1HG ARG 51 1HG ARG 51 -0.411 -3.229 -12.277 387 2HG ARG 51 2HG ARG 51 -0.309 -4.865 -11.628 388 1HD ARG 51 1HD ARG 51 -2.596 -4.869 -11.025 389 2HD ARG 51 2HD ARG 51 -2.739 -3.127 -11.268 390 HE ARG 51 HE ARG 51 -2.025 -3.992 -13.715 391 1HH1 ARG 51 1HH1 ARG 51 -4.530 -5.163 -11.528 392 2HH1 ARG 51 2HH1 ARG 51 -5.627 -5.557 -12.823 393 1HH2 ARG 51 1HH2 ARG 51 -3.469 -4.552 -15.376 394 2HH2 ARG 51 2HH2 ARG 51 -5.022 -5.225 -14.986 395 H ILE 52 H ILE 52 1.290 -0.765 -9.818 396 HA ILE 52 HA ILE 52 2.483 -0.725 -7.136 397 HB ILE 52 HB ILE 52 2.034 1.536 -9.098 398 1HG1 ILE 52 1HG1 ILE 52 3.718 -0.054 -9.886 399 2HG1 ILE 52 2HG1 ILE 52 4.480 1.459 -9.409 400 1HG2 ILE 52 1HG2 ILE 52 3.503 2.841 -7.612 401 2HG2 ILE 52 2HG2 ILE 52 3.505 1.501 -6.465 402 3HG2 ILE 52 3HG2 ILE 52 2.004 2.355 -6.820 403 1HD1 ILE 52 1HD1 ILE 52 5.764 -0.491 -8.690 404 2HD1 ILE 52 2HD1 ILE 52 4.382 -1.041 -7.738 405 3HD1 ILE 52 3HD1 ILE 52 5.195 0.466 -7.322 406 H LEU 53 H LEU 53 1.023 -0.822 -5.544 407 HA LEU 53 HA LEU 53 -1.695 0.051 -6.052 408 1HB LEU 53 1HB LEU 53 -0.348 -1.604 -3.971 409 2HB LEU 53 2HB LEU 53 -1.882 -0.854 -3.579 410 HG LEU 53 HG LEU 53 -2.976 -2.036 -5.400 411 1HD1 LEU 53 1HD1 LEU 53 -1.814 -3.714 -6.722 412 2HD1 LEU 53 2HD1 LEU 53 -0.286 -3.270 -5.961 413 3HD1 LEU 53 3HD1 LEU 53 -1.130 -2.110 -6.988 414 1HD2 LEU 53 1HD2 LEU 53 -1.302 -3.874 -3.698 415 2HD2 LEU 53 2HD2 LEU 53 -2.786 -4.310 -4.543 416 3HD2 LEU 53 3HD2 LEU 53 -2.833 -3.134 -3.232 417 H VAL 54 H VAL 54 -2.639 1.797 -5.283 418 HA VAL 54 HA VAL 54 -1.311 3.310 -3.125 419 HB VAL 54 HB VAL 54 -2.831 4.480 -5.470 420 1HG1 VAL 54 1HG1 VAL 54 -1.412 5.834 -3.177 421 2HG1 VAL 54 2HG1 VAL 54 -3.154 5.792 -3.451 422 3HG1 VAL 54 3HG1 VAL 54 -2.105 6.654 -4.577 423 1HG2 VAL 54 1HG2 VAL 54 0.118 4.603 -4.831 424 2HG2 VAL 54 2HG2 VAL 54 -0.688 5.425 -6.165 425 3HG2 VAL 54 3HG2 VAL 54 -0.618 3.664 -6.130 426 H PHE 55 H PHE 55 -2.546 3.459 -1.359 427 HA PHE 55 HA PHE 55 -5.475 3.378 -1.688 428 1HB PHE 55 1HB PHE 55 -3.791 1.836 0.286 429 2HB PHE 55 2HB PHE 55 -5.519 2.092 0.502 430 HD1 PHE 55 HD1 PHE 55 -2.968 0.489 -1.625 431 HD2 PHE 55 HD2 PHE 55 -7.117 0.855 -0.736 432 HE1 PHE 55 HE1 PHE 55 -3.439 -1.480 -3.019 433 HE2 PHE 55 HE2 PHE 55 -7.590 -1.119 -2.127 434 HZ PHE 55 HZ PHE 55 -5.747 -2.288 -3.268 435 HA PRO 56 HA PRO 56 -5.321 6.835 1.125 436 1HB PRO 56 1HB PRO 56 -7.954 7.095 1.599 437 2HB PRO 56 2HB PRO 56 -7.253 7.494 0.026 438 1HG PRO 56 1HG PRO 56 -8.746 5.046 0.872 439 2HG PRO 56 2HG PRO 56 -8.844 5.946 -0.651 440 1HD PRO 56 1HD PRO 56 -7.403 3.622 -0.297 441 2HD PRO 56 2HD PRO 56 -7.071 4.828 -1.554 442 H GLY 57 H GLY 57 -6.341 3.680 1.895 443 1HA GLY 57 1HA GLY 57 -5.451 3.176 4.254 444 2HA GLY 57 2HA GLY 57 -6.670 4.350 4.734 445 H GLY 58 H GLY 58 -7.598 2.661 6.011 446 1HA GLY 58 1HA GLY 58 -9.895 1.548 5.218 447 2HA GLY 58 2HA GLY 58 -8.722 0.362 4.653 448 H LYS 59 H LYS 59 -9.264 -1.279 6.057 449 HA LYS 59 HA LYS 59 -8.647 -0.716 8.882 450 1HB LYS 59 1HB LYS 59 -10.690 -2.594 7.711 451 2HB LYS 59 2HB LYS 59 -10.112 -2.755 9.363 452 1HG LYS 59 1HG LYS 59 -10.898 -0.489 9.857 453 2HG LYS 59 2HG LYS 59 -11.487 -0.338 8.201 454 1HD LYS 59 1HD LYS 59 -12.405 -2.468 10.123 455 2HD LYS 59 2HD LYS 59 -13.241 -0.934 9.881 456 1HE LYS 59 1HE LYS 59 -13.590 -1.456 7.545 457 2HE LYS 59 2HE LYS 59 -12.670 -2.950 7.715 458 1HZ LYS 59 1HZ LYS 59 -15.133 -2.393 9.270 459 2HZ LYS 59 2HZ LYS 59 -14.331 -3.876 9.088 460 3HZ LYS 59 3HZ LYS 59 -15.147 -3.186 7.770 461 H GLY 60 H GLY 60 -6.620 -1.358 9.131 462 1HA GLY 60 1HA GLY 60 -5.709 -3.828 7.827 463 2HA GLY 60 2HA GLY 60 -4.678 -2.600 8.553 464 H SER 61 H SER 61 -6.902 -5.225 9.228 465 HA SER 61 HA SER 61 -6.377 -5.155 12.062 466 1HB SER 61 1HB SER 61 -8.592 -5.803 10.937 467 2HB SER 61 2HB SER 61 -7.820 -7.340 10.558 468 HG SER 61 HG SER 61 -8.972 -6.556 12.837 469 H THR 62 H THR 62 -6.111 -7.618 12.928 470 HA THR 62 HA THR 62 -3.359 -8.124 12.547 471 HB THR 62 HB THR 62 -3.818 -10.132 14.013 472 HG1 THR 62 HG1 THR 62 -6.338 -9.159 14.642 473 1HG2 THR 62 1HG2 THR 62 -4.323 -8.784 16.005 474 2HG2 THR 62 2HG2 THR 62 -4.830 -7.448 14.970 475 3HG2 THR 62 3HG2 THR 62 -3.150 -7.981 14.964 476 H VAL 63 H VAL 63 -6.066 -9.179 10.806 477 HA VAL 63 HA VAL 63 -4.918 -11.714 9.986 478 HB VAL 63 HB VAL 63 -7.395 -10.372 8.896 479 1HG1 VAL 63 1HG1 VAL 63 -8.071 -12.643 8.306 480 2HG1 VAL 63 2HG1 VAL 63 -6.559 -13.269 8.966 481 3HG1 VAL 63 3HG1 VAL 63 -6.536 -12.217 7.551 482 1HG2 VAL 63 1HG2 VAL 63 -7.598 -10.551 11.318 483 2HG2 VAL 63 2HG2 VAL 63 -7.177 -12.263 11.238 484 3HG2 VAL 63 3HG2 VAL 63 -8.677 -11.689 10.511 485 H GLY 64 H GLY 64 -4.740 -8.462 9.030 486 1HA GLY 64 1HA GLY 64 -4.452 -8.900 6.200 487 2HA GLY 64 2HA GLY 64 -4.122 -7.406 7.064 488 H SER 65 H SER 65 -2.334 -8.938 8.931 489 HA SER 65 HA SER 65 0.067 -8.600 7.387 490 1HB SER 65 1HB SER 65 1.148 -9.296 9.598 491 2HB SER 65 2HB SER 65 0.188 -7.817 9.621 492 HG SER 65 HG SER 65 -0.741 -10.391 10.412 493 H TYR 66 H TYR 66 1.769 -10.229 7.351 494 HA TYR 66 HA TYR 66 2.695 -12.292 7.133 495 1HB TYR 66 1HB TYR 66 1.000 -12.742 9.162 496 2HB TYR 66 2HB TYR 66 0.264 -13.792 7.957 497 HD1 TYR 66 HD1 TYR 66 1.280 -15.866 7.354 498 HD2 TYR 66 HD2 TYR 66 3.354 -13.119 9.852 499 HE1 TYR 66 HE1 TYR 66 2.945 -17.600 7.874 500 HE2 TYR 66 HE2 TYR 66 5.023 -14.842 10.375 501 HH TYR 66 HH TYR 66 5.315 -17.712 8.627 502 H VAL 67 H VAL 67 -0.703 -12.123 6.105 503 HA VAL 67 HA VAL 67 -0.648 -14.121 4.148 504 HB VAL 67 HB VAL 67 -2.278 -11.573 4.112 505 1HG1 VAL 67 1HG1 VAL 67 -2.774 -14.225 2.759 506 2HG1 VAL 67 2HG1 VAL 67 -2.300 -12.725 1.961 507 3HG1 VAL 67 3HG1 VAL 67 -3.869 -12.842 2.757 508 1HG2 VAL 67 1HG2 VAL 67 -4.004 -12.861 5.247 509 2HG2 VAL 67 2HG2 VAL 67 -2.527 -12.812 6.207 510 3HG2 VAL 67 3HG2 VAL 67 -2.939 -14.266 5.299 511 H LEU 68 H LEU 68 0.384 -10.778 4.019 512 HA LEU 68 HA LEU 68 0.604 -10.411 1.271 513 1HB LEU 68 1HB LEU 68 2.380 -9.301 3.443 514 2HB LEU 68 2HB LEU 68 2.269 -8.681 1.807 515 HG LEU 68 HG LEU 68 0.011 -8.700 3.814 516 1HD1 LEU 68 1HD1 LEU 68 1.792 -7.144 4.435 517 2HD1 LEU 68 2HD1 LEU 68 0.340 -6.290 3.917 518 3HD1 LEU 68 3HD1 LEU 68 1.722 -6.418 2.829 519 1HD2 LEU 68 1HD2 LEU 68 0.208 -7.484 1.060 520 2HD2 LEU 68 2HD2 LEU 68 -1.127 -7.261 2.190 521 3HD2 LEU 68 3HD2 LEU 68 -0.792 -8.860 1.526 522 H LEU 69 H LEU 69 2.679 -12.145 3.477 523 HA LEU 69 HA LEU 69 4.995 -12.240 1.843 524 1HB LEU 69 1HB LEU 69 5.031 -12.663 4.261 525 2HB LEU 69 2HB LEU 69 4.084 -14.117 4.026 526 HG LEU 69 HG LEU 69 5.938 -15.104 2.730 527 1HD1 LEU 69 1HD1 LEU 69 8.136 -14.028 2.767 528 2HD1 LEU 69 2HD1 LEU 69 7.421 -12.602 3.521 529 3HD1 LEU 69 3HD1 LEU 69 6.951 -13.065 1.886 530 1HD2 LEU 69 1HD2 LEU 69 7.444 -15.471 4.625 531 2HD2 LEU 69 2HD2 LEU 69 5.751 -15.551 5.116 532 3HD2 LEU 69 3HD2 LEU 69 6.704 -14.111 5.470 533 H ASN 70 H ASN 70 2.110 -14.187 2.105 534 HA ASN 70 HA ASN 70 3.009 -16.417 0.610 535 1HB ASN 70 1HB ASN 70 0.945 -16.300 2.097 536 2HB ASN 70 2HB ASN 70 0.153 -15.448 0.775 537 1HD2 ASN 70 1HD2 ASN 70 -0.301 -16.579 -1.159 538 2HD2 ASN 70 2HD2 ASN 70 -0.294 -18.311 -1.209 539 H LEU 71 H LEU 71 1.330 -13.444 -0.238 540 HA LEU 71 HA LEU 71 0.838 -13.913 -2.941 541 1HB LEU 71 1HB LEU 71 1.557 -11.313 -1.577 542 2HB LEU 71 2HB LEU 71 0.849 -11.453 -3.175 543 HG LEU 71 HG LEU 71 -0.503 -12.386 -0.641 544 1HD1 LEU 71 1HD1 LEU 71 -0.910 -9.851 -2.226 545 2HD1 LEU 71 2HD1 LEU 71 -0.209 -9.964 -0.612 546 3HD1 LEU 71 3HD1 LEU 71 -1.900 -10.392 -0.870 547 1HD2 LEU 71 1HD2 LEU 71 -1.493 -12.019 -3.466 548 2HD2 LEU 71 2HD2 LEU 71 -2.500 -12.428 -2.077 549 3HD2 LEU 71 3HD2 LEU 71 -1.256 -13.553 -2.628 550 H ARG 72 H ARG 72 3.688 -12.641 -1.303 551 HA ARG 72 HA ARG 72 5.170 -11.856 -3.541 552 1HB ARG 72 1HB ARG 72 5.688 -11.283 -1.165 553 2HB ARG 72 2HB ARG 72 6.241 -12.932 -0.922 554 1HG ARG 72 1HG ARG 72 7.902 -12.500 -2.786 555 2HG ARG 72 2HG ARG 72 7.465 -10.797 -2.638 556 1HD ARG 72 1HD ARG 72 8.003 -11.014 -0.174 557 2HD ARG 72 2HD ARG 72 8.713 -12.579 -0.564 558 HE ARG 72 HE ARG 72 9.663 -10.155 -1.935 559 1HH1 ARG 72 1HH1 ARG 72 10.251 -12.883 0.183 560 2HH1 ARG 72 2HH1 ARG 72 11.962 -12.620 0.271 561 1HH2 ARG 72 1HH2 ARG 72 11.915 -9.754 -1.779 562 2HH2 ARG 72 2HH2 ARG 72 12.912 -10.830 -0.834 563 H LYS 73 H LYS 73 5.199 -14.923 -1.744 564 HA LYS 73 HA LYS 73 7.240 -16.052 -3.407 565 1HB LYS 73 1HB LYS 73 5.456 -17.312 -1.324 566 2HB LYS 73 2HB LYS 73 6.801 -18.125 -2.112 567 1HG LYS 73 1HG LYS 73 8.335 -16.433 -1.204 568 2HG LYS 73 2HG LYS 73 6.975 -15.676 -0.371 569 1HD LYS 73 1HD LYS 73 7.867 -18.526 0.030 570 2HD LYS 73 2HD LYS 73 8.314 -17.178 1.079 571 1HE LYS 73 1HE LYS 73 5.970 -16.803 1.618 572 2HE LYS 73 2HE LYS 73 5.497 -18.108 0.527 573 1HZ LYS 73 1HZ LYS 73 7.215 -18.440 2.929 574 2HZ LYS 73 2HZ LYS 73 6.659 -19.680 1.912 575 3HZ LYS 73 3HZ LYS 73 5.558 -18.807 2.863 576 H ASN 74 H ASN 74 3.934 -15.670 -3.837 577 HA ASN 74 HA ASN 74 3.702 -17.987 -5.588 578 1HB ASN 74 1HB ASN 74 1.779 -17.252 -4.149 579 2HB ASN 74 2HB ASN 74 1.675 -15.789 -5.127 580 1HD2 ASN 74 1HD2 ASN 74 1.063 -19.176 -4.959 581 2HD2 ASN 74 2HD2 ASN 74 0.189 -19.301 -6.452 582 H GLY 75 H GLY 75 4.202 -14.549 -5.697 583 1HA GLY 75 1HA GLY 75 5.266 -13.493 -7.550 584 2HA GLY 75 2HA GLY 75 4.592 -14.729 -8.605 585 H VAL 76 H VAL 76 2.429 -13.491 -6.288 586 HA VAL 76 HA VAL 76 1.179 -11.805 -8.356 587 HB VAL 76 HB VAL 76 -1.003 -12.346 -7.275 588 1HG1 VAL 76 1HG1 VAL 76 -1.211 -14.580 -8.247 589 2HG1 VAL 76 2HG1 VAL 76 0.547 -14.713 -8.321 590 3HG1 VAL 76 3HG1 VAL 76 -0.289 -13.503 -9.295 591 1HG2 VAL 76 1HG2 VAL 76 -0.271 -12.988 -5.074 592 2HG2 VAL 76 2HG2 VAL 76 0.673 -14.324 -5.733 593 3HG2 VAL 76 3HG2 VAL 76 -1.088 -14.363 -5.819 594 H ALA 77 H ALA 77 3.019 -11.348 -5.883 595 HA ALA 77 HA ALA 77 1.462 -9.722 -4.126 596 1HB ALA 77 1HB ALA 77 3.595 -9.087 -3.146 597 2HB ALA 77 2HB ALA 77 4.450 -9.809 -4.508 598 3HB ALA 77 3HB ALA 77 3.530 -10.830 -3.404 599 HA PRO 78 HA PRO 78 1.745 -5.827 -6.324 600 1HB PRO 78 1HB PRO 78 1.661 -4.476 -3.739 601 2HB PRO 78 2HB PRO 78 0.444 -4.501 -5.017 602 1HG PRO 78 1HG PRO 78 0.101 -5.741 -2.624 603 2HG PRO 78 2HG PRO 78 -0.646 -6.307 -4.130 604 1HD PRO 78 1HD PRO 78 1.776 -7.335 -2.704 605 2HD PRO 78 2HD PRO 78 0.489 -8.233 -3.538 606 H LYS 79 H LYS 79 3.452 -4.538 -6.878 607 HA LYS 79 HA LYS 79 6.002 -5.156 -5.872 608 1HB LYS 79 1HB LYS 79 4.977 -2.991 -7.677 609 2HB LYS 79 2HB LYS 79 6.659 -3.052 -7.193 610 1HG LYS 79 1HG LYS 79 6.719 -5.402 -8.096 611 2HG LYS 79 2HG LYS 79 5.127 -5.074 -8.790 612 1HD LYS 79 1HD LYS 79 6.003 -3.287 -10.122 613 2HD LYS 79 2HD LYS 79 7.567 -3.375 -9.306 614 1HE LYS 79 1HE LYS 79 7.826 -5.685 -10.196 615 2HE LYS 79 2HE LYS 79 6.334 -5.453 -11.106 616 1HZ LYS 79 1HZ LYS 79 8.384 -5.046 -12.401 617 2HZ LYS 79 2HZ LYS 79 8.732 -3.723 -11.396 618 3HZ LYS 79 3HZ LYS 79 7.338 -3.713 -12.363 619 H ALA 80 H ALA 80 3.863 -2.408 -5.312 620 HA ALA 80 HA ALA 80 5.096 -1.911 -2.759 621 1HB ALA 80 1HB ALA 80 5.672 0.422 -3.194 622 2HB ALA 80 2HB ALA 80 5.224 0.226 -4.888 623 3HB ALA 80 3HB ALA 80 6.603 -0.658 -4.233 624 H ILE 81 H ILE 81 3.821 -0.479 -1.451 625 HA ILE 81 HA ILE 81 1.220 0.258 -2.605 626 HB ILE 81 HB ILE 81 1.519 -1.043 0.109 627 1HG1 ILE 81 1HG1 ILE 81 0.352 -2.185 -2.445 628 2HG1 ILE 81 2HG1 ILE 81 1.888 -2.665 -1.729 629 1HG2 ILE 81 1HG2 ILE 81 -0.955 -0.322 -1.462 630 2HG2 ILE 81 2HG2 ILE 81 -0.312 0.597 -0.103 631 3HG2 ILE 81 3HG2 ILE 81 -0.903 -1.046 0.147 632 1HD1 ILE 81 1HD1 ILE 81 -0.835 -3.021 -0.499 633 2HD1 ILE 81 2HD1 ILE 81 0.696 -3.479 0.248 634 3HD1 ILE 81 3HD1 ILE 81 0.162 -4.282 -1.230 635 H ILE 82 H ILE 82 1.028 2.373 -2.394 636 HA ILE 82 HA ILE 82 2.352 3.722 -0.137 637 HB ILE 82 HB ILE 82 1.121 5.064 -2.554 638 1HG1 ILE 82 1HG1 ILE 82 2.820 3.499 -3.351 639 2HG1 ILE 82 2HG1 ILE 82 3.392 5.157 -3.510 640 1HG2 ILE 82 1HG2 ILE 82 3.229 5.985 -0.592 641 2HG2 ILE 82 2HG2 ILE 82 1.540 6.500 -0.613 642 3HG2 ILE 82 3HG2 ILE 82 2.607 6.914 -1.956 643 1HD1 ILE 82 1HD1 ILE 82 5.153 3.691 -2.716 644 2HD1 ILE 82 2HD1 ILE 82 4.160 3.219 -1.338 645 3HD1 ILE 82 3HD1 ILE 82 4.732 4.882 -1.485 646 H ASN 83 H ASN 83 1.140 4.510 1.504 647 HA ASN 83 HA ASN 83 -1.774 4.619 1.088 648 1HB ASN 83 1HB ASN 83 -0.301 3.594 3.518 649 2HB ASN 83 2HB ASN 83 -2.036 3.858 3.445 650 1HD2 ASN 83 1HD2 ASN 83 0.608 1.907 2.318 651 2HD2 ASN 83 2HD2 ASN 83 -0.347 0.587 1.753 652 H LYS 84 H LYS 84 -2.929 6.082 2.385 653 HA LYS 84 HA LYS 84 -1.530 8.496 3.068 654 1HB LYS 84 1HB LYS 84 -3.789 8.590 2.137 655 2HB LYS 84 2HB LYS 84 -4.410 7.664 3.496 656 1HG LYS 84 1HG LYS 84 -3.917 9.478 5.009 657 2HG LYS 84 2HG LYS 84 -3.169 10.400 3.702 658 1HD LYS 84 1HD LYS 84 -5.286 10.510 2.531 659 2HD LYS 84 2HD LYS 84 -6.052 9.514 3.769 660 1HE LYS 84 1HE LYS 84 -5.685 11.235 5.425 661 2HE LYS 84 2HE LYS 84 -4.798 12.211 4.255 662 1HZ LYS 84 1HZ LYS 84 -7.665 11.453 4.018 663 2HZ LYS 84 2HZ LYS 84 -6.799 12.458 2.960 664 3HZ LYS 84 3HZ LYS 84 -7.093 12.961 4.548 665 H LYS 85 H LYS 85 -3.276 5.979 4.843 666 HA LYS 85 HA LYS 85 -1.858 6.824 7.278 667 1HB LYS 85 1HB LYS 85 -4.554 5.464 7.065 668 2HB LYS 85 2HB LYS 85 -3.716 5.808 8.572 669 1HG LYS 85 1HG LYS 85 -3.785 8.234 7.942 670 2HG LYS 85 2HG LYS 85 -4.837 7.778 6.601 671 1HD LYS 85 1HD LYS 85 -5.405 7.238 9.515 672 2HD LYS 85 2HD LYS 85 -6.092 8.563 8.578 673 1HE LYS 85 1HE LYS 85 -7.096 6.888 7.041 674 2HE LYS 85 2HE LYS 85 -6.499 5.610 8.099 675 1HZ LYS 85 1HZ LYS 85 -8.450 7.733 8.817 676 2HZ LYS 85 2HZ LYS 85 -7.809 6.607 9.910 677 3HZ LYS 85 3HZ LYS 85 -8.782 6.076 8.627 678 H THR 86 H THR 86 -0.393 5.445 7.962 679 HA THR 86 HA THR 86 -0.409 2.743 6.850 680 HB THR 86 HB THR 86 1.627 4.030 6.431 681 HG1 THR 86 HG1 THR 86 3.113 2.483 7.374 682 1HG2 THR 86 1HG2 THR 86 1.902 4.139 9.437 683 2HG2 THR 86 2HG2 THR 86 1.598 5.507 8.365 684 3HG2 THR 86 3HG2 THR 86 3.133 4.643 8.280 685 H GLU 87 H GLU 87 -0.593 0.969 8.087 686 HA GLU 87 HA GLU 87 -0.914 1.367 10.981 687 1HB GLU 87 1HB GLU 87 -2.649 0.183 9.248 688 2HB GLU 87 2HB GLU 87 -1.716 -1.212 9.768 689 1HG GLU 87 1HG GLU 87 -3.369 0.642 11.454 690 2HG GLU 87 2HG GLU 87 -3.585 -1.089 11.196 691 H THR 88 H THR 88 0.224 0.086 12.414 692 HA THR 88 HA THR 88 2.831 -0.620 11.558 693 HB THR 88 HB THR 88 1.608 -1.392 14.205 694 HG1 THR 88 HG1 THR 88 2.080 1.110 13.129 695 1HG2 THR 88 1HG2 THR 88 3.898 -1.040 15.015 696 2HG2 THR 88 2HG2 THR 88 4.409 -0.602 13.385 697 3HG2 THR 88 3HG2 THR 88 3.861 -2.243 13.726 698 H ILE 89 H ILE 89 -0.067 -2.512 12.324 699 HA ILE 89 HA ILE 89 1.123 -5.067 12.353 700 HB ILE 89 HB ILE 89 -1.673 -4.251 11.542 701 1HG1 ILE 89 1HG1 ILE 89 -0.620 -5.392 14.143 702 2HG1 ILE 89 2HG1 ILE 89 -1.012 -3.696 13.871 703 1HG2 ILE 89 1HG2 ILE 89 -2.293 -6.594 11.933 704 2HG2 ILE 89 2HG2 ILE 89 -0.594 -6.991 12.192 705 3HG2 ILE 89 3HG2 ILE 89 -1.136 -6.432 10.610 706 1HD1 ILE 89 1HD1 ILE 89 -2.947 -5.995 13.742 707 2HD1 ILE 89 2HD1 ILE 89 -3.339 -4.295 13.486 708 3HD1 ILE 89 3HD1 ILE 89 -2.786 -4.844 15.067 709 H ILE 90 H ILE 90 -0.267 -3.163 9.704 710 HA ILE 90 HA ILE 90 0.145 -5.073 7.667 711 HB ILE 90 HB ILE 90 0.091 -2.061 7.378 712 1HG1 ILE 90 1HG1 ILE 90 -2.175 -4.064 7.209 713 2HG1 ILE 90 2HG1 ILE 90 -1.906 -2.944 8.539 714 1HG2 ILE 90 1HG2 ILE 90 -0.642 -2.536 5.080 715 2HG2 ILE 90 2HG2 ILE 90 -0.428 -4.261 5.379 716 3HG2 ILE 90 3HG2 ILE 90 0.967 -3.182 5.407 717 1HD1 ILE 90 1HD1 ILE 90 -2.536 -2.183 5.696 718 2HD1 ILE 90 2HD1 ILE 90 -2.257 -1.060 7.028 719 3HD1 ILE 90 3HD1 ILE 90 -3.650 -2.142 7.063 720 H ALA 91 H ALA 91 2.131 -2.471 8.970 721 HA ALA 91 HA ALA 91 4.206 -2.516 7.099 722 1HB ALA 91 1HB ALA 91 3.932 -0.732 8.736 723 2HB ALA 91 2HB ALA 91 5.555 -1.418 8.813 724 3HB ALA 91 3HB ALA 91 4.357 -1.846 10.035 725 H VAL 92 H VAL 92 3.876 -4.297 10.167 726 HA VAL 92 HA VAL 92 6.337 -5.618 10.108 727 HB VAL 92 HB VAL 92 3.722 -6.626 11.249 728 1HG1 VAL 92 1HG1 VAL 92 5.337 -8.429 10.998 729 2HG1 VAL 92 2HG1 VAL 92 5.119 -8.022 12.700 730 3HG1 VAL 92 3HG1 VAL 92 6.558 -7.473 11.838 731 1HG2 VAL 92 1HG2 VAL 92 4.572 -5.742 13.381 732 2HG2 VAL 92 2HG2 VAL 92 4.341 -4.472 12.180 733 3HG2 VAL 92 3HG2 VAL 92 5.963 -5.068 12.532 734 H GLY 93 H GLY 93 3.208 -6.533 8.722 735 1HA GLY 93 1HA GLY 93 4.075 -9.065 7.739 736 2HA GLY 93 2HA GLY 93 2.620 -8.207 7.256 737 H ALA 94 H ALA 94 3.843 -5.848 6.291 738 HA ALA 94 HA ALA 94 4.418 -6.728 3.645 739 1HB ALA 94 1HB ALA 94 3.190 -4.674 4.072 740 2HB ALA 94 2HB ALA 94 4.644 -4.354 3.125 741 3HB ALA 94 3HB ALA 94 4.612 -3.973 4.848 742 H ALA 95 H ALA 95 6.378 -5.657 6.341 743 HA ALA 95 HA ALA 95 8.771 -5.113 4.993 744 1HB ALA 95 1HB ALA 95 8.406 -4.531 7.334 745 2HB ALA 95 2HB ALA 95 9.868 -5.499 7.148 746 3HB ALA 95 3HB ALA 95 8.390 -6.240 7.765 747 H MET 96 H MET 96 7.472 -8.143 6.270 748 HA MET 96 HA MET 96 9.777 -9.699 5.667 749 1HB MET 96 1HB MET 96 6.912 -10.501 6.198 750 2HB MET 96 2HB MET 96 8.239 -11.643 6.033 751 1HG MET 96 1HG MET 96 9.346 -10.653 7.966 752 2HG MET 96 2HG MET 96 8.037 -9.484 8.120 753 1HE MET 96 1HE MET 96 5.545 -10.129 8.772 754 2HE MET 96 2HE MET 96 5.009 -11.778 9.094 755 3HE MET 96 3HE MET 96 5.472 -11.306 7.459 756 H ALA 97 H ALA 97 6.885 -8.839 3.919 757 HA ALA 97 HA ALA 97 7.444 -10.698 1.765 758 1HB ALA 97 1HB ALA 97 5.139 -10.320 2.480 759 2HB ALA 97 2HB ALA 97 5.376 -9.876 0.789 760 3HB ALA 97 3HB ALA 97 5.276 -8.621 2.025 761 H GLU 98 H GLU 98 8.790 -7.881 2.596 762 HA GLU 98 HA GLU 98 9.929 -6.227 1.547 763 1HB GLU 98 1HB GLU 98 11.035 -8.234 0.571 764 2HB GLU 98 2HB GLU 98 9.939 -8.135 -0.799 765 1HG GLU 98 1HG GLU 98 10.892 -6.123 -1.550 766 2HG GLU 98 2HG GLU 98 11.745 -5.864 -0.030 767 H ILE 99 H ILE 99 7.225 -5.904 1.594 768 HA ILE 99 HA ILE 99 6.626 -4.612 -0.983 769 HB ILE 99 HB ILE 99 4.693 -5.355 1.225 770 1HG1 ILE 99 1HG1 ILE 99 5.104 -6.608 -1.503 771 2HG1 ILE 99 2HG1 ILE 99 5.596 -7.324 0.028 772 1HG2 ILE 99 1HG2 ILE 99 4.206 -4.239 -1.537 773 2HG2 ILE 99 2HG2 ILE 99 3.988 -3.382 -0.011 774 3HG2 ILE 99 3HG2 ILE 99 2.957 -4.757 -0.405 775 1HD1 ILE 99 1HD1 ILE 99 3.528 -8.301 -0.804 776 2HD1 ILE 99 2HD1 ILE 99 2.764 -6.711 -0.790 777 3HD1 ILE 99 3HD1 ILE 99 3.270 -7.461 0.724 778 HA PRO 100 HA PRO 100 7.964 -1.163 1.737 779 1HB PRO 100 1HB PRO 100 8.129 0.593 -0.397 780 2HB PRO 100 2HB PRO 100 9.451 -0.425 0.183 781 1HG PRO 100 1HG PRO 100 7.578 -0.866 -2.102 782 2HG PRO 100 2HG PRO 100 9.317 -1.201 -1.996 783 1HD PRO 100 1HD PRO 100 7.502 -3.157 -1.783 784 2HD PRO 100 2HD PRO 100 8.992 -3.170 -0.815 785 H LEU 101 H LEU 101 6.333 -0.346 2.872 786 HA LEU 101 HA LEU 101 4.257 1.120 1.397 787 1HB LEU 101 1HB LEU 101 2.639 0.641 3.031 788 2HB LEU 101 2HB LEU 101 3.436 -0.884 2.715 789 HG LEU 101 HG LEU 101 4.189 0.841 5.066 790 1HD1 LEU 101 1HD1 LEU 101 2.706 -0.563 6.422 791 2HD1 LEU 101 2HD1 LEU 101 2.108 -1.339 4.957 792 3HD1 LEU 101 3HD1 LEU 101 1.805 0.376 5.231 793 1HD2 LEU 101 1HD2 LEU 101 5.785 -0.891 4.470 794 2HD2 LEU 101 2HD2 LEU 101 4.503 -2.101 4.480 795 3HD2 LEU 101 3HD2 LEU 101 4.971 -1.300 5.978 796 H VAL 102 H VAL 102 3.888 3.182 1.938 797 HA VAL 102 HA VAL 102 5.417 4.321 4.175 798 HB VAL 102 HB VAL 102 6.089 6.228 2.830 799 1HG1 VAL 102 1HG1 VAL 102 7.736 5.214 1.433 800 2HG1 VAL 102 2HG1 VAL 102 6.776 3.744 1.271 801 3HG1 VAL 102 3HG1 VAL 102 7.500 4.155 2.824 802 1HG2 VAL 102 1HG2 VAL 102 5.677 6.319 0.418 803 2HG2 VAL 102 2HG2 VAL 102 4.173 6.339 1.339 804 3HG2 VAL 102 3HG2 VAL 102 4.695 4.858 0.536 805 H GLU 103 H GLU 103 4.590 6.494 4.815 806 HA GLU 103 HA GLU 103 1.699 6.643 4.317 807 1HB GLU 103 1HB GLU 103 1.476 7.897 6.361 808 2HB GLU 103 2HB GLU 103 2.405 6.446 6.697 809 1HG GLU 103 1HG GLU 103 4.453 7.714 6.752 810 2HG GLU 103 2HG GLU 103 3.598 9.174 6.257 811 H VAL 104 H VAL 104 0.816 8.353 3.322 812 HA VAL 104 HA VAL 104 2.568 10.651 2.749 813 HB VAL 104 HB VAL 104 1.086 11.075 0.765 814 1HG1 VAL 104 1HG1 VAL 104 2.137 9.373 -0.641 815 2HG1 VAL 104 2HG1 VAL 104 2.578 8.456 0.799 816 3HG1 VAL 104 3HG1 VAL 104 3.278 10.051 0.519 817 1HG2 VAL 104 1HG2 VAL 104 -0.858 9.789 1.436 818 2HG2 VAL 104 2HG2 VAL 104 0.084 8.299 1.377 819 3HG2 VAL 104 3HG2 VAL 104 -0.235 9.199 -0.105 820 H ARG 105 H ARG 105 1.933 12.595 3.394 821 HA ARG 105 HA ARG 105 -0.635 12.776 4.797 822 1HB ARG 105 1HB ARG 105 1.631 13.287 5.913 823 2HB ARG 105 2HB ARG 105 1.628 14.761 4.956 824 1HG ARG 105 1HG ARG 105 0.804 15.221 7.168 825 2HG ARG 105 2HG ARG 105 -0.505 15.404 5.996 826 1HD ARG 105 1HD ARG 105 -1.357 13.208 6.565 827 2HD ARG 105 2HD ARG 105 -0.011 12.949 7.675 828 HE ARG 105 HE ARG 105 -1.660 15.270 8.223 829 1HH1 ARG 105 1HH1 ARG 105 -1.037 11.883 8.877 830 2HH1 ARG 105 2HH1 ARG 105 -1.856 11.909 10.407 831 1HH2 ARG 105 1HH2 ARG 105 -2.724 15.297 10.240 832 2HH2 ARG 105 2HH2 ARG 105 -2.817 13.837 11.184 833 H ASP 106 H ASP 106 0.458 13.336 1.830 834 HA ASP 106 HA ASP 106 -0.571 16.054 1.520 835 1HB ASP 106 1HB ASP 106 1.662 15.415 0.568 836 2HB ASP 106 2HB ASP 106 0.821 14.329 -0.535 837 H GLU 107 H GLU 107 -2.536 16.426 0.773 838 HA GLU 107 HA GLU 107 -4.281 14.302 0.025 839 1HB GLU 107 1HB GLU 107 -4.487 17.044 0.790 840 2HB GLU 107 2HB GLU 107 -5.372 16.822 -0.705 841 1HG GLU 107 1HG GLU 107 -6.857 16.522 1.149 842 2HG GLU 107 2HG GLU 107 -6.624 14.973 0.341 843 H LYS 108 H LYS 108 -2.353 16.633 -1.729 844 HA LYS 108 HA LYS 108 -3.813 16.507 -4.157 845 1HB LYS 108 1HB LYS 108 -0.972 17.385 -3.644 846 2HB LYS 108 2HB LYS 108 -1.887 17.679 -5.109 847 1HG LYS 108 1HG LYS 108 -3.528 18.966 -3.760 848 2HG LYS 108 2HG LYS 108 -2.451 18.778 -2.374 849 1HD LYS 108 1HD LYS 108 -2.059 20.923 -3.410 850 2HD LYS 108 2HD LYS 108 -0.654 19.885 -3.668 851 1HE LYS 108 1HE LYS 108 -1.200 21.078 -5.709 852 2HE LYS 108 2HE LYS 108 -1.484 19.352 -5.919 853 1HZ LYS 108 1HZ LYS 108 -3.262 20.779 -6.832 854 2HZ LYS 108 2HZ LYS 108 -3.610 21.320 -5.266 855 3HZ LYS 108 3HZ LYS 108 -3.827 19.687 -5.669 856 H PHE 109 H PHE 109 -1.293 14.602 -2.725 857 HA PHE 109 HA PHE 109 -0.296 13.254 -4.928 858 1HB PHE 109 1HB PHE 109 0.632 12.842 -2.740 859 2HB PHE 109 2HB PHE 109 -0.907 12.225 -2.148 860 HD1 PHE 109 HD1 PHE 109 1.485 11.535 -4.932 861 HD2 PHE 109 HD2 PHE 109 -1.083 9.952 -1.933 862 HE1 PHE 109 HE1 PHE 109 2.157 9.257 -5.568 863 HE2 PHE 109 HE2 PHE 109 -0.414 7.669 -2.563 864 HZ PHE 109 HZ PHE 109 1.207 7.318 -4.383 865 H PHE 110 H PHE 110 -3.214 12.531 -3.036 866 HA PHE 110 HA PHE 110 -3.983 10.339 -4.711 867 1HB PHE 110 1HB PHE 110 -5.504 11.871 -2.595 868 2HB PHE 110 2HB PHE 110 -6.119 10.434 -3.406 869 HD1 PHE 110 HD1 PHE 110 -4.913 8.269 -3.118 870 HD2 PHE 110 HD2 PHE 110 -4.015 11.717 -0.799 871 HE1 PHE 110 HE1 PHE 110 -3.774 6.851 -1.461 872 HE2 PHE 110 HE2 PHE 110 -2.873 10.311 0.861 873 HZ PHE 110 HZ PHE 110 -2.751 7.874 0.530 874 H GLU 111 H GLU 111 -4.625 13.746 -4.623 875 HA GLU 111 HA GLU 111 -6.832 13.843 -6.354 876 1HB GLU 111 1HB GLU 111 -6.144 15.693 -4.898 877 2HB GLU 111 2HB GLU 111 -4.638 15.850 -5.790 878 1HG GLU 111 1HG GLU 111 -5.923 16.436 -7.791 879 2HG GLU 111 2HG GLU 111 -7.398 16.353 -6.833 880 H ALA 112 H ALA 112 -3.341 14.001 -6.878 881 HA ALA 112 HA ALA 112 -3.643 14.462 -9.713 882 1HB ALA 112 1HB ALA 112 -1.226 14.593 -9.748 883 2HB ALA 112 2HB ALA 112 -1.153 14.003 -8.089 884 3HB ALA 112 3HB ALA 112 -1.879 15.572 -8.434 885 H VAL 113 H VAL 113 -2.647 11.766 -7.629 886 HA VAL 113 HA VAL 113 -1.585 10.204 -9.733 887 HB VAL 113 HB VAL 113 -1.091 9.836 -7.295 888 1HG1 VAL 113 1HG1 VAL 113 -2.575 8.344 -6.025 889 2HG1 VAL 113 2HG1 VAL 113 -3.778 8.469 -7.309 890 3HG1 VAL 113 3HG1 VAL 113 -3.329 9.899 -6.378 891 1HG2 VAL 113 1HG2 VAL 113 -0.876 7.407 -7.503 892 2HG2 VAL 113 2HG2 VAL 113 -0.409 8.235 -8.989 893 3HG2 VAL 113 3HG2 VAL 113 -1.975 7.428 -8.882 894 H LYS 114 H LYS 114 -2.501 8.998 -11.220 895 HA LYS 114 HA LYS 114 -5.353 8.321 -10.941 896 1HB LYS 114 1HB LYS 114 -3.894 9.040 -13.495 897 2HB LYS 114 2HB LYS 114 -5.582 8.568 -13.372 898 1HG LYS 114 1HG LYS 114 -4.339 11.049 -12.207 899 2HG LYS 114 2HG LYS 114 -5.388 10.965 -13.625 900 1HD LYS 114 1HD LYS 114 -7.203 10.105 -12.212 901 2HD LYS 114 2HD LYS 114 -6.147 10.227 -10.802 902 1HE LYS 114 1HE LYS 114 -5.957 12.653 -11.186 903 2HE LYS 114 2HE LYS 114 -7.070 12.513 -12.547 904 1HZ LYS 114 1HZ LYS 114 -8.694 11.553 -10.905 905 2HZ LYS 114 2HZ LYS 114 -8.346 13.202 -10.718 906 3HZ LYS 114 3HZ LYS 114 -7.645 12.068 -9.677 907 H THR 115 H THR 115 -5.898 6.239 -11.346 908 HA THR 115 HA THR 115 -3.792 4.330 -11.528 909 HB THR 115 HB THR 115 -5.835 3.909 -10.212 910 HG1 THR 115 HG1 THR 115 -5.417 2.046 -12.336 911 1HG2 THR 115 1HG2 THR 115 -7.526 4.915 -11.610 912 2HG2 THR 115 2HG2 THR 115 -7.913 3.214 -11.350 913 3HG2 THR 115 3HG2 THR 115 -7.220 3.736 -12.885 914 H GLY 116 H GLY 116 -2.779 3.809 -13.335 915 1HA GLY 116 1HA GLY 116 -3.357 2.773 -15.620 916 2HA GLY 116 2HA GLY 116 -4.147 4.319 -15.893 917 H ASP 117 H ASP 117 -1.896 5.579 -14.235 918 HA ASP 117 HA ASP 117 0.073 5.666 -16.411 919 1HB ASP 117 1HB ASP 117 -1.040 7.718 -14.929 920 2HB ASP 117 2HB ASP 117 0.537 7.498 -14.176 921 H ARG 118 H ARG 118 2.393 6.375 -15.017 922 HA ARG 118 HA ARG 118 2.812 3.874 -13.543 923 1HB ARG 118 1HB ARG 118 4.459 5.302 -15.577 924 2HB ARG 118 2HB ARG 118 5.241 4.301 -14.375 925 1HG ARG 118 1HG ARG 118 4.832 2.526 -15.630 926 2HG ARG 118 2HG ARG 118 3.105 2.789 -15.382 927 1HD ARG 118 1HD ARG 118 4.826 3.870 -17.599 928 2HD ARG 118 2HD ARG 118 3.526 2.690 -17.731 929 HE ARG 118 HE ARG 118 3.130 5.542 -17.069 930 1HH1 ARG 118 1HH1 ARG 118 1.929 2.496 -18.307 931 2HH1 ARG 118 2HH1 ARG 118 0.530 3.209 -19.052 932 1HH2 ARG 118 1HH2 ARG 118 1.284 6.484 -18.003 933 2HH2 ARG 118 2HH2 ARG 118 0.157 5.482 -18.883 934 H VAL 119 H VAL 119 3.813 3.886 -11.649 935 HA VAL 119 HA VAL 119 4.856 6.475 -10.680 936 HB VAL 119 HB VAL 119 3.412 4.349 -9.080 937 1HG1 VAL 119 1HG1 VAL 119 5.236 5.255 -7.759 938 2HG1 VAL 119 2HG1 VAL 119 3.694 5.863 -7.154 939 3HG1 VAL 119 3HG1 VAL 119 4.726 6.900 -8.140 940 1HG2 VAL 119 1HG2 VAL 119 1.940 5.804 -10.386 941 2HG2 VAL 119 2HG2 VAL 119 2.691 7.221 -9.652 942 3HG2 VAL 119 3HG2 VAL 119 1.770 6.094 -8.655 943 H VAL 120 H VAL 120 6.901 6.495 -10.043 944 HA VAL 120 HA VAL 120 8.299 3.947 -9.645 945 HB VAL 120 HB VAL 120 9.454 6.741 -9.866 946 1HG1 VAL 120 1HG1 VAL 120 10.812 4.046 -9.921 947 2HG1 VAL 120 2HG1 VAL 120 10.874 5.209 -8.595 948 3HG1 VAL 120 3HG1 VAL 120 11.597 5.607 -10.154 949 1HG2 VAL 120 1HG2 VAL 120 10.167 6.078 -12.117 950 2HG2 VAL 120 2HG2 VAL 120 8.411 6.048 -11.961 951 3HG2 VAL 120 3HG2 VAL 120 9.325 4.541 -11.929 952 H VAL 121 H VAL 121 8.328 3.242 -7.624 953 HA VAL 121 HA VAL 121 7.965 5.149 -5.428 954 HB VAL 121 HB VAL 121 7.806 2.129 -5.422 955 1HG1 VAL 121 1HG1 VAL 121 7.150 4.127 -3.261 956 2HG1 VAL 121 2HG1 VAL 121 8.480 2.969 -3.252 957 3HG1 VAL 121 3HG1 VAL 121 6.812 2.398 -3.189 958 1HG2 VAL 121 1HG2 VAL 121 5.383 2.495 -5.159 959 2HG2 VAL 121 2HG2 VAL 121 5.997 3.106 -6.694 960 3HG2 VAL 121 3HG2 VAL 121 5.638 4.226 -5.380 961 H ASN 122 H ASN 122 9.673 5.816 -4.325 962 HA ASN 122 HA ASN 122 11.924 3.956 -3.948 963 1HB ASN 122 1HB ASN 122 12.505 5.813 -5.499 964 2HB ASN 122 2HB ASN 122 12.108 6.967 -4.234 965 1HD2 ASN 122 1HD2 ASN 122 14.608 6.336 -5.700 966 2HD2 ASN 122 2HD2 ASN 122 15.793 6.063 -4.467 967 H ALA 123 H ALA 123 11.501 3.235 -1.942 968 HA ALA 123 HA ALA 123 10.527 5.042 0.103 969 1HB ALA 123 1HB ALA 123 11.193 2.110 0.302 970 2HB ALA 123 2HB ALA 123 9.604 2.774 -0.085 971 3HB ALA 123 3HB ALA 123 10.327 3.069 1.499 972 H ASP 124 H ASP 124 13.527 4.056 -1.056 973 HA ASP 124 HA ASP 124 15.012 4.004 1.362 974 1HB ASP 124 1HB ASP 124 15.921 4.652 -1.452 975 2HB ASP 124 2HB ASP 124 16.996 4.361 -0.090 976 H GLU 125 H GLU 125 14.288 6.524 -1.003 977 HA GLU 125 HA GLU 125 15.457 8.536 0.767 978 1HB GLU 125 1HB GLU 125 14.322 8.796 -2.023 979 2HB GLU 125 2HB GLU 125 15.076 10.095 -1.112 980 1HG GLU 125 1HG GLU 125 17.165 8.771 -1.041 981 2HG GLU 125 2HG GLU 125 16.393 7.572 -2.078 982 H GLY 126 H GLY 126 12.413 7.280 -0.271 983 1HA GLY 126 1HA GLY 126 10.403 7.541 0.890 984 2HA GLY 126 2HA GLY 126 11.096 8.914 1.737 985 H TYR 127 H TYR 127 10.248 8.011 -1.613 986 HA TYR 127 HA TYR 127 8.426 10.200 -1.820 987 1HB TYR 127 1HB TYR 127 9.539 11.538 -3.459 988 2HB TYR 127 2HB TYR 127 10.673 11.326 -2.133 989 HD1 TYR 127 HD1 TYR 127 12.787 10.234 -2.485 990 HD2 TYR 127 HD2 TYR 127 9.864 10.269 -5.582 991 HE1 TYR 127 HE1 TYR 127 14.471 9.420 -4.088 992 HE2 TYR 127 HE2 TYR 127 11.539 9.457 -7.180 993 HH TYR 127 HH TYR 127 13.759 9.188 -7.522 994 H VAL 128 H VAL 128 7.411 10.277 -3.966 995 HA VAL 128 HA VAL 128 7.838 7.841 -5.549 996 HB VAL 128 HB VAL 128 5.351 7.791 -5.993 997 1HG1 VAL 128 1HG1 VAL 128 6.243 7.296 -3.153 998 2HG1 VAL 128 2HG1 VAL 128 6.427 6.181 -4.509 999 3HG1 VAL 128 3HG1 VAL 128 4.817 6.601 -3.922 1000 1HG2 VAL 128 1HG2 VAL 128 5.275 9.612 -3.588 1001 2HG2 VAL 128 2HG2 VAL 128 3.877 8.836 -4.333 1002 3HG2 VAL 128 3HG2 VAL 128 4.800 10.040 -5.232 1003 H GLU 129 H GLU 129 8.209 8.264 -7.608 1004 HA GLU 129 HA GLU 129 7.509 10.916 -8.635 1005 1HB GLU 129 1HB GLU 129 9.420 8.800 -9.622 1006 2HB GLU 129 2HB GLU 129 8.960 10.182 -10.605 1007 1HG GLU 129 1HG GLU 129 9.814 11.680 -8.834 1008 2HG GLU 129 2HG GLU 129 10.365 10.264 -7.945 1009 H LEU 130 H LEU 130 5.512 10.961 -9.401 1010 HA LEU 130 HA LEU 130 4.388 8.738 -10.871 1011 1HB LEU 130 1HB LEU 130 2.895 10.048 -9.487 1012 2HB LEU 130 2HB LEU 130 3.374 11.529 -10.292 1013 HG LEU 130 HG LEU 130 2.318 10.707 -12.381 1014 1HD1 LEU 130 1HD1 LEU 130 2.516 8.307 -11.943 1015 2HD1 LEU 130 2HD1 LEU 130 0.860 8.776 -12.329 1016 3HD1 LEU 130 3HD1 LEU 130 1.318 8.451 -10.657 1017 1HD2 LEU 130 1HD2 LEU 130 -0.000 10.978 -11.627 1018 2HD2 LEU 130 2HD2 LEU 130 1.077 12.161 -10.884 1019 3HD2 LEU 130 3HD2 LEU 130 0.526 10.767 -9.957 1020 H ILE 131 H ILE 131 5.288 8.392 -12.821 1021 HA ILE 131 HA ILE 131 6.199 10.703 -14.352 1022 HB ILE 131 HB ILE 131 7.210 8.957 -15.876 1023 1HG1 ILE 131 1HG1 ILE 131 6.558 7.111 -13.571 1024 2HG1 ILE 131 2HG1 ILE 131 5.771 7.068 -15.143 1025 1HG2 ILE 131 1HG2 ILE 131 8.543 10.182 -14.279 1026 2HG2 ILE 131 2HG2 ILE 131 9.092 8.508 -14.352 1027 3HG2 ILE 131 3HG2 ILE 131 8.100 9.052 -12.999 1028 1HD1 ILE 131 1HD1 ILE 131 7.909 6.516 -16.194 1029 2HD1 ILE 131 2HD1 ILE 131 7.446 5.335 -14.968 1030 3HD1 ILE 131 3HD1 ILE 131 8.682 6.540 -14.610 1031 H GLU 132 H GLU 132 4.795 11.593 -15.601 1032 HA GLU 132 HA GLU 132 2.459 10.196 -16.522 1033 1HB GLU 132 1HB GLU 132 3.397 12.965 -17.273 1034 2HB GLU 132 2HB GLU 132 1.763 12.326 -17.396 1035 1HG GLU 132 1HG GLU 132 1.514 12.287 -15.039 1036 2HG GLU 132 2HG GLU 132 3.221 12.648 -14.788 Start of MODEL 4 1 H VAL 1 H VAL 1 4.471 14.317 -11.884 2 HA VAL 1 HA VAL 1 4.103 16.425 -9.868 3 HB VAL 1 HB VAL 1 2.677 14.766 -8.613 4 1HG1 VAL 1 1HG1 VAL 1 0.668 15.204 -9.957 5 2HG1 VAL 1 2HG1 VAL 1 1.692 15.700 -11.305 6 3HG1 VAL 1 3HG1 VAL 1 1.689 16.633 -9.809 7 1HG2 VAL 1 1HG2 VAL 1 1.652 12.949 -9.867 8 2HG2 VAL 1 2HG2 VAL 1 3.404 12.747 -9.801 9 3HG2 VAL 1 3HG2 VAL 1 2.641 13.347 -11.273 10 H LYS 2 H LYS 2 5.346 16.370 -8.144 11 HA LYS 2 HA LYS 2 7.019 14.004 -7.660 12 1HB LYS 2 1HB LYS 2 8.341 15.604 -8.926 13 2HB LYS 2 2HB LYS 2 7.902 16.894 -7.820 14 1HG LYS 2 1HG LYS 2 9.127 15.748 -6.023 15 2HG LYS 2 2HG LYS 2 9.598 14.493 -7.174 16 1HD LYS 2 1HD LYS 2 10.782 16.123 -8.518 17 2HD LYS 2 2HD LYS 2 10.236 17.428 -7.467 18 1HE LYS 2 1HE LYS 2 11.467 16.380 -5.595 19 2HE LYS 2 2HE LYS 2 12.066 15.155 -6.712 20 1HZ LYS 2 1HZ LYS 2 12.563 18.076 -6.944 21 2HZ LYS 2 2HZ LYS 2 13.164 16.882 -7.983 22 3HZ LYS 2 3HZ LYS 2 13.675 16.933 -6.365 23 H PHE 3 H PHE 3 6.626 13.316 -5.643 24 HA PHE 3 HA PHE 3 6.056 15.340 -3.581 25 1HB PHE 3 1HB PHE 3 4.660 12.669 -3.867 26 2HB PHE 3 2HB PHE 3 4.381 13.848 -2.593 27 HD1 PHE 3 HD1 PHE 3 3.412 12.711 -5.805 28 HD2 PHE 3 HD2 PHE 3 3.507 16.155 -3.306 29 HE1 PHE 3 HE1 PHE 3 1.654 13.748 -7.176 30 HE2 PHE 3 HE2 PHE 3 1.747 17.200 -4.674 31 HZ PHE 3 HZ PHE 3 0.820 15.993 -6.613 32 H ALA 4 H ALA 4 6.373 14.533 -1.370 33 HA ALA 4 HA ALA 4 8.378 12.383 -1.222 34 1HB ALA 4 1HB ALA 4 9.365 14.547 -0.676 35 2HB ALA 4 2HB ALA 4 9.299 13.515 0.752 36 3HB ALA 4 3HB ALA 4 8.126 14.816 0.548 37 H CYS 5 H CYS 5 8.052 10.803 0.300 38 HA CYS 5 HA CYS 5 5.556 11.001 1.841 39 1HB CYS 5 1HB CYS 5 5.421 8.498 1.581 40 2HB CYS 5 2HB CYS 5 5.188 9.409 0.095 41 HG CYS 5 HG CYS 5 6.691 7.606 -1.028 42 H ARG 6 H ARG 6 5.575 9.282 3.673 43 HA ARG 6 HA ARG 6 8.056 9.760 5.138 44 1HB ARG 6 1HB ARG 6 5.980 10.415 6.238 45 2HB ARG 6 2HB ARG 6 5.356 8.779 6.084 46 1HG ARG 6 1HG ARG 6 6.849 7.942 7.686 47 2HG ARG 6 2HG ARG 6 7.865 9.384 7.615 48 1HD ARG 6 1HD ARG 6 6.186 10.702 8.691 49 2HD ARG 6 2HD ARG 6 5.008 9.396 8.569 50 HE ARG 6 HE ARG 6 6.045 8.293 10.334 51 1HH1 ARG 6 1HH1 ARG 6 7.738 11.249 9.520 52 2HH1 ARG 6 2HH1 ARG 6 8.669 11.283 10.986 53 1HH2 ARG 6 1HH2 ARG 6 7.240 8.332 12.269 54 2HH2 ARG 6 2HH2 ARG 6 8.383 9.607 12.567 55 H ALA 7 H ALA 7 9.541 8.277 5.268 56 HA ALA 7 HA ALA 7 9.186 5.716 4.083 57 1HB ALA 7 1HB ALA 7 11.524 5.371 4.570 58 2HB ALA 7 2HB ALA 7 11.529 6.749 5.671 59 3HB ALA 7 3HB ALA 7 11.279 7.001 3.943 60 H ILE 8 H ILE 8 7.740 4.489 5.233 61 HA ILE 8 HA ILE 8 8.142 3.938 8.035 62 HB ILE 8 HB ILE 8 6.312 2.609 6.026 63 1HG1 ILE 8 1HG1 ILE 8 5.742 4.951 6.358 64 2HG1 ILE 8 2HG1 ILE 8 4.540 3.934 7.145 65 1HG2 ILE 8 1HG2 ILE 8 5.126 1.712 7.990 66 2HG2 ILE 8 2HG2 ILE 8 6.385 2.376 9.034 67 3HG2 ILE 8 3HG2 ILE 8 6.780 1.111 7.871 68 1HD1 ILE 8 1HD1 ILE 8 6.811 5.352 8.518 69 2HD1 ILE 8 2HD1 ILE 8 5.593 4.346 9.302 70 3HD1 ILE 8 3HD1 ILE 8 5.121 5.854 8.516 71 H THR 9 H THR 9 8.582 2.262 4.966 72 HA THR 9 HA THR 9 10.446 0.419 6.304 73 HB THR 9 HB THR 9 9.814 -1.260 4.508 74 HG1 THR 9 HG1 THR 9 7.730 0.649 4.143 75 1HG2 THR 9 1HG2 THR 9 7.677 -0.437 6.477 76 2HG2 THR 9 2HG2 THR 9 9.030 -1.523 6.797 77 3HG2 THR 9 3HG2 THR 9 7.764 -1.998 5.664 78 H ARG 10 H ARG 10 11.431 -0.769 3.939 79 HA ARG 10 HA ARG 10 12.623 1.553 2.577 80 1HB ARG 10 1HB ARG 10 13.901 -1.087 3.293 81 2HB ARG 10 2HB ARG 10 14.635 0.099 2.224 82 1HG ARG 10 1HG ARG 10 14.515 1.733 4.127 83 2HG ARG 10 2HG ARG 10 14.040 0.378 5.155 84 1HD ARG 10 1HD ARG 10 16.108 -0.796 4.508 85 2HD ARG 10 2HD ARG 10 16.589 0.610 3.561 86 HE ARG 10 HE ARG 10 16.316 0.547 6.498 87 1HH1 ARG 10 1HH1 ARG 10 17.609 1.989 3.565 88 2HH1 ARG 10 2HH1 ARG 10 18.767 2.968 4.415 89 1HH2 ARG 10 1HH2 ARG 10 17.849 1.813 7.612 90 2HH2 ARG 10 2HH2 ARG 10 18.938 2.841 6.716 91 H GLY 11 H GLY 11 13.874 0.469 0.507 92 1HA GLY 11 1HA GLY 11 13.517 -1.207 -1.250 93 2HA GLY 11 2HA GLY 11 11.797 -1.082 -0.912 94 H ARG 12 H ARG 12 13.401 -0.627 -3.392 95 HA ARG 12 HA ARG 12 12.186 1.943 -4.094 96 1HB ARG 12 1HB ARG 12 15.052 1.203 -4.749 97 2HB ARG 12 2HB ARG 12 14.210 2.634 -5.325 98 1HG ARG 12 1HG ARG 12 14.063 3.502 -3.077 99 2HG ARG 12 2HG ARG 12 14.775 2.024 -2.429 100 1HD ARG 12 1HD ARG 12 16.107 4.036 -4.238 101 2HD ARG 12 2HD ARG 12 16.457 3.755 -2.533 102 HE ARG 12 HE ARG 12 17.178 2.024 -4.787 103 1HH1 ARG 12 1HH1 ARG 12 17.307 2.687 -1.343 104 2HH1 ARG 12 2HH1 ARG 12 18.561 1.524 -1.035 105 1HH2 ARG 12 1HH2 ARG 12 18.816 0.504 -4.386 106 2HH2 ARG 12 2HH2 ARG 12 19.414 0.272 -2.770 107 H ALA 13 H ALA 13 10.875 1.526 -5.750 108 HA ALA 13 HA ALA 13 11.764 -0.112 -7.963 109 1HB ALA 13 1HB ALA 13 10.966 -1.812 -6.398 110 2HB ALA 13 2HB ALA 13 9.935 -1.723 -7.825 111 3HB ALA 13 3HB ALA 13 9.402 -1.002 -6.307 112 H GLU 14 H GLU 14 9.987 -0.290 -9.642 113 HA GLU 14 HA GLU 14 8.111 1.962 -9.529 114 1HB GLU 14 1HB GLU 14 8.669 2.610 -11.806 115 2HB GLU 14 2HB GLU 14 10.116 2.667 -10.810 116 1HG GLU 14 1HG GLU 14 10.830 0.517 -11.706 117 2HG GLU 14 2HG GLU 14 9.369 0.433 -12.686 118 H GLY 15 H GLY 15 6.147 1.590 -10.608 119 1HA GLY 15 1HA GLY 15 5.936 -0.535 -12.530 120 2HA GLY 15 2HA GLY 15 5.164 -0.924 -11.000 121 H GLU 16 H GLU 16 3.375 -1.025 -12.701 122 HA GLU 16 HA GLU 16 2.257 1.474 -13.542 123 1HB GLU 16 1HB GLU 16 1.890 -0.653 -14.762 124 2HB GLU 16 2HB GLU 16 0.988 -1.272 -13.388 125 1HG GLU 16 1HG GLU 16 -0.717 0.404 -13.701 126 2HG GLU 16 2HG GLU 16 0.205 1.136 -15.014 127 H ALA 17 H ALA 17 0.945 2.777 -12.470 128 HA ALA 17 HA ALA 17 0.418 2.225 -9.697 129 1HB ALA 17 1HB ALA 17 -0.308 4.632 -11.367 130 2HB ALA 17 2HB ALA 17 1.166 4.441 -10.416 131 3HB ALA 17 3HB ALA 17 -0.400 4.519 -9.609 132 H LEU 18 H LEU 18 -1.285 1.229 -8.996 133 HA LEU 18 HA LEU 18 -3.739 1.180 -10.605 134 1HB LEU 18 1HB LEU 18 -2.581 -0.954 -9.777 135 2HB LEU 18 2HB LEU 18 -3.107 -0.486 -8.172 136 HG LEU 18 HG LEU 18 -5.471 -0.518 -9.024 137 1HD1 LEU 18 1HD1 LEU 18 -5.012 -0.254 -11.389 138 2HD1 LEU 18 2HD1 LEU 18 -5.886 -1.760 -11.106 139 3HD1 LEU 18 3HD1 LEU 18 -4.149 -1.789 -11.416 140 1HD2 LEU 18 1HD2 LEU 18 -4.537 -2.371 -7.733 141 2HD2 LEU 18 2HD2 LEU 18 -3.917 -3.099 -9.216 142 3HD2 LEU 18 3HD2 LEU 18 -5.656 -2.953 -8.966 143 H VAL 19 H VAL 19 -5.200 2.688 -10.014 144 HA VAL 19 HA VAL 19 -4.905 3.863 -7.348 145 HB VAL 19 HB VAL 19 -6.416 4.935 -9.736 146 1HG1 VAL 19 1HG1 VAL 19 -7.264 5.790 -7.620 147 2HG1 VAL 19 2HG1 VAL 19 -6.414 7.052 -8.509 148 3HG1 VAL 19 3HG1 VAL 19 -5.631 6.260 -7.142 149 1HG2 VAL 19 1HG2 VAL 19 -4.016 4.792 -10.173 150 2HG2 VAL 19 2HG2 VAL 19 -3.689 5.689 -8.691 151 3HG2 VAL 19 3HG2 VAL 19 -4.540 6.470 -10.024 152 H THR 20 H THR 20 -6.172 3.094 -5.847 153 HA THR 20 HA THR 20 -8.841 2.118 -6.657 154 HB THR 20 HB THR 20 -7.361 1.331 -4.150 155 HG1 THR 20 HG1 THR 20 -6.694 0.757 -6.647 156 1HG2 THR 20 1HG2 THR 20 -9.787 0.902 -4.198 157 2HG2 THR 20 2HG2 THR 20 -8.862 -0.598 -4.220 158 3HG2 THR 20 3HG2 THR 20 -9.592 0.007 -5.706 159 H LYS 21 H LYS 21 -10.610 3.041 -5.808 160 HA LYS 21 HA LYS 21 -10.222 5.059 -3.716 161 1HB LYS 21 1HB LYS 21 -12.541 4.653 -5.616 162 2HB LYS 21 2HB LYS 21 -12.425 5.936 -4.417 163 1HG LYS 21 1HG LYS 21 -10.655 5.533 -6.820 164 2HG LYS 21 2HG LYS 21 -11.832 6.823 -6.560 165 1HD LYS 21 1HD LYS 21 -10.526 7.672 -4.697 166 2HD LYS 21 2HD LYS 21 -9.373 6.347 -4.873 167 1HE LYS 21 1HE LYS 21 -8.859 7.170 -7.157 168 2HE LYS 21 2HE LYS 21 -9.926 8.542 -6.866 169 1HZ LYS 21 1HZ LYS 21 -7.449 7.887 -5.362 170 2HZ LYS 21 2HZ LYS 21 -8.505 9.155 -4.974 171 3HZ LYS 21 3HZ LYS 21 -7.666 9.175 -6.445 172 H GLU 22 H GLU 22 -11.284 1.928 -4.150 173 HA GLU 22 HA GLU 22 -13.096 2.010 -1.852 174 1HB GLU 22 1HB GLU 22 -13.745 0.746 -3.928 175 2HB GLU 22 2HB GLU 22 -12.389 -0.328 -3.639 176 1HG GLU 22 1HG GLU 22 -14.551 -1.254 -2.906 177 2HG GLU 22 2HG GLU 22 -13.369 -1.125 -1.605 178 H TYR 23 H TYR 23 -12.745 0.326 -0.169 179 HA TYR 23 HA TYR 23 -9.886 0.231 0.468 180 1HB TYR 23 1HB TYR 23 -12.248 -0.369 2.262 181 2HB TYR 23 2HB TYR 23 -10.571 -0.180 2.763 182 HD1 TYR 23 HD1 TYR 23 -13.375 1.376 3.337 183 HD2 TYR 23 HD2 TYR 23 -9.778 2.214 1.223 184 HE1 TYR 23 HE1 TYR 23 -13.760 3.784 3.646 185 HE2 TYR 23 HE2 TYR 23 -10.152 4.623 1.525 186 HH TYR 23 HH TYR 23 -12.236 6.128 1.909 187 H ILE 24 H ILE 24 -8.789 -1.657 0.902 188 HA ILE 24 HA ILE 24 -10.202 -4.141 0.189 189 HB ILE 24 HB ILE 24 -7.340 -3.322 -0.328 190 1HG1 ILE 24 1HG1 ILE 24 -7.956 -4.179 -2.645 191 2HG1 ILE 24 2HG1 ILE 24 -9.622 -4.232 -2.078 192 1HG2 ILE 24 1HG2 ILE 24 -8.494 -6.101 -0.517 193 2HG2 ILE 24 2HG2 ILE 24 -7.241 -5.552 0.596 194 3HG2 ILE 24 3HG2 ILE 24 -6.916 -5.608 -1.136 195 1HD1 ILE 24 1HD1 ILE 24 -9.536 -1.830 -1.653 196 2HD1 ILE 24 2HD1 ILE 24 -9.196 -2.220 -3.338 197 3HD1 ILE 24 3HD1 ILE 24 -7.876 -1.787 -2.250 198 H SER 25 H SER 25 -10.151 -5.791 1.593 199 HA SER 25 HA SER 25 -9.151 -5.241 4.235 200 1HB SER 25 1HB SER 25 -10.174 -7.458 4.796 201 2HB SER 25 2HB SER 25 -11.302 -6.324 4.058 202 HG SER 25 HG SER 25 -10.733 -7.439 2.007 203 H PHE 26 H PHE 26 -7.129 -5.577 4.795 204 HA PHE 26 HA PHE 26 -5.325 -7.189 3.302 205 1HB PHE 26 1HB PHE 26 -5.120 -5.804 5.969 206 2HB PHE 26 2HB PHE 26 -3.805 -6.776 5.319 207 HD1 PHE 26 HD1 PHE 26 -3.100 -6.163 2.861 208 HD2 PHE 26 HD2 PHE 26 -5.141 -3.552 5.529 209 HE1 PHE 26 HE1 PHE 26 -2.270 -4.225 1.593 210 HE2 PHE 26 HE2 PHE 26 -4.317 -1.610 4.264 211 HZ PHE 26 HZ PHE 26 -2.879 -1.946 2.291 212 H LEU 27 H LEU 27 -7.675 -8.023 5.501 213 HA LEU 27 HA LEU 27 -6.483 -10.193 6.854 214 1HB LEU 27 1HB LEU 27 -8.755 -9.013 7.237 215 2HB LEU 27 2HB LEU 27 -9.369 -10.091 6.003 216 HG LEU 27 HG LEU 27 -9.801 -10.805 8.370 217 1HD1 LEU 27 1HD1 LEU 27 -8.166 -12.719 6.720 218 2HD1 LEU 27 2HD1 LEU 27 -9.889 -12.398 6.523 219 3HD1 LEU 27 3HD1 LEU 27 -9.295 -13.145 8.006 220 1HD2 LEU 27 1HD2 LEU 27 -6.833 -11.316 8.373 221 2HD2 LEU 27 2HD2 LEU 27 -7.973 -11.830 9.615 222 3HD2 LEU 27 3HD2 LEU 27 -7.683 -10.112 9.342 223 H GLY 28 H GLY 28 -7.793 -9.779 3.647 224 1HA GLY 28 1HA GLY 28 -6.474 -11.546 2.224 225 2HA GLY 28 2HA GLY 28 -7.545 -12.641 3.088 226 H GLY 29 H GLY 29 -8.028 -9.457 1.558 227 1HA GLY 29 1HA GLY 29 -10.477 -10.459 0.336 228 2HA GLY 29 2HA GLY 29 -9.921 -8.791 0.347 229 H ILE 30 H ILE 30 -7.676 -11.230 -0.549 230 HA ILE 30 HA ILE 30 -8.042 -10.627 -3.403 231 HB ILE 30 HB ILE 30 -5.354 -10.807 -2.019 232 1HG1 ILE 30 1HG1 ILE 30 -6.773 -8.360 -3.104 233 2HG1 ILE 30 2HG1 ILE 30 -6.601 -8.747 -1.396 234 1HG2 ILE 30 1HG2 ILE 30 -6.111 -10.067 -4.841 235 2HG2 ILE 30 2HG2 ILE 30 -5.300 -11.545 -4.327 236 3HG2 ILE 30 3HG2 ILE 30 -4.482 -9.991 -4.169 237 1HD1 ILE 30 1HD1 ILE 30 -4.349 -8.178 -3.312 238 2HD1 ILE 30 2HD1 ILE 30 -4.178 -8.550 -1.597 239 3HD1 ILE 30 3HD1 ILE 30 -4.991 -7.069 -2.102 240 H ASP 31 H ASP 31 -7.885 -12.378 -4.721 241 HA ASP 31 HA ASP 31 -7.750 -15.005 -3.630 242 1HB ASP 31 1HB ASP 31 -8.998 -14.351 -5.729 243 2HB ASP 31 2HB ASP 31 -7.440 -14.205 -6.532 244 H LYS 32 H LYS 32 -5.993 -16.235 -3.261 245 HA LYS 32 HA LYS 32 -3.451 -14.920 -3.525 246 1HB LYS 32 1HB LYS 32 -2.592 -16.607 -2.077 247 2HB LYS 32 2HB LYS 32 -4.177 -16.153 -1.472 248 1HG LYS 32 1HG LYS 32 -4.798 -18.249 -3.088 249 2HG LYS 32 2HG LYS 32 -3.207 -18.720 -2.487 250 1HD LYS 32 1HD LYS 32 -4.736 -19.604 -0.933 251 2HD LYS 32 2HD LYS 32 -4.095 -18.146 -0.168 252 1HE LYS 32 1HE LYS 32 -6.469 -18.180 0.157 253 2HE LYS 32 2HE LYS 32 -6.090 -16.909 -1.004 254 1HZ LYS 32 1HZ LYS 32 -7.306 -19.560 -1.510 255 2HZ LYS 32 2HZ LYS 32 -6.588 -18.671 -2.765 256 3HZ LYS 32 3HZ LYS 32 -7.912 -18.028 -1.917 257 H GLU 33 H GLU 33 -5.189 -17.075 -5.449 258 HA GLU 33 HA GLU 33 -2.793 -18.298 -6.562 259 1HB GLU 33 1HB GLU 33 -5.694 -18.762 -7.268 260 2HB GLU 33 2HB GLU 33 -4.326 -19.688 -7.872 261 1HG GLU 33 1HG GLU 33 -4.785 -21.087 -6.202 262 2HG GLU 33 2HG GLU 33 -3.982 -19.896 -5.182 263 H THR 34 H THR 34 -5.411 -16.113 -7.511 264 HA THR 34 HA THR 34 -4.102 -15.745 -10.116 265 HB THR 34 HB THR 34 -6.243 -14.526 -10.708 266 HG1 THR 34 HG1 THR 34 -7.182 -15.789 -8.323 267 1HG2 THR 34 1HG2 THR 34 -6.439 -17.429 -9.897 268 2HG2 THR 34 2HG2 THR 34 -5.816 -16.818 -11.429 269 3HG2 THR 34 3HG2 THR 34 -7.519 -16.606 -11.023 270 H GLY 35 H GLY 35 -5.102 -13.956 -7.243 271 1HA GLY 35 1HA GLY 35 -4.100 -11.928 -6.547 272 2HA GLY 35 2HA GLY 35 -3.557 -11.655 -8.197 273 H ILE 36 H ILE 36 -6.767 -12.703 -7.921 274 HA ILE 36 HA ILE 36 -7.789 -10.073 -8.656 275 HB ILE 36 HB ILE 36 -9.210 -12.743 -8.478 276 1HG1 ILE 36 1HG1 ILE 36 -7.460 -12.728 -10.203 277 2HG1 ILE 36 2HG1 ILE 36 -9.067 -12.797 -10.918 278 1HG2 ILE 36 1HG2 ILE 36 -10.740 -10.863 -8.230 279 2HG2 ILE 36 2HG2 ILE 36 -10.986 -11.676 -9.777 280 3HG2 ILE 36 3HG2 ILE 36 -10.111 -10.145 -9.714 281 1HD1 ILE 36 1HD1 ILE 36 -7.334 -10.346 -10.704 282 2HD1 ILE 36 2HD1 ILE 36 -8.944 -10.413 -11.420 283 3HD1 ILE 36 3HD1 ILE 36 -7.614 -11.305 -12.158 284 H VAL 37 H VAL 37 -8.812 -8.772 -7.210 285 HA VAL 37 HA VAL 37 -9.072 -9.456 -4.483 286 HB VAL 37 HB VAL 37 -10.566 -7.416 -4.334 287 1HG1 VAL 37 1HG1 VAL 37 -7.867 -7.070 -5.635 288 2HG1 VAL 37 2HG1 VAL 37 -8.164 -7.311 -3.914 289 3HG1 VAL 37 3HG1 VAL 37 -8.736 -5.845 -4.710 290 1HG2 VAL 37 1HG2 VAL 37 -9.838 -7.188 -7.250 291 2HG2 VAL 37 2HG2 VAL 37 -10.607 -5.930 -6.283 292 3HG2 VAL 37 3HG2 VAL 37 -11.454 -7.444 -6.594 293 H LYS 38 H LYS 38 -10.817 -10.026 -3.234 294 HA LYS 38 HA LYS 38 -12.866 -11.515 -4.706 295 1HB LYS 38 1HB LYS 38 -12.361 -11.591 -1.737 296 2HB LYS 38 2HB LYS 38 -13.159 -12.790 -2.732 297 1HG LYS 38 1HG LYS 38 -10.230 -12.116 -2.878 298 2HG LYS 38 2HG LYS 38 -10.910 -13.474 -1.984 299 1HD LYS 38 1HD LYS 38 -11.399 -13.115 -4.923 300 2HD LYS 38 2HD LYS 38 -9.956 -13.924 -4.314 301 1HE LYS 38 1HE LYS 38 -11.400 -15.513 -3.097 302 2HE LYS 38 2HE LYS 38 -12.815 -14.723 -3.792 303 1HZ LYS 38 1HZ LYS 38 -10.659 -16.004 -5.387 304 2HZ LYS 38 2HZ LYS 38 -12.117 -15.359 -5.976 305 3HZ LYS 38 3HZ LYS 38 -12.134 -16.744 -4.995 306 H GLU 39 H GLU 39 -12.545 -8.577 -3.385 307 HA GLU 39 HA GLU 39 -15.106 -8.417 -2.040 308 1HB GLU 39 1HB GLU 39 -12.890 -6.411 -2.410 309 2HB GLU 39 2HB GLU 39 -14.345 -6.135 -1.470 310 1HG GLU 39 1HG GLU 39 -13.745 -7.907 0.055 311 2HG GLU 39 2HG GLU 39 -12.322 -8.287 -0.916 312 H ASP 40 H ASP 40 -16.602 -6.654 -2.525 313 HA ASP 40 HA ASP 40 -16.948 -6.455 -5.412 314 1HB ASP 40 1HB ASP 40 -18.860 -7.243 -4.135 315 2HB ASP 40 2HB ASP 40 -18.830 -5.789 -3.140 316 H CYS 41 H CYS 41 -16.934 -4.669 -6.563 317 HA CYS 41 HA CYS 41 -17.625 -2.102 -5.741 318 1HB CYS 41 1HB CYS 41 -15.417 -2.173 -4.561 319 2HB CYS 41 2HB CYS 41 -14.630 -2.434 -6.114 320 HG CYS 41 HG CYS 41 -15.898 0.395 -4.793 321 H GLU 42 H GLU 42 -17.053 -0.507 -7.609 322 HA GLU 42 HA GLU 42 -17.787 -1.791 -10.031 323 1HB GLU 42 1HB GLU 42 -18.422 0.542 -9.452 324 2HB GLU 42 2HB GLU 42 -16.744 1.023 -9.661 325 1HG GLU 42 1HG GLU 42 -16.844 0.358 -12.009 326 2HG GLU 42 2HG GLU 42 -18.524 -0.131 -11.799 327 H ILE 43 H ILE 43 -14.751 -0.622 -8.721 328 HA ILE 43 HA ILE 43 -13.360 -1.432 -11.173 329 HB ILE 43 HB ILE 43 -11.389 -0.265 -10.199 330 1HG1 ILE 43 1HG1 ILE 43 -13.371 0.713 -8.132 331 2HG1 ILE 43 2HG1 ILE 43 -12.088 -0.451 -7.817 332 1HG2 ILE 43 1HG2 ILE 43 -12.248 2.008 -10.596 333 2HG2 ILE 43 2HG2 ILE 43 -13.894 1.378 -10.535 334 3HG2 ILE 43 3HG2 ILE 43 -12.796 0.857 -11.814 335 1HD1 ILE 43 1HD1 ILE 43 -11.709 2.408 -8.686 336 2HD1 ILE 43 2HD1 ILE 43 -10.422 1.245 -8.366 337 3HD1 ILE 43 3HD1 ILE 43 -11.479 1.773 -7.057 338 H LYS 44 H LYS 44 -14.357 -3.050 -8.659 339 HA LYS 44 HA LYS 44 -11.832 -4.380 -8.085 340 1HB LYS 44 1HB LYS 44 -14.430 -4.133 -6.691 341 2HB LYS 44 2HB LYS 44 -13.615 -5.669 -6.548 342 1HG LYS 44 1HG LYS 44 -11.606 -4.510 -5.710 343 2HG LYS 44 2HG LYS 44 -12.483 -2.983 -5.810 344 1HD LYS 44 1HD LYS 44 -14.098 -3.773 -4.175 345 2HD LYS 44 2HD LYS 44 -13.300 -5.345 -4.114 346 1HE LYS 44 1HE LYS 44 -11.311 -4.366 -3.200 347 2HE LYS 44 2HE LYS 44 -11.961 -2.741 -3.406 348 1HZ LYS 44 1HZ LYS 44 -12.329 -3.155 -1.183 349 2HZ LYS 44 2HZ LYS 44 -12.681 -4.790 -1.414 350 3HZ LYS 44 3HZ LYS 44 -13.820 -3.615 -1.844 351 H GLY 45 H GLY 45 -11.611 -6.613 -8.396 352 1HA GLY 45 1HA GLY 45 -12.598 -8.703 -9.255 353 2HA GLY 45 2HA GLY 45 -13.452 -7.705 -10.428 354 H GLU 46 H GLU 46 -10.513 -6.324 -10.042 355 HA GLU 46 HA GLU 46 -9.399 -7.803 -12.318 356 1HB GLU 46 1HB GLU 46 -8.866 -4.957 -11.452 357 2HB GLU 46 2HB GLU 46 -8.116 -5.761 -12.825 358 1HG GLU 46 1HG GLU 46 -10.542 -6.137 -13.628 359 2HG GLU 46 2HG GLU 46 -10.944 -4.869 -12.475 360 H SER 47 H SER 47 -6.832 -7.185 -12.323 361 HA SER 47 HA SER 47 -5.936 -8.798 -10.076 362 1HB SER 47 1HB SER 47 -4.352 -7.995 -12.520 363 2HB SER 47 2HB SER 47 -4.049 -9.351 -11.434 364 HG SER 47 HG SER 47 -5.071 -10.251 -13.135 365 H VAL 48 H VAL 48 -4.640 -8.103 -8.488 366 HA VAL 48 HA VAL 48 -3.497 -5.399 -8.684 367 HB VAL 48 HB VAL 48 -3.128 -5.540 -6.262 368 1HG1 VAL 48 1HG1 VAL 48 -5.232 -4.629 -7.032 369 2HG1 VAL 48 2HG1 VAL 48 -5.488 -5.550 -5.549 370 3HG1 VAL 48 3HG1 VAL 48 -5.935 -6.244 -7.106 371 1HG2 VAL 48 1HG2 VAL 48 -2.744 -7.935 -6.059 372 2HG2 VAL 48 2HG2 VAL 48 -4.430 -8.255 -6.468 373 3HG2 VAL 48 3HG2 VAL 48 -4.031 -7.418 -4.968 374 H ALA 49 H ALA 49 -2.613 -8.296 -9.573 375 HA ALA 49 HA ALA 49 -0.245 -8.909 -8.207 376 1HB ALA 49 1HB ALA 49 -1.561 -10.589 -9.405 377 2HB ALA 49 2HB ALA 49 0.111 -10.553 -9.966 378 3HB ALA 49 3HB ALA 49 -1.161 -9.810 -10.935 379 H GLY 50 H GLY 50 1.147 -7.303 -8.163 380 1HA GLY 50 1HA GLY 50 3.229 -6.586 -8.950 381 2HA GLY 50 2HA GLY 50 2.743 -7.022 -10.578 382 H ARG 51 H ARG 51 0.532 -5.135 -8.748 383 HA ARG 51 HA ARG 51 1.299 -2.775 -10.344 384 1HB ARG 51 1HB ARG 51 -1.401 -3.295 -9.082 385 2HB ARG 51 2HB ARG 51 -0.997 -2.083 -10.291 386 1HG ARG 51 1HG ARG 51 -1.003 -5.066 -10.713 387 2HG ARG 51 2HG ARG 51 -2.232 -3.931 -11.274 388 1HD ARG 51 1HD ARG 51 -0.944 -3.171 -12.975 389 2HD ARG 51 2HD ARG 51 0.553 -3.341 -12.059 390 HE ARG 51 HE ARG 51 0.082 -5.864 -12.471 391 1HH1 ARG 51 1HH1 ARG 51 -0.558 -3.258 -14.728 392 2HH1 ARG 51 2HH1 ARG 51 -0.262 -4.241 -16.127 393 1HH2 ARG 51 1HH2 ARG 51 0.473 -7.163 -14.316 394 2HH2 ARG 51 2HH2 ARG 51 0.321 -6.455 -15.900 395 H ILE 52 H ILE 52 1.175 -0.679 -9.298 396 HA ILE 52 HA ILE 52 1.773 -0.822 -6.460 397 HB ILE 52 HB ILE 52 1.857 1.430 -8.460 398 1HG1 ILE 52 1HG1 ILE 52 4.209 1.576 -7.672 399 2HG1 ILE 52 2HG1 ILE 52 3.912 0.215 -6.602 400 1HG2 ILE 52 1HG2 ILE 52 2.147 1.697 -5.467 401 2HG2 ILE 52 2HG2 ILE 52 0.864 2.388 -6.460 402 3HG2 ILE 52 3HG2 ILE 52 2.524 2.953 -6.648 403 1HD1 ILE 52 1HD1 ILE 52 3.799 0.169 -9.604 404 2HD1 ILE 52 2HD1 ILE 52 3.483 -1.204 -8.542 405 3HD1 ILE 52 3HD1 ILE 52 5.091 -0.479 -8.594 406 H LEU 53 H LEU 53 0.125 -1.034 -5.132 407 HA LEU 53 HA LEU 53 -2.526 -0.184 -5.917 408 1HB LEU 53 1HB LEU 53 -2.028 -2.365 -4.788 409 2HB LEU 53 2HB LEU 53 -1.608 -1.469 -3.342 410 HG LEU 53 HG LEU 53 -3.934 -0.591 -3.263 411 1HD1 LEU 53 1HD1 LEU 53 -5.642 -1.634 -4.637 412 2HD1 LEU 53 2HD1 LEU 53 -4.412 -2.577 -5.478 413 3HD1 LEU 53 3HD1 LEU 53 -4.449 -0.821 -5.648 414 1HD2 LEU 53 1HD2 LEU 53 -3.651 -3.593 -3.284 415 2HD2 LEU 53 2HD2 LEU 53 -4.943 -2.687 -2.498 416 3HD2 LEU 53 3HD2 LEU 53 -3.281 -2.523 -1.931 417 H VAL 54 H VAL 54 -3.457 1.710 -5.341 418 HA VAL 54 HA VAL 54 -2.438 3.009 -2.911 419 HB VAL 54 HB VAL 54 -1.497 4.157 -4.839 420 1HG1 VAL 54 1HG1 VAL 54 -3.165 3.718 -6.518 421 2HG1 VAL 54 2HG1 VAL 54 -2.871 5.452 -6.378 422 3HG1 VAL 54 3HG1 VAL 54 -4.319 4.743 -5.663 423 1HG2 VAL 54 1HG2 VAL 54 -2.213 6.443 -4.274 424 2HG2 VAL 54 2HG2 VAL 54 -1.908 5.448 -2.850 425 3HG2 VAL 54 3HG2 VAL 54 -3.565 5.766 -3.367 426 H PHE 55 H PHE 55 -4.046 2.729 -1.533 427 HA PHE 55 HA PHE 55 -6.509 4.167 -2.170 428 1HB PHE 55 1HB PHE 55 -7.906 2.548 -1.026 429 2HB PHE 55 2HB PHE 55 -7.025 1.742 -2.315 430 HD1 PHE 55 HD1 PHE 55 -5.043 0.318 -1.719 431 HD2 PHE 55 HD2 PHE 55 -7.736 1.854 1.197 432 HE1 PHE 55 HE1 PHE 55 -4.268 -1.376 -0.115 433 HE2 PHE 55 HE2 PHE 55 -6.960 0.166 2.809 434 HZ PHE 55 HZ PHE 55 -5.225 -1.452 2.152 435 HA PRO 56 HA PRO 56 -5.700 6.471 1.462 436 1HB PRO 56 1HB PRO 56 -8.532 6.092 2.271 437 2HB PRO 56 2HB PRO 56 -7.625 7.584 2.003 438 1HG PRO 56 1HG PRO 56 -9.436 6.753 0.232 439 2HG PRO 56 2HG PRO 56 -7.922 7.509 -0.295 440 1HD PRO 56 1HD PRO 56 -8.700 4.622 -0.286 441 2HD PRO 56 2HD PRO 56 -7.767 5.538 -1.490 442 H GLY 57 H GLY 57 -8.080 3.942 2.293 443 1HA GLY 57 1HA GLY 57 -7.023 2.124 3.750 444 2HA GLY 57 2HA GLY 57 -6.583 3.477 4.787 445 H GLY 58 H GLY 58 -8.454 1.060 5.023 446 1HA GLY 58 1HA GLY 58 -10.465 2.389 6.556 447 2HA GLY 58 2HA GLY 58 -11.116 1.748 5.052 448 H LYS 59 H LYS 59 -11.601 -0.369 4.918 449 HA LYS 59 HA LYS 59 -11.451 -1.979 7.279 450 1HB LYS 59 1HB LYS 59 -13.364 -2.156 5.761 451 2HB LYS 59 2HB LYS 59 -12.305 -2.679 4.461 452 1HG LYS 59 1HG LYS 59 -11.763 -4.707 5.724 453 2HG LYS 59 2HG LYS 59 -12.849 -4.184 7.014 454 1HD LYS 59 1HD LYS 59 -14.741 -4.276 5.507 455 2HD LYS 59 2HD LYS 59 -13.681 -4.671 4.155 456 1HE LYS 59 1HE LYS 59 -14.790 -6.668 4.965 457 2HE LYS 59 2HE LYS 59 -13.056 -6.765 5.263 458 1HZ LYS 59 1HZ LYS 59 -15.034 -5.916 7.313 459 2HZ LYS 59 2HZ LYS 59 -13.395 -6.273 7.551 460 3HZ LYS 59 3HZ LYS 59 -14.475 -7.509 7.142 461 H GLY 60 H GLY 60 -9.181 -1.999 7.600 462 1HA GLY 60 1HA GLY 60 -7.894 -4.254 6.345 463 2HA GLY 60 2HA GLY 60 -7.158 -2.708 5.942 464 H SER 61 H SER 61 -7.819 -5.001 8.467 465 HA SER 61 HA SER 61 -5.569 -4.019 9.989 466 1HB SER 61 1HB SER 61 -7.511 -2.641 10.773 467 2HB SER 61 2HB SER 61 -8.309 -4.131 11.273 468 HG SER 61 HG SER 61 -5.908 -2.986 12.281 469 H THR 62 H THR 62 -5.066 -5.472 11.807 470 HA THR 62 HA THR 62 -4.675 -7.520 12.703 471 HB THR 62 HB THR 62 -7.305 -8.446 11.527 472 HG1 THR 62 HG1 THR 62 -7.062 -6.375 13.027 473 1HG2 THR 62 1HG2 THR 62 -5.913 -10.193 12.541 474 2HG2 THR 62 2HG2 THR 62 -7.354 -9.892 13.514 475 3HG2 THR 62 3HG2 THR 62 -5.793 -9.246 14.023 476 H VAL 63 H VAL 63 -3.530 -6.900 10.295 477 HA VAL 63 HA VAL 63 -3.705 -8.999 8.373 478 HB VAL 63 HB VAL 63 -1.294 -7.249 8.802 479 1HG1 VAL 63 1HG1 VAL 63 -1.069 -9.003 7.150 480 2HG1 VAL 63 2HG1 VAL 63 -1.089 -7.418 6.376 481 3HG1 VAL 63 3HG1 VAL 63 -2.524 -8.442 6.330 482 1HG2 VAL 63 1HG2 VAL 63 -2.350 -5.563 7.370 483 2HG2 VAL 63 2HG2 VAL 63 -3.220 -5.791 8.887 484 3HG2 VAL 63 3HG2 VAL 63 -3.847 -6.496 7.398 485 H GLY 64 H GLY 64 -2.001 -8.538 11.323 486 1HA GLY 64 1HA GLY 64 -0.791 -10.022 12.595 487 2HA GLY 64 2HA GLY 64 -1.066 -11.240 11.353 488 H SER 65 H SER 65 0.175 -11.020 9.370 489 HA SER 65 HA SER 65 2.392 -9.463 8.955 490 1HB SER 65 1HB SER 65 4.258 -11.000 9.698 491 2HB SER 65 2HB SER 65 3.409 -10.169 10.995 492 HG SER 65 HG SER 65 2.986 -12.054 11.785 493 H TYR 66 H TYR 66 2.371 -13.012 9.072 494 HA TYR 66 HA TYR 66 3.568 -13.172 6.504 495 1HB TYR 66 1HB TYR 66 3.262 -15.660 6.817 496 2HB TYR 66 2HB TYR 66 4.192 -14.833 8.059 497 HD1 TYR 66 HD1 TYR 66 3.445 -14.784 10.327 498 HD2 TYR 66 HD2 TYR 66 0.936 -16.419 7.301 499 HE1 TYR 66 HE1 TYR 66 1.982 -15.734 12.059 500 HE2 TYR 66 HE2 TYR 66 -0.536 -17.369 9.028 501 HH TYR 66 HH TYR 66 -0.359 -16.473 12.293 502 H VAL 67 H VAL 67 0.321 -12.814 7.316 503 HA VAL 67 HA VAL 67 -0.946 -14.449 5.420 504 HB VAL 67 HB VAL 67 -1.843 -11.741 6.430 505 1HG1 VAL 67 1HG1 VAL 67 -3.437 -13.961 5.152 506 2HG1 VAL 67 2HG1 VAL 67 -3.041 -12.411 4.410 507 3HG1 VAL 67 3HG1 VAL 67 -4.096 -12.468 5.822 508 1HG2 VAL 67 1HG2 VAL 67 -3.186 -13.031 8.035 509 2HG2 VAL 67 2HG2 VAL 67 -1.456 -13.290 8.257 510 3HG2 VAL 67 3HG2 VAL 67 -2.435 -14.517 7.453 511 H LEU 68 H LEU 68 0.380 -11.177 5.157 512 HA LEU 68 HA LEU 68 -0.434 -10.800 2.442 513 1HB LEU 68 1HB LEU 68 0.256 -9.085 4.331 514 2HB LEU 68 2HB LEU 68 1.861 -9.328 3.679 515 HG LEU 68 HG LEU 68 0.668 -7.308 2.812 516 1HD1 LEU 68 1HD1 LEU 68 2.514 -8.279 1.556 517 2HD1 LEU 68 2HD1 LEU 68 1.279 -7.632 0.476 518 3HD1 LEU 68 3HD1 LEU 68 1.395 -9.372 0.740 519 1HD2 LEU 68 1HD2 LEU 68 -1.080 -7.619 1.135 520 2HD2 LEU 68 2HD2 LEU 68 -1.579 -8.236 2.709 521 3HD2 LEU 68 3HD2 LEU 68 -1.070 -9.355 1.444 522 H LEU 69 H LEU 69 2.350 -12.111 4.071 523 HA LEU 69 HA LEU 69 4.238 -12.053 1.995 524 1HB LEU 69 1HB LEU 69 4.776 -12.503 4.348 525 2HB LEU 69 2HB LEU 69 3.930 -14.033 4.256 526 HG LEU 69 HG LEU 69 5.581 -14.797 2.562 527 1HD1 LEU 69 1HD1 LEU 69 7.002 -12.240 3.281 528 2HD1 LEU 69 2HD1 LEU 69 6.271 -12.620 1.721 529 3HD1 LEU 69 3HD1 LEU 69 7.656 -13.549 2.295 530 1HD2 LEU 69 1HD2 LEU 69 6.737 -13.899 5.197 531 2HD2 LEU 69 2HD2 LEU 69 7.396 -15.157 4.151 532 3HD2 LEU 69 3HD2 LEU 69 5.823 -15.381 4.917 533 H ASN 70 H ASN 70 1.642 -14.276 2.739 534 HA ASN 70 HA ASN 70 2.301 -16.464 1.161 535 1HB ASN 70 1HB ASN 70 0.423 -16.580 2.656 536 2HB ASN 70 2HB ASN 70 -0.394 -15.266 1.817 537 1HD2 ASN 70 1HD2 ASN 70 0.488 -18.634 1.702 538 2HD2 ASN 70 2HD2 ASN 70 -0.598 -19.070 0.424 539 H LEU 71 H LEU 71 0.640 -13.478 0.252 540 HA LEU 71 HA LEU 71 -0.027 -14.208 -2.371 541 1HB LEU 71 1HB LEU 71 0.569 -11.457 -1.278 542 2HB LEU 71 2HB LEU 71 -0.271 -11.798 -2.779 543 HG LEU 71 HG LEU 71 -1.262 -12.500 -0.014 544 1HD1 LEU 71 1HD1 LEU 71 -1.309 -10.104 -0.458 545 2HD1 LEU 71 2HD1 LEU 71 -2.937 -10.779 -0.419 546 3HD1 LEU 71 3HD1 LEU 71 -2.180 -10.395 -1.964 547 1HD2 LEU 71 1HD2 LEU 71 -1.986 -14.103 -1.727 548 2HD2 LEU 71 2HD2 LEU 71 -2.617 -12.770 -2.695 549 3HD2 LEU 71 3HD2 LEU 71 -3.330 -13.133 -1.123 550 H ARG 72 H ARG 72 2.923 -12.930 -0.984 551 HA ARG 72 HA ARG 72 4.139 -12.210 -3.463 552 1HB ARG 72 1HB ARG 72 4.828 -11.285 -1.247 553 2HB ARG 72 2HB ARG 72 5.521 -12.857 -0.865 554 1HG ARG 72 1HG ARG 72 6.858 -12.600 -3.021 555 2HG ARG 72 2HG ARG 72 6.384 -10.903 -2.964 556 1HD ARG 72 1HD ARG 72 8.564 -11.248 -1.967 557 2HD ARG 72 2HD ARG 72 7.404 -10.679 -0.772 558 HE ARG 72 HE ARG 72 7.235 -13.114 -0.123 559 1HH1 ARG 72 1HH1 ARG 72 10.121 -11.790 -1.583 560 2HH1 ARG 72 2HH1 ARG 72 11.195 -12.884 -0.764 561 1HH2 ARG 72 1HH2 ARG 72 8.638 -14.568 0.951 562 2HH2 ARG 72 2HH2 ARG 72 10.346 -14.485 0.669 563 H LYS 73 H LYS 73 4.090 -15.103 -1.479 564 HA LYS 73 HA LYS 73 6.276 -16.418 -2.657 565 1HB LYS 73 1HB LYS 73 3.817 -17.561 -1.327 566 2HB LYS 73 2HB LYS 73 5.215 -18.515 -1.801 567 1HG LYS 73 1HG LYS 73 6.602 -17.043 -0.321 568 2HG LYS 73 2HG LYS 73 5.092 -16.342 0.270 569 1HD LYS 73 1HD LYS 73 4.349 -18.536 1.019 570 2HD LYS 73 2HD LYS 73 5.821 -19.268 0.380 571 1HE LYS 73 1HE LYS 73 7.119 -17.790 1.929 572 2HE LYS 73 2HE LYS 73 5.586 -17.304 2.652 573 1HZ LYS 73 1HZ LYS 73 6.656 -19.091 3.893 574 2HZ LYS 73 2HZ LYS 73 6.617 -20.089 2.525 575 3HZ LYS 73 3HZ LYS 73 5.168 -19.601 3.259 576 H ASN 74 H ASN 74 2.946 -16.098 -3.655 577 HA ASN 74 HA ASN 74 3.372 -17.977 -5.847 578 1HB ASN 74 1HB ASN 74 1.220 -18.000 -4.567 579 2HB ASN 74 2HB ASN 74 0.872 -16.399 -5.216 580 1HD2 ASN 74 1HD2 ASN 74 -0.982 -17.176 -6.240 581 2HD2 ASN 74 2HD2 ASN 74 -0.883 -18.116 -7.693 582 H GLY 75 H GLY 75 3.266 -14.577 -5.206 583 1HA GLY 75 1HA GLY 75 4.301 -12.998 -6.627 584 2HA GLY 75 2HA GLY 75 4.093 -14.109 -7.972 585 H VAL 76 H VAL 76 1.458 -13.395 -5.815 586 HA VAL 76 HA VAL 76 0.130 -11.973 -8.023 587 HB VAL 76 HB VAL 76 -2.002 -12.588 -6.961 588 1HG1 VAL 76 1HG1 VAL 76 -1.111 -14.038 -8.674 589 2HG1 VAL 76 2HG1 VAL 76 -1.899 -15.011 -7.431 590 3HG1 VAL 76 3HG1 VAL 76 -0.138 -14.900 -7.485 591 1HG2 VAL 76 1HG2 VAL 76 -1.331 -12.717 -4.645 592 2HG2 VAL 76 2HG2 VAL 76 -0.259 -14.073 -4.992 593 3HG2 VAL 76 3HG2 VAL 76 -2.006 -14.271 -5.139 594 H ALA 77 H ALA 77 1.821 -11.273 -5.402 595 HA ALA 77 HA ALA 77 0.086 -9.390 -4.093 596 1HB ALA 77 1HB ALA 77 1.836 -10.535 -2.842 597 2HB ALA 77 2HB ALA 77 2.088 -8.789 -2.813 598 3HB ALA 77 3HB ALA 77 3.065 -9.803 -3.873 599 HA PRO 78 HA PRO 78 0.896 -5.733 -6.497 600 1HB PRO 78 1HB PRO 78 1.376 -3.890 -4.512 601 2HB PRO 78 2HB PRO 78 -0.235 -4.416 -5.011 602 1HG PRO 78 1HG PRO 78 1.423 -5.329 -2.691 603 2HG PRO 78 2HG PRO 78 -0.317 -4.984 -2.761 604 1HD PRO 78 1HD PRO 78 0.619 -7.499 -2.822 605 2HD PRO 78 2HD PRO 78 -0.804 -7.016 -3.771 606 H LYS 79 H LYS 79 2.577 -4.196 -7.043 607 HA LYS 79 HA LYS 79 5.231 -5.237 -6.518 608 1HB LYS 79 1HB LYS 79 3.987 -3.648 -8.567 609 2HB LYS 79 2HB LYS 79 5.398 -2.798 -7.950 610 1HG LYS 79 1HG LYS 79 6.814 -4.676 -8.456 611 2HG LYS 79 2HG LYS 79 5.417 -5.647 -8.928 612 1HD LYS 79 1HD LYS 79 4.957 -4.086 -10.762 613 2HD LYS 79 2HD LYS 79 6.368 -3.130 -10.301 614 1HE LYS 79 1HE LYS 79 7.842 -4.953 -10.826 615 2HE LYS 79 2HE LYS 79 6.476 -6.036 -11.095 616 1HZ LYS 79 1HZ LYS 79 7.125 -3.638 -12.734 617 2HZ LYS 79 2HZ LYS 79 5.823 -4.699 -12.992 618 3HZ LYS 79 3HZ LYS 79 7.412 -5.249 -13.180 619 H ALA 80 H ALA 80 3.213 -2.587 -5.599 620 HA ALA 80 HA ALA 80 4.747 -2.065 -3.268 621 1HB ALA 80 1HB ALA 80 4.695 0.086 -5.389 622 2HB ALA 80 2HB ALA 80 6.123 -0.778 -4.817 623 3HB ALA 80 3HB ALA 80 5.249 0.302 -3.730 624 H ILE 81 H ILE 81 3.647 -0.290 -1.978 625 HA ILE 81 HA ILE 81 0.985 0.398 -2.873 626 HB ILE 81 HB ILE 81 0.470 -1.739 -1.994 627 1HG1 ILE 81 1HG1 ILE 81 -0.172 0.266 0.173 628 2HG1 ILE 81 2HG1 ILE 81 -1.056 0.101 -1.342 629 1HG2 ILE 81 1HG2 ILE 81 2.497 -2.173 -0.759 630 2HG2 ILE 81 2HG2 ILE 81 1.087 -2.472 0.258 631 3HG2 ILE 81 3HG2 ILE 81 2.027 -0.995 0.469 632 1HD1 ILE 81 1HD1 ILE 81 -1.691 -2.170 -0.718 633 2HD1 ILE 81 2HD1 ILE 81 -2.218 -0.993 0.485 634 3HD1 ILE 81 3HD1 ILE 81 -0.804 -2.002 0.796 635 H ILE 82 H ILE 82 0.621 2.399 -2.321 636 HA ILE 82 HA ILE 82 2.088 3.521 -0.023 637 HB ILE 82 HB ILE 82 0.858 5.304 -2.085 638 1HG1 ILE 82 1HG1 ILE 82 2.086 3.606 -3.411 639 2HG1 ILE 82 2HG1 ILE 82 2.822 5.200 -3.516 640 1HG2 ILE 82 1HG2 ILE 82 2.815 6.693 -1.528 641 2HG2 ILE 82 2HG2 ILE 82 3.381 5.431 -0.436 642 3HG2 ILE 82 3HG2 ILE 82 1.866 6.270 -0.103 643 1HD1 ILE 82 1HD1 ILE 82 4.522 4.503 -1.890 644 2HD1 ILE 82 2HD1 ILE 82 4.514 3.486 -3.331 645 3HD1 ILE 82 3HD1 ILE 82 3.791 2.898 -1.834 646 H ASN 83 H ASN 83 0.847 3.998 1.696 647 HA ASN 83 HA ASN 83 -2.051 4.252 1.221 648 1HB ASN 83 1HB ASN 83 -0.580 2.938 3.500 649 2HB ASN 83 2HB ASN 83 -2.288 3.349 3.583 650 1HD2 ASN 83 1HD2 ASN 83 -2.833 2.720 0.806 651 2HD2 ASN 83 2HD2 ASN 83 -2.774 0.999 0.677 652 H LYS 84 H LYS 84 -3.232 5.385 2.923 653 HA LYS 84 HA LYS 84 -1.765 7.755 3.832 654 1HB LYS 84 1HB LYS 84 -3.814 8.004 2.415 655 2HB LYS 84 2HB LYS 84 -4.745 7.262 3.703 656 1HG LYS 84 1HG LYS 84 -4.169 9.102 5.193 657 2HG LYS 84 2HG LYS 84 -3.225 9.854 3.902 658 1HD LYS 84 1HD LYS 84 -5.227 10.051 2.530 659 2HD LYS 84 2HD LYS 84 -6.177 9.242 3.776 660 1HE LYS 84 1HE LYS 84 -5.657 11.085 5.328 661 2HE LYS 84 2HE LYS 84 -4.778 11.900 4.034 662 1HZ LYS 84 1HZ LYS 84 -6.767 12.178 2.798 663 2HZ LYS 84 2HZ LYS 84 -7.122 12.657 4.391 664 3HZ LYS 84 3HZ LYS 84 -7.640 11.145 3.825 665 H LYS 85 H LYS 85 -3.666 5.037 4.867 666 HA LYS 85 HA LYS 85 -3.029 5.653 7.682 667 1HB LYS 85 1HB LYS 85 -5.453 5.755 7.226 668 2HB LYS 85 2HB LYS 85 -5.398 4.126 6.572 669 1HG LYS 85 1HG LYS 85 -4.598 3.359 8.828 670 2HG LYS 85 2HG LYS 85 -4.973 4.979 9.420 671 1HD LYS 85 1HD LYS 85 -7.297 4.699 8.704 672 2HD LYS 85 2HD LYS 85 -6.918 3.082 8.111 673 1HE LYS 85 1HE LYS 85 -6.817 4.045 10.963 674 2HE LYS 85 2HE LYS 85 -7.967 2.906 10.267 675 1HZ LYS 85 1HZ LYS 85 -5.084 2.502 10.810 676 2HZ LYS 85 2HZ LYS 85 -5.950 1.476 9.767 677 3HZ LYS 85 3HZ LYS 85 -6.405 1.609 11.394 678 H THR 86 H THR 86 -1.652 4.215 8.589 679 HA THR 86 HA THR 86 -1.433 1.548 7.357 680 HB THR 86 HB THR 86 1.010 1.627 7.712 681 HG1 THR 86 HG1 THR 86 1.555 3.108 9.153 682 1HG2 THR 86 1HG2 THR 86 0.112 2.233 5.522 683 2HG2 THR 86 2HG2 THR 86 1.545 3.193 5.894 684 3HG2 THR 86 3HG2 THR 86 -0.060 3.909 6.046 685 H GLU 87 H GLU 87 -0.578 -0.113 8.725 686 HA GLU 87 HA GLU 87 -0.631 0.481 11.610 687 1HB GLU 87 1HB GLU 87 -1.494 -2.080 10.251 688 2HB GLU 87 2HB GLU 87 -1.399 -1.835 11.987 689 1HG GLU 87 1HG GLU 87 -3.107 -0.026 11.731 690 2HG GLU 87 2HG GLU 87 -3.288 -0.532 10.050 691 H THR 88 H THR 88 0.783 -0.860 12.900 692 HA THR 88 HA THR 88 3.362 -1.153 11.851 693 HB THR 88 HB THR 88 2.195 -2.464 14.319 694 HG1 THR 88 HG1 THR 88 2.079 -0.139 14.276 695 1HG2 THR 88 1HG2 THR 88 4.514 -2.563 15.113 696 2HG2 THR 88 2HG2 THR 88 5.075 -1.913 13.572 697 3HG2 THR 88 3HG2 THR 88 4.309 -3.501 13.633 698 H ILE 89 H ILE 89 0.822 -3.583 12.428 699 HA ILE 89 HA ILE 89 2.386 -5.824 11.715 700 HB ILE 89 HB ILE 89 0.168 -6.955 11.284 701 1HG1 ILE 89 1HG1 ILE 89 -0.873 -4.274 12.220 702 2HG1 ILE 89 2HG1 ILE 89 -1.143 -5.009 10.641 703 1HG2 ILE 89 1HG2 ILE 89 -0.438 -6.976 13.668 704 2HG2 ILE 89 2HG2 ILE 89 0.614 -5.584 13.929 705 3HG2 ILE 89 3HG2 ILE 89 1.300 -7.123 13.408 706 1HD1 ILE 89 1HD1 ILE 89 -2.371 -6.830 11.735 707 2HD1 ILE 89 2HD1 ILE 89 -3.100 -5.250 12.022 708 3HD1 ILE 89 3HD1 ILE 89 -2.147 -6.025 13.288 709 H ILE 90 H ILE 90 0.567 -3.532 9.795 710 HA ILE 90 HA ILE 90 0.637 -4.981 7.357 711 HB ILE 90 HB ILE 90 0.564 -1.980 7.771 712 1HG1 ILE 90 1HG1 ILE 90 -1.678 -3.964 7.308 713 2HG1 ILE 90 2HG1 ILE 90 -1.333 -3.144 8.825 714 1HG2 ILE 90 1HG2 ILE 90 1.291 -2.563 5.519 715 2HG2 ILE 90 2HG2 ILE 90 -0.339 -1.888 5.488 716 3HG2 ILE 90 3HG2 ILE 90 -0.101 -3.629 5.330 717 1HD1 ILE 90 1HD1 ILE 90 -3.198 -2.107 7.695 718 2HD1 ILE 90 2HD1 ILE 90 -2.210 -1.838 6.259 719 3HD1 ILE 90 3HD1 ILE 90 -1.830 -0.995 7.761 720 H ALA 91 H ALA 91 2.785 -2.621 8.868 721 HA ALA 91 HA ALA 91 4.649 -2.463 6.753 722 1HB ALA 91 1HB ALA 91 4.527 -0.771 8.499 723 2HB ALA 91 2HB ALA 91 6.148 -1.457 8.403 724 3HB ALA 91 3HB ALA 91 5.056 -1.952 9.696 725 H VAL 92 H VAL 92 4.323 -4.641 9.495 726 HA VAL 92 HA VAL 92 6.831 -5.925 9.243 727 HB VAL 92 HB VAL 92 4.238 -7.049 10.329 728 1HG1 VAL 92 1HG1 VAL 92 5.642 -8.646 11.526 729 2HG1 VAL 92 2HG1 VAL 92 7.079 -7.974 10.757 730 3HG1 VAL 92 3HG1 VAL 92 5.861 -8.798 9.784 731 1HG2 VAL 92 1HG2 VAL 92 6.533 -5.707 11.752 732 2HG2 VAL 92 2HG2 VAL 92 5.122 -6.432 12.522 733 3HG2 VAL 92 3HG2 VAL 92 4.931 -5.019 11.486 734 H GLY 93 H GLY 93 3.599 -6.792 8.025 735 1HA GLY 93 1HA GLY 93 4.402 -9.104 6.623 736 2HA GLY 93 2HA GLY 93 2.947 -8.167 6.305 737 H ALA 94 H ALA 94 4.044 -5.744 5.569 738 HA ALA 94 HA ALA 94 4.631 -6.182 2.855 739 1HB ALA 94 1HB ALA 94 4.996 -3.769 2.731 740 2HB ALA 94 2HB ALA 94 5.016 -3.678 4.492 741 3HB ALA 94 3HB ALA 94 3.541 -4.155 3.650 742 H ALA 95 H ALA 95 6.710 -5.506 5.625 743 HA ALA 95 HA ALA 95 9.077 -4.993 4.183 744 1HB ALA 95 1HB ALA 95 10.245 -5.410 6.281 745 2HB ALA 95 2HB ALA 95 8.783 -6.129 6.961 746 3HB ALA 95 3HB ALA 95 8.812 -4.416 6.543 747 H MET 96 H MET 96 7.692 -7.989 5.474 748 HA MET 96 HA MET 96 9.940 -9.589 4.703 749 1HB MET 96 1HB MET 96 7.133 -10.349 5.505 750 2HB MET 96 2HB MET 96 8.430 -11.503 5.227 751 1HG MET 96 1HG MET 96 9.730 -10.424 7.021 752 2HG MET 96 2HG MET 96 8.363 -9.356 7.330 753 1HE MET 96 1HE MET 96 5.924 -11.462 6.820 754 2HE MET 96 2HE MET 96 5.965 -10.248 8.098 755 3HE MET 96 3HE MET 96 5.623 -11.932 8.494 756 H ALA 97 H ALA 97 6.874 -8.713 3.247 757 HA ALA 97 HA ALA 97 7.218 -10.481 1.000 758 1HB ALA 97 1HB ALA 97 4.985 -9.871 1.819 759 2HB ALA 97 2HB ALA 97 5.208 -9.448 0.123 760 3HB ALA 97 3HB ALA 97 5.284 -8.193 1.360 761 H GLU 98 H GLU 98 8.773 -7.751 1.889 762 HA GLU 98 HA GLU 98 10.075 -6.209 0.869 763 1HB GLU 98 1HB GLU 98 9.944 -8.148 -1.450 764 2HB GLU 98 2HB GLU 98 11.122 -6.854 -1.260 765 1HG GLU 98 1HG GLU 98 11.838 -7.944 0.875 766 2HG GLU 98 2HG GLU 98 10.807 -9.308 0.446 767 H ILE 99 H ILE 99 7.353 -5.718 0.819 768 HA ILE 99 HA ILE 99 6.935 -4.355 -1.755 769 HB ILE 99 HB ILE 99 4.843 -5.159 0.278 770 1HG1 ILE 99 1HG1 ILE 99 5.458 -6.283 -2.466 771 2HG1 ILE 99 2HG1 ILE 99 5.794 -7.082 -0.933 772 1HG2 ILE 99 1HG2 ILE 99 3.233 -4.468 -1.445 773 2HG2 ILE 99 2HG2 ILE 99 4.567 -3.892 -2.444 774 3HG2 ILE 99 3HG2 ILE 99 4.232 -3.123 -0.893 775 1HD1 ILE 99 1HD1 ILE 99 3.411 -7.188 -0.460 776 2HD1 ILE 99 2HD1 ILE 99 3.794 -7.969 -1.994 777 3HD1 ILE 99 3HD1 ILE 99 3.066 -6.363 -1.979 778 HA PRO 100 HA PRO 100 8.439 -0.950 0.919 779 1HB PRO 100 1HB PRO 100 7.583 0.361 -1.636 780 2HB PRO 100 2HB PRO 100 9.016 0.658 -0.646 781 1HG PRO 100 1HG PRO 100 9.179 -0.803 -2.863 782 2HG PRO 100 2HG PRO 100 10.107 -1.232 -1.413 783 1HD PRO 100 1HD PRO 100 7.719 -2.538 -2.587 784 2HD PRO 100 2HD PRO 100 9.015 -3.235 -1.598 785 H LEU 101 H LEU 101 7.121 -0.301 2.460 786 HA LEU 101 HA LEU 101 4.433 0.699 1.781 787 1HB LEU 101 1HB LEU 101 5.053 -1.252 3.527 788 2HB LEU 101 2HB LEU 101 5.237 0.126 4.591 789 HG LEU 101 HG LEU 101 3.052 -0.703 4.936 790 1HD1 LEU 101 1HD1 LEU 101 3.163 1.733 4.785 791 2HD1 LEU 101 2HD1 LEU 101 1.599 1.110 4.261 792 3HD1 LEU 101 3HD1 LEU 101 2.782 1.638 3.065 793 1HD2 LEU 101 1HD2 LEU 101 2.680 -0.651 1.953 794 2HD2 LEU 101 2HD2 LEU 101 1.449 -1.075 3.142 795 3HD2 LEU 101 3HD2 LEU 101 2.883 -2.086 2.958 796 H VAL 102 H VAL 102 4.224 2.856 1.833 797 HA VAL 102 HA VAL 102 5.630 4.382 3.897 798 HB VAL 102 HB VAL 102 6.045 6.217 2.183 799 1HG1 VAL 102 1HG1 VAL 102 7.855 4.920 3.141 800 2HG1 VAL 102 2HG1 VAL 102 8.168 5.233 1.433 801 3HG1 VAL 102 3HG1 VAL 102 7.599 3.645 1.951 802 1HG2 VAL 102 1HG2 VAL 102 6.296 5.530 -0.142 803 2HG2 VAL 102 2HG2 VAL 102 4.633 5.305 0.403 804 3HG2 VAL 102 3HG2 VAL 102 5.712 3.916 0.262 805 H GLU 103 H GLU 103 4.737 6.573 4.159 806 HA GLU 103 HA GLU 103 1.826 6.504 3.797 807 1HB GLU 103 1HB GLU 103 3.539 8.189 5.626 808 2HB GLU 103 2HB GLU 103 1.788 8.253 5.544 809 1HG GLU 103 1HG GLU 103 1.662 5.948 6.326 810 2HG GLU 103 2HG GLU 103 3.425 5.878 6.400 811 H VAL 104 H VAL 104 0.827 7.887 2.461 812 HA VAL 104 HA VAL 104 2.260 10.273 1.539 813 HB VAL 104 HB VAL 104 0.151 10.625 0.132 814 1HG1 VAL 104 1HG1 VAL 104 2.197 9.883 -0.875 815 2HG1 VAL 104 2HG1 VAL 104 0.868 8.938 -1.547 816 3HG1 VAL 104 3HG1 VAL 104 1.922 8.232 -0.322 817 1HG2 VAL 104 1HG2 VAL 104 -0.315 7.761 0.951 818 2HG2 VAL 104 2HG2 VAL 104 -1.184 8.617 -0.322 819 3HG2 VAL 104 3HG2 VAL 104 -1.335 9.142 1.356 820 H ARG 105 H ARG 105 1.573 12.342 2.014 821 HA ARG 105 HA ARG 105 -0.119 12.465 4.402 822 1HB ARG 105 1HB ARG 105 1.749 14.578 3.321 823 2HB ARG 105 2HB ARG 105 0.984 14.549 4.903 824 1HG ARG 105 1HG ARG 105 2.282 12.596 5.521 825 2HG ARG 105 2HG ARG 105 3.023 12.569 3.920 826 1HD ARG 105 1HD ARG 105 4.533 13.598 5.506 827 2HD ARG 105 2HD ARG 105 3.971 14.804 4.348 828 HE ARG 105 HE ARG 105 2.428 14.677 6.782 829 1HH1 ARG 105 1HH1 ARG 105 5.237 16.064 5.227 830 2HH1 ARG 105 2HH1 ARG 105 5.256 17.477 6.234 831 1HH2 ARG 105 1HH2 ARG 105 2.457 16.518 8.133 832 2HH2 ARG 105 2HH2 ARG 105 3.679 17.739 7.898 833 H ASP 106 H ASP 106 0.361 14.081 1.282 834 HA ASP 106 HA ASP 106 -1.984 15.736 1.787 835 1HB ASP 106 1HB ASP 106 0.240 16.601 0.810 836 2HB ASP 106 2HB ASP 106 -0.297 15.859 -0.694 837 H GLU 107 H GLU 107 -3.755 15.818 0.496 838 HA GLU 107 HA GLU 107 -4.634 13.340 -0.588 839 1HB GLU 107 1HB GLU 107 -5.917 15.369 0.534 840 2HB GLU 107 2HB GLU 107 -6.075 15.897 -1.134 841 1HG GLU 107 1HG GLU 107 -8.033 14.688 -0.558 842 2HG GLU 107 2HG GLU 107 -7.093 13.690 -1.666 843 H LYS 108 H LYS 108 -2.992 16.052 -1.930 844 HA LYS 108 HA LYS 108 -3.902 16.132 -4.548 845 1HB LYS 108 1HB LYS 108 -1.185 16.619 -3.363 846 2HB LYS 108 2HB LYS 108 -1.501 16.826 -5.073 847 1HG LYS 108 1HG LYS 108 -3.217 18.499 -4.540 848 2HG LYS 108 2HG LYS 108 -2.835 18.309 -2.825 849 1HD LYS 108 1HD LYS 108 -0.519 19.001 -3.284 850 2HD LYS 108 2HD LYS 108 -0.936 19.234 -4.982 851 1HE LYS 108 1HE LYS 108 -2.114 20.711 -2.634 852 2HE LYS 108 2HE LYS 108 -0.939 21.354 -3.780 853 1HZ LYS 108 1HZ LYS 108 -2.660 20.878 -5.539 854 2HZ LYS 108 2HZ LYS 108 -3.015 22.145 -4.473 855 3HZ LYS 108 3HZ LYS 108 -3.769 20.637 -4.276 856 H PHE 109 H PHE 109 -1.761 13.821 -3.022 857 HA PHE 109 HA PHE 109 -0.616 12.715 -5.339 858 1HB PHE 109 1HB PHE 109 0.241 12.292 -3.058 859 2HB PHE 109 2HB PHE 109 -1.201 11.349 -2.698 860 HD1 PHE 109 HD1 PHE 109 -1.354 9.083 -3.312 861 HD2 PHE 109 HD2 PHE 109 1.827 11.478 -4.810 862 HE1 PHE 109 HE1 PHE 109 -0.240 7.062 -4.171 863 HE2 PHE 109 HE2 PHE 109 2.946 9.466 -5.670 864 HZ PHE 109 HZ PHE 109 1.914 7.254 -5.352 865 H PHE 110 H PHE 110 -3.617 12.027 -3.623 866 HA PHE 110 HA PHE 110 -4.229 9.648 -5.057 867 1HB PHE 110 1HB PHE 110 -5.967 11.485 -3.404 868 2HB PHE 110 2HB PHE 110 -6.510 9.947 -4.064 869 HD1 PHE 110 HD1 PHE 110 -4.482 11.581 -1.522 870 HD2 PHE 110 HD2 PHE 110 -5.641 7.846 -3.194 871 HE1 PHE 110 HE1 PHE 110 -3.614 10.427 0.468 872 HE2 PHE 110 HE2 PHE 110 -4.777 6.683 -1.206 873 HZ PHE 110 HZ PHE 110 -3.762 7.976 0.628 874 H GLU 111 H GLU 111 -4.920 13.045 -5.556 875 HA GLU 111 HA GLU 111 -6.817 12.621 -7.644 876 1HB GLU 111 1HB GLU 111 -6.624 14.674 -6.164 877 2HB GLU 111 2HB GLU 111 -5.203 15.111 -7.107 878 1HG GLU 111 1HG GLU 111 -6.942 14.661 -9.081 879 2HG GLU 111 2HG GLU 111 -8.045 15.179 -7.813 880 H ALA 112 H ALA 112 -3.383 13.460 -7.457 881 HA ALA 112 HA ALA 112 -3.054 13.998 -10.211 882 1HB ALA 112 1HB ALA 112 -1.561 14.853 -8.460 883 2HB ALA 112 2HB ALA 112 -0.681 14.027 -9.746 884 3HB ALA 112 3HB ALA 112 -0.951 13.220 -8.200 885 H VAL 113 H VAL 113 -2.649 11.054 -8.308 886 HA VAL 113 HA VAL 113 -1.354 9.639 -10.434 887 HB VAL 113 HB VAL 113 -0.985 9.075 -8.050 888 1HG1 VAL 113 1HG1 VAL 113 -3.780 7.954 -8.169 889 2HG1 VAL 113 2HG1 VAL 113 -3.235 9.316 -7.191 890 3HG1 VAL 113 3HG1 VAL 113 -2.628 7.694 -6.859 891 1HG2 VAL 113 1HG2 VAL 113 -0.405 7.479 -9.781 892 2HG2 VAL 113 2HG2 VAL 113 -2.043 6.826 -9.755 893 3HG2 VAL 113 3HG2 VAL 113 -0.997 6.638 -8.347 894 H LYS 114 H LYS 114 -2.209 8.554 -12.062 895 HA LYS 114 HA LYS 114 -5.101 7.984 -12.011 896 1HB LYS 114 1HB LYS 114 -3.459 8.417 -14.509 897 2HB LYS 114 2HB LYS 114 -5.208 8.377 -14.361 898 1HG LYS 114 1HG LYS 114 -3.443 10.512 -13.183 899 2HG LYS 114 2HG LYS 114 -4.292 10.642 -14.723 900 1HD LYS 114 1HD LYS 114 -6.429 10.431 -13.584 901 2HD LYS 114 2HD LYS 114 -5.604 10.223 -12.035 902 1HE LYS 114 1HE LYS 114 -4.676 12.455 -12.197 903 2HE LYS 114 2HE LYS 114 -5.390 12.665 -13.795 904 1HZ LYS 114 1HZ LYS 114 -7.582 12.514 -12.810 905 2HZ LYS 114 2HZ LYS 114 -6.691 13.756 -12.075 906 3HZ LYS 114 3HZ LYS 114 -6.909 12.281 -11.270 907 H THR 115 H THR 115 -5.754 5.950 -12.720 908 HA THR 115 HA THR 115 -3.919 3.840 -12.398 909 HB THR 115 HB THR 115 -6.586 3.630 -13.800 910 HG1 THR 115 HG1 THR 115 -7.485 3.428 -11.746 911 1HG2 THR 115 1HG2 THR 115 -4.994 1.668 -12.138 912 2HG2 THR 115 2HG2 THR 115 -5.182 1.622 -13.891 913 3HG2 THR 115 3HG2 THR 115 -6.581 1.366 -12.849 914 H GLY 116 H GLY 116 -2.313 3.401 -13.753 915 1HA GLY 116 1HA GLY 116 -1.924 2.311 -15.970 916 2HA GLY 116 2HA GLY 116 -2.834 3.647 -16.653 917 H ASP 117 H ASP 117 -1.285 5.182 -14.334 918 HA ASP 117 HA ASP 117 0.952 5.910 -16.037 919 1HB ASP 117 1HB ASP 117 -0.146 7.024 -13.467 920 2HB ASP 117 2HB ASP 117 1.434 7.515 -14.072 921 H ARG 118 H ARG 118 3.099 6.293 -14.778 922 HA ARG 118 HA ARG 118 3.640 3.814 -13.278 923 1HB ARG 118 1HB ARG 118 4.714 3.717 -15.425 924 2HB ARG 118 2HB ARG 118 5.396 5.322 -15.214 925 1HG ARG 118 1HG ARG 118 6.758 4.468 -13.347 926 2HG ARG 118 2HG ARG 118 6.110 2.852 -13.647 927 1HD ARG 118 1HD ARG 118 8.346 3.271 -14.673 928 2HD ARG 118 2HD ARG 118 7.098 2.783 -15.819 929 HE ARG 118 HE ARG 118 6.899 5.310 -16.205 930 1HH1 ARG 118 1HH1 ARG 118 9.883 3.695 -15.346 931 2HH1 ARG 118 2HH1 ARG 118 10.884 4.799 -16.254 932 1HH2 ARG 118 1HH2 ARG 118 8.211 6.756 -17.396 933 2HH2 ARG 118 2HH2 ARG 118 9.928 6.537 -17.424 934 H VAL 119 H VAL 119 4.228 4.096 -11.257 935 HA VAL 119 HA VAL 119 5.432 6.676 -10.512 936 HB VAL 119 HB VAL 119 3.292 6.361 -9.410 937 1HG1 VAL 119 1HG1 VAL 119 3.132 3.947 -9.482 938 2HG1 VAL 119 2HG1 VAL 119 2.911 4.526 -7.830 939 3HG1 VAL 119 3HG1 VAL 119 4.445 3.802 -8.314 940 1HG2 VAL 119 1HG2 VAL 119 5.032 7.513 -8.166 941 2HG2 VAL 119 2HG2 VAL 119 5.588 5.980 -7.493 942 3HG2 VAL 119 3HG2 VAL 119 3.989 6.599 -7.076 943 H VAL 120 H VAL 120 7.422 6.692 -9.747 944 HA VAL 120 HA VAL 120 8.712 4.128 -9.137 945 HB VAL 120 HB VAL 120 10.002 6.846 -9.500 946 1HG1 VAL 120 1HG1 VAL 120 11.223 4.087 -9.405 947 2HG1 VAL 120 2HG1 VAL 120 11.302 5.293 -8.120 948 3HG1 VAL 120 3HG1 VAL 120 12.089 5.600 -9.668 949 1HG2 VAL 120 1HG2 VAL 120 10.727 6.012 -11.697 950 2HG2 VAL 120 2HG2 VAL 120 8.971 6.129 -11.579 951 3HG2 VAL 120 3HG2 VAL 120 9.761 4.557 -11.451 952 H VAL 121 H VAL 121 8.679 3.570 -7.061 953 HA VAL 121 HA VAL 121 8.366 5.706 -5.076 954 HB VAL 121 HB VAL 121 6.537 4.166 -4.994 955 1HG1 VAL 121 1HG1 VAL 121 7.546 2.253 -6.090 956 2HG1 VAL 121 2HG1 VAL 121 6.827 1.769 -4.554 957 3HG1 VAL 121 3HG1 VAL 121 8.575 1.965 -4.686 958 1HG2 VAL 121 1HG2 VAL 121 7.328 4.987 -2.846 959 2HG2 VAL 121 2HG2 VAL 121 8.429 3.616 -2.713 960 3HG2 VAL 121 3HG2 VAL 121 6.684 3.353 -2.689 961 H ASN 122 H ASN 122 10.135 6.302 -4.117 962 HA ASN 122 HA ASN 122 12.169 4.317 -3.393 963 1HB ASN 122 1HB ASN 122 12.889 6.443 -4.504 964 2HB ASN 122 2HB ASN 122 12.230 7.342 -3.144 965 1HD2 ASN 122 1HD2 ASN 122 14.925 7.271 -4.169 966 2HD2 ASN 122 2HD2 ASN 122 15.935 6.751 -2.856 967 H ALA 123 H ALA 123 11.222 3.273 -1.661 968 HA ALA 123 HA ALA 123 9.931 4.788 0.438 969 1HB ALA 123 1HB ALA 123 10.567 1.845 0.254 970 2HB ALA 123 2HB ALA 123 9.042 2.611 -0.193 971 3HB ALA 123 3HB ALA 123 9.566 2.607 1.490 972 H ASP 124 H ASP 124 13.037 3.659 -0.318 973 HA ASP 124 HA ASP 124 14.141 3.226 2.232 974 1HB ASP 124 1HB ASP 124 15.184 2.524 0.093 975 2HB ASP 124 2HB ASP 124 15.516 4.210 -0.281 976 H GLU 125 H GLU 125 13.837 6.122 0.240 977 HA GLU 125 HA GLU 125 14.826 7.749 2.480 978 1HB GLU 125 1HB GLU 125 14.710 8.188 -0.481 979 2HB GLU 125 2HB GLU 125 14.796 9.566 0.609 980 1HG GLU 125 1HG GLU 125 16.769 7.300 0.634 981 2HG GLU 125 2HG GLU 125 16.987 8.782 -0.297 982 H GLY 126 H GLY 126 12.022 7.093 0.536 983 1HA GLY 126 1HA GLY 126 9.821 7.694 1.162 984 2HA GLY 126 2HA GLY 126 10.485 8.975 2.168 985 H TYR 127 H TYR 127 10.349 7.996 -1.237 986 HA TYR 127 HA TYR 127 9.726 10.740 -2.010 987 1HB TYR 127 1HB TYR 127 12.144 10.718 -2.080 988 2HB TYR 127 2HB TYR 127 12.152 9.192 -2.950 989 HD1 TYR 127 HD1 TYR 127 10.527 12.544 -3.446 990 HD2 TYR 127 HD2 TYR 127 12.833 9.379 -5.106 991 HE1 TYR 127 HE1 TYR 127 10.656 13.763 -5.582 992 HE2 TYR 127 HE2 TYR 127 12.965 10.581 -7.244 993 HH TYR 127 HH TYR 127 11.724 12.324 -8.481 994 H VAL 128 H VAL 128 8.140 10.691 -3.482 995 HA VAL 128 HA VAL 128 7.894 8.292 -5.165 996 HB VAL 128 HB VAL 128 5.373 8.658 -5.069 997 1HG1 VAL 128 1HG1 VAL 128 5.141 7.371 -2.999 998 2HG1 VAL 128 2HG1 VAL 128 6.792 7.795 -2.551 999 3HG1 VAL 128 3HG1 VAL 128 6.496 6.786 -3.967 1000 1HG2 VAL 128 1HG2 VAL 128 6.112 10.216 -2.588 1001 2HG2 VAL 128 2HG2 VAL 128 4.481 9.770 -3.087 1002 3HG2 VAL 128 3HG2 VAL 128 5.420 10.903 -4.058 1003 H GLU 129 H GLU 129 8.092 8.768 -7.206 1004 HA GLU 129 HA GLU 129 7.103 11.371 -8.139 1005 1HB GLU 129 1HB GLU 129 8.901 11.295 -9.866 1006 2HB GLU 129 2HB GLU 129 9.505 11.425 -8.222 1007 1HG GLU 129 1HG GLU 129 9.809 8.909 -8.293 1008 2HG GLU 129 2HG GLU 129 9.527 9.031 -10.028 1009 H LEU 130 H LEU 130 5.540 11.261 -9.581 1010 HA LEU 130 HA LEU 130 5.019 8.670 -10.865 1011 1HB LEU 130 1HB LEU 130 3.203 9.562 -9.477 1012 2HB LEU 130 2HB LEU 130 3.191 11.035 -10.428 1013 HG LEU 130 HG LEU 130 2.664 9.496 -12.435 1014 1HD1 LEU 130 1HD1 LEU 130 1.880 7.689 -10.159 1015 2HD1 LEU 130 2HD1 LEU 130 3.168 7.391 -11.328 1016 3HD1 LEU 130 3HD1 LEU 130 1.486 7.446 -11.861 1017 1HD2 LEU 130 1HD2 LEU 130 0.274 9.591 -11.941 1018 2HD2 LEU 130 2HD2 LEU 130 1.082 11.089 -11.476 1019 3HD2 LEU 130 3HD2 LEU 130 0.632 9.908 -10.244 1020 H ILE 131 H ILE 131 5.534 8.493 -12.936 1021 HA ILE 131 HA ILE 131 5.972 10.896 -14.525 1022 HB ILE 131 HB ILE 131 6.332 8.025 -15.360 1023 1HG1 ILE 131 1HG1 ILE 131 8.839 8.731 -15.199 1024 2HG1 ILE 131 2HG1 ILE 131 8.245 9.988 -14.124 1025 1HG2 ILE 131 1HG2 ILE 131 7.694 8.986 -17.176 1026 2HG2 ILE 131 2HG2 ILE 131 7.224 10.597 -16.632 1027 3HG2 ILE 131 3HG2 ILE 131 6.003 9.480 -17.239 1028 1HD1 ILE 131 1HD1 ILE 131 9.061 8.083 -12.875 1029 2HD1 ILE 131 2HD1 ILE 131 7.933 7.023 -13.720 1030 3HD1 ILE 131 3HD1 ILE 131 7.324 8.280 -12.642 1031 H GLU 132 H GLU 132 4.507 11.682 -15.787 1032 HA GLU 132 HA GLU 132 1.937 10.457 -16.037 1033 1HB GLU 132 1HB GLU 132 3.005 12.939 -17.403 1034 2HB GLU 132 2HB GLU 132 1.316 12.474 -17.258 1035 1HG GLU 132 1HG GLU 132 1.457 12.702 -14.831 1036 2HG GLU 132 2HG GLU 132 3.149 13.168 -14.974 Start of MODEL 5 1 H VAL 1 H VAL 1 3.468 16.629 -7.931 2 HA VAL 1 HA VAL 1 4.651 14.989 -8.971 3 HB VAL 1 HB VAL 1 6.032 17.195 -10.528 4 1HG1 VAL 1 1HG1 VAL 1 5.890 14.227 -11.057 5 2HG1 VAL 1 2HG1 VAL 1 7.309 15.112 -10.500 6 3HG1 VAL 1 3HG1 VAL 1 6.646 15.431 -12.103 7 1HG2 VAL 1 1HG2 VAL 1 3.649 15.487 -11.248 8 2HG2 VAL 1 2HG2 VAL 1 4.491 16.568 -12.357 9 3HG2 VAL 1 3HG2 VAL 1 3.647 17.227 -10.956 10 H LYS 2 H LYS 2 6.620 13.887 -8.585 11 HA LYS 2 HA LYS 2 8.359 13.315 -7.229 12 1HB LYS 2 1HB LYS 2 8.970 16.266 -7.468 13 2HB LYS 2 2HB LYS 2 10.002 15.139 -6.603 14 1HG LYS 2 1HG LYS 2 10.525 13.965 -8.609 15 2HG LYS 2 2HG LYS 2 9.302 14.859 -9.517 16 1HD LYS 2 1HD LYS 2 10.531 16.884 -9.350 17 2HD LYS 2 2HD LYS 2 11.630 16.202 -8.153 18 1HE LYS 2 1HE LYS 2 12.636 16.404 -10.405 19 2HE LYS 2 2HE LYS 2 12.601 14.746 -9.806 20 1HZ LYS 2 1HZ LYS 2 11.923 15.108 -12.189 21 2HZ LYS 2 2HZ LYS 2 10.500 15.821 -11.598 22 3HZ LYS 2 3HZ LYS 2 10.854 14.198 -11.236 23 H PHE 3 H PHE 3 6.716 12.799 -5.638 24 HA PHE 3 HA PHE 3 6.291 14.850 -3.592 25 1HB PHE 3 1HB PHE 3 4.911 12.190 -3.916 26 2HB PHE 3 2HB PHE 3 4.482 13.442 -2.765 27 HD1 PHE 3 HD1 PHE 3 3.325 15.444 -3.470 28 HD2 PHE 3 HD2 PHE 3 4.342 12.402 -6.264 29 HE1 PHE 3 HE1 PHE 3 1.769 16.426 -5.100 30 HE2 PHE 3 HE2 PHE 3 2.788 13.383 -7.903 31 HZ PHE 3 HZ PHE 3 1.501 15.399 -7.321 32 H ALA 4 H ALA 4 6.976 14.640 -1.566 33 HA ALA 4 HA ALA 4 8.643 12.310 -0.922 34 1HB ALA 4 1HB ALA 4 9.847 14.446 -0.938 35 2HB ALA 4 2HB ALA 4 9.794 13.753 0.683 36 3HB ALA 4 3HB ALA 4 8.722 15.087 0.259 37 H CYS 5 H CYS 5 7.604 10.897 0.292 38 HA CYS 5 HA CYS 5 5.662 11.897 2.256 39 1HB CYS 5 1HB CYS 5 5.549 9.329 0.668 40 2HB CYS 5 2HB CYS 5 4.330 9.910 1.802 41 HG CYS 5 HG CYS 5 4.482 12.402 -0.040 42 H ARG 6 H ARG 6 5.153 9.728 3.743 43 HA ARG 6 HA ARG 6 7.686 9.599 5.177 44 1HB ARG 6 1HB ARG 6 5.587 10.376 6.289 45 2HB ARG 6 2HB ARG 6 4.929 8.758 6.095 46 1HG ARG 6 1HG ARG 6 5.777 9.091 8.343 47 2HG ARG 6 2HG ARG 6 6.728 7.867 7.496 48 1HD ARG 6 1HD ARG 6 8.454 9.490 7.021 49 2HD ARG 6 2HD ARG 6 7.492 10.770 7.756 50 HE ARG 6 HE ARG 6 8.091 8.569 9.519 51 1HH1 ARG 6 1HH1 ARG 6 9.200 11.628 8.237 52 2HH1 ARG 6 2HH1 ARG 6 10.188 11.998 9.618 53 1HH2 ARG 6 1HH2 ARG 6 9.398 9.025 11.328 54 2HH2 ARG 6 2HH2 ARG 6 10.292 10.516 11.394 55 H ALA 7 H ALA 7 8.918 7.897 5.087 56 HA ALA 7 HA ALA 7 7.883 5.395 3.996 57 1HB ALA 7 1HB ALA 7 9.905 6.325 2.998 58 2HB ALA 7 2HB ALA 7 10.233 4.764 3.751 59 3HB ALA 7 3HB ALA 7 10.720 6.254 4.560 60 H ILE 8 H ILE 8 7.825 3.504 5.076 61 HA ILE 8 HA ILE 8 8.635 3.547 7.911 62 HB ILE 8 HB ILE 8 6.439 1.939 6.582 63 1HG1 ILE 8 1HG1 ILE 8 5.072 3.127 8.436 64 2HG1 ILE 8 2HG1 ILE 8 6.432 4.236 8.538 65 1HG2 ILE 8 1HG2 ILE 8 5.970 1.005 8.785 66 2HG2 ILE 8 2HG2 ILE 8 7.376 1.841 9.441 67 3HG2 ILE 8 3HG2 ILE 8 7.586 0.575 8.230 68 1HD1 ILE 8 1HD1 ILE 8 4.760 3.709 6.094 69 2HD1 ILE 8 2HD1 ILE 8 6.123 4.825 6.190 70 3HD1 ILE 8 3HD1 ILE 8 4.666 5.127 7.138 71 H THR 9 H THR 9 8.380 1.530 5.022 72 HA THR 9 HA THR 9 10.507 -0.212 6.070 73 HB THR 9 HB THR 9 8.723 -0.861 3.730 74 HG1 THR 9 HG1 THR 9 7.439 -1.992 5.392 75 1HG2 THR 9 1HG2 THR 9 10.473 -2.429 3.885 76 2HG2 THR 9 2HG2 THR 9 9.112 -3.208 4.687 77 3HG2 THR 9 3HG2 THR 9 10.394 -2.469 5.646 78 H ARG 10 H ARG 10 11.704 -1.213 3.973 79 HA ARG 10 HA ARG 10 12.724 1.148 2.539 80 1HB ARG 10 1HB ARG 10 14.213 -1.389 3.226 81 2HB ARG 10 2HB ARG 10 14.895 0.080 2.537 82 1HG ARG 10 1HG ARG 10 14.519 1.291 4.545 83 2HG ARG 10 2HG ARG 10 13.564 -0.025 5.228 84 1HD ARG 10 1HD ARG 10 15.635 -1.451 5.074 85 2HD ARG 10 2HD ARG 10 16.523 0.027 4.686 86 HE ARG 10 HE ARG 10 15.191 0.666 6.961 87 1HH1 ARG 10 1HH1 ARG 10 17.337 -1.958 6.074 88 2HH1 ARG 10 2HH1 ARG 10 17.914 -2.201 7.691 89 1HH2 ARG 10 1HH2 ARG 10 15.956 0.367 9.085 90 2HH2 ARG 10 2HH2 ARG 10 17.147 -0.864 9.402 91 H GLY 11 H GLY 11 14.167 0.187 0.564 92 1HA GLY 11 1HA GLY 11 14.147 -1.391 -1.257 93 2HA GLY 11 2HA GLY 11 12.458 -1.720 -0.895 94 H ARG 12 H ARG 12 13.029 -1.218 -3.451 95 HA ARG 12 HA ARG 12 11.596 1.266 -3.879 96 1HB ARG 12 1HB ARG 12 13.227 1.982 -5.661 97 2HB ARG 12 2HB ARG 12 13.821 2.113 -4.012 98 1HG ARG 12 1HG ARG 12 14.754 -0.303 -4.550 99 2HG ARG 12 2HG ARG 12 14.667 0.311 -6.202 100 1HD ARG 12 1HD ARG 12 16.086 1.672 -3.915 101 2HD ARG 12 2HD ARG 12 16.870 0.687 -5.147 102 HE ARG 12 HE ARG 12 15.686 2.493 -6.678 103 1HH1 ARG 12 1HH1 ARG 12 17.428 2.957 -3.668 104 2HH1 ARG 12 2HH1 ARG 12 18.018 4.528 -4.102 105 1HH2 ARG 12 1HH2 ARG 12 16.475 4.563 -7.250 106 2HH2 ARG 12 2HH2 ARG 12 17.472 5.438 -6.125 107 H ALA 13 H ALA 13 10.002 0.877 -5.243 108 HA ALA 13 HA ALA 13 10.302 -1.359 -7.141 109 1HB ALA 13 1HB ALA 13 7.989 -1.997 -6.698 110 2HB ALA 13 2HB ALA 13 7.861 -0.715 -5.495 111 3HB ALA 13 3HB ALA 13 8.964 -2.067 -5.229 112 H GLU 14 H GLU 14 9.463 -1.092 -9.145 113 HA GLU 14 HA GLU 14 8.170 1.487 -9.732 114 1HB GLU 14 1HB GLU 14 9.407 1.552 -11.843 115 2HB GLU 14 2HB GLU 14 10.507 1.495 -10.477 116 1HG GLU 14 1HG GLU 14 9.752 -0.903 -12.139 117 2HG GLU 14 2HG GLU 14 11.176 0.092 -12.425 118 H GLY 15 H GLY 15 6.185 1.266 -10.650 119 1HA GLY 15 1HA GLY 15 5.770 -0.514 -12.836 120 2HA GLY 15 2HA GLY 15 5.027 -1.150 -11.378 121 H GLU 16 H GLU 16 3.045 -0.971 -12.584 122 HA GLU 16 HA GLU 16 1.983 1.557 -13.339 123 1HB GLU 16 1HB GLU 16 0.780 -1.185 -12.979 124 2HB GLU 16 2HB GLU 16 -0.139 0.203 -13.520 125 1HG GLU 16 1HG GLU 16 1.189 0.396 -15.501 126 2HG GLU 16 2HG GLU 16 2.290 -0.859 -14.931 127 H ALA 17 H ALA 17 0.886 2.975 -12.148 128 HA ALA 17 HA ALA 17 0.441 2.443 -9.337 129 1HB ALA 17 1HB ALA 17 1.312 4.616 -10.047 130 2HB ALA 17 2HB ALA 17 -0.237 4.789 -9.220 131 3HB ALA 17 3HB ALA 17 -0.157 4.903 -10.978 132 H LEU 18 H LEU 18 -1.406 1.814 -8.460 133 HA LEU 18 HA LEU 18 -3.882 2.089 -10.030 134 1HB LEU 18 1HB LEU 18 -2.899 -0.264 -9.555 135 2HB LEU 18 2HB LEU 18 -3.440 0.002 -7.911 136 HG LEU 18 HG LEU 18 -5.315 0.168 -10.261 137 1HD1 LEU 18 1HD1 LEU 18 -5.969 -2.133 -9.740 138 2HD1 LEU 18 2HD1 LEU 18 -4.671 -2.232 -8.552 139 3HD1 LEU 18 3HD1 LEU 18 -4.287 -2.039 -10.262 140 1HD2 LEU 18 1HD2 LEU 18 -6.093 1.194 -8.183 141 2HD2 LEU 18 2HD2 LEU 18 -5.782 -0.313 -7.319 142 3HD2 LEU 18 3HD2 LEU 18 -7.024 -0.253 -8.571 143 H VAL 19 H VAL 19 -5.201 3.553 -9.165 144 HA VAL 19 HA VAL 19 -4.776 4.275 -6.342 145 HB VAL 19 HB VAL 19 -6.072 5.927 -8.515 146 1HG1 VAL 19 1HG1 VAL 19 -5.789 7.789 -6.936 147 2HG1 VAL 19 2HG1 VAL 19 -5.169 6.661 -5.730 148 3HG1 VAL 19 3HG1 VAL 19 -6.838 6.529 -6.285 149 1HG2 VAL 19 1HG2 VAL 19 -3.991 7.237 -8.496 150 2HG2 VAL 19 2HG2 VAL 19 -3.731 5.576 -9.026 151 3HG2 VAL 19 3HG2 VAL 19 -3.277 6.060 -7.392 152 H THR 20 H THR 20 -6.320 3.843 -4.914 153 HA THR 20 HA THR 20 -9.097 3.642 -5.870 154 HB THR 20 HB THR 20 -7.879 1.863 -3.745 155 HG1 THR 20 HG1 THR 20 -7.554 1.663 -6.304 156 1HG2 THR 20 1HG2 THR 20 -10.578 1.794 -5.106 157 2HG2 THR 20 2HG2 THR 20 -10.274 2.284 -3.439 158 3HG2 THR 20 3HG2 THR 20 -9.985 0.616 -3.938 159 H LYS 21 H LYS 21 -9.703 5.650 -5.145 160 HA LYS 21 HA LYS 21 -9.098 6.448 -2.431 161 1HB LYS 21 1HB LYS 21 -9.137 8.097 -4.304 162 2HB LYS 21 2HB LYS 21 -10.870 7.831 -4.453 163 1HG LYS 21 1HG LYS 21 -11.195 8.652 -2.179 164 2HG LYS 21 2HG LYS 21 -9.457 8.917 -2.024 165 1HD LYS 21 1HD LYS 21 -9.546 10.519 -3.879 166 2HD LYS 21 2HD LYS 21 -11.287 10.260 -4.011 167 1HE LYS 21 1HE LYS 21 -11.571 11.069 -1.718 168 2HE LYS 21 2HE LYS 21 -9.837 11.349 -1.601 169 1HZ LYS 21 1HZ LYS 21 -10.019 12.965 -3.394 170 2HZ LYS 21 2HZ LYS 21 -11.017 13.384 -2.087 171 3HZ LYS 21 3HZ LYS 21 -11.694 12.698 -3.487 172 H GLU 22 H GLU 22 -10.126 4.777 -1.321 173 HA GLU 22 HA GLU 22 -12.859 5.329 -0.640 174 1HB GLU 22 1HB GLU 22 -13.121 3.882 -2.645 175 2HB GLU 22 2HB GLU 22 -12.143 2.657 -1.863 176 1HG GLU 22 1HG GLU 22 -14.583 2.219 -1.818 177 2HG GLU 22 2HG GLU 22 -13.811 2.226 -0.237 178 H TYR 23 H TYR 23 -13.521 3.969 1.210 179 HA TYR 23 HA TYR 23 -11.169 3.276 2.831 180 1HB TYR 23 1HB TYR 23 -14.003 3.898 3.705 181 2HB TYR 23 2HB TYR 23 -12.652 3.543 4.779 182 HD1 TYR 23 HD1 TYR 23 -14.193 6.048 2.615 183 HD2 TYR 23 HD2 TYR 23 -10.846 5.174 5.090 184 HE1 TYR 23 HE1 TYR 23 -13.591 8.430 2.634 185 HE2 TYR 23 HE2 TYR 23 -10.237 7.556 5.119 186 HH TYR 23 HH TYR 23 -10.584 9.562 3.765 187 H ILE 24 H ILE 24 -10.803 1.226 2.144 188 HA ILE 24 HA ILE 24 -13.036 -0.688 2.246 189 HB ILE 24 HB ILE 24 -11.683 -2.096 0.724 190 1HG1 ILE 24 1HG1 ILE 24 -9.884 0.333 0.563 191 2HG1 ILE 24 2HG1 ILE 24 -9.467 -1.191 1.339 192 1HG2 ILE 24 1HG2 ILE 24 -12.247 0.685 -0.293 193 2HG2 ILE 24 2HG2 ILE 24 -13.413 -0.631 -0.158 194 3HG2 ILE 24 3HG2 ILE 24 -12.065 -0.760 -1.287 195 1HD1 ILE 24 1HD1 ILE 24 -8.447 -1.018 -0.851 196 2HD1 ILE 24 2HD1 ILE 24 -10.033 -0.787 -1.592 197 3HD1 ILE 24 3HD1 ILE 24 -9.632 -2.325 -0.823 198 H SER 25 H SER 25 -12.248 -2.981 2.586 199 HA SER 25 HA SER 25 -10.786 -2.937 5.104 200 1HB SER 25 1HB SER 25 -12.033 -5.451 4.232 201 2HB SER 25 2HB SER 25 -12.180 -4.579 5.752 202 HG SER 25 HG SER 25 -13.573 -4.127 3.335 203 H PHE 26 H PHE 26 -8.761 -3.627 5.214 204 HA PHE 26 HA PHE 26 -7.458 -4.739 2.897 205 1HB PHE 26 1HB PHE 26 -6.428 -3.048 4.485 206 2HB PHE 26 2HB PHE 26 -6.303 -4.343 5.667 207 HD1 PHE 26 HD1 PHE 26 -4.377 -5.614 5.751 208 HD2 PHE 26 HD2 PHE 26 -5.325 -3.500 2.179 209 HE1 PHE 26 HE1 PHE 26 -2.209 -6.266 4.789 210 HE2 PHE 26 HE2 PHE 26 -3.159 -4.152 1.215 211 HZ PHE 26 HZ PHE 26 -1.597 -5.538 2.521 212 H LEU 27 H LEU 27 -9.295 -6.019 5.309 213 HA LEU 27 HA LEU 27 -7.831 -8.393 5.892 214 1HB LEU 27 1HB LEU 27 -9.985 -9.182 6.868 215 2HB LEU 27 2HB LEU 27 -9.412 -7.656 7.505 216 HG LEU 27 HG LEU 27 -11.051 -6.601 5.767 217 1HD1 LEU 27 1HD1 LEU 27 -13.040 -7.968 5.359 218 2HD1 LEU 27 2HD1 LEU 27 -12.223 -9.361 6.069 219 3HD1 LEU 27 3HD1 LEU 27 -11.609 -8.644 4.580 220 1HD2 LEU 27 1HD2 LEU 27 -12.837 -6.657 7.425 221 2HD2 LEU 27 2HD2 LEU 27 -11.266 -6.422 8.192 222 3HD2 LEU 27 3HD2 LEU 27 -12.047 -8.003 8.242 223 H GLY 28 H GLY 28 -9.670 -7.371 3.245 224 1HA GLY 28 1HA GLY 28 -9.390 -10.007 2.033 225 2HA GLY 28 2HA GLY 28 -11.017 -9.344 2.122 226 H GLY 29 H GLY 29 -7.925 -7.739 1.490 227 1HA GLY 29 1HA GLY 29 -9.062 -6.250 -0.680 228 2HA GLY 29 2HA GLY 29 -7.384 -6.215 -0.160 229 H ILE 30 H ILE 30 -5.956 -7.825 -0.939 230 HA ILE 30 HA ILE 30 -6.642 -8.768 -3.601 231 HB ILE 30 HB ILE 30 -3.989 -8.752 -2.132 232 1HG1 ILE 30 1HG1 ILE 30 -3.473 -7.036 -4.001 233 2HG1 ILE 30 2HG1 ILE 30 -5.217 -6.891 -4.154 234 1HG2 ILE 30 1HG2 ILE 30 -4.100 -10.556 -3.763 235 2HG2 ILE 30 2HG2 ILE 30 -2.978 -9.300 -4.283 236 3HG2 ILE 30 3HG2 ILE 30 -4.580 -9.407 -5.013 237 1HD1 ILE 30 1HD1 ILE 30 -4.345 -5.137 -2.757 238 2HD1 ILE 30 2HD1 ILE 30 -3.580 -6.321 -1.696 239 3HD1 ILE 30 3HD1 ILE 30 -5.338 -6.231 -1.794 240 H ASP 31 H ASP 31 -6.863 -10.915 -4.124 241 HA ASP 31 HA ASP 31 -7.236 -12.863 -2.135 242 1HB ASP 31 1HB ASP 31 -8.234 -13.099 -4.357 243 2HB ASP 31 2HB ASP 31 -6.632 -13.263 -5.074 244 H LYS 32 H LYS 32 -5.964 -14.490 -1.366 245 HA LYS 32 HA LYS 32 -3.229 -13.735 -1.084 246 1HB LYS 32 1HB LYS 32 -3.150 -15.667 0.488 247 2HB LYS 32 2HB LYS 32 -4.432 -14.516 0.834 248 1HG LYS 32 1HG LYS 32 -5.985 -16.059 -0.439 249 2HG LYS 32 2HG LYS 32 -4.676 -17.242 -0.404 250 1HD LYS 32 1HD LYS 32 -4.659 -17.191 2.020 251 2HD LYS 32 2HD LYS 32 -5.900 -15.940 2.025 252 1HE LYS 32 1HE LYS 32 -6.977 -18.006 2.497 253 2HE LYS 32 2HE LYS 32 -7.411 -17.559 0.849 254 1HZ LYS 32 1HZ LYS 32 -6.826 -19.926 1.124 255 2HZ LYS 32 2HZ LYS 32 -5.249 -19.471 1.550 256 3HZ LYS 32 3HZ LYS 32 -5.841 -19.133 -0.008 257 H GLU 33 H GLU 33 -4.720 -15.629 -3.423 258 HA GLU 33 HA GLU 33 -2.253 -17.183 -3.798 259 1HB GLU 33 1HB GLU 33 -5.105 -18.114 -4.051 260 2HB GLU 33 2HB GLU 33 -3.726 -19.026 -4.647 261 1HG GLU 33 1HG GLU 33 -2.853 -19.312 -2.466 262 2HG GLU 33 2HG GLU 33 -3.970 -18.127 -1.797 263 H THR 34 H THR 34 -5.130 -15.838 -5.450 264 HA THR 34 HA THR 34 -3.754 -16.229 -8.008 265 HB THR 34 HB THR 34 -5.917 -15.529 -9.035 266 HG1 THR 34 HG1 THR 34 -7.744 -15.573 -7.513 267 1HG2 THR 34 1HG2 THR 34 -7.104 -17.593 -8.499 268 2HG2 THR 34 2HG2 THR 34 -6.104 -17.810 -7.063 269 3HG2 THR 34 3HG2 THR 34 -5.375 -17.895 -8.667 270 H GLY 35 H GLY 35 -4.393 -13.754 -5.736 271 1HA GLY 35 1HA GLY 35 -3.514 -11.612 -5.701 272 2HA GLY 35 2HA GLY 35 -2.884 -11.882 -7.318 273 H ILE 36 H ILE 36 -6.201 -12.545 -6.941 274 HA ILE 36 HA ILE 36 -6.899 -10.191 -8.511 275 HB ILE 36 HB ILE 36 -8.654 -12.493 -7.622 276 1HG1 ILE 36 1HG1 ILE 36 -6.790 -13.218 -9.099 277 2HG1 ILE 36 2HG1 ILE 36 -8.369 -13.412 -9.853 278 1HG2 ILE 36 1HG2 ILE 36 -9.104 -10.377 -9.721 279 2HG2 ILE 36 2HG2 ILE 36 -9.898 -10.467 -8.150 280 3HG2 ILE 36 3HG2 ILE 36 -10.190 -11.719 -9.356 281 1HD1 ILE 36 1HD1 ILE 36 -6.466 -11.140 -10.369 282 2HD1 ILE 36 2HD1 ILE 36 -8.015 -11.411 -11.169 283 3HD1 ILE 36 3HD1 ILE 36 -6.688 -12.550 -11.404 284 H VAL 37 H VAL 37 -7.989 -8.469 -7.706 285 HA VAL 37 HA VAL 37 -8.212 -8.061 -4.923 286 HB VAL 37 HB VAL 37 -9.679 -6.558 -7.106 287 1HG1 VAL 37 1HG1 VAL 37 -8.908 -5.776 -4.298 288 2HG1 VAL 37 2HG1 VAL 37 -10.542 -6.047 -4.909 289 3HG1 VAL 37 3HG1 VAL 37 -9.592 -4.683 -5.500 290 1HG2 VAL 37 1HG2 VAL 37 -6.935 -6.079 -5.953 291 2HG2 VAL 37 2HG2 VAL 37 -7.777 -5.014 -7.079 292 3HG2 VAL 37 3HG2 VAL 37 -7.299 -6.633 -7.589 293 H LYS 38 H LYS 38 -9.672 -8.746 -3.537 294 HA LYS 38 HA LYS 38 -12.101 -10.055 -4.454 295 1HB LYS 38 1HB LYS 38 -10.788 -9.773 -1.752 296 2HB LYS 38 2HB LYS 38 -12.355 -10.536 -1.967 297 1HG LYS 38 1HG LYS 38 -9.870 -11.457 -3.382 298 2HG LYS 38 2HG LYS 38 -10.389 -12.087 -1.817 299 1HD LYS 38 1HD LYS 38 -12.541 -12.746 -2.836 300 2HD LYS 38 2HD LYS 38 -11.943 -12.194 -4.402 301 1HE LYS 38 1HE LYS 38 -11.685 -14.593 -4.217 302 2HE LYS 38 2HE LYS 38 -10.105 -13.816 -4.252 303 1HZ LYS 38 1HZ LYS 38 -11.509 -14.904 -1.869 304 2HZ LYS 38 2HZ LYS 38 -10.086 -13.993 -1.787 305 3HZ LYS 38 3HZ LYS 38 -10.085 -15.490 -2.579 306 H GLU 39 H GLU 39 -11.190 -7.368 -2.328 307 HA GLU 39 HA GLU 39 -13.797 -6.565 -1.643 308 1HB GLU 39 1HB GLU 39 -11.659 -5.842 -0.520 309 2HB GLU 39 2HB GLU 39 -11.366 -4.780 -1.888 310 1HG GLU 39 1HG GLU 39 -12.289 -3.411 -0.236 311 2HG GLU 39 2HG GLU 39 -13.607 -3.721 -1.364 312 H ASP 40 H ASP 40 -15.260 -5.238 -2.653 313 HA ASP 40 HA ASP 40 -14.695 -4.774 -5.478 314 1HB ASP 40 1HB ASP 40 -16.767 -6.001 -4.732 315 2HB ASP 40 2HB ASP 40 -17.351 -4.479 -4.071 316 H CYS 41 H CYS 41 -15.542 -2.841 -6.490 317 HA CYS 41 HA CYS 41 -16.007 -0.397 -5.224 318 1HB CYS 41 1HB CYS 41 -13.690 -0.671 -4.365 319 2HB CYS 41 2HB CYS 41 -13.106 -0.803 -6.018 320 HG CYS 41 HG CYS 41 -13.302 1.846 -4.241 321 H GLU 42 H GLU 42 -14.083 -1.854 -7.797 322 HA GLU 42 HA GLU 42 -15.895 -1.531 -9.855 323 1HB GLU 42 1HB GLU 42 -15.482 0.910 -9.599 324 2HB GLU 42 2HB GLU 42 -13.777 0.631 -9.933 325 1HG GLU 42 1HG GLU 42 -14.332 -0.199 -12.152 326 2HG GLU 42 2HG GLU 42 -16.046 0.035 -11.819 327 H ILE 43 H ILE 43 -12.460 -1.315 -9.077 328 HA ILE 43 HA ILE 43 -11.674 -2.671 -11.487 329 HB ILE 43 HB ILE 43 -9.360 -2.617 -10.408 330 1HG1 ILE 43 1HG1 ILE 43 -9.141 -0.786 -8.656 331 2HG1 ILE 43 2HG1 ILE 43 -10.873 -0.923 -8.409 332 1HG2 ILE 43 1HG2 ILE 43 -10.832 -0.051 -10.951 333 2HG2 ILE 43 2HG2 ILE 43 -10.042 -1.086 -12.139 334 3HG2 ILE 43 3HG2 ILE 43 -9.079 -0.233 -10.933 335 1HD1 ILE 43 1HD1 ILE 43 -10.562 -3.280 -7.766 336 2HD1 ILE 43 2HD1 ILE 43 -9.694 -2.156 -6.720 337 3HD1 ILE 43 3HD1 ILE 43 -8.820 -3.071 -7.948 338 H LYS 44 H LYS 44 -13.278 -3.949 -9.153 339 HA LYS 44 HA LYS 44 -11.680 -6.068 -8.173 340 1HB LYS 44 1HB LYS 44 -13.793 -5.333 -7.119 341 2HB LYS 44 2HB LYS 44 -14.688 -5.956 -8.493 342 1HG LYS 44 1HG LYS 44 -12.902 -7.769 -6.927 343 2HG LYS 44 2HG LYS 44 -14.495 -7.344 -6.303 344 1HD LYS 44 1HD LYS 44 -14.009 -8.532 -9.033 345 2HD LYS 44 2HD LYS 44 -14.429 -9.476 -7.603 346 1HE LYS 44 1HE LYS 44 -16.517 -8.222 -7.388 347 2HE LYS 44 2HE LYS 44 -16.092 -7.269 -8.810 348 1HZ LYS 44 1HZ LYS 44 -16.358 -10.223 -8.884 349 2HZ LYS 44 2HZ LYS 44 -16.291 -9.148 -10.194 350 3HZ LYS 44 3HZ LYS 44 -17.656 -9.176 -9.193 351 H GLY 45 H GLY 45 -11.107 -7.915 -9.070 352 1HA GLY 45 1HA GLY 45 -11.665 -9.785 -10.567 353 2HA GLY 45 2HA GLY 45 -12.271 -8.585 -11.701 354 H GLU 46 H GLU 46 -9.923 -6.826 -10.936 355 HA GLU 46 HA GLU 46 -8.072 -7.976 -12.852 356 1HB GLU 46 1HB GLU 46 -8.110 -5.297 -11.455 357 2HB GLU 46 2HB GLU 46 -6.874 -5.787 -12.604 358 1HG GLU 46 1HG GLU 46 -8.614 -6.043 -14.326 359 2HG GLU 46 2HG GLU 46 -9.811 -5.471 -13.168 360 H SER 47 H SER 47 -5.798 -8.131 -12.423 361 HA SER 47 HA SER 47 -5.265 -8.928 -9.654 362 1HB SER 47 1HB SER 47 -3.266 -10.092 -10.736 363 2HB SER 47 2HB SER 47 -4.858 -10.726 -11.158 364 HG SER 47 HG SER 47 -3.186 -9.030 -12.699 365 H VAL 48 H VAL 48 -3.522 -8.117 -8.510 366 HA VAL 48 HA VAL 48 -2.443 -5.616 -9.393 367 HB VAL 48 HB VAL 48 -0.874 -6.104 -7.281 368 1HG1 VAL 48 1HG1 VAL 48 -2.456 -4.258 -7.527 369 2HG1 VAL 48 2HG1 VAL 48 -2.547 -4.968 -5.915 370 3HG1 VAL 48 3HG1 VAL 48 -3.787 -5.340 -7.114 371 1HG2 VAL 48 1HG2 VAL 48 -1.712 -8.407 -6.968 372 2HG2 VAL 48 2HG2 VAL 48 -3.334 -7.765 -6.728 373 3HG2 VAL 48 3HG2 VAL 48 -2.055 -7.376 -5.581 374 H ALA 49 H ALA 49 -0.503 -8.349 -8.195 375 HA ALA 49 HA ALA 49 1.477 -9.221 -8.874 376 1HB ALA 49 1HB ALA 49 0.154 -9.056 -11.574 377 2HB ALA 49 2HB ALA 49 -0.132 -10.313 -10.369 378 3HB ALA 49 3HB ALA 49 1.462 -10.143 -11.105 379 H GLY 50 H GLY 50 2.730 -7.335 -8.333 380 1HA GLY 50 1HA GLY 50 4.653 -6.178 -8.956 381 2HA GLY 50 2HA GLY 50 4.257 -6.475 -10.640 382 H ARG 51 H ARG 51 1.537 -5.234 -9.201 383 HA ARG 51 HA ARG 51 2.139 -2.577 -10.249 384 1HB ARG 51 1HB ARG 51 -0.412 -3.999 -9.573 385 2HB ARG 51 2HB ARG 51 -0.388 -2.246 -9.727 386 1HG ARG 51 1HG ARG 51 0.464 -2.458 -12.004 387 2HG ARG 51 2HG ARG 51 0.445 -4.213 -11.847 388 1HD ARG 51 1HD ARG 51 -1.936 -4.239 -11.643 389 2HD ARG 51 2HD ARG 51 -1.997 -2.480 -11.533 390 HE ARG 51 HE ARG 51 -1.129 -2.502 -13.890 391 1HH1 ARG 51 1HH1 ARG 51 -2.990 -5.199 -12.622 392 2HH1 ARG 51 2HH1 ARG 51 -3.564 -5.691 -14.187 393 1HH2 ARG 51 1HH2 ARG 51 -1.868 -3.149 -15.920 394 2HH2 ARG 51 2HH2 ARG 51 -2.905 -4.540 -16.066 395 H ILE 52 H ILE 52 1.338 -0.680 -9.042 396 HA ILE 52 HA ILE 52 1.979 -0.993 -6.185 397 HB ILE 52 HB ILE 52 2.209 1.406 -8.018 398 1HG1 ILE 52 1HG1 ILE 52 4.602 1.347 -7.148 399 2HG1 ILE 52 2HG1 ILE 52 4.223 -0.224 -6.460 400 1HG2 ILE 52 1HG2 ILE 52 1.305 2.164 -5.898 401 2HG2 ILE 52 2HG2 ILE 52 2.981 2.685 -6.069 402 3HG2 ILE 52 3HG2 ILE 52 2.584 1.318 -5.027 403 1HD1 ILE 52 1HD1 ILE 52 5.381 -0.470 -8.554 404 2HD1 ILE 52 2HD1 ILE 52 4.157 0.502 -9.373 405 3HD1 ILE 52 3HD1 ILE 52 3.729 -1.072 -8.700 406 H LEU 53 H LEU 53 0.341 -0.814 -4.798 407 HA LEU 53 HA LEU 53 -2.197 0.266 -5.800 408 1HB LEU 53 1HB LEU 53 -2.207 -2.029 -4.910 409 2HB LEU 53 2HB LEU 53 -1.626 -1.433 -3.368 410 HG LEU 53 HG LEU 53 -3.719 -0.160 -3.080 411 1HD1 LEU 53 1HD1 LEU 53 -4.270 0.208 -5.414 412 2HD1 LEU 53 2HD1 LEU 53 -5.605 -0.593 -4.585 413 3HD1 LEU 53 3HD1 LEU 53 -4.539 -1.520 -5.642 414 1HD2 LEU 53 1HD2 LEU 53 -4.089 -3.099 -3.651 415 2HD2 LEU 53 2HD2 LEU 53 -5.181 -2.095 -2.697 416 3HD2 LEU 53 3HD2 LEU 53 -3.536 -2.390 -2.135 417 H VAL 54 H VAL 54 -3.069 2.083 -5.004 418 HA VAL 54 HA VAL 54 -1.943 3.190 -2.512 419 HB VAL 54 HB VAL 54 -2.749 4.793 -4.950 420 1HG1 VAL 54 1HG1 VAL 54 -1.494 5.692 -2.357 421 2HG1 VAL 54 2HG1 VAL 54 -3.173 5.952 -2.832 422 3HG1 VAL 54 3HG1 VAL 54 -1.869 6.715 -3.742 423 1HG2 VAL 54 1HG2 VAL 54 0.003 4.259 -3.822 424 2HG2 VAL 54 2HG2 VAL 54 -0.367 5.332 -5.171 425 3HG2 VAL 54 3HG2 VAL 54 -0.648 3.599 -5.321 426 H PHE 55 H PHE 55 -3.569 2.876 -1.085 427 HA PHE 55 HA PHE 55 -6.028 4.346 -1.667 428 1HB PHE 55 1HB PHE 55 -7.461 2.690 -0.670 429 2HB PHE 55 2HB PHE 55 -6.521 1.917 -1.937 430 HD1 PHE 55 HD1 PHE 55 -4.671 0.381 -1.327 431 HD2 PHE 55 HD2 PHE 55 -7.326 2.001 1.573 432 HE1 PHE 55 HE1 PHE 55 -4.007 -1.378 0.260 433 HE2 PHE 55 HE2 PHE 55 -6.662 0.251 3.169 434 HZ PHE 55 HZ PHE 55 -5.000 -1.445 2.511 435 HA PRO 56 HA PRO 56 -5.161 6.529 2.018 436 1HB PRO 56 1HB PRO 56 -7.748 6.730 3.045 437 2HB PRO 56 2HB PRO 56 -7.006 7.835 1.888 438 1HG PRO 56 1HG PRO 56 -8.872 5.561 1.408 439 2HG PRO 56 2HG PRO 56 -8.770 7.128 0.583 440 1HD PRO 56 1HD PRO 56 -7.833 4.880 -0.546 441 2HD PRO 56 2HD PRO 56 -7.009 6.440 -0.762 442 H GLY 57 H GLY 57 -7.735 4.124 2.660 443 1HA GLY 57 1HA GLY 57 -6.381 2.419 4.308 444 2HA GLY 57 2HA GLY 57 -6.855 3.745 5.363 445 H GLY 58 H GLY 58 -8.113 2.070 6.492 446 1HA GLY 58 1HA GLY 58 -10.805 2.244 6.165 447 2HA GLY 58 2HA GLY 58 -10.370 0.905 5.114 448 H LYS 59 H LYS 59 -9.997 -1.065 5.980 449 HA LYS 59 HA LYS 59 -9.912 -1.244 8.921 450 1HB LYS 59 1HB LYS 59 -11.560 -2.850 6.989 451 2HB LYS 59 2HB LYS 59 -11.112 -3.511 8.551 452 1HG LYS 59 1HG LYS 59 -13.269 -2.631 8.818 453 2HG LYS 59 2HG LYS 59 -12.186 -1.470 9.582 454 1HD LYS 59 1HD LYS 59 -12.301 -0.043 7.613 455 2HD LYS 59 2HD LYS 59 -13.339 -1.222 6.805 456 1HE LYS 59 1HE LYS 59 -15.050 -0.905 8.506 457 2HE LYS 59 2HE LYS 59 -14.007 0.228 9.366 458 1HZ LYS 59 1HZ LYS 59 -14.119 1.742 7.531 459 2HZ LYS 59 2HZ LYS 59 -15.701 1.316 7.973 460 3HZ LYS 59 3HZ LYS 59 -14.993 0.629 6.591 461 H GLY 60 H GLY 60 -7.755 -1.639 9.160 462 1HA GLY 60 1HA GLY 60 -6.516 -3.802 7.616 463 2HA GLY 60 2HA GLY 60 -5.698 -2.720 8.736 464 H SER 61 H SER 61 -8.008 -5.399 8.596 465 HA SER 61 HA SER 61 -7.905 -5.782 11.444 466 1HB SER 61 1HB SER 61 -9.962 -6.097 10.004 467 2HB SER 61 2HB SER 61 -9.216 -7.573 9.393 468 HG SER 61 HG SER 61 -9.723 -8.565 11.177 469 H THR 62 H THR 62 -5.436 -6.101 11.121 470 HA THR 62 HA THR 62 -3.650 -7.427 11.517 471 HB THR 62 HB THR 62 -4.113 -9.599 12.733 472 HG1 THR 62 HG1 THR 62 -6.519 -9.287 11.735 473 1HG2 THR 62 1HG2 THR 62 -4.936 -8.440 14.750 474 2HG2 THR 62 2HG2 THR 62 -5.353 -7.045 13.752 475 3HG2 THR 62 3HG2 THR 62 -3.668 -7.536 13.922 476 H VAL 63 H VAL 63 -5.132 -7.911 8.839 477 HA VAL 63 HA VAL 63 -4.401 -10.664 8.294 478 HB VAL 63 HB VAL 63 -5.663 -8.552 6.539 479 1HG1 VAL 63 1HG1 VAL 63 -4.320 -10.053 5.152 480 2HG1 VAL 63 2HG1 VAL 63 -6.044 -10.322 4.895 481 3HG1 VAL 63 3HG1 VAL 63 -5.114 -11.446 5.886 482 1HG2 VAL 63 1HG2 VAL 63 -7.642 -9.996 6.729 483 2HG2 VAL 63 2HG2 VAL 63 -7.100 -9.409 8.300 484 3HG2 VAL 63 3HG2 VAL 63 -6.744 -11.066 7.810 485 H GLY 64 H GLY 64 -3.184 -7.454 7.598 486 1HA GLY 64 1HA GLY 64 -1.309 -8.359 5.607 487 2HA GLY 64 2HA GLY 64 -1.408 -6.743 6.288 488 H SER 65 H SER 65 -1.093 -9.642 8.226 489 HA SER 65 HA SER 65 1.338 -8.550 9.382 490 1HB SER 65 1HB SER 65 0.939 -10.506 11.008 491 2HB SER 65 2HB SER 65 -0.246 -9.197 11.007 492 HG SER 65 HG SER 65 -1.587 -10.818 10.734 493 H TYR 66 H TYR 66 0.327 -11.161 7.313 494 HA TYR 66 HA TYR 66 3.082 -11.882 6.851 495 1HB TYR 66 1HB TYR 66 2.854 -14.251 7.403 496 2HB TYR 66 2HB TYR 66 2.570 -13.250 8.821 497 HD1 TYR 66 HD1 TYR 66 1.189 -15.727 6.581 498 HD2 TYR 66 HD2 TYR 66 0.224 -12.932 9.641 499 HE1 TYR 66 HE1 TYR 66 -0.950 -16.879 6.953 500 HE2 TYR 66 HE2 TYR 66 -1.916 -14.077 10.017 501 HH TYR 66 HH TYR 66 -2.613 -17.133 8.832 502 H VAL 67 H VAL 67 -0.243 -11.955 5.960 503 HA VAL 67 HA VAL 67 -0.259 -13.923 3.985 504 HB VAL 67 HB VAL 67 -1.888 -11.379 4.093 505 1HG1 VAL 67 1HG1 VAL 67 -1.952 -12.365 1.865 506 2HG1 VAL 67 2HG1 VAL 67 -3.502 -12.567 2.684 507 3HG1 VAL 67 3HG1 VAL 67 -2.387 -13.927 2.558 508 1HG2 VAL 67 1HG2 VAL 67 -2.127 -12.735 6.095 509 2HG2 VAL 67 2HG2 VAL 67 -2.477 -14.154 5.108 510 3HG2 VAL 67 3HG2 VAL 67 -3.598 -12.793 5.126 511 H LEU 68 H LEU 68 0.862 -10.606 3.854 512 HA LEU 68 HA LEU 68 0.942 -10.298 1.069 513 1HB LEU 68 1HB LEU 68 2.424 -8.981 3.316 514 2HB LEU 68 2HB LEU 68 2.831 -8.615 1.653 515 HG LEU 68 HG LEU 68 0.462 -7.914 1.282 516 1HD1 LEU 68 1HD1 LEU 68 -0.951 -7.460 3.204 517 2HD1 LEU 68 2HD1 LEU 68 0.257 -8.176 4.273 518 3HD1 LEU 68 3HD1 LEU 68 -0.576 -9.180 3.086 519 1HD2 LEU 68 1HD2 LEU 68 1.988 -6.464 3.438 520 2HD2 LEU 68 2HD2 LEU 68 0.674 -5.782 2.481 521 3HD2 LEU 68 3HD2 LEU 68 2.178 -6.263 1.697 522 H LEU 69 H LEU 69 3.097 -11.947 3.253 523 HA LEU 69 HA LEU 69 5.308 -12.125 1.464 524 1HB LEU 69 1HB LEU 69 5.580 -12.438 3.870 525 2HB LEU 69 2HB LEU 69 4.532 -13.841 3.829 526 HG LEU 69 HG LEU 69 6.187 -15.033 2.444 527 1HD1 LEU 69 1HD1 LEU 69 7.865 -12.566 2.860 528 2HD1 LEU 69 2HD1 LEU 69 7.200 -13.133 1.328 529 3HD1 LEU 69 3HD1 LEU 69 8.427 -14.085 2.164 530 1HD2 LEU 69 1HD2 LEU 69 7.330 -13.877 4.984 531 2HD2 LEU 69 2HD2 LEU 69 7.850 -15.364 4.191 532 3HD2 LEU 69 3HD2 LEU 69 6.232 -15.254 4.880 533 H ASN 70 H ASN 70 2.506 -14.155 2.158 534 HA ASN 70 HA ASN 70 3.277 -16.350 0.540 535 1HB ASN 70 1HB ASN 70 1.454 -16.328 2.329 536 2HB ASN 70 2HB ASN 70 0.422 -15.561 1.124 537 1HD2 ASN 70 1HD2 ASN 70 -0.284 -16.766 -0.661 538 2HD2 ASN 70 2HD2 ASN 70 -0.153 -18.492 -0.705 539 H LEU 71 H LEU 71 1.600 -13.350 -0.076 540 HA LEU 71 HA LEU 71 0.678 -13.794 -2.668 541 1HB LEU 71 1HB LEU 71 1.800 -11.267 -1.452 542 2HB LEU 71 2HB LEU 71 0.918 -11.337 -2.964 543 HG LEU 71 HG LEU 71 -0.213 -12.061 -0.259 544 1HD1 LEU 71 1HD1 LEU 71 0.213 -9.671 -0.450 545 2HD1 LEU 71 2HD1 LEU 71 -1.519 -9.999 -0.519 546 3HD1 LEU 71 3HD1 LEU 71 -0.632 -9.631 -1.997 547 1HD2 LEU 71 1HD2 LEU 71 -1.518 -11.818 -2.966 548 2HD2 LEU 71 2HD2 LEU 71 -2.353 -12.107 -1.440 549 3HD2 LEU 71 3HD2 LEU 71 -1.238 -13.315 -2.076 550 H ARG 72 H ARG 72 3.885 -12.880 -1.488 551 HA ARG 72 HA ARG 72 4.985 -12.439 -4.080 552 1HB ARG 72 1HB ARG 72 5.888 -11.576 -1.835 553 2HB ARG 72 2HB ARG 72 6.600 -13.175 -1.652 554 1HG ARG 72 1HG ARG 72 7.786 -12.858 -3.797 555 2HG ARG 72 2HG ARG 72 7.137 -11.220 -3.879 556 1HD ARG 72 1HD ARG 72 9.308 -11.001 -3.006 557 2HD ARG 72 2HD ARG 72 8.223 -10.822 -1.630 558 HE ARG 72 HE ARG 72 9.102 -13.523 -1.954 559 1HH1 ARG 72 1HH1 ARG 72 10.031 -10.382 -0.728 560 2HH1 ARG 72 2HH1 ARG 72 11.182 -11.015 0.412 561 1HH2 ARG 72 1HH2 ARG 72 10.603 -14.375 -0.462 562 2HH2 ARG 72 2HH2 ARG 72 11.484 -13.297 0.585 563 H LYS 73 H LYS 73 4.724 -15.199 -1.951 564 HA LYS 73 HA LYS 73 6.469 -16.961 -3.282 565 1HB LYS 73 1HB LYS 73 3.921 -17.586 -1.768 566 2HB LYS 73 2HB LYS 73 5.168 -18.750 -2.186 567 1HG LYS 73 1HG LYS 73 5.683 -16.344 -0.463 568 2HG LYS 73 2HG LYS 73 5.187 -17.910 0.178 569 1HD LYS 73 1HD LYS 73 7.169 -18.941 -0.839 570 2HD LYS 73 2HD LYS 73 7.667 -17.361 -1.449 571 1HE LYS 73 1HE LYS 73 7.982 -16.523 0.760 572 2HE LYS 73 2HE LYS 73 7.220 -17.945 1.471 573 1HZ LYS 73 1HZ LYS 73 9.052 -19.291 0.699 574 2HZ LYS 73 2HZ LYS 73 9.635 -18.017 1.649 575 3HZ LYS 73 3HZ LYS 73 9.785 -17.952 -0.036 576 H ASN 74 H ASN 74 3.146 -16.030 -3.860 577 HA ASN 74 HA ASN 74 2.802 -17.939 -6.004 578 1HB ASN 74 1HB ASN 74 1.040 -15.802 -4.809 579 2HB ASN 74 2HB ASN 74 0.573 -16.746 -6.209 580 1HD2 ASN 74 1HD2 ASN 74 -0.560 -16.570 -3.492 581 2HD2 ASN 74 2HD2 ASN 74 -0.595 -18.194 -2.903 582 H GLY 75 H GLY 75 4.025 -14.802 -5.613 583 1HA GLY 75 1HA GLY 75 5.042 -13.456 -7.201 584 2HA GLY 75 2HA GLY 75 4.477 -14.557 -8.449 585 H VAL 76 H VAL 76 2.062 -13.489 -6.316 586 HA VAL 76 HA VAL 76 0.995 -11.764 -8.449 587 HB VAL 76 HB VAL 76 -1.232 -12.200 -7.458 588 1HG1 VAL 76 1HG1 VAL 76 -1.415 -14.542 -8.188 589 2HG1 VAL 76 2HG1 VAL 76 0.343 -14.672 -8.177 590 3HG1 VAL 76 3HG1 VAL 76 -0.453 -13.574 -9.306 591 1HG2 VAL 76 1HG2 VAL 76 -1.474 -14.014 -5.797 592 2HG2 VAL 76 2HG2 VAL 76 -0.584 -12.631 -5.158 593 3HG2 VAL 76 3HG2 VAL 76 0.284 -14.084 -5.648 594 H ALA 77 H ALA 77 2.718 -11.329 -5.861 595 HA ALA 77 HA ALA 77 1.176 -9.616 -4.200 596 1HB ALA 77 1HB ALA 77 3.160 -10.811 -3.394 597 2HB ALA 77 2HB ALA 77 3.297 -9.071 -3.137 598 3HB ALA 77 3HB ALA 77 4.173 -9.837 -4.461 599 HA PRO 78 HA PRO 78 1.702 -5.736 -6.379 600 1HB PRO 78 1HB PRO 78 1.612 -4.377 -3.796 601 2HB PRO 78 2HB PRO 78 0.436 -4.338 -5.112 602 1HG PRO 78 1HG PRO 78 -0.047 -5.556 -2.731 603 2HG PRO 78 2HG PRO 78 -0.773 -6.090 -4.256 604 1HD PRO 78 1HD PRO 78 1.547 -7.234 -2.756 605 2HD PRO 78 2HD PRO 78 0.246 -8.070 -3.632 606 H LYS 79 H LYS 79 3.380 -4.266 -6.730 607 HA LYS 79 HA LYS 79 5.932 -5.043 -5.702 608 1HB LYS 79 1HB LYS 79 4.929 -3.350 -7.824 609 2HB LYS 79 2HB LYS 79 6.240 -2.561 -6.956 610 1HG LYS 79 1HG LYS 79 7.694 -4.448 -7.364 611 2HG LYS 79 2HG LYS 79 6.381 -5.323 -8.153 612 1HD LYS 79 1HD LYS 79 6.282 -3.644 -9.903 613 2HD LYS 79 2HD LYS 79 7.527 -2.695 -9.088 614 1HE LYS 79 1HE LYS 79 7.957 -5.519 -10.045 615 2HE LYS 79 2HE LYS 79 8.320 -4.098 -11.024 616 1HZ LYS 79 1HZ LYS 79 9.477 -4.518 -8.321 617 2HZ LYS 79 2HZ LYS 79 9.972 -3.408 -9.512 618 3HZ LYS 79 3HZ LYS 79 10.229 -5.070 -9.740 619 H ALA 80 H ALA 80 3.681 -2.442 -5.088 620 HA ALA 80 HA ALA 80 4.992 -1.858 -2.585 621 1HB ALA 80 1HB ALA 80 6.265 -0.447 -4.126 622 2HB ALA 80 2HB ALA 80 5.288 0.527 -3.027 623 3HB ALA 80 3HB ALA 80 4.766 0.290 -4.693 624 H ILE 81 H ILE 81 3.667 -0.664 -1.168 625 HA ILE 81 HA ILE 81 0.938 -0.116 -2.118 626 HB ILE 81 HB ILE 81 0.699 -2.162 -0.939 627 1HG1 ILE 81 1HG1 ILE 81 -0.611 -1.494 1.104 628 2HG1 ILE 81 2HG1 ILE 81 -0.051 0.157 0.849 629 1HG2 ILE 81 1HG2 ILE 81 2.815 -2.271 0.195 630 2HG2 ILE 81 2HG2 ILE 81 1.512 -2.515 1.360 631 3HG2 ILE 81 3HG2 ILE 81 2.345 -0.960 1.278 632 1HD1 ILE 81 1HD1 ILE 81 -1.724 -1.470 -1.048 633 2HD1 ILE 81 2HD1 ILE 81 -1.134 0.165 -1.348 634 3HD1 ILE 81 3HD1 ILE 81 -2.276 -0.134 -0.035 635 H ILE 82 H ILE 82 0.382 1.936 -1.766 636 HA ILE 82 HA ILE 82 1.833 3.421 0.335 637 HB ILE 82 HB ILE 82 0.654 4.818 -2.050 638 1HG1 ILE 82 1HG1 ILE 82 2.078 3.024 -2.982 639 2HG1 ILE 82 2HG1 ILE 82 2.765 4.619 -3.264 640 1HG2 ILE 82 1HG2 ILE 82 3.056 5.415 -0.309 641 2HG2 ILE 82 2HG2 ILE 82 1.456 6.143 -0.146 642 3HG2 ILE 82 3HG2 ILE 82 2.421 6.448 -1.591 643 1HD1 ILE 82 1HD1 ILE 82 3.632 2.672 -1.140 644 2HD1 ILE 82 2HD1 ILE 82 4.311 4.277 -1.404 645 3HD1 ILE 82 3HD1 ILE 82 4.484 3.033 -2.641 646 H ASN 83 H ASN 83 0.539 3.959 1.959 647 HA ASN 83 HA ASN 83 -2.348 4.300 1.452 648 1HB ASN 83 1HB ASN 83 -0.885 3.581 4.009 649 2HB ASN 83 2HB ASN 83 -2.624 3.850 3.894 650 1HD2 ASN 83 1HD2 ASN 83 -3.853 2.386 2.587 651 2HD2 ASN 83 2HD2 ASN 83 -3.302 0.762 2.373 652 H LYS 84 H LYS 84 -3.318 5.846 3.338 653 HA LYS 84 HA LYS 84 -1.808 8.326 3.208 654 1HB LYS 84 1HB LYS 84 -4.241 8.489 3.055 655 2HB LYS 84 2HB LYS 84 -4.416 7.699 4.620 656 1HG LYS 84 1HG LYS 84 -3.230 9.578 5.678 657 2HG LYS 84 2HG LYS 84 -3.131 10.381 4.112 658 1HD LYS 84 1HD LYS 84 -5.700 9.614 5.497 659 2HD LYS 84 2HD LYS 84 -4.967 11.216 5.558 660 1HE LYS 84 1HE LYS 84 -5.083 11.196 3.019 661 2HE LYS 84 2HE LYS 84 -6.121 9.781 3.185 662 1HZ LYS 84 1HZ LYS 84 -6.636 12.508 4.245 663 2HZ LYS 84 2HZ LYS 84 -7.586 11.155 4.616 664 3HZ LYS 84 3HZ LYS 84 -7.492 11.710 3.014 665 H LYS 85 H LYS 85 -2.945 6.095 5.693 666 HA LYS 85 HA LYS 85 -0.433 6.530 7.116 667 1HB LYS 85 1HB LYS 85 -2.323 7.828 8.260 668 2HB LYS 85 2HB LYS 85 -3.046 6.263 8.614 669 1HG LYS 85 1HG LYS 85 -0.431 5.980 9.462 670 2HG LYS 85 2HG LYS 85 -0.844 7.633 9.912 671 1HD LYS 85 1HD LYS 85 -1.397 6.255 11.762 672 2HD LYS 85 2HD LYS 85 -2.921 6.699 10.995 673 1HE LYS 85 1HE LYS 85 -3.161 4.560 10.017 674 2HE LYS 85 2HE LYS 85 -1.491 4.124 10.376 675 1HZ LYS 85 1HZ LYS 85 -1.993 4.023 12.694 676 2HZ LYS 85 2HZ LYS 85 -3.142 3.082 11.880 677 3HZ LYS 85 3HZ LYS 85 -3.559 4.625 12.451 678 H THR 86 H THR 86 0.395 4.563 6.616 679 HA THR 86 HA THR 86 -1.266 2.235 6.501 680 HB THR 86 HB THR 86 0.783 2.519 5.094 681 HG1 THR 86 HG1 THR 86 0.485 0.438 5.005 682 1HG2 THR 86 1HG2 THR 86 2.219 1.969 7.694 683 2HG2 THR 86 2HG2 THR 86 2.299 3.459 6.753 684 3HG2 THR 86 3HG2 THR 86 2.963 1.964 6.096 685 H GLU 87 H GLU 87 -1.102 0.392 7.903 686 HA GLU 87 HA GLU 87 -0.789 1.302 10.651 687 1HB GLU 87 1HB GLU 87 -2.896 0.145 9.760 688 2HB GLU 87 2HB GLU 87 -1.950 -1.337 9.783 689 1HG GLU 87 1HG GLU 87 -3.365 -1.018 11.788 690 2HG GLU 87 2HG GLU 87 -1.646 -1.188 12.151 691 H THR 88 H THR 88 0.406 0.187 12.197 692 HA THR 88 HA THR 88 2.956 -0.593 11.470 693 HB THR 88 HB THR 88 1.578 -1.567 13.972 694 HG1 THR 88 HG1 THR 88 2.694 1.018 13.424 695 1HG2 THR 88 1HG2 THR 88 3.805 -1.214 14.963 696 2HG2 THR 88 2HG2 THR 88 4.422 -0.723 13.385 697 3HG2 THR 88 3HG2 THR 88 3.854 -2.374 13.635 698 H ILE 89 H ILE 89 0.102 -2.577 11.991 699 HA ILE 89 HA ILE 89 1.214 -5.130 11.992 700 HB ILE 89 HB ILE 89 -1.410 -4.354 10.708 701 1HG1 ILE 89 1HG1 ILE 89 -0.901 -5.098 13.598 702 2HG1 ILE 89 2HG1 ILE 89 -1.128 -3.448 13.031 703 1HG2 ILE 89 1HG2 ILE 89 -0.501 -6.935 11.976 704 2HG2 ILE 89 2HG2 ILE 89 -0.672 -6.634 10.247 705 3HG2 ILE 89 3HG2 ILE 89 -2.093 -6.617 11.290 706 1HD1 ILE 89 1HD1 ILE 89 -3.142 -5.679 12.865 707 2HD1 ILE 89 2HD1 ILE 89 -3.376 -4.041 12.256 708 3HD1 ILE 89 3HD1 ILE 89 -3.174 -4.318 13.986 709 H ILE 90 H ILE 90 0.150 -3.135 9.263 710 HA ILE 90 HA ILE 90 0.645 -5.101 7.271 711 HB ILE 90 HB ILE 90 0.476 -2.103 6.924 712 1HG1 ILE 90 1HG1 ILE 90 -1.732 -4.165 6.744 713 2HG1 ILE 90 2HG1 ILE 90 -1.500 -3.055 8.089 714 1HG2 ILE 90 1HG2 ILE 90 -0.208 -2.645 4.630 715 2HG2 ILE 90 2HG2 ILE 90 0.052 -4.357 4.965 716 3HG2 ILE 90 3HG2 ILE 90 1.413 -3.236 4.989 717 1HD1 ILE 90 1HD1 ILE 90 -2.096 -2.260 5.251 718 2HD1 ILE 90 2HD1 ILE 90 -1.887 -1.160 6.615 719 3HD1 ILE 90 3HD1 ILE 90 -3.248 -2.284 6.586 720 H ALA 91 H ALA 91 2.480 -2.416 8.607 721 HA ALA 91 HA ALA 91 4.609 -2.373 6.794 722 1HB ALA 91 1HB ALA 91 5.847 -1.201 8.532 723 2HB ALA 91 2HB ALA 91 4.660 -1.704 9.735 724 3HB ALA 91 3HB ALA 91 4.188 -0.605 8.439 725 H VAL 92 H VAL 92 4.157 -4.232 9.778 726 HA VAL 92 HA VAL 92 6.709 -5.454 9.775 727 HB VAL 92 HB VAL 92 4.128 -6.428 11.015 728 1HG1 VAL 92 1HG1 VAL 92 6.971 -7.259 11.578 729 2HG1 VAL 92 2HG1 VAL 92 5.741 -8.242 10.787 730 3HG1 VAL 92 3HG1 VAL 92 5.548 -7.781 12.477 731 1HG2 VAL 92 1HG2 VAL 92 4.786 -4.237 11.843 732 2HG2 VAL 92 2HG2 VAL 92 6.406 -4.840 12.195 733 3HG2 VAL 92 3HG2 VAL 92 5.020 -5.464 13.089 734 H GLY 93 H GLY 93 3.569 -6.453 8.469 735 1HA GLY 93 1HA GLY 93 4.406 -9.031 7.625 736 2HA GLY 93 2HA GLY 93 2.981 -8.173 7.062 737 H ALA 94 H ALA 94 4.124 -5.948 5.900 738 HA ALA 94 HA ALA 94 4.862 -7.007 3.373 739 1HB ALA 94 1HB ALA 94 4.955 -4.166 4.372 740 2HB ALA 94 2HB ALA 94 3.593 -4.949 3.571 741 3HB ALA 94 3HB ALA 94 5.094 -4.665 2.688 742 H ALA 95 H ALA 95 6.688 -5.756 6.074 743 HA ALA 95 HA ALA 95 9.130 -5.236 4.776 744 1HB ALA 95 1HB ALA 95 8.641 -4.457 7.034 745 2HB ALA 95 2HB ALA 95 10.141 -5.383 6.994 746 3HB ALA 95 3HB ALA 95 8.665 -6.118 7.624 747 H MET 96 H MET 96 7.630 -8.208 5.741 748 HA MET 96 HA MET 96 10.065 -9.755 5.554 749 1HB MET 96 1HB MET 96 7.175 -10.518 5.924 750 2HB MET 96 2HB MET 96 8.455 -11.706 5.751 751 1HG MET 96 1HG MET 96 9.570 -10.730 7.732 752 2HG MET 96 2HG MET 96 8.195 -9.645 7.926 753 1HE MET 96 1HE MET 96 5.741 -10.447 8.594 754 2HE MET 96 2HE MET 96 5.283 -12.147 8.706 755 3HE MET 96 3HE MET 96 5.743 -11.460 7.149 756 H ALA 97 H ALA 97 7.474 -8.820 3.466 757 HA ALA 97 HA ALA 97 8.213 -10.812 1.462 758 1HB ALA 97 1HB ALA 97 5.984 -8.786 1.420 759 2HB ALA 97 2HB ALA 97 5.838 -10.448 1.987 760 3HB ALA 97 3HB ALA 97 6.211 -10.122 0.294 761 H GLU 98 H GLU 98 9.391 -7.912 2.307 762 HA GLU 98 HA GLU 98 10.463 -6.187 1.306 763 1HB GLU 98 1HB GLU 98 10.772 -8.351 -0.742 764 2HB GLU 98 2HB GLU 98 11.306 -6.721 -1.121 765 1HG GLU 98 1HG GLU 98 13.198 -7.877 -0.339 766 2HG GLU 98 2HG GLU 98 12.700 -6.804 0.965 767 H ILE 99 H ILE 99 7.798 -5.899 1.318 768 HA ILE 99 HA ILE 99 7.162 -4.714 -1.302 769 HB ILE 99 HB ILE 99 5.267 -5.332 0.973 770 1HG1 ILE 99 1HG1 ILE 99 5.667 -6.721 -1.691 771 2HG1 ILE 99 2HG1 ILE 99 6.124 -7.369 -0.119 772 1HG2 ILE 99 1HG2 ILE 99 3.510 -4.817 -0.673 773 2HG2 ILE 99 2HG2 ILE 99 4.750 -4.338 -1.831 774 3HG2 ILE 99 3HG2 ILE 99 4.535 -3.422 -0.338 775 1HD1 ILE 99 1HD1 ILE 99 4.060 -8.361 -0.918 776 2HD1 ILE 99 2HD1 ILE 99 3.321 -6.765 -1.031 777 3HD1 ILE 99 3HD1 ILE 99 3.777 -7.416 0.544 778 HA PRO 100 HA PRO 100 8.593 -1.123 1.166 779 1HB PRO 100 1HB PRO 100 8.374 0.083 -1.538 780 2HB PRO 100 2HB PRO 100 9.711 0.139 -0.386 781 1HG PRO 100 1HG PRO 100 9.844 -1.387 -2.569 782 2HG PRO 100 2HG PRO 100 10.523 -1.933 -1.024 783 1HD PRO 100 1HD PRO 100 7.978 -2.732 -2.368 784 2HD PRO 100 2HD PRO 100 9.121 -3.721 -1.437 785 H LEU 101 H LEU 101 7.003 -0.187 2.310 786 HA LEU 101 HA LEU 101 4.824 1.067 0.796 787 1HB LEU 101 1HB LEU 101 3.293 0.676 2.622 788 2HB LEU 101 2HB LEU 101 3.952 -0.837 2.045 789 HG LEU 101 HG LEU 101 5.133 0.496 4.459 790 1HD1 LEU 101 1HD1 LEU 101 2.720 0.366 4.843 791 2HD1 LEU 101 2HD1 LEU 101 3.595 -0.788 5.847 792 3HD1 LEU 101 3HD1 LEU 101 2.743 -1.343 4.407 793 1HD2 LEU 101 1HD2 LEU 101 4.850 -2.377 3.602 794 2HD2 LEU 101 2HD2 LEU 101 5.686 -1.798 5.043 795 3HD2 LEU 101 3HD2 LEU 101 6.306 -1.398 3.442 796 H VAL 102 H VAL 102 4.436 3.109 1.142 797 HA VAL 102 HA VAL 102 5.539 4.417 3.525 798 HB VAL 102 HB VAL 102 6.167 6.383 2.271 799 1HG1 VAL 102 1HG1 VAL 102 7.861 4.633 2.375 800 2HG1 VAL 102 2HG1 VAL 102 7.979 5.534 0.863 801 3HG1 VAL 102 3HG1 VAL 102 7.243 3.933 0.880 802 1HG2 VAL 102 1HG2 VAL 102 5.149 4.966 -0.189 803 2HG2 VAL 102 2HG2 VAL 102 6.005 6.509 -0.172 804 3HG2 VAL 102 3HG2 VAL 102 4.418 6.372 0.586 805 H GLU 103 H GLU 103 4.357 6.630 3.797 806 HA GLU 103 HA GLU 103 1.571 6.233 2.947 807 1HB GLU 103 1HB GLU 103 0.930 7.436 5.067 808 2HB GLU 103 2HB GLU 103 1.574 5.814 5.257 809 1HG GLU 103 1HG GLU 103 3.699 6.690 5.964 810 2HG GLU 103 2HG GLU 103 3.159 8.340 5.639 811 H VAL 104 H VAL 104 0.552 7.781 1.987 812 HA VAL 104 HA VAL 104 1.888 10.378 1.627 813 HB VAL 104 HB VAL 104 0.333 10.635 -0.344 814 1HG1 VAL 104 1HG1 VAL 104 2.117 8.208 -0.403 815 2HG1 VAL 104 2HG1 VAL 104 2.635 9.878 -0.630 816 3HG1 VAL 104 3HG1 VAL 104 1.564 9.120 -1.808 817 1HG2 VAL 104 1HG2 VAL 104 -0.287 7.730 0.201 818 2HG2 VAL 104 2HG2 VAL 104 -0.762 8.627 -1.241 819 3HG2 VAL 104 3HG2 VAL 104 -1.418 9.076 0.333 820 H ARG 105 H ARG 105 1.148 11.761 3.157 821 HA ARG 105 HA ARG 105 -1.678 11.610 3.917 822 1HB ARG 105 1HB ARG 105 0.340 11.658 5.569 823 2HB ARG 105 2HB ARG 105 0.336 13.389 5.252 824 1HG ARG 105 1HG ARG 105 -2.035 13.469 5.961 825 2HG ARG 105 2HG ARG 105 -1.933 11.759 6.377 826 1HD ARG 105 1HD ARG 105 -1.628 13.015 8.376 827 2HD ARG 105 2HD ARG 105 -0.069 12.323 7.931 828 HE ARG 105 HE ARG 105 -0.175 14.856 6.802 829 1HH1 ARG 105 1HH1 ARG 105 -0.139 13.414 9.995 830 2HH1 ARG 105 2HH1 ARG 105 0.500 14.835 10.768 831 1HH2 ARG 105 1HH2 ARG 105 0.671 16.711 7.800 832 2HH2 ARG 105 2HH2 ARG 105 0.968 16.722 9.515 833 H ASP 106 H ASP 106 -0.720 12.786 1.380 834 HA ASP 106 HA ASP 106 -1.852 15.472 1.774 835 1HB ASP 106 1HB ASP 106 0.629 15.411 1.159 836 2HB ASP 106 2HB ASP 106 0.114 14.812 -0.415 837 H GLU 107 H GLU 107 -3.533 15.990 0.542 838 HA GLU 107 HA GLU 107 -4.886 13.912 -0.850 839 1HB GLU 107 1HB GLU 107 -5.938 15.771 0.497 840 2HB GLU 107 2HB GLU 107 -5.564 16.852 -0.835 841 1HG GLU 107 1HG GLU 107 -7.866 16.140 -0.942 842 2HG GLU 107 2HG GLU 107 -6.962 15.515 -2.319 843 H LYS 108 H LYS 108 -2.768 16.488 -1.811 844 HA LYS 108 HA LYS 108 -3.639 16.810 -4.477 845 1HB LYS 108 1HB LYS 108 -1.006 17.367 -3.122 846 2HB LYS 108 2HB LYS 108 -1.331 17.781 -4.794 847 1HG LYS 108 1HG LYS 108 -2.908 18.787 -2.441 848 2HG LYS 108 2HG LYS 108 -1.624 19.680 -3.259 849 1HD LYS 108 1HD LYS 108 -2.891 19.644 -5.332 850 2HD LYS 108 2HD LYS 108 -4.157 18.687 -4.560 851 1HE LYS 108 1HE LYS 108 -4.780 21.043 -4.694 852 2HE LYS 108 2HE LYS 108 -4.616 20.515 -3.021 853 1HZ LYS 108 1HZ LYS 108 -2.564 22.027 -4.552 854 2HZ LYS 108 2HZ LYS 108 -2.445 21.556 -2.928 855 3HZ LYS 108 3HZ LYS 108 -3.616 22.689 -3.398 856 H PHE 109 H PHE 109 -1.667 14.425 -2.920 857 HA PHE 109 HA PHE 109 -0.337 13.448 -5.215 858 1HB PHE 109 1HB PHE 109 0.389 12.811 -2.970 859 2HB PHE 109 2HB PHE 109 -1.140 11.986 -2.687 860 HD1 PHE 109 HD1 PHE 109 1.758 11.981 -5.025 861 HD2 PHE 109 HD2 PHE 109 -1.287 9.723 -3.093 862 HE1 PHE 109 HE1 PHE 109 2.712 9.912 -5.950 863 HE2 PHE 109 HE2 PHE 109 -0.336 7.648 -4.011 864 HZ PHE 109 HZ PHE 109 1.668 7.743 -5.444 865 H PHE 110 H PHE 110 -3.369 12.512 -3.638 866 HA PHE 110 HA PHE 110 -4.032 10.446 -5.457 867 1HB PHE 110 1HB PHE 110 -5.842 12.097 -3.679 868 2HB PHE 110 2HB PHE 110 -6.294 10.598 -4.477 869 HD1 PHE 110 HD1 PHE 110 -5.312 8.463 -3.739 870 HD2 PHE 110 HD2 PHE 110 -4.565 12.108 -1.678 871 HE1 PHE 110 HE1 PHE 110 -4.535 7.191 -1.782 872 HE2 PHE 110 HE2 PHE 110 -3.783 10.845 0.282 873 HZ PHE 110 HZ PHE 110 -3.769 8.382 0.232 874 H GLU 111 H GLU 111 -4.379 13.870 -5.510 875 HA GLU 111 HA GLU 111 -6.384 13.987 -7.538 876 1HB GLU 111 1HB GLU 111 -4.668 15.894 -6.041 877 2HB GLU 111 2HB GLU 111 -5.365 16.423 -7.552 878 1HG GLU 111 1HG GLU 111 -7.597 15.914 -6.721 879 2HG GLU 111 2HG GLU 111 -6.901 15.337 -5.207 880 H ALA 112 H ALA 112 -2.939 13.795 -7.439 881 HA ALA 112 HA ALA 112 -2.653 14.649 -10.212 882 1HB ALA 112 1HB ALA 112 -1.071 15.495 -8.542 883 2HB ALA 112 2HB ALA 112 -0.265 14.577 -9.814 884 3HB ALA 112 3HB ALA 112 -0.531 13.845 -8.231 885 H VAL 113 H VAL 113 -2.264 11.737 -8.236 886 HA VAL 113 HA VAL 113 -1.259 10.252 -10.532 887 HB VAL 113 HB VAL 113 -0.241 9.913 -8.285 888 1HG1 VAL 113 1HG1 VAL 113 -2.253 10.088 -6.916 889 2HG1 VAL 113 2HG1 VAL 113 -1.398 8.575 -6.610 890 3HG1 VAL 113 3HG1 VAL 113 -2.855 8.577 -7.602 891 1HG2 VAL 113 1HG2 VAL 113 -0.126 7.469 -8.422 892 2HG2 VAL 113 2HG2 VAL 113 -0.009 8.216 -10.016 893 3HG2 VAL 113 3HG2 VAL 113 -1.520 7.466 -9.500 894 H LYS 114 H LYS 114 -2.365 8.733 -11.656 895 HA LYS 114 HA LYS 114 -4.990 7.911 -10.673 896 1HB LYS 114 1HB LYS 114 -4.414 9.107 -13.380 897 2HB LYS 114 2HB LYS 114 -5.847 8.138 -13.061 898 1HG LYS 114 1HG LYS 114 -6.658 9.701 -11.467 899 2HG LYS 114 2HG LYS 114 -5.132 10.585 -11.468 900 1HD LYS 114 1HD LYS 114 -5.523 11.243 -13.787 901 2HD LYS 114 2HD LYS 114 -7.052 10.359 -13.785 902 1HE LYS 114 1HE LYS 114 -7.918 11.796 -12.035 903 2HE LYS 114 2HE LYS 114 -6.374 12.640 -11.932 904 1HZ LYS 114 1HZ LYS 114 -6.687 13.546 -14.087 905 2HZ LYS 114 2HZ LYS 114 -8.125 13.811 -13.229 906 3HZ LYS 114 3HZ LYS 114 -8.043 12.569 -14.385 907 H THR 115 H THR 115 -5.796 5.962 -11.728 908 HA THR 115 HA THR 115 -3.814 3.975 -11.689 909 HB THR 115 HB THR 115 -6.643 3.730 -12.730 910 HG1 THR 115 HG1 THR 115 -7.226 3.330 -10.626 911 1HG2 THR 115 1HG2 THR 115 -5.228 1.820 -13.299 912 2HG2 THR 115 2HG2 THR 115 -6.418 1.376 -12.077 913 3HG2 THR 115 3HG2 THR 115 -4.743 1.666 -11.610 914 H GLY 116 H GLY 116 -2.328 3.722 -13.213 915 1HA GLY 116 1HA GLY 116 -2.308 2.609 -15.527 916 2HA GLY 116 2HA GLY 116 -3.103 4.093 -16.031 917 H ASP 117 H ASP 117 -1.309 5.441 -13.880 918 HA ASP 117 HA ASP 117 0.775 6.096 -15.771 919 1HB ASP 117 1HB ASP 117 0.120 7.155 -13.022 920 2HB ASP 117 2HB ASP 117 1.499 7.711 -13.966 921 H ARG 118 H ARG 118 3.031 6.116 -15.230 922 HA ARG 118 HA ARG 118 3.805 3.685 -13.822 923 1HB ARG 118 1HB ARG 118 4.734 4.080 -16.047 924 2HB ARG 118 2HB ARG 118 5.425 5.605 -15.515 925 1HG ARG 118 1HG ARG 118 6.328 3.527 -13.782 926 2HG ARG 118 2HG ARG 118 6.581 3.030 -15.456 927 1HD ARG 118 1HD ARG 118 8.541 4.191 -14.688 928 2HD ARG 118 2HD ARG 118 7.715 5.198 -15.876 929 HE ARG 118 HE ARG 118 6.716 6.090 -13.532 930 1HH1 ARG 118 1HH1 ARG 118 9.994 5.639 -14.717 931 2HH1 ARG 118 2HH1 ARG 118 10.655 6.874 -13.687 932 1HH2 ARG 118 1HH2 ARG 118 7.612 7.715 -12.191 933 2HH2 ARG 118 2HH2 ARG 118 9.318 8.041 -12.259 934 H VAL 119 H VAL 119 4.432 3.739 -11.787 935 HA VAL 119 HA VAL 119 5.540 6.260 -10.741 936 HB VAL 119 HB VAL 119 3.260 5.862 -9.880 937 1HG1 VAL 119 1HG1 VAL 119 4.427 3.365 -8.667 938 2HG1 VAL 119 2HG1 VAL 119 3.230 3.435 -9.959 939 3HG1 VAL 119 3HG1 VAL 119 2.821 4.015 -8.344 940 1HG2 VAL 119 1HG2 VAL 119 4.839 7.093 -8.509 941 2HG2 VAL 119 2HG2 VAL 119 5.433 5.588 -7.806 942 3HG2 VAL 119 3HG2 VAL 119 3.779 6.116 -7.492 943 H VAL 120 H VAL 120 7.395 6.164 -9.641 944 HA VAL 120 HA VAL 120 8.474 3.504 -8.996 945 HB VAL 120 HB VAL 120 9.968 6.111 -9.366 946 1HG1 VAL 120 1HG1 VAL 120 11.998 4.758 -9.143 947 2HG1 VAL 120 2HG1 VAL 120 11.013 3.340 -8.787 948 3HG1 VAL 120 3HG1 VAL 120 11.023 4.708 -7.674 949 1HG2 VAL 120 1HG2 VAL 120 9.191 5.196 -11.477 950 2HG2 VAL 120 2HG2 VAL 120 9.878 3.624 -11.071 951 3HG2 VAL 120 3HG2 VAL 120 10.938 5.008 -11.335 952 H VAL 121 H VAL 121 8.094 2.997 -6.973 953 HA VAL 121 HA VAL 121 7.936 5.076 -4.930 954 HB VAL 121 HB VAL 121 7.396 2.107 -4.725 955 1HG1 VAL 121 1HG1 VAL 121 6.851 4.332 -2.762 956 2HG1 VAL 121 2HG1 VAL 121 8.064 3.063 -2.589 957 3HG1 VAL 121 3HG1 VAL 121 6.349 2.651 -2.578 958 1HG2 VAL 121 1HG2 VAL 121 5.471 4.421 -4.921 959 2HG2 VAL 121 2HG2 VAL 121 5.034 2.731 -4.673 960 3HG2 VAL 121 3HG2 VAL 121 5.797 3.232 -6.183 961 H ASN 122 H ASN 122 9.893 5.675 -4.247 962 HA ASN 122 HA ASN 122 11.887 3.568 -3.763 963 1HB ASN 122 1HB ASN 122 12.566 5.364 -5.339 964 2HB ASN 122 2HB ASN 122 12.337 6.548 -4.060 965 1HD2 ASN 122 1HD2 ASN 122 14.564 7.099 -4.384 966 2HD2 ASN 122 2HD2 ASN 122 15.810 6.138 -3.664 967 H ALA 123 H ALA 123 11.473 2.896 -1.739 968 HA ALA 123 HA ALA 123 10.887 4.798 0.369 969 1HB ALA 123 1HB ALA 123 9.701 2.659 0.291 970 2HB ALA 123 2HB ALA 123 10.627 2.826 1.782 971 3HB ALA 123 3HB ALA 123 11.231 1.803 0.480 972 H ASP 124 H ASP 124 13.609 3.510 -1.088 973 HA ASP 124 HA ASP 124 15.428 3.334 1.063 974 1HB ASP 124 1HB ASP 124 15.855 2.495 -1.256 975 2HB ASP 124 2HB ASP 124 15.994 4.161 -1.799 976 H GLU 125 H GLU 125 14.385 5.997 -0.993 977 HA GLU 125 HA GLU 125 15.824 7.873 0.740 978 1HB GLU 125 1HB GLU 125 16.066 8.009 -1.776 979 2HB GLU 125 2HB GLU 125 14.380 8.500 -1.837 980 1HG GLU 125 1HG GLU 125 15.777 10.444 -1.959 981 2HG GLU 125 2HG GLU 125 14.925 10.442 -0.415 982 H GLY 126 H GLY 126 12.630 6.957 -0.407 983 1HA GLY 126 1HA GLY 126 10.728 7.067 1.010 984 2HA GLY 126 2HA GLY 126 11.490 8.386 1.887 985 H TYR 127 H TYR 127 10.209 7.597 -1.355 986 HA TYR 127 HA TYR 127 8.587 9.924 -1.408 987 1HB TYR 127 1HB TYR 127 9.665 11.225 -3.101 988 2HB TYR 127 2HB TYR 127 10.864 10.923 -1.852 989 HD1 TYR 127 HD1 TYR 127 9.803 10.030 -5.273 990 HD2 TYR 127 HD2 TYR 127 12.864 9.695 -2.338 991 HE1 TYR 127 HE1 TYR 127 11.334 9.161 -6.986 992 HE2 TYR 127 HE2 TYR 127 14.405 8.820 -4.044 993 HH TYR 127 HH TYR 127 13.607 8.825 -7.441 994 H VAL 128 H VAL 128 7.526 10.168 -3.557 995 HA VAL 128 HA VAL 128 7.563 7.692 -5.131 996 HB VAL 128 HB VAL 128 5.030 7.967 -5.369 997 1HG1 VAL 128 1HG1 VAL 128 6.028 6.128 -4.140 998 2HG1 VAL 128 2HG1 VAL 128 4.585 6.705 -3.305 999 3HG1 VAL 128 3HG1 VAL 128 6.183 7.145 -2.706 1000 1HG2 VAL 128 1HG2 VAL 128 4.852 10.203 -4.404 1001 2HG2 VAL 128 2HG2 VAL 128 5.431 9.588 -2.855 1002 3HG2 VAL 128 3HG2 VAL 128 3.879 9.045 -3.495 1003 H GLU 129 H GLU 129 7.925 8.137 -7.198 1004 HA GLU 129 HA GLU 129 7.014 10.744 -8.224 1005 1HB GLU 129 1HB GLU 129 9.441 10.731 -8.080 1006 2HB GLU 129 2HB GLU 129 9.518 9.222 -8.983 1007 1HG GLU 129 1HG GLU 129 8.684 10.299 -10.959 1008 2HG GLU 129 2HG GLU 129 8.409 11.797 -10.074 1009 H LEU 130 H LEU 130 5.462 10.551 -9.623 1010 HA LEU 130 HA LEU 130 5.292 8.137 -11.285 1011 1HB LEU 130 1HB LEU 130 2.923 8.649 -11.562 1012 2HB LEU 130 2HB LEU 130 3.335 8.479 -9.865 1013 HG LEU 130 HG LEU 130 3.363 11.231 -10.991 1014 1HD1 LEU 130 1HD1 LEU 130 0.947 11.458 -10.677 1015 2HD1 LEU 130 2HD1 LEU 130 0.825 9.723 -10.387 1016 3HD1 LEU 130 3HD1 LEU 130 1.334 10.319 -11.967 1017 1HD2 LEU 130 1HD2 LEU 130 2.361 10.053 -8.400 1018 2HD2 LEU 130 2HD2 LEU 130 2.499 11.769 -8.783 1019 3HD2 LEU 130 3HD2 LEU 130 3.951 10.775 -8.653 1020 H ILE 131 H ILE 131 4.977 8.346 -13.503 1021 HA ILE 131 HA ILE 131 5.338 11.072 -14.570 1022 HB ILE 131 HB ILE 131 5.881 8.470 -15.992 1023 1HG1 ILE 131 1HG1 ILE 131 7.527 8.813 -14.220 1024 2HG1 ILE 131 2HG1 ILE 131 8.272 9.057 -15.797 1025 1HG2 ILE 131 1HG2 ILE 131 5.236 10.242 -17.512 1026 2HG2 ILE 131 2HG2 ILE 131 6.951 9.873 -17.697 1027 3HG2 ILE 131 3HG2 ILE 131 6.450 11.311 -16.808 1028 1HD1 ILE 131 1HD1 ILE 131 9.026 10.719 -14.198 1029 2HD1 ILE 131 2HD1 ILE 131 7.361 11.228 -13.916 1030 3HD1 ILE 131 3HD1 ILE 131 8.105 11.476 -15.496 1031 H GLU 132 H GLU 132 3.762 11.920 -15.687 1032 HA GLU 132 HA GLU 132 1.239 10.605 -15.868 1033 1HB GLU 132 1HB GLU 132 2.163 13.220 -17.063 1034 2HB GLU 132 2HB GLU 132 0.498 12.664 -17.027 1035 1HG GLU 132 1HG GLU 132 0.602 12.656 -14.554 1036 2HG GLU 132 2HG GLU 132 2.224 13.341 -14.659 Start of MODEL 6 1 H VAL 1 H VAL 1 4.584 14.673 -11.882 2 HA VAL 1 HA VAL 1 4.970 16.611 -9.704 3 HB VAL 1 HB VAL 1 3.124 15.403 -8.518 4 1HG1 VAL 1 1HG1 VAL 1 2.708 17.522 -9.609 5 2HG1 VAL 1 2HG1 VAL 1 1.318 16.457 -9.824 6 3HG1 VAL 1 3HG1 VAL 1 2.453 16.710 -11.152 7 1HG2 VAL 1 1HG2 VAL 1 3.207 13.304 -9.766 8 2HG2 VAL 1 2HG2 VAL 1 2.684 14.143 -11.226 9 3HG2 VAL 1 3HG2 VAL 1 1.597 14.022 -9.841 10 H LYS 2 H LYS 2 6.021 16.027 -7.920 11 HA LYS 2 HA LYS 2 6.492 13.192 -7.385 12 1HB LYS 2 1HB LYS 2 8.816 13.699 -6.658 13 2HB LYS 2 2HB LYS 2 8.572 13.903 -8.383 14 1HG LYS 2 1HG LYS 2 8.168 16.350 -6.835 15 2HG LYS 2 2HG LYS 2 9.803 15.693 -6.737 16 1HD LYS 2 1HD LYS 2 8.290 16.342 -9.270 17 2HD LYS 2 2HD LYS 2 9.617 17.281 -8.578 18 1HE LYS 2 1HE LYS 2 11.087 15.310 -8.824 19 2HE LYS 2 2HE LYS 2 9.762 14.447 -9.602 20 1HZ LYS 2 1HZ LYS 2 11.370 16.692 -10.618 21 2HZ LYS 2 2HZ LYS 2 9.788 16.477 -11.195 22 3HZ LYS 2 3HZ LYS 2 10.936 15.239 -11.381 23 H PHE 3 H PHE 3 6.511 12.681 -5.193 24 HA PHE 3 HA PHE 3 5.765 14.915 -3.423 25 1HB PHE 3 1HB PHE 3 4.439 12.194 -3.455 26 2HB PHE 3 2HB PHE 3 3.995 13.572 -2.453 27 HD1 PHE 3 HD1 PHE 3 2.959 15.570 -3.494 28 HD2 PHE 3 HD2 PHE 3 3.684 12.000 -5.692 29 HE1 PHE 3 HE1 PHE 3 1.393 16.326 -5.233 30 HE2 PHE 3 HE2 PHE 3 2.118 12.751 -7.435 31 HZ PHE 3 HZ PHE 3 0.970 14.915 -7.206 32 H ALA 4 H ALA 4 6.237 14.653 -1.222 33 HA ALA 4 HA ALA 4 8.322 12.674 -0.659 34 1HB ALA 4 1HB ALA 4 8.855 14.073 1.282 35 2HB ALA 4 2HB ALA 4 7.515 15.144 0.877 36 3HB ALA 4 3HB ALA 4 8.892 15.005 -0.214 37 H CYS 5 H CYS 5 7.906 10.966 0.583 38 HA CYS 5 HA CYS 5 5.479 11.013 2.242 39 1HB CYS 5 1HB CYS 5 5.506 8.486 1.817 40 2HB CYS 5 2HB CYS 5 5.031 9.521 0.474 41 HG CYS 5 HG CYS 5 6.536 8.003 -1.009 42 H ARG 6 H ARG 6 5.601 9.222 3.958 43 HA ARG 6 HA ARG 6 8.157 9.445 5.351 44 1HB ARG 6 1HB ARG 6 6.043 9.938 6.550 45 2HB ARG 6 2HB ARG 6 5.508 8.292 6.265 46 1HG ARG 6 1HG ARG 6 6.271 8.276 8.460 47 2HG ARG 6 2HG ARG 6 7.607 7.584 7.542 48 1HD ARG 6 1HD ARG 6 7.457 10.502 8.266 49 2HD ARG 6 2HD ARG 6 8.216 9.297 9.303 50 HE ARG 6 HE ARG 6 9.730 8.849 7.366 51 1HH1 ARG 6 1HH1 ARG 6 8.132 11.936 7.739 52 2HH1 ARG 6 2HH1 ARG 6 9.351 12.828 6.878 53 1HH2 ARG 6 1HH2 ARG 6 11.334 10.003 6.204 54 2HH2 ARG 6 2HH2 ARG 6 11.167 11.726 5.990 55 H ALA 7 H ALA 7 9.589 7.846 5.234 56 HA ALA 7 HA ALA 7 8.836 5.381 3.916 57 1HB ALA 7 1HB ALA 7 10.879 6.510 3.231 58 2HB ALA 7 2HB ALA 7 11.229 4.902 3.867 59 3HB ALA 7 3HB ALA 7 11.537 6.330 4.858 60 H ILE 8 H ILE 8 7.666 4.183 5.358 61 HA ILE 8 HA ILE 8 8.773 3.533 7.952 62 HB ILE 8 HB ILE 8 6.402 2.338 6.489 63 1HG1 ILE 8 1HG1 ILE 8 5.224 3.489 8.515 64 2HG1 ILE 8 2HG1 ILE 8 6.687 4.462 8.587 65 1HG2 ILE 8 1HG2 ILE 8 7.400 0.712 8.000 66 2HG2 ILE 8 2HG2 ILE 8 5.834 1.255 8.599 67 3HG2 ILE 8 3HG2 ILE 8 7.318 1.875 9.324 68 1HD1 ILE 8 1HD1 ILE 8 4.871 4.213 6.201 69 2HD1 ILE 8 2HD1 ILE 8 6.316 5.218 6.307 70 3HD1 ILE 8 3HD1 ILE 8 4.919 5.571 7.326 71 H THR 9 H THR 9 8.272 1.956 4.835 72 HA THR 9 HA THR 9 10.070 -0.216 5.657 73 HB THR 9 HB THR 9 8.658 -0.317 3.038 74 HG1 THR 9 HG1 THR 9 7.004 0.409 4.392 75 1HG2 THR 9 1HG2 THR 9 8.365 -2.687 3.717 76 2HG2 THR 9 2HG2 THR 9 9.180 -2.324 5.238 77 3HG2 THR 9 3HG2 THR 9 10.054 -2.183 3.714 78 H ARG 10 H ARG 10 11.406 -1.019 3.716 79 HA ARG 10 HA ARG 10 12.689 1.313 2.456 80 1HB ARG 10 1HB ARG 10 13.885 -1.380 3.143 81 2HB ARG 10 2HB ARG 10 14.736 -0.058 2.359 82 1HG ARG 10 1HG ARG 10 14.413 1.320 4.373 83 2HG ARG 10 2HG ARG 10 13.623 -0.053 5.159 84 1HD ARG 10 1HD ARG 10 15.661 -1.379 4.870 85 2HD ARG 10 2HD ARG 10 16.444 -0.002 4.100 86 HE ARG 10 HE ARG 10 15.580 -0.053 6.928 87 1HH1 ARG 10 1HH1 ARG 10 17.738 1.019 4.375 88 2HH1 ARG 10 2HH1 ARG 10 18.839 1.818 5.461 89 1HH2 ARG 10 1HH2 ARG 10 17.042 0.956 8.363 90 2HH2 ARG 10 2HH2 ARG 10 18.451 1.766 7.734 91 H GLY 11 H GLY 11 13.987 0.547 0.422 92 1HA GLY 11 1HA GLY 11 14.007 -1.242 -1.298 93 2HA GLY 11 2HA GLY 11 12.259 -1.273 -1.126 94 H ARG 12 H ARG 12 12.837 -1.018 -3.556 95 HA ARG 12 HA ARG 12 12.117 1.683 -4.251 96 1HB ARG 12 1HB ARG 12 14.604 1.739 -4.184 97 2HB ARG 12 2HB ARG 12 14.644 0.442 -5.363 98 1HG ARG 12 1HG ARG 12 13.833 1.824 -7.073 99 2HG ARG 12 2HG ARG 12 13.300 3.060 -5.930 100 1HD ARG 12 1HD ARG 12 16.177 2.271 -6.384 101 2HD ARG 12 2HD ARG 12 15.392 3.657 -7.141 102 HE ARG 12 HE ARG 12 14.976 4.390 -4.732 103 1HH1 ARG 12 1HH1 ARG 12 17.766 2.501 -5.675 104 2HH1 ARG 12 2HH1 ARG 12 18.801 3.186 -4.459 105 1HH2 ARG 12 1HH2 ARG 12 16.317 5.270 -3.114 106 2HH2 ARG 12 2HH2 ARG 12 17.978 4.759 -2.994 107 H ALA 13 H ALA 13 10.479 1.405 -5.643 108 HA ALA 13 HA ALA 13 10.446 -1.085 -7.218 109 1HB ALA 13 1HB ALA 13 8.114 0.073 -5.710 110 2HB ALA 13 2HB ALA 13 9.064 -1.327 -5.212 111 3HB ALA 13 3HB ALA 13 8.105 -1.393 -6.690 112 H GLU 14 H GLU 14 9.115 -1.119 -9.048 113 HA GLU 14 HA GLU 14 8.193 1.478 -10.075 114 1HB GLU 14 1HB GLU 14 10.452 0.997 -10.981 115 2HB GLU 14 2HB GLU 14 9.879 -0.547 -11.583 116 1HG GLU 14 1HG GLU 14 8.663 2.038 -12.482 117 2HG GLU 14 2HG GLU 14 10.125 1.395 -13.224 118 H GLY 15 H GLY 15 6.064 1.261 -10.633 119 1HA GLY 15 1HA GLY 15 5.180 -1.059 -12.080 120 2HA GLY 15 2HA GLY 15 4.611 -1.038 -10.420 121 H GLU 16 H GLU 16 2.947 -1.038 -12.627 122 HA GLU 16 HA GLU 16 1.875 1.515 -13.223 123 1HB GLU 16 1HB GLU 16 1.445 -0.501 -14.576 124 2HB GLU 16 2HB GLU 16 0.566 -1.211 -13.235 125 1HG GLU 16 1HG GLU 16 -1.044 0.694 -13.395 126 2HG GLU 16 2HG GLU 16 -0.223 1.162 -14.886 127 H ALA 17 H ALA 17 0.208 2.643 -12.245 128 HA ALA 17 HA ALA 17 -0.099 2.153 -9.425 129 1HB ALA 17 1HB ALA 17 -1.305 4.329 -11.126 130 2HB ALA 17 2HB ALA 17 0.257 4.418 -10.318 131 3HB ALA 17 3HB ALA 17 -1.219 4.295 -9.365 132 H LEU 18 H LEU 18 -1.661 1.034 -8.530 133 HA LEU 18 HA LEU 18 -4.273 0.895 -9.878 134 1HB LEU 18 1HB LEU 18 -3.066 -1.272 -9.413 135 2HB LEU 18 2HB LEU 18 -3.197 -0.910 -7.704 136 HG LEU 18 HG LEU 18 -5.651 -1.118 -9.432 137 1HD1 LEU 18 1HD1 LEU 18 -4.243 -3.362 -7.989 138 2HD1 LEU 18 2HD1 LEU 18 -4.401 -3.188 -9.737 139 3HD1 LEU 18 3HD1 LEU 18 -5.835 -3.459 -8.745 140 1HD2 LEU 18 1HD2 LEU 18 -6.701 -1.728 -7.297 141 2HD2 LEU 18 2HD2 LEU 18 -5.945 -0.135 -7.230 142 3HD2 LEU 18 3HD2 LEU 18 -5.148 -1.520 -6.483 143 H VAL 19 H VAL 19 -5.609 2.380 -9.074 144 HA VAL 19 HA VAL 19 -5.175 3.291 -6.318 145 HB VAL 19 HB VAL 19 -6.752 4.661 -8.504 146 1HG1 VAL 19 1HG1 VAL 19 -5.797 5.640 -5.813 147 2HG1 VAL 19 2HG1 VAL 19 -7.465 5.283 -6.265 148 3HG1 VAL 19 3HG1 VAL 19 -6.612 6.621 -7.034 149 1HG2 VAL 19 1HG2 VAL 19 -4.843 6.179 -8.701 150 2HG2 VAL 19 2HG2 VAL 19 -4.391 4.523 -9.099 151 3HG2 VAL 19 3HG2 VAL 19 -3.949 5.205 -7.535 152 H THR 20 H THR 20 -6.412 2.276 -4.917 153 HA THR 20 HA THR 20 -9.144 1.550 -5.668 154 HB THR 20 HB THR 20 -9.009 0.417 -3.312 155 HG1 THR 20 HG1 THR 20 -6.845 1.519 -3.039 156 1HG2 THR 20 1HG2 THR 20 -8.035 -1.593 -4.333 157 2HG2 THR 20 2HG2 THR 20 -7.446 -0.618 -5.681 158 3HG2 THR 20 3HG2 THR 20 -9.181 -0.803 -5.417 159 H LYS 21 H LYS 21 -10.605 3.026 -5.280 160 HA LYS 21 HA LYS 21 -10.338 4.856 -3.020 161 1HB LYS 21 1HB LYS 21 -12.418 5.892 -4.022 162 2HB LYS 21 2HB LYS 21 -10.986 5.938 -5.041 163 1HG LYS 21 1HG LYS 21 -11.843 3.914 -6.217 164 2HG LYS 21 2HG LYS 21 -13.330 4.071 -5.283 165 1HD LYS 21 1HD LYS 21 -13.812 6.188 -6.270 166 2HD LYS 21 2HD LYS 21 -12.222 6.254 -7.039 167 1HE LYS 21 1HE LYS 21 -12.817 4.261 -8.361 168 2HE LYS 21 2HE LYS 21 -14.419 4.276 -7.626 169 1HZ LYS 21 1HZ LYS 21 -14.889 6.366 -8.638 170 2HZ LYS 21 2HZ LYS 21 -14.318 5.319 -9.848 171 3HZ LYS 21 3HZ LYS 21 -13.304 6.521 -9.214 172 H GLU 22 H GLU 22 -11.393 1.863 -3.559 173 HA GLU 22 HA GLU 22 -13.738 1.825 -1.913 174 1HB GLU 22 1HB GLU 22 -11.949 -0.305 -3.072 175 2HB GLU 22 2HB GLU 22 -13.258 -0.694 -1.968 176 1HG GLU 22 1HG GLU 22 -13.809 -0.963 -4.378 177 2HG GLU 22 2HG GLU 22 -14.894 0.094 -3.484 178 H TYR 23 H TYR 23 -13.357 -0.213 -0.142 179 HA TYR 23 HA TYR 23 -11.285 0.912 1.612 180 1HB TYR 23 1HB TYR 23 -13.993 -0.100 2.508 181 2HB TYR 23 2HB TYR 23 -12.780 0.710 3.499 182 HD1 TYR 23 HD1 TYR 23 -12.071 3.107 2.640 183 HD2 TYR 23 HD2 TYR 23 -15.722 1.172 1.624 184 HE1 TYR 23 HE1 TYR 23 -13.046 5.279 2.037 185 HE2 TYR 23 HE2 TYR 23 -16.708 3.343 1.021 186 HH TYR 23 HH TYR 23 -14.928 6.068 0.454 187 H ILE 24 H ILE 24 -9.764 -0.611 1.328 188 HA ILE 24 HA ILE 24 -10.504 -3.433 1.704 189 HB ILE 24 HB ILE 24 -7.929 -2.351 0.556 190 1HG1 ILE 24 1HG1 ILE 24 -10.359 -3.349 -0.948 191 2HG1 ILE 24 2HG1 ILE 24 -9.871 -1.660 -0.822 192 1HG2 ILE 24 1HG2 ILE 24 -7.785 -4.624 1.412 193 2HG2 ILE 24 2HG2 ILE 24 -7.676 -4.616 -0.347 194 3HG2 ILE 24 3HG2 ILE 24 -9.180 -5.094 0.440 195 1HD1 ILE 24 1HD1 ILE 24 -8.304 -3.874 -2.129 196 2HD1 ILE 24 2HD1 ILE 24 -7.775 -2.198 -1.973 197 3HD1 ILE 24 3HD1 ILE 24 -9.193 -2.588 -2.949 198 H SER 25 H SER 25 -9.404 -4.693 3.200 199 HA SER 25 HA SER 25 -7.327 -3.381 4.799 200 1HB SER 25 1HB SER 25 -9.443 -3.375 6.092 201 2HB SER 25 2HB SER 25 -9.542 -5.126 5.914 202 HG SER 25 HG SER 25 -7.480 -3.674 7.237 203 H PHE 26 H PHE 26 -5.966 -4.999 5.966 204 HA PHE 26 HA PHE 26 -5.382 -7.148 4.104 205 1HB PHE 26 1HB PHE 26 -3.846 -6.022 6.443 206 2HB PHE 26 2HB PHE 26 -3.302 -7.410 5.497 207 HD1 PHE 26 HD1 PHE 26 -3.328 -7.006 2.884 208 HD2 PHE 26 HD2 PHE 26 -3.073 -3.943 5.825 209 HE1 PHE 26 HE1 PHE 26 -2.330 -5.496 1.219 210 HE2 PHE 26 HE2 PHE 26 -2.073 -2.428 4.164 211 HZ PHE 26 HZ PHE 26 -1.702 -3.205 1.858 212 H LEU 27 H LEU 27 -7.639 -7.127 6.119 213 HA LEU 27 HA LEU 27 -7.168 -9.466 7.694 214 1HB LEU 27 1HB LEU 27 -9.737 -9.514 7.744 215 2HB LEU 27 2HB LEU 27 -8.916 -8.180 8.521 216 HG LEU 27 HG LEU 27 -9.394 -6.784 6.495 217 1HD1 LEU 27 1HD1 LEU 27 -11.109 -9.134 5.716 218 2HD1 LEU 27 2HD1 LEU 27 -9.711 -8.515 4.837 219 3HD1 LEU 27 3HD1 LEU 27 -11.171 -7.533 4.976 220 1HD2 LEU 27 1HD2 LEU 27 -11.788 -7.961 7.889 221 2HD2 LEU 27 2HD2 LEU 27 -11.733 -6.415 7.041 222 3HD2 LEU 27 3HD2 LEU 27 -10.769 -6.656 8.501 223 H GLY 28 H GLY 28 -7.648 -8.875 4.419 224 1HA GLY 28 1HA GLY 28 -7.167 -11.104 3.183 225 2HA GLY 28 2HA GLY 28 -8.721 -11.551 3.876 226 H GLY 29 H GLY 29 -7.378 -8.706 2.192 227 1HA GLY 29 1HA GLY 29 -9.922 -8.303 0.847 228 2HA GLY 29 2HA GLY 29 -8.530 -7.233 0.787 229 H ILE 30 H ILE 30 -6.582 -9.049 -0.061 230 HA ILE 30 HA ILE 30 -7.364 -9.390 -2.854 231 HB ILE 30 HB ILE 30 -4.623 -9.710 -1.589 232 1HG1 ILE 30 1HG1 ILE 30 -4.261 -7.470 -2.884 233 2HG1 ILE 30 2HG1 ILE 30 -6.006 -7.313 -2.749 234 1HG2 ILE 30 1HG2 ILE 30 -3.785 -9.500 -3.875 235 2HG2 ILE 30 2HG2 ILE 30 -5.443 -9.405 -4.472 236 3HG2 ILE 30 3HG2 ILE 30 -4.864 -10.884 -3.706 237 1HD1 ILE 30 1HD1 ILE 30 -4.078 -7.589 -0.453 238 2HD1 ILE 30 2HD1 ILE 30 -5.830 -7.424 -0.319 239 3HD1 ILE 30 3HD1 ILE 30 -4.868 -6.103 -0.980 240 H ASP 31 H ASP 31 -7.235 -11.389 -3.918 241 HA ASP 31 HA ASP 31 -7.632 -13.731 -2.342 242 1HB ASP 31 1HB ASP 31 -8.691 -13.492 -4.537 243 2HB ASP 31 2HB ASP 31 -7.110 -13.450 -5.312 244 H LYS 32 H LYS 32 -6.290 -15.462 -2.003 245 HA LYS 32 HA LYS 32 -3.568 -14.622 -1.660 246 1HB LYS 32 1HB LYS 32 -3.343 -16.680 -0.338 247 2HB LYS 32 2HB LYS 32 -4.734 -15.724 0.156 248 1HG LYS 32 1HG LYS 32 -6.151 -17.228 -1.272 249 2HG LYS 32 2HG LYS 32 -4.728 -18.250 -1.472 250 1HD LYS 32 1HD LYS 32 -6.064 -17.538 1.138 251 2HD LYS 32 2HD LYS 32 -6.152 -19.094 0.313 252 1HE LYS 32 1HE LYS 32 -3.722 -19.353 0.579 253 2HE LYS 32 2HE LYS 32 -3.660 -17.810 1.432 254 1HZ LYS 32 1HZ LYS 32 -5.102 -20.253 2.310 255 2HZ LYS 32 2HZ LYS 32 -5.154 -18.762 3.115 256 3HZ LYS 32 3HZ LYS 32 -3.694 -19.614 2.997 257 H GLU 33 H GLU 33 -5.127 -16.302 -4.156 258 HA GLU 33 HA GLU 33 -2.596 -17.644 -4.833 259 1HB GLU 33 1HB GLU 33 -5.419 -18.597 -5.236 260 2HB GLU 33 2HB GLU 33 -4.051 -19.301 -6.082 261 1HG GLU 33 1HG GLU 33 -3.015 -19.804 -3.888 262 2HG GLU 33 2HG GLU 33 -4.486 -19.225 -3.111 263 H THR 34 H THR 34 -5.442 -16.000 -6.159 264 HA THR 34 HA THR 34 -4.182 -15.962 -8.793 265 HB THR 34 HB THR 34 -6.312 -14.827 -9.505 266 HG1 THR 34 HG1 THR 34 -7.079 -15.449 -6.815 267 1HG2 THR 34 1HG2 THR 34 -6.579 -17.498 -8.121 268 2HG2 THR 34 2HG2 THR 34 -6.021 -17.231 -9.773 269 3HG2 THR 34 3HG2 THR 34 -7.689 -16.860 -9.333 270 H GLY 35 H GLY 35 -4.476 -13.961 -6.040 271 1HA GLY 35 1HA GLY 35 -3.507 -11.904 -5.617 272 2HA GLY 35 2HA GLY 35 -2.921 -11.885 -7.276 273 H ILE 36 H ILE 36 -6.217 -12.521 -7.103 274 HA ILE 36 HA ILE 36 -6.841 -9.903 -8.190 275 HB ILE 36 HB ILE 36 -8.657 -12.283 -7.750 276 1HG1 ILE 36 1HG1 ILE 36 -6.806 -12.795 -9.298 277 2HG1 ILE 36 2HG1 ILE 36 -8.360 -12.771 -10.121 278 1HG2 ILE 36 1HG2 ILE 36 -9.894 -10.209 -7.926 279 2HG2 ILE 36 2HG2 ILE 36 -10.127 -11.180 -9.381 280 3HG2 ILE 36 3HG2 ILE 36 -9.034 -9.796 -9.411 281 1HD1 ILE 36 1HD1 ILE 36 -6.649 -11.726 -11.469 282 2HD1 ILE 36 2HD1 ILE 36 -6.290 -10.588 -10.171 283 3HD1 ILE 36 3HD1 ILE 36 -7.857 -10.539 -10.979 284 H VAL 37 H VAL 37 -7.883 -8.313 -7.091 285 HA VAL 37 HA VAL 37 -8.244 -8.538 -4.285 286 HB VAL 37 HB VAL 37 -9.406 -6.304 -4.506 287 1HG1 VAL 37 1HG1 VAL 37 -6.665 -6.642 -5.716 288 2HG1 VAL 37 2HG1 VAL 37 -7.052 -6.431 -4.007 289 3HG1 VAL 37 3HG1 VAL 37 -7.334 -5.114 -5.145 290 1HG2 VAL 37 1HG2 VAL 37 -9.227 -5.152 -6.667 291 2HG2 VAL 37 2HG2 VAL 37 -10.280 -6.563 -6.763 292 3HG2 VAL 37 3HG2 VAL 37 -8.639 -6.641 -7.407 293 H LYS 38 H LYS 38 -9.911 -9.216 -3.133 294 HA LYS 38 HA LYS 38 -12.398 -9.976 -4.417 295 1HB LYS 38 1HB LYS 38 -11.625 -10.046 -1.489 296 2HB LYS 38 2HB LYS 38 -13.040 -10.805 -2.197 297 1HG LYS 38 1HG LYS 38 -10.214 -11.545 -2.914 298 2HG LYS 38 2HG LYS 38 -11.154 -12.349 -1.659 299 1HD LYS 38 1HD LYS 38 -12.892 -12.818 -3.434 300 2HD LYS 38 2HD LYS 38 -11.710 -12.257 -4.617 301 1HE LYS 38 1HE LYS 38 -10.136 -13.970 -3.859 302 2HE LYS 38 2HE LYS 38 -11.311 -14.527 -2.671 303 1HZ LYS 38 1HZ LYS 38 -12.812 -15.094 -4.509 304 2HZ LYS 38 2HZ LYS 38 -11.343 -15.936 -4.607 305 3HZ LYS 38 3HZ LYS 38 -11.627 -14.611 -5.627 306 H GLU 39 H GLU 39 -11.137 -7.552 -2.235 307 HA GLU 39 HA GLU 39 -13.769 -6.334 -1.936 308 1HB GLU 39 1HB GLU 39 -12.163 -6.653 0.013 309 2HB GLU 39 2HB GLU 39 -11.190 -5.385 -0.720 310 1HG GLU 39 1HG GLU 39 -12.572 -4.447 1.000 311 2HG GLU 39 2HG GLU 39 -13.101 -3.855 -0.573 312 H ASP 40 H ASP 40 -14.095 -5.510 -3.943 313 HA ASP 40 HA ASP 40 -12.729 -3.004 -4.506 314 1HB ASP 40 1HB ASP 40 -11.728 -5.037 -5.795 315 2HB ASP 40 2HB ASP 40 -13.193 -4.923 -6.757 316 H CYS 41 H CYS 41 -13.984 -2.547 -6.959 317 HA CYS 41 HA CYS 41 -16.797 -2.957 -6.787 318 1HB CYS 41 1HB CYS 41 -16.496 -1.368 -4.905 319 2HB CYS 41 2HB CYS 41 -15.786 -0.209 -6.023 320 HG CYS 41 HG CYS 41 -18.254 0.796 -5.595 321 H GLU 42 H GLU 42 -14.130 -0.971 -7.980 322 HA GLU 42 HA GLU 42 -15.700 -0.374 -10.389 323 1HB GLU 42 1HB GLU 42 -14.860 1.573 -9.178 324 2HB GLU 42 2HB GLU 42 -13.216 0.961 -9.308 325 1HG GLU 42 1HG GLU 42 -13.218 1.267 -11.677 326 2HG GLU 42 2HG GLU 42 -14.936 1.661 -11.674 327 H ILE 43 H ILE 43 -12.479 -1.485 -9.362 328 HA ILE 43 HA ILE 43 -11.988 -2.293 -12.156 329 HB ILE 43 HB ILE 43 -9.547 -2.228 -11.534 330 1HG1 ILE 43 1HG1 ILE 43 -10.626 -0.741 -9.128 331 2HG1 ILE 43 2HG1 ILE 43 -9.796 -2.294 -9.098 332 1HG2 ILE 43 1HG2 ILE 43 -10.564 -0.493 -12.877 333 2HG2 ILE 43 2HG2 ILE 43 -9.387 0.215 -11.773 334 3HG2 ILE 43 3HG2 ILE 43 -11.111 0.348 -11.425 335 1HD1 ILE 43 1HD1 ILE 43 -8.298 -0.536 -8.420 336 2HD1 ILE 43 2HD1 ILE 43 -8.616 0.352 -9.911 337 3HD1 ILE 43 3HD1 ILE 43 -7.775 -1.198 -9.968 338 H LYS 44 H LYS 44 -13.190 -3.666 -9.673 339 HA LYS 44 HA LYS 44 -11.654 -5.752 -8.786 340 1HB LYS 44 1HB LYS 44 -13.829 -5.389 -7.860 341 2HB LYS 44 2HB LYS 44 -14.607 -5.694 -9.402 342 1HG LYS 44 1HG LYS 44 -13.990 -8.022 -9.304 343 2HG LYS 44 2HG LYS 44 -13.047 -7.743 -7.841 344 1HD LYS 44 1HD LYS 44 -16.020 -7.312 -8.072 345 2HD LYS 44 2HD LYS 44 -15.267 -8.765 -7.412 346 1HE LYS 44 1HE LYS 44 -14.149 -7.356 -5.709 347 2HE LYS 44 2HE LYS 44 -15.020 -5.959 -6.336 348 1HZ LYS 44 1HZ LYS 44 -16.292 -8.393 -5.206 349 2HZ LYS 44 2HZ LYS 44 -17.096 -6.997 -5.741 350 3HZ LYS 44 3HZ LYS 44 -16.092 -6.926 -4.380 351 H GLY 45 H GLY 45 -10.831 -7.548 -9.578 352 1HA GLY 45 1HA GLY 45 -11.033 -9.429 -11.169 353 2HA GLY 45 2HA GLY 45 -11.474 -8.226 -12.378 354 H GLU 46 H GLU 46 -9.303 -6.624 -10.668 355 HA GLU 46 HA GLU 46 -7.146 -7.323 -12.499 356 1HB GLU 46 1HB GLU 46 -7.552 -4.987 -10.631 357 2HB GLU 46 2HB GLU 46 -6.088 -5.232 -11.572 358 1HG GLU 46 1HG GLU 46 -8.850 -4.908 -12.721 359 2HG GLU 46 2HG GLU 46 -7.646 -3.628 -12.594 360 H SER 47 H SER 47 -5.124 -7.935 -11.840 361 HA SER 47 HA SER 47 -4.949 -8.961 -9.102 362 1HB SER 47 1HB SER 47 -4.462 -10.524 -10.966 363 2HB SER 47 2HB SER 47 -3.156 -9.467 -11.498 364 HG SER 47 HG SER 47 -3.176 -11.335 -9.530 365 H VAL 48 H VAL 48 -3.196 -8.414 -7.765 366 HA VAL 48 HA VAL 48 -2.057 -5.797 -8.324 367 HB VAL 48 HB VAL 48 -1.125 -5.966 -6.012 368 1HG1 VAL 48 1HG1 VAL 48 -3.266 -4.891 -6.400 369 2HG1 VAL 48 2HG1 VAL 48 -3.298 -5.773 -4.872 370 3HG1 VAL 48 3HG1 VAL 48 -4.092 -6.445 -6.297 371 1HG2 VAL 48 1HG2 VAL 48 -1.935 -7.773 -4.554 372 2HG2 VAL 48 2HG2 VAL 48 -0.905 -8.380 -5.850 373 3HG2 VAL 48 3HG2 VAL 48 -2.654 -8.566 -5.955 374 H ALA 49 H ALA 49 -1.258 -8.739 -9.276 375 HA ALA 49 HA ALA 49 1.421 -9.104 -8.509 376 1HB ALA 49 1HB ALA 49 1.476 -10.839 -10.181 377 2HB ALA 49 2HB ALA 49 0.012 -10.209 -10.933 378 3HB ALA 49 3HB ALA 49 -0.060 -10.909 -9.318 379 H GLY 50 H GLY 50 2.471 -7.170 -8.863 380 1HA GLY 50 1HA GLY 50 4.378 -6.657 -10.271 381 2HA GLY 50 2HA GLY 50 3.362 -6.942 -11.670 382 H ARG 51 H ARG 51 1.625 -5.245 -9.379 383 HA ARG 51 HA ARG 51 2.415 -2.686 -10.583 384 1HB ARG 51 1HB ARG 51 -0.098 -2.089 -10.199 385 2HB ARG 51 2HB ARG 51 0.377 -2.990 -11.631 386 1HG ARG 51 1HG ARG 51 -0.409 -5.024 -10.716 387 2HG ARG 51 2HG ARG 51 -0.610 -4.307 -9.120 388 1HD ARG 51 1HD ARG 51 -2.745 -4.601 -10.289 389 2HD ARG 51 2HD ARG 51 -2.404 -2.912 -9.929 390 HE ARG 51 HE ARG 51 -1.738 -2.718 -12.326 391 1HH1 ARG 51 1HH1 ARG 51 -3.773 -5.406 -11.381 392 2HH1 ARG 51 2HH1 ARG 51 -4.681 -5.403 -12.865 393 1HH2 ARG 51 1HH2 ARG 51 -2.947 -2.716 -14.279 394 2HH2 ARG 51 2HH2 ARG 51 -4.246 -3.869 -14.482 395 H ILE 52 H ILE 52 1.177 -0.868 -9.203 396 HA ILE 52 HA ILE 52 2.112 -1.326 -6.452 397 HB ILE 52 HB ILE 52 1.983 1.211 -8.091 398 1HG1 ILE 52 1HG1 ILE 52 4.303 -0.294 -6.862 399 2HG1 ILE 52 2HG1 ILE 52 3.873 -0.289 -8.569 400 1HG2 ILE 52 1HG2 ILE 52 2.953 2.355 -6.139 401 2HG2 ILE 52 2HG2 ILE 52 2.742 0.886 -5.187 402 3HG2 ILE 52 3HG2 ILE 52 1.332 1.742 -5.812 403 1HD1 ILE 52 1HD1 ILE 52 4.764 2.088 -6.961 404 2HD1 ILE 52 2HD1 ILE 52 4.325 2.106 -8.670 405 3HD1 ILE 52 3HD1 ILE 52 5.734 1.192 -8.129 406 H LEU 53 H LEU 53 0.728 -1.090 -4.810 407 HA LEU 53 HA LEU 53 -2.066 -0.552 -5.501 408 1HB LEU 53 1HB LEU 53 -1.520 -2.671 -4.382 409 2HB LEU 53 2HB LEU 53 -0.838 -1.787 -3.033 410 HG LEU 53 HG LEU 53 -3.076 -0.846 -2.544 411 1HD1 LEU 53 1HD1 LEU 53 -4.023 -0.970 -4.789 412 2HD1 LEU 53 2HD1 LEU 53 -5.041 -1.814 -3.623 413 3HD1 LEU 53 3HD1 LEU 53 -3.999 -2.731 -4.709 414 1HD2 LEU 53 1HD2 LEU 53 -4.044 -2.929 -1.673 415 2HD2 LEU 53 2HD2 LEU 53 -2.311 -2.829 -1.373 416 3HD2 LEU 53 3HD2 LEU 53 -2.923 -3.854 -2.669 417 H VAL 54 H VAL 54 -2.986 1.314 -4.987 418 HA VAL 54 HA VAL 54 -1.851 2.872 -2.754 419 HB VAL 54 HB VAL 54 -3.066 4.002 -5.287 420 1HG1 VAL 54 1HG1 VAL 54 -3.471 5.399 -3.334 421 2HG1 VAL 54 2HG1 VAL 54 -2.314 6.165 -4.424 422 3HG1 VAL 54 3HG1 VAL 54 -1.750 5.379 -2.948 423 1HG2 VAL 54 1HG2 VAL 54 -0.798 4.797 -5.797 424 2HG2 VAL 54 2HG2 VAL 54 -0.876 3.035 -5.734 425 3HG2 VAL 54 3HG2 VAL 54 -0.186 3.937 -4.383 426 H PHE 55 H PHE 55 -3.272 2.646 -1.134 427 HA PHE 55 HA PHE 55 -6.012 3.518 -1.683 428 1HB PHE 55 1HB PHE 55 -6.942 1.876 -0.133 429 2HB PHE 55 2HB PHE 55 -6.101 1.073 -1.451 430 HD1 PHE 55 HD1 PHE 55 -6.208 1.676 2.127 431 HD2 PHE 55 HD2 PHE 55 -3.969 -0.071 -1.043 432 HE1 PHE 55 HE1 PHE 55 -4.923 0.365 3.763 433 HE2 PHE 55 HE2 PHE 55 -2.677 -1.382 0.588 434 HZ PHE 55 HZ PHE 55 -3.154 -1.168 2.996 435 HA PRO 56 HA PRO 56 -5.190 6.212 1.737 436 1HB PRO 56 1HB PRO 56 -8.059 6.524 2.126 437 2HB PRO 56 2HB PRO 56 -6.892 7.685 1.486 438 1HG PRO 56 1HG PRO 56 -8.813 6.523 -0.039 439 2HG PRO 56 2HG PRO 56 -7.247 7.041 -0.684 440 1HD PRO 56 1HD PRO 56 -8.166 4.295 0.087 441 2HD PRO 56 2HD PRO 56 -7.201 4.808 -1.315 442 H GLY 57 H GLY 57 -7.725 3.771 2.080 443 1HA GLY 57 1HA GLY 57 -6.746 2.756 4.520 444 2HA GLY 57 2HA GLY 57 -8.082 3.857 4.843 445 H GLY 58 H GLY 58 -9.080 1.810 5.691 446 1HA GLY 58 1HA GLY 58 -10.892 0.792 3.747 447 2HA GLY 58 2HA GLY 58 -9.671 -0.403 4.154 448 H LYS 59 H LYS 59 -10.667 -1.859 5.356 449 HA LYS 59 HA LYS 59 -12.869 -1.308 7.065 450 1HB LYS 59 1HB LYS 59 -11.102 -3.758 7.117 451 2HB LYS 59 2HB LYS 59 -12.766 -3.638 7.663 452 1HG LYS 59 1HG LYS 59 -11.930 -3.269 4.797 453 2HG LYS 59 2HG LYS 59 -12.418 -4.818 5.482 454 1HD LYS 59 1HD LYS 59 -14.602 -3.855 6.061 455 2HD LYS 59 2HD LYS 59 -14.105 -2.319 5.345 456 1HE LYS 59 1HE LYS 59 -13.919 -3.329 3.173 457 2HE LYS 59 2HE LYS 59 -14.202 -4.933 3.844 458 1HZ LYS 59 1HZ LYS 59 -16.434 -4.285 4.424 459 2HZ LYS 59 2HZ LYS 59 -16.179 -4.015 2.769 460 3HZ LYS 59 3HZ LYS 59 -16.174 -2.709 3.852 461 H GLY 60 H GLY 60 -12.928 -1.707 9.400 462 1HA GLY 60 1HA GLY 60 -10.673 -0.438 10.705 463 2HA GLY 60 2HA GLY 60 -12.203 -0.882 11.450 464 H SER 61 H SER 61 -12.004 -3.633 10.390 465 HA SER 61 HA SER 61 -10.475 -4.774 12.527 466 1HB SER 61 1HB SER 61 -11.828 -6.152 10.192 467 2HB SER 61 2HB SER 61 -11.271 -6.920 11.678 468 HG SER 61 HG SER 61 -12.779 -5.634 12.821 469 H THR 62 H THR 62 -8.438 -3.780 11.846 470 HA THR 62 HA THR 62 -7.201 -4.700 9.403 471 HB THR 62 HB THR 62 -6.894 -2.385 10.157 472 HG1 THR 62 HG1 THR 62 -4.414 -3.771 10.317 473 1HG2 THR 62 1HG2 THR 62 -5.472 -1.868 12.084 474 2HG2 THR 62 2HG2 THR 62 -5.385 -3.585 12.477 475 3HG2 THR 62 3HG2 THR 62 -6.928 -2.738 12.570 476 H VAL 63 H VAL 63 -7.781 -6.875 10.984 477 HA VAL 63 HA VAL 63 -5.154 -7.632 12.083 478 HB VAL 63 HB VAL 63 -7.803 -8.906 12.768 479 1HG1 VAL 63 1HG1 VAL 63 -5.084 -9.148 14.044 480 2HG1 VAL 63 2HG1 VAL 63 -5.884 -10.372 13.059 481 3HG1 VAL 63 3HG1 VAL 63 -6.565 -9.915 14.621 482 1HG2 VAL 63 1HG2 VAL 63 -7.646 -7.721 14.914 483 2HG2 VAL 63 2HG2 VAL 63 -7.795 -6.605 13.556 484 3HG2 VAL 63 3HG2 VAL 63 -6.226 -6.857 14.323 485 H GLY 64 H GLY 64 -4.093 -9.224 11.240 486 1HA GLY 64 1HA GLY 64 -4.695 -11.603 10.256 487 2HA GLY 64 2HA GLY 64 -5.183 -10.576 8.909 488 H SER 65 H SER 65 -3.552 -9.052 8.103 489 HA SER 65 HA SER 65 -1.598 -8.781 6.961 490 1HB SER 65 1HB SER 65 -0.960 -8.086 9.306 491 2HB SER 65 2HB SER 65 -0.294 -9.701 9.531 492 HG SER 65 HG SER 65 0.838 -7.572 8.369 493 H TYR 66 H TYR 66 0.876 -10.091 7.147 494 HA TYR 66 HA TYR 66 2.080 -11.905 6.569 495 1HB TYR 66 1HB TYR 66 -0.327 -13.366 7.631 496 2HB TYR 66 2HB TYR 66 1.090 -14.204 7.008 497 HD1 TYR 66 HD1 TYR 66 3.098 -14.361 8.299 498 HD2 TYR 66 HD2 TYR 66 -0.127 -11.943 9.664 499 HE1 TYR 66 HE1 TYR 66 4.188 -14.156 10.494 500 HE2 TYR 66 HE2 TYR 66 0.953 -11.733 11.862 501 HH TYR 66 HH TYR 66 4.211 -12.747 12.422 502 H VAL 67 H VAL 67 -1.162 -11.769 5.243 503 HA VAL 67 HA VAL 67 -0.934 -13.628 3.201 504 HB VAL 67 HB VAL 67 -2.659 -12.299 1.987 505 1HG1 VAL 67 1HG1 VAL 67 -3.300 -13.944 3.665 506 2HG1 VAL 67 2HG1 VAL 67 -4.403 -12.569 3.681 507 3HG1 VAL 67 3HG1 VAL 67 -3.168 -12.724 4.931 508 1HG2 VAL 67 1HG2 VAL 67 -3.617 -10.325 3.085 509 2HG2 VAL 67 2HG2 VAL 67 -1.942 -10.056 2.608 510 3HG2 VAL 67 3HG2 VAL 67 -2.337 -10.379 4.296 511 H LEU 68 H LEU 68 0.360 -10.373 3.350 512 HA LEU 68 HA LEU 68 0.942 -9.979 0.642 513 1HB LEU 68 1HB LEU 68 2.264 -8.986 3.152 514 2HB LEU 68 2HB LEU 68 2.907 -8.585 1.574 515 HG LEU 68 HG LEU 68 1.579 -6.753 2.343 516 1HD1 LEU 68 1HD1 LEU 68 1.453 -7.236 -0.032 517 2HD1 LEU 68 2HD1 LEU 68 -0.073 -6.576 0.553 518 3HD1 LEU 68 3HD1 LEU 68 0.078 -8.305 0.243 519 1HD2 LEU 68 1HD2 LEU 68 -0.806 -6.982 2.861 520 2HD2 LEU 68 2HD2 LEU 68 0.207 -7.904 3.973 521 3HD2 LEU 68 3HD2 LEU 68 -0.665 -8.733 2.684 522 H LEU 69 H LEU 69 2.729 -11.648 3.178 523 HA LEU 69 HA LEU 69 5.074 -12.153 1.701 524 1HB LEU 69 1HB LEU 69 4.957 -12.380 4.137 525 2HB LEU 69 2HB LEU 69 3.839 -13.719 3.971 526 HG LEU 69 HG LEU 69 5.622 -15.030 2.851 527 1HD1 LEU 69 1HD1 LEU 69 6.943 -13.200 1.959 528 2HD1 LEU 69 2HD1 LEU 69 7.932 -14.235 2.988 529 3HD1 LEU 69 3HD1 LEU 69 7.358 -12.684 3.592 530 1HD2 LEU 69 1HD2 LEU 69 5.223 -15.306 5.221 531 2HD2 LEU 69 2HD2 LEU 69 6.282 -13.944 5.584 532 3HD2 LEU 69 3HD2 LEU 69 6.950 -15.420 4.883 533 H ASN 70 H ASN 70 2.102 -14.014 2.174 534 HA ASN 70 HA ASN 70 2.864 -16.307 0.733 535 1HB ASN 70 1HB ASN 70 0.868 -16.097 2.269 536 2HB ASN 70 2HB ASN 70 0.054 -15.217 0.977 537 1HD2 ASN 70 1HD2 ASN 70 -0.567 -16.328 -0.896 538 2HD2 ASN 70 2HD2 ASN 70 -0.616 -18.057 -0.965 539 H LEU 71 H LEU 71 1.122 -13.381 -0.243 540 HA LEU 71 HA LEU 71 0.668 -14.056 -2.919 541 1HB LEU 71 1HB LEU 71 1.198 -11.331 -1.728 542 2HB LEU 71 2HB LEU 71 0.492 -11.625 -3.304 543 HG LEU 71 HG LEU 71 -0.756 -12.388 -0.663 544 1HD1 LEU 71 1HD1 LEU 71 -2.366 -10.613 -1.185 545 2HD1 LEU 71 2HD1 LEU 71 -1.414 -10.176 -2.603 546 3HD1 LEU 71 3HD1 LEU 71 -0.731 -9.983 -0.990 547 1HD2 LEU 71 1HD2 LEU 71 -1.809 -12.570 -3.482 548 2HD2 LEU 71 2HD2 LEU 71 -2.743 -12.882 -2.018 549 3HD2 LEU 71 3HD2 LEU 71 -1.382 -13.925 -2.436 550 H ARG 72 H ARG 72 3.451 -12.597 -1.333 551 HA ARG 72 HA ARG 72 4.813 -11.874 -3.710 552 1HB ARG 72 1HB ARG 72 5.098 -11.270 -1.088 553 2HB ARG 72 2HB ARG 72 6.406 -12.426 -1.285 554 1HG ARG 72 1HG ARG 72 6.040 -9.997 -3.019 555 2HG ARG 72 2HG ARG 72 7.057 -10.043 -1.582 556 1HD ARG 72 1HD ARG 72 8.323 -11.920 -2.637 557 2HD ARG 72 2HD ARG 72 7.378 -11.659 -4.103 558 HE ARG 72 HE ARG 72 9.042 -9.522 -2.940 559 1HH1 ARG 72 1HH1 ARG 72 8.043 -11.503 -5.638 560 2HH1 ARG 72 2HH1 ARG 72 9.012 -10.653 -6.805 561 1HH2 ARG 72 1HH2 ARG 72 10.369 -8.409 -4.460 562 2HH2 ARG 72 2HH2 ARG 72 10.338 -8.906 -6.125 563 H LYS 73 H LYS 73 4.896 -14.726 -1.633 564 HA LYS 73 HA LYS 73 7.114 -15.950 -2.926 565 1HB LYS 73 1HB LYS 73 4.890 -17.213 -1.311 566 2HB LYS 73 2HB LYS 73 6.392 -18.005 -1.759 567 1HG LYS 73 1HG LYS 73 6.147 -15.578 0.005 568 2HG LYS 73 2HG LYS 73 6.416 -17.232 0.551 569 1HD LYS 73 1HD LYS 73 8.270 -15.714 -1.278 570 2HD LYS 73 2HD LYS 73 8.481 -15.856 0.467 571 1HE LYS 73 1HE LYS 73 8.598 -18.306 0.233 572 2HE LYS 73 2HE LYS 73 8.443 -18.133 -1.515 573 1HZ LYS 73 1HZ LYS 73 10.644 -16.995 0.124 574 2HZ LYS 73 2HZ LYS 73 10.506 -16.915 -1.569 575 3HZ LYS 73 3HZ LYS 73 10.749 -18.408 -0.805 576 H ASN 74 H ASN 74 3.723 -15.785 -3.598 577 HA ASN 74 HA ASN 74 3.802 -17.977 -5.503 578 1HB ASN 74 1HB ASN 74 1.802 -17.606 -4.091 579 2HB ASN 74 2HB ASN 74 1.570 -16.036 -4.851 580 1HD2 ASN 74 1HD2 ASN 74 -0.431 -16.550 -5.658 581 2HD2 ASN 74 2HD2 ASN 74 -0.666 -17.660 -6.961 582 H GLY 75 H GLY 75 4.190 -14.560 -5.458 583 1HA GLY 75 1HA GLY 75 5.119 -13.306 -7.217 584 2HA GLY 75 2HA GLY 75 4.649 -14.572 -8.341 585 H VAL 76 H VAL 76 2.300 -13.499 -6.079 586 HA VAL 76 HA VAL 76 0.970 -11.954 -8.205 587 HB VAL 76 HB VAL 76 -1.198 -12.628 -7.174 588 1HG1 VAL 76 1HG1 VAL 76 -1.208 -14.905 -8.095 589 2HG1 VAL 76 2HG1 VAL 76 0.555 -14.890 -8.138 590 3HG1 VAL 76 3HG1 VAL 76 -0.360 -13.774 -9.151 591 1HG2 VAL 76 1HG2 VAL 76 -0.374 -13.184 -4.937 592 2HG2 VAL 76 2HG2 VAL 76 0.513 -14.558 -5.597 593 3HG2 VAL 76 3HG2 VAL 76 -1.249 -14.540 -5.647 594 H ALA 77 H ALA 77 2.779 -11.117 -5.993 595 HA ALA 77 HA ALA 77 1.002 -9.514 -4.316 596 1HB ALA 77 1HB ALA 77 3.995 -9.874 -4.219 597 2HB ALA 77 2HB ALA 77 2.815 -10.704 -3.205 598 3HB ALA 77 3HB ALA 77 3.031 -8.961 -3.058 599 HA PRO 78 HA PRO 78 1.909 -5.789 -6.565 600 1HB PRO 78 1HB PRO 78 1.731 -3.919 -4.628 601 2HB PRO 78 2HB PRO 78 0.314 -4.768 -5.253 602 1HG PRO 78 1HG PRO 78 1.836 -5.225 -2.727 603 2HG PRO 78 2HG PRO 78 0.088 -5.290 -3.012 604 1HD PRO 78 1HD PRO 78 1.719 -7.499 -2.860 605 2HD PRO 78 2HD PRO 78 0.169 -7.460 -3.721 606 H LYS 79 H LYS 79 3.586 -4.308 -6.966 607 HA LYS 79 HA LYS 79 6.128 -5.122 -5.946 608 1HB LYS 79 1HB LYS 79 5.268 -2.979 -7.869 609 2HB LYS 79 2HB LYS 79 6.940 -3.203 -7.398 610 1HG LYS 79 1HG LYS 79 6.725 -5.585 -8.191 611 2HG LYS 79 2HG LYS 79 5.170 -5.116 -8.883 612 1HD LYS 79 1HD LYS 79 6.271 -3.416 -10.232 613 2HD LYS 79 2HD LYS 79 7.826 -3.831 -9.513 614 1HE LYS 79 1HE LYS 79 7.549 -6.136 -10.431 615 2HE LYS 79 2HE LYS 79 6.102 -5.571 -11.266 616 1HZ LYS 79 1HZ LYS 79 7.495 -3.930 -12.428 617 2HZ LYS 79 2HZ LYS 79 7.988 -5.518 -12.744 618 3HZ LYS 79 3HZ LYS 79 8.872 -4.560 -11.663 619 H ALA 80 H ALA 80 3.934 -2.486 -5.337 620 HA ALA 80 HA ALA 80 5.376 -1.796 -2.943 621 1HB ALA 80 1HB ALA 80 5.744 0.541 -3.478 622 2HB ALA 80 2HB ALA 80 5.086 0.295 -5.096 623 3HB ALA 80 3HB ALA 80 6.598 -0.487 -4.631 624 H ILE 81 H ILE 81 4.197 -0.182 -1.650 625 HA ILE 81 HA ILE 81 1.407 0.248 -2.459 626 HB ILE 81 HB ILE 81 2.216 -0.913 0.223 627 1HG1 ILE 81 1HG1 ILE 81 0.536 -2.098 -2.001 628 2HG1 ILE 81 2HG1 ILE 81 2.185 -2.573 -1.612 629 1HG2 ILE 81 1HG2 ILE 81 -0.163 -0.927 0.750 630 2HG2 ILE 81 2HG2 ILE 81 -0.523 -0.168 -0.800 631 3HG2 ILE 81 3HG2 ILE 81 0.393 0.714 0.421 632 1HD1 ILE 81 1HD1 ILE 81 0.591 -4.165 -0.729 633 2HD1 ILE 81 2HD1 ILE 81 -0.217 -2.885 0.173 634 3HD1 ILE 81 3HD1 ILE 81 1.435 -3.345 0.585 635 H ILE 82 H ILE 82 0.761 2.285 -2.029 636 HA ILE 82 HA ILE 82 2.335 3.848 -0.076 637 HB ILE 82 HB ILE 82 0.762 5.191 -2.251 638 1HG1 ILE 82 1HG1 ILE 82 2.209 3.543 -3.409 639 2HG1 ILE 82 2HG1 ILE 82 2.691 5.204 -3.737 640 1HG2 ILE 82 1HG2 ILE 82 2.459 6.944 -1.954 641 2HG2 ILE 82 2HG2 ILE 82 3.290 5.936 -0.767 642 3HG2 ILE 82 3HG2 ILE 82 1.667 6.545 -0.428 643 1HD1 ILE 82 1HD1 ILE 82 4.025 3.335 -1.790 644 2HD1 ILE 82 2HD1 ILE 82 4.514 4.993 -2.138 645 3HD1 ILE 82 3HD1 ILE 82 4.616 3.762 -3.395 646 H ASN 83 H ASN 83 1.209 4.589 1.634 647 HA ASN 83 HA ASN 83 -1.737 4.487 1.470 648 1HB ASN 83 1HB ASN 83 0.030 3.783 3.823 649 2HB ASN 83 2HB ASN 83 -1.721 3.919 3.901 650 1HD2 ASN 83 1HD2 ASN 83 -2.102 2.749 1.258 651 2HD2 ASN 83 2HD2 ASN 83 -1.810 1.057 1.449 652 H LYS 84 H LYS 84 -2.884 5.928 2.908 653 HA LYS 84 HA LYS 84 -1.425 8.389 3.508 654 1HB LYS 84 1HB LYS 84 -3.619 8.587 2.384 655 2HB LYS 84 2HB LYS 84 -4.384 7.783 3.747 656 1HG LYS 84 1HG LYS 84 -4.726 10.147 3.943 657 2HG LYS 84 2HG LYS 84 -3.616 9.621 5.212 658 1HD LYS 84 1HD LYS 84 -1.836 10.233 3.313 659 2HD LYS 84 2HD LYS 84 -3.130 11.332 2.847 660 1HE LYS 84 1HE LYS 84 -1.712 12.532 4.323 661 2HE LYS 84 2HE LYS 84 -3.172 12.136 5.228 662 1HZ LYS 84 1HZ LYS 84 -2.001 10.312 6.280 663 2HZ LYS 84 2HZ LYS 84 -1.142 11.750 6.520 664 3HZ LYS 84 3HZ LYS 84 -0.607 10.626 5.370 665 H LYS 85 H LYS 85 -3.254 5.819 5.028 666 HA LYS 85 HA LYS 85 -1.938 6.496 7.559 667 1HB LYS 85 1HB LYS 85 -4.326 7.222 7.628 668 2HB LYS 85 2HB LYS 85 -4.806 5.555 7.335 669 1HG LYS 85 1HG LYS 85 -3.831 4.860 9.426 670 2HG LYS 85 2HG LYS 85 -3.186 6.478 9.702 671 1HD LYS 85 1HD LYS 85 -5.534 7.332 9.690 672 2HD LYS 85 2HD LYS 85 -6.084 5.656 9.625 673 1HE LYS 85 1HE LYS 85 -6.096 6.531 11.920 674 2HE LYS 85 2HE LYS 85 -4.969 5.187 11.734 675 1HZ LYS 85 1HZ LYS 85 -4.008 7.006 13.025 676 2HZ LYS 85 2HZ LYS 85 -4.221 8.064 11.715 677 3HZ LYS 85 3HZ LYS 85 -3.152 6.758 11.585 678 H THR 86 H THR 86 -0.676 4.867 8.114 679 HA THR 86 HA THR 86 -1.366 2.195 7.102 680 HB THR 86 HB THR 86 0.797 3.178 6.315 681 HG1 THR 86 HG1 THR 86 1.016 1.068 6.154 682 1HG2 THR 86 1HG2 THR 86 1.449 4.384 8.324 683 2HG2 THR 86 2HG2 THR 86 2.696 3.217 7.883 684 3HG2 THR 86 3HG2 THR 86 1.587 2.867 9.210 685 H GLU 87 H GLU 87 -0.323 0.427 8.554 686 HA GLU 87 HA GLU 87 -0.828 1.003 11.383 687 1HB GLU 87 1HB GLU 87 -2.836 -0.011 9.920 688 2HB GLU 87 2HB GLU 87 -1.974 -1.506 10.232 689 1HG GLU 87 1HG GLU 87 -2.974 0.375 12.362 690 2HG GLU 87 2HG GLU 87 -3.812 -1.075 11.817 691 H THR 88 H THR 88 -0.016 -0.720 12.777 692 HA THR 88 HA THR 88 2.579 -1.506 12.272 693 HB THR 88 HB THR 88 0.726 -3.070 14.060 694 HG1 THR 88 HG1 THR 88 0.276 -1.000 14.648 695 1HG2 THR 88 1HG2 THR 88 2.712 -3.227 15.488 696 2HG2 THR 88 2HG2 THR 88 3.630 -2.267 14.326 697 3HG2 THR 88 3HG2 THR 88 3.039 -3.868 13.877 698 H ILE 89 H ILE 89 -0.407 -3.462 11.926 699 HA ILE 89 HA ILE 89 0.905 -5.851 11.188 700 HB ILE 89 HB ILE 89 -1.227 -6.665 10.394 701 1HG1 ILE 89 1HG1 ILE 89 -3.128 -4.729 10.769 702 2HG1 ILE 89 2HG1 ILE 89 -1.810 -3.801 10.061 703 1HG2 ILE 89 1HG2 ILE 89 -2.639 -6.243 12.375 704 2HG2 ILE 89 2HG2 ILE 89 -1.530 -4.957 12.856 705 3HG2 ILE 89 3HG2 ILE 89 -0.965 -6.626 12.785 706 1HD1 ILE 89 1HD1 ILE 89 -1.758 -5.342 8.159 707 2HD1 ILE 89 2HD1 ILE 89 -3.340 -4.587 8.353 708 3HD1 ILE 89 3HD1 ILE 89 -3.090 -6.254 8.869 709 H ILE 90 H ILE 90 0.054 -3.017 9.394 710 HA ILE 90 HA ILE 90 0.209 -4.206 6.794 711 HB ILE 90 HB ILE 90 0.355 -1.287 7.573 712 1HG1 ILE 90 1HG1 ILE 90 -2.000 -2.994 6.743 713 2HG1 ILE 90 2HG1 ILE 90 -1.722 -2.326 8.347 714 1HG2 ILE 90 1HG2 ILE 90 -0.318 -0.858 5.264 715 2HG2 ILE 90 2HG2 ILE 90 -0.250 -2.586 4.922 716 3HG2 ILE 90 3HG2 ILE 90 1.224 -1.713 5.341 717 1HD1 ILE 90 1HD1 ILE 90 -2.212 -0.723 5.844 718 2HD1 ILE 90 2HD1 ILE 90 -1.982 -0.073 7.470 719 3HD1 ILE 90 3HD1 ILE 90 -3.398 -1.063 7.106 720 H ALA 91 H ALA 91 2.292 -2.042 8.685 721 HA ALA 91 HA ALA 91 4.419 -1.875 6.873 722 1HB ALA 91 1HB ALA 91 5.745 -1.092 8.756 723 2HB ALA 91 2HB ALA 91 4.530 -1.695 9.883 724 3HB ALA 91 3HB ALA 91 4.139 -0.368 8.789 725 H VAL 92 H VAL 92 3.949 -4.052 9.640 726 HA VAL 92 HA VAL 92 6.351 -5.482 9.348 727 HB VAL 92 HB VAL 92 3.719 -6.344 10.564 728 1HG1 VAL 92 1HG1 VAL 92 6.437 -7.638 10.785 729 2HG1 VAL 92 2HG1 VAL 92 5.018 -8.314 9.984 730 3HG1 VAL 92 3HG1 VAL 92 5.015 -8.078 11.732 731 1HG2 VAL 92 1HG2 VAL 92 4.817 -5.822 12.689 732 2HG2 VAL 92 2HG2 VAL 92 4.742 -4.408 11.640 733 3HG2 VAL 92 3HG2 VAL 92 6.256 -5.294 11.817 734 H GLY 93 H GLY 93 3.115 -6.038 8.043 735 1HA GLY 93 1HA GLY 93 3.621 -8.563 6.893 736 2HA GLY 93 2HA GLY 93 2.331 -7.463 6.431 737 H ALA 94 H ALA 94 3.870 -5.293 5.578 738 HA ALA 94 HA ALA 94 4.494 -6.141 2.932 739 1HB ALA 94 1HB ALA 94 3.511 -3.941 3.429 740 2HB ALA 94 2HB ALA 94 5.010 -3.808 2.508 741 3HB ALA 94 3HB ALA 94 5.006 -3.473 4.239 742 H ALA 95 H ALA 95 6.416 -5.155 5.729 743 HA ALA 95 HA ALA 95 8.908 -4.982 4.472 744 1HB ALA 95 1HB ALA 95 8.481 -4.133 6.727 745 2HB ALA 95 2HB ALA 95 9.875 -5.211 6.695 746 3HB ALA 95 3HB ALA 95 8.330 -5.786 7.322 747 H MET 96 H MET 96 7.245 -7.756 5.888 748 HA MET 96 HA MET 96 9.422 -9.548 5.780 749 1HB MET 96 1HB MET 96 6.444 -10.019 5.854 750 2HB MET 96 2HB MET 96 7.615 -11.328 5.882 751 1HG MET 96 1HG MET 96 8.578 -10.390 7.943 752 2HG MET 96 2HG MET 96 7.346 -9.130 7.924 753 1HE MET 96 1HE MET 96 4.756 -9.582 8.283 754 2HE MET 96 2HE MET 96 4.065 -11.195 8.452 755 3HE MET 96 3HE MET 96 4.789 -10.702 6.921 756 H ALA 97 H ALA 97 7.078 -8.563 3.392 757 HA ALA 97 HA ALA 97 7.892 -10.731 1.605 758 1HB ALA 97 1HB ALA 97 5.640 -8.750 1.339 759 2HB ALA 97 2HB ALA 97 5.500 -10.396 1.957 760 3HB ALA 97 3HB ALA 97 5.954 -10.121 0.277 761 H GLU 98 H GLU 98 9.097 -7.807 2.252 762 HA GLU 98 HA GLU 98 10.327 -6.253 1.121 763 1HB GLU 98 1HB GLU 98 11.396 -8.267 0.125 764 2HB GLU 98 2HB GLU 98 10.217 -8.227 -1.174 765 1HG GLU 98 1HG GLU 98 11.095 -5.861 -1.632 766 2HG GLU 98 2HG GLU 98 12.459 -6.319 -0.612 767 H ILE 99 H ILE 99 7.792 -5.627 1.297 768 HA ILE 99 HA ILE 99 6.972 -4.691 -1.375 769 HB ILE 99 HB ILE 99 5.217 -4.872 1.079 770 1HG1 ILE 99 1HG1 ILE 99 5.908 -7.126 0.408 771 2HG1 ILE 99 2HG1 ILE 99 4.205 -6.861 0.046 772 1HG2 ILE 99 1HG2 ILE 99 3.390 -4.622 -0.553 773 2HG2 ILE 99 2HG2 ILE 99 4.585 -4.429 -1.837 774 3HG2 ILE 99 3HG2 ILE 99 4.476 -3.233 -0.545 775 1HD1 ILE 99 1HD1 ILE 99 6.485 -6.793 -1.919 776 2HD1 ILE 99 2HD1 ILE 99 4.799 -6.453 -2.307 777 3HD1 ILE 99 3HD1 ILE 99 5.270 -8.060 -1.753 778 HA PRO 100 HA PRO 100 8.782 -0.896 0.540 779 1HB PRO 100 1HB PRO 100 8.063 -0.063 -2.238 780 2HB PRO 100 2HB PRO 100 9.526 0.273 -1.304 781 1HG PRO 100 1HG PRO 100 9.535 -1.566 -3.226 782 2HG PRO 100 2HG PRO 100 10.431 -1.821 -1.716 783 1HD PRO 100 1HD PRO 100 7.871 -3.038 -2.631 784 2HD PRO 100 2HD PRO 100 9.154 -3.728 -1.618 785 H LEU 101 H LEU 101 7.250 -0.177 1.915 786 HA LEU 101 HA LEU 101 4.839 1.030 0.757 787 1HB LEU 101 1HB LEU 101 4.405 -1.077 1.991 788 2HB LEU 101 2HB LEU 101 5.093 -0.351 3.429 789 HG LEU 101 HG LEU 101 2.809 1.062 2.152 790 1HD1 LEU 101 1HD1 LEU 101 2.532 -1.465 3.770 791 2HD1 LEU 101 2HD1 LEU 101 2.089 -1.258 2.075 792 3HD1 LEU 101 3HD1 LEU 101 1.213 -0.379 3.331 793 1HD2 LEU 101 1HD2 LEU 101 2.249 1.505 4.495 794 2HD2 LEU 101 2HD2 LEU 101 3.908 1.980 4.132 795 3HD2 LEU 101 3HD2 LEU 101 3.592 0.483 5.009 796 H VAL 102 H VAL 102 4.447 3.068 1.239 797 HA VAL 102 HA VAL 102 5.872 4.322 3.478 798 HB VAL 102 HB VAL 102 6.332 6.317 2.060 799 1HG1 VAL 102 1HG1 VAL 102 8.091 4.660 2.478 800 2HG1 VAL 102 2HG1 VAL 102 8.255 5.391 0.883 801 3HG1 VAL 102 3HG1 VAL 102 7.589 3.767 1.044 802 1HG2 VAL 102 1HG2 VAL 102 4.648 5.956 0.346 803 2HG2 VAL 102 2HG2 VAL 102 5.485 4.499 -0.193 804 3HG2 VAL 102 3HG2 VAL 102 6.251 6.077 -0.382 805 H GLU 103 H GLU 103 4.989 6.504 3.975 806 HA GLU 103 HA GLU 103 2.069 6.517 3.588 807 1HB GLU 103 1HB GLU 103 2.999 6.177 5.924 808 2HB GLU 103 2HB GLU 103 3.634 7.813 5.832 809 1HG GLU 103 1HG GLU 103 0.731 7.341 5.357 810 2HG GLU 103 2HG GLU 103 1.355 7.315 7.003 811 H VAL 104 H VAL 104 1.419 8.013 2.185 812 HA VAL 104 HA VAL 104 3.201 10.245 1.581 813 HB VAL 104 HB VAL 104 2.436 8.948 -0.320 814 1HG1 VAL 104 1HG1 VAL 104 -0.348 9.729 0.507 815 2HG1 VAL 104 2HG1 VAL 104 0.339 8.105 0.521 816 3HG1 VAL 104 3HG1 VAL 104 0.081 8.941 -1.009 817 1HG2 VAL 104 1HG2 VAL 104 1.598 10.736 -1.728 818 2HG2 VAL 104 2HG2 VAL 104 2.840 11.346 -0.634 819 3HG2 VAL 104 3HG2 VAL 104 1.138 11.666 -0.304 820 H ARG 105 H ARG 105 2.861 12.240 2.277 821 HA ARG 105 HA ARG 105 0.450 12.729 3.851 822 1HB ARG 105 1HB ARG 105 1.692 14.642 4.771 823 2HB ARG 105 2HB ARG 105 2.579 13.135 4.945 824 1HG ARG 105 1HG ARG 105 4.321 14.016 3.905 825 2HG ARG 105 2HG ARG 105 3.332 14.346 2.481 826 1HD ARG 105 1HD ARG 105 3.542 16.140 4.897 827 2HD ARG 105 2HD ARG 105 4.435 16.365 3.396 828 HE ARG 105 HE ARG 105 1.593 16.220 3.010 829 1HH1 ARG 105 1HH1 ARG 105 4.236 18.355 3.875 830 2HH1 ARG 105 2HH1 ARG 105 3.419 19.795 3.332 831 1HH2 ARG 105 1HH2 ARG 105 0.528 18.097 2.275 832 2HH2 ARG 105 2HH2 ARG 105 1.310 19.640 2.416 833 H ASP 106 H ASP 106 1.021 13.121 0.725 834 HA ASP 106 HA ASP 106 0.021 15.886 0.627 835 1HB ASP 106 1HB ASP 106 2.236 15.335 -0.507 836 2HB ASP 106 2HB ASP 106 1.288 14.432 -1.686 837 H GLU 107 H GLU 107 -1.916 16.266 -0.065 838 HA GLU 107 HA GLU 107 -3.721 14.140 -0.637 839 1HB GLU 107 1HB GLU 107 -4.362 16.138 0.618 840 2HB GLU 107 2HB GLU 107 -4.064 17.135 -0.793 841 1HG GLU 107 1HG GLU 107 -5.862 15.929 -1.980 842 2HG GLU 107 2HG GLU 107 -6.201 15.041 -0.493 843 H LYS 108 H LYS 108 -2.002 16.487 -2.594 844 HA LYS 108 HA LYS 108 -3.599 16.375 -4.901 845 1HB LYS 108 1HB LYS 108 -0.703 17.063 -4.455 846 2HB LYS 108 2HB LYS 108 -1.436 17.117 -6.042 847 1HG LYS 108 1HG LYS 108 -2.748 18.616 -3.840 848 2HG LYS 108 2HG LYS 108 -1.259 19.259 -4.531 849 1HD LYS 108 1HD LYS 108 -2.978 20.274 -5.768 850 2HD LYS 108 2HD LYS 108 -2.385 18.979 -6.805 851 1HE LYS 108 1HE LYS 108 -4.787 19.003 -6.872 852 2HE LYS 108 2HE LYS 108 -4.253 17.556 -6.021 853 1HZ LYS 108 1HZ LYS 108 -4.640 18.811 -3.914 854 2HZ LYS 108 2HZ LYS 108 -6.044 18.481 -4.805 855 3HZ LYS 108 3HZ LYS 108 -5.363 20.038 -4.836 856 H PHE 109 H PHE 109 -1.168 14.262 -3.635 857 HA PHE 109 HA PHE 109 -0.434 12.826 -5.901 858 1HB PHE 109 1HB PHE 109 0.701 12.488 -3.793 859 2HB PHE 109 2HB PHE 109 -0.777 11.902 -3.043 860 HD1 PHE 109 HD1 PHE 109 1.581 11.114 -5.815 861 HD2 PHE 109 HD2 PHE 109 -1.183 9.632 -2.937 862 HE1 PHE 109 HE1 PHE 109 2.195 8.809 -6.420 863 HE2 PHE 109 HE2 PHE 109 -0.575 7.325 -3.535 864 HZ PHE 109 HZ PHE 109 1.115 6.912 -5.279 865 H PHE 110 H PHE 110 -3.178 12.310 -3.706 866 HA PHE 110 HA PHE 110 -4.051 9.926 -5.000 867 1HB PHE 110 1HB PHE 110 -5.489 11.766 -3.078 868 2HB PHE 110 2HB PHE 110 -6.091 10.195 -3.598 869 HD1 PHE 110 HD1 PHE 110 -4.875 8.138 -2.959 870 HD2 PHE 110 HD2 PHE 110 -3.833 11.957 -1.400 871 HE1 PHE 110 HE1 PHE 110 -3.623 7.048 -1.144 872 HE2 PHE 110 HE2 PHE 110 -2.578 10.875 0.419 873 HZ PHE 110 HZ PHE 110 -2.466 8.419 0.547 874 H GLU 111 H GLU 111 -4.658 13.303 -5.462 875 HA GLU 111 HA GLU 111 -7.000 12.962 -7.057 876 1HB GLU 111 1HB GLU 111 -5.193 15.216 -6.305 877 2HB GLU 111 2HB GLU 111 -6.297 15.417 -7.641 878 1HG GLU 111 1HG GLU 111 -8.179 14.883 -6.164 879 2HG GLU 111 2HG GLU 111 -7.047 14.697 -4.825 880 H ALA 112 H ALA 112 -3.547 13.283 -7.623 881 HA ALA 112 HA ALA 112 -3.902 13.639 -10.474 882 1HB ALA 112 1HB ALA 112 -1.498 13.853 -10.569 883 2HB ALA 112 2HB ALA 112 -1.357 13.316 -8.895 884 3HB ALA 112 3HB ALA 112 -2.143 14.851 -9.268 885 H VAL 113 H VAL 113 -3.180 11.016 -8.286 886 HA VAL 113 HA VAL 113 -2.089 9.355 -10.377 887 HB VAL 113 HB VAL 113 -1.306 9.161 -8.024 888 1HG1 VAL 113 1HG1 VAL 113 -2.638 7.874 -6.412 889 2HG1 VAL 113 2HG1 VAL 113 -3.997 7.892 -7.536 890 3HG1 VAL 113 3HG1 VAL 113 -3.408 9.402 -6.840 891 1HG2 VAL 113 1HG2 VAL 113 -2.451 6.658 -9.248 892 2HG2 VAL 113 2HG2 VAL 113 -1.209 6.703 -7.999 893 3HG2 VAL 113 3HG2 VAL 113 -0.878 7.375 -9.595 894 H LYS 114 H LYS 114 -3.168 8.091 -11.705 895 HA LYS 114 HA LYS 114 -5.897 7.258 -10.969 896 1HB LYS 114 1HB LYS 114 -4.851 7.899 -13.739 897 2HB LYS 114 2HB LYS 114 -6.452 7.271 -13.378 898 1HG LYS 114 1HG LYS 114 -5.398 9.909 -12.382 899 2HG LYS 114 2HG LYS 114 -6.393 9.705 -13.823 900 1HD LYS 114 1HD LYS 114 -7.318 8.681 -11.163 901 2HD LYS 114 2HD LYS 114 -7.526 10.376 -11.595 902 1HE LYS 114 1HE LYS 114 -9.545 9.298 -12.177 903 2HE LYS 114 2HE LYS 114 -8.689 9.576 -13.690 904 1HZ LYS 114 1HZ LYS 114 -8.698 6.995 -12.213 905 2HZ LYS 114 2HZ LYS 114 -8.027 7.284 -13.744 906 3HZ LYS 114 3HZ LYS 114 -9.705 7.360 -13.528 907 H THR 115 H THR 115 -6.531 5.156 -11.744 908 HA THR 115 HA THR 115 -4.461 3.227 -11.597 909 HB THR 115 HB THR 115 -7.301 2.822 -12.569 910 HG1 THR 115 HG1 THR 115 -7.875 2.940 -10.527 911 1HG2 THR 115 1HG2 THR 115 -5.792 0.950 -13.084 912 2HG2 THR 115 2HG2 THR 115 -6.972 0.504 -11.851 913 3HG2 THR 115 3HG2 THR 115 -5.311 0.875 -11.389 914 H GLY 116 H GLY 116 -2.956 3.481 -13.194 915 1HA GLY 116 1HA GLY 116 -2.937 2.190 -15.513 916 2HA GLY 116 2HA GLY 116 -3.800 3.644 -15.980 917 H ASP 117 H ASP 117 -2.275 5.353 -14.134 918 HA ASP 117 HA ASP 117 0.021 5.862 -15.758 919 1HB ASP 117 1HB ASP 117 -1.033 7.034 -13.200 920 2HB ASP 117 2HB ASP 117 0.601 7.417 -13.732 921 H ARG 118 H ARG 118 2.255 6.121 -14.576 922 HA ARG 118 HA ARG 118 2.668 3.568 -13.155 923 1HB ARG 118 1HB ARG 118 3.510 3.668 -15.513 924 2HB ARG 118 2HB ARG 118 4.627 4.926 -15.012 925 1HG ARG 118 1HG ARG 118 4.622 2.279 -13.624 926 2HG ARG 118 2HG ARG 118 5.432 2.473 -15.179 927 1HD ARG 118 1HD ARG 118 5.977 4.042 -12.662 928 2HD ARG 118 2HD ARG 118 7.004 2.785 -13.361 929 HE ARG 118 HE ARG 118 6.586 5.488 -14.408 930 1HH1 ARG 118 1HH1 ARG 118 8.130 2.361 -14.702 931 2HH1 ARG 118 2HH1 ARG 118 9.413 2.946 -15.731 932 1HH2 ARG 118 1HH2 ARG 118 8.249 6.248 -15.796 933 2HH2 ARG 118 2HH2 ARG 118 9.458 5.147 -16.377 934 H VAL 119 H VAL 119 3.778 3.576 -11.294 935 HA VAL 119 HA VAL 119 4.716 6.203 -10.342 936 HB VAL 119 HB VAL 119 3.748 3.853 -8.699 937 1HG1 VAL 119 1HG1 VAL 119 3.758 5.420 -6.825 938 2HG1 VAL 119 2HG1 VAL 119 4.416 6.675 -7.874 939 3HG1 VAL 119 3HG1 VAL 119 5.372 5.236 -7.516 940 1HG2 VAL 119 1HG2 VAL 119 2.349 6.457 -9.278 941 2HG2 VAL 119 2HG2 VAL 119 1.744 5.137 -8.277 942 3HG2 VAL 119 3HG2 VAL 119 1.955 4.905 -10.013 943 H VAL 120 H VAL 120 6.740 6.416 -9.537 944 HA VAL 120 HA VAL 120 8.390 3.984 -9.295 945 HB VAL 120 HB VAL 120 9.308 6.854 -9.630 946 1HG1 VAL 120 1HG1 VAL 120 11.541 5.855 -9.939 947 2HG1 VAL 120 2HG1 VAL 120 10.874 4.280 -9.513 948 3HG1 VAL 120 3HG1 VAL 120 10.893 5.583 -8.323 949 1HG2 VAL 120 1HG2 VAL 120 9.355 4.561 -11.596 950 2HG2 VAL 120 2HG2 VAL 120 10.059 6.158 -11.858 951 3HG2 VAL 120 3HG2 VAL 120 8.314 5.982 -11.680 952 H VAL 121 H VAL 121 8.599 3.335 -7.259 953 HA VAL 121 HA VAL 121 8.115 5.288 -5.118 954 HB VAL 121 HB VAL 121 7.995 2.273 -5.018 955 1HG1 VAL 121 1HG1 VAL 121 6.983 2.590 -2.806 956 2HG1 VAL 121 2HG1 VAL 121 7.245 4.328 -2.938 957 3HG1 VAL 121 3HG1 VAL 121 8.624 3.233 -2.864 958 1HG2 VAL 121 1HG2 VAL 121 5.568 2.608 -4.821 959 2HG2 VAL 121 2HG2 VAL 121 6.202 3.203 -6.357 960 3HG2 VAL 121 3HG2 VAL 121 5.802 4.340 -5.069 961 H ASN 122 H ASN 122 9.870 6.076 -4.199 962 HA ASN 122 HA ASN 122 12.223 4.334 -3.886 963 1HB ASN 122 1HB ASN 122 12.423 6.606 -5.053 964 2HB ASN 122 2HB ASN 122 12.123 7.328 -3.478 965 1HD2 ASN 122 1HD2 ASN 122 14.425 7.636 -5.101 966 2HD2 ASN 122 2HD2 ASN 122 15.774 7.032 -4.198 967 H ALA 123 H ALA 123 11.642 3.215 -2.052 968 HA ALA 123 HA ALA 123 10.572 4.668 0.232 969 1HB ALA 123 1HB ALA 123 9.544 2.538 -0.370 970 2HB ALA 123 2HB ALA 123 10.270 2.455 1.237 971 3HB ALA 123 3HB ALA 123 11.088 1.717 -0.140 972 H ASP 124 H ASP 124 13.566 3.918 -0.974 973 HA ASP 124 HA ASP 124 14.933 3.275 1.448 974 1HB ASP 124 1HB ASP 124 15.833 2.653 -0.760 975 2HB ASP 124 2HB ASP 124 16.029 4.357 -1.157 976 H GLU 125 H GLU 125 14.262 6.252 -0.330 977 HA GLU 125 HA GLU 125 15.479 7.751 1.888 978 1HB GLU 125 1HB GLU 125 15.723 9.631 0.354 979 2HB GLU 125 2HB GLU 125 16.530 8.206 -0.275 980 1HG GLU 125 1HG GLU 125 14.596 7.812 -1.753 981 2HG GLU 125 2HG GLU 125 13.873 9.308 -1.158 982 H GLY 126 H GLY 126 12.548 6.760 0.734 983 1HA GLY 126 1HA GLY 126 10.414 7.317 1.420 984 2HA GLY 126 2HA GLY 126 11.112 8.582 2.421 985 H TYR 127 H TYR 127 10.346 7.778 -0.950 986 HA TYR 127 HA TYR 127 9.325 10.427 -1.410 987 1HB TYR 127 1HB TYR 127 11.981 10.316 -1.708 988 2HB TYR 127 2HB TYR 127 11.522 9.689 -3.287 989 HD1 TYR 127 HD1 TYR 127 10.699 11.138 -4.987 990 HD2 TYR 127 HD2 TYR 127 11.218 12.586 -1.020 991 HE1 TYR 127 HE1 TYR 127 10.357 13.438 -5.785 992 HE2 TYR 127 HE2 TYR 127 10.876 14.889 -1.808 993 HH TYR 127 HH TYR 127 11.078 16.162 -3.892 994 H VAL 128 H VAL 128 8.014 10.499 -3.254 995 HA VAL 128 HA VAL 128 7.857 8.003 -4.793 996 HB VAL 128 HB VAL 128 6.078 7.858 -3.166 997 1HG1 VAL 128 1HG1 VAL 128 5.163 10.545 -4.177 998 2HG1 VAL 128 2HG1 VAL 128 5.815 10.185 -2.577 999 3HG1 VAL 128 3HG1 VAL 128 4.260 9.512 -3.070 1000 1HG2 VAL 128 1HG2 VAL 128 5.604 7.008 -5.396 1001 2HG2 VAL 128 2HG2 VAL 128 4.986 8.588 -5.881 1002 3HG2 VAL 128 3HG2 VAL 128 4.142 7.651 -4.646 1003 H GLU 129 H GLU 129 8.004 8.326 -6.877 1004 HA GLU 129 HA GLU 129 7.368 10.997 -7.942 1005 1HB GLU 129 1HB GLU 129 9.249 8.872 -8.995 1006 2HB GLU 129 2HB GLU 129 8.871 10.371 -9.834 1007 1HG GLU 129 1HG GLU 129 9.816 11.649 -7.984 1008 2HG GLU 129 2HG GLU 129 10.193 10.147 -7.138 1009 H LEU 130 H LEU 130 5.555 11.128 -9.067 1010 HA LEU 130 HA LEU 130 4.367 8.686 -10.146 1011 1HB LEU 130 1HB LEU 130 2.908 10.105 -8.818 1012 2HB LEU 130 2HB LEU 130 3.261 11.481 -9.845 1013 HG LEU 130 HG LEU 130 2.170 10.284 -11.742 1014 1HD1 LEU 130 1HD1 LEU 130 2.474 8.001 -10.920 1015 2HD1 LEU 130 2HD1 LEU 130 0.783 8.346 -11.281 1016 3HD1 LEU 130 3HD1 LEU 130 1.340 8.325 -9.607 1017 1HD2 LEU 130 1HD2 LEU 130 0.949 11.940 -10.454 1018 2HD2 LEU 130 2HD2 LEU 130 0.487 10.710 -9.277 1019 3HD2 LEU 130 3HD2 LEU 130 -0.121 10.620 -10.931 1020 H ILE 131 H ILE 131 4.835 8.150 -12.156 1021 HA ILE 131 HA ILE 131 5.733 10.204 -14.017 1022 HB ILE 131 HB ILE 131 5.519 7.269 -14.583 1023 1HG1 ILE 131 1HG1 ILE 131 6.947 7.572 -12.595 1024 2HG1 ILE 131 2HG1 ILE 131 7.896 7.062 -13.986 1025 1HG2 ILE 131 1HG2 ILE 131 7.156 9.462 -15.833 1026 2HG2 ILE 131 2HG2 ILE 131 5.750 8.662 -16.536 1027 3HG2 ILE 131 3HG2 ILE 131 7.241 7.756 -16.275 1028 1HD1 ILE 131 1HD1 ILE 131 8.626 9.374 -14.322 1029 2HD1 ILE 131 2HD1 ILE 131 9.058 8.771 -12.725 1030 3HD1 ILE 131 3HD1 ILE 131 7.690 9.865 -12.912 1031 H GLU 132 H GLU 132 4.287 11.200 -15.071 1032 HA GLU 132 HA GLU 132 1.632 10.232 -15.472 1033 1HB GLU 132 1HB GLU 132 3.046 12.699 -16.476 1034 2HB GLU 132 2HB GLU 132 1.338 12.374 -16.717 1035 1HG GLU 132 1HG GLU 132 1.023 12.348 -14.276 1036 2HG GLU 132 2HG GLU 132 2.728 12.748 -14.075 Start of MODEL 7 1 H VAL 1 H VAL 1 4.704 18.027 -9.659 2 HA VAL 1 HA VAL 1 3.228 15.935 -8.198 3 HB VAL 1 HB VAL 1 3.899 14.369 -10.009 4 1HG1 VAL 1 1HG1 VAL 1 1.688 15.416 -10.005 5 2HG1 VAL 1 2HG1 VAL 1 2.273 15.151 -11.646 6 3HG1 VAL 1 3HG1 VAL 1 2.324 16.767 -10.945 7 1HG2 VAL 1 1HG2 VAL 1 4.842 16.878 -11.394 8 2HG2 VAL 1 2HG2 VAL 1 4.677 15.295 -12.150 9 3HG2 VAL 1 3HG2 VAL 1 5.852 15.534 -10.859 10 H LYS 2 H LYS 2 4.758 13.803 -8.365 11 HA LYS 2 HA LYS 2 6.451 12.714 -7.342 12 1HB LYS 2 1HB LYS 2 8.071 15.171 -8.044 13 2HB LYS 2 2HB LYS 2 8.737 13.656 -7.450 14 1HG LYS 2 1HG LYS 2 7.712 12.543 -9.461 15 2HG LYS 2 2HG LYS 2 7.363 14.161 -10.075 16 1HD LYS 2 1HD LYS 2 9.744 14.713 -9.987 17 2HD LYS 2 2HD LYS 2 10.096 13.102 -9.352 18 1HE LYS 2 1HE LYS 2 9.064 12.163 -11.441 19 2HE LYS 2 2HE LYS 2 8.997 13.810 -12.070 20 1HZ LYS 2 1HZ LYS 2 10.959 12.703 -12.866 21 2HZ LYS 2 2HZ LYS 2 11.446 12.319 -11.284 22 3HZ LYS 2 3HZ LYS 2 11.421 13.940 -11.800 23 H PHE 3 H PHE 3 5.809 12.520 -5.300 24 HA PHE 3 HA PHE 3 6.107 14.847 -3.527 25 1HB PHE 3 1HB PHE 3 4.215 12.504 -3.261 26 2HB PHE 3 2HB PHE 3 4.305 13.881 -2.171 27 HD1 PHE 3 HD1 PHE 3 3.214 12.708 -5.455 28 HD2 PHE 3 HD2 PHE 3 3.408 16.030 -2.805 29 HE1 PHE 3 HE1 PHE 3 1.566 13.899 -6.841 30 HE2 PHE 3 HE2 PHE 3 1.761 17.230 -4.185 31 HZ PHE 3 HZ PHE 3 0.839 16.165 -6.203 32 H ALA 4 H ALA 4 6.950 14.588 -1.495 33 HA ALA 4 HA ALA 4 8.559 12.184 -1.068 34 1HB ALA 4 1HB ALA 4 9.644 14.385 -0.812 35 2HB ALA 4 2HB ALA 4 9.662 13.463 0.692 36 3HB ALA 4 3HB ALA 4 8.510 14.781 0.478 37 H CYS 5 H CYS 5 8.044 10.690 0.431 38 HA CYS 5 HA CYS 5 5.732 11.274 2.155 39 1HB CYS 5 1HB CYS 5 6.400 8.599 0.921 40 2HB CYS 5 2HB CYS 5 4.936 9.034 1.797 41 HG CYS 5 HG CYS 5 5.267 11.109 -0.701 42 H ARG 6 H ARG 6 5.593 9.362 3.856 43 HA ARG 6 HA ARG 6 8.146 9.406 5.279 44 1HB ARG 6 1HB ARG 6 6.183 10.158 6.499 45 2HB ARG 6 2HB ARG 6 5.346 8.656 6.142 46 1HG ARG 6 1HG ARG 6 6.945 7.429 7.511 47 2HG ARG 6 2HG ARG 6 7.808 8.934 7.854 48 1HD ARG 6 1HD ARG 6 5.911 9.839 8.990 49 2HD ARG 6 2HD ARG 6 4.900 8.485 8.491 50 HE ARG 6 HE ARG 6 7.219 8.000 10.225 51 1HH1 ARG 6 1HH1 ARG 6 3.752 8.078 9.708 52 2HH1 ARG 6 2HH1 ARG 6 3.389 7.154 11.139 53 1HH2 ARG 6 1HH2 ARG 6 6.754 6.794 12.125 54 2HH2 ARG 6 2HH2 ARG 6 5.101 6.438 12.526 55 H ALA 7 H ALA 7 9.433 7.669 5.305 56 HA ALA 7 HA ALA 7 8.544 5.285 3.920 57 1HB ALA 7 1HB ALA 7 10.722 6.246 3.396 58 2HB ALA 7 2HB ALA 7 10.887 4.606 4.022 59 3HB ALA 7 3HB ALA 7 11.244 5.986 5.060 60 H ILE 8 H ILE 8 7.932 3.440 4.823 61 HA ILE 8 HA ILE 8 8.465 3.008 7.683 62 HB ILE 8 HB ILE 8 6.395 1.779 5.852 63 1HG1 ILE 8 1HG1 ILE 8 4.871 2.621 7.750 64 2HG1 ILE 8 2HG1 ILE 8 6.260 3.559 8.280 65 1HG2 ILE 8 1HG2 ILE 8 7.292 0.011 7.244 66 2HG2 ILE 8 2HG2 ILE 8 5.659 0.430 7.765 67 3HG2 ILE 8 3HG2 ILE 8 7.051 0.998 8.685 68 1HD1 ILE 8 1HD1 ILE 8 6.297 4.699 6.111 69 2HD1 ILE 8 2HD1 ILE 8 4.765 4.916 6.962 70 3HD1 ILE 8 3HD1 ILE 8 4.876 3.777 5.620 71 H THR 9 H THR 9 8.475 1.358 4.549 72 HA THR 9 HA THR 9 10.593 -0.413 5.567 73 HB THR 9 HB THR 9 9.883 -1.977 3.713 74 HG1 THR 9 HG1 THR 9 7.767 -1.647 2.885 75 1HG2 THR 9 1HG2 THR 9 7.953 -2.869 4.944 76 2HG2 THR 9 2HG2 THR 9 7.846 -1.360 5.853 77 3HG2 THR 9 3HG2 THR 9 9.261 -2.399 6.029 78 H ARG 10 H ARG 10 11.662 -1.386 3.282 79 HA ARG 10 HA ARG 10 12.490 1.037 1.811 80 1HB ARG 10 1HB ARG 10 14.213 -1.355 2.479 81 2HB ARG 10 2HB ARG 10 14.726 0.089 1.613 82 1HG ARG 10 1HG ARG 10 14.293 1.427 3.624 83 2HG ARG 10 2HG ARG 10 13.826 -0.044 4.482 84 1HD ARG 10 1HD ARG 10 16.096 -0.961 3.957 85 2HD ARG 10 2HD ARG 10 16.530 0.634 3.341 86 HE ARG 10 HE ARG 10 15.482 0.806 5.984 87 1HH1 ARG 10 1HH1 ARG 10 18.356 0.014 4.144 88 2HH1 ARG 10 2HH1 ARG 10 19.437 0.238 5.481 89 1HH2 ARG 10 1HH2 ARG 10 16.905 1.091 7.759 90 2HH2 ARG 10 2HH2 ARG 10 18.616 0.875 7.529 91 H GLY 11 H GLY 11 13.865 0.135 -0.239 92 1HA GLY 11 1HA GLY 11 13.864 -1.603 -1.938 93 2HA GLY 11 2HA GLY 11 12.196 -1.947 -1.503 94 H ARG 12 H ARG 12 13.327 -1.295 -4.118 95 HA ARG 12 HA ARG 12 11.799 1.163 -4.659 96 1HB ARG 12 1HB ARG 12 14.035 -0.084 -6.263 97 2HB ARG 12 2HB ARG 12 13.086 1.302 -6.784 98 1HG ARG 12 1HG ARG 12 13.864 2.452 -4.678 99 2HG ARG 12 2HG ARG 12 15.015 1.125 -4.498 100 1HD ARG 12 1HD ARG 12 16.078 2.984 -5.615 101 2HD ARG 12 2HD ARG 12 15.905 1.633 -6.735 102 HE ARG 12 HE ARG 12 13.864 2.872 -7.573 103 1HH1 ARG 12 1HH1 ARG 12 16.617 4.510 -6.142 104 2HH1 ARG 12 2HH1 ARG 12 16.294 6.022 -6.949 105 1HH2 ARG 12 1HH2 ARG 12 13.468 4.844 -8.666 106 2HH2 ARG 12 2HH2 ARG 12 14.519 6.207 -8.412 107 H ALA 13 H ALA 13 10.136 1.089 -6.051 108 HA ALA 13 HA ALA 13 9.749 -1.354 -7.622 109 1HB ALA 13 1HB ALA 13 8.441 -1.597 -5.552 110 2HB ALA 13 2HB ALA 13 7.419 -1.509 -6.985 111 3HB ALA 13 3HB ALA 13 7.586 -0.102 -5.937 112 H GLU 14 H GLU 14 9.139 -0.959 -9.636 113 HA GLU 14 HA GLU 14 7.853 1.612 -10.241 114 1HB GLU 14 1HB GLU 14 10.175 1.792 -10.944 115 2HB GLU 14 2HB GLU 14 10.055 0.270 -11.817 116 1HG GLU 14 1HG GLU 14 8.379 1.291 -13.301 117 2HG GLU 14 2HG GLU 14 8.606 2.824 -12.464 118 H GLY 15 H GLY 15 5.973 1.350 -11.265 119 1HA GLY 15 1HA GLY 15 5.602 -0.365 -13.457 120 2HA GLY 15 2HA GLY 15 5.005 -1.192 -12.030 121 H GLU 16 H GLU 16 2.942 -1.177 -13.005 122 HA GLU 16 HA GLU 16 1.610 1.215 -13.746 123 1HB GLU 16 1HB GLU 16 0.473 -1.503 -13.079 124 2HB GLU 16 2HB GLU 16 -0.304 -0.241 -14.012 125 1HG GLU 16 1HG GLU 16 1.179 -0.510 -15.820 126 2HG GLU 16 2HG GLU 16 2.273 -1.506 -14.861 127 H ALA 17 H ALA 17 0.283 2.491 -12.591 128 HA ALA 17 HA ALA 17 0.114 1.989 -9.709 129 1HB ALA 17 1HB ALA 17 -0.384 4.351 -9.493 130 2HB ALA 17 2HB ALA 17 -0.438 4.522 -11.248 131 3HB ALA 17 3HB ALA 17 1.080 4.118 -10.445 132 H LEU 18 H LEU 18 -1.725 1.544 -8.717 133 HA LEU 18 HA LEU 18 -4.250 1.893 -10.205 134 1HB LEU 18 1HB LEU 18 -3.103 -0.429 -9.070 135 2HB LEU 18 2HB LEU 18 -4.444 0.015 -8.033 136 HG LEU 18 HG LEU 18 -5.961 -0.033 -9.966 137 1HD1 LEU 18 1HD1 LEU 18 -3.525 -0.954 -11.487 138 2HD1 LEU 18 2HD1 LEU 18 -4.391 0.564 -11.715 139 3HD1 LEU 18 3HD1 LEU 18 -5.179 -0.966 -12.098 140 1HD2 LEU 18 1HD2 LEU 18 -5.676 -2.037 -8.606 141 2HD2 LEU 18 2HD2 LEU 18 -4.323 -2.543 -9.619 142 3HD2 LEU 18 3HD2 LEU 18 -5.948 -2.459 -10.297 143 H VAL 19 H VAL 19 -5.563 3.402 -9.313 144 HA VAL 19 HA VAL 19 -5.047 4.115 -6.517 145 HB VAL 19 HB VAL 19 -4.821 5.959 -8.158 146 1HG1 VAL 19 1HG1 VAL 19 -6.480 5.358 -9.793 147 2HG1 VAL 19 2HG1 VAL 19 -6.837 6.960 -9.147 148 3HG1 VAL 19 3HG1 VAL 19 -7.770 5.563 -8.605 149 1HG2 VAL 19 1HG2 VAL 19 -7.096 6.303 -6.219 150 2HG2 VAL 19 2HG2 VAL 19 -6.134 7.599 -6.929 151 3HG2 VAL 19 3HG2 VAL 19 -5.379 6.436 -5.839 152 H THR 20 H THR 20 -6.387 3.409 -5.051 153 HA THR 20 HA THR 20 -9.064 2.513 -5.898 154 HB THR 20 HB THR 20 -7.573 1.655 -3.413 155 HG1 THR 20 HG1 THR 20 -6.877 1.133 -5.877 156 1HG2 THR 20 1HG2 THR 20 -9.864 0.423 -4.949 157 2HG2 THR 20 2HG2 THR 20 -9.982 1.249 -3.395 158 3HG2 THR 20 3HG2 THR 20 -9.094 -0.270 -3.524 159 H LYS 21 H LYS 21 -10.835 3.392 -4.972 160 HA LYS 21 HA LYS 21 -10.440 5.500 -2.975 161 1HB LYS 21 1HB LYS 21 -13.004 4.693 -4.358 162 2HB LYS 21 2HB LYS 21 -12.689 6.186 -3.487 163 1HG LYS 21 1HG LYS 21 -11.190 6.937 -5.193 164 2HG LYS 21 2HG LYS 21 -11.286 5.384 -6.027 165 1HD LYS 21 1HD LYS 21 -13.734 5.780 -6.314 166 2HD LYS 21 2HD LYS 21 -13.500 7.395 -5.645 167 1HE LYS 21 1HE LYS 21 -11.995 7.959 -7.451 168 2HE LYS 21 2HE LYS 21 -12.111 6.323 -8.097 169 1HZ LYS 21 1HZ LYS 21 -14.510 6.724 -8.426 170 2HZ LYS 21 2HZ LYS 21 -13.532 7.765 -9.342 171 3HZ LYS 21 3HZ LYS 21 -14.293 8.336 -7.937 172 H GLU 22 H GLU 22 -11.467 2.269 -3.287 173 HA GLU 22 HA GLU 22 -13.288 2.240 -1.065 174 1HB GLU 22 1HB GLU 22 -12.037 -0.209 -2.284 175 2HB GLU 22 2HB GLU 22 -13.614 -0.043 -1.530 176 1HG GLU 22 1HG GLU 22 -12.753 0.938 -4.236 177 2HG GLU 22 2HG GLU 22 -13.946 -0.302 -3.859 178 H TYR 23 H TYR 23 -12.968 0.904 0.829 179 HA TYR 23 HA TYR 23 -10.145 0.579 1.576 180 1HB TYR 23 1HB TYR 23 -11.111 0.753 3.988 181 2HB TYR 23 2HB TYR 23 -10.858 2.223 3.060 182 HD1 TYR 23 HD1 TYR 23 -12.739 3.528 2.261 183 HD2 TYR 23 HD2 TYR 23 -13.363 -0.045 4.487 184 HE1 TYR 23 HE1 TYR 23 -15.082 4.172 2.629 185 HE2 TYR 23 HE2 TYR 23 -15.707 0.590 4.854 186 HH TYR 23 HH TYR 23 -17.217 3.136 3.149 187 H ILE 24 H ILE 24 -9.516 -1.454 1.914 188 HA ILE 24 HA ILE 24 -11.624 -3.473 2.330 189 HB ILE 24 HB ILE 24 -9.148 -3.808 0.617 190 1HG1 ILE 24 1HG1 ILE 24 -11.059 -4.256 -1.143 191 2HG1 ILE 24 2HG1 ILE 24 -12.019 -3.260 -0.052 192 1HG2 ILE 24 1HG2 ILE 24 -10.077 -5.994 0.037 193 2HG2 ILE 24 2HG2 ILE 24 -11.413 -5.722 1.153 194 3HG2 ILE 24 3HG2 ILE 24 -9.766 -5.861 1.769 195 1HD1 ILE 24 1HD1 ILE 24 -9.445 -2.429 -1.384 196 2HD1 ILE 24 2HD1 ILE 24 -10.431 -1.433 -0.312 197 3HD1 ILE 24 3HD1 ILE 24 -11.071 -1.949 -1.872 198 H SER 25 H SER 25 -11.367 -4.536 4.186 199 HA SER 25 HA SER 25 -8.835 -4.756 5.519 200 1HB SER 25 1HB SER 25 -10.148 -6.409 6.966 201 2HB SER 25 2HB SER 25 -10.764 -4.757 6.927 202 HG SER 25 HG SER 25 -11.744 -6.606 5.055 203 H PHE 26 H PHE 26 -7.331 -6.333 5.222 204 HA PHE 26 HA PHE 26 -7.674 -8.005 2.935 205 1HB PHE 26 1HB PHE 26 -5.359 -7.804 4.861 206 2HB PHE 26 2HB PHE 26 -5.346 -8.740 3.370 207 HD1 PHE 26 HD1 PHE 26 -5.601 -7.548 1.182 208 HD2 PHE 26 HD2 PHE 26 -4.936 -5.494 4.850 209 HE1 PHE 26 HE1 PHE 26 -4.880 -5.558 -0.071 210 HE2 PHE 26 HE2 PHE 26 -4.214 -3.497 3.604 211 HZ PHE 26 HZ PHE 26 -4.184 -3.529 1.140 212 H LEU 27 H LEU 27 -9.479 -9.170 3.786 213 HA LEU 27 HA LEU 27 -8.556 -11.663 5.073 214 1HB LEU 27 1HB LEU 27 -11.374 -10.549 4.928 215 2HB LEU 27 2HB LEU 27 -10.917 -12.066 5.673 216 HG LEU 27 HG LEU 27 -10.033 -9.343 6.630 217 1HD1 LEU 27 1HD1 LEU 27 -12.117 -11.223 7.735 218 2HD1 LEU 27 2HD1 LEU 27 -12.425 -9.678 6.941 219 3HD1 LEU 27 3HD1 LEU 27 -11.576 -9.721 8.486 220 1HD2 LEU 27 1HD2 LEU 27 -8.436 -11.123 7.127 221 2HD2 LEU 27 2HD2 LEU 27 -9.726 -12.080 7.860 222 3HD2 LEU 27 3HD2 LEU 27 -9.237 -10.550 8.589 223 H GLY 28 H GLY 28 -10.809 -10.232 2.786 224 1HA GLY 28 1HA GLY 28 -9.966 -12.146 0.748 225 2HA GLY 28 2HA GLY 28 -11.690 -11.991 1.079 226 H GLY 29 H GLY 29 -12.284 -11.080 -0.870 227 1HA GLY 29 1HA GLY 29 -12.917 -9.119 -1.991 228 2HA GLY 29 2HA GLY 29 -11.640 -8.254 -1.142 229 H ILE 30 H ILE 30 -9.446 -9.626 -1.682 230 HA ILE 30 HA ILE 30 -9.217 -9.687 -4.618 231 HB ILE 30 HB ILE 30 -6.920 -9.441 -2.668 232 1HG1 ILE 30 1HG1 ILE 30 -6.973 -6.972 -3.546 233 2HG1 ILE 30 2HG1 ILE 30 -8.676 -7.295 -3.815 234 1HG2 ILE 30 1HG2 ILE 30 -5.738 -8.563 -4.642 235 2HG2 ILE 30 2HG2 ILE 30 -7.184 -8.859 -5.610 236 3HG2 ILE 30 3HG2 ILE 30 -6.324 -10.211 -4.871 237 1HD1 ILE 30 1HD1 ILE 30 -8.327 -6.196 -1.685 238 2HD1 ILE 30 2HD1 ILE 30 -7.222 -7.475 -1.186 239 3HD1 ILE 30 3HD1 ILE 30 -8.930 -7.836 -1.438 240 H ASP 31 H ASP 31 -8.676 -11.617 -5.516 241 HA ASP 31 HA ASP 31 -8.610 -13.960 -3.918 242 1HB ASP 31 1HB ASP 31 -9.443 -13.962 -6.231 243 2HB ASP 31 2HB ASP 31 -7.822 -13.597 -6.816 244 H LYS 32 H LYS 32 -6.956 -14.905 -2.936 245 HA LYS 32 HA LYS 32 -4.440 -13.520 -2.913 246 1HB LYS 32 1HB LYS 32 -3.889 -15.184 -1.105 247 2HB LYS 32 2HB LYS 32 -5.293 -14.168 -0.800 248 1HG LYS 32 1HG LYS 32 -6.753 -16.012 -1.528 249 2HG LYS 32 2HG LYS 32 -5.325 -17.024 -1.755 250 1HD LYS 32 1HD LYS 32 -4.830 -17.001 0.562 251 2HD LYS 32 2HD LYS 32 -6.003 -15.719 0.874 252 1HE LYS 32 1HE LYS 32 -7.801 -17.273 0.155 253 2HE LYS 32 2HE LYS 32 -6.590 -18.544 0.001 254 1HZ LYS 32 1HZ LYS 32 -7.097 -17.077 2.526 255 2HZ LYS 32 2HZ LYS 32 -6.167 -18.485 2.315 256 3HZ LYS 32 3HZ LYS 32 -7.854 -18.541 2.128 257 H GLU 33 H GLU 33 -5.579 -15.949 -4.859 258 HA GLU 33 HA GLU 33 -2.985 -17.313 -4.970 259 1HB GLU 33 1HB GLU 33 -5.658 -18.130 -6.081 260 2HB GLU 33 2HB GLU 33 -4.169 -19.056 -6.234 261 1HG GLU 33 1HG GLU 33 -5.535 -18.337 -3.652 262 2HG GLU 33 2HG GLU 33 -5.578 -19.896 -4.453 263 H THR 34 H THR 34 -5.288 -15.480 -6.860 264 HA THR 34 HA THR 34 -3.473 -15.567 -9.181 265 HB THR 34 HB THR 34 -5.477 -14.686 -10.444 266 HG1 THR 34 HG1 THR 34 -6.834 -15.446 -8.041 267 1HG2 THR 34 1HG2 THR 34 -5.769 -17.357 -9.065 268 2HG2 THR 34 2HG2 THR 34 -4.850 -17.044 -10.537 269 3HG2 THR 34 3HG2 THR 34 -6.607 -16.868 -10.538 270 H GLY 35 H GLY 35 -4.975 -13.450 -6.847 271 1HA GLY 35 1HA GLY 35 -4.275 -11.280 -6.324 272 2HA GLY 35 2HA GLY 35 -3.376 -11.224 -7.831 273 H ILE 36 H ILE 36 -6.490 -12.377 -8.313 274 HA ILE 36 HA ILE 36 -7.257 -9.928 -9.651 275 HB ILE 36 HB ILE 36 -8.730 -12.561 -9.399 276 1HG1 ILE 36 1HG1 ILE 36 -6.606 -12.743 -10.639 277 2HG1 ILE 36 2HG1 ILE 36 -7.996 -12.973 -11.697 278 1HG2 ILE 36 1HG2 ILE 36 -9.290 -10.173 -11.153 279 2HG2 ILE 36 2HG2 ILE 36 -10.288 -10.761 -9.823 280 3HG2 ILE 36 3HG2 ILE 36 -10.097 -11.736 -11.281 281 1HD1 ILE 36 1HD1 ILE 36 -6.398 -10.437 -11.437 282 2HD1 ILE 36 2HD1 ILE 36 -7.759 -10.705 -12.525 283 3HD1 ILE 36 3HD1 ILE 36 -6.264 -11.614 -12.743 284 H VAL 37 H VAL 37 -8.456 -8.376 -8.746 285 HA VAL 37 HA VAL 37 -9.620 -8.645 -6.169 286 HB VAL 37 HB VAL 37 -10.664 -6.422 -6.628 287 1HG1 VAL 37 1HG1 VAL 37 -8.448 -6.582 -5.641 288 2HG1 VAL 37 2HG1 VAL 37 -8.545 -5.186 -6.716 289 3HG1 VAL 37 3HG1 VAL 37 -7.719 -6.652 -7.246 290 1HG2 VAL 37 1HG2 VAL 37 -10.098 -5.211 -8.657 291 2HG2 VAL 37 2HG2 VAL 37 -10.969 -6.690 -9.067 292 3HG2 VAL 37 3HG2 VAL 37 -9.218 -6.609 -9.274 293 H LYS 38 H LYS 38 -11.366 -9.677 -5.686 294 HA LYS 38 HA LYS 38 -13.338 -10.367 -7.714 295 1HB LYS 38 1HB LYS 38 -13.265 -11.138 -4.788 296 2HB LYS 38 2HB LYS 38 -14.198 -11.909 -6.063 297 1HG LYS 38 1HG LYS 38 -11.193 -11.847 -6.024 298 2HG LYS 38 2HG LYS 38 -12.149 -13.145 -5.310 299 1HD LYS 38 1HD LYS 38 -12.521 -12.318 -8.172 300 2HD LYS 38 2HD LYS 38 -11.263 -13.463 -7.701 301 1HE LYS 38 1HE LYS 38 -14.175 -13.800 -7.009 302 2HE LYS 38 2HE LYS 38 -13.428 -14.497 -8.445 303 1HZ LYS 38 1HZ LYS 38 -13.565 -16.042 -6.536 304 2HZ LYS 38 2HZ LYS 38 -12.510 -15.034 -5.667 305 3HZ LYS 38 3HZ LYS 38 -11.979 -15.794 -7.087 306 H GLU 39 H GLU 39 -12.827 -8.242 -5.072 307 HA GLU 39 HA GLU 39 -15.479 -7.655 -4.323 308 1HB GLU 39 1HB GLU 39 -13.167 -7.074 -3.216 309 2HB GLU 39 2HB GLU 39 -13.285 -5.617 -4.191 310 1HG GLU 39 1HG GLU 39 -14.131 -5.128 -2.026 311 2HG GLU 39 2HG GLU 39 -15.497 -5.178 -3.142 312 H ASP 40 H ASP 40 -16.976 -6.318 -5.186 313 HA ASP 40 HA ASP 40 -16.656 -5.467 -7.872 314 1HB ASP 40 1HB ASP 40 -18.832 -6.157 -6.984 315 2HB ASP 40 2HB ASP 40 -18.834 -4.774 -5.893 316 H CYS 41 H CYS 41 -16.150 -3.590 -8.733 317 HA CYS 41 HA CYS 41 -16.362 -1.055 -7.550 318 1HB CYS 41 1HB CYS 41 -13.931 -0.560 -7.289 319 2HB CYS 41 2HB CYS 41 -14.512 -1.746 -6.126 320 HG CYS 41 HG CYS 41 -13.233 -3.875 -7.109 321 H GLU 42 H GLU 42 -14.502 0.393 -8.953 322 HA GLU 42 HA GLU 42 -15.293 -0.148 -11.679 323 1HB GLU 42 1HB GLU 42 -13.648 2.066 -10.468 324 2HB GLU 42 2HB GLU 42 -13.999 1.948 -12.187 325 1HG GLU 42 1HG GLU 42 -16.458 1.898 -11.492 326 2HG GLU 42 2HG GLU 42 -15.885 2.463 -9.922 327 H ILE 43 H ILE 43 -12.622 -0.910 -9.722 328 HA ILE 43 HA ILE 43 -10.865 -1.347 -12.039 329 HB ILE 43 HB ILE 43 -10.084 -1.813 -9.165 330 1HG1 ILE 43 1HG1 ILE 43 -9.897 0.817 -10.656 331 2HG1 ILE 43 2HG1 ILE 43 -11.041 0.480 -9.359 332 1HG2 ILE 43 1HG2 ILE 43 -7.843 -1.283 -10.021 333 2HG2 ILE 43 2HG2 ILE 43 -8.526 -1.021 -11.626 334 3HG2 ILE 43 3HG2 ILE 43 -8.574 -2.626 -10.899 335 1HD1 ILE 43 1HD1 ILE 43 -9.182 0.170 -7.809 336 2HD1 ILE 43 2HD1 ILE 43 -9.143 1.765 -8.557 337 3HD1 ILE 43 3HD1 ILE 43 -8.042 0.504 -9.111 338 H LYS 44 H LYS 44 -13.296 -2.855 -11.046 339 HA LYS 44 HA LYS 44 -12.583 -5.313 -9.908 340 1HB LYS 44 1HB LYS 44 -14.843 -4.292 -9.972 341 2HB LYS 44 2HB LYS 44 -14.939 -4.669 -11.682 342 1HG LYS 44 1HG LYS 44 -14.783 -7.060 -11.131 343 2HG LYS 44 2HG LYS 44 -14.753 -6.639 -9.414 344 1HD LYS 44 1HD LYS 44 -16.923 -5.438 -9.768 345 2HD LYS 44 2HD LYS 44 -16.973 -6.131 -11.387 346 1HE LYS 44 1HE LYS 44 -16.962 -8.374 -10.428 347 2HE LYS 44 2HE LYS 44 -16.877 -7.683 -8.807 348 1HZ LYS 44 1HZ LYS 44 -19.010 -6.518 -9.345 349 2HZ LYS 44 2HZ LYS 44 -19.127 -8.210 -9.217 350 3HZ LYS 44 3HZ LYS 44 -19.111 -7.475 -10.742 351 H GLY 45 H GLY 45 -11.896 -7.179 -10.726 352 1HA GLY 45 1HA GLY 45 -11.764 -8.857 -12.398 353 2HA GLY 45 2HA GLY 45 -12.026 -7.625 -13.619 354 H GLU 46 H GLU 46 -9.858 -6.114 -11.828 355 HA GLU 46 HA GLU 46 -7.668 -7.068 -13.494 356 1HB GLU 46 1HB GLU 46 -8.012 -4.594 -11.817 357 2HB GLU 46 2HB GLU 46 -6.476 -5.029 -12.554 358 1HG GLU 46 1HG GLU 46 -7.985 -5.189 -14.720 359 2HG GLU 46 2HG GLU 46 -8.976 -4.054 -13.802 360 H SER 47 H SER 47 -5.451 -6.970 -12.470 361 HA SER 47 HA SER 47 -5.532 -8.425 -9.921 362 1HB SER 47 1HB SER 47 -3.232 -9.253 -10.747 363 2HB SER 47 2HB SER 47 -4.661 -9.887 -11.557 364 HG SER 47 HG SER 47 -2.635 -8.366 -12.554 365 H VAL 48 H VAL 48 -4.224 -7.791 -8.247 366 HA VAL 48 HA VAL 48 -2.777 -5.253 -8.596 367 HB VAL 48 HB VAL 48 -2.701 -5.148 -6.134 368 1HG1 VAL 48 1HG1 VAL 48 -5.466 -5.642 -7.238 369 2HG1 VAL 48 2HG1 VAL 48 -4.578 -4.121 -7.285 370 3HG1 VAL 48 3HG1 VAL 48 -5.098 -4.790 -5.740 371 1HG2 VAL 48 1HG2 VAL 48 -2.646 -7.539 -5.648 372 2HG2 VAL 48 2HG2 VAL 48 -4.303 -7.707 -6.230 373 3HG2 VAL 48 3HG2 VAL 48 -3.969 -6.756 -4.783 374 H ALA 49 H ALA 49 -2.053 -8.206 -9.179 375 HA ALA 49 HA ALA 49 0.070 -8.841 -7.415 376 1HB ALA 49 1HB ALA 49 -0.774 -10.111 -10.023 377 2HB ALA 49 2HB ALA 49 -1.269 -10.598 -8.397 378 3HB ALA 49 3HB ALA 49 0.412 -10.773 -8.893 379 H GLY 50 H GLY 50 1.539 -7.249 -7.511 380 1HA GLY 50 1HA GLY 50 3.784 -6.903 -8.125 381 2HA GLY 50 2HA GLY 50 3.439 -7.580 -9.703 382 H ARG 51 H ARG 51 1.397 -5.099 -8.355 383 HA ARG 51 HA ARG 51 2.821 -3.076 -9.932 384 1HB ARG 51 1HB ARG 51 0.537 -2.067 -10.386 385 2HB ARG 51 2HB ARG 51 0.948 -3.519 -11.281 386 1HG ARG 51 1HG ARG 51 -0.451 -4.853 -9.883 387 2HG ARG 51 2HG ARG 51 -0.725 -3.499 -8.784 388 1HD ARG 51 1HD ARG 51 -2.606 -3.952 -10.364 389 2HD ARG 51 2HD ARG 51 -1.968 -2.311 -10.431 390 HE ARG 51 HE ARG 51 -0.589 -3.559 -12.386 391 1HH1 ARG 51 1HH1 ARG 51 -3.992 -3.484 -11.627 392 2HH1 ARG 51 2HH1 ARG 51 -4.511 -3.520 -13.288 393 1HH2 ARG 51 1HH2 ARG 51 -1.234 -3.632 -14.575 394 2HH2 ARG 51 2HH2 ARG 51 -2.936 -3.606 -14.966 395 H ILE 52 H ILE 52 1.723 -0.809 -9.307 396 HA ILE 52 HA ILE 52 2.219 -0.619 -6.441 397 HB ILE 52 HB ILE 52 2.037 1.492 -8.599 398 1HG1 ILE 52 1HG1 ILE 52 4.393 1.965 -7.775 399 2HG1 ILE 52 2HG1 ILE 52 4.278 0.478 -6.845 400 1HG2 ILE 52 1HG2 ILE 52 2.379 1.913 -5.634 401 2HG2 ILE 52 2HG2 ILE 52 0.999 2.408 -6.612 402 3HG2 ILE 52 3HG2 ILE 52 2.576 3.157 -6.869 403 1HD1 ILE 52 1HD1 ILE 52 4.101 0.710 -9.835 404 2HD1 ILE 52 2HD1 ILE 52 3.975 -0.784 -8.908 405 3HD1 ILE 52 3HD1 ILE 52 5.485 0.129 -8.907 406 H LEU 53 H LEU 53 0.604 -0.575 -5.044 407 HA LEU 53 HA LEU 53 -2.077 0.086 -6.055 408 1HB LEU 53 1HB LEU 53 -1.715 -2.207 -5.146 409 2HB LEU 53 2HB LEU 53 -1.328 -1.495 -3.592 410 HG LEU 53 HG LEU 53 -3.605 -0.568 -3.458 411 1HD1 LEU 53 1HD1 LEU 53 -4.071 -0.332 -5.831 412 2HD1 LEU 53 2HD1 LEU 53 -5.310 -1.318 -5.052 413 3HD1 LEU 53 3HD1 LEU 53 -4.056 -2.086 -6.026 414 1HD2 LEU 53 1HD2 LEU 53 -3.130 -2.722 -2.444 415 2HD2 LEU 53 2HD2 LEU 53 -3.484 -3.537 -3.967 416 3HD2 LEU 53 3HD2 LEU 53 -4.768 -2.697 -3.096 417 H VAL 54 H VAL 54 -2.786 2.019 -5.525 418 HA VAL 54 HA VAL 54 -1.848 3.240 -3.010 419 HB VAL 54 HB VAL 54 -2.895 4.631 -5.483 420 1HG1 VAL 54 1HG1 VAL 54 -2.142 6.687 -4.383 421 2HG1 VAL 54 2HG1 VAL 54 -1.688 5.755 -2.958 422 3HG1 VAL 54 3HG1 VAL 54 -3.383 5.862 -3.438 423 1HG2 VAL 54 1HG2 VAL 54 -0.591 5.385 -5.822 424 2HG2 VAL 54 2HG2 VAL 54 -0.700 3.625 -5.874 425 3HG2 VAL 54 3HG2 VAL 54 -0.072 4.428 -4.435 426 H PHE 55 H PHE 55 -3.352 2.906 -1.516 427 HA PHE 55 HA PHE 55 -6.089 3.741 -2.128 428 1HB PHE 55 1HB PHE 55 -6.991 1.883 -0.756 429 2HB PHE 55 2HB PHE 55 -6.158 1.315 -2.194 430 HD1 PHE 55 HD1 PHE 55 -6.332 1.204 1.393 431 HD2 PHE 55 HD2 PHE 55 -3.863 0.333 -1.959 432 HE1 PHE 55 HE1 PHE 55 -4.989 -0.321 2.781 433 HE2 PHE 55 HE2 PHE 55 -2.516 -1.194 -0.579 434 HZ PHE 55 HZ PHE 55 -3.080 -1.522 1.798 435 HA PRO 56 HA PRO 56 -5.840 6.268 1.432 436 1HB PRO 56 1HB PRO 56 -8.283 5.780 2.642 437 2HB PRO 56 2HB PRO 56 -8.027 6.900 1.302 438 1HG PRO 56 1HG PRO 56 -9.030 4.087 1.260 439 2HG PRO 56 2HG PRO 56 -9.573 5.487 0.314 440 1HD PRO 56 1HD PRO 56 -8.000 3.600 -0.756 441 2HD PRO 56 2HD PRO 56 -7.806 5.314 -1.181 442 H GLY 57 H GLY 57 -7.121 3.023 2.050 443 1HA GLY 57 1HA GLY 57 -5.395 1.904 3.678 444 2HA GLY 57 2HA GLY 57 -6.075 3.099 4.776 445 H GLY 58 H GLY 58 -7.056 1.671 6.163 446 1HA GLY 58 1HA GLY 58 -9.673 0.931 5.675 447 2HA GLY 58 2HA GLY 58 -8.694 -0.479 5.297 448 H LYS 59 H LYS 59 -10.273 -1.094 7.176 449 HA LYS 59 HA LYS 59 -9.127 -0.436 9.774 450 1HB LYS 59 1HB LYS 59 -11.572 -2.054 9.023 451 2HB LYS 59 2HB LYS 59 -11.065 -1.707 10.673 452 1HG LYS 59 1HG LYS 59 -11.321 0.696 10.231 453 2HG LYS 59 2HG LYS 59 -11.872 0.326 8.598 454 1HD LYS 59 1HD LYS 59 -13.232 -0.575 11.138 455 2HD LYS 59 2HD LYS 59 -13.725 0.808 10.160 456 1HE LYS 59 1HE LYS 59 -13.966 -0.812 8.234 457 2HE LYS 59 2HE LYS 59 -13.761 -2.108 9.412 458 1HZ LYS 59 1HZ LYS 59 -15.947 -0.118 9.240 459 2HZ LYS 59 2HZ LYS 59 -15.673 -1.026 10.641 460 3HZ LYS 59 3HZ LYS 59 -16.065 -1.810 9.191 461 H GLY 60 H GLY 60 -7.366 -1.558 10.251 462 1HA GLY 60 1HA GLY 60 -6.973 -4.192 9.075 463 2HA GLY 60 2HA GLY 60 -5.751 -3.213 9.872 464 H SER 61 H SER 61 -8.582 -5.239 10.451 465 HA SER 61 HA SER 61 -7.306 -6.056 12.971 466 1HB SER 61 1HB SER 61 -9.388 -4.602 13.258 467 2HB SER 61 2HB SER 61 -10.299 -5.949 12.576 468 HG SER 61 HG SER 61 -8.733 -5.939 14.949 469 H THR 62 H THR 62 -6.956 -8.167 13.145 470 HA THR 62 HA THR 62 -6.992 -10.411 12.781 471 HB THR 62 HB THR 62 -9.640 -10.091 11.364 472 HG1 THR 62 HG1 THR 62 -8.968 -9.631 14.030 473 1HG2 THR 62 1HG2 THR 62 -8.677 -12.342 11.348 474 2HG2 THR 62 2HG2 THR 62 -10.101 -12.292 12.387 475 3HG2 THR 62 3HG2 THR 62 -8.488 -12.289 13.101 476 H VAL 63 H VAL 63 -6.181 -8.336 10.690 477 HA VAL 63 HA VAL 63 -6.624 -9.491 8.130 478 HB VAL 63 HB VAL 63 -4.648 -7.432 9.068 479 1HG1 VAL 63 1HG1 VAL 63 -5.256 -8.244 6.237 480 2HG1 VAL 63 2HG1 VAL 63 -3.748 -8.541 7.101 481 3HG1 VAL 63 3HG1 VAL 63 -4.240 -6.890 6.731 482 1HG2 VAL 63 1HG2 VAL 63 -6.120 -5.847 7.944 483 2HG2 VAL 63 2HG2 VAL 63 -6.987 -6.751 9.185 484 3HG2 VAL 63 3HG2 VAL 63 -7.194 -7.169 7.484 485 H GLY 64 H GLY 64 -5.390 -10.761 6.889 486 1HA GLY 64 1HA GLY 64 -3.559 -12.523 8.214 487 2HA GLY 64 2HA GLY 64 -4.003 -12.563 6.514 488 H SER 65 H SER 65 -2.242 -10.484 8.768 489 HA SER 65 HA SER 65 -0.554 -9.195 7.020 490 1HB SER 65 1HB SER 65 1.042 -9.118 9.016 491 2HB SER 65 2HB SER 65 -0.587 -8.490 9.278 492 HG SER 65 HG SER 65 -0.398 -9.820 10.946 493 H TYR 66 H TYR 66 -0.144 -12.417 8.427 494 HA TYR 66 HA TYR 66 2.499 -12.828 7.471 495 1HB TYR 66 1HB TYR 66 0.404 -14.881 8.217 496 2HB TYR 66 2HB TYR 66 2.129 -15.186 8.046 497 HD1 TYR 66 HD1 TYR 66 3.721 -14.206 9.695 498 HD2 TYR 66 HD2 TYR 66 -0.497 -13.947 10.209 499 HE1 TYR 66 HE1 TYR 66 4.046 -13.673 12.073 500 HE2 TYR 66 HE2 TYR 66 -0.181 -13.412 12.585 501 HH TYR 66 HH TYR 66 1.501 -13.737 14.327 502 H VAL 67 H VAL 67 -0.640 -13.157 6.050 503 HA VAL 67 HA VAL 67 0.024 -15.026 4.014 504 HB VAL 67 HB VAL 67 -2.212 -12.985 4.021 505 1HG1 VAL 67 1HG1 VAL 67 -1.772 -13.937 1.810 506 2HG1 VAL 67 2HG1 VAL 67 -3.324 -14.480 2.449 507 3HG1 VAL 67 3HG1 VAL 67 -1.930 -15.561 2.476 508 1HG2 VAL 67 1HG2 VAL 67 -2.307 -14.394 6.001 509 2HG2 VAL 67 2HG2 VAL 67 -2.195 -15.838 4.995 510 3HG2 VAL 67 3HG2 VAL 67 -3.614 -14.797 4.887 511 H LEU 68 H LEU 68 0.380 -11.591 4.362 512 HA LEU 68 HA LEU 68 0.619 -10.796 1.699 513 1HB LEU 68 1HB LEU 68 2.090 -9.745 4.117 514 2HB LEU 68 2HB LEU 68 2.000 -8.934 2.565 515 HG LEU 68 HG LEU 68 -0.359 -9.532 4.352 516 1HD1 LEU 68 1HD1 LEU 68 1.076 -6.935 3.813 517 2HD1 LEU 68 2HD1 LEU 68 1.107 -7.847 5.322 518 3HD1 LEU 68 3HD1 LEU 68 -0.400 -7.124 4.759 519 1HD2 LEU 68 1HD2 LEU 68 -0.172 -7.922 1.807 520 2HD2 LEU 68 2HD2 LEU 68 -1.600 -8.075 2.832 521 3HD2 LEU 68 3HD2 LEU 68 -0.963 -9.489 1.991 522 H LEU 69 H LEU 69 2.904 -12.400 3.813 523 HA LEU 69 HA LEU 69 5.200 -12.070 2.186 524 1HB LEU 69 1HB LEU 69 5.350 -12.669 4.546 525 2HB LEU 69 2HB LEU 69 4.519 -14.181 4.239 526 HG LEU 69 HG LEU 69 6.417 -14.961 2.893 527 1HD1 LEU 69 1HD1 LEU 69 7.713 -12.363 3.695 528 2HD1 LEU 69 2HD1 LEU 69 7.218 -12.823 2.066 529 3HD1 LEU 69 3HD1 LEU 69 8.513 -13.705 2.877 530 1HD2 LEU 69 1HD2 LEU 69 6.351 -15.476 5.265 531 2HD2 LEU 69 2HD2 LEU 69 7.175 -13.960 5.632 532 3HD2 LEU 69 3HD2 LEU 69 8.013 -15.224 4.731 533 H ASN 70 H ASN 70 2.811 -14.682 2.487 534 HA ASN 70 HA ASN 70 3.942 -16.356 0.504 535 1HB ASN 70 1HB ASN 70 2.271 -17.113 2.200 536 2HB ASN 70 2HB ASN 70 1.036 -16.209 1.326 537 1HD2 ASN 70 1HD2 ASN 70 0.233 -17.005 -0.578 538 2HD2 ASN 70 2HD2 ASN 70 0.641 -18.566 -1.197 539 H LEU 71 H LEU 71 1.539 -13.783 0.423 540 HA LEU 71 HA LEU 71 0.781 -13.965 -2.258 541 1HB LEU 71 1HB LEU 71 1.076 -11.533 -0.493 542 2HB LEU 71 2HB LEU 71 0.317 -11.508 -2.072 543 HG LEU 71 HG LEU 71 -0.657 -13.104 0.293 544 1HD1 LEU 71 1HD1 LEU 71 -2.498 -11.489 0.342 545 2HD1 LEU 71 2HD1 LEU 71 -1.706 -10.557 -0.931 546 3HD1 LEU 71 3HD1 LEU 71 -0.939 -10.721 0.650 547 1HD2 LEU 71 1HD2 LEU 71 -1.190 -14.142 -1.849 548 2HD2 LEU 71 2HD2 LEU 71 -1.896 -12.627 -2.414 549 3HD2 LEU 71 3HD2 LEU 71 -2.635 -13.500 -1.070 550 H ARG 72 H ARG 72 3.494 -12.236 -0.756 551 HA ARG 72 HA ARG 72 4.389 -11.065 -3.181 552 1HB ARG 72 1HB ARG 72 4.917 -10.399 -0.730 553 2HB ARG 72 2HB ARG 72 6.192 -11.601 -0.840 554 1HG ARG 72 1HG ARG 72 5.975 -9.442 -2.897 555 2HG ARG 72 2HG ARG 72 6.737 -9.125 -1.339 556 1HD ARG 72 1HD ARG 72 8.396 -10.789 -1.726 557 2HD ARG 72 2HD ARG 72 7.546 -11.396 -3.146 558 HE ARG 72 HE ARG 72 8.086 -9.225 -4.204 559 1HH1 ARG 72 1HH1 ARG 72 9.981 -10.280 -1.468 560 2HH1 ARG 72 2HH1 ARG 72 11.414 -9.449 -1.974 561 1HH2 ARG 72 1HH2 ARG 72 9.984 -8.119 -4.878 562 2HH2 ARG 72 2HH2 ARG 72 11.415 -8.204 -3.894 563 H LYS 73 H LYS 73 5.240 -14.030 -1.465 564 HA LYS 73 HA LYS 73 7.359 -14.848 -3.132 565 1HB LYS 73 1HB LYS 73 5.371 -16.446 -1.517 566 2HB LYS 73 2HB LYS 73 6.729 -17.173 -2.358 567 1HG LYS 73 1HG LYS 73 8.281 -15.891 -0.996 568 2HG LYS 73 2HG LYS 73 6.928 -15.108 -0.176 569 1HD LYS 73 1HD LYS 73 7.837 -16.942 1.166 570 2HD LYS 73 2HD LYS 73 6.176 -17.276 0.674 571 1HE LYS 73 1HE LYS 73 7.435 -19.285 0.392 572 2HE LYS 73 2HE LYS 73 7.095 -18.636 -1.211 573 1HZ LYS 73 1HZ LYS 73 9.347 -19.319 -1.181 574 2HZ LYS 73 2HZ LYS 73 9.658 -18.514 0.279 575 3HZ LYS 73 3HZ LYS 73 9.363 -17.623 -1.137 576 H ASN 74 H ASN 74 3.885 -15.083 -3.450 577 HA ASN 74 HA ASN 74 4.053 -16.850 -5.743 578 1HB ASN 74 1HB ASN 74 2.224 -16.912 -3.962 579 2HB ASN 74 2HB ASN 74 1.589 -15.449 -4.706 580 1HD2 ASN 74 1HD2 ASN 74 -0.328 -16.463 -5.284 581 2HD2 ASN 74 2HD2 ASN 74 -0.413 -17.611 -6.573 582 H GLY 75 H GLY 75 4.047 -13.499 -5.123 583 1HA GLY 75 1HA GLY 75 4.578 -11.876 -6.759 584 2HA GLY 75 2HA GLY 75 3.945 -12.950 -7.999 585 H VAL 76 H VAL 76 1.828 -12.965 -5.491 586 HA VAL 76 HA VAL 76 -0.137 -11.520 -7.017 587 HB VAL 76 HB VAL 76 -0.287 -13.006 -4.404 588 1HG1 VAL 76 1HG1 VAL 76 -2.724 -12.842 -4.582 589 2HG1 VAL 76 2HG1 VAL 76 -2.542 -11.765 -5.967 590 3HG1 VAL 76 3HG1 VAL 76 -1.972 -11.261 -4.376 591 1HG2 VAL 76 1HG2 VAL 76 -1.320 -13.685 -7.148 592 2HG2 VAL 76 2HG2 VAL 76 -1.521 -14.665 -5.695 593 3HG2 VAL 76 3HG2 VAL 76 0.089 -14.401 -6.363 594 H ALA 77 H ALA 77 1.769 -10.966 -4.143 595 HA ALA 77 HA ALA 77 0.212 -8.868 -3.054 596 1HB ALA 77 1HB ALA 77 2.208 -8.313 -1.748 597 2HB ALA 77 2HB ALA 77 3.170 -9.396 -2.755 598 3HB ALA 77 3HB ALA 77 1.890 -10.048 -1.731 599 HA PRO 78 HA PRO 78 1.109 -5.434 -5.740 600 1HB PRO 78 1HB PRO 78 1.212 -3.865 -3.219 601 2HB PRO 78 2HB PRO 78 0.228 -3.607 -4.664 602 1HG PRO 78 1HG PRO 78 -0.851 -4.568 -2.420 603 2HG PRO 78 2HG PRO 78 -1.370 -5.155 -4.012 604 1HD PRO 78 1HD PRO 78 0.423 -6.448 -2.002 605 2HD PRO 78 2HD PRO 78 -0.793 -7.182 -3.068 606 H LYS 79 H LYS 79 2.934 -4.380 -6.409 607 HA LYS 79 HA LYS 79 5.391 -5.304 -5.263 608 1HB LYS 79 1HB LYS 79 4.647 -4.667 -7.779 609 2HB LYS 79 2HB LYS 79 5.464 -3.184 -7.310 610 1HG LYS 79 1HG LYS 79 7.489 -4.364 -6.852 611 2HG LYS 79 2HG LYS 79 6.695 -5.917 -7.092 612 1HD LYS 79 1HD LYS 79 6.278 -5.294 -9.449 613 2HD LYS 79 2HD LYS 79 7.171 -3.796 -9.182 614 1HE LYS 79 1HE LYS 79 9.185 -4.997 -8.722 615 2HE LYS 79 2HE LYS 79 8.330 -6.538 -8.726 616 1HZ LYS 79 1HZ LYS 79 7.896 -6.280 -11.065 617 2HZ LYS 79 2HZ LYS 79 9.563 -6.139 -10.783 618 3HZ LYS 79 3HZ LYS 79 8.635 -4.755 -11.084 619 H ALA 80 H ALA 80 3.393 -2.613 -4.859 620 HA ALA 80 HA ALA 80 5.038 -1.547 -2.788 621 1HB ALA 80 1HB ALA 80 5.305 0.702 -3.709 622 2HB ALA 80 2HB ALA 80 4.579 0.176 -5.228 623 3HB ALA 80 3HB ALA 80 6.129 -0.489 -4.714 624 H ILE 81 H ILE 81 3.819 -0.317 -1.374 625 HA ILE 81 HA ILE 81 1.062 0.262 -2.202 626 HB ILE 81 HB ILE 81 0.380 -0.263 0.197 627 1HG1 ILE 81 1HG1 ILE 81 3.001 -1.783 0.123 628 2HG1 ILE 81 2HG1 ILE 81 2.629 -0.416 1.168 629 1HG2 ILE 81 1HG2 ILE 81 1.238 -2.510 -1.618 630 2HG2 ILE 81 2HG2 ILE 81 -0.289 -1.631 -1.685 631 3HG2 ILE 81 3HG2 ILE 81 0.080 -2.648 -0.294 632 1HD1 ILE 81 1HD1 ILE 81 2.472 -2.509 2.379 633 2HD1 ILE 81 2HD1 ILE 81 1.279 -3.101 1.225 634 3HD1 ILE 81 3HD1 ILE 81 0.892 -1.733 2.267 635 H ILE 82 H ILE 82 0.593 2.305 -2.019 636 HA ILE 82 HA ILE 82 2.063 3.950 -0.053 637 HB ILE 82 HB ILE 82 0.627 5.270 -2.304 638 1HG1 ILE 82 1HG1 ILE 82 1.798 3.358 -3.413 639 2HG1 ILE 82 2HG1 ILE 82 2.400 4.931 -3.914 640 1HG2 ILE 82 1HG2 ILE 82 2.539 6.792 -2.199 641 2HG2 ILE 82 2HG2 ILE 82 3.321 5.738 -1.023 642 3HG2 ILE 82 3HG2 ILE 82 1.818 6.563 -0.606 643 1HD1 ILE 82 1HD1 ILE 82 3.712 3.058 -1.964 644 2HD1 ILE 82 2HD1 ILE 82 4.307 4.663 -2.389 645 3HD1 ILE 82 3HD1 ILE 82 4.230 3.397 -3.616 646 H ASN 83 H ASN 83 0.803 4.605 1.625 647 HA ASN 83 HA ASN 83 -2.117 4.588 1.190 648 1HB ASN 83 1HB ASN 83 -0.617 3.589 3.617 649 2HB ASN 83 2HB ASN 83 -2.364 3.742 3.513 650 1HD2 ASN 83 1HD2 ASN 83 -2.485 2.878 0.756 651 2HD2 ASN 83 2HD2 ASN 83 -2.203 1.172 0.770 652 H LYS 84 H LYS 84 -3.368 5.835 2.689 653 HA LYS 84 HA LYS 84 -1.979 8.234 3.650 654 1HB LYS 84 1HB LYS 84 -4.020 8.380 2.136 655 2HB LYS 84 2HB LYS 84 -4.961 7.752 3.482 656 1HG LYS 84 1HG LYS 84 -4.389 9.686 4.822 657 2HG LYS 84 2HG LYS 84 -3.360 10.304 3.526 658 1HD LYS 84 1HD LYS 84 -5.365 10.364 2.051 659 2HD LYS 84 2HD LYS 84 -6.349 9.914 3.445 660 1HE LYS 84 1HE LYS 84 -5.584 11.931 4.614 661 2HE LYS 84 2HE LYS 84 -4.636 12.384 3.199 662 1HZ LYS 84 1HZ LYS 84 -6.721 13.563 3.231 663 2HZ LYS 84 2HZ LYS 84 -7.591 12.115 3.312 664 3HZ LYS 84 3HZ LYS 84 -6.701 12.496 1.918 665 H LYS 85 H LYS 85 -4.020 5.564 4.630 666 HA LYS 85 HA LYS 85 -3.189 6.006 7.424 667 1HB LYS 85 1HB LYS 85 -5.852 5.118 6.334 668 2HB LYS 85 2HB LYS 85 -5.330 4.582 7.920 669 1HG LYS 85 1HG LYS 85 -6.613 6.405 8.439 670 2HG LYS 85 2HG LYS 85 -5.001 7.116 8.382 671 1HD LYS 85 1HD LYS 85 -5.404 8.121 6.295 672 2HD LYS 85 2HD LYS 85 -6.826 7.117 5.991 673 1HE LYS 85 1HE LYS 85 -7.977 8.226 7.870 674 2HE LYS 85 2HE LYS 85 -6.564 9.250 8.108 675 1HZ LYS 85 1HZ LYS 85 -6.975 10.419 6.186 676 2HZ LYS 85 2HZ LYS 85 -8.550 10.122 6.738 677 3HZ LYS 85 3HZ LYS 85 -7.902 9.185 5.482 678 H THR 86 H THR 86 -2.140 4.286 8.317 679 HA THR 86 HA THR 86 -2.327 1.714 6.911 680 HB THR 86 HB THR 86 -0.215 2.942 6.311 681 HG1 THR 86 HG1 THR 86 0.300 0.910 6.015 682 1HG2 THR 86 1HG2 THR 86 0.481 2.462 9.213 683 2HG2 THR 86 2HG2 THR 86 0.187 4.032 8.465 684 3HG2 THR 86 3HG2 THR 86 1.580 3.069 7.973 685 H GLU 87 H GLU 87 -1.151 -0.020 8.358 686 HA GLU 87 HA GLU 87 -1.845 0.409 11.173 687 1HB GLU 87 1HB GLU 87 -3.240 -1.323 9.304 688 2HB GLU 87 2HB GLU 87 -2.586 -2.232 10.660 689 1HG GLU 87 1HG GLU 87 -4.385 0.175 10.861 690 2HG GLU 87 2HG GLU 87 -4.873 -1.507 11.072 691 H THR 88 H THR 88 -0.985 -1.320 12.573 692 HA THR 88 HA THR 88 1.767 -1.591 12.204 693 HB THR 88 HB THR 88 0.110 -3.326 14.029 694 HG1 THR 88 HG1 THR 88 1.104 -0.767 14.746 695 1HG2 THR 88 1HG2 THR 88 2.081 -3.150 15.489 696 2HG2 THR 88 2HG2 THR 88 2.895 -2.174 14.266 697 3HG2 THR 88 3HG2 THR 88 2.489 -3.856 13.927 698 H ILE 89 H ILE 89 -0.789 -4.087 12.009 699 HA ILE 89 HA ILE 89 0.864 -6.237 11.335 700 HB ILE 89 HB ILE 89 -1.202 -7.229 10.274 701 1HG1 ILE 89 1HG1 ILE 89 -2.378 -4.594 11.183 702 2HG1 ILE 89 2HG1 ILE 89 -2.299 -5.198 9.532 703 1HG2 ILE 89 1HG2 ILE 89 -0.622 -7.636 12.596 704 2HG2 ILE 89 2HG2 ILE 89 -2.370 -7.489 12.413 705 3HG2 ILE 89 3HG2 ILE 89 -1.435 -6.146 13.077 706 1HD1 ILE 89 1HD1 ILE 89 -3.892 -6.421 11.770 707 2HD1 ILE 89 2HD1 ILE 89 -3.835 -6.988 10.099 708 3HD1 ILE 89 3HD1 ILE 89 -4.531 -5.411 10.474 709 H ILE 90 H ILE 90 -0.457 -3.698 9.322 710 HA ILE 90 HA ILE 90 0.072 -4.935 6.820 711 HB ILE 90 HB ILE 90 -0.125 -1.983 7.444 712 1HG1 ILE 90 1HG1 ILE 90 -2.131 -3.150 8.182 713 2HG1 ILE 90 2HG1 ILE 90 -2.484 -2.202 6.744 714 1HG2 ILE 90 1HG2 ILE 90 -0.443 -3.473 4.842 715 2HG2 ILE 90 2HG2 ILE 90 0.884 -2.392 5.279 716 3HG2 ILE 90 3HG2 ILE 90 -0.747 -1.752 5.078 717 1HD1 ILE 90 1HD1 ILE 90 -3.564 -4.379 6.668 718 2HD1 ILE 90 2HD1 ILE 90 -1.996 -5.172 6.813 719 3HD1 ILE 90 3HD1 ILE 90 -2.373 -4.218 5.379 720 H ALA 91 H ALA 91 1.821 -2.591 8.821 721 HA ALA 91 HA ALA 91 4.061 -2.270 7.159 722 1HB ALA 91 1HB ALA 91 3.549 -0.759 9.008 723 2HB ALA 91 2HB ALA 91 5.188 -1.400 9.141 724 3HB ALA 91 3HB ALA 91 3.903 -2.045 10.163 725 H VAL 92 H VAL 92 3.339 -4.610 9.699 726 HA VAL 92 HA VAL 92 5.863 -5.856 9.816 727 HB VAL 92 HB VAL 92 3.139 -7.057 10.365 728 1HG1 VAL 92 1HG1 VAL 92 4.835 -8.780 10.000 729 2HG1 VAL 92 2HG1 VAL 92 4.324 -8.724 11.688 730 3HG1 VAL 92 3HG1 VAL 92 5.869 -8.017 11.209 731 1HG2 VAL 92 1HG2 VAL 92 5.154 -5.766 12.199 732 2HG2 VAL 92 2HG2 VAL 92 3.691 -6.597 12.724 733 3HG2 VAL 92 3HG2 VAL 92 3.571 -5.127 11.758 734 H GLY 93 H GLY 93 2.933 -6.731 7.980 735 1HA GLY 93 1HA GLY 93 4.020 -8.939 6.632 736 2HA GLY 93 2HA GLY 93 2.670 -7.968 6.063 737 H ALA 94 H ALA 94 3.900 -5.519 5.717 738 HA ALA 94 HA ALA 94 5.060 -5.808 3.172 739 1HB ALA 94 1HB ALA 94 5.112 -3.418 5.012 740 2HB ALA 94 2HB ALA 94 3.835 -3.814 3.861 741 3HB ALA 94 3HB ALA 94 5.450 -3.402 3.281 742 H ALA 95 H ALA 95 6.486 -5.395 6.369 743 HA ALA 95 HA ALA 95 9.120 -4.859 5.459 744 1HB ALA 95 1HB ALA 95 8.383 -4.253 7.698 745 2HB ALA 95 2HB ALA 95 9.800 -5.304 7.764 746 3HB ALA 95 3HB ALA 95 8.197 -5.958 8.110 747 H MET 96 H MET 96 7.448 -7.829 6.409 748 HA MET 96 HA MET 96 9.800 -9.451 6.273 749 1HB MET 96 1HB MET 96 6.880 -10.222 6.328 750 2HB MET 96 2HB MET 96 8.212 -11.357 6.483 751 1HG MET 96 1HG MET 96 8.934 -10.206 8.526 752 2HG MET 96 2HG MET 96 7.570 -9.102 8.365 753 1HE MET 96 1HE MET 96 4.979 -9.962 8.436 754 2HE MET 96 2HE MET 96 4.551 -11.651 8.707 755 3HE MET 96 3HE MET 96 5.375 -11.179 7.222 756 H ALA 97 H ALA 97 7.195 -8.680 4.054 757 HA ALA 97 HA ALA 97 8.073 -10.696 2.145 758 1HB ALA 97 1HB ALA 97 6.132 -10.044 0.844 759 2HB ALA 97 2HB ALA 97 5.839 -8.685 1.928 760 3HB ALA 97 3HB ALA 97 5.677 -10.338 2.522 761 H GLU 98 H GLU 98 8.888 -7.566 2.878 762 HA GLU 98 HA GLU 98 10.042 -5.906 1.884 763 1HB GLU 98 1HB GLU 98 11.459 -7.834 1.063 764 2HB GLU 98 2HB GLU 98 10.550 -7.768 -0.438 765 1HG GLU 98 1HG GLU 98 12.542 -6.567 -0.804 766 2HG GLU 98 2HG GLU 98 11.263 -5.366 -0.640 767 H ILE 99 H ILE 99 7.887 -5.038 1.779 768 HA ILE 99 HA ILE 99 7.043 -4.500 -0.986 769 HB ILE 99 HB ILE 99 5.190 -4.739 1.396 770 1HG1 ILE 99 1HG1 ILE 99 5.496 -6.582 -0.986 771 2HG1 ILE 99 2HG1 ILE 99 6.077 -6.933 0.639 772 1HG2 ILE 99 1HG2 ILE 99 4.631 -4.265 -1.532 773 2HG2 ILE 99 2HG2 ILE 99 4.419 -3.107 -0.220 774 3HG2 ILE 99 3HG2 ILE 99 3.403 -4.547 -0.297 775 1HD1 ILE 99 1HD1 ILE 99 3.982 -8.074 0.177 776 2HD1 ILE 99 2HD1 ILE 99 3.204 -6.528 -0.160 777 3HD1 ILE 99 3HD1 ILE 99 3.782 -6.887 1.466 778 HA PRO 100 HA PRO 100 8.648 -0.518 0.687 779 1HB PRO 100 1HB PRO 100 7.752 0.554 -1.827 780 2HB PRO 100 2HB PRO 100 9.405 0.281 -1.278 781 1HG PRO 100 1HG PRO 100 7.707 -1.389 -3.009 782 2HG PRO 100 2HG PRO 100 9.472 -1.333 -2.880 783 1HD PRO 100 1HD PRO 100 8.036 -3.411 -1.950 784 2HD PRO 100 2HD PRO 100 9.515 -2.854 -1.138 785 H LEU 101 H LEU 101 7.312 0.294 2.152 786 HA LEU 101 HA LEU 101 4.635 1.195 1.308 787 1HB LEU 101 1HB LEU 101 4.880 -0.747 3.003 788 2HB LEU 101 2HB LEU 101 5.412 0.480 4.130 789 HG LEU 101 HG LEU 101 2.712 0.480 2.766 790 1HD1 LEU 101 1HD1 LEU 101 1.837 -0.257 4.927 791 2HD1 LEU 101 2HD1 LEU 101 3.482 -0.394 5.547 792 3HD1 LEU 101 3HD1 LEU 101 2.943 -1.444 4.238 793 1HD2 LEU 101 1HD2 LEU 101 2.104 2.145 4.412 794 2HD2 LEU 101 2HD2 LEU 101 3.509 2.700 3.500 795 3HD2 LEU 101 3HD2 LEU 101 3.710 2.064 5.134 796 H VAL 102 H VAL 102 4.399 3.330 1.348 797 HA VAL 102 HA VAL 102 5.937 4.858 3.327 798 HB VAL 102 HB VAL 102 6.001 6.762 1.656 799 1HG1 VAL 102 1HG1 VAL 102 7.992 5.498 2.229 800 2HG1 VAL 102 2HG1 VAL 102 8.000 5.905 0.513 801 3HG1 VAL 102 3HG1 VAL 102 7.582 4.270 1.030 802 1HG2 VAL 102 1HG2 VAL 102 4.373 5.960 0.066 803 2HG2 VAL 102 2HG2 VAL 102 5.349 4.526 -0.256 804 3HG2 VAL 102 3HG2 VAL 102 5.939 6.120 -0.726 805 H GLU 103 H GLU 103 4.903 6.474 4.340 806 HA GLU 103 HA GLU 103 2.002 6.426 4.171 807 1HB GLU 103 1HB GLU 103 3.086 6.232 6.357 808 2HB GLU 103 2HB GLU 103 3.880 7.782 6.115 809 1HG GLU 103 1HG GLU 103 1.676 8.873 6.050 810 2HG GLU 103 2HG GLU 103 0.921 7.311 6.373 811 H VAL 104 H VAL 104 0.884 7.884 3.083 812 HA VAL 104 HA VAL 104 2.184 10.433 2.394 813 HB VAL 104 HB VAL 104 -0.178 9.081 1.074 814 1HG1 VAL 104 1HG1 VAL 104 1.279 11.626 0.370 815 2HG1 VAL 104 2HG1 VAL 104 -0.381 11.492 0.951 816 3HG1 VAL 104 3HG1 VAL 104 0.053 10.848 -0.632 817 1HG2 VAL 104 1HG2 VAL 104 2.667 9.455 0.164 818 2HG2 VAL 104 2HG2 VAL 104 1.352 8.843 -0.841 819 3HG2 VAL 104 3HG2 VAL 104 1.882 7.929 0.574 820 H ARG 105 H ARG 105 1.575 12.100 3.580 821 HA ARG 105 HA ARG 105 -1.152 12.142 4.665 822 1HB ARG 105 1HB ARG 105 1.334 13.629 5.543 823 2HB ARG 105 2HB ARG 105 -0.263 13.858 6.247 824 1HG ARG 105 1HG ARG 105 -0.291 11.523 6.957 825 2HG ARG 105 2HG ARG 105 1.304 11.285 6.240 826 1HD ARG 105 1HD ARG 105 0.652 13.203 8.475 827 2HD ARG 105 2HD ARG 105 1.403 11.621 8.675 828 HE ARG 105 HE ARG 105 2.671 13.826 7.165 829 1HH1 ARG 105 1HH1 ARG 105 2.841 11.130 9.400 830 2HH1 ARG 105 2HH1 ARG 105 4.535 11.336 9.708 831 1HH2 ARG 105 1HH2 ARG 105 4.912 14.076 7.563 832 2HH2 ARG 105 2HH2 ARG 105 5.713 12.985 8.667 833 H ASP 106 H ASP 106 0.071 12.973 1.957 834 HA ASP 106 HA ASP 106 -0.896 15.750 1.923 835 1HB ASP 106 1HB ASP 106 1.491 15.247 1.187 836 2HB ASP 106 2HB ASP 106 0.784 14.447 -0.215 837 H GLU 107 H GLU 107 -2.626 16.269 0.751 838 HA GLU 107 HA GLU 107 -4.316 14.171 -0.174 839 1HB GLU 107 1HB GLU 107 -4.858 16.531 0.869 840 2HB GLU 107 2HB GLU 107 -4.834 17.048 -0.811 841 1HG GLU 107 1HG GLU 107 -7.084 16.562 -0.214 842 2HG GLU 107 2HG GLU 107 -6.525 15.297 -1.308 843 H LYS 108 H LYS 108 -2.037 16.295 -1.731 844 HA LYS 108 HA LYS 108 -3.311 16.275 -4.279 845 1HB LYS 108 1HB LYS 108 -0.543 17.103 -3.430 846 2HB LYS 108 2HB LYS 108 -1.175 17.298 -5.053 847 1HG LYS 108 1HG LYS 108 -3.007 18.689 -4.109 848 2HG LYS 108 2HG LYS 108 -2.196 18.598 -2.546 849 1HD LYS 108 1HD LYS 108 -1.541 20.654 -3.547 850 2HD LYS 108 2HD LYS 108 -0.159 19.565 -3.658 851 1HE LYS 108 1HE LYS 108 -0.430 20.756 -5.748 852 2HE LYS 108 2HE LYS 108 -0.791 19.048 -5.990 853 1HZ LYS 108 1HZ LYS 108 -3.125 19.518 -5.962 854 2HZ LYS 108 2HZ LYS 108 -2.391 20.558 -7.079 855 3HZ LYS 108 3HZ LYS 108 -2.849 21.145 -5.555 856 H PHE 109 H PHE 109 -1.217 14.084 -2.664 857 HA PHE 109 HA PHE 109 0.003 12.869 -4.894 858 1HB PHE 109 1HB PHE 109 0.745 12.411 -2.607 859 2HB PHE 109 2HB PHE 109 -0.799 11.644 -2.243 860 HD1 PHE 109 HD1 PHE 109 -1.135 9.374 -2.669 861 HD2 PHE 109 HD2 PHE 109 2.211 11.366 -4.396 862 HE1 PHE 109 HE1 PHE 109 -0.250 7.213 -3.441 863 HE2 PHE 109 HE2 PHE 109 3.098 9.206 -5.168 864 HZ PHE 109 HZ PHE 109 1.869 7.128 -4.692 865 H PHE 110 H PHE 110 -3.011 12.160 -3.184 866 HA PHE 110 HA PHE 110 -3.793 10.037 -4.921 867 1HB PHE 110 1HB PHE 110 -5.317 11.684 -2.897 868 2HB PHE 110 2HB PHE 110 -6.024 10.333 -3.771 869 HD1 PHE 110 HD1 PHE 110 -5.547 8.085 -3.171 870 HD2 PHE 110 HD2 PHE 110 -3.498 11.297 -1.268 871 HE1 PHE 110 HE1 PHE 110 -4.694 6.528 -1.465 872 HE2 PHE 110 HE2 PHE 110 -2.640 9.744 0.436 873 HZ PHE 110 HZ PHE 110 -3.241 7.357 0.339 874 H GLU 111 H GLU 111 -4.048 13.448 -4.964 875 HA GLU 111 HA GLU 111 -6.178 13.736 -6.799 876 1HB GLU 111 1HB GLU 111 -5.462 15.492 -5.251 877 2HB GLU 111 2HB GLU 111 -3.892 15.558 -6.030 878 1HG GLU 111 1HG GLU 111 -5.015 16.260 -8.112 879 2HG GLU 111 2HG GLU 111 -6.530 16.318 -7.213 880 H ALA 112 H ALA 112 -2.653 13.560 -7.060 881 HA ALA 112 HA ALA 112 -2.664 14.181 -9.873 882 1HB ALA 112 1HB ALA 112 -0.833 14.916 -8.424 883 2HB ALA 112 2HB ALA 112 -0.256 13.906 -9.750 884 3HB ALA 112 3HB ALA 112 -0.400 13.233 -8.127 885 H VAL 113 H VAL 113 -2.364 11.273 -7.904 886 HA VAL 113 HA VAL 113 -1.472 9.643 -10.086 887 HB VAL 113 HB VAL 113 -0.887 9.136 -7.721 888 1HG1 VAL 113 1HG1 VAL 113 -3.768 8.278 -7.487 889 2HG1 VAL 113 2HG1 VAL 113 -3.023 9.652 -6.669 890 3HG1 VAL 113 3HG1 VAL 113 -2.509 8.009 -6.282 891 1HG2 VAL 113 1HG2 VAL 113 -0.691 7.415 -9.444 892 2HG2 VAL 113 2HG2 VAL 113 -2.363 6.930 -9.157 893 3HG2 VAL 113 3HG2 VAL 113 -1.152 6.713 -7.894 894 H LYS 114 H LYS 114 -2.605 8.392 -11.437 895 HA LYS 114 HA LYS 114 -5.509 8.138 -11.014 896 1HB LYS 114 1HB LYS 114 -4.081 8.415 -13.653 897 2HB LYS 114 2HB LYS 114 -5.812 8.216 -13.425 898 1HG LYS 114 1HG LYS 114 -5.909 10.351 -12.261 899 2HG LYS 114 2HG LYS 114 -4.172 10.552 -12.495 900 1HD LYS 114 1HD LYS 114 -6.025 10.118 -14.810 901 2HD LYS 114 2HD LYS 114 -5.773 11.712 -14.115 902 1HE LYS 114 1HE LYS 114 -4.307 11.418 -16.015 903 2HE LYS 114 2HE LYS 114 -3.350 11.494 -14.540 904 1HZ LYS 114 1HZ LYS 114 -4.139 8.937 -15.831 905 2HZ LYS 114 2HZ LYS 114 -2.995 9.164 -14.594 906 3HZ LYS 114 3HZ LYS 114 -2.679 9.731 -16.156 907 H THR 115 H THR 115 -6.435 6.163 -11.861 908 HA THR 115 HA THR 115 -4.852 3.843 -11.705 909 HB THR 115 HB THR 115 -7.525 4.164 -13.104 910 HG1 THR 115 HG1 THR 115 -8.428 4.039 -11.165 911 1HG2 THR 115 1HG2 THR 115 -7.788 1.760 -12.584 912 2HG2 THR 115 2HG2 THR 115 -6.131 1.729 -11.977 913 3HG2 THR 115 3HG2 THR 115 -6.440 2.065 -13.682 914 H GLY 116 H GLY 116 -3.227 3.417 -13.092 915 1HA GLY 116 1HA GLY 116 -2.891 2.388 -15.308 916 2HA GLY 116 2HA GLY 116 -3.826 3.715 -15.973 917 H ASP 117 H ASP 117 -1.930 5.059 -13.616 918 HA ASP 117 HA ASP 117 -0.016 6.013 -15.579 919 1HB ASP 117 1HB ASP 117 -0.510 6.727 -12.693 920 2HB ASP 117 2HB ASP 117 0.873 7.350 -13.585 921 H ARG 118 H ARG 118 2.324 6.296 -14.580 922 HA ARG 118 HA ARG 118 3.117 3.644 -13.581 923 1HB ARG 118 1HB ARG 118 3.871 4.015 -15.874 924 2HB ARG 118 2HB ARG 118 4.659 5.509 -15.398 925 1HG ARG 118 1HG ARG 118 5.483 3.053 -13.972 926 2HG ARG 118 2HG ARG 118 5.954 3.193 -15.668 927 1HD ARG 118 1HD ARG 118 6.533 5.194 -13.484 928 2HD ARG 118 2HD ARG 118 7.691 4.073 -14.201 929 HE ARG 118 HE ARG 118 6.337 6.139 -15.810 930 1HH1 ARG 118 1HH1 ARG 118 9.290 4.652 -14.634 931 2HH1 ARG 118 2HH1 ARG 118 10.304 5.455 -15.794 932 1HH2 ARG 118 1HH2 ARG 118 7.670 7.143 -17.376 933 2HH2 ARG 118 2HH2 ARG 118 9.385 6.859 -17.360 934 H VAL 119 H VAL 119 3.916 3.623 -11.633 935 HA VAL 119 HA VAL 119 4.935 6.143 -10.500 936 HB VAL 119 HB VAL 119 3.523 3.821 -9.194 937 1HG1 VAL 119 1HG1 VAL 119 3.938 4.908 -7.023 938 2HG1 VAL 119 2HG1 VAL 119 5.018 6.054 -7.816 939 3HG1 VAL 119 3HG1 VAL 119 5.430 4.340 -7.773 940 1HG2 VAL 119 1HG2 VAL 119 3.014 6.794 -9.187 941 2HG2 VAL 119 2HG2 VAL 119 2.021 5.569 -8.399 942 3HG2 VAL 119 3HG2 VAL 119 2.146 5.606 -10.157 943 H VAL 120 H VAL 120 6.992 6.268 -10.053 944 HA VAL 120 HA VAL 120 8.552 3.810 -9.617 945 HB VAL 120 HB VAL 120 9.649 6.595 -10.055 946 1HG1 VAL 120 1HG1 VAL 120 10.889 3.862 -10.331 947 2HG1 VAL 120 2HG1 VAL 120 11.201 5.035 -9.050 948 3HG1 VAL 120 3HG1 VAL 120 11.687 5.388 -10.709 949 1HG2 VAL 120 1HG2 VAL 120 9.159 4.484 -12.150 950 2HG2 VAL 120 2HG2 VAL 120 10.020 6.004 -12.395 951 3HG2 VAL 120 3HG2 VAL 120 8.302 6.017 -11.997 952 H VAL 121 H VAL 121 8.415 3.383 -7.447 953 HA VAL 121 HA VAL 121 8.677 5.675 -5.620 954 HB VAL 121 HB VAL 121 6.579 4.511 -5.312 955 1HG1 VAL 121 1HG1 VAL 121 6.461 2.186 -4.600 956 2HG1 VAL 121 2HG1 VAL 121 8.214 2.044 -4.744 957 3HG1 VAL 121 3HG1 VAL 121 7.231 2.322 -6.183 958 1HG2 VAL 121 1HG2 VAL 121 6.745 3.990 -2.920 959 2HG2 VAL 121 2HG2 VAL 121 7.632 5.456 -3.335 960 3HG2 VAL 121 3HG2 VAL 121 8.501 3.948 -3.059 961 H ASN 122 H ASN 122 10.354 5.852 -4.324 962 HA ASN 122 HA ASN 122 12.084 3.498 -3.921 963 1HB ASN 122 1HB ASN 122 13.236 5.262 -5.174 964 2HB ASN 122 2HB ASN 122 12.839 6.433 -3.922 965 1HD2 ASN 122 1HD2 ASN 122 15.030 6.897 -3.618 966 2HD2 ASN 122 2HD2 ASN 122 16.080 5.803 -2.775 967 H ALA 123 H ALA 123 11.516 2.672 -2.000 968 HA ALA 123 HA ALA 123 10.457 4.356 0.085 969 1HB ALA 123 1HB ALA 123 10.134 2.291 1.322 970 2HB ALA 123 2HB ALA 123 11.072 1.406 0.118 971 3HB ALA 123 3HB ALA 123 9.528 2.135 -0.326 972 H ASP 124 H ASP 124 13.549 3.140 -0.777 973 HA ASP 124 HA ASP 124 14.806 3.053 1.732 974 1HB ASP 124 1HB ASP 124 15.835 3.593 -1.048 975 2HB ASP 124 2HB ASP 124 16.907 3.641 0.346 976 H GLU 125 H GLU 125 13.950 5.705 -0.350 977 HA GLU 125 HA GLU 125 15.174 7.583 1.550 978 1HB GLU 125 1HB GLU 125 15.932 7.798 -0.788 979 2HB GLU 125 2HB GLU 125 14.273 8.068 -1.299 980 1HG GLU 125 1HG GLU 125 14.186 10.130 -0.048 981 2HG GLU 125 2HG GLU 125 15.805 9.842 0.589 982 H GLY 126 H GLY 126 12.197 6.719 -0.118 983 1HA GLY 126 1HA GLY 126 10.046 6.999 0.852 984 2HA GLY 126 2HA GLY 126 10.694 8.295 1.850 985 H TYR 127 H TYR 127 10.438 7.568 -1.632 986 HA TYR 127 HA TYR 127 9.329 10.225 -2.091 987 1HB TYR 127 1HB TYR 127 11.877 10.334 -2.137 988 2HB TYR 127 2HB TYR 127 11.804 9.316 -3.568 989 HD1 TYR 127 HD1 TYR 127 12.239 10.517 -5.486 990 HD2 TYR 127 HD2 TYR 127 9.931 12.339 -2.410 991 HE1 TYR 127 HE1 TYR 127 11.978 12.528 -6.876 992 HE2 TYR 127 HE2 TYR 127 9.665 14.348 -3.797 993 HH TYR 127 HH TYR 127 10.823 15.469 -5.639 994 H VAL 128 H VAL 128 7.922 10.232 -3.759 995 HA VAL 128 HA VAL 128 7.789 7.766 -5.377 996 HB VAL 128 HB VAL 128 5.457 9.479 -4.493 997 1HG1 VAL 128 1HG1 VAL 128 5.085 8.420 -6.649 998 2HG1 VAL 128 2HG1 VAL 128 4.076 7.677 -5.408 999 3HG1 VAL 128 3HG1 VAL 128 5.530 6.852 -5.975 1000 1HG2 VAL 128 1HG2 VAL 128 4.837 7.573 -3.076 1001 2HG2 VAL 128 2HG2 VAL 128 6.392 8.263 -2.611 1002 3HG2 VAL 128 3HG2 VAL 128 6.334 6.759 -3.531 1003 H GLU 129 H GLU 129 8.413 8.197 -7.386 1004 HA GLU 129 HA GLU 129 7.643 10.774 -8.586 1005 1HB GLU 129 1HB GLU 129 9.756 8.783 -9.434 1006 2HB GLU 129 2HB GLU 129 9.376 10.273 -10.283 1007 1HG GLU 129 1HG GLU 129 10.041 11.556 -8.305 1008 2HG GLU 129 2HG GLU 129 10.467 10.052 -7.490 1009 H LEU 130 H LEU 130 5.735 10.557 -9.630 1010 HA LEU 130 HA LEU 130 5.320 8.102 -11.185 1011 1HB LEU 130 1HB LEU 130 3.028 8.340 -10.977 1012 2HB LEU 130 2HB LEU 130 3.606 8.883 -9.416 1013 HG LEU 130 HG LEU 130 2.959 10.811 -11.635 1014 1HD1 LEU 130 1HD1 LEU 130 1.122 9.776 -9.476 1015 2HD1 LEU 130 2HD1 LEU 130 0.962 9.490 -11.210 1016 3HD1 LEU 130 3HD1 LEU 130 0.772 11.120 -10.562 1017 1HD2 LEU 130 1HD2 LEU 130 2.699 12.392 -9.779 1018 2HD2 LEU 130 2HD2 LEU 130 4.316 11.683 -9.796 1019 3HD2 LEU 130 3HD2 LEU 130 3.117 11.118 -8.633 1020 H ILE 131 H ILE 131 4.693 8.226 -13.344 1021 HA ILE 131 HA ILE 131 5.160 10.851 -14.592 1022 HB ILE 131 HB ILE 131 5.497 8.149 -15.882 1023 1HG1 ILE 131 1HG1 ILE 131 7.205 8.510 -14.159 1024 2HG1 ILE 131 2HG1 ILE 131 7.917 8.581 -15.768 1025 1HG2 ILE 131 1HG2 ILE 131 6.559 9.386 -17.703 1026 2HG2 ILE 131 2HG2 ILE 131 6.234 10.902 -16.863 1027 3HG2 ILE 131 3HG2 ILE 131 4.896 9.916 -17.452 1028 1HD1 ILE 131 1HD1 ILE 131 7.195 10.959 -14.074 1029 2HD1 ILE 131 2HD1 ILE 131 7.964 11.002 -15.660 1030 3HD1 ILE 131 3HD1 ILE 131 8.816 10.298 -14.284 1031 H GLU 132 H GLU 132 3.672 11.692 -15.853 1032 HA GLU 132 HA GLU 132 1.004 10.764 -15.657 1033 1HB GLU 132 1HB GLU 132 2.110 12.884 -17.510 1034 2HB GLU 132 2HB GLU 132 0.442 12.715 -16.976 1035 1HG GLU 132 1HG GLU 132 0.973 13.381 -14.775 1036 2HG GLU 132 2HG GLU 132 2.702 13.203 -15.061 Start of MODEL 8 1 H VAL 1 H VAL 1 4.888 14.718 -12.579 2 HA VAL 1 HA VAL 1 5.980 16.601 -10.634 3 HB VAL 1 HB VAL 1 3.630 16.862 -11.084 4 1HG1 VAL 1 1HG1 VAL 1 1.986 15.118 -10.575 5 2HG1 VAL 1 2HG1 VAL 1 3.299 14.001 -10.203 6 3HG1 VAL 1 3HG1 VAL 1 3.106 14.614 -11.845 7 1HG2 VAL 1 1HG2 VAL 1 4.338 17.333 -8.819 8 2HG2 VAL 1 2HG2 VAL 1 4.077 15.649 -8.364 9 3HG2 VAL 1 3HG2 VAL 1 2.707 16.662 -8.818 10 H LYS 2 H LYS 2 6.907 16.031 -8.799 11 HA LYS 2 HA LYS 2 6.920 13.170 -8.113 12 1HB LYS 2 1HB LYS 2 9.204 15.137 -7.910 13 2HB LYS 2 2HB LYS 2 9.235 13.504 -7.256 14 1HG LYS 2 1HG LYS 2 8.869 12.634 -9.551 15 2HG LYS 2 2HG LYS 2 8.997 14.290 -10.152 16 1HD LYS 2 1HD LYS 2 11.261 14.454 -9.278 17 2HD LYS 2 2HD LYS 2 11.138 12.825 -8.607 18 1HE LYS 2 1HE LYS 2 10.775 11.973 -10.914 19 2HE LYS 2 2HE LYS 2 11.066 13.604 -11.518 20 1HZ LYS 2 1HZ LYS 2 13.050 12.237 -11.651 21 2HZ LYS 2 2HZ LYS 2 13.006 11.956 -9.979 22 3HZ LYS 2 3HZ LYS 2 13.289 13.522 -10.571 23 H PHE 3 H PHE 3 6.735 12.605 -6.001 24 HA PHE 3 HA PHE 3 6.047 14.798 -4.151 25 1HB PHE 3 1HB PHE 3 4.939 11.980 -4.206 26 2HB PHE 3 2HB PHE 3 4.467 13.254 -3.089 27 HD1 PHE 3 HD1 PHE 3 4.180 11.983 -6.503 28 HD2 PHE 3 HD2 PHE 3 3.052 15.078 -3.809 29 HE1 PHE 3 HE1 PHE 3 2.420 12.698 -8.066 30 HE2 PHE 3 HE2 PHE 3 1.288 15.798 -5.367 31 HZ PHE 3 HZ PHE 3 0.969 14.606 -7.498 32 H ALA 4 H ALA 4 6.396 14.292 -1.857 33 HA ALA 4 HA ALA 4 8.612 12.397 -1.446 34 1HB ALA 4 1HB ALA 4 8.217 15.068 -0.094 35 2HB ALA 4 2HB ALA 4 9.420 14.701 -1.332 36 3HB ALA 4 3HB ALA 4 9.512 13.920 0.248 37 H CYS 5 H CYS 5 8.225 10.867 0.019 38 HA CYS 5 HA CYS 5 6.034 11.294 1.932 39 1HB CYS 5 1HB CYS 5 5.765 8.777 1.790 40 2HB CYS 5 2HB CYS 5 5.311 9.672 0.344 41 HG CYS 5 HG CYS 5 6.548 7.782 -0.964 42 H ARG 6 H ARG 6 6.240 9.605 3.783 43 HA ARG 6 HA ARG 6 8.988 9.713 4.796 44 1HB ARG 6 1HB ARG 6 7.055 10.577 6.169 45 2HB ARG 6 2HB ARG 6 6.469 8.925 6.277 46 1HG ARG 6 1HG ARG 6 7.612 9.273 8.277 47 2HG ARG 6 2HG ARG 6 8.753 8.372 7.279 48 1HD ARG 6 1HD ARG 6 8.752 11.374 7.576 49 2HD ARG 6 2HD ARG 6 9.764 10.286 8.522 50 HE ARG 6 HE ARG 6 10.601 9.569 6.193 51 1HH1 ARG 6 1HH1 ARG 6 9.666 12.827 7.106 52 2HH1 ARG 6 2HH1 ARG 6 10.728 13.577 5.945 53 1HH2 ARG 6 1HH2 ARG 6 11.986 10.567 4.675 54 2HH2 ARG 6 2HH2 ARG 6 12.020 12.304 4.570 55 H ALA 7 H ALA 7 10.203 7.933 4.816 56 HA ALA 7 HA ALA 7 9.216 5.550 3.610 57 1HB ALA 7 1HB ALA 7 11.880 6.043 4.927 58 2HB ALA 7 2HB ALA 7 11.495 6.364 3.236 59 3HB ALA 7 3HB ALA 7 11.478 4.709 3.845 60 H ILE 8 H ILE 8 8.686 3.622 4.471 61 HA ILE 8 HA ILE 8 8.904 3.300 7.394 62 HB ILE 8 HB ILE 8 7.006 1.924 5.476 63 1HG1 ILE 8 1HG1 ILE 8 6.414 4.280 5.891 64 2HG1 ILE 8 2HG1 ILE 8 5.237 3.183 6.609 65 1HG2 ILE 8 1HG2 ILE 8 7.652 0.454 7.298 66 2HG2 ILE 8 2HG2 ILE 8 5.976 0.967 7.483 67 3HG2 ILE 8 3HG2 ILE 8 7.235 1.701 8.474 68 1HD1 ILE 8 1HD1 ILE 8 6.266 3.517 8.798 69 2HD1 ILE 8 2HD1 ILE 8 5.728 5.039 8.088 70 3HD1 ILE 8 3HD1 ILE 8 7.441 4.619 8.076 71 H THR 9 H THR 9 8.834 1.355 4.400 72 HA THR 9 HA THR 9 11.049 -0.251 5.492 73 HB THR 9 HB THR 9 10.348 -2.020 3.878 74 HG1 THR 9 HG1 THR 9 8.407 -1.805 2.793 75 1HG2 THR 9 1HG2 THR 9 8.212 -1.114 5.806 76 2HG2 THR 9 2HG2 THR 9 9.601 -2.130 6.196 77 3HG2 THR 9 3HG2 THR 9 8.345 -2.728 5.111 78 H ARG 10 H ARG 10 11.818 -1.428 3.002 79 HA ARG 10 HA ARG 10 12.890 0.982 1.672 80 1HB ARG 10 1HB ARG 10 14.355 -1.594 2.253 81 2HB ARG 10 2HB ARG 10 14.972 -0.320 1.217 82 1HG ARG 10 1HG ARG 10 16.030 -0.007 3.279 83 2HG ARG 10 2HG ARG 10 14.762 1.219 3.225 84 1HD ARG 10 1HD ARG 10 13.321 -0.297 4.558 85 2HD ARG 10 2HD ARG 10 14.675 -1.417 4.688 86 HE ARG 10 HE ARG 10 15.612 1.011 5.604 87 1HH1 ARG 10 1HH1 ARG 10 13.125 -1.293 6.476 88 2HH1 ARG 10 2HH1 ARG 10 13.102 -0.836 8.156 89 1HH2 ARG 10 1HH2 ARG 10 15.629 1.598 7.814 90 2HH2 ARG 10 2HH2 ARG 10 14.549 0.796 8.921 91 H GLY 11 H GLY 11 13.815 0.501 -0.529 92 1HA GLY 11 1HA GLY 11 13.640 -1.316 -2.323 93 2HA GLY 11 2HA GLY 11 11.923 -1.241 -1.969 94 H ARG 12 H ARG 12 13.525 -0.656 -4.428 95 HA ARG 12 HA ARG 12 12.185 1.882 -5.051 96 1HB ARG 12 1HB ARG 12 14.884 1.822 -4.637 97 2HB ARG 12 2HB ARG 12 14.814 1.456 -6.353 98 1HG ARG 12 1HG ARG 12 13.542 3.870 -5.079 99 2HG ARG 12 2HG ARG 12 15.131 3.860 -5.838 100 1HD ARG 12 1HD ARG 12 12.571 3.122 -7.248 101 2HD ARG 12 2HD ARG 12 13.302 4.725 -7.292 102 HE ARG 12 HE ARG 12 14.906 2.440 -8.173 103 1HH1 ARG 12 1HH1 ARG 12 13.184 5.393 -8.938 104 2HH1 ARG 12 2HH1 ARG 12 13.789 5.478 -10.561 105 1HH2 ARG 12 1HH2 ARG 12 15.708 2.544 -10.305 106 2HH2 ARG 12 2HH2 ARG 12 15.206 3.834 -11.356 107 H ALA 13 H ALA 13 10.798 1.399 -6.672 108 HA ALA 13 HA ALA 13 11.623 -0.097 -8.973 109 1HB ALA 13 1HB ALA 13 10.119 -1.987 -8.724 110 2HB ALA 13 2HB ALA 13 9.615 -1.401 -7.137 111 3HB ALA 13 3HB ALA 13 11.274 -1.943 -7.393 112 H GLU 14 H GLU 14 9.694 -0.532 -10.442 113 HA GLU 14 HA GLU 14 7.796 1.702 -10.206 114 1HB GLU 14 1HB GLU 14 7.574 1.614 -12.639 115 2HB GLU 14 2HB GLU 14 9.258 1.837 -12.182 116 1HG GLU 14 1HG GLU 14 9.829 -0.356 -12.763 117 2HG GLU 14 2HG GLU 14 8.147 -0.883 -12.779 118 H GLY 15 H GLY 15 5.638 1.297 -11.153 119 1HA GLY 15 1HA GLY 15 4.793 -1.304 -11.896 120 2HA GLY 15 2HA GLY 15 4.335 -0.971 -10.230 121 H GLU 16 H GLU 16 2.525 -1.354 -12.479 122 HA GLU 16 HA GLU 16 1.403 1.063 -13.313 123 1HB GLU 16 1HB GLU 16 0.133 -1.624 -12.776 124 2HB GLU 16 2HB GLU 16 -0.693 -0.284 -13.535 125 1HG GLU 16 1HG GLU 16 0.931 -0.328 -15.369 126 2HG GLU 16 2HG GLU 16 1.714 -1.716 -14.611 127 H ALA 17 H ALA 17 -0.026 2.440 -12.354 128 HA ALA 17 HA ALA 17 -0.097 2.364 -9.484 129 1HB ALA 17 1HB ALA 17 -1.140 4.539 -9.645 130 2HB ALA 17 2HB ALA 17 -1.416 4.313 -11.372 131 3HB ALA 17 3HB ALA 17 0.228 4.458 -10.755 132 H LEU 18 H LEU 18 -1.471 0.987 -8.554 133 HA LEU 18 HA LEU 18 -4.234 0.884 -9.553 134 1HB LEU 18 1HB LEU 18 -2.876 -1.244 -9.096 135 2HB LEU 18 2HB LEU 18 -3.005 -0.839 -7.397 136 HG LEU 18 HG LEU 18 -5.460 -1.159 -9.102 137 1HD1 LEU 18 1HD1 LEU 18 -5.569 -3.489 -8.410 138 2HD1 LEU 18 2HD1 LEU 18 -4.015 -3.334 -7.589 139 3HD1 LEU 18 3HD1 LEU 18 -4.103 -3.191 -9.344 140 1HD2 LEU 18 1HD2 LEU 18 -4.946 -1.483 -6.146 141 2HD2 LEU 18 2HD2 LEU 18 -6.495 -1.723 -6.953 142 3HD2 LEU 18 3HD2 LEU 18 -5.757 -0.122 -6.917 143 H VAL 19 H VAL 19 -5.504 2.360 -8.653 144 HA VAL 19 HA VAL 19 -4.860 3.234 -5.913 145 HB VAL 19 HB VAL 19 -5.940 4.973 -8.136 146 1HG1 VAL 19 1HG1 VAL 19 -4.985 5.677 -5.362 147 2HG1 VAL 19 2HG1 VAL 19 -6.663 5.655 -5.902 148 3HG1 VAL 19 3HG1 VAL 19 -5.530 6.819 -6.589 149 1HG2 VAL 19 1HG2 VAL 19 -3.634 4.361 -8.590 150 2HG2 VAL 19 2HG2 VAL 19 -3.166 4.839 -6.958 151 3HG2 VAL 19 3HG2 VAL 19 -3.731 6.054 -8.105 152 H THR 20 H THR 20 -6.386 2.571 -4.597 153 HA THR 20 HA THR 20 -9.165 3.086 -5.388 154 HB THR 20 HB THR 20 -8.961 0.699 -5.423 155 HG1 THR 20 HG1 THR 20 -10.833 1.616 -4.339 156 1HG2 THR 20 1HG2 THR 20 -7.789 0.883 -2.648 157 2HG2 THR 20 2HG2 THR 20 -6.921 0.437 -4.116 158 3HG2 THR 20 3HG2 THR 20 -8.198 -0.608 -3.497 159 H LYS 21 H LYS 21 -10.000 4.605 -4.196 160 HA LYS 21 HA LYS 21 -8.825 5.223 -1.591 161 1HB LYS 21 1HB LYS 21 -9.299 6.956 -3.441 162 2HB LYS 21 2HB LYS 21 -10.990 6.784 -2.993 163 1HG LYS 21 1HG LYS 21 -10.609 7.653 -0.832 164 2HG LYS 21 2HG LYS 21 -8.859 7.518 -1.006 165 1HD LYS 21 1HD LYS 21 -10.655 9.367 -2.578 166 2HD LYS 21 2HD LYS 21 -9.603 9.837 -1.242 167 1HE LYS 21 1HE LYS 21 -7.669 8.964 -2.582 168 2HE LYS 21 2HE LYS 21 -8.779 8.758 -3.936 169 1HZ LYS 21 1HZ LYS 21 -7.662 10.829 -4.175 170 2HZ LYS 21 2HZ LYS 21 -8.034 11.300 -2.589 171 3HZ LYS 21 3HZ LYS 21 -9.268 11.173 -3.755 172 H GLU 22 H GLU 22 -10.596 2.928 -2.300 173 HA GLU 22 HA GLU 22 -12.925 3.414 -0.595 174 1HB GLU 22 1HB GLU 22 -12.167 1.123 -2.422 175 2HB GLU 22 2HB GLU 22 -13.572 1.093 -1.372 176 1HG GLU 22 1HG GLU 22 -14.228 1.636 -3.616 177 2HG GLU 22 2HG GLU 22 -14.499 3.021 -2.568 178 H TYR 23 H TYR 23 -13.288 2.180 1.277 179 HA TYR 23 HA TYR 23 -10.910 1.054 2.474 180 1HB TYR 23 1HB TYR 23 -12.839 0.505 4.298 181 2HB TYR 23 2HB TYR 23 -11.967 2.029 4.220 182 HD1 TYR 23 HD1 TYR 23 -15.113 0.359 3.140 183 HD2 TYR 23 HD2 TYR 23 -13.099 4.037 3.851 184 HE1 TYR 23 HE1 TYR 23 -17.237 1.570 2.866 185 HE2 TYR 23 HE2 TYR 23 -15.214 5.255 3.577 186 HH TYR 23 HH TYR 23 -17.365 4.997 2.584 187 H ILE 24 H ILE 24 -10.340 -0.840 1.654 188 HA ILE 24 HA ILE 24 -12.362 -2.844 1.015 189 HB ILE 24 HB ILE 24 -9.373 -3.040 0.594 190 1HG1 ILE 24 1HG1 ILE 24 -10.235 -1.051 -0.561 191 2HG1 ILE 24 2HG1 ILE 24 -9.747 -2.294 -1.710 192 1HG2 ILE 24 1HG2 ILE 24 -10.536 -5.172 0.461 193 2HG2 ILE 24 2HG2 ILE 24 -9.953 -4.681 -1.128 194 3HG2 ILE 24 3HG2 ILE 24 -11.659 -4.502 -0.721 195 1HD1 ILE 24 1HD1 ILE 24 -12.088 -2.928 -1.999 196 2HD1 ILE 24 2HD1 ILE 24 -11.810 -1.233 -2.395 197 3HD1 ILE 24 3HD1 ILE 24 -12.565 -1.668 -0.861 198 H SER 25 H SER 25 -10.783 -1.957 3.667 199 HA SER 25 HA SER 25 -10.712 -2.792 5.715 200 1HB SER 25 1HB SER 25 -12.190 -5.090 4.453 201 2HB SER 25 2HB SER 25 -12.063 -4.728 6.149 202 HG SER 25 HG SER 25 -13.708 -3.639 4.298 203 H PHE 26 H PHE 26 -9.535 -4.870 3.162 204 HA PHE 26 HA PHE 26 -7.543 -5.936 2.938 205 1HB PHE 26 1HB PHE 26 -6.559 -4.170 4.371 206 2HB PHE 26 2HB PHE 26 -6.953 -5.129 5.792 207 HD1 PHE 26 HD1 PHE 26 -5.216 -6.292 6.720 208 HD2 PHE 26 HD2 PHE 26 -5.224 -5.626 2.518 209 HE1 PHE 26 HE1 PHE 26 -3.049 -7.441 6.538 210 HE2 PHE 26 HE2 PHE 26 -3.058 -6.777 2.327 211 HZ PHE 26 HZ PHE 26 -1.968 -7.685 4.340 212 H LEU 27 H LEU 27 -9.463 -6.593 5.792 213 HA LEU 27 HA LEU 27 -8.491 -9.152 6.405 214 1HB LEU 27 1HB LEU 27 -10.017 -7.736 7.813 215 2HB LEU 27 2HB LEU 27 -11.324 -8.146 6.725 216 HG LEU 27 HG LEU 27 -11.128 -9.408 8.964 217 1HD1 LEU 27 1HD1 LEU 27 -12.689 -10.054 7.229 218 2HD1 LEU 27 2HD1 LEU 27 -11.970 -11.481 7.973 219 3HD1 LEU 27 3HD1 LEU 27 -11.420 -10.939 6.387 220 1HD2 LEU 27 1HD2 LEU 27 -8.752 -9.923 8.822 221 2HD2 LEU 27 2HD2 LEU 27 -9.038 -10.891 7.375 222 3HD2 LEU 27 3HD2 LEU 27 -9.717 -11.395 8.923 223 H GLY 28 H GLY 28 -8.216 -10.591 4.816 224 1HA GLY 28 1HA GLY 28 -8.728 -12.156 3.217 225 2HA GLY 28 2HA GLY 28 -10.405 -11.986 3.715 226 H GLY 29 H GLY 29 -8.552 -9.269 2.559 227 1HA GLY 29 1HA GLY 29 -10.622 -8.795 0.599 228 2HA GLY 29 2HA GLY 29 -9.316 -7.703 1.022 229 H ILE 30 H ILE 30 -7.543 -10.262 0.481 230 HA ILE 30 HA ILE 30 -7.490 -9.901 -2.440 231 HB ILE 30 HB ILE 30 -5.058 -10.111 -0.648 232 1HG1 ILE 30 1HG1 ILE 30 -6.133 -7.737 -2.190 233 2HG1 ILE 30 2HG1 ILE 30 -6.217 -7.934 -0.443 234 1HG2 ILE 30 1HG2 ILE 30 -5.301 -9.649 -3.619 235 2HG2 ILE 30 2HG2 ILE 30 -4.713 -11.115 -2.834 236 3HG2 ILE 30 3HG2 ILE 30 -3.799 -9.615 -2.694 237 1HD1 ILE 30 1HD1 ILE 30 -3.700 -7.694 -2.073 238 2HD1 ILE 30 2HD1 ILE 30 -3.782 -7.900 -0.323 239 3HD1 ILE 30 3HD1 ILE 30 -4.420 -6.436 -1.069 240 H ASP 31 H ASP 31 -7.480 -11.705 -3.577 241 HA ASP 31 HA ASP 31 -7.578 -14.296 -2.451 242 1HB ASP 31 1HB ASP 31 -8.600 -13.682 -4.624 243 2HB ASP 31 2HB ASP 31 -6.992 -13.464 -5.303 244 H LYS 32 H LYS 32 -5.980 -15.768 -2.053 245 HA LYS 32 HA LYS 32 -3.304 -14.663 -2.026 246 1HB LYS 32 1HB LYS 32 -2.725 -16.478 -0.554 247 2HB LYS 32 2HB LYS 32 -4.242 -15.769 -0.027 248 1HG LYS 32 1HG LYS 32 -5.434 -17.627 -1.175 249 2HG LYS 32 2HG LYS 32 -3.865 -18.358 -1.512 250 1HD LYS 32 1HD LYS 32 -3.409 -18.378 0.934 251 2HD LYS 32 2HD LYS 32 -5.047 -17.783 1.205 252 1HE LYS 32 1HE LYS 32 -5.110 -20.136 1.514 253 2HE LYS 32 2HE LYS 32 -5.878 -19.799 -0.036 254 1HZ LYS 32 1HZ LYS 32 -4.427 -21.654 -0.304 255 2HZ LYS 32 2HZ LYS 32 -3.133 -20.831 0.416 256 3HZ LYS 32 3HZ LYS 32 -3.710 -20.334 -1.096 257 H GLU 33 H GLU 33 -4.949 -16.313 -4.315 258 HA GLU 33 HA GLU 33 -2.649 -17.948 -5.118 259 1HB GLU 33 1HB GLU 33 -5.561 -18.051 -5.699 260 2HB GLU 33 2HB GLU 33 -4.451 -18.643 -6.930 261 1HG GLU 33 1HG GLU 33 -4.505 -19.578 -4.071 262 2HG GLU 33 2HG GLU 33 -5.263 -20.407 -5.428 263 H THR 34 H THR 34 -4.963 -15.638 -6.518 264 HA THR 34 HA THR 34 -3.022 -15.190 -8.684 265 HB THR 34 HB THR 34 -5.043 -16.049 -9.587 266 HG1 THR 34 HG1 THR 34 -4.304 -13.466 -10.072 267 1HG2 THR 34 1HG2 THR 34 -6.523 -13.874 -8.104 268 2HG2 THR 34 2HG2 THR 34 -6.527 -15.592 -7.694 269 3HG2 THR 34 3HG2 THR 34 -7.235 -15.043 -9.215 270 H GLY 35 H GLY 35 -4.044 -13.754 -5.892 271 1HA GLY 35 1HA GLY 35 -3.698 -11.643 -5.048 272 2HA GLY 35 2HA GLY 35 -2.756 -11.306 -6.493 273 H ILE 36 H ILE 36 -6.166 -12.153 -6.173 274 HA ILE 36 HA ILE 36 -6.883 -9.619 -7.488 275 HB ILE 36 HB ILE 36 -8.387 -12.245 -7.422 276 1HG1 ILE 36 1HG1 ILE 36 -6.447 -12.264 -8.932 277 2HG1 ILE 36 2HG1 ILE 36 -7.957 -12.322 -9.832 278 1HG2 ILE 36 1HG2 ILE 36 -9.123 -9.646 -8.762 279 2HG2 ILE 36 2HG2 ILE 36 -9.938 -10.386 -7.384 280 3HG2 ILE 36 3HG2 ILE 36 -9.975 -11.179 -8.959 281 1HD1 ILE 36 1HD1 ILE 36 -6.363 -10.857 -10.905 282 2HD1 ILE 36 2HD1 ILE 36 -6.222 -9.901 -9.429 283 3HD1 ILE 36 3HD1 ILE 36 -7.746 -9.937 -10.313 284 H VAL 37 H VAL 37 -8.153 -8.218 -6.387 285 HA VAL 37 HA VAL 37 -8.722 -8.542 -3.653 286 HB VAL 37 HB VAL 37 -10.045 -6.646 -5.616 287 1HG1 VAL 37 1HG1 VAL 37 -9.756 -6.486 -2.619 288 2HG1 VAL 37 2HG1 VAL 37 -11.247 -6.819 -3.501 289 3HG1 VAL 37 3HG1 VAL 37 -10.462 -5.247 -3.658 290 1HG2 VAL 37 1HG2 VAL 37 -8.344 -5.033 -4.911 291 2HG2 VAL 37 2HG2 VAL 37 -7.621 -6.444 -5.685 292 3HG2 VAL 37 3HG2 VAL 37 -7.572 -6.279 -3.929 293 H LYS 38 H LYS 38 -10.241 -9.651 -2.672 294 HA LYS 38 HA LYS 38 -12.313 -11.053 -4.050 295 1HB LYS 38 1HB LYS 38 -11.914 -10.592 -1.087 296 2HB LYS 38 2HB LYS 38 -13.019 -11.755 -1.797 297 1HG LYS 38 1HG LYS 38 -10.053 -11.854 -2.242 298 2HG LYS 38 2HG LYS 38 -10.851 -12.660 -0.894 299 1HD LYS 38 1HD LYS 38 -12.340 -13.734 -2.712 300 2HD LYS 38 2HD LYS 38 -11.073 -13.227 -3.831 301 1HE LYS 38 1HE LYS 38 -9.414 -14.447 -2.501 302 2HE LYS 38 2HE LYS 38 -10.684 -14.953 -1.391 303 1HZ LYS 38 1HZ LYS 38 -10.123 -15.865 -4.122 304 2HZ LYS 38 2HZ LYS 38 -11.734 -15.890 -3.582 305 3HZ LYS 38 3HZ LYS 38 -10.545 -16.760 -2.745 306 H GLU 39 H GLU 39 -12.224 -8.329 -1.800 307 HA GLU 39 HA GLU 39 -14.996 -7.917 -1.607 308 1HB GLU 39 1HB GLU 39 -13.461 -6.975 0.019 309 2HB GLU 39 2HB GLU 39 -12.685 -6.009 -1.226 310 1HG GLU 39 1HG GLU 39 -14.098 -4.586 0.057 311 2HG GLU 39 2HG GLU 39 -14.809 -4.781 -1.542 312 H ASP 40 H ASP 40 -16.404 -7.116 -3.012 313 HA ASP 40 HA ASP 40 -15.448 -5.997 -5.500 314 1HB ASP 40 1HB ASP 40 -17.330 -7.482 -5.680 315 2HB ASP 40 2HB ASP 40 -18.242 -6.557 -4.490 316 H CYS 41 H CYS 41 -15.420 -3.953 -6.056 317 HA CYS 41 HA CYS 41 -17.055 -1.922 -4.974 318 1HB CYS 41 1HB CYS 41 -15.259 -2.443 -3.129 319 2HB CYS 41 2HB CYS 41 -14.180 -1.544 -4.192 320 HG CYS 41 HG CYS 41 -16.450 0.529 -4.143 321 H GLU 42 H GLU 42 -16.386 -2.946 -7.466 322 HA GLU 42 HA GLU 42 -16.109 -2.170 -9.574 323 1HB GLU 42 1HB GLU 42 -16.909 -0.008 -8.690 324 2HB GLU 42 2HB GLU 42 -15.254 0.434 -8.305 325 1HG GLU 42 1HG GLU 42 -14.662 0.499 -10.614 326 2HG GLU 42 2HG GLU 42 -16.217 -0.192 -11.082 327 H ILE 43 H ILE 43 -13.511 -1.661 -7.286 328 HA ILE 43 HA ILE 43 -11.450 -1.737 -9.317 329 HB ILE 43 HB ILE 43 -11.162 -1.967 -6.311 330 1HG1 ILE 43 1HG1 ILE 43 -12.289 0.117 -6.907 331 2HG1 ILE 43 2HG1 ILE 43 -10.653 0.441 -6.350 332 1HG2 ILE 43 1HG2 ILE 43 -9.153 -1.233 -8.434 333 2HG2 ILE 43 2HG2 ILE 43 -9.189 -2.733 -7.508 334 3HG2 ILE 43 3HG2 ILE 43 -8.863 -1.202 -6.696 335 1HD1 ILE 43 1HD1 ILE 43 -9.917 0.728 -8.651 336 2HD1 ILE 43 2HD1 ILE 43 -11.249 1.819 -8.264 337 3HD1 ILE 43 3HD1 ILE 43 -11.546 0.369 -9.223 338 H LYS 44 H LYS 44 -13.375 -3.990 -7.792 339 HA LYS 44 HA LYS 44 -11.673 -6.154 -7.288 340 1HB LYS 44 1HB LYS 44 -13.969 -6.119 -6.507 341 2HB LYS 44 2HB LYS 44 -14.568 -6.116 -8.160 342 1HG LYS 44 1HG LYS 44 -13.456 -8.357 -8.450 343 2HG LYS 44 2HG LYS 44 -13.172 -8.352 -6.707 344 1HD LYS 44 1HD LYS 44 -15.193 -9.592 -7.209 345 2HD LYS 44 2HD LYS 44 -15.597 -8.111 -6.342 346 1HE LYS 44 1HE LYS 44 -17.167 -8.380 -8.123 347 2HE LYS 44 2HE LYS 44 -16.097 -7.040 -8.534 348 1HZ LYS 44 1HZ LYS 44 -16.083 -9.788 -9.638 349 2HZ LYS 44 2HZ LYS 44 -14.793 -8.715 -9.867 350 3HZ LYS 44 3HZ LYS 44 -16.333 -8.334 -10.469 351 H GLY 45 H GLY 45 -10.747 -7.674 -8.551 352 1HA GLY 45 1HA GLY 45 -10.920 -9.131 -10.491 353 2HA GLY 45 2HA GLY 45 -11.549 -7.757 -11.386 354 H GLU 46 H GLU 46 -9.315 -6.206 -9.822 355 HA GLU 46 HA GLU 46 -7.394 -6.541 -11.971 356 1HB GLU 46 1HB GLU 46 -7.686 -4.475 -9.796 357 2HB GLU 46 2HB GLU 46 -6.335 -4.501 -10.923 358 1HG GLU 46 1HG GLU 46 -9.235 -4.268 -11.690 359 2HG GLU 46 2HG GLU 46 -8.091 -2.930 -11.594 360 H SER 47 H SER 47 -5.286 -7.104 -11.739 361 HA SER 47 HA SER 47 -4.637 -8.678 -9.397 362 1HB SER 47 1HB SER 47 -2.990 -8.156 -11.887 363 2HB SER 47 2HB SER 47 -2.694 -9.404 -10.677 364 HG SER 47 HG SER 47 -5.191 -9.679 -11.510 365 H VAL 48 H VAL 48 -3.233 -8.118 -7.817 366 HA VAL 48 HA VAL 48 -1.981 -5.490 -7.928 367 HB VAL 48 HB VAL 48 -1.256 -5.954 -5.607 368 1HG1 VAL 48 1HG1 VAL 48 -4.179 -6.461 -6.129 369 2HG1 VAL 48 2HG1 VAL 48 -3.400 -4.886 -5.990 370 3HG1 VAL 48 3HG1 VAL 48 -3.488 -5.954 -4.589 371 1HG2 VAL 48 1HG2 VAL 48 -2.088 -7.961 -4.453 372 2HG2 VAL 48 2HG2 VAL 48 -0.970 -8.366 -5.755 373 3HG2 VAL 48 3HG2 VAL 48 -2.707 -8.575 -5.987 374 H ALA 49 H ALA 49 -1.236 -8.506 -8.958 375 HA ALA 49 HA ALA 49 1.395 -8.942 -8.120 376 1HB ALA 49 1HB ALA 49 1.487 -10.615 -9.886 377 2HB ALA 49 2HB ALA 49 0.006 -9.966 -10.593 378 3HB ALA 49 3HB ALA 49 -0.036 -10.725 -9.001 379 H GLY 50 H GLY 50 2.576 -7.143 -8.373 380 1HA GLY 50 1HA GLY 50 4.443 -6.360 -9.605 381 2HA GLY 50 2HA GLY 50 3.616 -6.793 -11.093 382 H ARG 51 H ARG 51 1.643 -5.179 -8.863 383 HA ARG 51 HA ARG 51 2.014 -2.662 -10.347 384 1HB ARG 51 1HB ARG 51 -0.459 -3.929 -9.189 385 2HB ARG 51 2HB ARG 51 -0.398 -2.217 -9.585 386 1HG ARG 51 1HG ARG 51 0.187 -2.831 -11.918 387 2HG ARG 51 2HG ARG 51 -0.044 -4.527 -11.483 388 1HD ARG 51 1HD ARG 51 -2.349 -4.192 -11.042 389 2HD ARG 51 2HD ARG 51 -2.174 -2.440 -11.089 390 HE ARG 51 HE ARG 51 -1.401 -3.365 -13.586 391 1HH1 ARG 51 1HH1 ARG 51 -4.298 -3.468 -11.620 392 2HH1 ARG 51 2HH1 ARG 51 -5.387 -3.422 -12.981 393 1HH2 ARG 51 1HH2 ARG 51 -2.806 -3.288 -15.367 394 2HH2 ARG 51 2HH2 ARG 51 -4.526 -3.326 -15.117 395 H ILE 52 H ILE 52 1.333 -0.710 -9.120 396 HA ILE 52 HA ILE 52 2.447 -0.803 -6.417 397 HB ILE 52 HB ILE 52 1.832 1.523 -8.253 398 1HG1 ILE 52 1HG1 ILE 52 3.825 0.218 -8.868 399 2HG1 ILE 52 2HG1 ILE 52 4.252 1.835 -8.321 400 1HG2 ILE 52 1HG2 ILE 52 3.002 1.560 -5.472 401 2HG2 ILE 52 2HG2 ILE 52 1.430 2.194 -5.955 402 3HG2 ILE 52 3HG2 ILE 52 2.907 2.947 -6.557 403 1HD1 ILE 52 1HD1 ILE 52 4.464 -0.695 -6.707 404 2HD1 ILE 52 2HD1 ILE 52 4.872 0.924 -6.139 405 3HD1 ILE 52 3HD1 ILE 52 5.795 0.191 -7.450 406 H LEU 53 H LEU 53 1.117 -0.777 -4.716 407 HA LEU 53 HA LEU 53 -1.729 -0.328 -5.203 408 1HB LEU 53 1HB LEU 53 -1.033 -2.393 -4.053 409 2HB LEU 53 2HB LEU 53 -0.306 -1.434 -2.778 410 HG LEU 53 HG LEU 53 -2.546 -0.538 -2.210 411 1HD1 LEU 53 1HD1 LEU 53 -3.609 -0.793 -4.381 412 2HD1 LEU 53 2HD1 LEU 53 -4.527 -1.639 -3.135 413 3HD1 LEU 53 3HD1 LEU 53 -3.499 -2.547 -4.245 414 1HD2 LEU 53 1HD2 LEU 53 -2.330 -3.544 -2.202 415 2HD2 LEU 53 2HD2 LEU 53 -3.385 -2.580 -1.167 416 3HD2 LEU 53 3HD2 LEU 53 -1.633 -2.451 -1.009 417 H VAL 54 H VAL 54 -2.437 1.679 -4.941 418 HA VAL 54 HA VAL 54 -1.233 3.335 -2.829 419 HB VAL 54 HB VAL 54 -3.082 4.196 -5.065 420 1HG1 VAL 54 1HG1 VAL 54 -2.399 6.463 -4.465 421 2HG1 VAL 54 2HG1 VAL 54 -1.417 5.823 -3.147 422 3HG1 VAL 54 3HG1 VAL 54 -3.172 5.650 -3.105 423 1HG2 VAL 54 1HG2 VAL 54 -0.089 4.475 -4.848 424 2HG2 VAL 54 2HG2 VAL 54 -1.100 5.155 -6.122 425 3HG2 VAL 54 3HG2 VAL 54 -0.957 3.406 -5.951 426 H PHE 55 H PHE 55 -2.273 3.167 -0.951 427 HA PHE 55 HA PHE 55 -5.209 2.915 -0.976 428 1HB PHE 55 1HB PHE 55 -3.863 0.707 -0.755 429 2HB PHE 55 2HB PHE 55 -3.457 1.285 0.853 430 HD1 PHE 55 HD1 PHE 55 -6.504 0.922 -1.262 431 HD2 PHE 55 HD2 PHE 55 -4.704 0.428 2.559 432 HE1 PHE 55 HE1 PHE 55 -8.581 -0.083 -0.420 433 HE2 PHE 55 HE2 PHE 55 -6.783 -0.574 3.411 434 HZ PHE 55 HZ PHE 55 -8.726 -0.834 1.919 435 HA PRO 56 HA PRO 56 -4.571 5.781 2.416 436 1HB PRO 56 1HB PRO 56 -7.277 6.273 2.777 437 2HB PRO 56 2HB PRO 56 -6.255 7.056 1.574 438 1HG PRO 56 1HG PRO 56 -8.417 5.244 1.121 439 2HG PRO 56 2HG PRO 56 -7.359 5.995 -0.083 440 1HD PRO 56 1HD PRO 56 -7.256 3.281 1.090 441 2HD PRO 56 2HD PRO 56 -6.637 3.864 -0.468 442 H GLY 57 H GLY 57 -7.414 3.636 2.913 443 1HA GLY 57 1HA GLY 57 -6.361 2.904 5.528 444 2HA GLY 57 2HA GLY 57 -7.875 3.796 5.515 445 H GLY 58 H GLY 58 -7.019 0.965 6.224 446 1HA GLY 58 1HA GLY 58 -8.937 -0.471 4.500 447 2HA GLY 58 2HA GLY 58 -7.602 -1.232 5.354 448 H LYS 59 H LYS 59 -7.685 -1.355 7.662 449 HA LYS 59 HA LYS 59 -9.744 -0.562 9.314 450 1HB LYS 59 1HB LYS 59 -11.147 -2.027 7.805 451 2HB LYS 59 2HB LYS 59 -10.216 -3.402 8.381 452 1HG LYS 59 1HG LYS 59 -10.990 -2.981 10.657 453 2HG LYS 59 2HG LYS 59 -11.912 -1.589 10.086 454 1HD LYS 59 1HD LYS 59 -12.326 -4.451 9.219 455 2HD LYS 59 2HD LYS 59 -13.337 -3.565 10.361 456 1HE LYS 59 1HE LYS 59 -13.968 -1.993 8.634 457 2HE LYS 59 2HE LYS 59 -12.876 -2.769 7.489 458 1HZ LYS 59 1HZ LYS 59 -15.312 -3.962 8.701 459 2HZ LYS 59 2HZ LYS 59 -14.219 -4.807 7.725 460 3HZ LYS 59 3HZ LYS 59 -15.103 -3.512 7.082 461 H GLY 60 H GLY 60 -8.397 -3.810 8.807 462 1HA GLY 60 1HA GLY 60 -6.214 -4.122 10.140 463 2HA GLY 60 2HA GLY 60 -7.237 -3.682 11.502 464 H SER 61 H SER 61 -8.429 -5.195 12.458 465 HA SER 61 HA SER 61 -9.501 -7.131 12.913 466 1HB SER 61 1HB SER 61 -10.425 -6.775 10.557 467 2HB SER 61 2HB SER 61 -9.206 -7.923 10.014 468 HG SER 61 HG SER 61 -11.586 -8.446 11.007 469 H THR 62 H THR 62 -9.078 -9.721 11.921 470 HA THR 62 HA THR 62 -6.397 -10.159 13.026 471 HB THR 62 HB THR 62 -8.097 -11.158 14.381 472 HG1 THR 62 HG1 THR 62 -6.866 -13.208 12.827 473 1HG2 THR 62 1HG2 THR 62 -9.051 -12.600 11.906 474 2HG2 THR 62 2HG2 THR 62 -9.901 -11.307 12.750 475 3HG2 THR 62 3HG2 THR 62 -9.654 -12.861 13.543 476 H VAL 63 H VAL 63 -6.025 -9.482 10.607 477 HA VAL 63 HA VAL 63 -6.281 -11.501 8.616 478 HB VAL 63 HB VAL 63 -4.331 -9.193 8.664 479 1HG1 VAL 63 1HG1 VAL 63 -5.449 -10.790 6.366 480 2HG1 VAL 63 2HG1 VAL 63 -3.805 -10.889 6.996 481 3HG1 VAL 63 3HG1 VAL 63 -4.369 -9.401 6.232 482 1HG2 VAL 63 1HG2 VAL 63 -6.028 -7.987 7.340 483 2HG2 VAL 63 2HG2 VAL 63 -6.577 -8.352 8.976 484 3HG2 VAL 63 3HG2 VAL 63 -7.154 -9.317 7.618 485 H GLY 64 H GLY 64 -3.616 -10.495 10.742 486 1HA GLY 64 1HA GLY 64 -1.927 -11.928 11.545 487 2HA GLY 64 2HA GLY 64 -2.336 -13.086 10.287 488 H SER 65 H SER 65 -2.283 -10.348 8.656 489 HA SER 65 HA SER 65 -0.926 -9.353 7.166 490 1HB SER 65 1HB SER 65 1.316 -8.608 7.985 491 2HB SER 65 2HB SER 65 -0.024 -8.192 9.047 492 HG SER 65 HG SER 65 0.962 -10.584 9.764 493 H TYR 66 H TYR 66 -0.741 -12.473 7.482 494 HA TYR 66 HA TYR 66 1.821 -12.915 6.187 495 1HB TYR 66 1HB TYR 66 -0.271 -14.690 7.357 496 2HB TYR 66 2HB TYR 66 0.833 -15.362 6.159 497 HD1 TYR 66 HD1 TYR 66 0.407 -14.457 9.602 498 HD2 TYR 66 HD2 TYR 66 3.320 -15.133 6.579 499 HE1 TYR 66 HE1 TYR 66 2.130 -14.741 11.332 500 HE2 TYR 66 HE2 TYR 66 5.047 -15.420 8.299 501 HH TYR 66 HH TYR 66 5.477 -14.819 10.580 502 H VAL 67 H VAL 67 -1.215 -12.056 5.168 503 HA VAL 67 HA VAL 67 -1.582 -13.633 2.868 504 HB VAL 67 HB VAL 67 -2.452 -10.768 3.325 505 1HG1 VAL 67 1HG1 VAL 67 -3.481 -12.817 1.359 506 2HG1 VAL 67 2HG1 VAL 67 -2.514 -11.399 0.956 507 3HG1 VAL 67 3HG1 VAL 67 -4.139 -11.199 1.613 508 1HG2 VAL 67 1HG2 VAL 67 -3.281 -12.287 5.049 509 2HG2 VAL 67 2HG2 VAL 67 -3.914 -13.364 3.807 510 3HG2 VAL 67 3HG2 VAL 67 -4.594 -11.749 4.002 511 H LEU 68 H LEU 68 -0.069 -10.434 3.254 512 HA LEU 68 HA LEU 68 0.679 -10.094 0.568 513 1HB LEU 68 1HB LEU 68 1.961 -8.973 3.061 514 2HB LEU 68 2HB LEU 68 2.253 -8.397 1.432 515 HG LEU 68 HG LEU 68 -0.397 -8.277 2.874 516 1HD1 LEU 68 1HD1 LEU 68 0.001 -5.866 2.936 517 2HD1 LEU 68 2HD1 LEU 68 1.592 -6.108 2.215 518 3HD1 LEU 68 3HD1 LEU 68 1.245 -6.745 3.824 519 1HD2 LEU 68 1HD2 LEU 68 -1.103 -6.900 0.981 520 2HD2 LEU 68 2HD2 LEU 68 -0.652 -8.523 0.459 521 3HD2 LEU 68 3HD2 LEU 68 0.451 -7.173 0.197 522 H LEU 69 H LEU 69 2.345 -11.562 3.305 523 HA LEU 69 HA LEU 69 4.856 -11.896 2.090 524 1HB LEU 69 1HB LEU 69 4.468 -12.097 4.515 525 2HB LEU 69 2HB LEU 69 3.554 -13.569 4.245 526 HG LEU 69 HG LEU 69 5.601 -14.645 3.355 527 1HD1 LEU 69 1HD1 LEU 69 7.767 -13.552 3.713 528 2HD1 LEU 69 2HD1 LEU 69 6.933 -12.082 4.214 529 3HD1 LEU 69 3HD1 LEU 69 6.765 -12.670 2.562 530 1HD2 LEU 69 1HD2 LEU 69 6.745 -14.870 5.508 531 2HD2 LEU 69 2HD2 LEU 69 4.991 -14.932 5.693 532 3HD2 LEU 69 3HD2 LEU 69 5.872 -13.462 6.116 533 H ASN 70 H ASN 70 2.044 -14.064 2.316 534 HA ASN 70 HA ASN 70 3.210 -16.240 0.950 535 1HB ASN 70 1HB ASN 70 1.095 -16.321 2.321 536 2HB ASN 70 2HB ASN 70 0.272 -15.535 0.977 537 1HD2 ASN 70 1HD2 ASN 70 -0.040 -16.684 -0.953 538 2HD2 ASN 70 2HD2 ASN 70 0.125 -18.399 -1.029 539 H LEU 71 H LEU 71 1.209 -13.538 -0.185 540 HA LEU 71 HA LEU 71 1.001 -14.201 -2.876 541 1HB LEU 71 1HB LEU 71 1.354 -11.469 -1.636 542 2HB LEU 71 2HB LEU 71 0.828 -11.756 -3.281 543 HG LEU 71 HG LEU 71 -0.681 -12.601 -0.808 544 1HD1 LEU 71 1HD1 LEU 71 -2.263 -10.834 -1.476 545 2HD1 LEU 71 2HD1 LEU 71 -1.134 -10.327 -2.734 546 3HD1 LEU 71 3HD1 LEU 71 -0.678 -10.195 -1.035 547 1HD2 LEU 71 1HD2 LEU 71 -2.507 -13.031 -2.410 548 2HD2 LEU 71 2HD2 LEU 71 -1.116 -14.089 -2.650 549 3HD2 LEU 71 3HD2 LEU 71 -1.382 -12.724 -3.734 550 H ARG 72 H ARG 72 3.598 -12.587 -1.131 551 HA ARG 72 HA ARG 72 5.164 -11.865 -3.359 552 1HB ARG 72 1HB ARG 72 5.259 -11.563 -0.576 553 2HB ARG 72 2HB ARG 72 6.728 -12.433 -0.988 554 1HG ARG 72 1HG ARG 72 5.895 -9.897 -2.357 555 2HG ARG 72 2HG ARG 72 6.887 -9.923 -0.902 556 1HD ARG 72 1HD ARG 72 8.424 -11.501 -2.221 557 2HD ARG 72 2HD ARG 72 7.541 -10.944 -3.644 558 HE ARG 72 HE ARG 72 8.525 -8.810 -1.987 559 1HH1 ARG 72 1HH1 ARG 72 9.341 -11.020 -4.580 560 2HH1 ARG 72 2HH1 ARG 72 10.589 -9.999 -5.222 561 1HH2 ARG 72 1HH2 ARG 72 10.176 -7.469 -2.824 562 2HH2 ARG 72 2HH2 ARG 72 11.057 -7.970 -4.238 563 H LYS 73 H LYS 73 5.020 -14.779 -1.398 564 HA LYS 73 HA LYS 73 7.432 -15.912 -2.385 565 1HB LYS 73 1HB LYS 73 5.057 -17.269 -1.095 566 2HB LYS 73 2HB LYS 73 6.643 -17.990 -1.332 567 1HG LYS 73 1HG LYS 73 6.010 -15.613 0.401 568 2HG LYS 73 2HG LYS 73 6.382 -17.246 0.955 569 1HD LYS 73 1HD LYS 73 8.616 -17.083 0.005 570 2HD LYS 73 2HD LYS 73 8.248 -15.472 -0.618 571 1HE LYS 73 1HE LYS 73 9.536 -15.275 1.411 572 2HE LYS 73 2HE LYS 73 7.897 -14.695 1.698 573 1HZ LYS 73 1HZ LYS 73 7.373 -16.828 2.734 574 2HZ LYS 73 2HZ LYS 73 8.665 -16.060 3.519 575 3HZ LYS 73 3HZ LYS 73 8.966 -17.359 2.477 576 H ASN 74 H ASN 74 4.182 -15.804 -3.554 577 HA ASN 74 HA ASN 74 4.676 -17.919 -5.508 578 1HB ASN 74 1HB ASN 74 2.495 -17.833 -4.323 579 2HB ASN 74 2HB ASN 74 2.185 -16.259 -5.043 580 1HD2 ASN 74 1HD2 ASN 74 0.325 -16.992 -6.033 581 2HD2 ASN 74 2HD2 ASN 74 0.355 -18.029 -7.416 582 H GLY 75 H GLY 75 4.655 -14.487 -5.217 583 1HA GLY 75 1HA GLY 75 5.766 -13.100 -6.795 584 2HA GLY 75 2HA GLY 75 5.419 -14.291 -8.041 585 H VAL 76 H VAL 76 2.806 -13.583 -5.980 586 HA VAL 76 HA VAL 76 1.582 -11.956 -8.107 587 HB VAL 76 HB VAL 76 -0.610 -12.712 -7.128 588 1HG1 VAL 76 1HG1 VAL 76 -0.540 -14.922 -8.168 589 2HG1 VAL 76 2HG1 VAL 76 1.223 -14.871 -8.165 590 3HG1 VAL 76 3HG1 VAL 76 0.307 -13.724 -9.144 591 1HG2 VAL 76 1HG2 VAL 76 0.178 -13.363 -4.916 592 2HG2 VAL 76 2HG2 VAL 76 1.144 -14.656 -5.633 593 3HG2 VAL 76 3HG2 VAL 76 -0.617 -14.712 -5.726 594 H ALA 77 H ALA 77 3.262 -11.109 -5.802 595 HA ALA 77 HA ALA 77 1.383 -9.612 -4.149 596 1HB ALA 77 1HB ALA 77 3.269 -10.742 -3.056 597 2HB ALA 77 2HB ALA 77 3.323 -8.996 -2.823 598 3HB ALA 77 3HB ALA 77 4.394 -9.762 -3.997 599 HA PRO 78 HA PRO 78 1.958 -5.749 -6.284 600 1HB PRO 78 1HB PRO 78 1.896 -3.999 -4.197 601 2HB PRO 78 2HB PRO 78 0.454 -4.788 -4.841 602 1HG PRO 78 1HG PRO 78 2.090 -5.505 -2.440 603 2HG PRO 78 2HG PRO 78 0.325 -5.465 -2.620 604 1HD PRO 78 1HD PRO 78 1.731 -7.764 -2.728 605 2HD PRO 78 2HD PRO 78 0.262 -7.512 -3.689 606 H LYS 79 H LYS 79 3.485 -4.116 -6.666 607 HA LYS 79 HA LYS 79 6.172 -4.771 -6.036 608 1HB LYS 79 1HB LYS 79 4.793 -2.556 -7.494 609 2HB LYS 79 2HB LYS 79 6.482 -2.356 -7.054 610 1HG LYS 79 1HG LYS 79 5.431 -4.695 -8.626 611 2HG LYS 79 2HG LYS 79 6.096 -3.230 -9.354 612 1HD LYS 79 1HD LYS 79 8.217 -3.599 -8.279 613 2HD LYS 79 2HD LYS 79 7.571 -4.986 -7.405 614 1HE LYS 79 1HE LYS 79 7.230 -6.160 -9.521 615 2HE LYS 79 2HE LYS 79 7.864 -4.764 -10.395 616 1HZ LYS 79 1HZ LYS 79 9.993 -5.078 -9.461 617 2HZ LYS 79 2HZ LYS 79 9.488 -6.612 -9.983 618 3HZ LYS 79 3HZ LYS 79 9.427 -6.210 -8.334 619 H ALA 80 H ALA 80 3.930 -2.298 -4.915 620 HA ALA 80 HA ALA 80 5.279 -2.037 -2.408 621 1HB ALA 80 1HB ALA 80 6.735 -0.637 -3.779 622 2HB ALA 80 2HB ALA 80 5.845 0.330 -2.602 623 3HB ALA 80 3HB ALA 80 5.345 0.316 -4.296 624 H ILE 81 H ILE 81 4.181 -0.357 -1.038 625 HA ILE 81 HA ILE 81 1.418 0.128 -1.912 626 HB ILE 81 HB ILE 81 2.185 -0.896 0.831 627 1HG1 ILE 81 1HG1 ILE 81 0.642 -2.272 -1.381 628 2HG1 ILE 81 2HG1 ILE 81 2.308 -2.630 -0.939 629 1HG2 ILE 81 1HG2 ILE 81 -0.223 -0.984 1.241 630 2HG2 ILE 81 2HG2 ILE 81 -0.526 -0.301 -0.357 631 3HG2 ILE 81 3HG2 ILE 81 0.299 0.660 0.871 632 1HD1 ILE 81 1HD1 ILE 81 -0.084 -2.966 0.850 633 2HD1 ILE 81 2HD1 ILE 81 1.584 -3.366 1.255 634 3HD1 ILE 81 3HD1 ILE 81 0.747 -4.256 -0.017 635 H ILE 82 H ILE 82 0.987 2.211 -1.802 636 HA ILE 82 HA ILE 82 2.563 3.897 0.030 637 HB ILE 82 HB ILE 82 0.799 5.048 -2.102 638 1HG1 ILE 82 1HG1 ILE 82 2.104 3.285 -3.254 639 2HG1 ILE 82 2HG1 ILE 82 2.566 4.900 -3.774 640 1HG2 ILE 82 1HG2 ILE 82 3.470 5.894 -0.975 641 2HG2 ILE 82 2HG2 ILE 82 1.896 6.527 -0.496 642 3HG2 ILE 82 3HG2 ILE 82 2.496 6.804 -2.130 643 1HD1 ILE 82 1HD1 ILE 82 4.539 4.789 -2.339 644 2HD1 ILE 82 2HD1 ILE 82 4.504 3.476 -3.517 645 3HD1 ILE 82 3HD1 ILE 82 4.071 3.165 -1.835 646 H ASN 83 H ASN 83 1.536 4.494 1.861 647 HA ASN 83 HA ASN 83 -1.413 4.428 1.845 648 1HB ASN 83 1HB ASN 83 0.525 3.876 4.094 649 2HB ASN 83 2HB ASN 83 -1.200 4.106 4.343 650 1HD2 ASN 83 1HD2 ASN 83 -1.867 2.727 1.823 651 2HD2 ASN 83 2HD2 ASN 83 -1.622 1.044 2.144 652 H LYS 84 H LYS 84 -2.491 5.879 3.391 653 HA LYS 84 HA LYS 84 -1.548 8.552 3.178 654 1HB LYS 84 1HB LYS 84 -3.969 7.967 3.328 655 2HB LYS 84 2HB LYS 84 -3.717 7.475 4.998 656 1HG LYS 84 1HG LYS 84 -2.838 9.848 5.376 657 2HG LYS 84 2HG LYS 84 -3.572 10.226 3.817 658 1HD LYS 84 1HD LYS 84 -5.024 9.055 6.190 659 2HD LYS 84 2HD LYS 84 -5.040 10.756 5.730 660 1HE LYS 84 1HE LYS 84 -6.102 10.203 3.620 661 2HE LYS 84 2HE LYS 84 -6.011 8.483 4.000 662 1HZ LYS 84 1HZ LYS 84 -7.595 10.523 5.465 663 2HZ LYS 84 2HZ LYS 84 -7.449 8.902 5.929 664 3HZ LYS 84 3HZ LYS 84 -8.208 9.299 4.463 665 H LYS 85 H LYS 85 -1.995 6.382 5.988 666 HA LYS 85 HA LYS 85 0.361 7.660 7.160 667 1HB LYS 85 1HB LYS 85 -2.083 8.436 8.030 668 2HB LYS 85 2HB LYS 85 -1.756 7.093 9.124 669 1HG LYS 85 1HG LYS 85 0.616 8.357 9.197 670 2HG LYS 85 2HG LYS 85 -0.463 9.723 8.921 671 1HD LYS 85 1HD LYS 85 -1.694 9.246 10.891 672 2HD LYS 85 2HD LYS 85 -0.883 7.690 11.098 673 1HE LYS 85 1HE LYS 85 0.382 10.422 11.292 674 2HE LYS 85 2HE LYS 85 0.070 9.310 12.625 675 1HZ LYS 85 1HZ LYS 85 1.877 8.729 10.332 676 2HZ LYS 85 2HZ LYS 85 1.638 7.757 11.698 677 3HZ LYS 85 3HZ LYS 85 2.395 9.266 11.854 678 H THR 86 H THR 86 -0.441 5.060 5.973 679 HA THR 86 HA THR 86 0.452 2.970 6.101 680 HB THR 86 HB THR 86 1.623 3.825 8.755 681 HG1 THR 86 HG1 THR 86 2.311 4.368 6.120 682 1HG2 THR 86 1HG2 THR 86 2.409 1.606 6.860 683 2HG2 THR 86 2HG2 THR 86 1.602 1.393 8.414 684 3HG2 THR 86 3HG2 THR 86 3.243 2.037 8.352 685 H GLU 87 H GLU 87 -0.817 1.264 6.411 686 HA GLU 87 HA GLU 87 -2.491 1.040 8.765 687 1HB GLU 87 1HB GLU 87 -3.401 0.317 6.622 688 2HB GLU 87 2HB GLU 87 -2.063 -0.800 6.398 689 1HG GLU 87 1HG GLU 87 -4.042 -2.002 7.057 690 2HG GLU 87 2HG GLU 87 -2.835 -2.094 8.337 691 H THR 88 H THR 88 -2.038 -0.200 10.519 692 HA THR 88 HA THR 88 0.638 -0.729 11.101 693 HB THR 88 HB THR 88 -1.706 -2.008 12.511 694 HG1 THR 88 HG1 THR 88 -0.742 0.668 12.515 695 1HG2 THR 88 1HG2 THR 88 1.002 -1.082 13.481 696 2HG2 THR 88 2HG2 THR 88 0.515 -2.758 13.226 697 3HG2 THR 88 3HG2 THR 88 -0.262 -1.795 14.481 698 H ILE 89 H ILE 89 -1.979 -3.014 10.342 699 HA ILE 89 HA ILE 89 -0.353 -5.327 10.561 700 HB ILE 89 HB ILE 89 -3.013 -4.941 9.183 701 1HG1 ILE 89 1HG1 ILE 89 -2.286 -6.004 11.920 702 2HG1 ILE 89 2HG1 ILE 89 -3.035 -4.448 11.586 703 1HG2 ILE 89 1HG2 ILE 89 -1.900 -6.920 8.313 704 2HG2 ILE 89 2HG2 ILE 89 -3.244 -7.384 9.356 705 3HG2 ILE 89 3HG2 ILE 89 -1.587 -7.487 9.952 706 1HD1 ILE 89 1HD1 ILE 89 -4.234 -7.158 11.109 707 2HD1 ILE 89 2HD1 ILE 89 -4.986 -5.623 10.672 708 3HD1 ILE 89 3HD1 ILE 89 -4.680 -6.004 12.367 709 H ILE 90 H ILE 90 -1.217 -3.214 7.871 710 HA ILE 90 HA ILE 90 -0.175 -4.918 5.842 711 HB ILE 90 HB ILE 90 -0.729 -1.948 5.833 712 1HG1 ILE 90 1HG1 ILE 90 -2.198 -4.311 4.638 713 2HG1 ILE 90 2HG1 ILE 90 -2.710 -3.371 6.037 714 1HG2 ILE 90 1HG2 ILE 90 0.055 -3.728 3.530 715 2HG2 ILE 90 2HG2 ILE 90 1.018 -2.418 4.213 716 3HG2 ILE 90 3HG2 ILE 90 -0.499 -2.060 3.390 717 1HD1 ILE 90 1HD1 ILE 90 -3.956 -2.762 4.046 718 2HD1 ILE 90 2HD1 ILE 90 -2.455 -2.344 3.218 719 3HD1 ILE 90 3HD1 ILE 90 -2.979 -1.409 4.619 720 H ALA 91 H ALA 91 1.159 -2.316 7.813 721 HA ALA 91 HA ALA 91 3.612 -1.998 6.510 722 1HB ALA 91 1HB ALA 91 3.072 -1.726 9.463 723 2HB ALA 91 2HB ALA 91 2.775 -0.480 8.249 724 3HB ALA 91 3HB ALA 91 4.421 -1.021 8.572 725 H VAL 92 H VAL 92 2.708 -4.202 9.147 726 HA VAL 92 HA VAL 92 5.242 -5.371 9.503 727 HB VAL 92 HB VAL 92 2.533 -6.649 9.938 728 1HG1 VAL 92 1HG1 VAL 92 5.219 -7.336 11.124 729 2HG1 VAL 92 2HG1 VAL 92 4.368 -8.273 9.895 730 3HG1 VAL 92 3HG1 VAL 92 3.683 -8.109 11.514 731 1HG2 VAL 92 1HG2 VAL 92 2.801 -5.929 12.275 732 2HG2 VAL 92 2HG2 VAL 92 2.723 -4.560 11.167 733 3HG2 VAL 92 3HG2 VAL 92 4.274 -5.071 11.832 734 H GLY 93 H GLY 93 2.467 -6.406 7.535 735 1HA GLY 93 1HA GLY 93 3.671 -8.707 6.449 736 2HA GLY 93 2HA GLY 93 2.316 -7.834 5.747 737 H ALA 94 H ALA 94 3.548 -5.370 5.274 738 HA ALA 94 HA ALA 94 4.784 -5.856 2.784 739 1HB ALA 94 1HB ALA 94 5.138 -3.437 2.713 740 2HB ALA 94 2HB ALA 94 4.708 -3.325 4.419 741 3HB ALA 94 3HB ALA 94 3.501 -3.833 3.236 742 H ALA 95 H ALA 95 6.078 -5.002 5.961 743 HA ALA 95 HA ALA 95 8.754 -4.587 5.167 744 1HB ALA 95 1HB ALA 95 7.880 -3.904 7.356 745 2HB ALA 95 2HB ALA 95 9.320 -4.911 7.511 746 3HB ALA 95 3HB ALA 95 7.725 -5.600 7.818 747 H MET 96 H MET 96 7.014 -7.504 6.181 748 HA MET 96 HA MET 96 9.324 -9.179 6.160 749 1HB MET 96 1HB MET 96 6.381 -9.855 6.122 750 2HB MET 96 2HB MET 96 7.660 -11.053 6.254 751 1HG MET 96 1HG MET 96 8.415 -9.958 8.334 752 2HG MET 96 2HG MET 96 7.044 -8.855 8.214 753 1HE MET 96 1HE MET 96 4.760 -10.776 7.088 754 2HE MET 96 2HE MET 96 4.489 -9.638 8.405 755 3HE MET 96 3HE MET 96 4.003 -11.323 8.584 756 H ALA 97 H ALA 97 6.865 -8.357 3.799 757 HA ALA 97 HA ALA 97 7.805 -10.417 1.968 758 1HB ALA 97 1HB ALA 97 5.897 -9.848 0.615 759 2HB ALA 97 2HB ALA 97 5.576 -8.429 1.611 760 3HB ALA 97 3HB ALA 97 5.395 -10.044 2.294 761 H GLU 98 H GLU 98 9.001 -7.526 2.702 762 HA GLU 98 HA GLU 98 10.243 -5.930 1.663 763 1HB GLU 98 1HB GLU 98 10.479 -8.037 -0.490 764 2HB GLU 98 2HB GLU 98 11.494 -6.609 -0.346 765 1HG GLU 98 1HG GLU 98 11.329 -8.918 1.570 766 2HG GLU 98 2HG GLU 98 12.674 -8.506 0.510 767 H ILE 99 H ILE 99 7.694 -5.387 1.469 768 HA ILE 99 HA ILE 99 7.232 -4.486 -1.294 769 HB ILE 99 HB ILE 99 5.158 -4.933 0.865 770 1HG1 ILE 99 1HG1 ILE 99 5.733 -6.525 -1.643 771 2HG1 ILE 99 2HG1 ILE 99 6.117 -7.038 -0.004 772 1HG2 ILE 99 1HG2 ILE 99 4.880 -4.164 -2.038 773 2HG2 ILE 99 2HG2 ILE 99 4.521 -3.151 -0.639 774 3HG2 ILE 99 3HG2 ILE 99 3.542 -4.581 -0.967 775 1HD1 ILE 99 1HD1 ILE 99 3.739 -7.065 0.543 776 2HD1 ILE 99 2HD1 ILE 99 4.107 -8.121 -0.820 777 3HD1 ILE 99 3HD1 ILE 99 3.356 -6.551 -1.100 778 HA PRO 100 HA PRO 100 8.828 -0.710 0.778 779 1HB PRO 100 1HB PRO 100 7.743 0.217 -1.853 780 2HB PRO 100 2HB PRO 100 9.239 0.676 -1.033 781 1HG PRO 100 1HG PRO 100 9.194 -1.115 -3.047 782 2HG PRO 100 2HG PRO 100 10.346 -1.219 -1.705 783 1HD PRO 100 1HD PRO 100 8.066 -2.951 -2.335 784 2HD PRO 100 2HD PRO 100 9.439 -3.250 -1.255 785 H LEU 101 H LEU 101 7.578 0.013 2.338 786 HA LEU 101 HA LEU 101 4.856 0.973 1.739 787 1HB LEU 101 1HB LEU 101 5.461 -0.883 3.522 788 2HB LEU 101 2HB LEU 101 5.923 0.490 4.503 789 HG LEU 101 HG LEU 101 3.685 -0.261 5.071 790 1HD1 LEU 101 1HD1 LEU 101 3.601 2.371 3.609 791 2HD1 LEU 101 2HD1 LEU 101 4.140 2.124 5.271 792 3HD1 LEU 101 3HD1 LEU 101 2.456 1.825 4.835 793 1HD2 LEU 101 1HD2 LEU 101 1.848 -0.134 3.479 794 2HD2 LEU 101 2HD2 LEU 101 3.089 -1.269 2.939 795 3HD2 LEU 101 3HD2 LEU 101 2.975 0.332 2.206 796 H VAL 102 H VAL 102 4.517 3.130 1.879 797 HA VAL 102 HA VAL 102 6.345 4.732 3.516 798 HB VAL 102 HB VAL 102 6.348 6.520 1.755 799 1HG1 VAL 102 1HG1 VAL 102 7.647 3.899 1.020 800 2HG1 VAL 102 2HG1 VAL 102 8.301 5.121 2.110 801 3HG1 VAL 102 3HG1 VAL 102 8.107 5.482 0.395 802 1HG2 VAL 102 1HG2 VAL 102 5.889 5.859 -0.556 803 2HG2 VAL 102 2HG2 VAL 102 4.446 5.753 0.452 804 3HG2 VAL 102 3HG2 VAL 102 5.323 4.287 0.009 805 H GLU 103 H GLU 103 5.538 6.918 3.931 806 HA GLU 103 HA GLU 103 2.594 6.940 4.173 807 1HB GLU 103 1HB GLU 103 3.598 6.682 6.331 808 2HB GLU 103 2HB GLU 103 4.776 7.943 6.003 809 1HG GLU 103 1HG GLU 103 2.960 9.604 6.000 810 2HG GLU 103 2HG GLU 103 1.818 8.323 6.394 811 H VAL 104 H VAL 104 1.643 8.470 2.944 812 HA VAL 104 HA VAL 104 3.215 10.835 2.177 813 HB VAL 104 HB VAL 104 0.496 10.079 1.093 814 1HG1 VAL 104 1HG1 VAL 104 2.684 11.845 0.007 815 2HG1 VAL 104 2HG1 VAL 104 1.172 12.387 0.727 816 3HG1 VAL 104 3HG1 VAL 104 1.153 11.495 -0.791 817 1HG2 VAL 104 1HG2 VAL 104 1.956 8.227 0.616 818 2HG2 VAL 104 2HG2 VAL 104 3.203 9.321 0.013 819 3HG2 VAL 104 3HG2 VAL 104 1.678 9.156 -0.858 820 H ARG 105 H ARG 105 2.794 12.784 3.015 821 HA ARG 105 HA ARG 105 0.598 13.038 4.921 822 1HB ARG 105 1HB ARG 105 2.891 14.907 4.284 823 2HB ARG 105 2HB ARG 105 1.715 15.144 5.568 824 1HG ARG 105 1HG ARG 105 3.532 12.758 5.404 825 2HG ARG 105 2HG ARG 105 3.928 14.231 6.288 826 1HD ARG 105 1HD ARG 105 3.035 12.632 7.838 827 2HD ARG 105 2HD ARG 105 1.852 13.919 7.623 828 HE ARG 105 HE ARG 105 1.593 11.404 6.120 829 1HH1 ARG 105 1HH1 ARG 105 0.350 13.698 8.447 830 2HH1 ARG 105 2HH1 ARG 105 -1.214 12.945 8.551 831 1HH2 ARG 105 1HH2 ARG 105 -0.468 10.418 6.216 832 2HH2 ARG 105 2HH2 ARG 105 -1.683 11.098 7.262 833 H ASP 106 H ASP 106 0.176 12.987 2.011 834 HA ASP 106 HA ASP 106 -1.235 15.518 1.719 835 1HB ASP 106 1HB ASP 106 0.987 15.799 0.657 836 2HB ASP 106 2HB ASP 106 0.641 14.423 -0.384 837 H GLU 107 H GLU 107 -3.257 14.890 1.445 838 HA GLU 107 HA GLU 107 -4.019 12.377 0.344 839 1HB GLU 107 1HB GLU 107 -5.297 13.925 1.992 840 2HB GLU 107 2HB GLU 107 -5.851 14.755 0.548 841 1HG GLU 107 1HG GLU 107 -6.229 11.803 0.953 842 2HG GLU 107 2HG GLU 107 -7.379 12.997 1.545 843 H LYS 108 H LYS 108 -3.401 15.520 -0.985 844 HA LYS 108 HA LYS 108 -4.849 15.283 -3.373 845 1HB LYS 108 1HB LYS 108 -2.492 16.939 -2.540 846 2HB LYS 108 2HB LYS 108 -3.109 16.997 -4.181 847 1HG LYS 108 1HG LYS 108 -4.737 17.567 -1.718 848 2HG LYS 108 2HG LYS 108 -4.009 18.792 -2.759 849 1HD LYS 108 1HD LYS 108 -5.347 18.057 -4.629 850 2HD LYS 108 2HD LYS 108 -6.001 16.724 -3.681 851 1HE LYS 108 1HE LYS 108 -7.107 18.287 -2.192 852 2HE LYS 108 2HE LYS 108 -6.378 19.648 -3.043 853 1HZ LYS 108 1HZ LYS 108 -8.696 19.218 -3.710 854 2HZ LYS 108 2HZ LYS 108 -8.233 17.689 -4.290 855 3HZ LYS 108 3HZ LYS 108 -7.608 19.092 -5.006 856 H PHE 109 H PHE 109 -1.846 13.858 -2.364 857 HA PHE 109 HA PHE 109 -0.839 13.089 -4.866 858 1HB PHE 109 1HB PHE 109 0.528 12.697 -2.953 859 2HB PHE 109 2HB PHE 109 -0.741 11.784 -2.143 860 HD1 PHE 109 HD1 PHE 109 -0.726 9.477 -2.233 861 HD2 PHE 109 HD2 PHE 109 1.443 11.680 -5.159 862 HE1 PHE 109 HE1 PHE 109 0.213 7.381 -3.111 863 HE2 PHE 109 HE2 PHE 109 2.384 9.587 -6.039 864 HZ PHE 109 HZ PHE 109 1.769 7.436 -5.016 865 H PHE 110 H PHE 110 -3.257 11.634 -2.751 866 HA PHE 110 HA PHE 110 -3.695 9.307 -4.313 867 1HB PHE 110 1HB PHE 110 -5.411 10.644 -2.212 868 2HB PHE 110 2HB PHE 110 -5.746 9.064 -2.907 869 HD1 PHE 110 HD1 PHE 110 -4.609 7.131 -2.157 870 HD2 PHE 110 HD2 PHE 110 -3.382 10.979 -0.824 871 HE1 PHE 110 HE1 PHE 110 -3.180 6.080 -0.454 872 HE2 PHE 110 HE2 PHE 110 -1.946 9.935 0.881 873 HZ PHE 110 HZ PHE 110 -1.844 7.480 1.066 874 H GLU 111 H GLU 111 -4.880 12.550 -4.513 875 HA GLU 111 HA GLU 111 -7.070 11.900 -6.249 876 1HB GLU 111 1HB GLU 111 -6.984 13.882 -4.685 877 2HB GLU 111 2HB GLU 111 -5.792 14.591 -5.767 878 1HG GLU 111 1HG GLU 111 -7.438 14.379 -7.601 879 2HG GLU 111 2HG GLU 111 -8.626 13.881 -6.405 880 H ALA 112 H ALA 112 -3.726 12.891 -6.512 881 HA ALA 112 HA ALA 112 -3.871 13.571 -9.292 882 1HB ALA 112 1HB ALA 112 -2.261 14.642 -7.798 883 2HB ALA 112 2HB ALA 112 -1.453 13.834 -9.141 884 3HB ALA 112 3HB ALA 112 -1.459 13.092 -7.540 885 H VAL 113 H VAL 113 -2.647 10.813 -7.421 886 HA VAL 113 HA VAL 113 -1.928 9.414 -9.849 887 HB VAL 113 HB VAL 113 -0.530 9.119 -7.849 888 1HG1 VAL 113 1HG1 VAL 113 -2.917 7.713 -6.659 889 2HG1 VAL 113 2HG1 VAL 113 -2.237 9.250 -6.120 890 3HG1 VAL 113 3HG1 VAL 113 -1.294 7.766 -5.966 891 1HG2 VAL 113 1HG2 VAL 113 -0.521 7.395 -9.534 892 2HG2 VAL 113 2HG2 VAL 113 -1.914 6.615 -8.782 893 3HG2 VAL 113 3HG2 VAL 113 -0.368 6.668 -7.934 894 H LYS 114 H LYS 114 -3.228 8.181 -10.982 895 HA LYS 114 HA LYS 114 -5.606 7.058 -9.686 896 1HB LYS 114 1HB LYS 114 -5.496 8.444 -12.365 897 2HB LYS 114 2HB LYS 114 -6.878 7.525 -11.775 898 1HG LYS 114 1HG LYS 114 -7.197 9.054 -9.960 899 2HG LYS 114 2HG LYS 114 -5.709 9.910 -10.364 900 1HD LYS 114 1HD LYS 114 -6.717 10.499 -12.555 901 2HD LYS 114 2HD LYS 114 -8.230 9.767 -12.011 902 1HE LYS 114 1HE LYS 114 -8.380 11.341 -10.189 903 2HE LYS 114 2HE LYS 114 -6.807 12.018 -10.600 904 1HZ LYS 114 1HZ LYS 114 -8.496 13.451 -11.437 905 2HZ LYS 114 2HZ LYS 114 -9.287 12.175 -12.221 906 3HZ LYS 114 3HZ LYS 114 -7.765 12.685 -12.765 907 H THR 115 H THR 115 -6.406 5.133 -10.639 908 HA THR 115 HA THR 115 -4.449 3.284 -11.347 909 HB THR 115 HB THR 115 -7.401 3.038 -11.947 910 HG1 THR 115 HG1 THR 115 -7.701 2.601 -9.850 911 1HG2 THR 115 1HG2 THR 115 -7.009 0.643 -11.622 912 2HG2 THR 115 2HG2 THR 115 -5.298 0.956 -11.331 913 3HG2 THR 115 3HG2 THR 115 -5.996 1.274 -12.920 914 H GLY 116 H GLY 116 -3.245 3.445 -13.150 915 1HA GLY 116 1HA GLY 116 -4.007 2.746 -15.635 916 2HA GLY 116 2HA GLY 116 -4.394 4.459 -15.609 917 H ASP 117 H ASP 117 -2.145 5.292 -14.001 918 HA ASP 117 HA ASP 117 -0.133 5.060 -16.125 919 1HB ASP 117 1HB ASP 117 -1.166 7.321 -15.028 920 2HB ASP 117 2HB ASP 117 0.289 7.114 -14.052 921 H ARG 118 H ARG 118 2.126 5.953 -14.700 922 HA ARG 118 HA ARG 118 2.637 3.496 -13.182 923 1HB ARG 118 1HB ARG 118 4.262 5.121 -15.078 924 2HB ARG 118 2HB ARG 118 5.073 4.177 -13.848 925 1HG ARG 118 1HG ARG 118 4.941 2.416 -15.179 926 2HG ARG 118 2HG ARG 118 3.189 2.469 -14.998 927 1HD ARG 118 1HD ARG 118 4.791 3.937 -17.083 928 2HD ARG 118 2HD ARG 118 3.862 2.464 -17.351 929 HE ARG 118 HE ARG 118 2.783 5.155 -16.874 930 1HH1 ARG 118 1HH1 ARG 118 2.196 1.752 -17.471 931 2HH1 ARG 118 2HH1 ARG 118 0.600 2.013 -18.119 932 1HH2 ARG 118 1HH2 ARG 118 0.727 5.512 -17.750 933 2HH2 ARG 118 2HH2 ARG 118 -0.245 4.156 -18.246 934 H VAL 119 H VAL 119 3.504 3.547 -11.220 935 HA VAL 119 HA VAL 119 4.452 6.135 -10.165 936 HB VAL 119 HB VAL 119 3.117 3.873 -8.654 937 1HG1 VAL 119 1HG1 VAL 119 4.915 4.834 -7.323 938 2HG1 VAL 119 2HG1 VAL 119 3.343 5.295 -6.666 939 3HG1 VAL 119 3HG1 VAL 119 4.280 6.455 -7.609 940 1HG2 VAL 119 1HG2 VAL 119 1.395 5.519 -8.145 941 2HG2 VAL 119 2HG2 VAL 119 1.562 5.295 -9.886 942 3HG2 VAL 119 3HG2 VAL 119 2.248 6.723 -9.112 943 H VAL 120 H VAL 120 6.582 6.139 -9.798 944 HA VAL 120 HA VAL 120 7.916 3.572 -9.331 945 HB VAL 120 HB VAL 120 9.179 6.264 -9.875 946 1HG1 VAL 120 1HG1 VAL 120 11.218 4.943 -10.265 947 2HG1 VAL 120 2HG1 VAL 120 10.349 3.484 -9.786 948 3HG1 VAL 120 3HG1 VAL 120 10.624 4.771 -8.612 949 1HG2 VAL 120 1HG2 VAL 120 9.653 5.381 -12.113 950 2HG2 VAL 120 2HG2 VAL 120 7.919 5.485 -11.809 951 3HG2 VAL 120 3HG2 VAL 120 8.738 3.925 -11.728 952 H VAL 121 H VAL 121 8.110 3.015 -7.298 953 HA VAL 121 HA VAL 121 7.899 5.016 -5.207 954 HB VAL 121 HB VAL 121 6.607 2.950 -4.973 955 1HG1 VAL 121 1HG1 VAL 121 7.742 0.819 -4.502 956 2HG1 VAL 121 2HG1 VAL 121 9.289 1.577 -4.875 957 3HG1 VAL 121 3HG1 VAL 121 8.065 1.403 -6.133 958 1HG2 VAL 121 1HG2 VAL 121 8.802 3.199 -2.919 959 2HG2 VAL 121 2HG2 VAL 121 7.260 2.377 -2.680 960 3HG2 VAL 121 3HG2 VAL 121 7.297 4.119 -2.953 961 H ASN 122 H ASN 122 9.530 5.746 -3.997 962 HA ASN 122 HA ASN 122 12.091 4.316 -4.136 963 1HB ASN 122 1HB ASN 122 12.152 6.397 -5.487 964 2HB ASN 122 2HB ASN 122 11.716 7.321 -4.056 965 1HD2 ASN 122 1HD2 ASN 122 14.093 7.380 -5.814 966 2HD2 ASN 122 2HD2 ASN 122 15.446 7.186 -4.754 967 H ALA 123 H ALA 123 11.841 3.257 -2.215 968 HA ALA 123 HA ALA 123 11.220 4.788 0.183 969 1HB ALA 123 1HB ALA 123 11.815 1.853 -0.163 970 2HB ALA 123 2HB ALA 123 10.211 2.583 -0.087 971 3HB ALA 123 3HB ALA 123 11.268 2.626 1.324 972 H ASP 124 H ASP 124 13.837 4.396 -1.649 973 HA ASP 124 HA ASP 124 15.892 3.952 0.292 974 1HB ASP 124 1HB ASP 124 16.433 3.484 -1.987 975 2HB ASP 124 2HB ASP 124 15.863 5.058 -2.523 976 H GLU 125 H GLU 125 14.266 6.719 -1.114 977 HA GLU 125 HA GLU 125 15.689 8.499 0.755 978 1HB GLU 125 1HB GLU 125 14.271 9.162 -1.833 979 2HB GLU 125 2HB GLU 125 15.081 10.323 -0.789 980 1HG GLU 125 1HG GLU 125 17.208 9.204 -1.193 981 2HG GLU 125 2HG GLU 125 16.397 8.036 -2.235 982 H GLY 126 H GLY 126 12.695 7.043 0.162 983 1HA GLY 126 1HA GLY 126 10.571 7.447 1.018 984 2HA GLY 126 2HA GLY 126 11.239 8.812 1.917 985 H TYR 127 H TYR 127 10.435 7.772 -1.360 986 HA TYR 127 HA TYR 127 9.717 10.505 -2.091 987 1HB TYR 127 1HB TYR 127 12.252 9.919 -2.420 988 2HB TYR 127 2HB TYR 127 11.676 8.981 -3.787 989 HD1 TYR 127 HD1 TYR 127 10.590 10.149 -5.708 990 HD2 TYR 127 HD2 TYR 127 12.417 12.270 -2.508 991 HE1 TYR 127 HE1 TYR 127 10.686 12.169 -7.107 992 HE2 TYR 127 HE2 TYR 127 12.513 14.296 -3.891 993 HH TYR 127 HH TYR 127 12.575 14.799 -6.400 994 H VAL 128 H VAL 128 8.269 10.568 -3.800 995 HA VAL 128 HA VAL 128 7.657 8.006 -5.117 996 HB VAL 128 HB VAL 128 5.617 10.092 -4.312 997 1HG1 VAL 128 1HG1 VAL 128 5.274 7.429 -5.688 998 2HG1 VAL 128 2HG1 VAL 128 5.063 9.019 -6.423 999 3HG1 VAL 128 3HG1 VAL 128 3.967 8.484 -5.148 1000 1HG2 VAL 128 1HG2 VAL 128 4.720 8.333 -2.834 1001 2HG2 VAL 128 2HG2 VAL 128 6.350 8.828 -2.378 1002 3HG2 VAL 128 3HG2 VAL 128 6.099 7.311 -3.243 1003 H GLU 129 H GLU 129 8.495 8.292 -7.087 1004 HA GLU 129 HA GLU 129 8.108 10.878 -8.392 1005 1HB GLU 129 1HB GLU 129 9.706 9.885 -10.117 1006 2HB GLU 129 2HB GLU 129 10.369 10.234 -8.530 1007 1HG GLU 129 1HG GLU 129 9.987 7.800 -7.977 1008 2HG GLU 129 2HG GLU 129 9.651 7.562 -9.690 1009 H LEU 130 H LEU 130 6.268 11.070 -9.412 1010 HA LEU 130 HA LEU 130 4.889 8.764 -10.495 1011 1HB LEU 130 1HB LEU 130 3.702 10.561 -9.240 1012 2HB LEU 130 2HB LEU 130 4.112 11.688 -10.515 1013 HG LEU 130 HG LEU 130 2.774 10.333 -12.110 1014 1HD1 LEU 130 1HD1 LEU 130 1.277 8.617 -11.265 1015 2HD1 LEU 130 2HD1 LEU 130 1.949 8.807 -9.645 1016 3HD1 LEU 130 3HD1 LEU 130 2.958 8.181 -10.949 1017 1HD2 LEU 130 1HD2 LEU 130 0.582 10.990 -11.222 1018 2HD2 LEU 130 2HD2 LEU 130 1.781 12.266 -11.008 1019 3HD2 LEU 130 3HD2 LEU 130 1.307 11.260 -9.637 1020 H ILE 131 H ILE 131 4.902 8.184 -12.595 1021 HA ILE 131 HA ILE 131 6.183 10.069 -14.473 1022 HB ILE 131 HB ILE 131 6.149 7.128 -14.974 1023 1HG1 ILE 131 1HG1 ILE 131 7.158 7.431 -12.714 1024 2HG1 ILE 131 2HG1 ILE 131 8.311 6.831 -13.899 1025 1HG2 ILE 131 1HG2 ILE 131 6.766 8.588 -16.791 1026 2HG2 ILE 131 2HG2 ILE 131 8.172 7.664 -16.269 1027 3HG2 ILE 131 3HG2 ILE 131 8.003 9.353 -15.794 1028 1HD1 ILE 131 1HD1 ILE 131 8.068 9.682 -12.977 1029 2HD1 ILE 131 2HD1 ILE 131 9.251 9.054 -14.124 1030 3HD1 ILE 131 3HD1 ILE 131 9.285 8.522 -12.442 1031 H GLU 132 H GLU 132 4.701 10.872 -15.744 1032 HA GLU 132 HA GLU 132 2.226 9.449 -16.245 1033 1HB GLU 132 1HB GLU 132 2.963 12.106 -17.455 1034 2HB GLU 132 2HB GLU 132 1.364 11.468 -17.111 1035 1HG GLU 132 1HG GLU 132 1.651 13.101 -15.495 1036 2HG GLU 132 2HG GLU 132 2.066 11.615 -14.639 Start of MODEL 9 1 H VAL 1 H VAL 1 5.084 13.996 -11.168 2 HA VAL 1 HA VAL 1 6.013 16.223 -9.489 3 HB VAL 1 HB VAL 1 4.348 15.419 -7.760 4 1HG1 VAL 1 1HG1 VAL 1 2.484 16.651 -8.770 5 2HG1 VAL 1 2HG1 VAL 1 3.277 16.557 -10.343 6 3HG1 VAL 1 3HG1 VAL 1 4.023 17.472 -9.033 7 1HG2 VAL 1 1HG2 VAL 1 3.187 13.996 -10.156 8 2HG2 VAL 1 2HG2 VAL 1 2.376 14.213 -8.605 9 3HG2 VAL 1 3HG2 VAL 1 3.841 13.236 -8.706 10 H LYS 2 H LYS 2 7.685 15.749 -8.295 11 HA LYS 2 HA LYS 2 8.135 12.953 -7.476 12 1HB LYS 2 1HB LYS 2 10.101 15.260 -7.520 13 2HB LYS 2 2HB LYS 2 10.471 13.594 -7.099 14 1HG LYS 2 1HG LYS 2 10.025 12.878 -9.362 15 2HG LYS 2 2HG LYS 2 9.510 14.507 -9.806 16 1HD LYS 2 1HD LYS 2 11.764 14.182 -10.577 17 2HD LYS 2 2HD LYS 2 11.790 15.325 -9.234 18 1HE LYS 2 1HE LYS 2 13.579 13.893 -8.786 19 2HE LYS 2 2HE LYS 2 12.282 13.282 -7.761 20 1HZ LYS 2 1HZ LYS 2 12.894 11.334 -8.687 21 2HZ LYS 2 2HZ LYS 2 13.564 12.054 -10.061 22 3HZ LYS 2 3HZ LYS 2 11.887 11.834 -9.963 23 H PHE 3 H PHE 3 6.907 12.832 -5.624 24 HA PHE 3 HA PHE 3 7.142 14.995 -3.662 25 1HB PHE 3 1HB PHE 3 5.218 12.675 -3.847 26 2HB PHE 3 2HB PHE 3 5.268 13.793 -2.492 27 HD1 PHE 3 HD1 PHE 3 5.415 16.392 -3.534 28 HD2 PHE 3 HD2 PHE 3 3.409 13.018 -5.182 29 HE1 PHE 3 HE1 PHE 3 3.855 17.895 -4.705 30 HE2 PHE 3 HE2 PHE 3 1.851 14.514 -6.356 31 HZ PHE 3 HZ PHE 3 2.069 16.954 -6.119 32 H ALA 4 H ALA 4 7.539 14.569 -1.460 33 HA ALA 4 HA ALA 4 9.037 12.084 -0.956 34 1HB ALA 4 1HB ALA 4 9.157 14.719 0.518 35 2HB ALA 4 2HB ALA 4 10.339 14.137 -0.654 36 3HB ALA 4 3HB ALA 4 10.125 13.288 0.877 37 H CYS 5 H CYS 5 8.192 10.651 0.410 38 HA CYS 5 HA CYS 5 5.902 11.496 2.053 39 1HB CYS 5 1HB CYS 5 6.353 8.843 0.667 40 2HB CYS 5 2HB CYS 5 4.993 9.220 1.721 41 HG CYS 5 HG CYS 5 5.349 9.786 -1.500 42 H ARG 6 H ARG 6 5.513 9.503 3.732 43 HA ARG 6 HA ARG 6 7.984 9.584 5.284 44 1HB ARG 6 1HB ARG 6 5.833 10.329 6.301 45 2HB ARG 6 2HB ARG 6 5.227 8.686 6.152 46 1HG ARG 6 1HG ARG 6 6.919 7.882 7.669 47 2HG ARG 6 2HG ARG 6 7.660 9.481 7.739 48 1HD ARG 6 1HD ARG 6 6.355 9.181 9.718 49 2HD ARG 6 2HD ARG 6 5.536 10.356 8.694 50 HE ARG 6 HE ARG 6 3.817 8.821 8.316 51 1HH1 ARG 6 1HH1 ARG 6 6.376 7.403 10.227 52 2HH1 ARG 6 2HH1 ARG 6 5.403 6.093 10.810 53 1HH2 ARG 6 1HH2 ARG 6 2.512 7.121 9.078 54 2HH2 ARG 6 2HH2 ARG 6 3.184 5.942 10.181 55 H ALA 7 H ALA 7 9.300 7.967 5.291 56 HA ALA 7 HA ALA 7 8.706 5.581 3.853 57 1HB ALA 7 1HB ALA 7 10.998 4.943 4.333 58 2HB ALA 7 2HB ALA 7 11.135 6.263 5.495 59 3HB ALA 7 3HB ALA 7 10.912 6.615 3.781 60 H ILE 8 H ILE 8 7.853 3.775 4.569 61 HA ILE 8 HA ILE 8 7.841 3.226 7.453 62 HB ILE 8 HB ILE 8 6.215 1.895 5.274 63 1HG1 ILE 8 1HG1 ILE 8 5.575 4.246 5.519 64 2HG1 ILE 8 2HG1 ILE 8 4.310 3.193 6.140 65 1HG2 ILE 8 1HG2 ILE 8 6.542 0.449 7.183 66 2HG2 ILE 8 2HG2 ILE 8 4.873 1.018 7.150 67 3HG2 ILE 8 3HG2 ILE 8 6.025 1.731 8.278 68 1HD1 ILE 8 1HD1 ILE 8 4.602 5.088 7.596 69 2HD1 ILE 8 2HD1 ILE 8 6.320 4.728 7.769 70 3HD1 ILE 8 3HD1 ILE 8 5.116 3.617 8.424 71 H THR 9 H THR 9 8.393 1.644 4.317 72 HA THR 9 HA THR 9 10.055 -0.377 5.664 73 HB THR 9 HB THR 9 9.497 -0.707 2.788 74 HG1 THR 9 HG1 THR 9 7.310 -1.438 4.291 75 1HG2 THR 9 1HG2 THR 9 9.145 -2.493 5.202 76 2HG2 THR 9 2HG2 THR 9 10.533 -2.471 4.115 77 3HG2 THR 9 3HG2 THR 9 8.958 -3.000 3.523 78 H ARG 10 H ARG 10 11.735 -1.187 3.752 79 HA ARG 10 HA ARG 10 13.133 1.221 2.795 80 1HB ARG 10 1HB ARG 10 14.154 -1.430 3.767 81 2HB ARG 10 2HB ARG 10 15.122 -0.440 2.685 82 1HG ARG 10 1HG ARG 10 15.074 1.383 4.314 83 2HG ARG 10 2HG ARG 10 14.119 0.372 5.405 84 1HD ARG 10 1HD ARG 10 15.884 -1.151 5.707 85 2HD ARG 10 2HD ARG 10 16.776 -0.511 4.329 86 HE ARG 10 HE ARG 10 16.361 1.128 6.740 87 1HH1 ARG 10 1HH1 ARG 10 18.451 -0.365 4.365 88 2HH1 ARG 10 2HH1 ARG 10 19.913 0.299 5.039 89 1HH2 ARG 10 1HH2 ARG 10 18.260 2.047 7.598 90 2HH2 ARG 10 2HH2 ARG 10 19.800 1.679 6.875 91 H GLY 11 H GLY 11 14.697 0.410 0.883 92 1HA GLY 11 1HA GLY 11 14.945 -0.907 -1.059 93 2HA GLY 11 2HA GLY 11 13.337 -1.558 -0.795 94 H ARG 12 H ARG 12 13.531 -1.049 -3.222 95 HA ARG 12 HA ARG 12 11.940 1.269 -3.764 96 1HB ARG 12 1HB ARG 12 13.562 2.215 -5.441 97 2HB ARG 12 2HB ARG 12 14.063 2.405 -3.764 98 1HG ARG 12 1HG ARG 12 15.454 0.322 -4.077 99 2HG ARG 12 2HG ARG 12 15.106 0.466 -5.799 100 1HD ARG 12 1HD ARG 12 16.328 2.671 -4.165 101 2HD ARG 12 2HD ARG 12 17.282 1.471 -5.032 102 HE ARG 12 HE ARG 12 15.430 2.707 -6.783 103 1HH1 ARG 12 1HH1 ARG 12 18.401 3.298 -5.045 104 2HH1 ARG 12 2HH1 ARG 12 19.026 4.423 -6.209 105 1HH2 ARG 12 1HH2 ARG 12 16.238 4.232 -8.334 106 2HH2 ARG 12 2HH2 ARG 12 17.795 4.960 -8.066 107 H ALA 13 H ALA 13 10.892 1.087 -5.772 108 HA ALA 13 HA ALA 13 11.558 -1.068 -7.564 109 1HB ALA 13 1HB ALA 13 9.054 -1.290 -5.902 110 2HB ALA 13 2HB ALA 13 10.489 -2.301 -5.736 111 3HB ALA 13 3HB ALA 13 9.530 -2.365 -7.216 112 H GLU 14 H GLU 14 9.550 -1.431 -9.048 113 HA GLU 14 HA GLU 14 8.381 1.177 -9.762 114 1HB GLU 14 1HB GLU 14 8.596 0.430 -12.146 115 2HB GLU 14 2HB GLU 14 10.146 0.684 -11.349 116 1HG GLU 14 1HG GLU 14 10.576 -1.596 -11.180 117 2HG GLU 14 2HG GLU 14 8.888 -2.028 -11.440 118 H GLY 15 H GLY 15 6.311 1.010 -10.884 119 1HA GLY 15 1HA GLY 15 5.213 -1.453 -11.662 120 2HA GLY 15 2HA GLY 15 4.585 -1.030 -10.078 121 H GLU 16 H GLU 16 3.120 -1.271 -12.531 122 HA GLU 16 HA GLU 16 2.394 1.375 -13.368 123 1HB GLU 16 1HB GLU 16 2.126 -0.750 -14.736 124 2HB GLU 16 2HB GLU 16 0.786 -1.167 -13.679 125 1HG GLU 16 1HG GLU 16 -0.477 0.705 -14.411 126 2HG GLU 16 2HG GLU 16 0.908 1.372 -15.276 127 H ALA 17 H ALA 17 0.638 2.596 -12.650 128 HA ALA 17 HA ALA 17 0.152 2.153 -9.855 129 1HB ALA 17 1HB ALA 17 -0.862 4.358 -11.639 130 2HB ALA 17 2HB ALA 17 0.660 4.377 -10.749 131 3HB ALA 17 3HB ALA 17 -0.871 4.347 -9.875 132 H LEU 18 H LEU 18 -1.604 1.463 -8.869 133 HA LEU 18 HA LEU 18 -4.132 1.321 -10.366 134 1HB LEU 18 1HB LEU 18 -2.924 -0.926 -10.062 135 2HB LEU 18 2HB LEU 18 -3.259 -0.751 -8.352 136 HG LEU 18 HG LEU 18 -5.454 -0.753 -10.421 137 1HD1 LEU 18 1HD1 LEU 18 -4.343 -3.105 -8.890 138 2HD1 LEU 18 2HD1 LEU 18 -4.169 -2.828 -10.623 139 3HD1 LEU 18 3HD1 LEU 18 -5.766 -3.123 -9.935 140 1HD2 LEU 18 1HD2 LEU 18 -5.443 -1.359 -7.462 141 2HD2 LEU 18 2HD2 LEU 18 -6.849 -1.403 -8.525 142 3HD2 LEU 18 3HD2 LEU 18 -6.032 0.128 -8.204 143 H VAL 19 H VAL 19 -5.544 2.617 -9.387 144 HA VAL 19 HA VAL 19 -5.055 3.277 -6.569 145 HB VAL 19 HB VAL 19 -4.996 5.120 -8.277 146 1HG1 VAL 19 1HG1 VAL 19 -7.101 6.048 -9.084 147 2HG1 VAL 19 2HG1 VAL 19 -7.972 4.681 -8.389 148 3HG1 VAL 19 3HG1 VAL 19 -6.830 4.421 -9.708 149 1HG2 VAL 19 1HG2 VAL 19 -7.049 5.377 -6.101 150 2HG2 VAL 19 2HG2 VAL 19 -6.200 6.704 -6.895 151 3HG2 VAL 19 3HG2 VAL 19 -5.305 5.546 -5.912 152 H THR 20 H THR 20 -6.500 2.806 -5.037 153 HA THR 20 HA THR 20 -9.032 1.571 -5.904 154 HB THR 20 HB THR 20 -7.604 1.214 -3.262 155 HG1 THR 20 HG1 THR 20 -7.773 -0.881 -5.085 156 1HG2 THR 20 1HG2 THR 20 -9.983 0.792 -3.094 157 2HG2 THR 20 2HG2 THR 20 -9.109 -0.737 -3.033 158 3HG2 THR 20 3HG2 THR 20 -9.929 -0.249 -4.516 159 H LYS 21 H LYS 21 -10.892 2.522 -5.353 160 HA LYS 21 HA LYS 21 -10.724 4.987 -3.775 161 1HB LYS 21 1HB LYS 21 -12.822 3.974 -5.702 162 2HB LYS 21 2HB LYS 21 -12.919 5.502 -4.838 163 1HG LYS 21 1HG LYS 21 -11.155 6.435 -6.051 164 2HG LYS 21 2HG LYS 21 -10.593 4.860 -6.615 165 1HD LYS 21 1HD LYS 21 -11.735 6.142 -8.384 166 2HD LYS 21 2HD LYS 21 -12.554 4.624 -8.016 167 1HE LYS 21 1HE LYS 21 -14.088 5.928 -6.520 168 2HE LYS 21 2HE LYS 21 -13.346 7.399 -7.149 169 1HZ LYS 21 1HZ LYS 21 -14.736 5.340 -8.781 170 2HZ LYS 21 2HZ LYS 21 -14.059 6.780 -9.366 171 3HZ LYS 21 3HZ LYS 21 -15.395 6.837 -8.318 172 H GLU 22 H GLU 22 -11.431 1.867 -3.187 173 HA GLU 22 HA GLU 22 -13.900 2.345 -1.704 174 1HB GLU 22 1HB GLU 22 -12.489 -0.213 -2.467 175 2HB GLU 22 2HB GLU 22 -13.963 -0.145 -1.507 176 1HG GLU 22 1HG GLU 22 -13.611 0.753 -4.356 177 2HG GLU 22 2HG GLU 22 -14.538 -0.632 -3.777 178 H TYR 23 H TYR 23 -14.190 1.479 0.410 179 HA TYR 23 HA TYR 23 -11.743 1.583 2.045 180 1HB TYR 23 1HB TYR 23 -14.609 1.785 3.009 181 2HB TYR 23 2HB TYR 23 -13.147 2.170 3.913 182 HD1 TYR 23 HD1 TYR 23 -15.542 3.331 1.427 183 HD2 TYR 23 HD2 TYR 23 -11.925 4.248 3.470 184 HE1 TYR 23 HE1 TYR 23 -15.740 5.672 0.708 185 HE2 TYR 23 HE2 TYR 23 -12.109 6.595 2.755 186 HH TYR 23 HH TYR 23 -14.976 7.862 1.336 187 H ILE 24 H ILE 24 -11.039 -0.523 1.907 188 HA ILE 24 HA ILE 24 -13.015 -2.621 2.531 189 HB ILE 24 HB ILE 24 -11.712 -4.104 0.996 190 1HG1 ILE 24 1HG1 ILE 24 -10.434 -1.495 0.140 191 2HG1 ILE 24 2HG1 ILE 24 -9.617 -2.781 1.024 192 1HG2 ILE 24 1HG2 ILE 24 -13.804 -3.076 0.295 193 2HG2 ILE 24 2HG2 ILE 24 -12.675 -3.170 -1.057 194 3HG2 ILE 24 3HG2 ILE 24 -12.934 -1.634 -0.230 195 1HD1 ILE 24 1HD1 ILE 24 -9.059 -2.814 -1.343 196 2HD1 ILE 24 2HD1 ILE 24 -10.765 -3.001 -1.752 197 3HD1 ILE 24 3HD1 ILE 24 -9.923 -4.277 -0.873 198 H SER 25 H SER 25 -10.828 -1.170 4.113 199 HA SER 25 HA SER 25 -9.129 -1.552 5.542 200 1HB SER 25 1HB SER 25 -9.401 -3.412 7.015 201 2HB SER 25 2HB SER 25 -11.009 -2.858 6.581 202 HG SER 25 HG SER 25 -10.652 -4.605 4.818 203 H PHE 26 H PHE 26 -7.838 -4.139 6.097 204 HA PHE 26 HA PHE 26 -6.676 -4.828 3.512 205 1HB PHE 26 1HB PHE 26 -5.379 -2.917 4.662 206 2HB PHE 26 2HB PHE 26 -4.853 -4.144 5.810 207 HD1 PHE 26 HD1 PHE 26 -5.228 -3.978 2.099 208 HD2 PHE 26 HD2 PHE 26 -2.712 -4.855 5.416 209 HE1 PHE 26 HE1 PHE 26 -3.424 -4.614 0.555 210 HE2 PHE 26 HE2 PHE 26 -0.903 -5.493 3.875 211 HZ PHE 26 HZ PHE 26 -1.256 -5.372 1.441 212 H LEU 27 H LEU 27 -8.302 -6.047 5.806 213 HA LEU 27 HA LEU 27 -6.522 -8.124 6.755 214 1HB LEU 27 1HB LEU 27 -8.591 -9.005 7.889 215 2HB LEU 27 2HB LEU 27 -8.057 -7.414 8.385 216 HG LEU 27 HG LEU 27 -9.829 -6.491 6.788 217 1HD1 LEU 27 1HD1 LEU 27 -10.836 -9.325 7.000 218 2HD1 LEU 27 2HD1 LEU 27 -10.281 -8.527 5.528 219 3HD1 LEU 27 3HD1 LEU 27 -11.734 -7.954 6.347 220 1HD2 LEU 27 1HD2 LEU 27 -10.668 -8.056 9.220 221 2HD2 LEU 27 2HD2 LEU 27 -11.585 -6.754 8.463 222 3HD2 LEU 27 3HD2 LEU 27 -10.021 -6.416 9.205 223 H GLY 28 H GLY 28 -8.351 -7.626 4.005 224 1HA GLY 28 1HA GLY 28 -7.715 -10.031 2.802 225 2HA GLY 28 2HA GLY 28 -9.294 -10.267 3.535 226 H GLY 29 H GLY 29 -8.016 -9.794 0.691 227 1HA GLY 29 1HA GLY 29 -10.392 -8.740 -0.462 228 2HA GLY 29 2HA GLY 29 -9.133 -7.514 -0.443 229 H ILE 30 H ILE 30 -6.890 -8.968 -0.956 230 HA ILE 30 HA ILE 30 -7.267 -9.585 -3.772 231 HB ILE 30 HB ILE 30 -4.728 -9.418 -2.124 232 1HG1 ILE 30 1HG1 ILE 30 -4.412 -7.340 -3.631 233 2HG1 ILE 30 2HG1 ILE 30 -6.148 -7.440 -3.894 234 1HG2 ILE 30 1HG2 ILE 30 -5.084 -9.656 -5.105 235 2HG2 ILE 30 2HG2 ILE 30 -4.441 -10.894 -4.026 236 3HG2 ILE 30 3HG2 ILE 30 -3.553 -9.389 -4.271 237 1HD1 ILE 30 1HD1 ILE 30 -5.622 -5.844 -2.155 238 2HD1 ILE 30 2HD1 ILE 30 -4.765 -7.088 -1.244 239 3HD1 ILE 30 3HD1 ILE 30 -6.508 -7.214 -1.484 240 H ASP 31 H ASP 31 -7.145 -11.586 -4.644 241 HA ASP 31 HA ASP 31 -7.069 -13.868 -2.895 242 1HB ASP 31 1HB ASP 31 -8.575 -13.923 -4.791 243 2HB ASP 31 2HB ASP 31 -7.236 -13.671 -5.909 244 H LYS 32 H LYS 32 -5.569 -15.564 -2.949 245 HA LYS 32 HA LYS 32 -2.870 -14.570 -3.214 246 1HB LYS 32 1HB LYS 32 -2.227 -16.643 -2.070 247 2HB LYS 32 2HB LYS 32 -3.507 -15.802 -1.208 248 1HG LYS 32 1HG LYS 32 -5.157 -17.343 -2.130 249 2HG LYS 32 2HG LYS 32 -3.884 -18.178 -3.023 250 1HD LYS 32 1HD LYS 32 -4.401 -19.414 -1.015 251 2HD LYS 32 2HD LYS 32 -2.787 -18.716 -0.875 252 1HE LYS 32 1HE LYS 32 -3.934 -18.409 1.207 253 2HE LYS 32 2HE LYS 32 -3.768 -16.841 0.420 254 1HZ LYS 32 1HZ LYS 32 -6.108 -17.267 -0.453 255 2HZ LYS 32 2HZ LYS 32 -5.947 -16.899 1.192 256 3HZ LYS 32 3HZ LYS 32 -6.200 -18.504 0.709 257 H GLU 33 H GLU 33 -4.970 -16.343 -5.206 258 HA GLU 33 HA GLU 33 -2.763 -17.825 -6.437 259 1HB GLU 33 1HB GLU 33 -5.750 -18.118 -6.764 260 2HB GLU 33 2HB GLU 33 -4.547 -19.104 -7.586 261 1HG GLU 33 1HG GLU 33 -3.738 -19.914 -5.429 262 2HG GLU 33 2HG GLU 33 -4.956 -18.939 -4.608 263 H THR 34 H THR 34 -5.483 -15.702 -7.331 264 HA THR 34 HA THR 34 -4.333 -15.390 -9.998 265 HB THR 34 HB THR 34 -6.381 -14.006 -10.431 266 HG1 THR 34 HG1 THR 34 -8.042 -14.600 -8.633 267 1HG2 THR 34 1HG2 THR 34 -6.305 -16.385 -11.008 268 2HG2 THR 34 2HG2 THR 34 -7.919 -15.916 -10.473 269 3HG2 THR 34 3HG2 THR 34 -6.851 -16.800 -9.383 270 H GLY 35 H GLY 35 -4.857 -13.520 -7.064 271 1HA GLY 35 1HA GLY 35 -3.754 -11.548 -6.446 272 2HA GLY 35 2HA GLY 35 -3.137 -11.400 -8.086 273 H ILE 36 H ILE 36 -6.462 -12.086 -7.734 274 HA ILE 36 HA ILE 36 -7.168 -9.460 -8.771 275 HB ILE 36 HB ILE 36 -8.867 -11.920 -8.302 276 1HG1 ILE 36 1HG1 ILE 36 -7.154 -12.185 -10.066 277 2HG1 ILE 36 2HG1 ILE 36 -8.791 -12.225 -10.711 278 1HG2 ILE 36 1HG2 ILE 36 -9.571 -9.367 -9.754 279 2HG2 ILE 36 2HG2 ILE 36 -10.208 -9.883 -8.192 280 3HG2 ILE 36 3HG2 ILE 36 -10.582 -10.810 -9.645 281 1HD1 ILE 36 1HD1 ILE 36 -6.903 -9.884 -10.805 282 2HD1 ILE 36 2HD1 ILE 36 -8.552 -9.902 -11.435 283 3HD1 ILE 36 3HD1 ILE 36 -7.323 -10.948 -12.149 284 H VAL 37 H VAL 37 -8.282 -7.924 -7.642 285 HA VAL 37 HA VAL 37 -8.705 -8.312 -4.817 286 HB VAL 37 HB VAL 37 -9.444 -5.968 -6.586 287 1HG1 VAL 37 1HG1 VAL 37 -9.376 -6.171 -3.575 288 2HG1 VAL 37 2HG1 VAL 37 -10.830 -6.075 -4.569 289 3HG1 VAL 37 3HG1 VAL 37 -9.711 -4.713 -4.510 290 1HG2 VAL 37 1HG2 VAL 37 -7.030 -6.388 -6.442 291 2HG2 VAL 37 2HG2 VAL 37 -7.138 -6.333 -4.681 292 3HG2 VAL 37 3HG2 VAL 37 -7.489 -4.890 -5.631 293 H LYS 38 H LYS 38 -10.298 -9.667 -4.330 294 HA LYS 38 HA LYS 38 -12.749 -9.744 -5.857 295 1HB LYS 38 1HB LYS 38 -11.913 -11.269 -3.414 296 2HB LYS 38 2HB LYS 38 -13.373 -11.561 -4.352 297 1HG LYS 38 1HG LYS 38 -11.758 -11.829 -6.347 298 2HG LYS 38 2HG LYS 38 -10.526 -12.051 -5.100 299 1HD LYS 38 1HD LYS 38 -12.206 -13.707 -4.102 300 2HD LYS 38 2HD LYS 38 -12.935 -13.708 -5.699 301 1HE LYS 38 1HE LYS 38 -10.760 -14.326 -6.676 302 2HE LYS 38 2HE LYS 38 -10.068 -14.393 -5.057 303 1HZ LYS 38 1HZ LYS 38 -10.658 -16.585 -5.866 304 2HZ LYS 38 2HZ LYS 38 -12.271 -16.111 -6.071 305 3HZ LYS 38 3HZ LYS 38 -11.600 -16.185 -4.512 306 H GLU 39 H GLU 39 -11.581 -8.432 -2.864 307 HA GLU 39 HA GLU 39 -14.279 -7.690 -2.036 308 1HB GLU 39 1HB GLU 39 -12.738 -8.628 -0.342 309 2HB GLU 39 2HB GLU 39 -11.652 -7.274 -0.627 310 1HG GLU 39 1HG GLU 39 -12.857 -6.779 1.331 311 2HG GLU 39 2HG GLU 39 -13.510 -5.751 0.069 312 H ASP 40 H ASP 40 -14.473 -6.299 -3.819 313 HA ASP 40 HA ASP 40 -13.701 -3.585 -3.162 314 1HB ASP 40 1HB ASP 40 -12.055 -4.634 -4.827 315 2HB ASP 40 2HB ASP 40 -13.375 -4.589 -5.979 316 H CYS 41 H CYS 41 -14.787 -2.350 -5.377 317 HA CYS 41 HA CYS 41 -17.490 -3.400 -5.682 318 1HB CYS 41 1HB CYS 41 -16.926 -0.690 -4.472 319 2HB CYS 41 2HB CYS 41 -18.512 -1.233 -5.008 320 HG CYS 41 HG CYS 41 -17.243 -3.460 -2.950 321 H GLU 42 H GLU 42 -14.902 -1.369 -6.796 322 HA GLU 42 HA GLU 42 -16.430 -0.892 -9.262 323 1HB GLU 42 1HB GLU 42 -16.463 1.176 -7.900 324 2HB GLU 42 2HB GLU 42 -14.705 1.185 -7.901 325 1HG GLU 42 1HG GLU 42 -14.691 1.459 -10.317 326 2HG GLU 42 2HG GLU 42 -16.453 1.397 -10.345 327 H ILE 43 H ILE 43 -13.235 -0.796 -7.723 328 HA ILE 43 HA ILE 43 -11.791 -1.007 -10.212 329 HB ILE 43 HB ILE 43 -10.714 -1.585 -7.445 330 1HG1 ILE 43 1HG1 ILE 43 -11.845 0.604 -7.427 331 2HG1 ILE 43 2HG1 ILE 43 -10.101 0.778 -7.276 332 1HG2 ILE 43 1HG2 ILE 43 -8.591 -0.831 -8.422 333 2HG2 ILE 43 2HG2 ILE 43 -9.398 -0.602 -9.974 334 3HG2 ILE 43 3HG2 ILE 43 -9.260 -2.218 -9.283 335 1HD1 ILE 43 1HD1 ILE 43 -9.962 1.376 -9.641 336 2HD1 ILE 43 2HD1 ILE 43 -11.026 2.465 -8.749 337 3HD1 ILE 43 3HD1 ILE 43 -11.712 1.209 -9.782 338 H LYS 44 H LYS 44 -13.358 -3.051 -8.051 339 HA LYS 44 HA LYS 44 -12.115 -5.443 -7.971 340 1HB LYS 44 1HB LYS 44 -14.189 -5.065 -6.863 341 2HB LYS 44 2HB LYS 44 -15.039 -4.833 -8.379 342 1HG LYS 44 1HG LYS 44 -14.786 -7.166 -8.917 343 2HG LYS 44 2HG LYS 44 -13.808 -7.422 -7.471 344 1HD LYS 44 1HD LYS 44 -15.668 -6.932 -6.046 345 2HD LYS 44 2HD LYS 44 -16.647 -6.417 -7.420 346 1HE LYS 44 1HE LYS 44 -15.578 -9.210 -7.064 347 2HE LYS 44 2HE LYS 44 -17.187 -8.698 -6.556 348 1HZ LYS 44 1HZ LYS 44 -17.696 -8.130 -8.849 349 2HZ LYS 44 2HZ LYS 44 -17.234 -9.758 -8.731 350 3HZ LYS 44 3HZ LYS 44 -16.145 -8.609 -9.343 351 H GLY 45 H GLY 45 -11.251 -6.715 -9.392 352 1HA GLY 45 1HA GLY 45 -11.932 -8.232 -11.310 353 2HA GLY 45 2HA GLY 45 -12.316 -6.735 -12.144 354 H GLU 46 H GLU 46 -9.837 -5.571 -10.678 355 HA GLU 46 HA GLU 46 -8.020 -6.325 -12.831 356 1HB GLU 46 1HB GLU 46 -8.057 -4.020 -10.898 357 2HB GLU 46 2HB GLU 46 -6.667 -4.357 -11.923 358 1HG GLU 46 1HG GLU 46 -8.141 -4.180 -13.901 359 2HG GLU 46 2HG GLU 46 -9.465 -3.730 -12.830 360 H SER 47 H SER 47 -5.791 -6.714 -12.452 361 HA SER 47 HA SER 47 -5.336 -8.300 -10.038 362 1HB SER 47 1HB SER 47 -3.593 -8.071 -12.506 363 2HB SER 47 2HB SER 47 -3.501 -9.306 -11.249 364 HG SER 47 HG SER 47 -5.209 -10.298 -12.070 365 H VAL 48 H VAL 48 -3.810 -7.798 -8.534 366 HA VAL 48 HA VAL 48 -2.486 -5.209 -8.809 367 HB VAL 48 HB VAL 48 -1.894 -5.471 -6.426 368 1HG1 VAL 48 1HG1 VAL 48 -4.812 -5.900 -7.049 369 2HG1 VAL 48 2HG1 VAL 48 -3.963 -4.355 -7.044 370 3HG1 VAL 48 3HG1 VAL 48 -4.169 -5.253 -5.539 371 1HG2 VAL 48 1HG2 VAL 48 -1.735 -7.907 -6.345 372 2HG2 VAL 48 2HG2 VAL 48 -3.475 -8.038 -6.603 373 3HG2 VAL 48 3HG2 VAL 48 -2.854 -7.308 -5.122 374 H ALA 49 H ALA 49 -1.813 -8.309 -9.579 375 HA ALA 49 HA ALA 49 0.820 -8.657 -8.620 376 1HB ALA 49 1HB ALA 49 -0.572 -10.544 -9.288 377 2HB ALA 49 2HB ALA 49 0.945 -10.516 -10.186 378 3HB ALA 49 3HB ALA 49 -0.546 -9.978 -10.959 379 H GLY 50 H GLY 50 1.912 -6.804 -9.082 380 1HA GLY 50 1HA GLY 50 3.781 -6.225 -10.559 381 2HA GLY 50 2HA GLY 50 2.695 -6.498 -11.915 382 H ARG 51 H ARG 51 0.970 -5.076 -9.515 383 HA ARG 51 HA ARG 51 1.233 -2.433 -10.775 384 1HB ARG 51 1HB ARG 51 -1.037 -3.743 -9.269 385 2HB ARG 51 2HB ARG 51 -1.043 -2.051 -9.742 386 1HG ARG 51 1HG ARG 51 -0.613 -4.166 -11.801 387 2HG ARG 51 2HG ARG 51 -2.242 -3.816 -11.215 388 1HD ARG 51 1HD ARG 51 -1.939 -1.456 -11.829 389 2HD ARG 51 2HD ARG 51 -0.325 -1.825 -12.430 390 HE ARG 51 HE ARG 51 -1.268 -2.916 -14.270 391 1HH1 ARG 51 1HH1 ARG 51 -3.737 -1.740 -12.087 392 2HH1 ARG 51 2HH1 ARG 51 -5.016 -1.828 -13.260 393 1HH2 ARG 51 1HH2 ARG 51 -2.922 -2.968 -15.844 394 2HH2 ARG 51 2HH2 ARG 51 -4.537 -2.490 -15.411 395 H ILE 52 H ILE 52 1.212 -0.558 -9.461 396 HA ILE 52 HA ILE 52 1.998 -0.971 -6.670 397 HB ILE 52 HB ILE 52 2.152 1.459 -8.462 398 1HG1 ILE 52 1HG1 ILE 52 4.210 -0.145 -6.937 399 2HG1 ILE 52 2HG1 ILE 52 3.974 -0.127 -8.679 400 1HG2 ILE 52 1HG2 ILE 52 1.351 2.197 -6.266 401 2HG2 ILE 52 2HG2 ILE 52 3.007 2.732 -6.556 402 3HG2 ILE 52 3HG2 ILE 52 2.696 1.359 -5.493 403 1HD1 ILE 52 1HD1 ILE 52 4.882 2.200 -7.002 404 2HD1 ILE 52 2HD1 ILE 52 4.653 2.210 -8.751 405 3HD1 ILE 52 3HD1 ILE 52 5.903 1.195 -8.031 406 H LEU 53 H LEU 53 0.522 -0.819 -5.140 407 HA LEU 53 HA LEU 53 -2.171 -0.051 -5.964 408 1HB LEU 53 1HB LEU 53 -1.665 -2.295 -4.960 409 2HB LEU 53 2HB LEU 53 -1.270 -1.478 -3.461 410 HG LEU 53 HG LEU 53 -3.584 -0.653 -3.309 411 1HD1 LEU 53 1HD1 LEU 53 -4.017 -2.327 -5.777 412 2HD1 LEU 53 2HD1 LEU 53 -4.125 -0.570 -5.675 413 3HD1 LEU 53 3HD1 LEU 53 -5.289 -1.576 -4.814 414 1HD2 LEU 53 1HD2 LEU 53 -4.619 -2.806 -2.784 415 2HD2 LEU 53 2HD2 LEU 53 -2.949 -2.751 -2.220 416 3HD2 LEU 53 3HD2 LEU 53 -3.354 -3.639 -3.690 417 H VAL 54 H VAL 54 -3.041 1.821 -5.359 418 HA VAL 54 HA VAL 54 -2.043 3.098 -2.890 419 HB VAL 54 HB VAL 54 -2.990 4.508 -5.398 420 1HG1 VAL 54 1HG1 VAL 54 -3.598 5.769 -3.448 421 2HG1 VAL 54 2HG1 VAL 54 -2.244 6.560 -4.254 422 3HG1 VAL 54 3HG1 VAL 54 -1.968 5.613 -2.790 423 1HG2 VAL 54 1HG2 VAL 54 -0.785 3.515 -5.681 424 2HG2 VAL 54 2HG2 VAL 54 -0.221 4.316 -4.215 425 3HG2 VAL 54 3HG2 VAL 54 -0.684 5.272 -5.626 426 H PHE 55 H PHE 55 -3.610 2.758 -1.427 427 HA PHE 55 HA PHE 55 -6.305 3.664 -2.127 428 1HB PHE 55 1HB PHE 55 -7.329 1.804 -0.883 429 2HB PHE 55 2HB PHE 55 -6.406 1.234 -2.266 430 HD1 PHE 55 HD1 PHE 55 -6.825 1.100 1.307 431 HD2 PHE 55 HD2 PHE 55 -4.179 0.171 -1.889 432 HE1 PHE 55 HE1 PHE 55 -5.617 -0.465 2.769 433 HE2 PHE 55 HE2 PHE 55 -2.967 -1.399 -0.434 434 HZ PHE 55 HZ PHE 55 -3.684 -1.720 1.897 435 HA PRO 56 HA PRO 56 -6.013 5.865 1.737 436 1HB PRO 56 1HB PRO 56 -8.946 5.678 1.887 437 2HB PRO 56 2HB PRO 56 -7.921 7.107 1.736 438 1HG PRO 56 1HG PRO 56 -9.451 6.235 -0.296 439 2HG PRO 56 2HG PRO 56 -7.872 6.995 -0.565 440 1HD PRO 56 1HD PRO 56 -8.614 4.093 -0.607 441 2HD PRO 56 2HD PRO 56 -7.534 4.996 -1.691 442 H GLY 57 H GLY 57 -8.010 2.996 1.387 443 1HA GLY 57 1HA GLY 57 -7.959 1.096 2.735 444 2HA GLY 57 2HA GLY 57 -7.018 1.992 3.916 445 H GLY 58 H GLY 58 -8.416 3.963 4.783 446 1HA GLY 58 1HA GLY 58 -10.304 4.648 5.947 447 2HA GLY 58 2HA GLY 58 -11.184 3.282 5.269 448 H LYS 59 H LYS 59 -10.285 1.100 6.095 449 HA LYS 59 HA LYS 59 -10.132 1.296 9.028 450 1HB LYS 59 1HB LYS 59 -10.869 -1.111 7.353 451 2HB LYS 59 2HB LYS 59 -11.038 -0.944 9.095 452 1HG LYS 59 1HG LYS 59 -12.744 0.746 8.793 453 2HG LYS 59 2HG LYS 59 -12.542 0.666 7.042 454 1HD LYS 59 1HD LYS 59 -13.195 -1.724 7.129 455 2HD LYS 59 2HD LYS 59 -13.512 -1.537 8.855 456 1HE LYS 59 1HE LYS 59 -14.884 -0.068 6.609 457 2HE LYS 59 2HE LYS 59 -15.574 -1.361 7.590 458 1HZ LYS 59 1HZ LYS 59 -14.716 1.305 8.586 459 2HZ LYS 59 2HZ LYS 59 -15.374 0.064 9.535 460 3HZ LYS 59 3HZ LYS 59 -16.316 0.806 8.337 461 H GLY 60 H GLY 60 -8.290 0.708 10.008 462 1HA GLY 60 1HA GLY 60 -6.155 -0.458 8.408 463 2HA GLY 60 2HA GLY 60 -6.014 0.148 10.054 464 H SER 61 H SER 61 -8.177 -1.287 11.157 465 HA SER 61 HA SER 61 -8.729 -3.245 12.138 466 1HB SER 61 1HB SER 61 -7.473 -4.556 9.715 467 2HB SER 61 2HB SER 61 -8.649 -5.274 10.818 468 HG SER 61 HG SER 61 -10.219 -4.221 9.844 469 H THR 62 H THR 62 -7.632 -5.571 12.656 470 HA THR 62 HA THR 62 -4.872 -4.975 13.494 471 HB THR 62 HB THR 62 -5.353 -6.582 15.403 472 HG1 THR 62 HG1 THR 62 -7.241 -7.520 15.350 473 1HG2 THR 62 1HG2 THR 62 -6.911 -3.996 15.260 474 2HG2 THR 62 2HG2 THR 62 -5.230 -4.178 15.764 475 3HG2 THR 62 3HG2 THR 62 -6.524 -4.870 16.741 476 H VAL 63 H VAL 63 -6.300 -6.551 11.195 477 HA VAL 63 HA VAL 63 -4.531 -8.890 11.370 478 HB VAL 63 HB VAL 63 -7.317 -8.920 10.188 479 1HG1 VAL 63 1HG1 VAL 63 -6.975 -11.322 9.955 480 2HG1 VAL 63 2HG1 VAL 63 -5.344 -11.163 10.608 481 3HG1 VAL 63 3HG1 VAL 63 -5.750 -10.423 9.059 482 1HG2 VAL 63 1HG2 VAL 63 -7.409 -8.797 12.622 483 2HG2 VAL 63 2HG2 VAL 63 -6.311 -10.172 12.741 484 3HG2 VAL 63 3HG2 VAL 63 -7.921 -10.385 12.052 485 H GLY 64 H GLY 64 -3.425 -9.357 9.497 486 1HA GLY 64 1HA GLY 64 -3.844 -8.888 6.913 487 2HA GLY 64 2HA GLY 64 -3.479 -7.261 7.473 488 H SER 65 H SER 65 -1.706 -8.856 9.527 489 HA SER 65 HA SER 65 0.736 -8.496 8.132 490 1HB SER 65 1HB SER 65 1.489 -9.858 10.311 491 2HB SER 65 2HB SER 65 1.033 -8.154 10.378 492 HG SER 65 HG SER 65 -0.126 -10.236 11.595 493 H TYR 66 H TYR 66 2.247 -10.037 7.493 494 HA TYR 66 HA TYR 66 3.167 -12.009 6.889 495 1HB TYR 66 1HB TYR 66 0.942 -13.083 8.576 496 2HB TYR 66 2HB TYR 66 1.913 -14.175 7.594 497 HD1 TYR 66 HD1 TYR 66 2.059 -11.711 10.356 498 HD2 TYR 66 HD2 TYR 66 4.110 -14.780 8.236 499 HE1 TYR 66 HE1 TYR 66 3.796 -11.748 12.097 500 HE2 TYR 66 HE2 TYR 66 5.850 -14.825 9.972 501 HH TYR 66 HH TYR 66 5.485 -13.401 12.979 502 H VAL 67 H VAL 67 -0.273 -11.621 6.209 503 HA VAL 67 HA VAL 67 -0.456 -13.657 4.283 504 HB VAL 67 HB VAL 67 -2.493 -12.597 3.491 505 1HG1 VAL 67 1HG1 VAL 67 -2.618 -13.920 5.512 506 2HG1 VAL 67 2HG1 VAL 67 -3.731 -12.555 5.617 507 3HG1 VAL 67 3HG1 VAL 67 -2.200 -12.513 6.489 508 1HG2 VAL 67 1HG2 VAL 67 -1.768 -10.269 3.510 509 2HG2 VAL 67 2HG2 VAL 67 -1.751 -10.281 5.272 510 3HG2 VAL 67 3HG2 VAL 67 -3.275 -10.472 4.404 511 H LEU 68 H LEU 68 0.878 -10.460 4.052 512 HA LEU 68 HA LEU 68 0.771 -10.223 1.224 513 1HB LEU 68 1HB LEU 68 2.617 -8.939 3.232 514 2HB LEU 68 2HB LEU 68 2.614 -8.548 1.525 515 HG LEU 68 HG LEU 68 0.092 -8.000 1.920 516 1HD1 LEU 68 1HD1 LEU 68 0.002 -8.891 4.195 517 2HD1 LEU 68 2HD1 LEU 68 -0.395 -7.175 4.146 518 3HD1 LEU 68 3HD1 LEU 68 1.195 -7.697 4.706 519 1HD2 LEU 68 1HD2 LEU 68 1.806 -6.388 1.275 520 2HD2 LEU 68 2HD2 LEU 68 2.291 -6.221 2.963 521 3HD2 LEU 68 3HD2 LEU 68 0.685 -5.699 2.449 522 H LEU 69 H LEU 69 2.984 -11.760 3.451 523 HA LEU 69 HA LEU 69 5.108 -12.165 1.625 524 1HB LEU 69 1HB LEU 69 5.392 -12.370 4.054 525 2HB LEU 69 2HB LEU 69 4.318 -13.756 4.071 526 HG LEU 69 HG LEU 69 5.945 -15.003 2.679 527 1HD1 LEU 69 1HD1 LEU 69 7.697 -12.592 3.124 528 2HD1 LEU 69 2HD1 LEU 69 7.017 -13.113 1.582 529 3HD1 LEU 69 3HD1 LEU 69 8.204 -14.123 2.409 530 1HD2 LEU 69 1HD2 LEU 69 7.040 -13.868 5.248 531 2HD2 LEU 69 2HD2 LEU 69 7.592 -15.345 4.458 532 3HD2 LEU 69 3HD2 LEU 69 5.951 -15.248 5.099 533 H ASN 70 H ASN 70 2.247 -14.007 2.507 534 HA ASN 70 HA ASN 70 2.703 -16.304 0.958 535 1HB ASN 70 1HB ASN 70 0.946 -16.220 2.640 536 2HB ASN 70 2HB ASN 70 0.114 -14.950 1.751 537 1HD2 ASN 70 1HD2 ASN 70 1.606 -17.761 0.249 538 2HD2 ASN 70 2HD2 ASN 70 0.124 -18.494 -0.272 539 H LEU 71 H LEU 71 0.960 -13.299 0.198 540 HA LEU 71 HA LEU 71 0.281 -13.915 -2.451 541 1HB LEU 71 1HB LEU 71 0.929 -11.185 -1.339 542 2HB LEU 71 2HB LEU 71 -0.032 -11.528 -2.763 543 HG LEU 71 HG LEU 71 -0.799 -12.212 0.077 544 1HD1 LEU 71 1HD1 LEU 71 -0.854 -9.815 -0.363 545 2HD1 LEU 71 2HD1 LEU 71 -2.482 -10.470 -0.189 546 3HD1 LEU 71 3HD1 LEU 71 -1.851 -10.094 -1.792 547 1HD2 LEU 71 1HD2 LEU 71 -1.717 -13.824 -1.488 548 2HD2 LEU 71 2HD2 LEU 71 -2.316 -12.521 -2.514 549 3HD2 LEU 71 3HD2 LEU 71 -2.994 -12.758 -0.903 550 H ARG 72 H ARG 72 3.160 -12.420 -1.066 551 HA ARG 72 HA ARG 72 4.322 -11.724 -3.568 552 1HB ARG 72 1HB ARG 72 4.770 -10.621 -1.349 553 2HB ARG 72 2HB ARG 72 5.701 -12.041 -0.900 554 1HG ARG 72 1HG ARG 72 6.377 -10.496 -3.371 555 2HG ARG 72 2HG ARG 72 6.926 -9.955 -1.785 556 1HD ARG 72 1HD ARG 72 8.042 -12.091 -1.430 557 2HD ARG 72 2HD ARG 72 7.452 -12.670 -2.988 558 HE ARG 72 HE ARG 72 9.448 -10.534 -2.600 559 1HH1 ARG 72 1HH1 ARG 72 7.877 -12.925 -4.622 560 2HH1 ARG 72 2HH1 ARG 72 9.043 -12.804 -5.903 561 1HH2 ARG 72 1HH2 ARG 72 11.003 -10.389 -4.247 562 2HH2 ARG 72 2HH2 ARG 72 10.838 -11.359 -5.692 563 H LYS 73 H LYS 73 4.611 -14.486 -1.409 564 HA LYS 73 HA LYS 73 6.818 -15.719 -2.567 565 1HB LYS 73 1HB LYS 73 5.656 -16.306 -0.413 566 2HB LYS 73 2HB LYS 73 4.400 -17.074 -1.369 567 1HG LYS 73 1HG LYS 73 7.240 -17.905 -1.718 568 2HG LYS 73 2HG LYS 73 6.307 -18.473 -0.337 569 1HD LYS 73 1HD LYS 73 4.635 -19.423 -1.820 570 2HD LYS 73 2HD LYS 73 5.491 -18.784 -3.224 571 1HE LYS 73 1HE LYS 73 7.408 -20.194 -2.712 572 2HE LYS 73 2HE LYS 73 6.587 -20.810 -1.279 573 1HZ LYS 73 1HZ LYS 73 4.899 -21.783 -2.672 574 2HZ LYS 73 2HZ LYS 73 6.427 -22.325 -3.175 575 3HZ LYS 73 3HZ LYS 73 5.616 -21.136 -4.069 576 H ASN 74 H ASN 74 3.411 -15.749 -3.467 577 HA ASN 74 HA ASN 74 3.853 -17.729 -5.536 578 1HB ASN 74 1HB ASN 74 1.700 -17.588 -4.252 579 2HB ASN 74 2HB ASN 74 1.381 -16.049 -5.050 580 1HD2 ASN 74 1HD2 ASN 74 -0.508 -16.889 -5.986 581 2HD2 ASN 74 2HD2 ASN 74 -0.437 -17.973 -7.332 582 H GLY 75 H GLY 75 3.663 -14.280 -5.213 583 1HA GLY 75 1HA GLY 75 4.753 -12.825 -6.741 584 2HA GLY 75 2HA GLY 75 4.518 -14.021 -8.007 585 H VAL 76 H VAL 76 1.864 -13.273 -5.926 586 HA VAL 76 HA VAL 76 0.571 -11.887 -8.177 587 HB VAL 76 HB VAL 76 -1.576 -12.532 -7.165 588 1HG1 VAL 76 1HG1 VAL 76 0.300 -14.857 -7.589 589 2HG1 VAL 76 2HG1 VAL 76 -0.559 -13.977 -8.852 590 3HG1 VAL 76 3HG1 VAL 76 -1.460 -14.924 -7.668 591 1HG2 VAL 76 1HG2 VAL 76 -1.635 -14.141 -5.322 592 2HG2 VAL 76 2HG2 VAL 76 -0.879 -12.625 -4.831 593 3HG2 VAL 76 3HG2 VAL 76 0.119 -14.037 -5.177 594 H ALA 77 H ALA 77 2.159 -11.085 -5.532 595 HA ALA 77 HA ALA 77 0.294 -9.247 -4.314 596 1HB ALA 77 1HB ALA 77 2.166 -8.656 -2.860 597 2HB ALA 77 2HB ALA 77 3.250 -9.633 -3.852 598 3HB ALA 77 3HB ALA 77 1.951 -10.405 -2.942 599 HA PRO 78 HA PRO 78 1.345 -5.632 -6.690 600 1HB PRO 78 1HB PRO 78 1.349 -3.746 -4.692 601 2HB PRO 78 2HB PRO 78 -0.115 -4.358 -5.471 602 1HG PRO 78 1HG PRO 78 1.113 -5.140 -2.862 603 2HG PRO 78 2HG PRO 78 -0.597 -4.911 -3.272 604 1HD PRO 78 1HD PRO 78 0.511 -7.359 -3.082 605 2HD PRO 78 2HD PRO 78 -0.769 -6.995 -4.257 606 H LYS 79 H LYS 79 3.169 -4.401 -7.174 607 HA LYS 79 HA LYS 79 5.616 -5.368 -6.063 608 1HB LYS 79 1HB LYS 79 4.959 -3.287 -8.136 609 2HB LYS 79 2HB LYS 79 6.604 -3.630 -7.636 610 1HG LYS 79 1HG LYS 79 6.287 -5.986 -8.304 611 2HG LYS 79 2HG LYS 79 4.671 -5.574 -8.879 612 1HD LYS 79 1HD LYS 79 5.649 -4.003 -10.489 613 2HD LYS 79 2HD LYS 79 7.265 -4.419 -9.910 614 1HE LYS 79 1HE LYS 79 6.899 -6.748 -10.588 615 2HE LYS 79 2HE LYS 79 5.295 -6.322 -11.178 616 1HZ LYS 79 1HZ LYS 79 7.897 -5.355 -12.241 617 2HZ LYS 79 2HZ LYS 79 6.387 -4.786 -12.761 618 3HZ LYS 79 3HZ LYS 79 6.811 -6.411 -13.005 619 H ALA 80 H ALA 80 3.623 -2.578 -5.624 620 HA ALA 80 HA ALA 80 5.066 -1.906 -3.222 621 1HB ALA 80 1HB ALA 80 4.848 0.120 -5.446 622 2HB ALA 80 2HB ALA 80 6.335 -0.648 -4.888 623 3HB ALA 80 3HB ALA 80 5.442 0.433 -3.816 624 H ILE 81 H ILE 81 3.887 -0.382 -1.895 625 HA ILE 81 HA ILE 81 1.137 0.188 -2.760 626 HB ILE 81 HB ILE 81 1.778 -0.869 0.002 627 1HG1 ILE 81 1HG1 ILE 81 0.500 -2.353 -2.308 628 2HG1 ILE 81 2HG1 ILE 81 2.126 -2.642 -1.702 629 1HG2 ILE 81 1HG2 ILE 81 -0.172 0.567 -0.113 630 2HG2 ILE 81 2HG2 ILE 81 -0.669 -1.102 0.163 631 3HG2 ILE 81 3HG2 ILE 81 -0.825 -0.390 -1.443 632 1HD1 ILE 81 1HD1 ILE 81 1.211 -3.362 0.434 633 2HD1 ILE 81 2HD1 ILE 81 0.548 -4.311 -0.899 634 3HD1 ILE 81 3HD1 ILE 81 -0.420 -3.040 -0.151 635 H ILE 82 H ILE 82 0.608 2.278 -2.342 636 HA ILE 82 HA ILE 82 2.240 3.721 -0.345 637 HB ILE 82 HB ILE 82 1.029 5.192 -2.664 638 1HG1 ILE 82 1HG1 ILE 82 2.328 3.288 -3.647 639 2HG1 ILE 82 2HG1 ILE 82 2.991 4.869 -4.044 640 1HG2 ILE 82 1HG2 ILE 82 2.021 6.409 -0.764 641 2HG2 ILE 82 2HG2 ILE 82 2.880 6.722 -2.271 642 3HG2 ILE 82 3HG2 ILE 82 3.569 5.622 -1.078 643 1HD1 ILE 82 1HD1 ILE 82 4.755 3.302 -3.536 644 2HD1 ILE 82 2HD1 ILE 82 4.037 2.964 -1.961 645 3HD1 ILE 82 3HD1 ILE 82 4.695 4.564 -2.304 646 H ASN 83 H ASN 83 1.012 4.453 1.324 647 HA ASN 83 HA ASN 83 -1.854 4.927 0.810 648 1HB ASN 83 1HB ASN 83 -0.790 3.548 3.281 649 2HB ASN 83 2HB ASN 83 -2.477 3.798 2.846 650 1HD2 ASN 83 1HD2 ASN 83 -3.360 2.578 1.133 651 2HD2 ASN 83 2HD2 ASN 83 -2.643 1.074 0.666 652 H LYS 84 H LYS 84 -2.854 5.913 2.917 653 HA LYS 84 HA LYS 84 -0.983 7.902 4.018 654 1HB LYS 84 1HB LYS 84 -3.340 8.431 2.804 655 2HB LYS 84 2HB LYS 84 -3.907 8.214 4.454 656 1HG LYS 84 1HG LYS 84 -1.829 10.191 3.518 657 2HG LYS 84 2HG LYS 84 -3.485 10.550 4.014 658 1HD LYS 84 1HD LYS 84 -3.019 9.909 6.272 659 2HD LYS 84 2HD LYS 84 -1.431 9.282 5.825 660 1HE LYS 84 1HE LYS 84 -0.788 11.597 5.153 661 2HE LYS 84 2HE LYS 84 -2.339 12.159 5.771 662 1HZ LYS 84 1HZ LYS 84 -0.674 12.507 7.422 663 2HZ LYS 84 2HZ LYS 84 -0.146 10.896 7.342 664 3HZ LYS 84 3HZ LYS 84 -1.687 11.261 7.967 665 H LYS 85 H LYS 85 -3.451 5.503 4.788 666 HA LYS 85 HA LYS 85 -2.740 5.714 7.627 667 1HB LYS 85 1HB LYS 85 -5.218 5.535 6.479 668 2HB LYS 85 2HB LYS 85 -4.886 3.848 6.843 669 1HG LYS 85 1HG LYS 85 -5.069 6.161 8.744 670 2HG LYS 85 2HG LYS 85 -6.049 4.695 8.700 671 1HD LYS 85 1HD LYS 85 -4.075 3.373 9.328 672 2HD LYS 85 2HD LYS 85 -3.115 4.852 9.391 673 1HE LYS 85 1HE LYS 85 -3.705 4.408 11.619 674 2HE LYS 85 2HE LYS 85 -4.795 5.691 11.098 675 1HZ LYS 85 1HZ LYS 85 -6.485 3.960 10.668 676 2HZ LYS 85 2HZ LYS 85 -6.025 4.050 12.298 677 3HZ LYS 85 3HZ LYS 85 -5.427 2.798 11.320 678 H THR 86 H THR 86 -1.168 4.387 8.237 679 HA THR 86 HA THR 86 -1.107 1.687 7.078 680 HB THR 86 HB THR 86 0.844 2.928 6.325 681 HG1 THR 86 HG1 THR 86 1.908 1.139 6.601 682 1HG2 THR 86 1HG2 THR 86 0.990 4.597 8.087 683 2HG2 THR 86 2HG2 THR 86 2.526 3.747 7.913 684 3HG2 THR 86 3HG2 THR 86 1.446 3.352 9.250 685 H GLU 87 H GLU 87 -0.888 -0.016 8.456 686 HA GLU 87 HA GLU 87 -1.078 0.606 11.326 687 1HB GLU 87 1HB GLU 87 -2.028 -1.814 9.778 688 2HB GLU 87 2HB GLU 87 -2.106 -1.661 11.527 689 1HG GLU 87 1HG GLU 87 -3.486 0.173 9.584 690 2HG GLU 87 2HG GLU 87 -4.243 -1.197 10.392 691 H THR 88 H THR 88 -0.038 -0.928 12.799 692 HA THR 88 HA THR 88 2.650 -1.370 12.169 693 HB THR 88 HB THR 88 1.126 -2.844 14.322 694 HG1 THR 88 HG1 THR 88 0.794 -0.964 15.226 695 1HG2 THR 88 1HG2 THR 88 3.988 -1.895 14.114 696 2HG2 THR 88 2HG2 THR 88 3.432 -3.565 14.000 697 3HG2 THR 88 3HG2 THR 88 3.272 -2.685 15.519 698 H ILE 89 H ILE 89 -0.093 -3.637 12.272 699 HA ILE 89 HA ILE 89 1.414 -5.931 11.645 700 HB ILE 89 HB ILE 89 -0.812 -6.919 10.937 701 1HG1 ILE 89 1HG1 ILE 89 -2.727 -5.447 12.053 702 2HG1 ILE 89 2HG1 ILE 89 -1.666 -4.126 11.579 703 1HG2 ILE 89 1HG2 ILE 89 0.125 -7.269 13.127 704 2HG2 ILE 89 2HG2 ILE 89 -1.620 -7.045 13.252 705 3HG2 ILE 89 3HG2 ILE 89 -0.528 -5.729 13.687 706 1HD1 ILE 89 1HD1 ILE 89 -2.819 -6.205 9.739 707 2HD1 ILE 89 2HD1 ILE 89 -1.763 -4.873 9.265 708 3HD1 ILE 89 3HD1 ILE 89 -3.370 -4.538 9.908 709 H ILE 90 H ILE 90 -0.030 -3.471 9.618 710 HA ILE 90 HA ILE 90 0.204 -4.878 7.162 711 HB ILE 90 HB ILE 90 0.160 -1.892 7.654 712 1HG1 ILE 90 1HG1 ILE 90 -2.052 -3.795 6.854 713 2HG1 ILE 90 2HG1 ILE 90 -1.861 -3.059 8.442 714 1HG2 ILE 90 1HG2 ILE 90 -0.266 -3.425 5.093 715 2HG2 ILE 90 2HG2 ILE 90 1.140 -2.436 5.484 716 3HG2 ILE 90 3HG2 ILE 90 -0.443 -1.681 5.296 717 1HD1 ILE 90 1HD1 ILE 90 -2.244 -0.868 7.497 718 2HD1 ILE 90 2HD1 ILE 90 -3.567 -1.952 7.073 719 3HD1 ILE 90 3HD1 ILE 90 -2.333 -1.555 5.875 720 H ALA 91 H ALA 91 2.265 -2.558 8.863 721 HA ALA 91 HA ALA 91 4.304 -2.350 6.957 722 1HB ALA 91 1HB ALA 91 4.078 -0.823 8.848 723 2HB ALA 91 2HB ALA 91 5.693 -1.530 8.790 724 3HB ALA 91 3HB ALA 91 4.512 -2.123 9.956 725 H VAL 92 H VAL 92 4.011 -4.512 9.763 726 HA VAL 92 HA VAL 92 6.439 -5.873 9.427 727 HB VAL 92 HB VAL 92 3.853 -6.916 10.598 728 1HG1 VAL 92 1HG1 VAL 92 5.270 -8.519 11.805 729 2HG1 VAL 92 2HG1 VAL 92 6.675 -7.942 10.906 730 3HG1 VAL 92 3HG1 VAL 92 5.356 -8.748 10.058 731 1HG2 VAL 92 1HG2 VAL 92 4.840 -6.311 12.754 732 2HG2 VAL 92 2HG2 VAL 92 4.639 -4.901 11.713 733 3HG2 VAL 92 3HG2 VAL 92 6.235 -5.623 11.922 734 H GLY 93 H GLY 93 3.200 -6.593 8.166 735 1HA GLY 93 1HA GLY 93 3.820 -9.055 6.963 736 2HA GLY 93 2HA GLY 93 2.489 -8.005 6.508 737 H ALA 94 H ALA 94 3.935 -5.761 5.664 738 HA ALA 94 HA ALA 94 4.577 -6.627 3.015 739 1HB ALA 94 1HB ALA 94 4.899 -4.245 2.553 740 2HB ALA 94 2HB ALA 94 4.772 -3.898 4.278 741 3HB ALA 94 3HB ALA 94 3.385 -4.549 3.406 742 H ALA 95 H ALA 95 6.437 -5.486 5.792 743 HA ALA 95 HA ALA 95 8.874 -5.005 4.501 744 1HB ALA 95 1HB ALA 95 8.391 -4.267 6.784 745 2HB ALA 95 2HB ALA 95 9.897 -5.184 6.706 746 3HB ALA 95 3HB ALA 95 8.432 -5.942 7.335 747 H MET 96 H MET 96 7.526 -7.978 5.826 748 HA MET 96 HA MET 96 9.892 -9.527 5.511 749 1HB MET 96 1HB MET 96 7.001 -10.361 5.796 750 2HB MET 96 2HB MET 96 8.365 -11.464 5.856 751 1HG MET 96 1HG MET 96 9.218 -10.336 7.828 752 2HG MET 96 2HG MET 96 7.887 -9.180 7.754 753 1HE MET 96 1HE MET 96 5.521 -11.149 6.817 754 2HE MET 96 2HE MET 96 5.297 -9.921 8.063 755 3HE MET 96 3HE MET 96 4.809 -11.590 8.366 756 H ALA 97 H ALA 97 7.191 -8.748 3.466 757 HA ALA 97 HA ALA 97 7.915 -10.712 1.448 758 1HB ALA 97 1HB ALA 97 5.561 -10.303 1.942 759 2HB ALA 97 2HB ALA 97 5.937 -9.902 0.266 760 3HB ALA 97 3HB ALA 97 5.747 -8.618 1.462 761 H GLU 98 H GLU 98 9.045 -7.756 2.298 762 HA GLU 98 HA GLU 98 10.270 -6.124 1.317 763 1HB GLU 98 1HB GLU 98 11.404 -8.187 0.328 764 2HB GLU 98 2HB GLU 98 10.465 -7.887 -1.128 765 1HG GLU 98 1HG GLU 98 12.606 -6.939 -1.468 766 2HG GLU 98 2HG GLU 98 11.483 -5.606 -1.208 767 H ILE 99 H ILE 99 7.544 -5.872 1.196 768 HA ILE 99 HA ILE 99 7.077 -4.590 -1.413 769 HB ILE 99 HB ILE 99 5.033 -5.250 0.717 770 1HG1 ILE 99 1HG1 ILE 99 5.575 -6.629 -1.924 771 2HG1 ILE 99 2HG1 ILE 99 5.992 -7.272 -0.340 772 1HG2 ILE 99 1HG2 ILE 99 4.381 -3.342 -0.620 773 2HG2 ILE 99 2HG2 ILE 99 3.396 -4.738 -1.057 774 3HG2 ILE 99 3HG2 ILE 99 4.720 -4.231 -2.107 775 1HD1 ILE 99 1HD1 ILE 99 3.641 -7.387 0.256 776 2HD1 ILE 99 2HD1 ILE 99 3.960 -8.286 -1.229 777 3HD1 ILE 99 3HD1 ILE 99 3.202 -6.696 -1.306 778 HA PRO 100 HA PRO 100 8.296 -1.157 1.352 779 1HB PRO 100 1HB PRO 100 8.588 0.232 -1.236 780 2HB PRO 100 2HB PRO 100 9.761 0.025 0.068 781 1HG PRO 100 1HG PRO 100 9.996 -1.299 -2.247 782 2HG PRO 100 2HG PRO 100 10.443 -2.047 -0.703 783 1HD PRO 100 1HD PRO 100 7.968 -2.422 -2.343 784 2HD PRO 100 2HD PRO 100 8.931 -3.631 -1.468 785 H LEU 101 H LEU 101 6.636 -0.153 2.302 786 HA LEU 101 HA LEU 101 4.804 1.355 0.563 787 1HB LEU 101 1HB LEU 101 3.024 1.096 2.120 788 2HB LEU 101 2HB LEU 101 3.679 -0.495 1.805 789 HG LEU 101 HG LEU 101 4.569 1.022 4.232 790 1HD1 LEU 101 1HD1 LEU 101 2.061 -0.640 4.010 791 2HD1 LEU 101 2HD1 LEU 101 2.124 1.106 4.252 792 3HD1 LEU 101 3HD1 LEU 101 2.744 0.020 5.495 793 1HD2 LEU 101 1HD2 LEU 101 4.827 -1.233 5.130 794 2HD2 LEU 101 2HD2 LEU 101 5.733 -1.040 3.628 795 3HD2 LEU 101 3HD2 LEU 101 4.200 -1.910 3.627 796 H VAL 102 H VAL 102 4.263 3.441 1.174 797 HA VAL 102 HA VAL 102 5.661 4.569 3.490 798 HB VAL 102 HB VAL 102 6.311 6.569 2.191 799 1HG1 VAL 102 1HG1 VAL 102 7.902 4.707 2.550 800 2HG1 VAL 102 2HG1 VAL 102 8.225 5.628 1.082 801 3HG1 VAL 102 3HG1 VAL 102 7.441 4.053 0.980 802 1HG2 VAL 102 1HG2 VAL 102 6.270 6.551 -0.242 803 2HG2 VAL 102 2HG2 VAL 102 4.639 6.382 0.405 804 3HG2 VAL 102 3HG2 VAL 102 5.484 4.972 -0.232 805 H GLU 103 H GLU 103 4.761 6.635 4.179 806 HA GLU 103 HA GLU 103 1.879 6.723 3.681 807 1HB GLU 103 1HB GLU 103 2.703 6.668 6.032 808 2HB GLU 103 2HB GLU 103 3.514 8.205 5.755 809 1HG GLU 103 1HG GLU 103 1.254 9.150 5.159 810 2HG GLU 103 2HG GLU 103 0.563 7.653 5.780 811 H VAL 104 H VAL 104 1.119 8.094 2.232 812 HA VAL 104 HA VAL 104 2.627 10.329 1.260 813 HB VAL 104 HB VAL 104 0.549 10.935 0.023 814 1HG1 VAL 104 1HG1 VAL 104 0.572 8.984 -1.459 815 2HG1 VAL 104 2HG1 VAL 104 1.422 8.061 -0.219 816 3HG1 VAL 104 3HG1 VAL 104 2.201 9.452 -0.969 817 1HG2 VAL 104 1HG2 VAL 104 -1.106 10.122 1.611 818 2HG2 VAL 104 2HG2 VAL 104 -0.574 8.463 1.341 819 3HG2 VAL 104 3HG2 VAL 104 -1.340 9.368 0.035 820 H ARG 105 H ARG 105 2.238 12.516 1.598 821 HA ARG 105 HA ARG 105 0.730 13.087 4.065 822 1HB ARG 105 1HB ARG 105 3.253 14.397 3.038 823 2HB ARG 105 2HB ARG 105 2.398 14.844 4.508 824 1HG ARG 105 1HG ARG 105 2.862 12.690 5.482 825 2HG ARG 105 2HG ARG 105 3.625 12.152 3.986 826 1HD ARG 105 1HD ARG 105 4.572 14.445 5.699 827 2HD ARG 105 2HD ARG 105 5.264 12.823 5.704 828 HE ARG 105 HE ARG 105 5.472 13.523 3.114 829 1HH1 ARG 105 1HH1 ARG 105 6.338 15.177 6.073 830 2HH1 ARG 105 2HH1 ARG 105 7.663 16.046 5.349 831 1HH2 ARG 105 1HH2 ARG 105 7.220 14.641 2.156 832 2HH2 ARG 105 2HH2 ARG 105 8.183 15.726 3.121 833 H ASP 106 H ASP 106 -0.095 13.229 1.195 834 HA ASP 106 HA ASP 106 -1.015 15.996 1.230 835 1HB ASP 106 1HB ASP 106 1.133 15.797 -0.137 836 2HB ASP 106 2HB ASP 106 0.194 14.838 -1.277 837 H GLU 107 H GLU 107 -3.085 16.100 0.764 838 HA GLU 107 HA GLU 107 -4.641 13.838 0.063 839 1HB GLU 107 1HB GLU 107 -5.543 15.693 1.372 840 2HB GLU 107 2HB GLU 107 -5.334 16.783 0.011 841 1HG GLU 107 1HG GLU 107 -6.944 15.413 -1.273 842 2HG GLU 107 2HG GLU 107 -7.211 14.436 0.171 843 H LYS 108 H LYS 108 -3.287 16.473 -1.823 844 HA LYS 108 HA LYS 108 -4.892 16.085 -4.122 845 1HB LYS 108 1HB LYS 108 -2.237 17.457 -3.738 846 2HB LYS 108 2HB LYS 108 -3.161 17.505 -5.227 847 1HG LYS 108 1HG LYS 108 -4.993 18.615 -4.093 848 2HG LYS 108 2HG LYS 108 -4.124 18.506 -2.562 849 1HD LYS 108 1HD LYS 108 -2.900 19.887 -4.926 850 2HD LYS 108 2HD LYS 108 -4.049 20.731 -3.891 851 1HE LYS 108 1HE LYS 108 -1.838 21.240 -3.123 852 2HE LYS 108 2HE LYS 108 -2.602 20.184 -1.940 853 1HZ LYS 108 1HZ LYS 108 -1.344 18.332 -2.755 854 2HZ LYS 108 2HZ LYS 108 -0.271 19.604 -2.435 855 3HZ LYS 108 3HZ LYS 108 -0.710 19.251 -4.033 856 H PHE 109 H PHE 109 -2.142 14.445 -2.889 857 HA PHE 109 HA PHE 109 -1.062 13.364 -5.232 858 1HB PHE 109 1HB PHE 109 -0.007 13.082 -3.022 859 2HB PHE 109 2HB PHE 109 -1.339 12.046 -2.518 860 HD1 PHE 109 HD1 PHE 109 1.585 12.311 -4.732 861 HD2 PHE 109 HD2 PHE 109 -1.436 9.755 -3.160 862 HE1 PHE 109 HE1 PHE 109 2.789 10.357 -5.610 863 HE2 PHE 109 HE2 PHE 109 -0.235 7.794 -4.040 864 HZ PHE 109 HZ PHE 109 1.879 8.092 -5.264 865 H PHE 110 H PHE 110 -3.850 12.427 -3.295 866 HA PHE 110 HA PHE 110 -4.399 9.996 -4.653 867 1HB PHE 110 1HB PHE 110 -6.153 11.796 -2.971 868 2HB PHE 110 2HB PHE 110 -6.666 10.227 -3.574 869 HD1 PHE 110 HD1 PHE 110 -5.492 8.175 -2.798 870 HD2 PHE 110 HD2 PHE 110 -4.792 11.994 -1.052 871 HE1 PHE 110 HE1 PHE 110 -4.508 7.088 -0.823 872 HE2 PHE 110 HE2 PHE 110 -3.804 10.914 0.924 873 HZ PHE 110 HZ PHE 110 -3.661 8.457 1.038 874 H GLU 111 H GLU 111 -5.210 13.326 -5.241 875 HA GLU 111 HA GLU 111 -7.216 12.837 -7.194 876 1HB GLU 111 1HB GLU 111 -7.064 14.926 -5.899 877 2HB GLU 111 2HB GLU 111 -5.515 15.276 -6.654 878 1HG GLU 111 1HG GLU 111 -6.615 15.379 -8.826 879 2HG GLU 111 2HG GLU 111 -8.158 15.058 -8.041 880 H ALA 112 H ALA 112 -3.762 13.451 -7.207 881 HA ALA 112 HA ALA 112 -3.517 13.775 -10.022 882 1HB ALA 112 1HB ALA 112 -1.923 14.776 -8.476 883 2HB ALA 112 2HB ALA 112 -1.106 13.707 -9.615 884 3HB ALA 112 3HB ALA 112 -1.400 13.173 -7.961 885 H VAL 113 H VAL 113 -2.876 11.062 -7.809 886 HA VAL 113 HA VAL 113 -1.712 9.394 -9.777 887 HB VAL 113 HB VAL 113 -1.354 9.083 -7.347 888 1HG1 VAL 113 1HG1 VAL 113 -4.172 8.006 -7.345 889 2HG1 VAL 113 2HG1 VAL 113 -3.610 9.471 -6.537 890 3HG1 VAL 113 3HG1 VAL 113 -3.028 7.894 -6.007 891 1HG2 VAL 113 1HG2 VAL 113 -2.485 6.654 -8.737 892 2HG2 VAL 113 2HG2 VAL 113 -1.378 6.645 -7.362 893 3HG2 VAL 113 3HG2 VAL 113 -0.845 7.280 -8.918 894 H LYS 114 H LYS 114 -2.539 7.845 -11.091 895 HA LYS 114 HA LYS 114 -5.422 7.340 -11.017 896 1HB LYS 114 1HB LYS 114 -3.976 7.904 -13.599 897 2HB LYS 114 2HB LYS 114 -5.711 7.770 -13.333 898 1HG LYS 114 1HG LYS 114 -5.578 9.817 -11.924 899 2HG LYS 114 2HG LYS 114 -3.892 9.978 -12.413 900 1HD LYS 114 1HD LYS 114 -4.739 9.930 -14.795 901 2HD LYS 114 2HD LYS 114 -6.354 10.151 -14.119 902 1HE LYS 114 1HE LYS 114 -3.994 12.009 -13.986 903 2HE LYS 114 2HE LYS 114 -5.609 12.323 -14.626 904 1HZ LYS 114 1HZ LYS 114 -4.812 12.033 -11.786 905 2HZ LYS 114 2HZ LYS 114 -6.429 12.020 -12.285 906 3HZ LYS 114 3HZ LYS 114 -5.476 13.399 -12.542 907 H THR 115 H THR 115 -6.028 5.326 -11.912 908 HA THR 115 HA THR 115 -4.058 3.295 -11.821 909 HB THR 115 HB THR 115 -6.875 3.148 -12.932 910 HG1 THR 115 HG1 THR 115 -7.386 2.385 -10.848 911 1HG2 THR 115 1HG2 THR 115 -6.677 0.733 -12.513 912 2HG2 THR 115 2HG2 THR 115 -4.996 0.956 -12.029 913 3HG2 THR 115 3HG2 THR 115 -5.487 1.282 -13.693 914 H GLY 116 H GLY 116 -2.602 2.865 -13.388 915 1HA GLY 116 1HA GLY 116 -2.467 1.935 -15.687 916 2HA GLY 116 2HA GLY 116 -3.439 3.305 -16.194 917 H ASP 117 H ASP 117 -1.627 4.803 -14.079 918 HA ASP 117 HA ASP 117 0.291 5.644 -16.087 919 1HB ASP 117 1HB ASP 117 -0.547 6.752 -13.421 920 2HB ASP 117 2HB ASP 117 0.898 7.345 -14.237 921 H ARG 118 H ARG 118 2.521 6.379 -14.898 922 HA ARG 118 HA ARG 118 3.584 3.809 -13.924 923 1HB ARG 118 1HB ARG 118 4.418 4.525 -16.121 924 2HB ARG 118 2HB ARG 118 5.015 6.016 -15.408 925 1HG ARG 118 1HG ARG 118 6.089 3.903 -13.890 926 2HG ARG 118 2HG ARG 118 6.275 3.461 -15.587 927 1HD ARG 118 1HD ARG 118 8.228 4.656 -14.975 928 2HD ARG 118 2HD ARG 118 7.257 5.745 -15.963 929 HE ARG 118 HE ARG 118 6.548 6.277 -13.357 930 1HH1 ARG 118 1HH1 ARG 118 9.465 6.405 -15.296 931 2HH1 ARG 118 2HH1 ARG 118 10.204 7.641 -14.319 932 1HH2 ARG 118 1HH2 ARG 118 7.528 7.907 -12.069 933 2HH2 ARG 118 2HH2 ARG 118 9.111 8.502 -12.495 934 H VAL 119 H VAL 119 4.240 3.746 -11.914 935 HA VAL 119 HA VAL 119 5.224 6.232 -10.665 936 HB VAL 119 HB VAL 119 3.702 4.014 -9.279 937 1HG1 VAL 119 1HG1 VAL 119 3.698 5.507 -7.341 938 2HG1 VAL 119 2HG1 VAL 119 4.672 6.675 -8.234 939 3HG1 VAL 119 3HG1 VAL 119 5.344 5.097 -7.824 940 1HG2 VAL 119 1HG2 VAL 119 1.901 5.655 -9.025 941 2HG2 VAL 119 2HG2 VAL 119 2.243 5.326 -10.724 942 3HG2 VAL 119 3HG2 VAL 119 2.826 6.813 -9.980 943 H VAL 120 H VAL 120 7.159 6.110 -9.680 944 HA VAL 120 HA VAL 120 8.270 3.440 -9.155 945 HB VAL 120 HB VAL 120 10.511 4.624 -9.082 946 1HG1 VAL 120 1HG1 VAL 120 10.791 4.572 -11.508 947 2HG1 VAL 120 2HG1 VAL 120 9.039 4.560 -11.710 948 3HG1 VAL 120 3HG1 VAL 120 9.849 3.198 -10.934 949 1HG2 VAL 120 1HG2 VAL 120 8.959 6.797 -10.482 950 2HG2 VAL 120 2HG2 VAL 120 10.713 6.727 -10.312 951 3HG2 VAL 120 3HG2 VAL 120 9.697 6.913 -8.883 952 H VAL 121 H VAL 121 8.868 2.951 -7.115 953 HA VAL 121 HA VAL 121 8.394 5.053 -5.111 954 HB VAL 121 HB VAL 121 6.751 3.235 -4.984 955 1HG1 VAL 121 1HG1 VAL 121 7.446 0.984 -4.279 956 2HG1 VAL 121 2HG1 VAL 121 9.133 1.457 -4.478 957 3HG1 VAL 121 3HG1 VAL 121 8.059 1.406 -5.877 958 1HG2 VAL 121 1HG2 VAL 121 8.688 3.252 -2.672 959 2HG2 VAL 121 2HG2 VAL 121 7.007 2.723 -2.607 960 3HG2 VAL 121 3HG2 VAL 121 7.386 4.411 -2.946 961 H ASN 122 H ASN 122 9.968 5.554 -3.752 962 HA ASN 122 HA ASN 122 12.200 3.664 -3.430 963 1HB ASN 122 1HB ASN 122 12.795 5.641 -4.888 964 2HB ASN 122 2HB ASN 122 12.485 6.680 -3.503 965 1HD2 ASN 122 1HD2 ASN 122 14.925 6.260 -5.017 966 2HD2 ASN 122 2HD2 ASN 122 16.122 5.761 -3.858 967 H ALA 123 H ALA 123 11.526 2.886 -1.474 968 HA ALA 123 HA ALA 123 10.599 4.719 0.580 969 1HB ALA 123 1HB ALA 123 10.135 2.701 1.881 970 2HB ALA 123 2HB ALA 123 10.915 1.720 0.640 971 3HB ALA 123 3HB ALA 123 9.427 2.592 0.269 972 H ASP 124 H ASP 124 13.471 3.258 -0.441 973 HA ASP 124 HA ASP 124 14.831 3.082 2.050 974 1HB ASP 124 1HB ASP 124 15.501 1.896 -0.059 975 2HB ASP 124 2HB ASP 124 16.029 3.448 -0.703 976 H GLU 125 H GLU 125 14.584 5.541 -0.460 977 HA GLU 125 HA GLU 125 16.137 7.407 1.181 978 1HB GLU 125 1HB GLU 125 15.193 7.580 -1.683 979 2HB GLU 125 2HB GLU 125 16.117 8.831 -0.862 980 1HG GLU 125 1HG GLU 125 17.997 7.365 -0.622 981 2HG GLU 125 2HG GLU 125 17.072 6.006 -1.255 982 H GLY 126 H GLY 126 12.918 6.774 0.064 983 1HA GLY 126 1HA GLY 126 10.974 7.605 1.093 984 2HA GLY 126 2HA GLY 126 11.925 8.906 1.794 985 H TYR 127 H TYR 127 10.733 7.714 -1.342 986 HA TYR 127 HA TYR 127 9.923 10.357 -2.146 987 1HB TYR 127 1HB TYR 127 12.402 9.104 -3.254 988 2HB TYR 127 2HB TYR 127 11.358 10.002 -4.347 989 HD1 TYR 127 HD1 TYR 127 10.646 12.399 -3.411 990 HD2 TYR 127 HD2 TYR 127 14.127 10.251 -2.237 991 HE1 TYR 127 HE1 TYR 127 11.706 14.506 -2.722 992 HE2 TYR 127 HE2 TYR 127 15.195 12.354 -1.540 993 HH TYR 127 HH TYR 127 14.951 14.837 -2.178 994 H VAL 128 H VAL 128 8.485 10.325 -3.831 995 HA VAL 128 HA VAL 128 8.149 7.828 -5.332 996 HB VAL 128 HB VAL 128 5.655 8.169 -5.294 997 1HG1 VAL 128 1HG1 VAL 128 5.331 7.139 -3.085 998 2HG1 VAL 128 2HG1 VAL 128 6.990 7.562 -2.661 999 3HG1 VAL 128 3HG1 VAL 128 6.676 6.422 -3.970 1000 1HG2 VAL 128 1HG2 VAL 128 6.286 10.021 -2.998 1001 2HG2 VAL 128 2HG2 VAL 128 4.679 9.464 -3.463 1002 3HG2 VAL 128 3HG2 VAL 128 5.606 10.494 -4.554 1003 H GLU 129 H GLU 129 8.155 8.212 -7.465 1004 HA GLU 129 HA GLU 129 7.663 10.979 -8.330 1005 1HB GLU 129 1HB GLU 129 9.932 10.216 -8.820 1006 2HB GLU 129 2HB GLU 129 9.289 8.826 -9.690 1007 1HG GLU 129 1HG GLU 129 8.215 10.370 -11.289 1008 2HG GLU 129 2HG GLU 129 8.974 11.720 -10.447 1009 H LEU 130 H LEU 130 5.743 11.255 -9.128 1010 HA LEU 130 HA LEU 130 4.472 9.092 -10.655 1011 1HB LEU 130 1HB LEU 130 3.144 9.801 -8.784 1012 2HB LEU 130 2HB LEU 130 3.341 11.488 -9.216 1013 HG LEU 130 HG LEU 130 1.997 11.106 -11.255 1014 1HD1 LEU 130 1HD1 LEU 130 0.719 9.036 -11.481 1015 2HD1 LEU 130 2HD1 LEU 130 1.578 8.353 -10.100 1016 3HD1 LEU 130 3HD1 LEU 130 2.455 8.741 -11.580 1017 1HD2 LEU 130 1HD2 LEU 130 0.936 11.952 -9.251 1018 2HD2 LEU 130 2HD2 LEU 130 0.685 10.310 -8.661 1019 3HD2 LEU 130 3HD2 LEU 130 -0.160 10.866 -10.106 1020 H ILE 131 H ILE 131 4.455 9.293 -12.781 1021 HA ILE 131 HA ILE 131 4.531 12.007 -13.921 1022 HB ILE 131 HB ILE 131 5.407 9.490 -15.312 1023 1HG1 ILE 131 1HG1 ILE 131 7.081 11.651 -14.018 1024 2HG1 ILE 131 2HG1 ILE 131 6.955 9.980 -13.483 1025 1HG2 ILE 131 1HG2 ILE 131 5.710 12.388 -16.066 1026 2HG2 ILE 131 2HG2 ILE 131 4.603 11.230 -16.806 1027 3HG2 ILE 131 3HG2 ILE 131 6.346 11.017 -16.976 1028 1HD1 ILE 131 1HD1 ILE 131 9.031 10.348 -14.659 1029 2HD1 ILE 131 2HD1 ILE 131 8.156 10.932 -16.073 1030 3HD1 ILE 131 3HD1 ILE 131 8.002 9.247 -15.574 1031 H GLU 132 H GLU 132 2.762 12.605 -14.792 1032 HA GLU 132 HA GLU 132 0.572 10.814 -15.240 1033 1HB GLU 132 1HB GLU 132 0.588 13.641 -16.237 1034 2HB GLU 132 2HB GLU 132 -0.742 12.707 -15.568 1035 1HG GLU 132 1HG GLU 132 -0.364 14.143 -13.853 1036 2HG GLU 132 2HG GLU 132 0.716 12.830 -13.382 Start of MODEL 10 1 H VAL 1 H VAL 1 4.330 14.932 -11.025 2 HA VAL 1 HA VAL 1 6.423 16.373 -9.678 3 HB VAL 1 HB VAL 1 3.714 15.538 -8.618 4 1HG1 VAL 1 1HG1 VAL 1 5.617 17.693 -7.707 5 2HG1 VAL 1 2HG1 VAL 1 5.259 16.186 -6.860 6 3HG1 VAL 1 3HG1 VAL 1 4.002 17.406 -7.060 7 1HG2 VAL 1 1HG2 VAL 1 4.525 18.069 -10.038 8 2HG2 VAL 1 2HG2 VAL 1 2.980 17.812 -9.227 9 3HG2 VAL 1 3HG2 VAL 1 3.412 16.836 -10.631 10 H LYS 2 H LYS 2 7.615 15.707 -7.957 11 HA LYS 2 HA LYS 2 7.414 12.867 -7.218 12 1HB LYS 2 1HB LYS 2 9.644 14.866 -6.781 13 2HB LYS 2 2HB LYS 2 9.669 13.212 -6.196 14 1HG LYS 2 1HG LYS 2 10.960 13.178 -8.135 15 2HG LYS 2 2HG LYS 2 9.402 12.518 -8.633 16 1HD LYS 2 1HD LYS 2 8.775 14.717 -9.532 17 2HD LYS 2 2HD LYS 2 10.348 15.356 -9.049 18 1HE LYS 2 1HE LYS 2 11.470 13.839 -10.551 19 2HE LYS 2 2HE LYS 2 9.940 13.066 -10.966 20 1HZ LYS 2 1HZ LYS 2 10.763 15.853 -11.592 21 2HZ LYS 2 2HZ LYS 2 9.201 15.242 -11.842 22 3HZ LYS 2 3HZ LYS 2 10.511 14.581 -12.690 23 H PHE 3 H PHE 3 6.283 12.461 -5.435 24 HA PHE 3 HA PHE 3 5.853 14.634 -3.526 25 1HB PHE 3 1HB PHE 3 4.492 11.947 -3.775 26 2HB PHE 3 2HB PHE 3 4.074 13.180 -2.594 27 HD1 PHE 3 HD1 PHE 3 4.042 12.320 -6.174 28 HD2 PHE 3 HD2 PHE 3 2.761 15.072 -3.191 29 HE1 PHE 3 HE1 PHE 3 2.479 13.330 -7.782 30 HE2 PHE 3 HE2 PHE 3 1.195 16.088 -4.796 31 HZ PHE 3 HZ PHE 3 1.052 15.214 -7.094 32 H ALA 4 H ALA 4 6.185 14.411 -1.316 33 HA ALA 4 HA ALA 4 8.337 12.540 -0.643 34 1HB ALA 4 1HB ALA 4 8.675 14.940 -0.180 35 2HB ALA 4 2HB ALA 4 8.743 13.956 1.282 36 3HB ALA 4 3HB ALA 4 7.300 14.904 0.924 37 H CYS 5 H CYS 5 7.965 10.782 0.530 38 HA CYS 5 HA CYS 5 5.522 10.668 2.174 39 1HB CYS 5 1HB CYS 5 6.925 8.264 1.035 40 2HB CYS 5 2HB CYS 5 5.256 8.409 1.577 41 HG CYS 5 HG CYS 5 5.157 10.477 -0.725 42 H ARG 6 H ARG 6 5.802 8.884 3.928 43 HA ARG 6 HA ARG 6 8.480 9.158 5.096 44 1HB ARG 6 1HB ARG 6 6.743 9.823 6.623 45 2HB ARG 6 2HB ARG 6 5.853 8.333 6.339 46 1HG ARG 6 1HG ARG 6 7.477 7.039 7.490 47 2HG ARG 6 2HG ARG 6 8.604 8.393 7.552 48 1HD ARG 6 1HD ARG 6 5.903 8.415 8.883 49 2HD ARG 6 2HD ARG 6 7.384 7.907 9.696 50 HE ARG 6 HE ARG 6 7.881 10.412 8.601 51 1HH1 ARG 6 1HH1 ARG 6 5.780 8.999 11.033 52 2HH1 ARG 6 2HH1 ARG 6 5.681 10.460 11.971 53 1HH2 ARG 6 1HH2 ARG 6 7.762 12.320 9.836 54 2HH2 ARG 6 2HH2 ARG 6 6.834 12.341 11.304 55 H ALA 7 H ALA 7 9.847 7.560 4.938 56 HA ALA 7 HA ALA 7 9.173 5.126 3.642 57 1HB ALA 7 1HB ALA 7 11.353 6.206 3.400 58 2HB ALA 7 2HB ALA 7 11.508 4.540 3.955 59 3HB ALA 7 3HB ALA 7 11.708 5.871 5.095 60 H ILE 8 H ILE 8 8.072 3.538 4.573 61 HA ILE 8 HA ILE 8 8.449 2.931 7.396 62 HB ILE 8 HB ILE 8 6.688 1.547 5.361 63 1HG1 ILE 8 1HG1 ILE 8 5.978 3.867 5.666 64 2HG1 ILE 8 2HG1 ILE 8 4.821 2.771 6.409 65 1HG2 ILE 8 1HG2 ILE 8 7.240 0.115 7.237 66 2HG2 ILE 8 2HG2 ILE 8 5.546 0.604 7.322 67 3HG2 ILE 8 3HG2 ILE 8 6.740 1.372 8.371 68 1HD1 ILE 8 1HD1 ILE 8 5.216 4.718 7.801 69 2HD1 ILE 8 2HD1 ILE 8 6.938 4.341 7.856 70 3HD1 ILE 8 3HD1 ILE 8 5.771 3.247 8.598 71 H THR 9 H THR 9 8.328 0.910 4.456 72 HA THR 9 HA THR 9 10.554 -0.668 5.502 73 HB THR 9 HB THR 9 10.067 -2.129 3.481 74 HG1 THR 9 HG1 THR 9 7.871 -1.778 2.655 75 1HG2 THR 9 1HG2 THR 9 9.284 -2.744 5.705 76 2HG2 THR 9 2HG2 THR 9 8.064 -3.147 4.496 77 3HG2 THR 9 3HG2 THR 9 7.865 -1.716 5.508 78 H ARG 10 H ARG 10 11.774 -1.496 3.137 79 HA ARG 10 HA ARG 10 12.756 1.036 2.016 80 1HB ARG 10 1HB ARG 10 14.524 -1.212 2.996 81 2HB ARG 10 2HB ARG 10 15.065 0.292 2.261 82 1HG ARG 10 1HG ARG 10 14.243 1.566 4.122 83 2HG ARG 10 2HG ARG 10 13.521 0.124 4.837 84 1HD ARG 10 1HD ARG 10 15.808 -0.852 4.992 85 2HD ARG 10 2HD ARG 10 16.452 0.697 4.447 86 HE ARG 10 HE ARG 10 14.779 1.148 6.655 87 1HH1 ARG 10 1HH1 ARG 10 17.867 -0.327 5.883 88 2HH1 ARG 10 2HH1 ARG 10 18.551 -0.033 7.457 89 1HH2 ARG 10 1HH2 ARG 10 15.669 1.534 8.728 90 2HH2 ARG 10 2HH2 ARG 10 17.285 1.007 9.085 91 H GLY 11 H GLY 11 14.161 0.683 0.092 92 1HA GLY 11 1HA GLY 11 14.751 -0.840 -1.729 93 2HA GLY 11 2HA GLY 11 13.202 -1.629 -1.468 94 H ARG 12 H ARG 12 14.195 -0.528 -3.942 95 HA ARG 12 HA ARG 12 12.179 1.589 -4.355 96 1HB ARG 12 1HB ARG 12 14.537 2.294 -4.757 97 2HB ARG 12 2HB ARG 12 14.656 1.070 -6.013 98 1HG ARG 12 1HG ARG 12 12.901 2.192 -7.288 99 2HG ARG 12 2HG ARG 12 12.755 3.409 -6.016 100 1HD ARG 12 1HD ARG 12 15.115 4.025 -6.379 101 2HD ARG 12 2HD ARG 12 15.197 2.858 -7.696 102 HE ARG 12 HE ARG 12 13.180 4.956 -7.900 103 1HH1 ARG 12 1HH1 ARG 12 16.283 3.680 -8.891 104 2HH1 ARG 12 2HH1 ARG 12 16.434 4.750 -10.258 105 1HH2 ARG 12 1HH2 ARG 12 13.347 6.362 -9.689 106 2HH2 ARG 12 2HH2 ARG 12 14.761 6.281 -10.714 107 H ALA 13 H ALA 13 10.451 0.937 -5.427 108 HA ALA 13 HA ALA 13 10.727 -1.393 -7.206 109 1HB ALA 13 1HB ALA 13 8.505 -2.106 -6.558 110 2HB ALA 13 2HB ALA 13 8.335 -0.699 -5.508 111 3HB ALA 13 3HB ALA 13 9.528 -1.942 -5.132 112 H GLU 14 H GLU 14 9.830 -1.309 -9.170 113 HA GLU 14 HA GLU 14 8.453 1.172 -9.969 114 1HB GLU 14 1HB GLU 14 10.599 0.828 -11.094 115 2HB GLU 14 2HB GLU 14 10.101 -0.781 -11.595 116 1HG GLU 14 1HG GLU 14 8.156 0.484 -12.771 117 2HG GLU 14 2HG GLU 14 9.225 1.878 -12.615 118 H GLY 15 H GLY 15 6.449 1.012 -10.940 119 1HA GLY 15 1HA GLY 15 5.631 -1.333 -12.326 120 2HA GLY 15 2HA GLY 15 4.882 -1.258 -10.739 121 H GLU 16 H GLU 16 3.293 -1.267 -12.894 122 HA GLU 16 HA GLU 16 2.491 1.431 -13.543 123 1HB GLU 16 1HB GLU 16 2.262 -0.626 -15.058 124 2HB GLU 16 2HB GLU 16 0.923 -1.106 -14.027 125 1HG GLU 16 1HG GLU 16 -0.291 0.894 -14.605 126 2HG GLU 16 2HG GLU 16 1.076 1.486 -15.551 127 H ALA 17 H ALA 17 0.979 2.603 -12.469 128 HA ALA 17 HA ALA 17 0.273 1.509 -9.865 129 1HB ALA 17 1HB ALA 17 0.056 4.332 -10.889 130 2HB ALA 17 2HB ALA 17 1.416 3.663 -9.985 131 3HB ALA 17 3HB ALA 17 -0.169 3.804 -9.222 132 H LEU 18 H LEU 18 -1.667 0.950 -9.255 133 HA LEU 18 HA LEU 18 -3.988 1.934 -10.767 134 1HB LEU 18 1HB LEU 18 -3.407 -0.681 -9.500 135 2HB LEU 18 2HB LEU 18 -5.042 -0.074 -9.316 136 HG LEU 18 HG LEU 18 -5.164 0.163 -11.801 137 1HD1 LEU 18 1HD1 LEU 18 -3.553 -1.062 -13.164 138 2HD1 LEU 18 2HD1 LEU 18 -2.599 -1.426 -11.726 139 3HD1 LEU 18 3HD1 LEU 18 -2.768 0.243 -12.272 140 1HD2 LEU 18 1HD2 LEU 18 -5.475 -2.247 -12.207 141 2HD2 LEU 18 2HD2 LEU 18 -6.186 -1.720 -10.683 142 3HD2 LEU 18 3HD2 LEU 18 -4.653 -2.593 -10.686 143 H VAL 19 H VAL 19 -5.464 3.104 -9.710 144 HA VAL 19 HA VAL 19 -4.883 3.619 -6.864 145 HB VAL 19 HB VAL 19 -5.820 5.648 -8.900 146 1HG1 VAL 19 1HG1 VAL 19 -5.021 5.964 -6.007 147 2HG1 VAL 19 2HG1 VAL 19 -6.646 6.140 -6.670 148 3HG1 VAL 19 3HG1 VAL 19 -5.380 7.288 -7.115 149 1HG2 VAL 19 1HG2 VAL 19 -3.114 5.296 -7.618 150 2HG2 VAL 19 2HG2 VAL 19 -3.588 6.639 -8.658 151 3HG2 VAL 19 3HG2 VAL 19 -3.512 5.002 -9.310 152 H THR 20 H THR 20 -6.492 3.303 -5.516 153 HA THR 20 HA THR 20 -9.243 3.470 -6.549 154 HB THR 20 HB THR 20 -8.800 1.171 -5.966 155 HG1 THR 20 HG1 THR 20 -10.207 1.434 -3.745 156 1HG2 THR 20 1HG2 THR 20 -6.899 1.497 -4.468 157 2HG2 THR 20 2HG2 THR 20 -8.133 0.492 -3.709 158 3HG2 THR 20 3HG2 THR 20 -7.970 2.186 -3.247 159 H LYS 21 H LYS 21 -10.709 4.650 -5.400 160 HA LYS 21 HA LYS 21 -9.555 6.481 -3.437 161 1HB LYS 21 1HB LYS 21 -12.299 6.526 -4.719 162 2HB LYS 21 2HB LYS 21 -11.550 7.823 -3.796 163 1HG LYS 21 1HG LYS 21 -9.838 8.079 -5.508 164 2HG LYS 21 2HG LYS 21 -10.552 6.753 -6.429 165 1HD LYS 21 1HD LYS 21 -12.652 8.072 -6.587 166 2HD LYS 21 2HD LYS 21 -11.821 9.414 -5.795 167 1HE LYS 21 1HE LYS 21 -10.177 9.451 -7.621 168 2HE LYS 21 2HE LYS 21 -11.039 8.137 -8.418 169 1HZ LYS 21 1HZ LYS 21 -11.965 10.915 -7.965 170 2HZ LYS 21 2HZ LYS 21 -13.026 9.667 -8.396 171 3HZ LYS 21 3HZ LYS 21 -11.765 10.105 -9.442 172 H GLU 22 H GLU 22 -11.210 3.613 -3.494 173 HA GLU 22 HA GLU 22 -12.711 4.092 -1.038 174 1HB GLU 22 1HB GLU 22 -12.608 1.703 -2.885 175 2HB GLU 22 2HB GLU 22 -13.582 1.790 -1.423 176 1HG GLU 22 1HG GLU 22 -13.853 3.594 -3.819 177 2HG GLU 22 2HG GLU 22 -14.899 2.230 -3.431 178 H TYR 23 H TYR 23 -12.303 3.053 0.860 179 HA TYR 23 HA TYR 23 -9.639 1.980 1.212 180 1HB TYR 23 1HB TYR 23 -10.338 1.898 3.649 181 2HB TYR 23 2HB TYR 23 -10.329 3.499 2.917 182 HD1 TYR 23 HD1 TYR 23 -12.369 4.732 2.607 183 HD2 TYR 23 HD2 TYR 23 -12.473 0.800 4.227 184 HE1 TYR 23 HE1 TYR 23 -14.692 5.092 3.321 185 HE2 TYR 23 HE2 TYR 23 -14.800 1.152 4.944 186 HH TYR 23 HH TYR 23 -16.639 3.907 3.911 187 H ILE 24 H ILE 24 -9.266 -0.087 2.267 188 HA ILE 24 HA ILE 24 -11.384 -2.032 1.608 189 HB ILE 24 HB ILE 24 -9.608 -3.636 0.998 190 1HG1 ILE 24 1HG1 ILE 24 -7.748 -1.258 1.200 191 2HG1 ILE 24 2HG1 ILE 24 -7.803 -2.594 2.349 192 1HG2 ILE 24 1HG2 ILE 24 -10.708 -2.415 -0.756 193 2HG2 ILE 24 2HG2 ILE 24 -9.001 -2.597 -1.157 194 3HG2 ILE 24 3HG2 ILE 24 -9.607 -1.055 -0.552 195 1HD1 ILE 24 1HD1 ILE 24 -7.120 -4.136 0.608 196 2HD1 ILE 24 2HD1 ILE 24 -5.960 -2.817 0.757 197 3HD1 ILE 24 3HD1 ILE 24 -7.119 -2.830 -0.575 198 H SER 25 H SER 25 -10.661 -4.272 2.593 199 HA SER 25 HA SER 25 -9.921 -3.817 5.402 200 1HB SER 25 1HB SER 25 -11.115 -6.006 5.792 201 2HB SER 25 2HB SER 25 -12.157 -4.701 5.225 202 HG SER 25 HG SER 25 -10.963 -6.569 3.462 203 H PHE 26 H PHE 26 -8.003 -4.613 6.037 204 HA PHE 26 HA PHE 26 -6.432 -6.131 4.181 205 1HB PHE 26 1HB PHE 26 -5.939 -4.642 6.633 206 2HB PHE 26 2HB PHE 26 -5.039 -6.156 6.574 207 HD1 PHE 26 HD1 PHE 26 -5.469 -2.853 5.089 208 HD2 PHE 26 HD2 PHE 26 -3.389 -6.555 4.847 209 HE1 PHE 26 HE1 PHE 26 -3.817 -1.821 3.583 210 HE2 PHE 26 HE2 PHE 26 -1.730 -5.534 3.344 211 HZ PHE 26 HZ PHE 26 -1.943 -3.162 2.715 212 H LEU 27 H LEU 27 -7.258 -8.058 3.857 213 HA LEU 27 HA LEU 27 -6.729 -10.128 5.720 214 1HB LEU 27 1HB LEU 27 -9.188 -10.949 5.637 215 2HB LEU 27 2HB LEU 27 -8.732 -9.733 6.806 216 HG LEU 27 HG LEU 27 -9.639 -8.004 5.185 217 1HD1 LEU 27 1HD1 LEU 27 -10.836 -10.449 3.898 218 2HD1 LEU 27 2HD1 LEU 27 -9.658 -9.357 3.169 219 3HD1 LEU 27 3HD1 LEU 27 -11.281 -8.778 3.551 220 1HD2 LEU 27 1HD2 LEU 27 -11.970 -8.431 5.860 221 2HD2 LEU 27 2HD2 LEU 27 -10.824 -8.624 7.189 222 3HD2 LEU 27 3HD2 LEU 27 -11.497 -10.047 6.389 223 H GLY 28 H GLY 28 -8.416 -12.109 4.547 224 1HA GLY 28 1HA GLY 28 -7.005 -12.550 2.095 225 2HA GLY 28 2HA GLY 28 -8.265 -13.573 2.768 226 H GLY 29 H GLY 29 -7.885 -10.376 1.241 227 1HA GLY 29 1HA GLY 29 -10.526 -10.711 -0.002 228 2HA GLY 29 2HA GLY 29 -9.638 -9.201 0.132 229 H ILE 30 H ILE 30 -7.158 -10.662 -0.775 230 HA ILE 30 HA ILE 30 -7.746 -10.610 -3.658 231 HB ILE 30 HB ILE 30 -5.058 -10.514 -2.255 232 1HG1 ILE 30 1HG1 ILE 30 -6.646 -8.283 -3.546 233 2HG1 ILE 30 2HG1 ILE 30 -6.436 -8.509 -1.813 234 1HG2 ILE 30 1HG2 ILE 30 -5.795 -10.066 -5.147 235 2HG2 ILE 30 2HG2 ILE 30 -4.911 -11.447 -4.496 236 3HG2 ILE 30 3HG2 ILE 30 -4.192 -9.836 -4.452 237 1HD1 ILE 30 1HD1 ILE 30 -4.246 -7.932 -3.797 238 2HD1 ILE 30 2HD1 ILE 30 -4.034 -8.156 -2.061 239 3HD1 ILE 30 3HD1 ILE 30 -4.958 -6.782 -2.666 240 H ASP 31 H ASP 31 -7.396 -12.390 -4.905 241 HA ASP 31 HA ASP 31 -7.315 -14.934 -3.634 242 1HB ASP 31 1HB ASP 31 -8.529 -14.570 -5.740 243 2HB ASP 31 2HB ASP 31 -7.009 -14.236 -6.564 244 H LYS 32 H LYS 32 -5.673 -16.333 -3.325 245 HA LYS 32 HA LYS 32 -3.031 -15.210 -3.355 246 1HB LYS 32 1HB LYS 32 -2.391 -17.306 -2.200 247 2HB LYS 32 2HB LYS 32 -3.737 -16.482 -1.428 248 1HG LYS 32 1HG LYS 32 -5.300 -18.037 -2.422 249 2HG LYS 32 2HG LYS 32 -3.986 -18.837 -3.286 250 1HD LYS 32 1HD LYS 32 -2.969 -19.466 -1.148 251 2HD LYS 32 2HD LYS 32 -4.287 -18.665 -0.290 252 1HE LYS 32 1HE LYS 32 -5.890 -20.203 -1.256 253 2HE LYS 32 2HE LYS 32 -4.619 -20.974 -2.203 254 1HZ LYS 32 1HZ LYS 32 -5.164 -22.246 -0.218 255 2HZ LYS 32 2HZ LYS 32 -4.770 -20.921 0.766 256 3HZ LYS 32 3HZ LYS 32 -3.564 -21.682 -0.149 257 H GLU 33 H GLU 33 -4.789 -17.124 -5.551 258 HA GLU 33 HA GLU 33 -2.419 -18.525 -6.521 259 1HB GLU 33 1HB GLU 33 -5.347 -18.814 -7.098 260 2HB GLU 33 2HB GLU 33 -4.115 -19.638 -8.047 261 1HG GLU 33 1HG GLU 33 -4.478 -19.901 -5.072 262 2HG GLU 33 2HG GLU 33 -5.052 -21.041 -6.280 263 H THR 34 H THR 34 -5.015 -16.454 -7.836 264 HA THR 34 HA THR 34 -3.297 -15.994 -10.182 265 HB THR 34 HB THR 34 -5.442 -16.927 -10.774 266 HG1 THR 34 HG1 THR 34 -4.732 -14.355 -11.519 267 1HG2 THR 34 1HG2 THR 34 -6.662 -14.555 -9.356 268 2HG2 THR 34 2HG2 THR 34 -6.750 -16.239 -8.842 269 3HG2 THR 34 3HG2 THR 34 -7.545 -15.731 -10.331 270 H GLY 35 H GLY 35 -4.112 -14.514 -7.336 271 1HA GLY 35 1HA GLY 35 -3.615 -12.416 -6.546 272 2HA GLY 35 2HA GLY 35 -2.780 -12.125 -8.064 273 H ILE 36 H ILE 36 -6.199 -12.877 -7.662 274 HA ILE 36 HA ILE 36 -6.843 -10.277 -8.869 275 HB ILE 36 HB ILE 36 -8.560 -12.762 -8.649 276 1HG1 ILE 36 1HG1 ILE 36 -6.699 -13.025 -10.241 277 2HG1 ILE 36 2HG1 ILE 36 -8.249 -12.974 -11.071 278 1HG2 ILE 36 1HG2 ILE 36 -10.107 -11.589 -10.156 279 2HG2 ILE 36 2HG2 ILE 36 -9.094 -10.150 -10.060 280 3HG2 ILE 36 3HG2 ILE 36 -9.915 -10.746 -8.617 281 1HD1 ILE 36 1HD1 ILE 36 -6.548 -11.712 -12.260 282 2HD1 ILE 36 2HD1 ILE 36 -6.299 -10.695 -10.841 283 3HD1 ILE 36 3HD1 ILE 36 -7.842 -10.655 -11.694 284 H VAL 37 H VAL 37 -7.852 -8.768 -7.675 285 HA VAL 37 HA VAL 37 -8.404 -9.234 -4.914 286 HB VAL 37 HB VAL 37 -9.271 -6.849 -6.554 287 1HG1 VAL 37 1HG1 VAL 37 -10.300 -6.971 -4.371 288 2HG1 VAL 37 2HG1 VAL 37 -9.114 -5.667 -4.404 289 3HG1 VAL 37 3HG1 VAL 37 -8.725 -7.194 -3.611 290 1HG2 VAL 37 1HG2 VAL 37 -7.159 -5.789 -5.871 291 2HG2 VAL 37 2HG2 VAL 37 -6.894 -7.200 -6.894 292 3HG2 VAL 37 3HG2 VAL 37 -6.640 -7.314 -5.153 293 H LYS 38 H LYS 38 -10.156 -10.200 -4.149 294 HA LYS 38 HA LYS 38 -12.524 -10.530 -5.786 295 1HB LYS 38 1HB LYS 38 -11.885 -11.463 -2.978 296 2HB LYS 38 2HB LYS 38 -13.335 -11.896 -3.874 297 1HG LYS 38 1HG LYS 38 -10.540 -12.526 -4.794 298 2HG LYS 38 2HG LYS 38 -11.557 -13.636 -3.873 299 1HD LYS 38 1HD LYS 38 -12.626 -12.424 -6.383 300 2HD LYS 38 2HD LYS 38 -11.467 -13.748 -6.499 301 1HE LYS 38 1HE LYS 38 -13.775 -14.562 -6.575 302 2HE LYS 38 2HE LYS 38 -12.919 -15.167 -5.162 303 1HZ LYS 38 1HZ LYS 38 -14.748 -12.826 -5.105 304 2HZ LYS 38 2HZ LYS 38 -14.059 -13.628 -3.776 305 3HZ LYS 38 3HZ LYS 38 -15.227 -14.407 -4.722 306 H GLU 39 H GLU 39 -11.543 -8.798 -2.884 307 HA GLU 39 HA GLU 39 -14.078 -7.751 -2.213 308 1HB GLU 39 1HB GLU 39 -12.091 -7.742 -0.700 309 2HB GLU 39 2HB GLU 39 -11.362 -6.509 -1.718 310 1HG GLU 39 1HG GLU 39 -12.405 -5.600 0.317 311 2HG GLU 39 2HG GLU 39 -13.097 -4.946 -1.167 312 H ASP 40 H ASP 40 -15.162 -5.961 -2.944 313 HA ASP 40 HA ASP 40 -14.386 -5.226 -5.619 314 1HB ASP 40 1HB ASP 40 -16.768 -5.793 -4.889 315 2HB ASP 40 2HB ASP 40 -16.811 -4.180 -4.177 316 H CYS 41 H CYS 41 -13.703 -3.359 -6.352 317 HA CYS 41 HA CYS 41 -13.777 -0.948 -4.714 318 1HB CYS 41 1HB CYS 41 -11.235 -2.030 -5.967 319 2HB CYS 41 2HB CYS 41 -11.396 -0.474 -5.160 320 HG CYS 41 HG CYS 41 -12.443 -2.673 -3.035 321 H GLU 42 H GLU 42 -15.149 -1.978 -7.060 322 HA GLU 42 HA GLU 42 -15.936 -1.272 -9.055 323 1HB GLU 42 1HB GLU 42 -15.789 1.003 -8.109 324 2HB GLU 42 2HB GLU 42 -14.139 1.131 -8.702 325 1HG GLU 42 1HG GLU 42 -14.981 0.856 -11.005 326 2HG GLU 42 2HG GLU 42 -16.627 0.840 -10.369 327 H ILE 43 H ILE 43 -12.549 -0.127 -9.160 328 HA ILE 43 HA ILE 43 -12.231 -1.220 -11.813 329 HB ILE 43 HB ILE 43 -9.945 -0.333 -11.708 330 1HG1 ILE 43 1HG1 ILE 43 -10.659 0.563 -8.905 331 2HG1 ILE 43 2HG1 ILE 43 -9.589 -0.785 -9.276 332 1HG2 ILE 43 1HG2 ILE 43 -12.047 1.596 -10.729 333 2HG2 ILE 43 2HG2 ILE 43 -11.743 1.146 -12.407 334 3HG2 ILE 43 3HG2 ILE 43 -10.527 2.047 -11.500 335 1HD1 ILE 43 1HD1 ILE 43 -9.121 2.094 -10.012 336 2HD1 ILE 43 2HD1 ILE 43 -8.046 0.745 -10.383 337 3HD1 ILE 43 3HD1 ILE 43 -8.333 1.210 -8.705 338 H LYS 44 H LYS 44 -12.319 -2.692 -8.987 339 HA LYS 44 HA LYS 44 -10.005 -4.288 -8.926 340 1HB LYS 44 1HB LYS 44 -10.907 -4.566 -6.916 341 2HB LYS 44 2HB LYS 44 -12.440 -3.933 -7.456 342 1HG LYS 44 1HG LYS 44 -11.781 -6.758 -8.101 343 2HG LYS 44 2HG LYS 44 -12.245 -6.344 -6.447 344 1HD LYS 44 1HD LYS 44 -14.275 -5.219 -7.405 345 2HD LYS 44 2HD LYS 44 -13.830 -5.896 -8.971 346 1HE LYS 44 1HE LYS 44 -14.023 -8.140 -8.099 347 2HE LYS 44 2HE LYS 44 -14.349 -7.517 -6.482 348 1HZ LYS 44 1HZ LYS 44 -16.078 -7.298 -8.881 349 2HZ LYS 44 2HZ LYS 44 -16.356 -6.415 -7.465 350 3HZ LYS 44 3HZ LYS 44 -16.415 -8.112 -7.435 351 H GLY 45 H GLY 45 -9.562 -6.262 -9.761 352 1HA GLY 45 1HA GLY 45 -10.868 -8.325 -10.667 353 2HA GLY 45 2HA GLY 45 -11.354 -7.173 -11.900 354 H GLU 46 H GLU 46 -8.344 -6.256 -11.047 355 HA GLU 46 HA GLU 46 -7.152 -7.764 -13.259 356 1HB GLU 46 1HB GLU 46 -6.548 -5.101 -12.002 357 2HB GLU 46 2HB GLU 46 -5.344 -5.932 -12.976 358 1HG GLU 46 1HG GLU 46 -8.095 -5.394 -14.024 359 2HG GLU 46 2HG GLU 46 -6.819 -4.184 -14.104 360 H SER 47 H SER 47 -4.925 -8.477 -13.030 361 HA SER 47 HA SER 47 -4.403 -9.567 -10.419 362 1HB SER 47 1HB SER 47 -2.305 -10.439 -11.697 363 2HB SER 47 2HB SER 47 -3.889 -11.089 -12.117 364 HG SER 47 HG SER 47 -2.678 -10.508 -13.969 365 H VAL 48 H VAL 48 -3.237 -8.627 -8.915 366 HA VAL 48 HA VAL 48 -1.894 -6.127 -9.516 367 HB VAL 48 HB VAL 48 -1.612 -5.961 -7.048 368 1HG1 VAL 48 1HG1 VAL 48 -4.419 -6.562 -7.978 369 2HG1 VAL 48 2HG1 VAL 48 -3.576 -5.022 -8.154 370 3HG1 VAL 48 3HG1 VAL 48 -3.980 -5.628 -6.549 371 1HG2 VAL 48 1HG2 VAL 48 -2.736 -7.561 -5.593 372 2HG2 VAL 48 2HG2 VAL 48 -1.491 -8.367 -6.548 373 3HG2 VAL 48 3HG2 VAL 48 -3.192 -8.536 -6.988 374 H ALA 49 H ALA 49 -0.805 -8.830 -10.275 375 HA ALA 49 HA ALA 49 1.396 -9.495 -8.662 376 1HB ALA 49 1HB ALA 49 2.064 -10.937 -10.508 377 2HB ALA 49 2HB ALA 49 0.897 -10.145 -11.565 378 3HB ALA 49 3HB ALA 49 0.336 -11.090 -10.186 379 H GLY 50 H GLY 50 2.555 -7.684 -8.282 380 1HA GLY 50 1HA GLY 50 4.591 -6.600 -8.633 381 2HA GLY 50 2HA GLY 50 4.547 -7.092 -10.316 382 H ARG 51 H ARG 51 1.779 -5.602 -8.910 383 HA ARG 51 HA ARG 51 2.207 -3.231 -10.577 384 1HB ARG 51 1HB ARG 51 -0.247 -4.340 -9.204 385 2HB ARG 51 2HB ARG 51 -0.224 -2.798 -10.048 386 1HG ARG 51 1HG ARG 51 0.416 -5.449 -11.315 387 2HG ARG 51 2HG ARG 51 -1.148 -4.636 -11.400 388 1HD ARG 51 1HD ARG 51 -0.020 -2.689 -12.435 389 2HD ARG 51 2HD ARG 51 1.484 -3.607 -12.444 390 HE ARG 51 HE ARG 51 0.313 -5.212 -13.932 391 1HH1 ARG 51 1HH1 ARG 51 -0.899 -1.946 -13.636 392 2HH1 ARG 51 2HH1 ARG 51 -1.559 -1.900 -15.239 393 1HH2 ARG 51 1HH2 ARG 51 -0.592 -5.176 -16.034 394 2HH2 ARG 51 2HH2 ARG 51 -1.412 -3.746 -16.591 395 H ILE 52 H ILE 52 1.547 -1.123 -9.681 396 HA ILE 52 HA ILE 52 2.297 -0.879 -6.848 397 HB ILE 52 HB ILE 52 2.100 1.271 -8.973 398 1HG1 ILE 52 1HG1 ILE 52 3.981 -0.223 -9.394 399 2HG1 ILE 52 2HG1 ILE 52 4.559 1.343 -8.841 400 1HG2 ILE 52 1HG2 ILE 52 3.128 1.427 -6.143 401 2HG2 ILE 52 2HG2 ILE 52 1.624 2.126 -6.743 402 3HG2 ILE 52 3HG2 ILE 52 3.174 2.728 -7.334 403 1HD1 ILE 52 1HD1 ILE 52 5.825 -0.454 -7.839 404 2HD1 ILE 52 2HD1 ILE 52 4.346 -1.158 -7.184 405 3HD1 ILE 52 3HD1 ILE 52 4.906 0.412 -6.609 406 H LEU 53 H LEU 53 0.671 -0.654 -5.447 407 HA LEU 53 HA LEU 53 -1.915 0.258 -6.508 408 1HB LEU 53 1HB LEU 53 -1.189 -1.649 -4.329 409 2HB LEU 53 2HB LEU 53 -2.708 -0.785 -4.231 410 HG LEU 53 HG LEU 53 -3.081 -2.965 -5.185 411 1HD1 LEU 53 1HD1 LEU 53 -4.440 -1.126 -6.027 412 2HD1 LEU 53 2HD1 LEU 53 -4.170 -2.347 -7.270 413 3HD1 LEU 53 3HD1 LEU 53 -3.265 -0.835 -7.308 414 1HD2 LEU 53 1HD2 LEU 53 -2.074 -3.665 -7.285 415 2HD2 LEU 53 2HD2 LEU 53 -0.836 -3.375 -6.063 416 3HD2 LEU 53 3HD2 LEU 53 -1.117 -2.184 -7.333 417 H VAL 54 H VAL 54 -2.655 2.156 -5.922 418 HA VAL 54 HA VAL 54 -1.587 3.378 -3.461 419 HB VAL 54 HB VAL 54 -2.850 4.751 -5.844 420 1HG1 VAL 54 1HG1 VAL 54 -3.237 5.936 -3.742 421 2HG1 VAL 54 2HG1 VAL 54 -2.126 6.827 -4.782 422 3HG1 VAL 54 3HG1 VAL 54 -1.505 5.913 -3.406 423 1HG2 VAL 54 1HG2 VAL 54 -0.593 5.612 -6.292 424 2HG2 VAL 54 2HG2 VAL 54 -0.659 3.854 -6.408 425 3HG2 VAL 54 3HG2 VAL 54 0.039 4.619 -4.980 426 H PHE 55 H PHE 55 -2.951 2.920 -1.879 427 HA PHE 55 HA PHE 55 -5.721 3.775 -2.201 428 1HB PHE 55 1HB PHE 55 -6.515 1.840 -0.857 429 2HB PHE 55 2HB PHE 55 -5.862 1.375 -2.420 430 HD1 PHE 55 HD1 PHE 55 -3.579 0.349 -2.527 431 HD2 PHE 55 HD2 PHE 55 -5.638 0.991 1.138 432 HE1 PHE 55 HE1 PHE 55 -2.125 -1.300 -1.426 433 HE2 PHE 55 HE2 PHE 55 -4.183 -0.650 2.248 434 HZ PHE 55 HZ PHE 55 -2.421 -1.802 0.964 435 HA PRO 56 HA PRO 56 -5.001 6.029 1.516 436 1HB PRO 56 1HB PRO 56 -7.740 5.235 2.340 437 2HB PRO 56 2HB PRO 56 -7.048 6.848 2.142 438 1HG PRO 56 1HG PRO 56 -8.783 5.883 0.361 439 2HG PRO 56 2HG PRO 56 -7.395 6.860 -0.153 440 1HD PRO 56 1HD PRO 56 -7.777 3.896 -0.279 441 2HD PRO 56 2HD PRO 56 -7.029 4.990 -1.461 442 H GLY 57 H GLY 57 -6.803 2.998 1.947 443 1HA GLY 57 1HA GLY 57 -5.249 1.444 3.388 444 2HA GLY 57 2HA GLY 57 -5.638 2.656 4.604 445 H GLY 58 H GLY 58 -7.164 1.967 5.933 446 1HA GLY 58 1HA GLY 58 -9.713 1.642 5.730 447 2HA GLY 58 2HA GLY 58 -9.242 0.173 4.887 448 H LYS 59 H LYS 59 -9.961 -1.344 6.281 449 HA LYS 59 HA LYS 59 -9.295 -1.101 9.113 450 1HB LYS 59 1HB LYS 59 -10.981 -3.135 7.637 451 2HB LYS 59 2HB LYS 59 -10.751 -3.091 9.382 452 1HG LYS 59 1HG LYS 59 -11.834 -0.931 9.504 453 2HG LYS 59 2HG LYS 59 -11.990 -0.880 7.747 454 1HD LYS 59 1HD LYS 59 -13.279 -2.910 9.571 455 2HD LYS 59 2HD LYS 59 -14.093 -1.525 8.847 456 1HE LYS 59 1HE LYS 59 -13.430 -2.464 6.599 457 2HE LYS 59 2HE LYS 59 -12.927 -3.923 7.451 458 1HZ LYS 59 1HZ LYS 59 -15.128 -4.254 6.671 459 2HZ LYS 59 2HZ LYS 59 -15.659 -2.774 7.305 460 3HZ LYS 59 3HZ LYS 59 -15.237 -4.040 8.353 461 H GLY 60 H GLY 60 -7.256 -1.671 9.526 462 1HA GLY 60 1HA GLY 60 -5.993 -3.806 8.001 463 2HA GLY 60 2HA GLY 60 -5.187 -2.686 9.088 464 H SER 61 H SER 61 -7.157 -5.561 8.893 465 HA SER 61 HA SER 61 -6.877 -6.222 11.674 466 1HB SER 61 1HB SER 61 -7.740 -7.984 9.361 467 2HB SER 61 2HB SER 61 -8.018 -8.285 11.079 468 HG SER 61 HG SER 61 -8.940 -5.859 10.484 469 H THR 62 H THR 62 -5.739 -8.142 12.434 470 HA THR 62 HA THR 62 -3.043 -8.093 11.533 471 HB THR 62 HB THR 62 -3.612 -8.479 13.904 472 HG1 THR 62 HG1 THR 62 -1.938 -10.114 12.411 473 1HG2 THR 62 1HG2 THR 62 -4.326 -10.745 14.610 474 2HG2 THR 62 2HG2 THR 62 -4.598 -11.156 12.916 475 3HG2 THR 62 3HG2 THR 62 -5.561 -9.893 13.682 476 H VAL 63 H VAL 63 -5.743 -10.003 10.669 477 HA VAL 63 HA VAL 63 -4.404 -12.323 9.761 478 HB VAL 63 HB VAL 63 -6.809 -12.291 10.186 479 1HG1 VAL 63 1HG1 VAL 63 -6.990 -10.498 7.779 480 2HG1 VAL 63 2HG1 VAL 63 -7.375 -10.073 9.447 481 3HG1 VAL 63 3HG1 VAL 63 -8.362 -11.256 8.589 482 1HG2 VAL 63 1HG2 VAL 63 -7.558 -13.508 8.187 483 2HG2 VAL 63 2HG2 VAL 63 -5.951 -14.005 8.714 484 3HG2 VAL 63 3HG2 VAL 63 -6.129 -12.936 7.324 485 H GLY 64 H GLY 64 -4.904 -9.168 8.421 486 1HA GLY 64 1HA GLY 64 -4.169 -9.986 5.732 487 2HA GLY 64 2HA GLY 64 -4.582 -8.360 6.254 488 H SER 65 H SER 65 -2.313 -9.813 8.298 489 HA SER 65 HA SER 65 -0.237 -8.058 7.317 490 1HB SER 65 1HB SER 65 -0.659 -8.363 9.753 491 2HB SER 65 2HB SER 65 -0.153 -10.045 9.606 492 HG SER 65 HG SER 65 1.374 -7.690 9.436 493 H TYR 66 H TYR 66 -0.528 -11.572 7.882 494 HA TYR 66 HA TYR 66 2.008 -12.049 6.630 495 1HB TYR 66 1HB TYR 66 1.500 -14.447 7.053 496 2HB TYR 66 2HB TYR 66 1.387 -13.442 8.493 497 HD1 TYR 66 HD1 TYR 66 -0.490 -15.465 6.077 498 HD2 TYR 66 HD2 TYR 66 -0.756 -13.042 9.567 499 HE1 TYR 66 HE1 TYR 66 -2.756 -16.323 6.497 500 HE2 TYR 66 HE2 TYR 66 -3.020 -13.896 9.994 501 HH TYR 66 HH TYR 66 -4.308 -16.594 8.399 502 H VAL 67 H VAL 67 -1.180 -11.743 5.463 503 HA VAL 67 HA VAL 67 -1.067 -13.615 3.341 504 HB VAL 67 HB VAL 67 -2.914 -12.389 2.311 505 1HG1 VAL 67 1HG1 VAL 67 -4.539 -12.625 4.122 506 2HG1 VAL 67 2HG1 VAL 67 -3.224 -12.697 5.295 507 3HG1 VAL 67 3HG1 VAL 67 -3.401 -13.974 4.091 508 1HG2 VAL 67 1HG2 VAL 67 -2.499 -10.366 4.508 509 2HG2 VAL 67 2HG2 VAL 67 -3.850 -10.395 3.375 510 3HG2 VAL 67 3HG2 VAL 67 -2.211 -10.109 2.788 511 H LEU 68 H LEU 68 0.170 -10.382 3.716 512 HA LEU 68 HA LEU 68 0.599 -9.748 1.012 513 1HB LEU 68 1HB LEU 68 2.165 -8.919 3.457 514 2HB LEU 68 2HB LEU 68 2.326 -8.188 1.872 515 HG LEU 68 HG LEU 68 -0.182 -8.157 3.559 516 1HD1 LEU 68 1HD1 LEU 68 0.300 -5.765 3.809 517 2HD1 LEU 68 2HD1 LEU 68 1.828 -5.989 2.957 518 3HD1 LEU 68 3HD1 LEU 68 1.564 -6.769 4.516 519 1HD2 LEU 68 1HD2 LEU 68 -1.002 -6.561 1.886 520 2HD2 LEU 68 2HD2 LEU 68 -0.669 -8.140 1.172 521 3HD2 LEU 68 3HD2 LEU 68 0.464 -6.810 0.938 522 H LEU 69 H LEU 69 2.547 -11.491 3.374 523 HA LEU 69 HA LEU 69 4.792 -11.869 1.673 524 1HB LEU 69 1HB LEU 69 5.023 -12.039 4.077 525 2HB LEU 69 2HB LEU 69 3.877 -13.363 4.135 526 HG LEU 69 HG LEU 69 5.479 -14.769 2.862 527 1HD1 LEU 69 1HD1 LEU 69 7.778 -14.022 2.578 528 2HD1 LEU 69 2HD1 LEU 69 7.361 -12.445 3.245 529 3HD1 LEU 69 3HD1 LEU 69 6.669 -12.960 1.709 530 1HD2 LEU 69 1HD2 LEU 69 6.611 -13.547 5.377 531 2HD2 LEU 69 2HD2 LEU 69 7.028 -15.123 4.702 532 3HD2 LEU 69 3HD2 LEU 69 5.400 -14.828 5.312 533 H ASN 70 H ASN 70 1.967 -13.829 2.482 534 HA ASN 70 HA ASN 70 2.591 -16.141 1.048 535 1HB ASN 70 1HB ASN 70 0.647 -15.783 2.645 536 2HB ASN 70 2HB ASN 70 -0.180 -14.958 1.337 537 1HD2 ASN 70 1HD2 ASN 70 0.917 -16.860 -0.686 538 2HD2 ASN 70 2HD2 ASN 70 -0.011 -18.310 -0.478 539 H LEU 71 H LEU 71 0.784 -13.253 0.018 540 HA LEU 71 HA LEU 71 0.331 -14.099 -2.627 541 1HB LEU 71 1HB LEU 71 0.526 -11.307 -1.499 542 2HB LEU 71 2HB LEU 71 -0.095 -11.699 -3.089 543 HG LEU 71 HG LEU 71 -1.318 -12.581 -0.474 544 1HD1 LEU 71 1HD1 LEU 71 -1.539 -10.179 -0.854 545 2HD1 LEU 71 2HD1 LEU 71 -3.091 -11.001 -1.014 546 3HD1 LEU 71 3HD1 LEU 71 -2.211 -10.491 -2.454 547 1HD2 LEU 71 1HD2 LEU 71 -2.271 -12.897 -3.315 548 2HD2 LEU 71 2HD2 LEU 71 -3.199 -13.301 -1.869 549 3HD2 LEU 71 3HD2 LEU 71 -1.721 -14.187 -2.247 550 H ARG 72 H ARG 72 2.946 -12.163 -1.187 551 HA ARG 72 HA ARG 72 4.178 -11.513 -3.653 552 1HB ARG 72 1HB ARG 72 4.525 -10.375 -1.380 553 2HB ARG 72 2HB ARG 72 5.611 -11.703 -1.005 554 1HG ARG 72 1HG ARG 72 6.022 -10.090 -3.489 555 2HG ARG 72 2HG ARG 72 6.580 -9.492 -1.926 556 1HD ARG 72 1HD ARG 72 8.002 -11.380 -1.626 557 2HD ARG 72 2HD ARG 72 7.298 -12.206 -3.016 558 HE ARG 72 HE ARG 72 8.364 -10.513 -4.426 559 1HH1 ARG 72 1HH1 ARG 72 9.496 -10.789 -1.140 560 2HH1 ARG 72 2HH1 ARG 72 11.088 -10.185 -1.491 561 1HH2 ARG 72 1HH2 ARG 72 10.434 -9.715 -4.916 562 2HH2 ARG 72 2HH2 ARG 72 11.617 -9.550 -3.645 563 H LYS 73 H LYS 73 4.616 -14.141 -1.356 564 HA LYS 73 HA LYS 73 6.907 -15.295 -2.462 565 1HB LYS 73 1HB LYS 73 5.625 -15.745 -0.243 566 2HB LYS 73 2HB LYS 73 4.695 -16.888 -1.196 567 1HG LYS 73 1HG LYS 73 7.684 -17.015 -1.089 568 2HG LYS 73 2HG LYS 73 6.672 -17.750 0.150 569 1HD LYS 73 1HD LYS 73 6.567 -18.353 -2.803 570 2HD LYS 73 2HD LYS 73 7.316 -19.371 -1.572 571 1HE LYS 73 1HE LYS 73 4.396 -18.649 -1.773 572 2HE LYS 73 2HE LYS 73 5.116 -20.214 -2.146 573 1HZ LYS 73 1HZ LYS 73 4.123 -20.254 0.029 574 2HZ LYS 73 2HZ LYS 73 5.031 -18.910 0.525 575 3HZ LYS 73 3HZ LYS 73 5.808 -20.380 0.187 576 H ASN 74 H ASN 74 3.519 -15.514 -3.365 577 HA ASN 74 HA ASN 74 4.121 -17.572 -5.343 578 1HB ASN 74 1HB ASN 74 1.980 -17.541 -3.932 579 2HB ASN 74 2HB ASN 74 1.449 -16.220 -4.971 580 1HD2 ASN 74 1HD2 ASN 74 -0.282 -17.494 -5.735 581 2HD2 ASN 74 2HD2 ASN 74 -0.024 -18.767 -6.876 582 H GLY 75 H GLY 75 4.204 -14.251 -5.103 583 1HA GLY 75 1HA GLY 75 5.023 -12.798 -6.714 584 2HA GLY 75 2HA GLY 75 4.799 -14.050 -7.924 585 H VAL 76 H VAL 76 2.080 -13.400 -5.948 586 HA VAL 76 HA VAL 76 0.830 -12.067 -8.252 587 HB VAL 76 HB VAL 76 -1.323 -12.899 -7.401 588 1HG1 VAL 76 1HG1 VAL 76 0.778 -15.030 -7.795 589 2HG1 VAL 76 2HG1 VAL 76 -0.136 -14.208 -9.059 590 3HG1 VAL 76 3HG1 VAL 76 -0.964 -15.276 -7.925 591 1HG2 VAL 76 1HG2 VAL 76 -0.806 -13.034 -5.030 592 2HG2 VAL 76 2HG2 VAL 76 0.358 -14.324 -5.338 593 3HG2 VAL 76 3HG2 VAL 76 -1.359 -14.598 -5.626 594 H ALA 77 H ALA 77 2.204 -11.158 -5.538 595 HA ALA 77 HA ALA 77 0.110 -9.391 -4.531 596 1HB ALA 77 1HB ALA 77 1.704 -8.807 -2.790 597 2HB ALA 77 2HB ALA 77 2.967 -9.724 -3.613 598 3HB ALA 77 3HB ALA 77 1.573 -10.559 -2.929 599 HA PRO 78 HA PRO 78 1.548 -5.673 -6.577 600 1HB PRO 78 1HB PRO 78 1.591 -4.419 -3.885 601 2HB PRO 78 2HB PRO 78 0.748 -3.905 -5.350 602 1HG PRO 78 1HG PRO 78 -0.580 -5.002 -3.313 603 2HG PRO 78 2HG PRO 78 -1.026 -5.351 -4.994 604 1HD PRO 78 1HD PRO 78 0.488 -7.035 -3.044 605 2HD PRO 78 2HD PRO 78 -0.707 -7.519 -4.264 606 H LYS 79 H LYS 79 3.477 -4.518 -6.853 607 HA LYS 79 HA LYS 79 5.766 -5.784 -5.625 608 1HB LYS 79 1HB LYS 79 5.599 -5.176 -8.075 609 2HB LYS 79 2HB LYS 79 5.790 -3.506 -7.577 610 1HG LYS 79 1HG LYS 79 7.979 -3.886 -6.782 611 2HG LYS 79 2HG LYS 79 7.787 -5.637 -6.886 612 1HD LYS 79 1HD LYS 79 7.607 -5.443 -9.337 613 2HD LYS 79 2HD LYS 79 7.858 -3.702 -9.200 614 1HE LYS 79 1HE LYS 79 10.058 -4.037 -8.287 615 2HE LYS 79 2HE LYS 79 9.816 -5.782 -8.238 616 1HZ LYS 79 1HZ LYS 79 9.817 -4.165 -10.731 617 2HZ LYS 79 2HZ LYS 79 9.756 -5.855 -10.614 618 3HZ LYS 79 3HZ LYS 79 11.153 -5.025 -10.148 619 H ALA 80 H ALA 80 3.952 -2.892 -5.328 620 HA ALA 80 HA ALA 80 5.125 -2.252 -2.830 621 1HB ALA 80 1HB ALA 80 6.015 -0.050 -3.388 622 2HB ALA 80 2HB ALA 80 5.679 -0.340 -5.095 623 3HB ALA 80 3HB ALA 80 6.878 -1.322 -4.255 624 H ILE 81 H ILE 81 3.975 -0.520 -1.767 625 HA ILE 81 HA ILE 81 1.521 0.340 -3.133 626 HB ILE 81 HB ILE 81 0.216 -0.100 -1.039 627 1HG1 ILE 81 1HG1 ILE 81 2.606 -1.812 -0.321 628 2HG1 ILE 81 2HG1 ILE 81 2.155 -0.312 0.479 629 1HG2 ILE 81 1HG2 ILE 81 0.055 -1.550 -3.006 630 2HG2 ILE 81 2HG2 ILE 81 -0.161 -2.453 -1.507 631 3HG2 ILE 81 3HG2 ILE 81 1.370 -2.541 -2.377 632 1HD1 ILE 81 1HD1 ILE 81 0.540 -2.850 0.421 633 2HD1 ILE 81 2HD1 ILE 81 0.049 -1.339 1.186 634 3HD1 ILE 81 3HD1 ILE 81 1.457 -2.213 1.787 635 H ILE 82 H ILE 82 0.666 2.299 -2.444 636 HA ILE 82 HA ILE 82 2.275 3.768 -0.445 637 HB ILE 82 HB ILE 82 0.706 5.215 -2.557 638 1HG1 ILE 82 1HG1 ILE 82 2.135 3.612 -3.792 639 2HG1 ILE 82 2HG1 ILE 82 2.638 5.277 -4.047 640 1HG2 ILE 82 1HG2 ILE 82 3.255 5.885 -1.073 641 2HG2 ILE 82 2HG2 ILE 82 1.637 6.457 -0.658 642 3HG2 ILE 82 3HG2 ILE 82 2.386 6.953 -2.176 643 1HD1 ILE 82 1HD1 ILE 82 4.548 3.809 -3.772 644 2HD1 ILE 82 2HD1 ILE 82 3.949 3.307 -2.190 645 3HD1 ILE 82 3HD1 ILE 82 4.457 4.976 -2.453 646 H ASN 83 H ASN 83 1.147 4.413 1.311 647 HA ASN 83 HA ASN 83 -1.804 4.438 1.128 648 1HB ASN 83 1HB ASN 83 -0.100 3.488 3.450 649 2HB ASN 83 2HB ASN 83 -1.853 3.623 3.475 650 1HD2 ASN 83 1HD2 ASN 83 -2.136 2.667 0.735 651 2HD2 ASN 83 2HD2 ASN 83 -1.838 0.964 0.798 652 H LYS 84 H LYS 84 -2.779 5.729 3.033 653 HA LYS 84 HA LYS 84 -1.186 8.149 3.381 654 1HB LYS 84 1HB LYS 84 -3.215 9.230 4.056 655 2HB LYS 84 2HB LYS 84 -3.507 8.368 2.563 656 1HG LYS 84 1HG LYS 84 -4.711 6.655 3.731 657 2HG LYS 84 2HG LYS 84 -4.280 7.365 5.291 658 1HD LYS 84 1HD LYS 84 -5.515 9.393 4.712 659 2HD LYS 84 2HD LYS 84 -5.946 8.691 3.152 660 1HE LYS 84 1HE LYS 84 -7.157 6.899 4.313 661 2HE LYS 84 2HE LYS 84 -6.742 7.629 5.863 662 1HZ LYS 84 1HZ LYS 84 -7.983 9.594 5.250 663 2HZ LYS 84 2HZ LYS 84 -8.979 8.227 5.143 664 3HZ LYS 84 3HZ LYS 84 -8.350 8.933 3.733 665 H LYS 85 H LYS 85 -2.663 5.552 5.157 666 HA LYS 85 HA LYS 85 -1.051 6.322 7.477 667 1HB LYS 85 1HB LYS 85 -3.296 7.125 7.943 668 2HB LYS 85 2HB LYS 85 -3.968 5.545 7.578 669 1HG LYS 85 1HG LYS 85 -3.827 6.039 9.995 670 2HG LYS 85 2HG LYS 85 -2.955 4.586 9.516 671 1HD LYS 85 1HD LYS 85 -1.709 5.947 11.154 672 2HD LYS 85 2HD LYS 85 -0.844 5.766 9.631 673 1HE LYS 85 1HE LYS 85 -2.572 8.153 9.891 674 2HE LYS 85 2HE LYS 85 -1.136 8.111 10.912 675 1HZ LYS 85 1HZ LYS 85 -0.427 9.142 8.964 676 2HZ LYS 85 2HZ LYS 85 -1.292 8.091 7.958 677 3HZ LYS 85 3HZ LYS 85 0.093 7.541 8.760 678 H THR 86 H THR 86 0.312 4.760 7.792 679 HA THR 86 HA THR 86 -0.401 2.014 7.079 680 HB THR 86 HB THR 86 2.299 3.191 7.776 681 HG1 THR 86 HG1 THR 86 1.209 2.515 5.226 682 1HG2 THR 86 1HG2 THR 86 3.207 1.136 6.786 683 2HG2 THR 86 2HG2 THR 86 1.569 0.525 6.554 684 3HG2 THR 86 3HG2 THR 86 2.191 0.782 8.184 685 H GLU 87 H GLU 87 -0.832 0.553 8.598 686 HA GLU 87 HA GLU 87 -0.459 1.201 11.407 687 1HB GLU 87 1HB GLU 87 -2.454 -0.096 10.089 688 2HB GLU 87 2HB GLU 87 -1.491 -1.464 10.619 689 1HG GLU 87 1HG GLU 87 -2.752 0.650 12.351 690 2HG GLU 87 2HG GLU 87 -3.223 -1.042 12.214 691 H THR 88 H THR 88 0.726 -0.157 12.842 692 HA THR 88 HA THR 88 3.217 -1.040 11.974 693 HB THR 88 HB THR 88 1.781 -2.054 14.431 694 HG1 THR 88 HG1 THR 88 3.106 0.417 13.913 695 1HG2 THR 88 1HG2 THR 88 4.705 -1.589 13.835 696 2HG2 THR 88 2HG2 THR 88 3.905 -3.158 13.946 697 3HG2 THR 88 3HG2 THR 88 4.045 -2.133 15.375 698 H ILE 89 H ILE 89 0.213 -2.845 12.509 699 HA ILE 89 HA ILE 89 1.124 -5.447 12.117 700 HB ILE 89 HB ILE 89 -1.512 -4.197 11.324 701 1HG1 ILE 89 1HG1 ILE 89 -0.754 -5.916 13.697 702 2HG1 ILE 89 2HG1 ILE 89 -0.964 -4.169 13.739 703 1HG2 ILE 89 1HG2 ILE 89 -1.091 -6.232 10.018 704 2HG2 ILE 89 2HG2 ILE 89 -2.428 -6.426 11.151 705 3HG2 ILE 89 3HG2 ILE 89 -0.854 -7.130 11.517 706 1HD1 ILE 89 1HD1 ILE 89 -3.314 -4.449 13.125 707 2HD1 ILE 89 2HD1 ILE 89 -2.912 -5.293 14.620 708 3HD1 ILE 89 3HD1 ILE 89 -3.096 -6.200 13.117 709 H ILE 90 H ILE 90 0.231 -2.984 9.766 710 HA ILE 90 HA ILE 90 0.441 -4.661 7.470 711 HB ILE 90 HB ILE 90 0.637 -1.648 7.542 712 1HG1 ILE 90 1HG1 ILE 90 -1.361 -2.232 8.759 713 2HG1 ILE 90 2HG1 ILE 90 -1.835 -1.675 7.159 714 1HG2 ILE 90 1HG2 ILE 90 -0.298 -3.547 5.397 715 2HG2 ILE 90 2HG2 ILE 90 1.228 -2.663 5.413 716 3HG2 ILE 90 3HG2 ILE 90 -0.298 -1.786 5.287 717 1HD1 ILE 90 1HD1 ILE 90 -1.651 -4.548 8.027 718 2HD1 ILE 90 2HD1 ILE 90 -2.162 -3.970 6.442 719 3HD1 ILE 90 3HD1 ILE 90 -3.133 -3.607 7.868 720 H ALA 91 H ALA 91 2.539 -2.332 9.078 721 HA ALA 91 HA ALA 91 4.641 -2.242 7.258 722 1HB ALA 91 1HB ALA 91 6.019 -1.484 9.127 723 2HB ALA 91 2HB ALA 91 4.780 -2.023 10.260 724 3HB ALA 91 3HB ALA 91 4.436 -0.705 9.140 725 H VAL 92 H VAL 92 4.172 -4.411 10.037 726 HA VAL 92 HA VAL 92 6.559 -5.855 9.773 727 HB VAL 92 HB VAL 92 3.898 -6.819 10.846 728 1HG1 VAL 92 1HG1 VAL 92 6.670 -7.937 11.264 729 2HG1 VAL 92 2HG1 VAL 92 5.372 -8.691 10.337 730 3HG1 VAL 92 3HG1 VAL 92 5.204 -8.483 12.080 731 1HG2 VAL 92 1HG2 VAL 92 4.851 -6.272 13.045 732 2HG2 VAL 92 2HG2 VAL 92 4.690 -4.847 12.018 733 3HG2 VAL 92 3HG2 VAL 92 6.271 -5.594 12.249 734 H GLY 93 H GLY 93 3.333 -6.465 8.416 735 1HA GLY 93 1HA GLY 93 3.942 -8.887 7.120 736 2HA GLY 93 2HA GLY 93 2.640 -7.792 6.677 737 H ALA 94 H ALA 94 3.982 -5.555 5.892 738 HA ALA 94 HA ALA 94 4.749 -6.255 3.260 739 1HB ALA 94 1HB ALA 94 5.168 -3.875 2.954 740 2HB ALA 94 2HB ALA 94 5.082 -3.627 4.698 741 3HB ALA 94 3HB ALA 94 3.648 -4.140 3.811 742 H ALA 95 H ALA 95 6.582 -5.498 6.171 743 HA ALA 95 HA ALA 95 9.107 -5.141 4.963 744 1HB ALA 95 1HB ALA 95 10.041 -5.531 7.169 745 2HB ALA 95 2HB ALA 95 8.512 -6.215 7.720 746 3HB ALA 95 3HB ALA 95 8.609 -4.508 7.287 747 H MET 96 H MET 96 7.507 -8.023 6.261 748 HA MET 96 HA MET 96 9.699 -9.771 5.797 749 1HB MET 96 1HB MET 96 6.759 -10.345 6.180 750 2HB MET 96 2HB MET 96 8.006 -11.581 6.114 751 1HG MET 96 1HG MET 96 9.083 -10.562 8.079 752 2HG MET 96 2HG MET 96 7.774 -9.385 8.158 753 1HE MET 96 1HE MET 96 4.690 -11.640 9.016 754 2HE MET 96 2HE MET 96 5.230 -11.165 7.406 755 3HE MET 96 3HE MET 96 5.262 -9.996 8.726 756 H ALA 97 H ALA 97 6.971 -8.744 3.875 757 HA ALA 97 HA ALA 97 7.445 -10.727 1.820 758 1HB ALA 97 1HB ALA 97 5.163 -10.038 2.360 759 2HB ALA 97 2HB ALA 97 5.561 -9.697 0.676 760 3HB ALA 97 3HB ALA 97 5.541 -8.389 1.859 761 H GLU 98 H GLU 98 8.844 -7.833 2.633 762 HA GLU 98 HA GLU 98 10.164 -6.311 1.610 763 1HB GLU 98 1HB GLU 98 10.336 -8.386 -0.583 764 2HB GLU 98 2HB GLU 98 11.407 -7.007 -0.388 765 1HG GLU 98 1HG GLU 98 12.142 -7.904 1.775 766 2HG GLU 98 2HG GLU 98 11.105 -9.309 1.526 767 H ILE 99 H ILE 99 7.580 -5.760 1.442 768 HA ILE 99 HA ILE 99 7.143 -4.765 -1.296 769 HB ILE 99 HB ILE 99 5.112 -5.134 0.919 770 1HG1 ILE 99 1HG1 ILE 99 5.514 -6.648 -1.674 771 2HG1 ILE 99 2HG1 ILE 99 5.870 -7.258 -0.060 772 1HG2 ILE 99 1HG2 ILE 99 4.724 -4.240 -1.937 773 2HG2 ILE 99 2HG2 ILE 99 4.593 -3.220 -0.504 774 3HG2 ILE 99 3HG2 ILE 99 3.445 -4.533 -0.758 775 1HD1 ILE 99 1HD1 ILE 99 3.491 -7.090 0.504 776 2HD1 ILE 99 2HD1 ILE 99 3.784 -8.153 -0.873 777 3HD1 ILE 99 3HD1 ILE 99 3.157 -6.525 -1.132 778 HA PRO 100 HA PRO 100 8.658 -1.036 0.927 779 1HB PRO 100 1HB PRO 100 8.537 -0.113 -1.903 780 2HB PRO 100 2HB PRO 100 9.823 0.087 -0.707 781 1HG PRO 100 1HG PRO 100 10.073 -1.683 -2.675 782 2HG PRO 100 2HG PRO 100 10.649 -2.057 -1.039 783 1HD PRO 100 1HD PRO 100 8.186 -2.992 -2.445 784 2HD PRO 100 2HD PRO 100 9.248 -3.872 -1.327 785 H LEU 101 H LEU 101 7.084 0.017 1.957 786 HA LEU 101 HA LEU 101 4.997 1.283 0.336 787 1HB LEU 101 1HB LEU 101 3.270 0.715 1.789 788 2HB LEU 101 2HB LEU 101 4.190 -0.765 1.630 789 HG LEU 101 HG LEU 101 4.434 1.114 3.983 790 1HD1 LEU 101 1HD1 LEU 101 2.838 -1.429 3.698 791 2HD1 LEU 101 2HD1 LEU 101 2.180 0.201 3.851 792 3HD1 LEU 101 3HD1 LEU 101 3.073 -0.518 5.191 793 1HD2 LEU 101 1HD2 LEU 101 5.520 -0.767 5.067 794 2HD2 LEU 101 2HD2 LEU 101 6.383 -0.333 3.590 795 3HD2 LEU 101 3HD2 LEU 101 5.325 -1.743 3.611 796 H VAL 102 H VAL 102 4.343 3.284 0.984 797 HA VAL 102 HA VAL 102 5.758 4.508 3.241 798 HB VAL 102 HB VAL 102 6.177 6.544 1.834 799 1HG1 VAL 102 1HG1 VAL 102 7.543 4.018 0.916 800 2HG1 VAL 102 2HG1 VAL 102 7.975 4.975 2.330 801 3HG1 VAL 102 3HG1 VAL 102 8.163 5.657 0.715 802 1HG2 VAL 102 1HG2 VAL 102 4.551 6.061 0.067 803 2HG2 VAL 102 2HG2 VAL 102 5.525 4.684 -0.450 804 3HG2 VAL 102 3HG2 VAL 102 6.167 6.322 -0.592 805 H GLU 103 H GLU 103 4.733 6.471 4.008 806 HA GLU 103 HA GLU 103 1.860 6.434 3.428 807 1HB GLU 103 1HB GLU 103 1.564 7.559 5.588 808 2HB GLU 103 2HB GLU 103 2.428 6.039 5.761 809 1HG GLU 103 1HG GLU 103 4.375 7.046 6.361 810 2HG GLU 103 2HG GLU 103 4.031 8.513 5.445 811 H VAL 104 H VAL 104 0.814 8.121 2.646 812 HA VAL 104 HA VAL 104 2.162 10.737 2.581 813 HB VAL 104 HB VAL 104 0.671 11.152 0.503 814 1HG1 VAL 104 1HG1 VAL 104 3.082 11.081 0.401 815 2HG1 VAL 104 2HG1 VAL 104 2.400 10.242 -0.990 816 3HG1 VAL 104 3HG1 VAL 104 3.057 9.318 0.360 817 1HG2 VAL 104 1HG2 VAL 104 0.776 8.135 0.476 818 2HG2 VAL 104 2HG2 VAL 104 0.220 9.158 -0.849 819 3HG2 VAL 104 3HG2 VAL 104 -0.673 9.125 0.671 820 H ARG 105 H ARG 105 1.174 11.930 4.067 821 HA ARG 105 HA ARG 105 -1.681 11.659 4.528 822 1HB ARG 105 1HB ARG 105 -1.296 13.430 6.283 823 2HB ARG 105 2HB ARG 105 -0.438 11.919 6.533 824 1HG ARG 105 1HG ARG 105 1.007 14.060 5.094 825 2HG ARG 105 2HG ARG 105 0.708 14.302 6.815 826 1HD ARG 105 1HD ARG 105 1.801 12.200 7.330 827 2HD ARG 105 2HD ARG 105 2.024 11.866 5.613 828 HE ARG 105 HE ARG 105 3.194 14.354 6.439 829 1HH1 ARG 105 1HH1 ARG 105 3.731 10.884 6.420 830 2HH1 ARG 105 2HH1 ARG 105 5.458 11.039 6.289 831 1HH2 ARG 105 1HH2 ARG 105 5.465 14.534 6.274 832 2HH2 ARG 105 2HH2 ARG 105 6.445 13.097 6.210 833 H ASP 106 H ASP 106 -0.314 12.804 2.082 834 HA ASP 106 HA ASP 106 -1.517 15.464 1.957 835 1HB ASP 106 1HB ASP 106 0.739 15.267 1.062 836 2HB ASP 106 2HB ASP 106 0.232 13.953 0.003 837 H GLU 107 H GLU 107 -3.445 15.761 1.140 838 HA GLU 107 HA GLU 107 -5.012 13.566 0.236 839 1HB GLU 107 1HB GLU 107 -5.911 15.460 1.548 840 2HB GLU 107 2HB GLU 107 -5.630 16.524 0.180 841 1HG GLU 107 1HG GLU 107 -7.977 15.817 0.389 842 2HG GLU 107 2HG GLU 107 -7.246 15.335 -1.142 843 H LYS 108 H LYS 108 -3.362 16.233 -1.390 844 HA LYS 108 HA LYS 108 -4.861 15.969 -3.791 845 1HB LYS 108 1HB LYS 108 -2.369 17.485 -3.089 846 2HB LYS 108 2HB LYS 108 -3.026 17.468 -4.716 847 1HG LYS 108 1HG LYS 108 -5.221 18.220 -3.688 848 2HG LYS 108 2HG LYS 108 -4.291 18.537 -2.223 849 1HD LYS 108 1HD LYS 108 -2.876 20.095 -3.435 850 2HD LYS 108 2HD LYS 108 -3.735 19.734 -4.935 851 1HE LYS 108 1HE LYS 108 -4.937 20.965 -2.460 852 2HE LYS 108 2HE LYS 108 -4.517 21.825 -3.941 853 1HZ LYS 108 1HZ LYS 108 -6.216 20.770 -5.117 854 2HZ LYS 108 2HZ LYS 108 -6.928 21.136 -3.625 855 3HZ LYS 108 3HZ LYS 108 -6.418 19.555 -3.957 856 H PHE 109 H PHE 109 -2.053 14.378 -2.578 857 HA PHE 109 HA PHE 109 -0.976 13.327 -4.910 858 1HB PHE 109 1HB PHE 109 0.001 12.890 -2.711 859 2HB PHE 109 2HB PHE 109 -1.411 11.947 -2.249 860 HD1 PHE 109 HD1 PHE 109 -1.427 9.651 -2.580 861 HD2 PHE 109 HD2 PHE 109 1.335 12.053 -4.754 862 HE1 PHE 109 HE1 PHE 109 -0.348 7.619 -3.450 863 HE2 PHE 109 HE2 PHE 109 2.417 10.024 -5.627 864 HZ PHE 109 HZ PHE 109 1.574 7.802 -4.978 865 H PHE 110 H PHE 110 -3.722 12.152 -2.998 866 HA PHE 110 HA PHE 110 -4.345 10.021 -4.824 867 1HB PHE 110 1HB PHE 110 -5.952 11.198 -2.542 868 2HB PHE 110 2HB PHE 110 -6.372 9.735 -3.423 869 HD1 PHE 110 HD1 PHE 110 -5.251 7.662 -2.997 870 HD2 PHE 110 HD2 PHE 110 -4.024 11.233 -1.024 871 HE1 PHE 110 HE1 PHE 110 -3.921 6.328 -1.413 872 HE2 PHE 110 HE2 PHE 110 -2.693 9.902 0.560 873 HZ PHE 110 HZ PHE 110 -2.640 7.447 0.369 874 H GLU 111 H GLU 111 -5.211 13.317 -4.392 875 HA GLU 111 HA GLU 111 -7.621 13.447 -5.803 876 1HB GLU 111 1HB GLU 111 -6.723 15.164 -4.269 877 2HB GLU 111 2HB GLU 111 -5.453 15.518 -5.429 878 1HG GLU 111 1HG GLU 111 -7.252 16.121 -7.050 879 2HG GLU 111 2HG GLU 111 -8.390 15.995 -5.710 880 H ALA 112 H ALA 112 -4.237 13.782 -6.820 881 HA ALA 112 HA ALA 112 -5.116 14.478 -9.524 882 1HB ALA 112 1HB ALA 112 -2.836 15.207 -9.905 883 2HB ALA 112 2HB ALA 112 -2.351 14.570 -8.333 884 3HB ALA 112 3HB ALA 112 -3.475 15.925 -8.425 885 H VAL 113 H VAL 113 -3.578 11.848 -7.820 886 HA VAL 113 HA VAL 113 -2.229 10.733 -10.049 887 HB VAL 113 HB VAL 113 -1.659 10.198 -7.689 888 1HG1 VAL 113 1HG1 VAL 113 -3.894 9.927 -6.773 889 2HG1 VAL 113 2HG1 VAL 113 -2.930 8.476 -6.499 890 3HG1 VAL 113 3HG1 VAL 113 -4.147 8.498 -7.775 891 1HG2 VAL 113 1HG2 VAL 113 -1.153 7.842 -8.080 892 2HG2 VAL 113 2HG2 VAL 113 -0.837 8.816 -9.516 893 3HG2 VAL 113 3HG2 VAL 113 -2.290 7.819 -9.428 894 H LYS 114 H LYS 114 -2.863 9.358 -11.608 895 HA LYS 114 HA LYS 114 -5.665 8.464 -11.553 896 1HB LYS 114 1HB LYS 114 -3.839 8.968 -13.899 897 2HB LYS 114 2HB LYS 114 -5.463 8.303 -14.021 898 1HG LYS 114 1HG LYS 114 -6.372 10.361 -13.051 899 2HG LYS 114 2HG LYS 114 -4.739 11.026 -12.959 900 1HD LYS 114 1HD LYS 114 -4.544 10.772 -15.404 901 2HD LYS 114 2HD LYS 114 -6.216 10.220 -15.460 902 1HE LYS 114 1HE LYS 114 -6.932 12.367 -14.495 903 2HE LYS 114 2HE LYS 114 -5.254 12.913 -14.504 904 1HZ LYS 114 1HZ LYS 114 -6.769 12.107 -16.930 905 2HZ LYS 114 2HZ LYS 114 -5.212 12.784 -16.884 906 3HZ LYS 114 3HZ LYS 114 -6.555 13.708 -16.420 907 H THR 115 H THR 115 -6.118 6.362 -12.463 908 HA THR 115 HA THR 115 -4.062 4.455 -11.754 909 HB THR 115 HB THR 115 -6.328 4.071 -10.935 910 HG1 THR 115 HG1 THR 115 -5.763 2.088 -12.902 911 1HG2 THR 115 1HG2 THR 115 -7.107 3.823 -13.840 912 2HG2 THR 115 2HG2 THR 115 -7.627 5.082 -12.720 913 3HG2 THR 115 3HG2 THR 115 -8.140 3.413 -12.468 914 H GLY 116 H GLY 116 -2.797 3.414 -13.168 915 1HA GLY 116 1HA GLY 116 -2.665 2.137 -15.250 916 2HA GLY 116 2HA GLY 116 -3.628 3.394 -16.006 917 H ASP 117 H ASP 117 -1.539 4.977 -14.021 918 HA ASP 117 HA ASP 117 0.340 5.400 -16.232 919 1HB ASP 117 1HB ASP 117 -0.438 7.128 -13.891 920 2HB ASP 117 2HB ASP 117 1.005 7.457 -14.844 921 H ARG 118 H ARG 118 2.510 6.462 -14.890 922 HA ARG 118 HA ARG 118 3.560 3.948 -13.785 923 1HB ARG 118 1HB ARG 118 4.553 4.907 -15.886 924 2HB ARG 118 2HB ARG 118 5.134 6.256 -14.922 925 1HG ARG 118 1HG ARG 118 6.142 4.260 -13.479 926 2HG ARG 118 2HG ARG 118 6.071 3.452 -15.046 927 1HD ARG 118 1HD ARG 118 8.203 4.428 -14.967 928 2HD ARG 118 2HD ARG 118 7.243 5.512 -15.975 929 HE ARG 118 HE ARG 118 6.956 6.834 -13.808 930 1HH1 ARG 118 1HH1 ARG 118 9.818 4.981 -14.639 931 2HH1 ARG 118 2HH1 ARG 118 10.877 5.916 -13.616 932 1HH2 ARG 118 1HH2 ARG 118 8.359 8.075 -12.473 933 2HH2 ARG 118 2HH2 ARG 118 10.045 7.667 -12.369 934 H VAL 119 H VAL 119 4.167 3.836 -11.751 935 HA VAL 119 HA VAL 119 5.084 6.274 -10.396 936 HB VAL 119 HB VAL 119 3.141 4.263 -9.237 937 1HG1 VAL 119 1HG1 VAL 119 4.801 4.809 -7.555 938 2HG1 VAL 119 2HG1 VAL 119 3.268 5.588 -7.166 939 3HG1 VAL 119 3HG1 VAL 119 4.584 6.531 -7.865 940 1HG2 VAL 119 1HG2 VAL 119 1.698 6.213 -8.923 941 2HG2 VAL 119 2HG2 VAL 119 2.109 5.983 -10.624 942 3HG2 VAL 119 3HG2 VAL 119 2.915 7.239 -9.683 943 H VAL 120 H VAL 120 7.044 5.999 -9.619 944 HA VAL 120 HA VAL 120 7.913 3.283 -8.876 945 HB VAL 120 HB VAL 120 9.628 5.598 -9.811 946 1HG1 VAL 120 1HG1 VAL 120 10.390 2.774 -9.084 947 2HG1 VAL 120 2HG1 VAL 120 10.778 4.224 -8.160 948 3HG1 VAL 120 3HG1 VAL 120 11.473 3.989 -9.764 949 1HG2 VAL 120 1HG2 VAL 120 8.369 4.605 -11.633 950 2HG2 VAL 120 2HG2 VAL 120 8.912 2.996 -11.156 951 3HG2 VAL 120 3HG2 VAL 120 10.075 4.176 -11.765 952 H VAL 121 H VAL 121 8.349 2.977 -6.781 953 HA VAL 121 HA VAL 121 8.484 5.389 -5.100 954 HB VAL 121 HB VAL 121 6.553 4.056 -4.550 955 1HG1 VAL 121 1HG1 VAL 121 6.723 1.752 -3.769 956 2HG1 VAL 121 2HG1 VAL 121 8.455 1.764 -4.099 957 3HG1 VAL 121 3HG1 VAL 121 7.305 1.913 -5.427 958 1HG2 VAL 121 1HG2 VAL 121 8.702 3.700 -2.465 959 2HG2 VAL 121 2HG2 VAL 121 6.963 3.629 -2.179 960 3HG2 VAL 121 3HG2 VAL 121 7.713 5.139 -2.695 961 H ASN 122 H ASN 122 10.327 5.866 -4.209 962 HA ASN 122 HA ASN 122 12.308 3.747 -3.759 963 1HB ASN 122 1HB ASN 122 13.121 5.677 -5.052 964 2HB ASN 122 2HB ASN 122 12.653 6.760 -3.744 965 1HD2 ASN 122 1HD2 ASN 122 14.741 7.504 -3.451 966 2HD2 ASN 122 2HD2 ASN 122 15.983 6.536 -2.734 967 H ALA 123 H ALA 123 11.674 2.844 -1.852 968 HA ALA 123 HA ALA 123 10.751 4.496 0.336 969 1HB ALA 123 1HB ALA 123 11.268 1.526 0.250 970 2HB ALA 123 2HB ALA 123 9.731 2.309 -0.117 971 3HB ALA 123 3HB ALA 123 10.402 2.400 1.513 972 H ASP 124 H ASP 124 13.710 4.015 -0.831 973 HA ASP 124 HA ASP 124 15.241 3.453 1.494 974 1HB ASP 124 1HB ASP 124 16.139 3.264 -0.797 975 2HB ASP 124 2HB ASP 124 16.002 5.007 -0.991 976 H GLU 125 H GLU 125 14.048 6.399 -0.015 977 HA GLU 125 HA GLU 125 14.746 7.886 2.430 978 1HB GLU 125 1HB GLU 125 14.467 8.802 -0.427 979 2HB GLU 125 2HB GLU 125 14.395 9.931 0.916 980 1HG GLU 125 1HG GLU 125 16.715 8.098 0.368 981 2HG GLU 125 2HG GLU 125 16.615 9.771 -0.175 982 H GLY 126 H GLY 126 12.201 6.777 0.394 983 1HA GLY 126 1HA GLY 126 9.899 6.829 0.926 984 2HA GLY 126 2HA GLY 126 10.215 8.143 2.056 985 H TYR 127 H TYR 127 10.308 7.406 -1.417 986 HA TYR 127 HA TYR 127 9.415 10.125 -2.021 987 1HB TYR 127 1HB TYR 127 12.038 9.743 -1.888 988 2HB TYR 127 2HB TYR 127 11.795 9.037 -3.478 989 HD1 TYR 127 HD1 TYR 127 10.580 12.092 -1.694 990 HD2 TYR 127 HD2 TYR 127 12.374 10.453 -5.186 991 HE1 TYR 127 HE1 TYR 127 10.749 14.344 -2.657 992 HE2 TYR 127 HE2 TYR 127 12.542 12.703 -6.164 993 HH TYR 127 HH TYR 127 12.022 15.545 -4.306 994 H VAL 128 H VAL 128 7.907 10.011 -3.620 995 HA VAL 128 HA VAL 128 7.914 7.562 -5.264 996 HB VAL 128 HB VAL 128 5.468 7.898 -5.566 997 1HG1 VAL 128 1HG1 VAL 128 6.293 6.313 -3.936 998 2HG1 VAL 128 2HG1 VAL 128 4.836 7.103 -3.333 999 3HG1 VAL 128 3HG1 VAL 128 6.420 7.587 -2.725 1000 1HG2 VAL 128 1HG2 VAL 128 5.823 10.003 -3.437 1001 2HG2 VAL 128 2HG2 VAL 128 4.277 9.370 -4.003 1002 3HG2 VAL 128 3HG2 VAL 128 5.319 10.272 -5.104 1003 H GLU 129 H GLU 129 7.964 7.694 -7.386 1004 HA GLU 129 HA GLU 129 7.992 10.329 -8.657 1005 1HB GLU 129 1HB GLU 129 8.646 7.589 -9.767 1006 2HB GLU 129 2HB GLU 129 8.849 9.107 -10.623 1007 1HG GLU 129 1HG GLU 129 10.603 9.782 -9.151 1008 2HG GLU 129 2HG GLU 129 10.297 8.410 -8.084 1009 H LEU 130 H LEU 130 5.951 10.997 -9.156 1010 HA LEU 130 HA LEU 130 4.138 9.057 -10.401 1011 1HB LEU 130 1HB LEU 130 3.124 10.313 -8.611 1012 2HB LEU 130 2HB LEU 130 3.649 11.829 -9.317 1013 HG LEU 130 HG LEU 130 2.169 11.386 -11.270 1014 1HD1 LEU 130 1HD1 LEU 130 0.441 9.669 -11.058 1015 2HD1 LEU 130 2HD1 LEU 130 1.207 9.083 -9.581 1016 3HD1 LEU 130 3HD1 LEU 130 2.058 8.968 -11.123 1017 1HD2 LEU 130 1HD2 LEU 130 0.077 11.889 -10.094 1018 2HD2 LEU 130 2HD2 LEU 130 1.429 12.825 -9.454 1019 3HD2 LEU 130 3HD2 LEU 130 0.826 11.423 -8.568 1020 H ILE 131 H ILE 131 4.406 8.906 -12.533 1021 HA ILE 131 HA ILE 131 4.827 11.411 -14.042 1022 HB ILE 131 HB ILE 131 5.753 8.695 -14.939 1023 1HG1 ILE 131 1HG1 ILE 131 7.010 9.365 -12.920 1024 2HG1 ILE 131 2HG1 ILE 131 8.033 9.370 -14.353 1025 1HG2 ILE 131 1HG2 ILE 131 7.060 9.964 -16.580 1026 2HG2 ILE 131 2HG2 ILE 131 6.376 11.461 -15.949 1027 3HG2 ILE 131 3HG2 ILE 131 5.329 10.274 -16.729 1028 1HD1 ILE 131 1HD1 ILE 131 6.805 11.784 -13.044 1029 2HD1 ILE 131 2HD1 ILE 131 7.814 11.799 -14.489 1030 3HD1 ILE 131 3HD1 ILE 131 8.492 11.284 -12.945 1031 H GLU 132 H GLU 132 3.274 11.894 -15.385 1032 HA GLU 132 HA GLU 132 1.188 9.976 -16.022 1033 1HB GLU 132 1HB GLU 132 1.396 12.842 -16.971 1034 2HB GLU 132 2HB GLU 132 -0.041 11.836 -16.918 1035 1HG GLU 132 1HG GLU 132 -0.311 13.299 -15.141 1036 2HG GLU 132 2HG GLU 132 0.281 11.823 -14.385 Start of MODEL 11 1 H VAL 1 H VAL 1 5.086 16.089 -11.293 2 HA VAL 1 HA VAL 1 5.779 17.410 -8.765 3 HB VAL 1 HB VAL 1 3.865 16.098 -7.794 4 1HG1 VAL 1 1HG1 VAL 1 3.240 18.053 -10.005 5 2HG1 VAL 1 2HG1 VAL 1 3.645 18.458 -8.337 6 3HG1 VAL 1 3HG1 VAL 1 2.144 17.605 -8.698 7 1HG2 VAL 1 1HG2 VAL 1 3.711 14.377 -9.534 8 2HG2 VAL 1 2HG2 VAL 1 3.217 15.601 -10.701 9 3HG2 VAL 1 3HG2 VAL 1 2.176 15.221 -9.330 10 H LYS 2 H LYS 2 7.187 16.484 -7.508 11 HA LYS 2 HA LYS 2 7.324 13.549 -7.419 12 1HB LYS 2 1HB LYS 2 9.547 15.568 -7.040 13 2HB LYS 2 2HB LYS 2 9.687 13.886 -6.547 14 1HG LYS 2 1HG LYS 2 9.305 13.201 -8.884 15 2HG LYS 2 2HG LYS 2 9.258 14.903 -9.352 16 1HD LYS 2 1HD LYS 2 11.458 13.869 -9.766 17 2HD LYS 2 2HD LYS 2 11.549 15.198 -8.612 18 1HE LYS 2 1HE LYS 2 11.698 13.678 -6.770 19 2HE LYS 2 2HE LYS 2 11.364 12.297 -7.814 20 1HZ LYS 2 1HZ LYS 2 13.455 12.473 -8.819 21 2HZ LYS 2 2HZ LYS 2 13.768 12.700 -7.169 22 3HZ LYS 2 3HZ LYS 2 13.731 14.032 -8.216 23 H PHE 3 H PHE 3 6.680 12.725 -5.529 24 HA PHE 3 HA PHE 3 6.100 14.653 -3.406 25 1HB PHE 3 1HB PHE 3 5.068 11.850 -3.853 26 2HB PHE 3 2HB PHE 3 4.599 12.892 -2.515 27 HD1 PHE 3 HD1 PHE 3 3.173 14.815 -2.872 28 HD2 PHE 3 HD2 PHE 3 4.269 12.263 -6.098 29 HE1 PHE 3 HE1 PHE 3 1.389 15.800 -4.253 30 HE2 PHE 3 HE2 PHE 3 2.488 13.242 -7.481 31 HZ PHE 3 HZ PHE 3 1.045 15.013 -6.562 32 H ALA 4 H ALA 4 6.598 14.262 -1.258 33 HA ALA 4 HA ALA 4 8.775 12.328 -0.818 34 1HB ALA 4 1HB ALA 4 9.480 14.676 -0.580 35 2HB ALA 4 2HB ALA 4 9.589 13.800 0.945 36 3HB ALA 4 3HB ALA 4 8.252 14.913 0.663 37 H CYS 5 H CYS 5 8.290 10.687 0.472 38 HA CYS 5 HA CYS 5 6.012 10.978 2.317 39 1HB CYS 5 1HB CYS 5 5.725 8.489 1.929 40 2HB CYS 5 2HB CYS 5 5.344 9.525 0.557 41 HG CYS 5 HG CYS 5 8.429 8.105 0.837 42 H ARG 6 H ARG 6 6.070 9.261 4.075 43 HA ARG 6 HA ARG 6 8.765 9.178 5.204 44 1HB ARG 6 1HB ARG 6 7.201 9.963 6.790 45 2HB ARG 6 2HB ARG 6 6.018 8.735 6.359 46 1HG ARG 6 1HG ARG 6 7.006 8.267 8.522 47 2HG ARG 6 2HG ARG 6 7.428 7.013 7.357 48 1HD ARG 6 1HD ARG 6 9.578 8.425 6.998 49 2HD ARG 6 2HD ARG 6 9.154 9.152 8.550 50 HE ARG 6 HE ARG 6 9.195 6.255 8.494 51 1HH1 ARG 6 1HH1 ARG 6 10.982 9.180 9.199 52 2HH1 ARG 6 2HH1 ARG 6 12.126 8.385 10.236 53 1HH2 ARG 6 1HH2 ARG 6 10.705 5.203 9.817 54 2HH2 ARG 6 2HH2 ARG 6 11.984 6.105 10.570 55 H ALA 7 H ALA 7 9.972 7.488 4.839 56 HA ALA 7 HA ALA 7 8.933 5.076 3.731 57 1HB ALA 7 1HB ALA 7 11.098 5.977 3.063 58 2HB ALA 7 2HB ALA 7 11.257 4.343 3.708 59 3HB ALA 7 3HB ALA 7 11.709 5.729 4.698 60 H ILE 8 H ILE 8 7.821 3.718 4.989 61 HA ILE 8 HA ILE 8 8.673 3.127 7.700 62 HB ILE 8 HB ILE 8 6.551 1.770 6.019 63 1HG1 ILE 8 1HG1 ILE 8 6.011 4.122 6.388 64 2HG1 ILE 8 2HG1 ILE 8 4.938 3.091 7.327 65 1HG2 ILE 8 1HG2 ILE 8 5.722 0.881 8.140 66 2HG2 ILE 8 2HG2 ILE 8 7.066 1.646 8.990 67 3HG2 ILE 8 3HG2 ILE 8 7.377 0.360 7.824 68 1HD1 ILE 8 1HD1 ILE 8 6.269 3.544 9.326 69 2HD1 ILE 8 2HD1 ILE 8 5.629 5.024 8.609 70 3HD1 ILE 8 3HD1 ILE 8 7.324 4.593 8.379 71 H THR 9 H THR 9 8.194 1.274 4.711 72 HA THR 9 HA THR 9 10.372 -0.528 5.485 73 HB THR 9 HB THR 9 8.886 -0.870 2.928 74 HG1 THR 9 HG1 THR 9 7.744 -1.562 5.452 75 1HG2 THR 9 1HG2 THR 9 9.781 -2.780 5.088 76 2HG2 THR 9 2HG2 THR 9 10.598 -2.478 3.555 77 3HG2 THR 9 3HG2 THR 9 9.012 -3.247 3.571 78 H ARG 10 H ARG 10 11.778 -1.132 3.450 79 HA ARG 10 HA ARG 10 12.285 1.312 1.893 80 1HB ARG 10 1HB ARG 10 14.267 -0.658 3.012 81 2HB ARG 10 2HB ARG 10 14.670 0.416 1.680 82 1HG ARG 10 1HG ARG 10 13.935 2.319 3.204 83 2HG ARG 10 2HG ARG 10 13.980 1.131 4.509 84 1HD ARG 10 1HD ARG 10 16.297 1.731 2.679 85 2HD ARG 10 2HD ARG 10 16.072 2.463 4.266 86 HE ARG 10 HE ARG 10 16.167 0.111 5.140 87 1HH1 ARG 10 1HH1 ARG 10 17.684 0.931 2.074 88 2HH1 ARG 10 2HH1 ARG 10 18.956 -0.238 2.268 89 1HH2 ARG 10 1HH2 ARG 10 17.830 -1.407 5.377 90 2HH2 ARG 10 2HH2 ARG 10 19.036 -1.582 4.136 91 H GLY 11 H GLY 11 13.672 0.686 -0.131 92 1HA GLY 11 1HA GLY 11 13.944 -1.179 -1.755 93 2HA GLY 11 2HA GLY 11 12.275 -1.587 -1.389 94 H ARG 12 H ARG 12 13.691 -0.772 -3.898 95 HA ARG 12 HA ARG 12 11.868 1.430 -4.606 96 1HB ARG 12 1HB ARG 12 14.600 0.769 -5.720 97 2HB ARG 12 2HB ARG 12 13.510 1.950 -6.435 98 1HG ARG 12 1HG ARG 12 13.581 3.278 -4.404 99 2HG ARG 12 2HG ARG 12 14.634 2.083 -3.645 100 1HD ARG 12 1HD ARG 12 15.302 3.630 -6.143 101 2HD ARG 12 2HD ARG 12 15.848 4.057 -4.523 102 HE ARG 12 HE ARG 12 16.509 1.370 -5.386 103 1HH1 ARG 12 1HH1 ARG 12 17.539 4.713 -5.200 104 2HH1 ARG 12 2HH1 ARG 12 19.227 4.335 -5.328 105 1HH2 ARG 12 1HH2 ARG 12 18.701 0.861 -5.567 106 2HH2 ARG 12 2HH2 ARG 12 19.897 2.124 -5.541 107 H ALA 13 H ALA 13 10.452 1.069 -6.192 108 HA ALA 13 HA ALA 13 10.864 -1.067 -8.104 109 1HB ALA 13 1HB ALA 13 9.918 -2.258 -6.183 110 2HB ALA 13 2HB ALA 13 8.801 -2.246 -7.552 111 3HB ALA 13 3HB ALA 13 8.538 -1.161 -6.186 112 H GLU 14 H GLU 14 9.618 -0.834 -9.936 113 HA GLU 14 HA GLU 14 7.765 1.451 -9.960 114 1HB GLU 14 1HB GLU 14 8.459 1.915 -12.283 115 2HB GLU 14 2HB GLU 14 9.791 2.095 -11.150 116 1HG GLU 14 1HG GLU 14 10.713 -0.022 -11.816 117 2HG GLU 14 2HG GLU 14 9.316 -0.351 -12.840 118 H GLY 15 H GLY 15 5.860 1.162 -11.041 119 1HA GLY 15 1HA GLY 15 5.393 -1.014 -12.831 120 2HA GLY 15 2HA GLY 15 4.752 -1.354 -11.229 121 H GLU 16 H GLU 16 2.933 -1.303 -13.159 122 HA GLU 16 HA GLU 16 1.744 1.232 -13.589 123 1HB GLU 16 1HB GLU 16 1.232 -0.830 -14.906 124 2HB GLU 16 2HB GLU 16 0.374 -1.461 -13.507 125 1HG GLU 16 1HG GLU 16 -1.185 0.407 -13.614 126 2HG GLU 16 2HG GLU 16 -0.332 1.039 -15.022 127 H ALA 17 H ALA 17 0.536 2.447 -12.297 128 HA ALA 17 HA ALA 17 0.308 1.676 -9.533 129 1HB ALA 17 1HB ALA 17 -0.471 3.957 -9.175 130 2HB ALA 17 2HB ALA 17 -0.556 4.208 -10.920 131 3HB ALA 17 3HB ALA 17 1.003 3.936 -10.142 132 H LEU 18 H LEU 18 -1.375 0.783 -8.635 133 HA LEU 18 HA LEU 18 -3.993 0.988 -9.957 134 1HB LEU 18 1HB LEU 18 -2.994 -1.303 -9.622 135 2HB LEU 18 2HB LEU 18 -3.072 -1.028 -7.896 136 HG LEU 18 HG LEU 18 -5.577 -0.880 -9.545 137 1HD1 LEU 18 1HD1 LEU 18 -4.350 -3.396 -8.417 138 2HD1 LEU 18 2HD1 LEU 18 -4.478 -2.998 -10.130 139 3HD1 LEU 18 3HD1 LEU 18 -5.936 -3.256 -9.172 140 1HD2 LEU 18 1HD2 LEU 18 -5.664 -0.140 -7.220 141 2HD2 LEU 18 2HD2 LEU 18 -4.994 -1.683 -6.695 142 3HD2 LEU 18 3HD2 LEU 18 -6.590 -1.623 -7.444 143 H VAL 19 H VAL 19 -5.146 2.567 -9.064 144 HA VAL 19 HA VAL 19 -4.591 3.281 -6.274 145 HB VAL 19 HB VAL 19 -5.891 4.932 -8.448 146 1HG1 VAL 19 1HG1 VAL 19 -6.756 5.537 -6.253 147 2HG1 VAL 19 2HG1 VAL 19 -5.695 6.804 -6.870 148 3HG1 VAL 19 3HG1 VAL 19 -5.111 5.691 -5.633 149 1HG2 VAL 19 1HG2 VAL 19 -3.506 4.588 -8.833 150 2HG2 VAL 19 2HG2 VAL 19 -3.155 5.128 -7.191 151 3HG2 VAL 19 3HG2 VAL 19 -3.829 6.257 -8.365 152 H THR 20 H THR 20 -6.068 3.065 -4.761 153 HA THR 20 HA THR 20 -8.818 2.380 -5.576 154 HB THR 20 HB THR 20 -7.399 1.225 -3.169 155 HG1 THR 20 HG1 THR 20 -7.051 0.631 -5.790 156 1HG2 THR 20 1HG2 THR 20 -9.844 1.149 -3.112 157 2HG2 THR 20 2HG2 THR 20 -9.169 -0.470 -3.300 158 3HG2 THR 20 3HG2 THR 20 -9.864 0.364 -4.691 159 H LYS 21 H LYS 21 -10.012 4.127 -5.007 160 HA LYS 21 HA LYS 21 -9.385 5.555 -2.540 161 1HB LYS 21 1HB LYS 21 -11.487 6.062 -4.651 162 2HB LYS 21 2HB LYS 21 -11.213 7.086 -3.248 163 1HG LYS 21 1HG LYS 21 -8.854 7.386 -4.068 164 2HG LYS 21 2HG LYS 21 -9.355 6.582 -5.555 165 1HD LYS 21 1HD LYS 21 -9.466 8.982 -5.846 166 2HD LYS 21 2HD LYS 21 -11.095 8.300 -5.866 167 1HE LYS 21 1HE LYS 21 -11.412 8.960 -3.538 168 2HE LYS 21 2HE LYS 21 -9.771 9.605 -3.487 169 1HZ LYS 21 1HZ LYS 21 -11.466 11.332 -3.827 170 2HZ LYS 21 2HZ LYS 21 -11.924 10.594 -5.286 171 3HZ LYS 21 3HZ LYS 21 -10.368 11.253 -5.123 172 H GLU 22 H GLU 22 -10.592 2.778 -2.877 173 HA GLU 22 HA GLU 22 -13.100 2.937 -1.450 174 1HB GLU 22 1HB GLU 22 -12.601 1.160 -3.147 175 2HB GLU 22 2HB GLU 22 -11.342 0.561 -2.080 176 1HG GLU 22 1HG GLU 22 -13.122 -0.864 -1.714 177 2HG GLU 22 2HG GLU 22 -13.169 0.250 -0.350 178 H TYR 23 H TYR 23 -13.359 1.901 0.640 179 HA TYR 23 HA TYR 23 -10.908 1.898 2.267 180 1HB TYR 23 1HB TYR 23 -13.640 2.973 2.901 181 2HB TYR 23 2HB TYR 23 -12.586 2.413 4.196 182 HD1 TYR 23 HD1 TYR 23 -12.573 4.711 1.250 183 HD2 TYR 23 HD2 TYR 23 -11.089 3.887 5.149 184 HE1 TYR 23 HE1 TYR 23 -11.421 6.885 1.267 185 HE2 TYR 23 HE2 TYR 23 -9.936 6.053 5.178 186 HH TYR 23 HH TYR 23 -10.419 8.431 2.647 187 H ILE 24 H ILE 24 -10.674 -0.313 1.811 188 HA ILE 24 HA ILE 24 -12.745 -2.091 2.918 189 HB ILE 24 HB ILE 24 -11.569 -3.884 1.599 190 1HG1 ILE 24 1HG1 ILE 24 -10.249 -1.505 0.268 191 2HG1 ILE 24 2HG1 ILE 24 -9.432 -2.676 1.297 192 1HG2 ILE 24 1HG2 ILE 24 -13.661 -2.950 0.841 193 2HG2 ILE 24 2HG2 ILE 24 -12.602 -3.235 -0.542 194 3HG2 ILE 24 3HG2 ILE 24 -12.816 -1.600 0.084 195 1HD1 ILE 24 1HD1 ILE 24 -9.016 -3.123 -1.050 196 2HD1 ILE 24 2HD1 ILE 24 -10.749 -3.255 -1.348 197 3HD1 ILE 24 3HD1 ILE 24 -9.938 -4.438 -0.320 198 H SER 25 H SER 25 -11.947 -4.122 3.758 199 HA SER 25 HA SER 25 -9.815 -3.667 5.665 200 1HB SER 25 1HB SER 25 -11.210 -6.270 5.579 201 2HB SER 25 2HB SER 25 -10.914 -5.183 6.934 202 HG SER 25 HG SER 25 -13.089 -5.332 5.244 203 H PHE 26 H PHE 26 -7.793 -4.382 5.294 204 HA PHE 26 HA PHE 26 -7.018 -5.511 2.876 205 1HB PHE 26 1HB PHE 26 -5.540 -4.284 4.531 206 2HB PHE 26 2HB PHE 26 -5.456 -5.784 5.446 207 HD1 PHE 26 HD1 PHE 26 -4.436 -4.064 2.389 208 HD2 PHE 26 HD2 PHE 26 -4.204 -7.682 4.616 209 HE1 PHE 26 HE1 PHE 26 -2.576 -4.819 0.962 210 HE2 PHE 26 HE2 PHE 26 -2.345 -8.442 3.196 211 HZ PHE 26 HZ PHE 26 -1.531 -7.011 1.363 212 H LEU 27 H LEU 27 -6.634 -7.187 5.985 213 HA LEU 27 HA LEU 27 -6.899 -9.338 6.636 214 1HB LEU 27 1HB LEU 27 -8.923 -9.441 4.398 215 2HB LEU 27 2HB LEU 27 -8.776 -10.608 5.696 216 HG LEU 27 HG LEU 27 -9.506 -7.703 6.061 217 1HD1 LEU 27 1HD1 LEU 27 -11.744 -8.547 6.571 218 2HD1 LEU 27 2HD1 LEU 27 -11.225 -10.178 6.146 219 3HD1 LEU 27 3HD1 LEU 27 -11.271 -8.916 4.915 220 1HD2 LEU 27 1HD2 LEU 27 -8.364 -8.604 7.990 221 2HD2 LEU 27 2HD2 LEU 27 -9.431 -10.007 7.998 222 3HD2 LEU 27 3HD2 LEU 27 -10.080 -8.404 8.344 223 H GLY 28 H GLY 28 -7.672 -10.064 3.287 224 1HA GLY 28 1HA GLY 28 -5.246 -10.845 2.265 225 2HA GLY 28 2HA GLY 28 -5.811 -12.224 3.206 226 H GLY 29 H GLY 29 -7.641 -9.868 1.307 227 1HA GLY 29 1HA GLY 29 -9.321 -11.944 0.274 228 2HA GLY 29 2HA GLY 29 -9.435 -10.231 -0.088 229 H ILE 30 H ILE 30 -6.354 -10.743 -0.769 230 HA ILE 30 HA ILE 30 -6.831 -11.115 -3.590 231 HB ILE 30 HB ILE 30 -4.196 -10.878 -2.109 232 1HG1 ILE 30 1HG1 ILE 30 -4.225 -8.601 -3.341 233 2HG1 ILE 30 2HG1 ILE 30 -5.956 -8.865 -3.489 234 1HG2 ILE 30 1HG2 ILE 30 -3.967 -12.070 -4.218 235 2HG2 ILE 30 2HG2 ILE 30 -3.203 -10.484 -4.295 236 3HG2 ILE 30 3HG2 ILE 30 -4.769 -10.746 -5.062 237 1HD1 ILE 30 1HD1 ILE 30 -4.397 -8.689 -0.921 238 2HD1 ILE 30 2HD1 ILE 30 -6.132 -8.979 -1.051 239 3HD1 ILE 30 3HD1 ILE 30 -5.451 -7.448 -1.598 240 H ASP 31 H ASP 31 -6.994 -13.047 -4.504 241 HA ASP 31 HA ASP 31 -6.420 -15.453 -3.118 242 1HB ASP 31 1HB ASP 31 -8.146 -15.421 -4.817 243 2HB ASP 31 2HB ASP 31 -6.976 -14.945 -6.045 244 H LYS 32 H LYS 32 -4.615 -16.642 -3.026 245 HA LYS 32 HA LYS 32 -2.192 -15.369 -3.849 246 1HB LYS 32 1HB LYS 32 -1.093 -17.364 -2.771 247 2HB LYS 32 2HB LYS 32 -2.139 -16.416 -1.725 248 1HG LYS 32 1HG LYS 32 -3.418 -18.701 -3.077 249 2HG LYS 32 2HG LYS 32 -2.194 -19.100 -1.872 250 1HD LYS 32 1HD LYS 32 -4.453 -17.188 -1.333 251 2HD LYS 32 2HD LYS 32 -4.579 -18.920 -1.028 252 1HE LYS 32 1HE LYS 32 -2.765 -18.814 0.550 253 2HE LYS 32 2HE LYS 32 -2.459 -17.125 0.146 254 1HZ LYS 32 1HZ LYS 32 -4.546 -16.501 1.097 255 2HZ LYS 32 2HZ LYS 32 -3.718 -17.451 2.234 256 3HZ LYS 32 3HZ LYS 32 -4.993 -18.119 1.343 257 H GLU 33 H GLU 33 -4.243 -17.481 -5.443 258 HA GLU 33 HA GLU 33 -2.073 -18.805 -6.886 259 1HB GLU 33 1HB GLU 33 -5.057 -19.282 -6.967 260 2HB GLU 33 2HB GLU 33 -3.845 -20.239 -7.812 261 1HG GLU 33 1HG GLU 33 -2.876 -20.923 -5.693 262 2HG GLU 33 2HG GLU 33 -4.040 -19.925 -4.824 263 H THR 34 H THR 34 -4.755 -16.586 -7.377 264 HA THR 34 HA THR 34 -3.994 -16.298 -10.202 265 HB THR 34 HB THR 34 -6.190 -15.040 -10.372 266 HG1 THR 34 HG1 THR 34 -6.606 -16.226 -7.800 267 1HG2 THR 34 1HG2 THR 34 -5.945 -17.364 -11.115 268 2HG2 THR 34 2HG2 THR 34 -7.540 -17.083 -10.417 269 3HG2 THR 34 3HG2 THR 34 -6.306 -17.925 -9.482 270 H GLY 35 H GLY 35 -4.361 -14.485 -7.201 271 1HA GLY 35 1HA GLY 35 -3.327 -12.459 -6.665 272 2HA GLY 35 2HA GLY 35 -2.894 -12.249 -8.355 273 H ILE 36 H ILE 36 -6.114 -13.157 -7.827 274 HA ILE 36 HA ILE 36 -7.036 -10.479 -8.554 275 HB ILE 36 HB ILE 36 -8.552 -13.097 -8.449 276 1HG1 ILE 36 1HG1 ILE 36 -6.798 -13.098 -10.174 277 2HG1 ILE 36 2HG1 ILE 36 -8.403 -13.084 -10.894 278 1HG2 ILE 36 1HG2 ILE 36 -10.279 -11.931 -9.723 279 2HG2 ILE 36 2HG2 ILE 36 -9.350 -10.434 -9.618 280 3HG2 ILE 36 3HG2 ILE 36 -10.011 -11.169 -8.155 281 1HD1 ILE 36 1HD1 ILE 36 -8.182 -10.680 -11.310 282 2HD1 ILE 36 2HD1 ILE 36 -6.901 -11.609 -12.088 283 3HD1 ILE 36 3HD1 ILE 36 -6.565 -10.718 -10.606 284 H VAL 37 H VAL 37 -8.293 -9.242 -7.223 285 HA VAL 37 HA VAL 37 -8.498 -9.932 -4.463 286 HB VAL 37 HB VAL 37 -9.874 -7.830 -4.288 287 1HG1 VAL 37 1HG1 VAL 37 -7.467 -7.815 -3.925 288 2HG1 VAL 37 2HG1 VAL 37 -7.980 -6.332 -4.731 289 3HG1 VAL 37 3HG1 VAL 37 -7.190 -7.608 -5.656 290 1HG2 VAL 37 1HG2 VAL 37 -9.919 -6.321 -6.226 291 2HG2 VAL 37 2HG2 VAL 37 -10.822 -7.802 -6.537 292 3HG2 VAL 37 3HG2 VAL 37 -9.213 -7.589 -7.228 293 H LYS 38 H LYS 38 -9.904 -11.266 -3.625 294 HA LYS 38 HA LYS 38 -12.326 -11.968 -5.064 295 1HB LYS 38 1HB LYS 38 -11.099 -13.062 -2.529 296 2HB LYS 38 2HB LYS 38 -12.553 -13.699 -3.285 297 1HG LYS 38 1HG LYS 38 -9.866 -13.575 -4.637 298 2HG LYS 38 2HG LYS 38 -10.486 -14.987 -3.780 299 1HD LYS 38 1HD LYS 38 -11.888 -13.665 -6.102 300 2HD LYS 38 2HD LYS 38 -10.813 -15.056 -6.256 301 1HE LYS 38 1HE LYS 38 -12.272 -16.350 -4.787 302 2HE LYS 38 2HE LYS 38 -13.336 -14.957 -4.604 303 1HZ LYS 38 1HZ LYS 38 -14.081 -16.641 -6.267 304 2HZ LYS 38 2HZ LYS 38 -12.739 -16.223 -7.219 305 3HZ LYS 38 3HZ LYS 38 -13.933 -15.065 -6.880 306 H GLU 39 H GLU 39 -11.477 -9.722 -2.727 307 HA GLU 39 HA GLU 39 -14.036 -9.840 -1.351 308 1HB GLU 39 1HB GLU 39 -11.894 -9.390 -0.111 309 2HB GLU 39 2HB GLU 39 -11.806 -7.843 -0.946 310 1HG GLU 39 1HG GLU 39 -12.751 -7.759 1.371 311 2HG GLU 39 2HG GLU 39 -13.770 -7.055 0.117 312 H ASP 40 H ASP 40 -15.441 -8.002 -1.246 313 HA ASP 40 HA ASP 40 -15.915 -7.082 -3.925 314 1HB ASP 40 1HB ASP 40 -17.661 -7.897 -2.254 315 2HB ASP 40 2HB ASP 40 -17.491 -6.331 -1.469 316 H CYS 41 H CYS 41 -15.687 -5.122 -4.754 317 HA CYS 41 HA CYS 41 -15.453 -2.719 -3.268 318 1HB CYS 41 1HB CYS 41 -13.081 -2.226 -4.030 319 2HB CYS 41 2HB CYS 41 -13.220 -3.422 -2.746 320 HG CYS 41 HG CYS 41 -12.641 -5.600 -4.259 321 H GLU 42 H GLU 42 -14.702 -0.903 -4.913 322 HA GLU 42 HA GLU 42 -16.475 -1.043 -7.087 323 1HB GLU 42 1HB GLU 42 -15.580 1.079 -7.814 324 2HB GLU 42 2HB GLU 42 -15.745 1.084 -6.066 325 1HG GLU 42 1HG GLU 42 -13.467 1.061 -5.715 326 2HG GLU 42 2HG GLU 42 -13.123 0.374 -7.304 327 H ILE 43 H ILE 43 -13.024 -1.679 -6.879 328 HA ILE 43 HA ILE 43 -12.984 -2.331 -9.745 329 HB ILE 43 HB ILE 43 -10.481 -2.371 -9.441 330 1HG1 ILE 43 1HG1 ILE 43 -11.198 -1.085 -6.793 331 2HG1 ILE 43 2HG1 ILE 43 -10.435 -2.657 -7.002 332 1HG2 ILE 43 1HG2 ILE 43 -11.932 0.216 -8.889 333 2HG2 ILE 43 2HG2 ILE 43 -11.623 -0.495 -10.474 334 3HG2 ILE 43 3HG2 ILE 43 -10.278 0.080 -9.486 335 1HD1 ILE 43 1HD1 ILE 43 -8.824 -0.956 -6.358 336 2HD1 ILE 43 2HD1 ILE 43 -9.241 -0.012 -7.787 337 3HD1 ILE 43 3HD1 ILE 43 -8.475 -1.590 -7.966 338 H LYS 44 H LYS 44 -14.305 -4.035 -8.125 339 HA LYS 44 HA LYS 44 -12.793 -6.178 -7.081 340 1HB LYS 44 1HB LYS 44 -15.054 -5.687 -6.399 341 2HB LYS 44 2HB LYS 44 -15.652 -5.975 -8.018 342 1HG LYS 44 1HG LYS 44 -15.042 -8.346 -7.785 343 2HG LYS 44 2HG LYS 44 -14.520 -8.022 -6.123 344 1HD LYS 44 1HD LYS 44 -16.778 -7.161 -5.618 345 2HD LYS 44 2HD LYS 44 -17.279 -7.577 -7.254 346 1HE LYS 44 1HE LYS 44 -16.804 -9.935 -6.786 347 2HE LYS 44 2HE LYS 44 -16.340 -9.508 -5.139 348 1HZ LYS 44 1HZ LYS 44 -18.590 -10.256 -5.109 349 2HZ LYS 44 2HZ LYS 44 -19.023 -9.216 -6.375 350 3HZ LYS 44 3HZ LYS 44 -18.614 -8.574 -4.862 351 H GLY 45 H GLY 45 -11.729 -7.688 -8.118 352 1HA GLY 45 1HA GLY 45 -11.741 -9.493 -9.739 353 2HA GLY 45 2HA GLY 45 -12.584 -8.417 -10.843 354 H GLU 46 H GLU 46 -10.355 -6.484 -9.464 355 HA GLU 46 HA GLU 46 -8.582 -6.664 -11.721 356 1HB GLU 46 1HB GLU 46 -8.729 -4.864 -9.319 357 2HB GLU 46 2HB GLU 46 -7.343 -4.821 -10.401 358 1HG GLU 46 1HG GLU 46 -10.198 -4.388 -11.252 359 2HG GLU 46 2HG GLU 46 -9.039 -3.104 -10.902 360 H SER 47 H SER 47 -6.280 -6.907 -11.571 361 HA SER 47 HA SER 47 -5.522 -8.828 -9.481 362 1HB SER 47 1HB SER 47 -3.683 -9.457 -11.053 363 2HB SER 47 2HB SER 47 -5.292 -9.715 -11.724 364 HG SER 47 HG SER 47 -4.697 -7.293 -12.434 365 H VAL 48 H VAL 48 -3.848 -8.439 -8.121 366 HA VAL 48 HA VAL 48 -2.720 -5.735 -8.206 367 HB VAL 48 HB VAL 48 -2.078 -6.081 -5.883 368 1HG1 VAL 48 1HG1 VAL 48 -4.305 -5.239 -6.291 369 2HG1 VAL 48 2HG1 VAL 48 -4.323 -6.310 -4.891 370 3HG1 VAL 48 3HG1 VAL 48 -4.931 -6.880 -6.445 371 1HG2 VAL 48 1HG2 VAL 48 -1.542 -8.454 -5.976 372 2HG2 VAL 48 2HG2 VAL 48 -3.248 -8.845 -6.199 373 3HG2 VAL 48 3HG2 VAL 48 -2.698 -8.128 -4.683 374 H ALA 49 H ALA 49 -1.897 -8.647 -9.336 375 HA ALA 49 HA ALA 49 0.715 -9.087 -8.413 376 1HB ALA 49 1HB ALA 49 -0.598 -10.879 -9.402 377 2HB ALA 49 2HB ALA 49 0.905 -10.650 -10.294 378 3HB ALA 49 3HB ALA 49 -0.611 -10.037 -10.952 379 H GLY 50 H GLY 50 1.874 -7.254 -8.538 380 1HA GLY 50 1HA GLY 50 3.735 -6.339 -9.673 381 2HA GLY 50 2HA GLY 50 2.976 -6.742 -11.205 382 H ARG 51 H ARG 51 0.947 -5.281 -8.878 383 HA ARG 51 HA ARG 51 1.107 -2.746 -10.372 384 1HB ARG 51 1HB ARG 51 -1.208 -3.735 -8.702 385 2HB ARG 51 2HB ARG 51 -1.201 -2.368 -9.810 386 1HG ARG 51 1HG ARG 51 -0.916 -5.267 -10.571 387 2HG ARG 51 2HG ARG 51 -2.355 -4.270 -10.778 388 1HD ARG 51 1HD ARG 51 -1.516 -3.196 -12.581 389 2HD ARG 51 2HD ARG 51 0.132 -3.211 -11.952 390 HE ARG 51 HE ARG 51 -0.032 -5.720 -12.547 391 1HH1 ARG 51 1HH1 ARG 51 -1.493 -3.102 -14.376 392 2HH1 ARG 51 2HH1 ARG 51 -1.350 -3.938 -15.890 393 1HH2 ARG 51 1HH2 ARG 51 0.157 -6.789 -14.560 394 2HH2 ARG 51 2HH2 ARG 51 -0.410 -6.004 -15.999 395 H ILE 52 H ILE 52 1.037 -0.783 -9.209 396 HA ILE 52 HA ILE 52 1.989 -1.036 -6.449 397 HB ILE 52 HB ILE 52 1.959 1.359 -8.294 398 1HG1 ILE 52 1HG1 ILE 52 4.222 -0.383 -7.293 399 2HG1 ILE 52 2HG1 ILE 52 3.579 -0.368 -8.928 400 1HG2 ILE 52 1HG2 ILE 52 3.318 2.468 -6.569 401 2HG2 ILE 52 2HG2 ILE 52 3.084 1.078 -5.510 402 3HG2 ILE 52 3HG2 ILE 52 1.702 2.067 -5.982 403 1HD1 ILE 52 1HD1 ILE 52 4.338 1.912 -9.226 404 2HD1 ILE 52 2HD1 ILE 52 5.672 0.857 -8.756 405 3HD1 ILE 52 3HD1 ILE 52 4.941 1.938 -7.571 406 H LEU 53 H LEU 53 0.395 -1.114 -5.011 407 HA LEU 53 HA LEU 53 -2.186 0.007 -5.633 408 1HB LEU 53 1HB LEU 53 -1.109 -1.747 -3.483 409 2HB LEU 53 2HB LEU 53 -2.592 -0.866 -3.172 410 HG LEU 53 HG LEU 53 -3.643 -1.938 -5.117 411 1HD1 LEU 53 1HD1 LEU 53 -1.668 -2.294 -6.490 412 2HD1 LEU 53 2HD1 LEU 53 -2.540 -3.807 -6.239 413 3HD1 LEU 53 3HD1 LEU 53 -1.063 -3.479 -5.332 414 1HD2 LEU 53 1HD2 LEU 53 -3.826 -4.172 -4.166 415 2HD2 LEU 53 2HD2 LEU 53 -3.853 -2.943 -2.904 416 3HD2 LEU 53 3HD2 LEU 53 -2.390 -3.883 -3.187 417 H VAL 54 H VAL 54 -2.662 2.011 -5.291 418 HA VAL 54 HA VAL 54 -1.542 3.357 -2.920 419 HB VAL 54 HB VAL 54 -2.595 4.636 -5.455 420 1HG1 VAL 54 1HG1 VAL 54 -2.932 6.005 -3.451 421 2HG1 VAL 54 2HG1 VAL 54 -1.739 6.719 -4.537 422 3HG1 VAL 54 3HG1 VAL 54 -1.213 5.876 -3.080 423 1HG2 VAL 54 1HG2 VAL 54 -0.478 3.488 -5.845 424 2HG2 VAL 54 2HG2 VAL 54 0.245 4.339 -4.480 425 3HG2 VAL 54 3HG2 VAL 54 -0.270 5.239 -5.908 426 H PHE 55 H PHE 55 -3.020 3.167 -1.364 427 HA PHE 55 HA PHE 55 -5.690 4.196 -1.939 428 1HB PHE 55 1HB PHE 55 -6.695 2.497 -0.417 429 2HB PHE 55 2HB PHE 55 -6.028 1.816 -1.892 430 HD1 PHE 55 HD1 PHE 55 -5.809 1.946 1.729 431 HD2 PHE 55 HD2 PHE 55 -3.999 0.450 -1.821 432 HE1 PHE 55 HE1 PHE 55 -4.543 0.312 3.068 433 HE2 PHE 55 HE2 PHE 55 -2.727 -1.182 -0.490 434 HZ PHE 55 HZ PHE 55 -3.000 -1.255 1.957 435 HA PRO 56 HA PRO 56 -4.978 6.774 1.549 436 1HB PRO 56 1HB PRO 56 -7.537 7.024 2.506 437 2HB PRO 56 2HB PRO 56 -6.910 7.904 1.108 438 1HG PRO 56 1HG PRO 56 -8.587 5.432 1.193 439 2HG PRO 56 2HG PRO 56 -8.700 6.828 0.106 440 1HD PRO 56 1HD PRO 56 -7.564 4.506 -0.653 441 2HD PRO 56 2HD PRO 56 -6.981 6.077 -1.240 442 H GLY 57 H GLY 57 -7.123 3.994 2.126 443 1HA GLY 57 1HA GLY 57 -5.687 2.786 4.125 444 2HA GLY 57 2HA GLY 57 -6.682 3.975 4.953 445 H GLY 58 H GLY 58 -7.914 2.430 6.027 446 1HA GLY 58 1HA GLY 58 -10.289 1.627 4.889 447 2HA GLY 58 2HA GLY 58 -9.190 0.276 4.659 448 H LYS 59 H LYS 59 -10.041 -1.190 6.054 449 HA LYS 59 HA LYS 59 -10.633 -0.372 8.791 450 1HB LYS 59 1HB LYS 59 -11.154 -2.899 7.246 451 2HB LYS 59 2HB LYS 59 -11.302 -2.862 8.995 452 1HG LYS 59 1HG LYS 59 -13.462 -2.480 8.366 453 2HG LYS 59 2HG LYS 59 -12.870 -0.829 8.530 454 1HD LYS 59 1HD LYS 59 -12.637 -0.597 6.170 455 2HD LYS 59 2HD LYS 59 -12.917 -2.322 5.912 456 1HE LYS 59 1HE LYS 59 -15.198 -2.044 6.839 457 2HE LYS 59 2HE LYS 59 -14.902 -0.312 6.963 458 1HZ LYS 59 1HZ LYS 59 -16.148 -0.917 4.960 459 2HZ LYS 59 2HZ LYS 59 -14.847 -1.863 4.428 460 3HZ LYS 59 3HZ LYS 59 -14.664 -0.188 4.584 461 H GLY 60 H GLY 60 -9.524 -1.026 10.572 462 1HA GLY 60 1HA GLY 60 -6.892 -2.221 10.074 463 2HA GLY 60 2HA GLY 60 -7.347 -1.278 11.488 464 H SER 61 H SER 61 -7.530 -4.373 9.932 465 HA SER 61 HA SER 61 -8.788 -5.564 12.277 466 1HB SER 61 1HB SER 61 -9.484 -6.083 9.854 467 2HB SER 61 2HB SER 61 -7.999 -7.027 9.762 468 HG SER 61 HG SER 61 -10.227 -7.408 11.475 469 H THR 62 H THR 62 -7.868 -7.420 13.299 470 HA THR 62 HA THR 62 -5.020 -7.109 13.690 471 HB THR 62 HB THR 62 -6.472 -7.239 15.647 472 HG1 THR 62 HG1 THR 62 -4.758 -9.492 15.328 473 1HG2 THR 62 1HG2 THR 62 -8.254 -8.632 14.747 474 2HG2 THR 62 2HG2 THR 62 -7.634 -9.324 16.246 475 3HG2 THR 62 3HG2 THR 62 -7.168 -10.021 14.694 476 H VAL 63 H VAL 63 -5.336 -8.011 11.237 477 HA VAL 63 HA VAL 63 -5.701 -10.641 10.582 478 HB VAL 63 HB VAL 63 -3.580 -8.855 9.397 479 1HG1 VAL 63 1HG1 VAL 63 -3.923 -10.179 7.365 480 2HG1 VAL 63 2HG1 VAL 63 -5.049 -11.219 8.236 481 3HG1 VAL 63 3HG1 VAL 63 -3.350 -11.173 8.706 482 1HG2 VAL 63 1HG2 VAL 63 -6.499 -9.136 8.692 483 2HG2 VAL 63 2HG2 VAL 63 -5.312 -8.197 7.787 484 3HG2 VAL 63 3HG2 VAL 63 -5.734 -7.732 9.436 485 H GLY 64 H GLY 64 -2.632 -9.203 11.648 486 1HA GLY 64 1HA GLY 64 -0.986 -10.355 12.891 487 2HA GLY 64 2HA GLY 64 -1.724 -11.877 12.407 488 H SER 65 H SER 65 -1.390 -9.694 9.857 489 HA SER 65 HA SER 65 -0.006 -9.436 8.094 490 1HB SER 65 1HB SER 65 2.401 -9.387 8.479 491 2HB SER 65 2HB SER 65 1.559 -8.604 9.809 492 HG SER 65 HG SER 65 1.760 -11.052 10.585 493 H TYR 66 H TYR 66 2.478 -10.978 7.607 494 HA TYR 66 HA TYR 66 3.226 -12.897 6.659 495 1HB TYR 66 1HB TYR 66 0.783 -14.067 7.965 496 2HB TYR 66 2HB TYR 66 1.802 -15.022 6.896 497 HD1 TYR 66 HD1 TYR 66 1.337 -13.811 10.221 498 HD2 TYR 66 HD2 TYR 66 4.271 -15.242 7.498 499 HE1 TYR 66 HE1 TYR 66 2.818 -14.335 12.107 500 HE2 TYR 66 HE2 TYR 66 5.767 -15.773 9.376 501 HH TYR 66 HH TYR 66 4.771 -16.010 12.502 502 H VAL 67 H VAL 67 -0.206 -12.260 6.109 503 HA VAL 67 HA VAL 67 -0.624 -13.758 3.843 504 HB VAL 67 HB VAL 67 -2.403 -12.104 3.240 505 1HG1 VAL 67 1HG1 VAL 67 -2.812 -13.983 4.762 506 2HG1 VAL 67 2HG1 VAL 67 -3.772 -12.572 5.203 507 3HG1 VAL 67 3HG1 VAL 67 -2.328 -12.979 6.129 508 1HG2 VAL 67 1HG2 VAL 67 -2.873 -10.288 4.824 509 2HG2 VAL 67 2HG2 VAL 67 -1.312 -10.071 4.031 510 3HG2 VAL 67 3HG2 VAL 67 -1.383 -10.664 5.692 511 H LEU 68 H LEU 68 0.904 -10.576 4.019 512 HA LEU 68 HA LEU 68 0.833 -10.076 1.227 513 1HB LEU 68 1HB LEU 68 2.672 -8.954 3.339 514 2HB LEU 68 2HB LEU 68 2.555 -8.354 1.697 515 HG LEU 68 HG LEU 68 -0.013 -8.106 2.390 516 1HD1 LEU 68 1HD1 LEU 68 0.269 -9.006 4.628 517 2HD1 LEU 68 2HD1 LEU 68 -0.193 -7.305 4.691 518 3HD1 LEU 68 3HD1 LEU 68 1.481 -7.775 4.986 519 1HD2 LEU 68 1HD2 LEU 68 2.163 -6.153 3.118 520 2HD2 LEU 68 2HD2 LEU 68 0.458 -5.766 2.885 521 3HD2 LEU 68 3HD2 LEU 68 1.424 -6.341 1.527 522 H LEU 69 H LEU 69 3.095 -11.710 3.337 523 HA LEU 69 HA LEU 69 5.239 -11.851 1.465 524 1HB LEU 69 1HB LEU 69 5.612 -12.050 3.869 525 2HB LEU 69 2HB LEU 69 4.631 -13.501 3.924 526 HG LEU 69 HG LEU 69 6.297 -14.657 2.506 527 1HD1 LEU 69 1HD1 LEU 69 7.224 -12.729 1.344 528 2HD1 LEU 69 2HD1 LEU 69 8.494 -13.636 2.163 529 3HD1 LEU 69 3HD1 LEU 69 7.902 -12.127 2.857 530 1HD2 LEU 69 1HD2 LEU 69 8.006 -14.872 4.240 531 2HD2 LEU 69 2HD2 LEU 69 6.384 -14.850 4.932 532 3HD2 LEU 69 3HD2 LEU 69 7.399 -13.411 5.020 533 H ASN 70 H ASN 70 2.596 -13.964 2.405 534 HA ASN 70 HA ASN 70 3.224 -16.241 0.939 535 1HB ASN 70 1HB ASN 70 1.443 -16.372 2.499 536 2HB ASN 70 2HB ASN 70 0.597 -15.019 1.763 537 1HD2 ASN 70 1HD2 ASN 70 1.331 -18.412 1.519 538 2HD2 ASN 70 2HD2 ASN 70 0.128 -18.789 0.342 539 H LEU 71 H LEU 71 1.535 -13.299 -0.043 540 HA LEU 71 HA LEU 71 0.755 -14.138 -2.605 541 1HB LEU 71 1HB LEU 71 1.431 -11.345 -1.678 542 2HB LEU 71 2HB LEU 71 0.522 -11.755 -3.119 543 HG LEU 71 HG LEU 71 -0.352 -12.230 -0.269 544 1HD1 LEU 71 1HD1 LEU 71 -0.466 -9.896 -0.917 545 2HD1 LEU 71 2HD1 LEU 71 -2.088 -10.580 -0.804 546 3HD1 LEU 71 3HD1 LEU 71 -1.346 -10.328 -2.384 547 1HD2 LEU 71 1HD2 LEU 71 -1.799 -12.811 -2.856 548 2HD2 LEU 71 2HD2 LEU 71 -2.470 -12.982 -1.234 549 3HD2 LEU 71 3HD2 LEU 71 -1.138 -14.017 -1.751 550 H ARG 72 H ARG 72 3.743 -12.614 -1.449 551 HA ARG 72 HA ARG 72 4.701 -12.096 -4.096 552 1HB ARG 72 1HB ARG 72 5.359 -10.953 -1.809 553 2HB ARG 72 2HB ARG 72 6.575 -12.227 -1.773 554 1HG ARG 72 1HG ARG 72 7.232 -11.484 -4.100 555 2HG ARG 72 2HG ARG 72 6.217 -10.069 -3.833 556 1HD ARG 72 1HD ARG 72 8.360 -9.358 -3.250 557 2HD ARG 72 2HD ARG 72 7.585 -9.716 -1.708 558 HE ARG 72 HE ARG 72 8.837 -12.043 -2.327 559 1HH1 ARG 72 1HH1 ARG 72 9.872 -8.721 -2.137 560 2HH1 ARG 72 2HH1 ARG 72 11.512 -9.101 -1.703 561 1HH2 ARG 72 1HH2 ARG 72 10.987 -12.580 -1.730 562 2HH2 ARG 72 2HH2 ARG 72 12.146 -11.311 -1.474 563 H LYS 73 H LYS 73 4.863 -14.790 -1.932 564 HA LYS 73 HA LYS 73 7.186 -15.956 -3.118 565 1HB LYS 73 1HB LYS 73 5.066 -17.069 -1.292 566 2HB LYS 73 2HB LYS 73 6.397 -18.044 -1.904 567 1HG LYS 73 1HG LYS 73 7.921 -16.220 -0.943 568 2HG LYS 73 2HG LYS 73 6.493 -15.694 -0.049 569 1HD LYS 73 1HD LYS 73 6.309 -17.823 1.032 570 2HD LYS 73 2HD LYS 73 7.582 -18.505 0.018 571 1HE LYS 73 1HE LYS 73 9.123 -16.762 0.987 572 2HE LYS 73 2HE LYS 73 7.847 -16.391 2.145 573 1HZ LYS 73 1HZ LYS 73 7.940 -18.649 2.953 574 2HZ LYS 73 2HZ LYS 73 9.488 -17.954 3.024 575 3HZ LYS 73 3HZ LYS 73 9.112 -19.056 1.793 576 H ASN 74 H ASN 74 3.783 -16.016 -3.844 577 HA ASN 74 HA ASN 74 4.206 -18.157 -5.783 578 1HB ASN 74 1HB ASN 74 2.104 -18.048 -4.390 579 2HB ASN 74 2HB ASN 74 1.656 -16.608 -5.303 580 1HD2 ASN 74 1HD2 ASN 74 1.018 -16.810 -7.425 581 2HD2 ASN 74 2HD2 ASN 74 0.646 -18.331 -8.148 582 H GLY 75 H GLY 75 3.877 -14.705 -5.603 583 1HA GLY 75 1HA GLY 75 4.981 -13.403 -7.313 584 2HA GLY 75 2HA GLY 75 4.480 -14.612 -8.485 585 H VAL 76 H VAL 76 2.220 -13.569 -6.086 586 HA VAL 76 HA VAL 76 0.755 -12.110 -8.189 587 HB VAL 76 HB VAL 76 -1.321 -12.737 -7.010 588 1HG1 VAL 76 1HG1 VAL 76 0.444 -15.062 -7.767 589 2HG1 VAL 76 2HG1 VAL 76 -0.556 -14.106 -8.861 590 3HG1 VAL 76 3HG1 VAL 76 -1.315 -15.119 -7.633 591 1HG2 VAL 76 1HG2 VAL 76 0.501 -14.407 -5.278 592 2HG2 VAL 76 2HG2 VAL 76 -1.261 -14.474 -5.276 593 3HG2 VAL 76 3HG2 VAL 76 -0.435 -13.004 -4.759 594 H ALA 77 H ALA 77 2.728 -11.168 -6.127 595 HA ALA 77 HA ALA 77 1.085 -9.561 -4.335 596 1HB ALA 77 1HB ALA 77 3.048 -10.744 -3.446 597 2HB ALA 77 2HB ALA 77 3.168 -8.998 -3.231 598 3HB ALA 77 3HB ALA 77 4.086 -9.794 -4.510 599 HA PRO 78 HA PRO 78 1.528 -5.768 -6.620 600 1HB PRO 78 1HB PRO 78 1.827 -4.344 -4.067 601 2HB PRO 78 2HB PRO 78 0.524 -4.249 -5.255 602 1HG PRO 78 1HG PRO 78 0.179 -5.408 -2.851 603 2HG PRO 78 2HG PRO 78 -0.645 -5.993 -4.308 604 1HD PRO 78 1HD PRO 78 1.786 -7.084 -2.939 605 2HD PRO 78 2HD PRO 78 0.400 -7.952 -3.636 606 H LYS 79 H LYS 79 3.036 -4.095 -7.106 607 HA LYS 79 HA LYS 79 5.760 -4.759 -6.660 608 1HB LYS 79 1HB LYS 79 4.401 -2.377 -7.903 609 2HB LYS 79 2HB LYS 79 6.145 -2.478 -7.748 610 1HG LYS 79 1HG LYS 79 4.411 -4.430 -9.241 611 2HG LYS 79 2HG LYS 79 5.385 -3.147 -9.966 612 1HD LYS 79 1HD LYS 79 7.413 -4.181 -9.110 613 2HD LYS 79 2HD LYS 79 6.459 -5.430 -8.310 614 1HE LYS 79 1HE LYS 79 5.625 -6.161 -10.509 615 2HE LYS 79 2HE LYS 79 6.652 -4.952 -11.280 616 1HZ LYS 79 1HZ LYS 79 7.616 -7.193 -9.582 617 2HZ LYS 79 2HZ LYS 79 8.592 -6.055 -10.371 618 3HZ LYS 79 3HZ LYS 79 7.672 -7.158 -11.277 619 H ALA 80 H ALA 80 3.643 -2.217 -5.403 620 HA ALA 80 HA ALA 80 5.170 -1.994 -2.995 621 1HB ALA 80 1HB ALA 80 5.819 0.345 -3.248 622 2HB ALA 80 2HB ALA 80 5.188 0.349 -4.894 623 3HB ALA 80 3HB ALA 80 6.579 -0.653 -4.488 624 H ILE 81 H ILE 81 4.219 -0.310 -1.542 625 HA ILE 81 HA ILE 81 1.374 0.175 -2.189 626 HB ILE 81 HB ILE 81 2.461 -0.609 0.524 627 1HG1 ILE 81 1HG1 ILE 81 2.505 -2.509 -1.066 628 2HG1 ILE 81 2HG1 ILE 81 1.334 -2.748 0.227 629 1HG2 ILE 81 1HG2 ILE 81 -0.371 -0.205 -0.427 630 2HG2 ILE 81 2HG2 ILE 81 0.527 0.845 0.666 631 3HG2 ILE 81 3HG2 ILE 81 0.102 -0.792 1.168 632 1HD1 ILE 81 1HD1 ILE 81 0.704 -1.861 -2.577 633 2HD1 ILE 81 2HD1 ILE 81 -0.470 -2.106 -1.283 634 3HD1 ILE 81 3HD1 ILE 81 0.450 -3.473 -1.910 635 H ILE 82 H ILE 82 0.859 2.309 -2.059 636 HA ILE 82 HA ILE 82 2.436 3.985 -0.200 637 HB ILE 82 HB ILE 82 1.021 5.133 -2.601 638 1HG1 ILE 82 1HG1 ILE 82 2.619 3.395 -3.406 639 2HG1 ILE 82 2HG1 ILE 82 3.071 5.023 -3.899 640 1HG2 ILE 82 1HG2 ILE 82 3.417 6.089 -1.018 641 2HG2 ILE 82 2HG2 ILE 82 1.757 6.644 -0.788 642 3HG2 ILE 82 3HG2 ILE 82 2.593 6.968 -2.307 643 1HD1 ILE 82 1HD1 ILE 82 5.008 3.750 -3.205 644 2HD1 ILE 82 2HD1 ILE 82 4.275 3.459 -1.627 645 3HD1 ILE 82 3HD1 ILE 82 4.725 5.097 -2.103 646 H ASN 83 H ASN 83 1.244 4.632 1.496 647 HA ASN 83 HA ASN 83 -1.668 4.909 1.121 648 1HB ASN 83 1HB ASN 83 -0.251 3.691 3.504 649 2HB ASN 83 2HB ASN 83 -1.974 4.025 3.424 650 1HD2 ASN 83 1HD2 ASN 83 -2.127 3.229 0.609 651 2HD2 ASN 83 2HD2 ASN 83 -2.049 1.501 0.613 652 H LYS 84 H LYS 84 -2.724 6.370 2.570 653 HA LYS 84 HA LYS 84 -1.229 8.690 3.272 654 1HB LYS 84 1HB LYS 84 -3.673 8.695 2.716 655 2HB LYS 84 2HB LYS 84 -3.981 7.873 4.240 656 1HG LYS 84 1HG LYS 84 -2.956 9.822 5.413 657 2HG LYS 84 2HG LYS 84 -2.879 10.647 3.855 658 1HD LYS 84 1HD LYS 84 -5.384 9.625 5.190 659 2HD LYS 84 2HD LYS 84 -4.862 11.309 5.133 660 1HE LYS 84 1HE LYS 84 -5.521 9.602 2.734 661 2HE LYS 84 2HE LYS 84 -6.595 10.797 3.457 662 1HZ LYS 84 1HZ LYS 84 -4.894 12.494 2.972 663 2HZ LYS 84 2HZ LYS 84 -5.514 11.756 1.574 664 3HZ LYS 84 3HZ LYS 84 -3.981 11.321 2.157 665 H LYS 85 H LYS 85 -2.883 6.220 5.200 666 HA LYS 85 HA LYS 85 -0.600 6.001 6.932 667 1HB LYS 85 1HB LYS 85 -1.855 7.821 8.026 668 2HB LYS 85 2HB LYS 85 -3.282 6.792 8.092 669 1HG LYS 85 1HG LYS 85 -2.057 6.911 10.232 670 2HG LYS 85 2HG LYS 85 -2.181 5.270 9.592 671 1HD LYS 85 1HD LYS 85 0.106 5.542 8.638 672 2HD LYS 85 2HD LYS 85 0.216 7.099 9.461 673 1HE LYS 85 1HE LYS 85 -0.310 4.487 10.866 674 2HE LYS 85 2HE LYS 85 1.295 5.185 10.667 675 1HZ LYS 85 1HZ LYS 85 0.255 5.679 12.830 676 2HZ LYS 85 2HZ LYS 85 -0.963 6.553 12.033 677 3HZ LYS 85 3HZ LYS 85 0.649 7.071 11.952 678 H THR 86 H THR 86 -0.297 3.904 6.822 679 HA THR 86 HA THR 86 -2.561 2.103 6.502 680 HB THR 86 HB THR 86 -0.535 1.918 5.037 681 HG1 THR 86 HG1 THR 86 -1.107 -0.096 4.855 682 1HG2 THR 86 1HG2 THR 86 1.484 0.864 5.931 683 2HG2 THR 86 2HG2 THR 86 0.791 0.898 7.554 684 3HG2 THR 86 3HG2 THR 86 1.175 2.408 6.727 685 H GLU 87 H GLU 87 -2.430 -0.005 7.746 686 HA GLU 87 HA GLU 87 -2.226 0.625 10.561 687 1HB GLU 87 1HB GLU 87 -3.421 -1.569 8.944 688 2HB GLU 87 2HB GLU 87 -2.970 -1.935 10.606 689 1HG GLU 87 1HG GLU 87 -4.691 0.417 9.886 690 2HG GLU 87 2HG GLU 87 -5.352 -1.189 10.194 691 H THR 88 H THR 88 -1.037 -0.588 12.070 692 HA THR 88 HA THR 88 1.633 -1.021 11.409 693 HB THR 88 HB THR 88 0.246 -2.265 13.782 694 HG1 THR 88 HG1 THR 88 1.142 0.069 14.509 695 1HG2 THR 88 1HG2 THR 88 2.376 -1.806 14.902 696 2HG2 THR 88 2HG2 THR 88 3.013 -1.102 13.414 697 3HG2 THR 88 3HG2 THR 88 2.617 -2.820 13.481 698 H ILE 89 H ILE 89 -1.075 -3.244 11.571 699 HA ILE 89 HA ILE 89 0.331 -5.673 11.468 700 HB ILE 89 HB ILE 89 -2.434 -4.960 10.472 701 1HG1 ILE 89 1HG1 ILE 89 -3.062 -6.448 12.457 702 2HG1 ILE 89 2HG1 ILE 89 -1.382 -6.308 12.956 703 1HG2 ILE 89 1HG2 ILE 89 -1.627 -6.849 9.180 704 2HG2 ILE 89 2HG2 ILE 89 -2.885 -7.357 10.307 705 3HG2 ILE 89 3HG2 ILE 89 -1.192 -7.697 10.665 706 1HD1 ILE 89 1HD1 ILE 89 -2.827 -4.742 14.135 707 2HD1 ILE 89 2HD1 ILE 89 -3.291 -4.008 12.599 708 3HD1 ILE 89 3HD1 ILE 89 -1.621 -3.906 13.160 709 H ILE 90 H ILE 90 -0.763 -3.469 8.955 710 HA ILE 90 HA ILE 90 0.063 -5.158 6.786 711 HB ILE 90 HB ILE 90 -0.594 -2.208 6.720 712 1HG1 ILE 90 1HG1 ILE 90 -2.411 -4.591 6.278 713 2HG1 ILE 90 2HG1 ILE 90 -2.423 -3.556 7.701 714 1HG2 ILE 90 1HG2 ILE 90 -0.601 -4.301 4.544 715 2HG2 ILE 90 2HG2 ILE 90 0.586 -3.012 4.739 716 3HG2 ILE 90 3HG2 ILE 90 -1.090 -2.617 4.356 717 1HD1 ILE 90 1HD1 ILE 90 -3.036 -2.664 4.897 718 2HD1 ILE 90 2HD1 ILE 90 -3.111 -1.668 6.352 719 3HD1 ILE 90 3HD1 ILE 90 -4.226 -3.021 6.147 720 H ALA 91 H ALA 91 1.323 -2.283 8.423 721 HA ALA 91 HA ALA 91 3.493 -1.714 6.786 722 1HB ALA 91 1HB ALA 91 4.458 -0.550 8.671 723 2HB ALA 91 2HB ALA 91 3.389 -1.406 9.781 724 3HB ALA 91 3HB ALA 91 2.719 -0.266 8.615 725 H VAL 92 H VAL 92 3.411 -3.850 9.636 726 HA VAL 92 HA VAL 92 6.126 -4.673 9.344 727 HB VAL 92 HB VAL 92 3.877 -6.017 10.851 728 1HG1 VAL 92 1HG1 VAL 92 6.864 -6.351 11.108 729 2HG1 VAL 92 2HG1 VAL 92 5.738 -7.534 10.436 730 3HG1 VAL 92 3HG1 VAL 92 5.644 -7.098 12.143 731 1HG2 VAL 92 1HG2 VAL 92 4.240 -3.738 11.623 732 2HG2 VAL 92 2HG2 VAL 92 5.966 -4.055 11.796 733 3HG2 VAL 92 3HG2 VAL 92 4.807 -4.894 12.829 734 H GLY 93 H GLY 93 3.013 -5.966 8.313 735 1HA GLY 93 1HA GLY 93 3.892 -8.493 7.451 736 2HA GLY 93 2HA GLY 93 2.455 -7.663 6.874 737 H ALA 94 H ALA 94 3.661 -5.409 5.724 738 HA ALA 94 HA ALA 94 4.508 -6.530 3.231 739 1HB ALA 94 1HB ALA 94 3.125 -4.505 3.356 740 2HB ALA 94 2HB ALA 94 4.613 -4.243 2.446 741 3HB ALA 94 3HB ALA 94 4.475 -3.644 4.098 742 H ALA 95 H ALA 95 6.096 -5.006 5.961 743 HA ALA 95 HA ALA 95 8.649 -4.625 4.842 744 1HB ALA 95 1HB ALA 95 7.951 -5.338 7.694 745 2HB ALA 95 2HB ALA 95 7.981 -3.709 7.023 746 3HB ALA 95 3HB ALA 95 9.472 -4.642 7.137 747 H MET 96 H MET 96 7.107 -7.419 6.321 748 HA MET 96 HA MET 96 9.331 -9.163 6.248 749 1HB MET 96 1HB MET 96 6.368 -9.766 6.159 750 2HB MET 96 2HB MET 96 7.622 -10.968 6.421 751 1HG MET 96 1HG MET 96 8.225 -10.000 8.508 752 2HG MET 96 2HG MET 96 7.207 -8.592 8.216 753 1HE MET 96 1HE MET 96 5.538 -12.832 8.963 754 2HE MET 96 2HE MET 96 7.260 -12.453 8.938 755 3HE MET 96 3HE MET 96 6.314 -12.352 7.454 756 H ALA 97 H ALA 97 6.726 -8.503 3.960 757 HA ALA 97 HA ALA 97 7.620 -10.485 2.075 758 1HB ALA 97 1HB ALA 97 5.565 -8.306 1.777 759 2HB ALA 97 2HB ALA 97 5.254 -9.955 2.319 760 3HB ALA 97 3HB ALA 97 5.813 -9.658 0.673 761 H GLU 98 H GLU 98 8.781 -7.491 2.863 762 HA GLU 98 HA GLU 98 10.115 -5.951 1.875 763 1HB GLU 98 1HB GLU 98 11.392 -8.027 1.276 764 2HB GLU 98 2HB GLU 98 10.547 -8.045 -0.265 765 1HG GLU 98 1HG GLU 98 11.521 -5.876 -0.823 766 2HG GLU 98 2HG GLU 98 12.367 -5.863 0.723 767 H ILE 99 H ILE 99 7.358 -5.898 1.370 768 HA ILE 99 HA ILE 99 7.193 -4.742 -1.333 769 HB ILE 99 HB ILE 99 4.923 -5.414 0.558 770 1HG1 ILE 99 1HG1 ILE 99 5.853 -6.844 -1.947 771 2HG1 ILE 99 2HG1 ILE 99 6.063 -7.433 -0.301 772 1HG2 ILE 99 1HG2 ILE 99 4.901 -4.526 -2.328 773 2HG2 ILE 99 2HG2 ILE 99 4.406 -3.559 -0.939 774 3HG2 ILE 99 3HG2 ILE 99 3.486 -4.996 -1.385 775 1HD1 ILE 99 1HD1 ILE 99 3.651 -7.597 -0.043 776 2HD1 ILE 99 2HD1 ILE 99 4.207 -8.533 -1.431 777 3HD1 ILE 99 3HD1 ILE 99 3.425 -6.970 -1.675 778 HA PRO 100 HA PRO 100 8.203 -1.252 1.378 779 1HB PRO 100 1HB PRO 100 8.425 0.522 -0.747 780 2HB PRO 100 2HB PRO 100 9.737 -0.450 -0.075 781 1HG PRO 100 1HG PRO 100 8.033 -0.962 -2.474 782 2HG PRO 100 2HG PRO 100 9.767 -1.260 -2.239 783 1HD PRO 100 1HD PRO 100 8.000 -3.258 -2.131 784 2HD PRO 100 2HD PRO 100 9.397 -3.209 -1.036 785 H LEU 101 H LEU 101 6.521 -0.450 2.483 786 HA LEU 101 HA LEU 101 4.648 1.196 0.941 787 1HB LEU 101 1HB LEU 101 3.085 0.982 2.911 788 2HB LEU 101 2HB LEU 101 3.283 -0.432 1.902 789 HG LEU 101 HG LEU 101 4.877 -1.327 3.653 790 1HD1 LEU 101 1HD1 LEU 101 3.692 0.905 5.300 791 2HD1 LEU 101 2HD1 LEU 101 5.377 0.780 4.797 792 3HD1 LEU 101 3HD1 LEU 101 4.697 -0.413 5.905 793 1HD2 LEU 101 1HD2 LEU 101 2.034 -0.790 4.488 794 2HD2 LEU 101 2HD2 LEU 101 3.068 -2.092 5.077 795 3HD2 LEU 101 3HD2 LEU 101 2.559 -2.065 3.390 796 H VAL 102 H VAL 102 4.064 3.216 1.771 797 HA VAL 102 HA VAL 102 5.871 4.302 3.812 798 HB VAL 102 HB VAL 102 6.310 6.283 2.408 799 1HG1 VAL 102 1HG1 VAL 102 7.097 3.716 1.036 800 2HG1 VAL 102 2HG1 VAL 102 7.900 4.402 2.446 801 3HG1 VAL 102 3HG1 VAL 102 7.921 5.272 0.913 802 1HG2 VAL 102 1HG2 VAL 102 4.320 6.175 0.999 803 2HG2 VAL 102 2HG2 VAL 102 4.930 4.708 0.233 804 3HG2 VAL 102 3HG2 VAL 102 5.786 6.236 0.018 805 H GLU 103 H GLU 103 5.219 6.455 4.556 806 HA GLU 103 HA GLU 103 2.306 6.756 4.593 807 1HB GLU 103 1HB GLU 103 4.424 8.176 6.226 808 2HB GLU 103 2HB GLU 103 2.690 8.303 6.456 809 1HG GLU 103 1HG GLU 103 2.603 5.932 7.063 810 2HG GLU 103 2HG GLU 103 4.350 5.826 6.855 811 H VAL 104 H VAL 104 1.510 8.040 3.027 812 HA VAL 104 HA VAL 104 3.009 10.493 2.405 813 HB VAL 104 HB VAL 104 2.710 9.131 0.413 814 1HG1 VAL 104 1HG1 VAL 104 -0.254 9.348 0.892 815 2HG1 VAL 104 2HG1 VAL 104 0.719 7.888 1.074 816 3HG1 VAL 104 3HG1 VAL 104 0.524 8.626 -0.517 817 1HG2 VAL 104 1HG2 VAL 104 2.665 11.562 0.182 818 2HG2 VAL 104 2HG2 VAL 104 0.911 11.549 0.368 819 3HG2 VAL 104 3HG2 VAL 104 1.656 10.780 -1.034 820 H ARG 105 H ARG 105 2.275 12.223 3.369 821 HA ARG 105 HA ARG 105 -0.435 12.171 4.480 822 1HB ARG 105 1HB ARG 105 1.898 14.003 5.058 823 2HB ARG 105 2HB ARG 105 0.350 14.046 5.887 824 1HG ARG 105 1HG ARG 105 0.753 11.733 6.672 825 2HG ARG 105 2HG ARG 105 2.353 11.799 5.928 826 1HD ARG 105 1HD ARG 105 2.910 13.727 7.342 827 2HD ARG 105 2HD ARG 105 1.324 13.620 8.100 828 HE ARG 105 HE ARG 105 3.254 11.402 8.258 829 1HH1 ARG 105 1HH1 ARG 105 1.026 13.638 9.744 830 2HH1 ARG 105 2HH1 ARG 105 1.274 13.028 11.349 831 1HH2 ARG 105 1HH2 ARG 105 3.584 10.572 10.382 832 2HH2 ARG 105 2HH2 ARG 105 2.714 11.287 11.709 833 H ASP 106 H ASP 106 0.103 12.727 1.647 834 HA ASP 106 HA ASP 106 -0.950 15.475 1.528 835 1HB ASP 106 1HB ASP 106 1.288 15.265 0.499 836 2HB ASP 106 2HB ASP 106 0.658 14.034 -0.592 837 H GLU 107 H GLU 107 -2.976 15.631 0.888 838 HA GLU 107 HA GLU 107 -4.439 13.339 0.009 839 1HB GLU 107 1HB GLU 107 -5.305 15.288 1.430 840 2HB GLU 107 2HB GLU 107 -5.425 16.186 -0.076 841 1HG GLU 107 1HG GLU 107 -7.569 15.286 0.417 842 2HG GLU 107 2HG GLU 107 -6.913 14.392 -0.955 843 H LYS 108 H LYS 108 -2.999 16.108 -1.561 844 HA LYS 108 HA LYS 108 -4.440 16.108 -3.964 845 1HB LYS 108 1HB LYS 108 -1.585 16.953 -3.430 846 2HB LYS 108 2HB LYS 108 -2.521 17.378 -4.847 847 1HG LYS 108 1HG LYS 108 -3.231 18.164 -2.033 848 2HG LYS 108 2HG LYS 108 -2.388 19.194 -3.192 849 1HD LYS 108 1HD LYS 108 -4.352 18.935 -4.720 850 2HD LYS 108 2HD LYS 108 -5.190 18.106 -3.407 851 1HE LYS 108 1HE LYS 108 -4.097 20.913 -3.284 852 2HE LYS 108 2HE LYS 108 -5.784 20.491 -3.557 853 1HZ LYS 108 1HZ LYS 108 -5.770 19.380 -1.368 854 2HZ LYS 108 2HZ LYS 108 -5.478 21.049 -1.275 855 3HZ LYS 108 3HZ LYS 108 -4.194 19.957 -1.108 856 H PHE 109 H PHE 109 -1.585 14.344 -2.930 857 HA PHE 109 HA PHE 109 -0.703 13.236 -5.284 858 1HB PHE 109 1HB PHE 109 0.530 12.867 -3.272 859 2HB PHE 109 2HB PHE 109 -0.834 12.058 -2.506 860 HD1 PHE 109 HD1 PHE 109 -0.737 9.780 -2.350 861 HD2 PHE 109 HD2 PHE 109 1.277 11.701 -5.569 862 HE1 PHE 109 HE1 PHE 109 0.103 7.601 -3.118 863 HE2 PHE 109 HE2 PHE 109 2.120 9.523 -6.344 864 HZ PHE 109 HZ PHE 109 1.530 7.468 -5.119 865 H PHE 110 H PHE 110 -3.377 12.076 -3.249 866 HA PHE 110 HA PHE 110 -3.745 9.670 -4.732 867 1HB PHE 110 1HB PHE 110 -5.578 11.092 -2.791 868 2HB PHE 110 2HB PHE 110 -5.862 9.481 -3.435 869 HD1 PHE 110 HD1 PHE 110 -4.396 7.615 -2.786 870 HD2 PHE 110 HD2 PHE 110 -3.993 11.481 -1.054 871 HE1 PHE 110 HE1 PHE 110 -3.053 6.654 -0.964 872 HE2 PHE 110 HE2 PHE 110 -2.647 10.524 0.770 873 HZ PHE 110 HZ PHE 110 -2.170 8.110 0.815 874 H GLU 111 H GLU 111 -4.856 12.909 -5.107 875 HA GLU 111 HA GLU 111 -6.916 12.166 -6.978 876 1HB GLU 111 1HB GLU 111 -6.025 14.625 -5.619 877 2HB GLU 111 2HB GLU 111 -6.721 14.836 -7.211 878 1HG GLU 111 1HG GLU 111 -7.976 13.714 -4.743 879 2HG GLU 111 2HG GLU 111 -8.534 15.036 -5.768 880 H ALA 112 H ALA 112 -3.618 13.261 -6.986 881 HA ALA 112 HA ALA 112 -3.504 13.967 -9.740 882 1HB ALA 112 1HB ALA 112 -1.871 14.789 -8.111 883 2HB ALA 112 2HB ALA 112 -1.089 13.957 -9.454 884 3HB ALA 112 3HB ALA 112 -1.260 13.149 -7.895 885 H VAL 113 H VAL 113 -2.747 11.031 -7.922 886 HA VAL 113 HA VAL 113 -2.031 9.650 -10.388 887 HB VAL 113 HB VAL 113 -0.622 9.366 -8.359 888 1HG1 VAL 113 1HG1 VAL 113 -1.384 7.933 -6.535 889 2HG1 VAL 113 2HG1 VAL 113 -2.998 7.886 -7.247 890 3HG1 VAL 113 3HG1 VAL 113 -2.341 9.410 -6.648 891 1HG2 VAL 113 1HG2 VAL 113 -1.930 6.852 -9.389 892 2HG2 VAL 113 2HG2 VAL 113 -0.387 6.932 -8.542 893 3HG2 VAL 113 3HG2 VAL 113 -0.565 7.701 -10.118 894 H LYS 114 H LYS 114 -3.293 8.228 -11.412 895 HA LYS 114 HA LYS 114 -5.644 7.165 -10.001 896 1HB LYS 114 1HB LYS 114 -5.574 8.006 -12.911 897 2HB LYS 114 2HB LYS 114 -6.941 7.282 -12.081 898 1HG LYS 114 1HG LYS 114 -5.738 9.976 -11.474 899 2HG LYS 114 2HG LYS 114 -7.227 9.682 -12.369 900 1HD LYS 114 1HD LYS 114 -8.239 8.678 -10.396 901 2HD LYS 114 2HD LYS 114 -6.738 8.904 -9.495 902 1HE LYS 114 1HE LYS 114 -6.947 11.352 -9.891 903 2HE LYS 114 2HE LYS 114 -8.521 11.057 -10.624 904 1HZ LYS 114 1HZ LYS 114 -7.774 10.414 -7.825 905 2HZ LYS 114 2HZ LYS 114 -9.293 10.146 -8.521 906 3HZ LYS 114 3HZ LYS 114 -8.724 11.731 -8.308 907 H THR 115 H THR 115 -6.409 5.085 -10.956 908 HA THR 115 HA THR 115 -4.262 3.307 -11.278 909 HB THR 115 HB THR 115 -6.418 2.628 -10.325 910 HG1 THR 115 HG1 THR 115 -6.581 0.832 -12.236 911 1HG2 THR 115 1HG2 THR 115 -8.365 2.219 -11.725 912 2HG2 THR 115 2HG2 THR 115 -7.502 2.824 -13.140 913 3HG2 THR 115 3HG2 THR 115 -7.903 3.918 -11.814 914 H GLY 116 H GLY 116 -3.115 2.767 -13.005 915 1HA GLY 116 1HA GLY 116 -3.214 2.002 -15.351 916 2HA GLY 116 2HA GLY 116 -4.250 3.383 -15.667 917 H ASP 117 H ASP 117 -2.357 4.923 -13.746 918 HA ASP 117 HA ASP 117 -0.379 5.602 -15.784 919 1HB ASP 117 1HB ASP 117 -1.210 6.910 -13.199 920 2HB ASP 117 2HB ASP 117 0.251 7.403 -14.049 921 H ARG 118 H ARG 118 1.897 6.208 -14.638 922 HA ARG 118 HA ARG 118 2.620 3.706 -13.270 923 1HB ARG 118 1HB ARG 118 3.389 3.803 -15.619 924 2HB ARG 118 2HB ARG 118 4.299 5.259 -15.243 925 1HG ARG 118 1HG ARG 118 4.850 2.888 -13.572 926 2HG ARG 118 2HG ARG 118 5.370 2.814 -15.256 927 1HD ARG 118 1HD ARG 118 6.058 5.037 -13.339 928 2HD ARG 118 2HD ARG 118 7.110 3.670 -13.704 929 HE ARG 118 HE ARG 118 6.252 5.665 -15.712 930 1HH1 ARG 118 1HH1 ARG 118 8.637 3.508 -14.342 931 2HH1 ARG 118 2HH1 ARG 118 9.863 3.889 -15.511 932 1HH2 ARG 118 1HH2 ARG 118 7.846 6.142 -17.304 933 2HH2 ARG 118 2HH2 ARG 118 9.417 5.398 -17.192 934 H VAL 119 H VAL 119 3.653 3.825 -11.423 935 HA VAL 119 HA VAL 119 4.762 6.427 -10.592 936 HB VAL 119 HB VAL 119 3.537 4.261 -8.863 937 1HG1 VAL 119 1HG1 VAL 119 3.849 5.805 -6.998 938 2HG1 VAL 119 2HG1 VAL 119 4.673 6.941 -8.064 939 3HG1 VAL 119 3HG1 VAL 119 5.394 5.366 -7.726 940 1HG2 VAL 119 1HG2 VAL 119 2.573 7.054 -9.453 941 2HG2 VAL 119 2HG2 VAL 119 1.802 5.889 -8.376 942 3HG2 VAL 119 3HG2 VAL 119 1.886 5.569 -10.109 943 H VAL 120 H VAL 120 6.817 6.470 -9.821 944 HA VAL 120 HA VAL 120 8.244 3.906 -9.610 945 HB VAL 120 HB VAL 120 9.404 6.701 -9.753 946 1HG1 VAL 120 1HG1 VAL 120 10.713 3.987 -9.895 947 2HG1 VAL 120 2HG1 VAL 120 10.864 5.162 -8.587 948 3HG1 VAL 120 3HG1 VAL 120 11.530 5.523 -10.181 949 1HG2 VAL 120 1HG2 VAL 120 8.301 6.097 -11.849 950 2HG2 VAL 120 2HG2 VAL 120 9.222 4.593 -11.905 951 3HG2 VAL 120 3HG2 VAL 120 10.053 6.143 -12.042 952 H VAL 121 H VAL 121 8.207 3.152 -7.592 953 HA VAL 121 HA VAL 121 7.896 5.030 -5.384 954 HB VAL 121 HB VAL 121 7.702 2.018 -5.431 955 1HG1 VAL 121 1HG1 VAL 121 7.182 3.965 -3.187 956 2HG1 VAL 121 2HG1 VAL 121 8.453 2.743 -3.246 957 3HG1 VAL 121 3HG1 VAL 121 6.760 2.255 -3.157 958 1HG2 VAL 121 1HG2 VAL 121 5.559 4.118 -5.151 959 2HG2 VAL 121 2HG2 VAL 121 5.323 2.371 -5.169 960 3HG2 VAL 121 3HG2 VAL 121 5.901 3.197 -6.616 961 H ASN 122 H ASN 122 9.584 5.718 -4.322 962 HA ASN 122 HA ASN 122 11.902 3.923 -4.033 963 1HB ASN 122 1HB ASN 122 12.312 6.050 -5.312 964 2HB ASN 122 2HB ASN 122 11.873 6.947 -3.866 965 1HD2 ASN 122 1HD2 ASN 122 14.332 7.060 -5.275 966 2HD2 ASN 122 2HD2 ASN 122 15.579 6.551 -4.177 967 H ALA 123 H ALA 123 11.248 2.916 -2.132 968 HA ALA 123 HA ALA 123 10.463 4.611 0.115 969 1HB ALA 123 1HB ALA 123 9.136 2.598 -0.374 970 2HB ALA 123 2HB ALA 123 9.851 2.551 1.238 971 3HB ALA 123 3HB ALA 123 10.559 1.602 -0.070 972 H ASP 124 H ASP 124 13.255 3.577 -1.214 973 HA ASP 124 HA ASP 124 14.679 2.902 1.202 974 1HB ASP 124 1HB ASP 124 15.300 2.029 -1.073 975 2HB ASP 124 2HB ASP 124 15.814 3.658 -1.497 976 H GLU 125 H GLU 125 14.335 5.652 -0.954 977 HA GLU 125 HA GLU 125 15.811 7.357 0.911 978 1HB GLU 125 1HB GLU 125 14.736 7.891 -1.865 979 2HB GLU 125 2HB GLU 125 15.615 9.064 -0.892 980 1HG GLU 125 1HG GLU 125 17.594 7.717 -0.948 981 2HG GLU 125 2HG GLU 125 16.731 6.407 -1.752 982 H GLY 126 H GLY 126 12.588 6.712 -0.258 983 1HA GLY 126 1HA GLY 126 10.640 7.257 0.965 984 2HA GLY 126 2HA GLY 126 11.535 8.532 1.779 985 H TYR 127 H TYR 127 10.563 7.660 -1.545 986 HA TYR 127 HA TYR 127 9.524 10.340 -1.953 987 1HB TYR 127 1HB TYR 127 11.862 9.269 -3.550 988 2HB TYR 127 2HB TYR 127 10.868 10.625 -4.068 989 HD1 TYR 127 HD1 TYR 127 13.607 9.561 -1.983 990 HD2 TYR 127 HD2 TYR 127 10.844 12.719 -2.682 991 HE1 TYR 127 HE1 TYR 127 15.039 11.088 -0.699 992 HE2 TYR 127 HE2 TYR 127 12.270 14.255 -1.399 993 HH TYR 127 HH TYR 127 15.469 13.468 -0.500 994 H VAL 128 H VAL 128 8.065 10.474 -3.614 995 HA VAL 128 HA VAL 128 7.476 7.960 -5.039 996 HB VAL 128 HB VAL 128 5.487 10.088 -4.216 997 1HG1 VAL 128 1HG1 VAL 128 3.797 8.486 -4.982 998 2HG1 VAL 128 2HG1 VAL 128 5.079 7.399 -5.519 999 3HG1 VAL 128 3HG1 VAL 128 4.877 8.971 -6.290 1000 1HG2 VAL 128 1HG2 VAL 128 4.603 8.417 -2.661 1001 2HG2 VAL 128 2HG2 VAL 128 6.272 8.838 -2.279 1002 3HG2 VAL 128 3HG2 VAL 128 5.912 7.318 -3.100 1003 H GLU 129 H GLU 129 8.192 8.217 -7.068 1004 HA GLU 129 HA GLU 129 7.918 10.851 -8.322 1005 1HB GLU 129 1HB GLU 129 9.467 8.417 -9.232 1006 2HB GLU 129 2HB GLU 129 9.444 9.976 -10.046 1007 1HG GLU 129 1HG GLU 129 10.398 10.988 -7.979 1008 2HG GLU 129 2HG GLU 129 10.564 9.361 -7.322 1009 H LEU 130 H LEU 130 6.001 11.096 -9.265 1010 HA LEU 130 HA LEU 130 4.733 8.827 -10.586 1011 1HB LEU 130 1HB LEU 130 3.308 10.178 -9.163 1012 2HB LEU 130 2HB LEU 130 3.755 11.631 -10.037 1013 HG LEU 130 HG LEU 130 2.694 10.606 -12.088 1014 1HD1 LEU 130 1HD1 LEU 130 2.732 8.283 -11.376 1015 2HD1 LEU 130 2HD1 LEU 130 1.089 8.807 -11.745 1016 3HD1 LEU 130 3HD1 LEU 130 1.610 8.655 -10.067 1017 1HD2 LEU 130 1HD2 LEU 130 1.566 12.330 -10.802 1018 2HD2 LEU 130 2HD2 LEU 130 0.944 11.117 -9.683 1019 3HD2 LEU 130 3HD2 LEU 130 0.401 11.128 -11.361 1020 H ILE 131 H ILE 131 4.677 8.574 -12.737 1021 HA ILE 131 HA ILE 131 5.499 10.884 -14.363 1022 HB ILE 131 HB ILE 131 5.899 8.011 -15.130 1023 1HG1 ILE 131 1HG1 ILE 131 7.897 10.002 -14.029 1024 2HG1 ILE 131 2HG1 ILE 131 7.338 8.542 -13.219 1025 1HG2 ILE 131 1HG2 ILE 131 6.913 10.569 -16.345 1026 2HG2 ILE 131 2HG2 ILE 131 5.658 9.524 -17.008 1027 3HG2 ILE 131 3HG2 ILE 131 7.321 8.944 -16.896 1028 1HD1 ILE 131 1HD1 ILE 131 9.576 8.287 -14.168 1029 2HD1 ILE 131 2HD1 ILE 131 8.926 8.614 -15.775 1030 3HD1 ILE 131 3HD1 ILE 131 8.420 7.172 -14.896 1031 H GLU 132 H GLU 132 3.919 11.662 -15.382 1032 HA GLU 132 HA GLU 132 1.415 10.389 -15.739 1033 1HB GLU 132 1HB GLU 132 2.516 12.879 -17.063 1034 2HB GLU 132 2HB GLU 132 0.825 12.401 -17.019 1035 1HG GLU 132 1HG GLU 132 0.637 12.837 -14.733 1036 2HG GLU 132 2HG GLU 132 2.384 12.847 -14.503 Start of MODEL 12 1 H VAL 1 H VAL 1 8.730 16.023 -10.812 2 HA VAL 1 HA VAL 1 8.063 16.769 -8.781 3 HB VAL 1 HB VAL 1 5.284 15.834 -9.479 4 1HG1 VAL 1 1HG1 VAL 1 4.571 17.440 -7.767 5 2HG1 VAL 1 2HG1 VAL 1 6.262 17.770 -7.391 6 3HG1 VAL 1 3HG1 VAL 1 5.590 16.166 -7.099 7 1HG2 VAL 1 1HG2 VAL 1 4.828 18.148 -10.103 8 2HG2 VAL 1 2HG2 VAL 1 6.110 17.470 -11.109 9 3HG2 VAL 1 3HG2 VAL 1 6.511 18.573 -9.791 10 H LYS 2 H LYS 2 8.628 15.832 -7.033 11 HA LYS 2 HA LYS 2 7.919 13.012 -6.572 12 1HB LYS 2 1HB LYS 2 10.273 14.681 -5.701 13 2HB LYS 2 2HB LYS 2 9.880 13.158 -4.918 14 1HG LYS 2 1HG LYS 2 10.632 11.925 -6.642 15 2HG LYS 2 2HG LYS 2 10.063 13.075 -7.855 16 1HD LYS 2 1HD LYS 2 12.386 13.722 -6.072 17 2HD LYS 2 2HD LYS 2 12.602 12.773 -7.544 18 1HE LYS 2 1HE LYS 2 11.258 15.467 -7.483 19 2HE LYS 2 2HE LYS 2 12.978 15.244 -7.807 20 1HZ LYS 2 1HZ LYS 2 12.486 13.999 -9.748 21 2HZ LYS 2 2HZ LYS 2 11.547 15.407 -9.828 22 3HZ LYS 2 3HZ LYS 2 10.833 13.934 -9.390 23 H PHE 3 H PHE 3 6.470 12.645 -5.032 24 HA PHE 3 HA PHE 3 5.886 14.732 -3.087 25 1HB PHE 3 1HB PHE 3 4.575 12.029 -3.397 26 2HB PHE 3 2HB PHE 3 3.987 13.369 -2.429 27 HD1 PHE 3 HD1 PHE 3 4.329 12.028 -5.811 28 HD2 PHE 3 HD2 PHE 3 2.920 15.284 -3.454 29 HE1 PHE 3 HE1 PHE 3 3.019 12.848 -7.727 30 HE2 PHE 3 HE2 PHE 3 1.611 16.106 -5.366 31 HZ PHE 3 HZ PHE 3 1.659 14.889 -7.505 32 H ALA 4 H ALA 4 6.334 14.598 -0.959 33 HA ALA 4 HA ALA 4 8.281 12.545 -0.219 34 1HB ALA 4 1HB ALA 4 7.601 15.154 1.133 35 2HB ALA 4 2HB ALA 4 8.979 14.860 0.069 36 3HB ALA 4 3HB ALA 4 8.873 14.036 1.625 37 H CYS 5 H CYS 5 7.551 10.841 0.816 38 HA CYS 5 HA CYS 5 5.359 11.184 2.756 39 1HB CYS 5 1HB CYS 5 5.996 8.628 1.282 40 2HB CYS 5 2HB CYS 5 4.548 9.014 2.202 41 HG CYS 5 HG CYS 5 5.066 11.092 -0.354 42 H ARG 6 H ARG 6 5.467 9.542 4.567 43 HA ARG 6 HA ARG 6 8.269 9.271 5.365 44 1HB ARG 6 1HB ARG 6 6.667 10.335 6.942 45 2HB ARG 6 2HB ARG 6 5.792 8.810 7.036 46 1HG ARG 6 1HG ARG 6 7.709 7.717 8.006 47 2HG ARG 6 2HG ARG 6 8.683 9.172 7.793 48 1HD ARG 6 1HD ARG 6 7.182 10.373 9.333 49 2HD ARG 6 2HD ARG 6 6.266 8.886 9.577 50 HE ARG 6 HE ARG 6 8.662 8.048 10.280 51 1HH1 ARG 6 1HH1 ARG 6 7.084 11.068 11.066 52 2HH1 ARG 6 2HH1 ARG 6 7.936 11.271 12.564 53 1HH2 ARG 6 1HH2 ARG 6 9.809 8.316 12.231 54 2HH2 ARG 6 2HH2 ARG 6 9.503 9.718 13.217 55 H ALA 7 H ALA 7 9.306 7.400 5.389 56 HA ALA 7 HA ALA 7 7.829 5.089 4.377 57 1HB ALA 7 1HB ALA 7 9.776 5.879 3.112 58 2HB ALA 7 2HB ALA 7 9.991 4.227 3.693 59 3HB ALA 7 3HB ALA 7 10.801 5.563 4.512 60 H ILE 8 H ILE 8 7.638 3.206 5.429 61 HA ILE 8 HA ILE 8 8.911 2.987 8.070 62 HB ILE 8 HB ILE 8 6.651 1.305 6.950 63 1HG1 ILE 8 1HG1 ILE 8 5.397 2.531 8.894 64 2HG1 ILE 8 2HG1 ILE 8 6.669 3.736 8.721 65 1HG2 ILE 8 1HG2 ILE 8 6.425 0.493 9.261 66 2HG2 ILE 8 2HG2 ILE 8 7.849 1.428 9.717 67 3HG2 ILE 8 3HG2 ILE 8 7.999 0.099 8.568 68 1HD1 ILE 8 1HD1 ILE 8 4.662 4.332 7.478 69 2HD1 ILE 8 2HD1 ILE 8 4.799 2.844 6.541 70 3HD1 ILE 8 3HD1 ILE 8 6.040 4.089 6.406 71 H THR 9 H THR 9 8.204 1.107 5.144 72 HA THR 9 HA THR 9 10.555 -0.556 5.682 73 HB THR 9 HB THR 9 9.666 -1.923 3.732 74 HG1 THR 9 HG1 THR 9 7.432 -1.568 3.249 75 1HG2 THR 9 1HG2 THR 9 9.341 -2.607 6.056 76 2HG2 THR 9 2HG2 THR 9 7.937 -3.021 5.070 77 3HG2 THR 9 3HG2 THR 9 7.879 -1.624 6.147 78 H ARG 10 H ARG 10 11.785 -1.131 3.547 79 HA ARG 10 HA ARG 10 12.095 1.368 2.016 80 1HB ARG 10 1HB ARG 10 14.207 -0.285 3.352 81 2HB ARG 10 2HB ARG 10 14.597 0.720 1.963 82 1HG ARG 10 1HG ARG 10 13.740 2.685 3.161 83 2HG ARG 10 2HG ARG 10 13.409 1.668 4.563 84 1HD ARG 10 1HD ARG 10 15.734 1.209 4.863 85 2HD ARG 10 2HD ARG 10 16.141 1.983 3.331 86 HE ARG 10 HE ARG 10 15.748 4.087 4.315 87 1HH1 ARG 10 1HH1 ARG 10 15.325 1.450 6.581 88 2HH1 ARG 10 2HH1 ARG 10 15.463 2.471 7.978 89 1HH2 ARG 10 1HH2 ARG 10 15.918 5.432 6.143 90 2HH2 ARG 10 2HH2 ARG 10 15.780 4.737 7.735 91 H GLY 11 H GLY 11 14.016 0.680 0.250 92 1HA GLY 11 1HA GLY 11 14.382 -0.860 -1.558 93 2HA GLY 11 2HA GLY 11 12.794 -1.548 -1.238 94 H ARG 12 H ARG 12 13.181 -0.972 -3.775 95 HA ARG 12 HA ARG 12 11.367 1.257 -4.198 96 1HB ARG 12 1HB ARG 12 12.745 2.142 -6.092 97 2HB ARG 12 2HB ARG 12 13.451 2.408 -4.506 98 1HG ARG 12 1HG ARG 12 14.257 0.021 -6.097 99 2HG ARG 12 2HG ARG 12 14.929 1.606 -6.489 100 1HD ARG 12 1HD ARG 12 16.058 1.772 -4.501 101 2HD ARG 12 2HD ARG 12 14.933 0.713 -3.652 102 HE ARG 12 HE ARG 12 16.551 -0.552 -5.704 103 1HH1 ARG 12 1HH1 ARG 12 16.311 0.334 -2.317 104 2HH1 ARG 12 2HH1 ARG 12 17.252 -1.026 -1.765 105 1HH2 ARG 12 1HH2 ARG 12 17.769 -2.346 -4.988 106 2HH2 ARG 12 2HH2 ARG 12 18.090 -2.547 -3.290 107 H ALA 13 H ALA 13 10.219 1.127 -6.162 108 HA ALA 13 HA ALA 13 10.681 -1.120 -7.919 109 1HB ALA 13 1HB ALA 13 8.526 -2.182 -7.541 110 2HB ALA 13 2HB ALA 13 8.165 -1.023 -6.263 111 3HB ALA 13 3HB ALA 13 9.483 -2.176 -6.058 112 H GLU 14 H GLU 14 9.354 -1.087 -9.788 113 HA GLU 14 HA GLU 14 7.836 1.400 -10.191 114 1HB GLU 14 1HB GLU 14 9.924 1.521 -11.447 115 2HB GLU 14 2HB GLU 14 9.604 -0.045 -12.177 116 1HG GLU 14 1HG GLU 14 7.559 0.939 -13.209 117 2HG GLU 14 2HG GLU 14 8.078 2.509 -12.605 118 H GLY 15 H GLY 15 5.816 1.138 -10.921 119 1HA GLY 15 1HA GLY 15 5.090 -1.121 -12.554 120 2HA GLY 15 2HA GLY 15 4.426 -1.202 -10.927 121 H GLU 16 H GLU 16 2.625 -1.172 -12.838 122 HA GLU 16 HA GLU 16 1.751 1.443 -13.571 123 1HB GLU 16 1HB GLU 16 1.138 -0.787 -14.694 124 2HB GLU 16 2HB GLU 16 0.005 -1.016 -13.369 125 1HG GLU 16 1HG GLU 16 -1.278 -0.123 -15.097 126 2HG GLU 16 2HG GLU 16 -0.969 1.243 -14.028 127 H ALA 17 H ALA 17 0.456 2.818 -12.474 128 HA ALA 17 HA ALA 17 0.087 2.301 -9.667 129 1HB ALA 17 1HB ALA 17 -0.735 4.695 -11.306 130 2HB ALA 17 2HB ALA 17 0.803 4.504 -10.463 131 3HB ALA 17 3HB ALA 17 -0.701 4.599 -9.546 132 H LEU 18 H LEU 18 -1.602 1.367 -8.822 133 HA LEU 18 HA LEU 18 -4.195 1.569 -10.202 134 1HB LEU 18 1HB LEU 18 -3.186 -0.727 -9.955 135 2HB LEU 18 2HB LEU 18 -3.292 -0.530 -8.217 136 HG LEU 18 HG LEU 18 -5.737 -0.387 -9.973 137 1HD1 LEU 18 1HD1 LEU 18 -4.562 -2.833 -8.659 138 2HD1 LEU 18 2HD1 LEU 18 -4.630 -2.527 -10.394 139 3HD1 LEU 18 3HD1 LEU 18 -6.120 -2.743 -9.477 140 1HD2 LEU 18 1HD2 LEU 18 -6.889 -0.993 -7.924 141 2HD2 LEU 18 2HD2 LEU 18 -5.928 0.465 -7.676 142 3HD2 LEU 18 3HD2 LEU 18 -5.354 -1.088 -7.065 143 H VAL 19 H VAL 19 -5.478 3.032 -9.244 144 HA VAL 19 HA VAL 19 -5.049 3.579 -6.394 145 HB VAL 19 HB VAL 19 -6.516 5.262 -8.431 146 1HG1 VAL 19 1HG1 VAL 19 -6.470 7.006 -6.726 147 2HG1 VAL 19 2HG1 VAL 19 -5.683 5.895 -5.603 148 3HG1 VAL 19 3HG1 VAL 19 -7.331 5.578 -6.145 149 1HG2 VAL 19 1HG2 VAL 19 -4.570 6.767 -8.276 150 2HG2 VAL 19 2HG2 VAL 19 -4.145 5.189 -8.938 151 3HG2 VAL 19 3HG2 VAL 19 -3.752 5.577 -7.263 152 H THR 20 H THR 20 -6.338 2.420 -5.154 153 HA THR 20 HA THR 20 -9.030 1.745 -5.996 154 HB THR 20 HB THR 20 -7.716 1.163 -3.334 155 HG1 THR 20 HG1 THR 20 -7.832 -0.980 -4.935 156 1HG2 THR 20 1HG2 THR 20 -10.149 0.909 -3.351 157 2HG2 THR 20 2HG2 THR 20 -9.362 -0.666 -3.238 158 3HG2 THR 20 3HG2 THR 20 -10.042 -0.128 -4.774 159 H LYS 21 H LYS 21 -10.655 3.112 -5.650 160 HA LYS 21 HA LYS 21 -10.278 5.475 -4.093 161 1HB LYS 21 1HB LYS 21 -12.785 4.410 -5.406 162 2HB LYS 21 2HB LYS 21 -12.597 6.022 -4.734 163 1HG LYS 21 1HG LYS 21 -12.274 6.416 -6.970 164 2HG LYS 21 2HG LYS 21 -10.614 6.196 -6.417 165 1HD LYS 21 1HD LYS 21 -10.612 3.915 -7.214 166 2HD LYS 21 2HD LYS 21 -12.316 4.029 -7.650 167 1HE LYS 21 1HE LYS 21 -11.669 5.887 -9.218 168 2HE LYS 21 2HE LYS 21 -9.987 5.469 -8.897 169 1HZ LYS 21 1HZ LYS 21 -12.047 3.666 -10.062 170 2HZ LYS 21 2HZ LYS 21 -10.445 3.226 -9.720 171 3HZ LYS 21 3HZ LYS 21 -10.764 4.395 -10.899 172 H GLU 22 H GLU 22 -11.641 2.362 -3.549 173 HA GLU 22 HA GLU 22 -13.045 3.209 -1.149 174 1HB GLU 22 1HB GLU 22 -12.810 0.505 -2.474 175 2HB GLU 22 2HB GLU 22 -13.742 0.826 -1.018 176 1HG GLU 22 1HG GLU 22 -14.218 2.042 -3.729 177 2HG GLU 22 2HG GLU 22 -15.169 0.762 -2.978 178 H TYR 23 H TYR 23 -12.625 2.315 0.890 179 HA TYR 23 HA TYR 23 -9.809 1.752 1.341 180 1HB TYR 23 1HB TYR 23 -11.040 1.771 3.823 181 2HB TYR 23 2HB TYR 23 -10.237 3.143 3.062 182 HD1 TYR 23 HD1 TYR 23 -13.526 1.534 3.612 183 HD2 TYR 23 HD2 TYR 23 -11.470 5.025 2.313 184 HE1 TYR 23 HE1 TYR 23 -15.652 2.770 3.588 185 HE2 TYR 23 HE2 TYR 23 -13.590 6.272 2.285 186 HH TYR 23 HH TYR 23 -15.973 5.856 2.127 187 H ILE 24 H ILE 24 -9.599 -0.340 0.644 188 HA ILE 24 HA ILE 24 -11.352 -2.404 1.678 189 HB ILE 24 HB ILE 24 -9.952 -3.953 0.328 190 1HG1 ILE 24 1HG1 ILE 24 -8.574 -1.414 -0.580 191 2HG1 ILE 24 2HG1 ILE 24 -7.844 -2.654 0.434 192 1HG2 ILE 24 1HG2 ILE 24 -11.025 -1.561 -1.162 193 2HG2 ILE 24 2HG2 ILE 24 -11.967 -2.943 -0.602 194 3HG2 ILE 24 3HG2 ILE 24 -10.736 -3.160 -1.848 195 1HD1 ILE 24 1HD1 ILE 24 -8.769 -3.007 -2.408 196 2HD1 ILE 24 2HD1 ILE 24 -8.060 -4.265 -1.395 197 3HD1 ILE 24 3HD1 ILE 24 -7.100 -2.859 -1.860 198 H SER 25 H SER 25 -10.774 -4.087 2.907 199 HA SER 25 HA SER 25 -8.814 -3.356 4.907 200 1HB SER 25 1HB SER 25 -10.822 -5.609 4.951 201 2HB SER 25 2HB SER 25 -10.014 -4.850 6.307 202 HG SER 25 HG SER 25 -12.275 -4.095 5.019 203 H PHE 26 H PHE 26 -7.245 -4.775 5.702 204 HA PHE 26 HA PHE 26 -6.153 -6.592 3.714 205 1HB PHE 26 1HB PHE 26 -5.137 -5.563 6.358 206 2HB PHE 26 2HB PHE 26 -4.282 -6.791 5.434 207 HD1 PHE 26 HD1 PHE 26 -5.394 -3.277 5.446 208 HD2 PHE 26 HD2 PHE 26 -3.000 -6.231 3.529 209 HE1 PHE 26 HE1 PHE 26 -4.254 -1.515 4.161 210 HE2 PHE 26 HE2 PHE 26 -1.858 -4.474 2.242 211 HZ PHE 26 HZ PHE 26 -2.485 -2.116 2.559 212 H LEU 27 H LEU 27 -8.591 -7.098 5.519 213 HA LEU 27 HA LEU 27 -7.855 -9.240 7.266 214 1HB LEU 27 1HB LEU 27 -10.606 -8.644 6.175 215 2HB LEU 27 2HB LEU 27 -10.206 -9.502 7.649 216 HG LEU 27 HG LEU 27 -9.724 -6.558 7.170 217 1HD1 LEU 27 1HD1 LEU 27 -12.096 -7.073 7.326 218 2HD1 LEU 27 2HD1 LEU 27 -11.542 -6.213 8.762 219 3HD1 LEU 27 3HD1 LEU 27 -11.817 -7.954 8.828 220 1HD2 LEU 27 1HD2 LEU 27 -8.108 -7.510 8.717 221 2HD2 LEU 27 2HD2 LEU 27 -9.412 -8.234 9.657 222 3HD2 LEU 27 3HD2 LEU 27 -9.255 -6.480 9.576 223 H GLY 28 H GLY 28 -8.168 -9.064 3.931 224 1HA GLY 28 1HA GLY 28 -7.391 -11.217 2.882 225 2HA GLY 28 2HA GLY 28 -8.726 -11.962 3.749 226 H GLY 29 H GLY 29 -8.059 -9.373 1.403 227 1HA GLY 29 1HA GLY 29 -10.717 -9.873 0.236 228 2HA GLY 29 2HA GLY 29 -9.799 -8.387 0.055 229 H ILE 30 H ILE 30 -7.321 -10.026 -0.441 230 HA ILE 30 HA ILE 30 -7.746 -10.283 -3.312 231 HB ILE 30 HB ILE 30 -5.179 -10.365 -1.698 232 1HG1 ILE 30 1HG1 ILE 30 -4.843 -8.128 -2.965 233 2HG1 ILE 30 2HG1 ILE 30 -6.587 -8.160 -3.183 234 1HG2 ILE 30 1HG2 ILE 30 -4.051 -10.091 -3.867 235 2HG2 ILE 30 2HG2 ILE 30 -5.607 -10.267 -4.679 236 3HG2 ILE 30 3HG2 ILE 30 -4.939 -11.610 -3.751 237 1HD1 ILE 30 1HD1 ILE 30 -6.874 -8.209 -0.756 238 2HD1 ILE 30 2HD1 ILE 30 -5.966 -6.792 -1.285 239 3HD1 ILE 30 3HD1 ILE 30 -5.123 -8.158 -0.553 240 H ASP 31 H ASP 31 -7.760 -12.196 -4.372 241 HA ASP 31 HA ASP 31 -7.705 -14.673 -2.970 242 1HB ASP 31 1HB ASP 31 -9.041 -14.486 -4.973 243 2HB ASP 31 2HB ASP 31 -7.628 -14.049 -5.929 244 H LYS 32 H LYS 32 -6.131 -16.166 -2.763 245 HA LYS 32 HA LYS 32 -3.482 -15.124 -2.716 246 1HB LYS 32 1HB LYS 32 -2.939 -17.409 -1.790 247 2HB LYS 32 2HB LYS 32 -4.140 -16.483 -0.901 248 1HG LYS 32 1HG LYS 32 -5.924 -17.773 -1.967 249 2HG LYS 32 2HG LYS 32 -4.716 -18.706 -2.848 250 1HD LYS 32 1HD LYS 32 -3.838 -19.597 -0.790 251 2HD LYS 32 2HD LYS 32 -4.900 -18.556 0.157 252 1HE LYS 32 1HE LYS 32 -6.852 -19.698 -0.748 253 2HE LYS 32 2HE LYS 32 -5.810 -20.717 -1.740 254 1HZ LYS 32 1HZ LYS 32 -6.614 -21.755 0.358 255 2HZ LYS 32 2HZ LYS 32 -5.677 -20.638 1.225 256 3HZ LYS 32 3HZ LYS 32 -4.928 -21.750 0.183 257 H GLU 33 H GLU 33 -5.165 -16.776 -5.152 258 HA GLU 33 HA GLU 33 -2.698 -18.004 -6.185 259 1HB GLU 33 1HB GLU 33 -5.593 -18.573 -6.844 260 2HB GLU 33 2HB GLU 33 -4.216 -19.364 -7.599 261 1HG GLU 33 1HG GLU 33 -3.549 -20.282 -5.444 262 2HG GLU 33 2HG GLU 33 -4.926 -19.486 -4.678 263 H THR 34 H THR 34 -5.471 -16.035 -7.123 264 HA THR 34 HA THR 34 -4.303 -15.606 -9.776 265 HB THR 34 HB THR 34 -6.518 -14.515 -10.254 266 HG1 THR 34 HG1 THR 34 -7.198 -15.614 -7.698 267 1HG2 THR 34 1HG2 THR 34 -6.106 -16.839 -10.866 268 2HG2 THR 34 2HG2 THR 34 -7.774 -16.633 -10.328 269 3HG2 THR 34 3HG2 THR 34 -6.583 -17.365 -9.252 270 H GLY 35 H GLY 35 -4.887 -13.938 -6.788 271 1HA GLY 35 1HA GLY 35 -4.092 -11.852 -6.139 272 2HA GLY 35 2HA GLY 35 -3.561 -11.565 -7.792 273 H ILE 36 H ILE 36 -6.705 -12.689 -7.753 274 HA ILE 36 HA ILE 36 -7.758 -10.101 -8.497 275 HB ILE 36 HB ILE 36 -9.217 -12.739 -8.208 276 1HG1 ILE 36 1HG1 ILE 36 -7.367 -12.881 -9.851 277 2HG1 ILE 36 2HG1 ILE 36 -8.950 -13.042 -10.602 278 1HG2 ILE 36 1HG2 ILE 36 -10.883 -11.729 -9.695 279 2HG2 ILE 36 2HG2 ILE 36 -9.980 -10.216 -9.668 280 3HG2 ILE 36 3HG2 ILE 36 -10.712 -10.834 -8.186 281 1HD1 ILE 36 1HD1 ILE 36 -8.827 -10.723 -11.345 282 2HD1 ILE 36 2HD1 ILE 36 -7.469 -11.675 -11.943 283 3HD1 ILE 36 3HD1 ILE 36 -7.241 -10.567 -10.591 284 H VAL 37 H VAL 37 -8.988 -8.781 -7.202 285 HA VAL 37 HA VAL 37 -9.312 -9.506 -4.437 286 HB VAL 37 HB VAL 37 -10.585 -7.316 -4.281 287 1HG1 VAL 37 1HG1 VAL 37 -8.294 -7.463 -3.603 288 2HG1 VAL 37 2HG1 VAL 37 -8.528 -5.959 -4.496 289 3HG1 VAL 37 3HG1 VAL 37 -7.746 -7.334 -5.277 290 1HG2 VAL 37 1HG2 VAL 37 -10.286 -5.745 -6.137 291 2HG2 VAL 37 2HG2 VAL 37 -11.275 -7.131 -6.596 292 3HG2 VAL 37 3HG2 VAL 37 -9.590 -7.038 -7.110 293 H LYS 38 H LYS 38 -11.006 -10.324 -3.457 294 HA LYS 38 HA LYS 38 -13.413 -10.901 -5.021 295 1HB LYS 38 1HB LYS 38 -12.651 -11.821 -2.241 296 2HB LYS 38 2HB LYS 38 -13.977 -12.435 -3.215 297 1HG LYS 38 1HG LYS 38 -11.069 -12.667 -3.954 298 2HG LYS 38 2HG LYS 38 -12.007 -13.925 -3.152 299 1HD LYS 38 1HD LYS 38 -13.536 -14.000 -5.065 300 2HD LYS 38 2HD LYS 38 -12.584 -12.751 -5.873 301 1HE LYS 38 1HE LYS 38 -10.661 -14.210 -5.933 302 2HE LYS 38 2HE LYS 38 -11.524 -15.436 -5.008 303 1HZ LYS 38 1HZ LYS 38 -12.161 -14.522 -7.764 304 2HZ LYS 38 2HZ LYS 38 -13.114 -15.599 -6.866 305 3HZ LYS 38 3HZ LYS 38 -11.533 -16.031 -7.305 306 H GLU 39 H GLU 39 -12.220 -8.692 -2.803 307 HA GLU 39 HA GLU 39 -14.922 -7.830 -2.034 308 1HB GLU 39 1HB GLU 39 -13.698 -8.972 -0.170 309 2HB GLU 39 2HB GLU 39 -12.475 -7.719 -0.293 310 1HG GLU 39 1HG GLU 39 -14.024 -7.279 1.524 311 2HG GLU 39 2HG GLU 39 -14.094 -6.025 0.298 312 H ASP 40 H ASP 40 -14.820 -6.337 -3.706 313 HA ASP 40 HA ASP 40 -13.392 -3.910 -3.041 314 1HB ASP 40 1HB ASP 40 -12.044 -5.411 -4.654 315 2HB ASP 40 2HB ASP 40 -13.230 -4.917 -5.853 316 H CYS 41 H CYS 41 -13.930 -2.625 -5.451 317 HA CYS 41 HA CYS 41 -16.781 -2.644 -5.896 318 1HB CYS 41 1HB CYS 41 -16.560 -1.431 -3.743 319 2HB CYS 41 2HB CYS 41 -15.484 -0.276 -4.520 320 HG CYS 41 HG CYS 41 -17.329 1.019 -5.967 321 H GLU 42 H GLU 42 -13.588 -1.262 -6.439 322 HA GLU 42 HA GLU 42 -14.550 -0.017 -8.927 323 1HB GLU 42 1HB GLU 42 -12.378 0.694 -7.007 324 2HB GLU 42 2HB GLU 42 -12.187 1.132 -8.700 325 1HG GLU 42 1HG GLU 42 -14.557 1.885 -7.010 326 2HG GLU 42 2HG GLU 42 -13.159 2.923 -7.294 327 H ILE 43 H ILE 43 -11.858 -1.917 -7.568 328 HA ILE 43 HA ILE 43 -10.986 -2.532 -10.313 329 HB ILE 43 HB ILE 43 -8.891 -3.294 -9.369 330 1HG1 ILE 43 1HG1 ILE 43 -10.019 -2.540 -6.661 331 2HG1 ILE 43 2HG1 ILE 43 -9.854 -4.192 -7.245 332 1HG2 ILE 43 1HG2 ILE 43 -8.083 -1.155 -8.445 333 2HG2 ILE 43 2HG2 ILE 43 -9.756 -0.621 -8.279 334 3HG2 ILE 43 3HG2 ILE 43 -9.087 -0.940 -9.879 335 1HD1 ILE 43 1HD1 ILE 43 -8.052 -3.632 -5.747 336 2HD1 ILE 43 2HD1 ILE 43 -7.619 -2.245 -6.748 337 3HD1 ILE 43 3HD1 ILE 43 -7.429 -3.883 -7.379 338 H LYS 44 H LYS 44 -13.129 -3.647 -8.342 339 HA LYS 44 HA LYS 44 -12.663 -6.321 -7.820 340 1HB LYS 44 1HB LYS 44 -14.585 -5.274 -6.924 341 2HB LYS 44 2HB LYS 44 -15.176 -4.806 -8.510 342 1HG LYS 44 1HG LYS 44 -15.499 -7.237 -8.995 343 2HG LYS 44 2HG LYS 44 -15.105 -7.563 -7.306 344 1HD LYS 44 1HD LYS 44 -16.969 -6.192 -6.583 345 2HD LYS 44 2HD LYS 44 -17.336 -5.763 -8.253 346 1HE LYS 44 1HE LYS 44 -17.777 -8.154 -8.725 347 2HE LYS 44 2HE LYS 44 -17.495 -8.511 -7.020 348 1HZ LYS 44 1HZ LYS 44 -19.338 -7.024 -6.460 349 2HZ LYS 44 2HZ LYS 44 -19.849 -8.298 -7.458 350 3HZ LYS 44 3HZ LYS 44 -19.628 -6.748 -8.110 351 H GLY 45 H GLY 45 -12.057 -7.850 -9.131 352 1HA GLY 45 1HA GLY 45 -12.684 -9.320 -10.987 353 2HA GLY 45 2HA GLY 45 -13.099 -7.874 -11.894 354 H GLU 46 H GLU 46 -10.506 -6.754 -10.495 355 HA GLU 46 HA GLU 46 -8.731 -7.697 -12.641 356 1HB GLU 46 1HB GLU 46 -8.699 -5.155 -11.008 357 2HB GLU 46 2HB GLU 46 -7.418 -5.611 -12.122 358 1HG GLU 46 1HG GLU 46 -9.077 -5.621 -13.956 359 2HG GLU 46 2HG GLU 46 -10.291 -5.046 -12.814 360 H SER 47 H SER 47 -6.348 -7.591 -12.034 361 HA SER 47 HA SER 47 -6.010 -8.905 -9.423 362 1HB SER 47 1HB SER 47 -5.497 -10.340 -11.360 363 2HB SER 47 2HB SER 47 -4.329 -9.154 -11.935 364 HG SER 47 HG SER 47 -3.970 -11.122 -10.164 365 H VAL 48 H VAL 48 -4.172 -8.414 -8.176 366 HA VAL 48 HA VAL 48 -3.018 -5.764 -8.726 367 HB VAL 48 HB VAL 48 -2.372 -5.730 -6.342 368 1HG1 VAL 48 1HG1 VAL 48 -5.289 -6.309 -6.832 369 2HG1 VAL 48 2HG1 VAL 48 -4.487 -4.746 -6.999 370 3HG1 VAL 48 3HG1 VAL 48 -4.633 -5.498 -5.409 371 1HG2 VAL 48 1HG2 VAL 48 -3.239 -7.441 -4.810 372 2HG2 VAL 48 2HG2 VAL 48 -2.126 -8.136 -5.987 373 3HG2 VAL 48 3HG2 VAL 48 -3.865 -8.353 -6.183 374 H ALA 49 H ALA 49 -2.269 -8.796 -9.395 375 HA ALA 49 HA ALA 49 0.318 -9.145 -8.271 376 1HB ALA 49 1HB ALA 49 -1.095 -11.037 -8.933 377 2HB ALA 49 2HB ALA 49 0.482 -11.084 -9.722 378 3HB ALA 49 3HB ALA 49 -0.939 -10.554 -10.621 379 H GLY 50 H GLY 50 1.360 -7.213 -8.795 380 1HA GLY 50 1HA GLY 50 3.364 -6.806 -10.177 381 2HA GLY 50 2HA GLY 50 2.363 -7.163 -11.576 382 H ARG 51 H ARG 51 0.623 -5.430 -9.299 383 HA ARG 51 HA ARG 51 1.166 -2.916 -10.739 384 1HB ARG 51 1HB ARG 51 -1.406 -3.851 -9.443 385 2HB ARG 51 2HB ARG 51 -1.170 -2.287 -10.207 386 1HG ARG 51 1HG ARG 51 -0.792 -3.379 -12.354 387 2HG ARG 51 2HG ARG 51 -1.004 -4.955 -11.590 388 1HD ARG 51 1HD ARG 51 -3.291 -4.398 -11.010 389 2HD ARG 51 2HD ARG 51 -3.090 -2.778 -11.673 390 HE ARG 51 HE ARG 51 -2.508 -4.741 -13.636 391 1HH1 ARG 51 1HH1 ARG 51 -5.215 -3.323 -11.919 392 2HH1 ARG 51 2HH1 ARG 51 -6.338 -3.543 -13.231 393 1HH2 ARG 51 1HH2 ARG 51 -3.970 -5.006 -15.375 394 2HH2 ARG 51 2HH2 ARG 51 -5.625 -4.503 -15.190 395 H ILE 52 H ILE 52 0.932 -0.937 -9.480 396 HA ILE 52 HA ILE 52 1.756 -1.340 -6.705 397 HB ILE 52 HB ILE 52 1.732 1.137 -8.437 398 1HG1 ILE 52 1HG1 ILE 52 3.959 -0.534 -7.250 399 2HG1 ILE 52 2HG1 ILE 52 3.519 -0.428 -8.953 400 1HG2 ILE 52 1HG2 ILE 52 1.180 1.749 -6.136 401 2HG2 ILE 52 2HG2 ILE 52 2.796 2.305 -6.572 402 3HG2 ILE 52 3HG2 ILE 52 2.600 0.875 -5.558 403 1HD1 ILE 52 1HD1 ILE 52 4.622 1.805 -7.266 404 2HD1 ILE 52 2HD1 ILE 52 4.177 1.921 -8.969 405 3HD1 ILE 52 3HD1 ILE 52 5.506 0.873 -8.474 406 H LEU 53 H LEU 53 0.324 -1.264 -5.133 407 HA LEU 53 HA LEU 53 -2.399 -0.458 -5.776 408 1HB LEU 53 1HB LEU 53 -1.892 -2.666 -4.751 409 2HB LEU 53 2HB LEU 53 -1.304 -1.835 -3.325 410 HG LEU 53 HG LEU 53 -3.556 -0.919 -2.934 411 1HD1 LEU 53 1HD1 LEU 53 -4.348 -2.629 -5.288 412 2HD1 LEU 53 2HD1 LEU 53 -4.346 -0.867 -5.237 413 3HD1 LEU 53 3HD1 LEU 53 -5.453 -1.776 -4.210 414 1HD2 LEU 53 1HD2 LEU 53 -2.876 -3.024 -1.880 415 2HD2 LEU 53 2HD2 LEU 53 -3.504 -3.917 -3.265 416 3HD2 LEU 53 3HD2 LEU 53 -4.604 -3.003 -2.232 417 H VAL 54 H VAL 54 -2.890 1.607 -5.433 418 HA VAL 54 HA VAL 54 -1.876 2.872 -2.965 419 HB VAL 54 HB VAL 54 -2.617 4.244 -5.556 420 1HG1 VAL 54 1HG1 VAL 54 -1.692 6.256 -4.516 421 2HG1 VAL 54 2HG1 VAL 54 -1.429 5.358 -3.020 422 3HG1 VAL 54 3HG1 VAL 54 -3.069 5.631 -3.607 423 1HG2 VAL 54 1HG2 VAL 54 -0.208 4.744 -5.731 424 2HG2 VAL 54 2HG2 VAL 54 -0.549 3.016 -5.817 425 3HG2 VAL 54 3HG2 VAL 54 0.086 3.720 -4.327 426 H PHE 55 H PHE 55 -3.518 2.693 -1.564 427 HA PHE 55 HA PHE 55 -6.015 4.026 -2.290 428 1HB PHE 55 1HB PHE 55 -7.364 2.342 -1.124 429 2HB PHE 55 2HB PHE 55 -6.482 1.621 -2.461 430 HD1 PHE 55 HD1 PHE 55 -7.282 1.405 0.971 431 HD2 PHE 55 HD2 PHE 55 -4.276 0.416 -1.872 432 HE1 PHE 55 HE1 PHE 55 -6.409 -0.309 2.500 433 HE2 PHE 55 HE2 PHE 55 -3.394 -1.300 -0.346 434 HZ PHE 55 HZ PHE 55 -4.463 -1.663 1.841 435 HA PRO 56 HA PRO 56 -5.771 6.282 1.490 436 1HB PRO 56 1HB PRO 56 -8.142 5.534 2.787 437 2HB PRO 56 2HB PRO 56 -7.948 6.881 1.660 438 1HG PRO 56 1HG PRO 56 -8.990 4.132 1.172 439 2HG PRO 56 2HG PRO 56 -9.502 5.673 0.461 440 1HD PRO 56 1HD PRO 56 -8.012 3.938 -0.924 441 2HD PRO 56 2HD PRO 56 -7.753 5.690 -1.067 442 H GLY 57 H GLY 57 -7.297 3.141 2.270 443 1HA GLY 57 1HA GLY 57 -5.906 1.482 3.464 444 2HA GLY 57 2HA GLY 57 -5.295 2.824 4.422 445 H GLY 58 H GLY 58 -6.758 0.307 5.170 446 1HA GLY 58 1HA GLY 58 -8.223 1.366 7.299 447 2HA GLY 58 2HA GLY 58 -9.360 0.961 6.023 448 H LYS 59 H LYS 59 -8.152 -0.121 8.788 449 HA LYS 59 HA LYS 59 -8.150 -2.080 9.899 450 1HB LYS 59 1HB LYS 59 -10.111 -2.778 7.723 451 2HB LYS 59 2HB LYS 59 -9.814 -3.786 9.134 452 1HG LYS 59 1HG LYS 59 -10.497 -1.926 10.583 453 2HG LYS 59 2HG LYS 59 -10.847 -0.959 9.151 454 1HD LYS 59 1HD LYS 59 -12.155 -3.597 9.801 455 2HD LYS 59 2HD LYS 59 -12.853 -2.017 10.156 456 1HE LYS 59 1HE LYS 59 -12.792 -1.479 7.754 457 2HE LYS 59 2HE LYS 59 -12.156 -3.091 7.426 458 1HZ LYS 59 1HZ LYS 59 -14.606 -2.822 7.112 459 2HZ LYS 59 2HZ LYS 59 -14.744 -2.610 8.790 460 3HZ LYS 59 3HZ LYS 59 -14.162 -4.077 8.166 461 H GLY 60 H GLY 60 -6.024 -2.646 9.639 462 1HA GLY 60 1HA GLY 60 -5.452 -4.669 7.571 463 2HA GLY 60 2HA GLY 60 -4.250 -3.806 8.523 464 H SER 61 H SER 61 -4.766 -4.124 11.016 465 HA SER 61 HA SER 61 -4.837 -5.468 12.830 466 1HB SER 61 1HB SER 61 -7.134 -6.004 11.935 467 2HB SER 61 2HB SER 61 -6.432 -7.410 11.140 468 HG SER 61 HG SER 61 -7.050 -6.997 13.796 469 H THR 62 H THR 62 -4.580 -8.104 13.291 470 HA THR 62 HA THR 62 -1.863 -8.590 12.634 471 HB THR 62 HB THR 62 -3.778 -10.621 13.777 472 HG1 THR 62 HG1 THR 62 -4.035 -9.263 15.371 473 1HG2 THR 62 1HG2 THR 62 -1.774 -11.386 14.986 474 2HG2 THR 62 2HG2 THR 62 -0.817 -10.151 14.167 475 3HG2 THR 62 3HG2 THR 62 -1.550 -11.460 13.239 476 H VAL 63 H VAL 63 -4.868 -9.522 11.209 477 HA VAL 63 HA VAL 63 -3.943 -11.793 9.784 478 HB VAL 63 HB VAL 63 -6.297 -11.520 10.213 479 1HG1 VAL 63 1HG1 VAL 63 -7.637 -9.813 9.102 480 2HG1 VAL 63 2HG1 VAL 63 -6.169 -9.094 8.440 481 3HG1 VAL 63 3HG1 VAL 63 -6.439 -9.100 10.182 482 1HG2 VAL 63 1HG2 VAL 63 -5.696 -12.808 8.252 483 2HG2 VAL 63 2HG2 VAL 63 -5.680 -11.340 7.273 484 3HG2 VAL 63 3HG2 VAL 63 -7.193 -11.921 7.967 485 H GLY 64 H GLY 64 -4.096 -8.352 9.070 486 1HA GLY 64 1HA GLY 64 -3.331 -8.717 6.309 487 2HA GLY 64 2HA GLY 64 -3.552 -7.186 7.141 488 H SER 65 H SER 65 -1.382 -9.995 7.411 489 HA SER 65 HA SER 65 0.886 -8.177 7.093 490 1HB SER 65 1HB SER 65 2.051 -9.326 9.008 491 2HB SER 65 2HB SER 65 0.680 -8.327 9.487 492 HG SER 65 HG SER 65 -0.404 -10.069 10.086 493 H TYR 66 H TYR 66 0.456 -11.605 7.967 494 HA TYR 66 HA TYR 66 2.600 -12.442 6.311 495 1HB TYR 66 1HB TYR 66 0.425 -14.012 7.702 496 2HB TYR 66 2HB TYR 66 1.786 -14.754 6.868 497 HD1 TYR 66 HD1 TYR 66 0.733 -12.877 9.827 498 HD2 TYR 66 HD2 TYR 66 4.036 -14.620 7.787 499 HE1 TYR 66 HE1 TYR 66 2.092 -12.667 11.864 500 HE2 TYR 66 HE2 TYR 66 5.404 -14.415 9.819 501 HH TYR 66 HH TYR 66 4.043 -13.574 12.878 502 H VAL 67 H VAL 67 -0.687 -11.811 5.630 503 HA VAL 67 HA VAL 67 -1.185 -13.538 3.490 504 HB VAL 67 HB VAL 67 -2.106 -10.670 3.821 505 1HG1 VAL 67 1HG1 VAL 67 -2.350 -11.438 1.514 506 2HG1 VAL 67 2HG1 VAL 67 -3.922 -11.267 2.294 507 3HG1 VAL 67 3HG1 VAL 67 -3.214 -12.868 2.075 508 1HG2 VAL 67 1HG2 VAL 67 -2.748 -12.083 5.696 509 2HG2 VAL 67 2HG2 VAL 67 -3.424 -13.273 4.585 510 3HG2 VAL 67 3HG2 VAL 67 -4.158 -11.674 4.717 511 H LEU 68 H LEU 68 0.397 -10.373 3.572 512 HA LEU 68 HA LEU 68 0.864 -10.114 0.813 513 1HB LEU 68 1HB LEU 68 2.229 -8.963 3.234 514 2HB LEU 68 2HB LEU 68 2.807 -8.621 1.618 515 HG LEU 68 HG LEU 68 1.451 -6.786 2.370 516 1HD1 LEU 68 1HD1 LEU 68 -0.060 -8.438 0.358 517 2HD1 LEU 68 2HD1 LEU 68 1.297 -7.364 0.015 518 3HD1 LEU 68 3HD1 LEU 68 -0.226 -6.700 0.609 519 1HD2 LEU 68 1HD2 LEU 68 -0.748 -8.803 2.807 520 2HD2 LEU 68 2HD2 LEU 68 -0.918 -7.053 2.937 521 3HD2 LEU 68 3HD2 LEU 68 0.125 -7.923 4.063 522 H LEU 69 H LEU 69 2.705 -11.651 3.386 523 HA LEU 69 HA LEU 69 5.045 -12.143 1.879 524 1HB LEU 69 1HB LEU 69 4.988 -12.169 4.331 525 2HB LEU 69 2HB LEU 69 3.950 -13.581 4.295 526 HG LEU 69 HG LEU 69 5.764 -14.895 3.290 527 1HD1 LEU 69 1HD1 LEU 69 7.383 -12.376 3.614 528 2HD1 LEU 69 2HD1 LEU 69 6.917 -13.133 2.091 529 3HD1 LEU 69 3HD1 LEU 69 8.026 -13.960 3.183 530 1HD2 LEU 69 1HD2 LEU 69 6.616 -13.442 5.789 531 2HD2 LEU 69 2HD2 LEU 69 7.171 -15.029 5.256 532 3HD2 LEU 69 3HD2 LEU 69 5.487 -14.795 5.728 533 H ASN 70 H ASN 70 2.118 -14.050 2.482 534 HA ASN 70 HA ASN 70 3.024 -16.381 1.112 535 1HB ASN 70 1HB ASN 70 0.993 -16.019 2.754 536 2HB ASN 70 2HB ASN 70 0.128 -15.785 1.232 537 1HD2 ASN 70 1HD2 ASN 70 -0.955 -17.603 1.061 538 2HD2 ASN 70 2HD2 ASN 70 -0.259 -19.182 0.989 539 H LEU 71 H LEU 71 1.092 -13.580 0.145 540 HA LEU 71 HA LEU 71 0.586 -14.388 -2.505 541 1HB LEU 71 1HB LEU 71 0.949 -11.592 -1.411 542 2HB LEU 71 2HB LEU 71 0.253 -11.985 -2.972 543 HG LEU 71 HG LEU 71 -0.924 -12.708 -0.284 544 1HD1 LEU 71 1HD1 LEU 71 -1.788 -10.690 -2.351 545 2HD1 LEU 71 2HD1 LEU 71 -1.073 -10.328 -0.779 546 3HD1 LEU 71 3HD1 LEU 71 -2.660 -11.095 -0.871 547 1HD2 LEU 71 1HD2 LEU 71 -1.448 -14.396 -1.951 548 2HD2 LEU 71 2HD2 LEU 71 -1.980 -13.146 -3.076 549 3HD2 LEU 71 3HD2 LEU 71 -2.879 -13.431 -1.585 550 H ARG 72 H ARG 72 3.296 -12.772 -0.998 551 HA ARG 72 HA ARG 72 4.653 -11.970 -3.321 552 1HB ARG 72 1HB ARG 72 5.054 -11.146 -0.990 553 2HB ARG 72 2HB ARG 72 5.853 -12.668 -0.636 554 1HG ARG 72 1HG ARG 72 6.829 -11.047 -2.931 555 2HG ARG 72 2HG ARG 72 7.209 -10.522 -1.290 556 1HD ARG 72 1HD ARG 72 8.152 -12.772 -0.842 557 2HD ARG 72 2HD ARG 72 7.864 -13.197 -2.529 558 HE ARG 72 HE ARG 72 9.706 -11.058 -1.654 559 1HH1 ARG 72 1HH1 ARG 72 8.791 -13.616 -3.839 560 2HH1 ARG 72 2HH1 ARG 72 10.238 -13.511 -4.792 561 1HH2 ARG 72 1HH2 ARG 72 11.636 -10.912 -2.862 562 2HH2 ARG 72 2HH2 ARG 72 11.864 -11.966 -4.241 563 H LYS 73 H LYS 73 4.741 -14.984 -1.475 564 HA LYS 73 HA LYS 73 6.946 -16.089 -2.887 565 1HB LYS 73 1HB LYS 73 4.730 -17.552 -1.442 566 2HB LYS 73 2HB LYS 73 6.266 -18.243 -1.943 567 1HG LYS 73 1HG LYS 73 7.270 -16.344 -0.455 568 2HG LYS 73 2HG LYS 73 5.667 -16.366 0.285 569 1HD LYS 73 1HD LYS 73 5.966 -18.876 0.506 570 2HD LYS 73 2HD LYS 73 7.661 -18.609 0.094 571 1HE LYS 73 1HE LYS 73 7.655 -18.609 2.420 572 2HE LYS 73 2HE LYS 73 7.637 -16.894 2.008 573 1HZ LYS 73 1HZ LYS 73 5.271 -16.844 2.392 574 2HZ LYS 73 2HZ LYS 73 6.050 -17.455 3.768 575 3HZ LYS 73 3HZ LYS 73 5.243 -18.509 2.710 576 H ASN 74 H ASN 74 3.536 -15.887 -3.526 577 HA ASN 74 HA ASN 74 3.681 -17.900 -5.630 578 1HB ASN 74 1HB ASN 74 1.692 -17.606 -4.032 579 2HB ASN 74 2HB ASN 74 1.287 -16.183 -4.988 580 1HD2 ASN 74 1HD2 ASN 74 -0.683 -17.160 -5.599 581 2HD2 ASN 74 2HD2 ASN 74 -0.726 -18.407 -6.799 582 H GLY 75 H GLY 75 4.104 -14.578 -5.247 583 1HA GLY 75 1HA GLY 75 4.931 -13.114 -6.858 584 2HA GLY 75 2HA GLY 75 4.481 -14.266 -8.106 585 H VAL 76 H VAL 76 1.975 -13.706 -5.930 586 HA VAL 76 HA VAL 76 0.632 -12.036 -7.932 587 HB VAL 76 HB VAL 76 -1.479 -12.698 -6.800 588 1HG1 VAL 76 1HG1 VAL 76 0.262 -14.985 -7.708 589 2HG1 VAL 76 2HG1 VAL 76 -0.655 -13.903 -8.755 590 3HG1 VAL 76 3HG1 VAL 76 -1.501 -14.985 -7.649 591 1HG2 VAL 76 1HG2 VAL 76 -1.425 -14.589 -5.224 592 2HG2 VAL 76 2HG2 VAL 76 -0.623 -13.157 -4.577 593 3HG2 VAL 76 3HG2 VAL 76 0.336 -14.499 -5.202 594 H ALA 77 H ALA 77 2.468 -11.352 -5.525 595 HA ALA 77 HA ALA 77 0.817 -9.558 -3.986 596 1HB ALA 77 1HB ALA 77 2.765 -10.660 -2.976 597 2HB ALA 77 2HB ALA 77 2.899 -8.903 -2.906 598 3HB ALA 77 3HB ALA 77 3.823 -9.810 -4.103 599 HA PRO 78 HA PRO 78 1.254 -5.997 -6.596 600 1HB PRO 78 1HB PRO 78 1.295 -4.001 -4.750 601 2HB PRO 78 2HB PRO 78 -0.177 -4.884 -5.174 602 1HG PRO 78 1HG PRO 78 1.646 -5.250 -2.831 603 2HG PRO 78 2HG PRO 78 -0.126 -5.269 -2.885 604 1HD PRO 78 1HD PRO 78 1.361 -7.534 -2.800 605 2HD PRO 78 2HD PRO 78 -0.207 -7.446 -3.628 606 H LYS 79 H LYS 79 2.744 -4.308 -7.186 607 HA LYS 79 HA LYS 79 5.469 -4.979 -6.681 608 1HB LYS 79 1HB LYS 79 4.108 -2.768 -8.203 609 2HB LYS 79 2HB LYS 79 5.850 -2.803 -8.005 610 1HG LYS 79 1HG LYS 79 4.261 -5.044 -9.225 611 2HG LYS 79 2HG LYS 79 5.021 -3.750 -10.154 612 1HD LYS 79 1HD LYS 79 7.207 -4.410 -9.165 613 2HD LYS 79 2HD LYS 79 6.401 -5.777 -8.392 614 1HE LYS 79 1HE LYS 79 5.793 -6.685 -10.546 615 2HE LYS 79 2HE LYS 79 6.451 -5.272 -11.367 616 1HZ LYS 79 1HZ LYS 79 7.969 -7.327 -9.846 617 2HZ LYS 79 2HZ LYS 79 8.650 -5.891 -10.432 618 3HZ LYS 79 3HZ LYS 79 8.026 -7.036 -11.517 619 H ALA 80 H ALA 80 3.230 -2.617 -5.459 620 HA ALA 80 HA ALA 80 4.840 -2.040 -3.187 621 1HB ALA 80 1HB ALA 80 5.204 0.349 -3.595 622 2HB ALA 80 2HB ALA 80 4.556 0.168 -5.224 623 3HB ALA 80 3HB ALA 80 6.057 -0.643 -4.776 624 H ILE 81 H ILE 81 3.779 -0.404 -1.777 625 HA ILE 81 HA ILE 81 0.945 0.024 -2.403 626 HB ILE 81 HB ILE 81 1.950 -1.122 0.216 627 1HG1 ILE 81 1HG1 ILE 81 0.174 -2.342 -1.911 628 2HG1 ILE 81 2HG1 ILE 81 1.848 -2.785 -1.600 629 1HG2 ILE 81 1HG2 ILE 81 -0.411 -1.195 0.868 630 2HG2 ILE 81 2HG2 ILE 81 -0.851 -0.401 -0.645 631 3HG2 ILE 81 3HG2 ILE 81 0.124 0.455 0.550 632 1HD1 ILE 81 1HD1 ILE 81 -0.447 -3.125 0.312 633 2HD1 ILE 81 2HD1 ILE 81 1.229 -3.582 0.616 634 3HD1 ILE 81 3HD1 ILE 81 0.306 -4.399 -0.647 635 H ILE 82 H ILE 82 0.562 2.141 -2.213 636 HA ILE 82 HA ILE 82 2.067 3.652 -0.165 637 HB ILE 82 HB ILE 82 0.760 4.948 -2.557 638 1HG1 ILE 82 1HG1 ILE 82 2.350 3.261 -3.424 639 2HG1 ILE 82 2HG1 ILE 82 2.898 4.902 -3.742 640 1HG2 ILE 82 1HG2 ILE 82 3.094 5.803 -0.834 641 2HG2 ILE 82 2HG2 ILE 82 1.429 6.360 -0.643 642 3HG2 ILE 82 3HG2 ILE 82 2.328 6.748 -2.110 643 1HD1 ILE 82 1HD1 ILE 82 4.449 4.741 -1.861 644 2HD1 ILE 82 2HD1 ILE 82 4.735 3.479 -3.061 645 3HD1 ILE 82 3HD1 ILE 82 3.899 3.092 -1.557 646 H ASN 83 H ASN 83 0.831 4.282 1.508 647 HA ASN 83 HA ASN 83 -2.080 4.441 1.063 648 1HB ASN 83 1HB ASN 83 -0.595 3.413 3.486 649 2HB ASN 83 2HB ASN 83 -2.318 3.750 3.470 650 1HD2 ASN 83 1HD2 ASN 83 -2.704 2.792 0.756 651 2HD2 ASN 83 2HD2 ASN 83 -2.595 1.068 0.840 652 H LYS 84 H LYS 84 -3.255 5.850 2.427 653 HA LYS 84 HA LYS 84 -1.845 8.292 3.099 654 1HB LYS 84 1HB LYS 84 -4.164 8.129 1.991 655 2HB LYS 84 2HB LYS 84 -4.771 7.672 3.570 656 1HG LYS 84 1HG LYS 84 -3.330 10.255 3.017 657 2HG LYS 84 2HG LYS 84 -5.081 10.073 2.961 658 1HD LYS 84 1HD LYS 84 -5.032 9.332 5.327 659 2HD LYS 84 2HD LYS 84 -3.295 9.647 5.357 660 1HE LYS 84 1HE LYS 84 -4.477 11.520 6.318 661 2HE LYS 84 2HE LYS 84 -3.745 12.003 4.789 662 1HZ LYS 84 1HZ LYS 84 -6.003 12.836 5.001 663 2HZ LYS 84 2HZ LYS 84 -6.594 11.256 5.175 664 3HZ LYS 84 3HZ LYS 84 -5.888 11.739 3.714 665 H LYS 85 H LYS 85 -3.684 5.736 4.669 666 HA LYS 85 HA LYS 85 -2.355 6.316 7.209 667 1HB LYS 85 1HB LYS 85 -4.784 7.355 6.872 668 2HB LYS 85 2HB LYS 85 -5.288 5.718 7.256 669 1HG LYS 85 1HG LYS 85 -3.561 7.462 9.001 670 2HG LYS 85 2HG LYS 85 -5.290 7.191 9.211 671 1HD LYS 85 1HD LYS 85 -4.789 4.752 9.448 672 2HD LYS 85 2HD LYS 85 -3.074 5.164 9.442 673 1HE LYS 85 1HE LYS 85 -3.455 6.618 11.403 674 2HE LYS 85 2HE LYS 85 -5.140 6.097 11.430 675 1HZ LYS 85 1HZ LYS 85 -4.137 4.712 12.954 676 2HZ LYS 85 2HZ LYS 85 -2.710 4.551 12.051 677 3HZ LYS 85 3HZ LYS 85 -4.125 3.750 11.554 678 H THR 86 H THR 86 -1.385 4.436 7.696 679 HA THR 86 HA THR 86 -2.829 1.952 7.061 680 HB THR 86 HB THR 86 -0.897 2.386 5.522 681 HG1 THR 86 HG1 THR 86 -0.793 0.285 5.424 682 1HG2 THR 86 1HG2 THR 86 0.735 2.000 8.036 683 2HG2 THR 86 2HG2 THR 86 0.627 3.475 7.073 684 3HG2 THR 86 3HG2 THR 86 1.383 2.033 6.394 685 H GLU 87 H GLU 87 -1.390 0.082 8.264 686 HA GLU 87 HA GLU 87 -1.306 0.919 11.090 687 1HB GLU 87 1HB GLU 87 -2.200 -1.713 9.900 688 2HB GLU 87 2HB GLU 87 -1.939 -1.456 11.619 689 1HG GLU 87 1HG GLU 87 -3.676 0.260 11.627 690 2HG GLU 87 2HG GLU 87 -3.939 0.002 9.904 691 H THR 88 H THR 88 0.262 -0.077 12.430 692 HA THR 88 HA THR 88 2.793 -0.278 11.258 693 HB THR 88 HB THR 88 2.147 -1.444 13.952 694 HG1 THR 88 HG1 THR 88 1.621 0.475 14.681 695 1HG2 THR 88 1HG2 THR 88 4.465 -1.589 13.174 696 2HG2 THR 88 2HG2 THR 88 4.326 -0.480 14.537 697 3HG2 THR 88 3HG2 THR 88 4.486 0.151 12.897 698 H ILE 89 H ILE 89 0.512 -2.774 12.276 699 HA ILE 89 HA ILE 89 2.204 -5.002 12.082 700 HB ILE 89 HB ILE 89 -0.761 -4.956 11.504 701 1HG1 ILE 89 1HG1 ILE 89 0.659 -5.316 14.157 702 2HG1 ILE 89 2HG1 ILE 89 -0.226 -3.876 13.668 703 1HG2 ILE 89 1HG2 ILE 89 0.301 -7.028 10.858 704 2HG2 ILE 89 2HG2 ILE 89 -0.671 -7.286 12.305 705 3HG2 ILE 89 3HG2 ILE 89 1.082 -7.153 12.434 706 1HD1 ILE 89 1HD1 ILE 89 -1.409 -6.618 14.017 707 2HD1 ILE 89 2HD1 ILE 89 -2.284 -5.153 13.568 708 3HD1 ILE 89 3HD1 ILE 89 -1.535 -5.279 15.161 709 H ILE 90 H ILE 90 0.238 -3.344 9.685 710 HA ILE 90 HA ILE 90 0.537 -5.164 7.560 711 HB ILE 90 HB ILE 90 0.182 -2.167 7.373 712 1HG1 ILE 90 1HG1 ILE 90 -1.933 -4.329 7.455 713 2HG1 ILE 90 2HG1 ILE 90 -1.508 -3.304 8.824 714 1HG2 ILE 90 1HG2 ILE 90 0.828 -3.204 5.267 715 2HG2 ILE 90 2HG2 ILE 90 -0.852 -2.671 5.205 716 3HG2 ILE 90 3HG2 ILE 90 -0.476 -4.380 5.430 717 1HD1 ILE 90 1HD1 ILE 90 -2.667 -2.402 6.200 718 2HD1 ILE 90 2HD1 ILE 90 -2.185 -1.337 7.520 719 3HD1 ILE 90 3HD1 ILE 90 -3.501 -2.488 7.752 720 H ALA 91 H ALA 91 2.402 -2.354 8.583 721 HA ALA 91 HA ALA 91 4.261 -2.308 6.482 722 1HB ALA 91 1HB ALA 91 3.983 -0.449 8.033 723 2HB ALA 91 2HB ALA 91 5.663 -0.986 7.982 724 3HB ALA 91 3HB ALA 91 4.634 -1.437 9.341 725 H VAL 92 H VAL 92 4.227 -4.059 9.547 726 HA VAL 92 HA VAL 92 6.806 -5.184 9.355 727 HB VAL 92 HB VAL 92 4.358 -6.333 10.712 728 1HG1 VAL 92 1HG1 VAL 92 6.177 -7.971 10.358 729 2HG1 VAL 92 2HG1 VAL 92 5.896 -7.620 12.064 730 3HG1 VAL 92 3HG1 VAL 92 7.275 -6.901 11.230 731 1HG2 VAL 92 1HG2 VAL 92 5.247 -5.297 12.752 732 2HG2 VAL 92 2HG2 VAL 92 4.865 -4.089 11.523 733 3HG2 VAL 92 3HG2 VAL 92 6.543 -4.558 11.807 734 H GLY 93 H GLY 93 3.634 -6.345 8.266 735 1HA GLY 93 1HA GLY 93 4.530 -8.809 7.209 736 2HA GLY 93 2HA GLY 93 3.057 -7.970 6.745 737 H ALA 94 H ALA 94 4.186 -5.603 5.765 738 HA ALA 94 HA ALA 94 4.893 -6.337 3.133 739 1HB ALA 94 1HB ALA 94 3.780 -4.230 3.694 740 2HB ALA 94 2HB ALA 94 5.254 -3.964 2.763 741 3HB ALA 94 3HB ALA 94 5.246 -3.675 4.504 742 H ALA 95 H ALA 95 6.796 -5.499 5.957 743 HA ALA 95 HA ALA 95 9.289 -5.178 4.672 744 1HB ALA 95 1HB ALA 95 8.903 -4.424 6.949 745 2HB ALA 95 2HB ALA 95 10.263 -5.545 6.893 746 3HB ALA 95 3HB ALA 95 8.694 -6.091 7.488 747 H MET 96 H MET 96 7.436 -7.967 5.526 748 HA MET 96 HA MET 96 9.606 -9.853 5.299 749 1HB MET 96 1HB MET 96 6.636 -10.393 5.144 750 2HB MET 96 2HB MET 96 7.905 -11.550 5.510 751 1HG MET 96 1HG MET 96 8.340 -10.489 7.616 752 2HG MET 96 2HG MET 96 7.196 -9.198 7.242 753 1HE MET 96 1HE MET 96 5.710 -9.409 9.312 754 2HE MET 96 2HE MET 96 6.881 -10.555 9.961 755 3HE MET 96 3HE MET 96 5.159 -10.937 9.998 756 H ALA 97 H ALA 97 6.933 -8.706 3.321 757 HA ALA 97 HA ALA 97 7.509 -10.546 1.171 758 1HB ALA 97 1HB ALA 97 5.202 -9.986 1.736 759 2HB ALA 97 2HB ALA 97 5.585 -9.540 0.073 760 3HB ALA 97 3HB ALA 97 5.506 -8.297 1.322 761 H GLU 98 H GLU 98 8.932 -7.748 2.101 762 HA GLU 98 HA GLU 98 10.345 -6.266 1.126 763 1HB GLU 98 1HB GLU 98 10.137 -8.093 -1.280 764 2HB GLU 98 2HB GLU 98 11.331 -6.821 -1.063 765 1HG GLU 98 1HG GLU 98 12.182 -8.017 0.927 766 2HG GLU 98 2HG GLU 98 11.039 -9.318 0.590 767 H ILE 99 H ILE 99 7.617 -5.711 1.129 768 HA ILE 99 HA ILE 99 7.198 -4.298 -1.419 769 HB ILE 99 HB ILE 99 5.131 -5.062 0.650 770 1HG1 ILE 99 1HG1 ILE 99 5.615 -6.139 -2.138 771 2HG1 ILE 99 2HG1 ILE 99 6.028 -6.976 -0.647 772 1HG2 ILE 99 1HG2 ILE 99 4.585 -2.972 -0.507 773 2HG2 ILE 99 2HG2 ILE 99 3.490 -4.269 -0.984 774 3HG2 ILE 99 3HG2 ILE 99 4.796 -3.776 -2.063 775 1HD1 ILE 99 1HD1 ILE 99 3.647 -7.015 -0.044 776 2HD1 ILE 99 2HD1 ILE 99 3.989 -7.859 -1.555 777 3HD1 ILE 99 3HD1 ILE 99 3.267 -6.250 -1.588 778 HA PRO 100 HA PRO 100 8.454 -0.934 1.442 779 1HB PRO 100 1HB PRO 100 8.840 0.832 -0.643 780 2HB PRO 100 2HB PRO 100 10.077 -0.249 0.003 781 1HG PRO 100 1HG PRO 100 8.337 -0.586 -2.406 782 2HG PRO 100 2HG PRO 100 10.058 -0.967 -2.200 783 1HD PRO 100 1HD PRO 100 8.190 -2.883 -2.128 784 2HD PRO 100 2HD PRO 100 9.614 -2.940 -1.067 785 H LEU 101 H LEU 101 6.946 0.226 2.441 786 HA LEU 101 HA LEU 101 4.909 1.545 0.798 787 1HB LEU 101 1HB LEU 101 3.324 1.240 2.755 788 2HB LEU 101 2HB LEU 101 3.654 -0.159 1.759 789 HG LEU 101 HG LEU 101 5.311 -0.884 3.547 790 1HD1 LEU 101 1HD1 LEU 101 5.535 1.276 4.690 791 2HD1 LEU 101 2HD1 LEU 101 4.985 0.007 5.784 792 3HD1 LEU 101 3HD1 LEU 101 3.838 1.192 5.161 793 1HD2 LEU 101 1HD2 LEU 101 2.388 -0.665 4.247 794 2HD2 LEU 101 2HD2 LEU 101 3.535 -1.803 4.952 795 3HD2 LEU 101 3HD2 LEU 101 3.127 -1.911 3.241 796 H VAL 102 H VAL 102 4.174 3.534 1.482 797 HA VAL 102 HA VAL 102 5.634 4.790 3.694 798 HB VAL 102 HB VAL 102 5.941 6.844 2.337 799 1HG1 VAL 102 1HG1 VAL 102 7.797 5.288 2.546 800 2HG1 VAL 102 2HG1 VAL 102 7.797 6.033 0.947 801 3HG1 VAL 102 3HG1 VAL 102 7.218 4.379 1.150 802 1HG2 VAL 102 1HG2 VAL 102 5.682 6.774 -0.082 803 2HG2 VAL 102 2HG2 VAL 102 4.142 6.456 0.719 804 3HG2 VAL 102 3HG2 VAL 102 5.064 5.126 0.019 805 H GLU 103 H GLU 103 4.570 6.677 4.565 806 HA GLU 103 HA GLU 103 1.675 6.604 4.150 807 1HB GLU 103 1HB GLU 103 3.335 7.960 6.279 808 2HB GLU 103 2HB GLU 103 1.587 8.061 6.173 809 1HG GLU 103 1HG GLU 103 1.531 5.560 6.384 810 2HG GLU 103 2HG GLU 103 3.255 5.635 6.758 811 H VAL 104 H VAL 104 0.779 7.997 2.809 812 HA VAL 104 HA VAL 104 2.054 10.630 2.471 813 HB VAL 104 HB VAL 104 2.111 9.450 0.376 814 1HG1 VAL 104 1HG1 VAL 104 0.325 7.825 0.837 815 2HG1 VAL 104 2HG1 VAL 104 0.162 8.579 -0.748 816 3HG1 VAL 104 3HG1 VAL 104 -0.870 9.098 0.585 817 1HG2 VAL 104 1HG2 VAL 104 0.777 10.954 -1.051 818 2HG2 VAL 104 2HG2 VAL 104 1.667 11.813 0.207 819 3HG2 VAL 104 3HG2 VAL 104 -0.066 11.530 0.386 820 H ARG 105 H ARG 105 0.997 12.214 3.426 821 HA ARG 105 HA ARG 105 -1.777 11.812 4.222 822 1HB ARG 105 1HB ARG 105 -0.038 12.622 5.835 823 2HB ARG 105 2HB ARG 105 0.075 14.104 4.895 824 1HG ARG 105 1HG ARG 105 -2.283 14.574 5.361 825 2HG ARG 105 2HG ARG 105 -2.382 13.092 6.313 826 1HD ARG 105 1HD ARG 105 -0.578 15.440 6.884 827 2HD ARG 105 2HD ARG 105 -2.084 15.071 7.725 828 HE ARG 105 HE ARG 105 -0.544 12.801 7.972 829 1HH1 ARG 105 1HH1 ARG 105 -0.116 16.185 8.748 830 2HH1 ARG 105 2HH1 ARG 105 0.814 15.874 10.184 831 1HH2 ARG 105 1HH2 ARG 105 0.697 12.380 9.865 832 2HH2 ARG 105 2HH2 ARG 105 1.269 13.716 10.822 833 H ASP 106 H ASP 106 0.132 13.697 2.032 834 HA ASP 106 HA ASP 106 -1.742 15.770 1.535 835 1HB ASP 106 1HB ASP 106 0.724 15.869 1.053 836 2HB ASP 106 2HB ASP 106 0.447 14.782 -0.303 837 H GLU 107 H GLU 107 -3.634 15.574 0.541 838 HA GLU 107 HA GLU 107 -4.391 13.217 -0.852 839 1HB GLU 107 1HB GLU 107 -5.962 14.740 0.372 840 2HB GLU 107 2HB GLU 107 -5.787 15.890 -0.941 841 1HG GLU 107 1HG GLU 107 -6.659 14.223 -2.510 842 2HG GLU 107 2HG GLU 107 -6.863 13.088 -1.179 843 H LYS 108 H LYS 108 -2.835 16.123 -1.810 844 HA LYS 108 HA LYS 108 -3.621 16.220 -4.509 845 1HB LYS 108 1HB LYS 108 -1.404 17.364 -2.921 846 2HB LYS 108 2HB LYS 108 -1.145 17.254 -4.655 847 1HG LYS 108 1HG LYS 108 -3.386 18.412 -4.918 848 2HG LYS 108 2HG LYS 108 -3.282 18.756 -3.190 849 1HD LYS 108 1HD LYS 108 -1.309 20.037 -3.472 850 2HD LYS 108 2HD LYS 108 -1.104 19.480 -5.133 851 1HE LYS 108 1HE LYS 108 -3.303 21.254 -4.083 852 2HE LYS 108 2HE LYS 108 -1.962 21.747 -5.117 853 1HZ LYS 108 1HZ LYS 108 -2.835 20.156 -6.802 854 2HZ LYS 108 2HZ LYS 108 -3.873 21.455 -6.477 855 3HZ LYS 108 3HZ LYS 108 -4.202 19.926 -5.824 856 H PHE 109 H PHE 109 -1.493 14.076 -2.853 857 HA PHE 109 HA PHE 109 -0.062 13.120 -5.101 858 1HB PHE 109 1HB PHE 109 0.713 12.496 -2.918 859 2HB PHE 109 2HB PHE 109 -0.845 11.787 -2.503 860 HD1 PHE 109 HD1 PHE 109 1.800 11.429 -5.120 861 HD2 PHE 109 HD2 PHE 109 -1.006 9.501 -2.570 862 HE1 PHE 109 HE1 PHE 109 2.579 9.239 -5.925 863 HE2 PHE 109 HE2 PHE 109 -0.229 7.308 -3.367 864 HZ PHE 109 HZ PHE 109 1.566 7.174 -5.046 865 H PHE 110 H PHE 110 -3.026 11.997 -3.516 866 HA PHE 110 HA PHE 110 -3.602 9.967 -5.424 867 1HB PHE 110 1HB PHE 110 -5.502 11.354 -3.521 868 2HB PHE 110 2HB PHE 110 -5.751 9.797 -4.296 869 HD1 PHE 110 HD1 PHE 110 -4.108 11.587 -1.601 870 HD2 PHE 110 HD2 PHE 110 -4.486 7.831 -3.560 871 HE1 PHE 110 HE1 PHE 110 -3.052 10.485 0.324 872 HE2 PHE 110 HE2 PHE 110 -3.427 6.721 -1.634 873 HZ PHE 110 HZ PHE 110 -2.704 8.048 0.308 874 H GLU 111 H GLU 111 -4.285 13.345 -5.170 875 HA GLU 111 HA GLU 111 -6.319 13.527 -7.113 876 1HB GLU 111 1HB GLU 111 -5.816 15.222 -5.374 877 2HB GLU 111 2HB GLU 111 -4.302 15.578 -6.191 878 1HG GLU 111 1HG GLU 111 -5.488 16.354 -8.125 879 2HG GLU 111 2HG GLU 111 -7.028 15.921 -7.387 880 H ALA 112 H ALA 112 -2.805 13.666 -7.201 881 HA ALA 112 HA ALA 112 -2.696 14.365 -9.996 882 1HB ALA 112 1HB ALA 112 -0.489 13.460 -8.151 883 2HB ALA 112 2HB ALA 112 -0.971 15.134 -8.425 884 3HB ALA 112 3HB ALA 112 -0.282 14.186 -9.743 885 H VAL 113 H VAL 113 -1.779 11.481 -8.079 886 HA VAL 113 HA VAL 113 -1.160 9.949 -10.400 887 HB VAL 113 HB VAL 113 -0.161 9.490 -8.157 888 1HG1 VAL 113 1HG1 VAL 113 -2.878 8.338 -7.532 889 2HG1 VAL 113 2HG1 VAL 113 -2.119 9.724 -6.750 890 3HG1 VAL 113 3HG1 VAL 113 -1.426 8.113 -6.557 891 1HG2 VAL 113 1HG2 VAL 113 -0.000 7.844 -9.919 892 2HG2 VAL 113 2HG2 VAL 113 -1.580 7.191 -9.491 893 3HG2 VAL 113 3HG2 VAL 113 -0.231 7.038 -8.367 894 H LYS 114 H LYS 114 -2.343 8.469 -11.498 895 HA LYS 114 HA LYS 114 -5.108 8.020 -10.645 896 1HB LYS 114 1HB LYS 114 -4.241 8.835 -13.420 897 2HB LYS 114 2HB LYS 114 -5.866 8.326 -12.980 898 1HG LYS 114 1HG LYS 114 -6.134 10.228 -11.544 899 2HG LYS 114 2HG LYS 114 -4.450 10.696 -11.787 900 1HD LYS 114 1HD LYS 114 -4.943 10.973 -14.199 901 2HD LYS 114 2HD LYS 114 -6.644 10.664 -13.851 902 1HE LYS 114 1HE LYS 114 -6.199 13.060 -13.984 903 2HE LYS 114 2HE LYS 114 -6.694 12.592 -12.358 904 1HZ LYS 114 1HZ LYS 114 -3.874 12.998 -13.208 905 2HZ LYS 114 2HZ LYS 114 -4.415 12.687 -11.634 906 3HZ LYS 114 3HZ LYS 114 -4.805 14.154 -12.390 907 H THR 115 H THR 115 -6.014 6.062 -11.387 908 HA THR 115 HA THR 115 -4.310 3.871 -11.561 909 HB THR 115 HB THR 115 -7.125 3.969 -12.655 910 HG1 THR 115 HG1 THR 115 -7.763 4.288 -10.668 911 1HG2 THR 115 1HG2 THR 115 -5.861 1.905 -13.104 912 2HG2 THR 115 2HG2 THR 115 -7.200 1.625 -11.990 913 3HG2 THR 115 3HG2 THR 115 -5.549 1.730 -11.378 914 H GLY 116 H GLY 116 -2.931 3.424 -13.130 915 1HA GLY 116 1HA GLY 116 -2.604 2.611 -15.370 916 2HA GLY 116 2HA GLY 116 -3.842 3.733 -15.913 917 H ASP 117 H ASP 117 -1.340 4.734 -13.677 918 HA ASP 117 HA ASP 117 0.241 5.794 -15.916 919 1HB ASP 117 1HB ASP 117 -1.223 7.540 -14.579 920 2HB ASP 117 2HB ASP 117 0.082 7.409 -13.402 921 H ARG 118 H ARG 118 2.487 6.619 -14.843 922 HA ARG 118 HA ARG 118 3.433 4.123 -13.622 923 1HB ARG 118 1HB ARG 118 4.458 4.829 -15.751 924 2HB ARG 118 2HB ARG 118 5.035 6.298 -14.973 925 1HG ARG 118 1HG ARG 118 6.145 4.636 -13.299 926 2HG ARG 118 2HG ARG 118 5.933 3.475 -14.608 927 1HD ARG 118 1HD ARG 118 7.486 6.053 -14.676 928 2HD ARG 118 2HD ARG 118 8.125 4.415 -14.778 929 HE ARG 118 HE ARG 118 6.456 5.660 -16.865 930 1HH1 ARG 118 1HH1 ARG 118 9.093 3.577 -15.845 931 2HH1 ARG 118 2HH1 ARG 118 9.560 3.168 -17.470 932 1HH2 ARG 118 1HH2 ARG 118 7.097 5.101 -19.024 933 2HH2 ARG 118 2HH2 ARG 118 8.435 4.027 -19.258 934 H VAL 119 H VAL 119 3.927 4.068 -11.572 935 HA VAL 119 HA VAL 119 4.963 6.516 -10.303 936 HB VAL 119 HB VAL 119 3.401 4.269 -9.012 937 1HG1 VAL 119 1HG1 VAL 119 5.160 5.015 -7.508 938 2HG1 VAL 119 2HG1 VAL 119 3.586 5.568 -6.933 939 3HG1 VAL 119 3HG1 VAL 119 4.676 6.694 -7.745 940 1HG2 VAL 119 1HG2 VAL 119 2.023 5.859 -10.247 941 2HG2 VAL 119 2HG2 VAL 119 2.757 7.194 -9.360 942 3HG2 VAL 119 3HG2 VAL 119 1.766 6.011 -8.508 943 H VAL 120 H VAL 120 7.021 6.421 -9.766 944 HA VAL 120 HA VAL 120 8.243 3.786 -9.290 945 HB VAL 120 HB VAL 120 9.646 6.415 -9.841 946 1HG1 VAL 120 1HG1 VAL 120 11.016 4.900 -8.555 947 2HG1 VAL 120 2HG1 VAL 120 11.619 4.965 -10.211 948 3HG1 VAL 120 3HG1 VAL 120 10.666 3.583 -9.673 949 1HG2 VAL 120 1HG2 VAL 120 10.099 5.534 -12.070 950 2HG2 VAL 120 2HG2 VAL 120 8.362 5.669 -11.789 951 3HG2 VAL 120 3HG2 VAL 120 9.153 4.094 -11.705 952 H VAL 121 H VAL 121 8.110 3.336 -7.182 953 HA VAL 121 HA VAL 121 8.268 5.502 -5.234 954 HB VAL 121 HB VAL 121 6.429 3.961 -4.906 955 1HG1 VAL 121 1HG1 VAL 121 6.781 1.600 -4.388 956 2HG1 VAL 121 2HG1 VAL 121 8.512 1.797 -4.672 957 3HG1 VAL 121 3HG1 VAL 121 7.371 2.001 -6.001 958 1HG2 VAL 121 1HG2 VAL 121 7.421 4.908 -2.897 959 2HG2 VAL 121 2HG2 VAL 121 8.570 3.574 -2.813 960 3HG2 VAL 121 3HG2 VAL 121 6.850 3.269 -2.582 961 H ASN 122 H ASN 122 9.981 5.856 -3.965 962 HA ASN 122 HA ASN 122 12.050 3.758 -3.795 963 1HB ASN 122 1HB ASN 122 12.587 5.829 -5.274 964 2HB ASN 122 2HB ASN 122 12.711 6.698 -3.751 965 1HD2 ASN 122 1HD2 ASN 122 14.450 6.308 -2.398 966 2HD2 ASN 122 2HD2 ASN 122 15.822 5.365 -2.879 967 H ALA 123 H ALA 123 11.495 3.031 -1.785 968 HA ALA 123 HA ALA 123 10.633 4.898 0.254 969 1HB ALA 123 1HB ALA 123 10.157 2.926 1.586 970 2HB ALA 123 2HB ALA 123 10.960 1.908 0.391 971 3HB ALA 123 3HB ALA 123 9.478 2.765 -0.033 972 H ASP 124 H ASP 124 13.586 3.503 -0.701 973 HA ASP 124 HA ASP 124 14.919 3.320 1.767 974 1HB ASP 124 1HB ASP 124 16.086 4.111 -0.912 975 2HB ASP 124 2HB ASP 124 17.010 3.600 0.496 976 H GLU 125 H GLU 125 14.207 6.025 -0.322 977 HA GLU 125 HA GLU 125 15.493 7.846 1.592 978 1HB GLU 125 1HB GLU 125 16.172 7.955 -0.833 979 2HB GLU 125 2HB GLU 125 14.540 8.490 -1.204 980 1HG GLU 125 1HG GLU 125 14.843 10.474 0.136 981 2HG GLU 125 2HG GLU 125 16.442 9.926 0.635 982 H GLY 126 H GLY 126 12.463 6.944 0.104 983 1HA GLY 126 1HA GLY 126 10.401 7.179 1.219 984 2HA GLY 126 2HA GLY 126 11.094 8.474 2.181 985 H TYR 127 H TYR 127 10.175 7.716 -1.183 986 HA TYR 127 HA TYR 127 8.538 10.003 -1.397 987 1HB TYR 127 1HB TYR 127 9.787 11.357 -2.955 988 2HB TYR 127 2HB TYR 127 10.770 11.126 -1.516 989 HD1 TYR 127 HD1 TYR 127 12.762 9.667 -1.598 990 HD2 TYR 127 HD2 TYR 127 10.470 10.488 -5.086 991 HE1 TYR 127 HE1 TYR 127 14.617 8.871 -3.001 992 HE2 TYR 127 HE2 TYR 127 12.320 9.693 -6.495 993 HH TYR 127 HH TYR 127 15.057 8.048 -5.181 994 H VAL 128 H VAL 128 7.649 10.240 -3.580 995 HA VAL 128 HA VAL 128 7.940 7.787 -5.176 996 HB VAL 128 HB VAL 128 5.510 8.057 -5.789 997 1HG1 VAL 128 1HG1 VAL 128 6.225 6.344 -4.227 998 2HG1 VAL 128 2HG1 VAL 128 4.678 7.022 -3.719 999 3HG1 VAL 128 3HG1 VAL 128 6.162 7.501 -2.896 1000 1HG2 VAL 128 1HG2 VAL 128 5.231 10.386 -5.096 1001 2HG2 VAL 128 2HG2 VAL 128 5.506 9.922 -3.417 1002 3HG2 VAL 128 3HG2 VAL 128 4.082 9.334 -4.270 1003 H GLU 129 H GLU 129 8.303 8.062 -7.273 1004 HA GLU 129 HA GLU 129 8.239 10.798 -8.358 1005 1HB GLU 129 1HB GLU 129 10.430 9.686 -8.383 1006 2HB GLU 129 2HB GLU 129 9.748 8.334 -9.275 1007 1HG GLU 129 1HG GLU 129 10.865 9.594 -10.877 1008 2HG GLU 129 2HG GLU 129 9.171 10.039 -11.075 1009 H LEU 130 H LEU 130 6.535 11.228 -9.627 1010 HA LEU 130 HA LEU 130 5.157 9.014 -10.948 1011 1HB LEU 130 1HB LEU 130 3.819 10.693 -9.718 1012 2HB LEU 130 2HB LEU 130 4.412 11.937 -10.802 1013 HG LEU 130 HG LEU 130 3.380 10.556 -12.701 1014 1HD1 LEU 130 1HD1 LEU 130 1.972 9.294 -10.354 1015 2HD1 LEU 130 2HD1 LEU 130 3.060 8.489 -11.482 1016 3HD1 LEU 130 3HD1 LEU 130 1.512 9.115 -12.049 1017 1HD2 LEU 130 1HD2 LEU 130 1.153 11.511 -12.309 1018 2HD2 LEU 130 2HD2 LEU 130 2.434 12.666 -11.939 1019 3HD2 LEU 130 3HD2 LEU 130 1.588 11.836 -10.630 1020 H ILE 131 H ILE 131 5.506 8.551 -13.017 1021 HA ILE 131 HA ILE 131 6.783 10.609 -14.697 1022 HB ILE 131 HB ILE 131 6.649 7.668 -15.275 1023 1HG1 ILE 131 1HG1 ILE 131 7.981 8.061 -13.234 1024 2HG1 ILE 131 2HG1 ILE 131 8.997 7.523 -14.566 1025 1HG2 ILE 131 1HG2 ILE 131 6.928 9.043 -17.244 1026 2HG2 ILE 131 2HG2 ILE 131 8.420 8.163 -16.906 1027 3HG2 ILE 131 3HG2 ILE 131 8.290 9.874 -16.496 1028 1HD1 ILE 131 1HD1 ILE 131 8.686 10.367 -13.634 1029 2HD1 ILE 131 2HD1 ILE 131 9.731 9.810 -14.941 1030 3HD1 ILE 131 3HD1 ILE 131 10.048 9.304 -13.280 1031 H GLU 132 H GLU 132 5.432 11.601 -15.926 1032 HA GLU 132 HA GLU 132 2.773 10.569 -16.377 1033 1HB GLU 132 1HB GLU 132 3.954 13.197 -17.282 1034 2HB GLU 132 2HB GLU 132 2.248 12.777 -17.212 1035 1HG GLU 132 1HG GLU 132 2.451 12.569 -14.754 1036 2HG GLU 132 2HG GLU 132 4.117 13.136 -14.880 Start of MODEL 13 1 H VAL 1 H VAL 1 4.783 14.478 -11.907 2 HA VAL 1 HA VAL 1 5.789 16.372 -9.962 3 HB VAL 1 HB VAL 1 3.566 14.354 -9.608 4 1HG1 VAL 1 1HG1 VAL 1 4.242 16.901 -8.147 5 2HG1 VAL 1 2HG1 VAL 1 4.396 15.259 -7.524 6 3HG1 VAL 1 3HG1 VAL 1 2.799 15.923 -7.872 7 1HG2 VAL 1 1HG2 VAL 1 3.091 15.774 -11.534 8 2HG2 VAL 1 2HG2 VAL 1 3.394 17.213 -10.560 9 3HG2 VAL 1 3HG2 VAL 1 2.023 16.167 -10.187 10 H LYS 2 H LYS 2 6.875 15.911 -8.121 11 HA LYS 2 HA LYS 2 7.527 13.077 -7.595 12 1HB LYS 2 1HB LYS 2 9.442 14.441 -8.465 13 2HB LYS 2 2HB LYS 2 9.284 15.483 -7.059 14 1HG LYS 2 1HG LYS 2 9.727 13.501 -5.620 15 2HG LYS 2 2HG LYS 2 10.040 12.568 -7.087 16 1HD LYS 2 1HD LYS 2 11.528 15.053 -6.241 17 2HD LYS 2 2HD LYS 2 12.112 13.400 -6.054 18 1HE LYS 2 1HE LYS 2 11.386 14.641 -8.701 19 2HE LYS 2 2HE LYS 2 13.019 14.625 -8.036 20 1HZ LYS 2 1HZ LYS 2 11.389 12.230 -8.681 21 2HZ LYS 2 2HZ LYS 2 12.949 12.207 -8.021 22 3HZ LYS 2 3HZ LYS 2 12.697 12.810 -9.582 23 H PHE 3 H PHE 3 6.487 12.459 -5.807 24 HA PHE 3 HA PHE 3 5.711 14.463 -3.826 25 1HB PHE 3 1HB PHE 3 4.951 11.542 -4.054 26 2HB PHE 3 2HB PHE 3 4.299 12.672 -2.878 27 HD1 PHE 3 HD1 PHE 3 2.755 14.425 -3.562 28 HD2 PHE 3 HD2 PHE 3 4.218 11.551 -6.340 29 HE1 PHE 3 HE1 PHE 3 0.966 15.041 -5.132 30 HE2 PHE 3 HE2 PHE 3 2.433 12.166 -7.918 31 HZ PHE 3 HZ PHE 3 0.803 13.910 -7.315 32 H ALA 4 H ALA 4 6.195 14.282 -1.635 33 HA ALA 4 HA ALA 4 8.482 12.550 -0.997 34 1HB ALA 4 1HB ALA 4 9.007 14.130 0.785 35 2HB ALA 4 2HB ALA 4 7.582 15.085 0.375 36 3HB ALA 4 3HB ALA 4 8.918 14.956 -0.770 37 H CYS 5 H CYS 5 8.000 10.824 0.188 38 HA CYS 5 HA CYS 5 5.673 10.948 1.986 39 1HB CYS 5 1HB CYS 5 5.589 8.426 1.542 40 2HB CYS 5 2HB CYS 5 5.089 9.487 0.227 41 HG CYS 5 HG CYS 5 7.328 7.142 0.174 42 H ARG 6 H ARG 6 5.784 9.266 3.755 43 HA ARG 6 HA ARG 6 8.483 9.206 4.887 44 1HB ARG 6 1HB ARG 6 6.659 10.013 6.337 45 2HB ARG 6 2HB ARG 6 5.826 8.474 6.150 46 1HG ARG 6 1HG ARG 6 7.573 7.317 7.317 47 2HG ARG 6 2HG ARG 6 8.568 8.773 7.355 48 1HD ARG 6 1HD ARG 6 7.564 8.484 9.509 49 2HD ARG 6 2HD ARG 6 6.817 9.872 8.724 50 HE ARG 6 HE ARG 6 5.160 7.790 8.120 51 1HH1 ARG 6 1HH1 ARG 6 6.418 9.169 11.075 52 2HH1 ARG 6 2HH1 ARG 6 5.024 8.726 12.027 53 1HH2 ARG 6 1HH2 ARG 6 3.335 7.170 9.361 54 2HH2 ARG 6 2HH2 ARG 6 3.293 7.560 11.060 55 H ALA 7 H ALA 7 9.666 7.392 5.004 56 HA ALA 7 HA ALA 7 8.531 5.043 3.685 57 1HB ALA 7 1HB ALA 7 10.838 4.329 3.367 58 2HB ALA 7 2HB ALA 7 11.402 5.702 4.319 59 3HB ALA 7 3HB ALA 7 10.598 5.972 2.772 60 H ILE 8 H ILE 8 8.027 3.262 4.727 61 HA ILE 8 HA ILE 8 8.902 2.942 7.512 62 HB ILE 8 HB ILE 8 6.727 1.469 6.009 63 1HG1 ILE 8 1HG1 ILE 8 6.155 3.833 6.367 64 2HG1 ILE 8 2HG1 ILE 8 5.155 2.784 7.365 65 1HG2 ILE 8 1HG2 ILE 8 7.702 0.127 7.797 66 2HG2 ILE 8 2HG2 ILE 8 6.058 0.618 8.201 67 3HG2 ILE 8 3HG2 ILE 8 7.429 1.441 8.944 68 1HD1 ILE 8 1HD1 ILE 8 5.849 4.748 8.598 69 2HD1 ILE 8 2HD1 ILE 8 7.542 4.365 8.294 70 3HD1 ILE 8 3HD1 ILE 8 6.564 3.297 9.301 71 H THR 9 H THR 9 8.349 0.941 4.621 72 HA THR 9 HA THR 9 10.503 -0.858 5.440 73 HB THR 9 HB THR 9 9.015 -1.232 2.882 74 HG1 THR 9 HG1 THR 9 7.486 -2.431 4.500 75 1HG2 THR 9 1HG2 THR 9 10.680 -2.872 3.485 76 2HG2 THR 9 2HG2 THR 9 9.084 -3.605 3.629 77 3HG2 THR 9 3HG2 THR 9 9.950 -3.083 5.075 78 H ARG 10 H ARG 10 11.880 -1.585 3.365 79 HA ARG 10 HA ARG 10 12.739 0.935 2.079 80 1HB ARG 10 1HB ARG 10 14.529 -1.285 3.087 81 2HB ARG 10 2HB ARG 10 15.072 0.157 2.239 82 1HG ARG 10 1HG ARG 10 13.687 0.104 4.916 83 2HG ARG 10 2HG ARG 10 15.414 0.343 4.648 84 1HD ARG 10 1HD ARG 10 15.053 2.430 3.584 85 2HD ARG 10 2HD ARG 10 13.318 2.142 3.452 86 HE ARG 10 HE ARG 10 13.855 2.090 6.146 87 1HH1 ARG 10 1HH1 ARG 10 14.249 4.431 3.563 88 2HH1 ARG 10 2HH1 ARG 10 14.097 5.808 4.616 89 1HH2 ARG 10 1HH2 ARG 10 13.611 3.887 7.512 90 2HH2 ARG 10 2HH2 ARG 10 13.684 5.495 6.854 91 H GLY 11 H GLY 11 14.214 0.511 0.144 92 1HA GLY 11 1HA GLY 11 14.699 -0.989 -1.716 93 2HA GLY 11 2HA GLY 11 13.144 -1.756 -1.416 94 H ARG 12 H ARG 12 13.193 -1.171 -3.902 95 HA ARG 12 HA ARG 12 11.530 1.227 -4.070 96 1HB ARG 12 1HB ARG 12 12.565 2.032 -6.099 97 2HB ARG 12 2HB ARG 12 13.764 1.942 -4.820 98 1HG ARG 12 1HG ARG 12 13.515 -0.377 -6.649 99 2HG ARG 12 2HG ARG 12 14.255 1.098 -7.275 100 1HD ARG 12 1HD ARG 12 15.110 -0.390 -4.794 101 2HD ARG 12 2HD ARG 12 15.922 -0.454 -6.359 102 HE ARG 12 HE ARG 12 15.612 2.128 -4.980 103 1HH1 ARG 12 1HH1 ARG 12 17.671 -0.417 -6.209 104 2HH1 ARG 12 2HH1 ARG 12 19.134 0.508 -6.049 105 1HH2 ARG 12 1HH2 ARG 12 17.509 3.363 -4.801 106 2HH2 ARG 12 2HH2 ARG 12 19.032 2.672 -5.258 107 H ALA 13 H ALA 13 10.113 1.282 -5.878 108 HA ALA 13 HA ALA 13 9.780 -1.258 -7.300 109 1HB ALA 13 1HB ALA 13 8.343 -1.372 -5.326 110 2HB ALA 13 2HB ALA 13 7.397 -1.304 -6.812 111 3HB ALA 13 3HB ALA 13 7.562 0.135 -5.807 112 H GLU 14 H GLU 14 9.027 -1.076 -9.326 113 HA GLU 14 HA GLU 14 8.164 1.573 -10.269 114 1HB GLU 14 1HB GLU 14 9.435 0.549 -12.457 115 2HB GLU 14 2HB GLU 14 10.141 1.705 -11.340 116 1HG GLU 14 1HG GLU 14 11.667 -0.133 -11.835 117 2HG GLU 14 2HG GLU 14 11.236 -0.085 -10.130 118 H GLY 15 H GLY 15 6.215 1.481 -11.250 119 1HA GLY 15 1HA GLY 15 5.607 -0.319 -13.299 120 2HA GLY 15 2HA GLY 15 4.949 -0.992 -11.815 121 H GLU 16 H GLU 16 2.957 -0.773 -13.099 122 HA GLU 16 HA GLU 16 1.848 1.791 -13.614 123 1HB GLU 16 1HB GLU 16 0.543 -0.923 -13.358 124 2HB GLU 16 2HB GLU 16 -0.209 0.510 -14.025 125 1HG GLU 16 1HG GLU 16 1.321 0.538 -15.863 126 2HG GLU 16 2HG GLU 16 2.251 -0.784 -15.155 127 H ALA 17 H ALA 17 0.606 3.056 -12.349 128 HA ALA 17 HA ALA 17 0.351 2.360 -9.549 129 1HB ALA 17 1HB ALA 17 -0.497 4.839 -11.039 130 2HB ALA 17 2HB ALA 17 1.022 4.615 -10.173 131 3HB ALA 17 3HB ALA 17 -0.500 4.636 -9.287 132 H LEU 18 H LEU 18 -1.347 1.420 -8.690 133 HA LEU 18 HA LEU 18 -3.944 1.597 -10.066 134 1HB LEU 18 1HB LEU 18 -2.827 -0.671 -9.598 135 2HB LEU 18 2HB LEU 18 -3.177 -0.365 -7.909 136 HG LEU 18 HG LEU 18 -5.361 -0.367 -9.972 137 1HD1 LEU 18 1HD1 LEU 18 -4.144 -2.487 -10.153 138 2HD1 LEU 18 2HD1 LEU 18 -5.746 -2.716 -9.451 139 3HD1 LEU 18 3HD1 LEU 18 -4.320 -2.730 -8.414 140 1HD2 LEU 18 1HD2 LEU 18 -5.315 -0.898 -7.001 141 2HD2 LEU 18 2HD2 LEU 18 -6.744 -0.940 -8.034 142 3HD2 LEU 18 3HD2 LEU 18 -5.883 0.578 -7.783 143 H VAL 19 H VAL 19 -5.260 3.085 -9.183 144 HA VAL 19 HA VAL 19 -4.538 4.016 -6.488 145 HB VAL 19 HB VAL 19 -5.988 5.526 -8.664 146 1HG1 VAL 19 1HG1 VAL 19 -6.586 6.296 -6.431 147 2HG1 VAL 19 2HG1 VAL 19 -5.580 7.489 -7.253 148 3HG1 VAL 19 3HG1 VAL 19 -4.879 6.449 -6.013 149 1HG2 VAL 19 1HG2 VAL 19 -3.901 6.767 -8.916 150 2HG2 VAL 19 2HG2 VAL 19 -3.674 5.053 -9.261 151 3HG2 VAL 19 3HG2 VAL 19 -3.133 5.720 -7.721 152 H THR 20 H THR 20 -5.851 3.719 -4.896 153 HA THR 20 HA THR 20 -8.753 3.793 -5.331 154 HB THR 20 HB THR 20 -8.939 2.029 -3.490 155 HG1 THR 20 HG1 THR 20 -6.207 2.131 -3.846 156 1HG2 THR 20 1HG2 THR 20 -8.666 0.145 -5.043 157 2HG2 THR 20 2HG2 THR 20 -7.780 1.193 -6.150 158 3HG2 THR 20 3HG2 THR 20 -9.480 1.511 -5.807 159 H LYS 21 H LYS 21 -9.892 4.820 -3.659 160 HA LYS 21 HA LYS 21 -8.268 5.626 -1.345 161 1HB LYS 21 1HB LYS 21 -9.402 7.810 -1.307 162 2HB LYS 21 2HB LYS 21 -8.420 7.572 -2.741 163 1HG LYS 21 1HG LYS 21 -10.406 7.134 -4.062 164 2HG LYS 21 2HG LYS 21 -11.417 7.282 -2.620 165 1HD LYS 21 1HD LYS 21 -11.477 9.353 -3.882 166 2HD LYS 21 2HD LYS 21 -10.643 9.611 -2.348 167 1HE LYS 21 1HE LYS 21 -8.486 9.182 -3.657 168 2HE LYS 21 2HE LYS 21 -9.470 9.384 -5.105 169 1HZ LYS 21 1HZ LYS 21 -8.918 11.381 -2.982 170 2HZ LYS 21 2HZ LYS 21 -10.157 11.582 -4.124 171 3HZ LYS 21 3HZ LYS 21 -8.549 11.480 -4.638 172 H GLU 22 H GLU 22 -10.381 3.559 -1.986 173 HA GLU 22 HA GLU 22 -12.476 4.152 -0.095 174 1HB GLU 22 1HB GLU 22 -11.672 1.494 -1.286 175 2HB GLU 22 2HB GLU 22 -13.174 1.846 -0.451 176 1HG GLU 22 1HG GLU 22 -12.334 3.130 -3.038 177 2HG GLU 22 2HG GLU 22 -13.385 1.723 -2.915 178 H TYR 23 H TYR 23 -12.320 3.879 2.041 179 HA TYR 23 HA TYR 23 -9.870 2.892 3.192 180 1HB TYR 23 1HB TYR 23 -11.830 4.685 3.983 181 2HB TYR 23 2HB TYR 23 -12.091 3.306 5.043 182 HD1 TYR 23 HD1 TYR 23 -10.541 2.783 6.797 183 HD2 TYR 23 HD2 TYR 23 -9.662 5.873 4.007 184 HE1 TYR 23 HE1 TYR 23 -8.687 3.542 8.225 185 HE2 TYR 23 HE2 TYR 23 -7.807 6.637 5.426 186 HH TYR 23 HH TYR 23 -6.587 4.810 8.009 187 H ILE 24 H ILE 24 -9.513 0.751 3.352 188 HA ILE 24 HA ILE 24 -11.822 -0.978 3.997 189 HB ILE 24 HB ILE 24 -9.569 -1.757 2.132 190 1HG1 ILE 24 1HG1 ILE 24 -12.424 -0.985 1.470 191 2HG1 ILE 24 2HG1 ILE 24 -11.000 -0.005 1.135 192 1HG2 ILE 24 1HG2 ILE 24 -12.178 -3.128 2.799 193 2HG2 ILE 24 2HG2 ILE 24 -10.572 -3.645 3.310 194 3HG2 ILE 24 3HG2 ILE 24 -11.006 -3.682 1.601 195 1HD1 ILE 24 1HD1 ILE 24 -11.585 -2.714 -0.035 196 2HD1 ILE 24 2HD1 ILE 24 -10.172 -1.718 -0.385 197 3HD1 ILE 24 3HD1 ILE 24 -11.781 -1.165 -0.856 198 H SER 25 H SER 25 -8.884 0.146 4.901 199 HA SER 25 HA SER 25 -7.233 -0.418 6.302 200 1HB SER 25 1HB SER 25 -8.076 -1.513 8.407 201 2HB SER 25 2HB SER 25 -8.887 -0.035 7.928 202 HG SER 25 HG SER 25 -10.072 -2.262 6.881 203 H PHE 26 H PHE 26 -7.747 -2.414 4.122 204 HA PHE 26 HA PHE 26 -6.827 -4.329 3.374 205 1HB PHE 26 1HB PHE 26 -5.125 -3.796 5.773 206 2HB PHE 26 2HB PHE 26 -4.948 -5.323 4.916 207 HD1 PHE 26 HD1 PHE 26 -4.003 -5.405 2.710 208 HD2 PHE 26 HD2 PHE 26 -4.543 -1.688 4.707 209 HE1 PHE 26 HE1 PHE 26 -2.545 -4.313 1.059 210 HE2 PHE 26 HE2 PHE 26 -3.085 -0.587 3.058 211 HZ PHE 26 HZ PHE 26 -2.085 -1.899 1.229 212 H LEU 27 H LEU 27 -9.077 -4.305 5.475 213 HA LEU 27 HA LEU 27 -8.971 -7.042 6.448 214 1HB LEU 27 1HB LEU 27 -10.878 -4.754 6.665 215 2HB LEU 27 2HB LEU 27 -11.524 -6.368 6.866 216 HG LEU 27 HG LEU 27 -11.026 -5.359 9.020 217 1HD1 LEU 27 1HD1 LEU 27 -9.627 -7.118 9.957 218 2HD1 LEU 27 2HD1 LEU 27 -9.107 -7.573 8.335 219 3HD1 LEU 27 3HD1 LEU 27 -10.795 -7.769 8.804 220 1HD2 LEU 27 1HD2 LEU 27 -8.171 -5.223 8.068 221 2HD2 LEU 27 2HD2 LEU 27 -8.743 -4.848 9.693 222 3HD2 LEU 27 3HD2 LEU 27 -9.240 -3.845 8.330 223 H GLY 28 H GLY 28 -8.774 -6.505 3.578 224 1HA GLY 28 1HA GLY 28 -11.348 -7.365 2.493 225 2HA GLY 28 2HA GLY 28 -9.978 -6.768 1.566 226 H GLY 29 H GLY 29 -9.274 -8.322 0.248 227 1HA GLY 29 1HA GLY 29 -8.217 -10.747 1.126 228 2HA GLY 29 2HA GLY 29 -9.870 -11.044 0.614 229 H ILE 30 H ILE 30 -6.682 -10.111 -0.408 230 HA ILE 30 HA ILE 30 -7.403 -10.443 -3.225 231 HB ILE 30 HB ILE 30 -4.658 -9.993 -2.024 232 1HG1 ILE 30 1HG1 ILE 30 -6.564 -7.978 -3.241 233 2HG1 ILE 30 2HG1 ILE 30 -6.193 -8.116 -1.525 234 1HG2 ILE 30 1HG2 ILE 30 -5.666 -9.700 -4.849 235 2HG2 ILE 30 2HG2 ILE 30 -4.624 -10.989 -4.247 236 3HG2 ILE 30 3HG2 ILE 30 -4.032 -9.328 -4.290 237 1HD1 ILE 30 1HD1 ILE 30 -3.869 -7.528 -1.990 238 2HD1 ILE 30 2HD1 ILE 30 -4.984 -6.281 -2.546 239 3HD1 ILE 30 3HD1 ILE 30 -4.249 -7.386 -3.707 240 H ASP 31 H ASP 31 -7.211 -12.373 -4.221 241 HA ASP 31 HA ASP 31 -6.690 -14.709 -2.735 242 1HB ASP 31 1HB ASP 31 -8.163 -14.742 -4.675 243 2HB ASP 31 2HB ASP 31 -6.817 -14.321 -5.730 244 H LYS 32 H LYS 32 -4.857 -15.732 -2.272 245 HA LYS 32 HA LYS 32 -2.398 -14.474 -3.118 246 1HB LYS 32 1HB LYS 32 -1.365 -16.014 -1.425 247 2HB LYS 32 2HB LYS 32 -2.565 -14.900 -0.788 248 1HG LYS 32 1HG LYS 32 -4.232 -16.716 -0.836 249 2HG LYS 32 2HG LYS 32 -2.969 -17.821 -1.387 250 1HD LYS 32 1HD LYS 32 -1.714 -17.455 0.646 251 2HD LYS 32 2HD LYS 32 -2.891 -16.259 1.189 252 1HE LYS 32 1HE LYS 32 -3.186 -18.466 2.264 253 2HE LYS 32 2HE LYS 32 -4.603 -17.945 1.353 254 1HZ LYS 32 1HZ LYS 32 -4.089 -19.433 -0.389 255 2HZ LYS 32 2HZ LYS 32 -3.937 -20.325 1.048 256 3HZ LYS 32 3HZ LYS 32 -2.551 -19.775 0.239 257 H GLU 33 H GLU 33 -4.199 -16.750 -4.553 258 HA GLU 33 HA GLU 33 -1.915 -18.392 -5.370 259 1HB GLU 33 1HB GLU 33 -4.847 -18.770 -5.939 260 2HB GLU 33 2HB GLU 33 -3.558 -19.870 -6.402 261 1HG GLU 33 1HG GLU 33 -4.497 -19.210 -3.633 262 2HG GLU 33 2HG GLU 33 -4.604 -20.744 -4.481 263 H THR 34 H THR 34 -4.366 -16.194 -6.598 264 HA THR 34 HA THR 34 -3.073 -16.263 -9.246 265 HB THR 34 HB THR 34 -5.263 -15.260 -10.053 266 HG1 THR 34 HG1 THR 34 -6.051 -16.069 -7.418 267 1HG2 THR 34 1HG2 THR 34 -6.434 -17.426 -10.052 268 2HG2 THR 34 2HG2 THR 34 -5.311 -18.019 -8.829 269 3HG2 THR 34 3HG2 THR 34 -4.723 -17.600 -10.439 270 H GLY 35 H GLY 35 -3.714 -14.252 -6.537 271 1HA GLY 35 1HA GLY 35 -2.974 -12.106 -6.109 272 2HA GLY 35 2HA GLY 35 -2.328 -12.032 -7.741 273 H ILE 36 H ILE 36 -5.619 -12.934 -7.219 274 HA ILE 36 HA ILE 36 -6.486 -10.433 -8.486 275 HB ILE 36 HB ILE 36 -7.910 -13.089 -8.217 276 1HG1 ILE 36 1HG1 ILE 36 -6.060 -13.119 -9.836 277 2HG1 ILE 36 2HG1 ILE 36 -7.615 -13.254 -10.647 278 1HG2 ILE 36 1HG2 ILE 36 -8.805 -10.576 -9.619 279 2HG2 ILE 36 2HG2 ILE 36 -9.515 -11.270 -8.160 280 3HG2 ILE 36 3HG2 ILE 36 -9.620 -12.137 -9.693 281 1HD1 ILE 36 1HD1 ILE 36 -5.964 -10.746 -10.427 282 2HD1 ILE 36 2HD1 ILE 36 -7.508 -10.905 -11.265 283 3HD1 ILE 36 3HD1 ILE 36 -6.093 -11.784 -11.847 284 H VAL 37 H VAL 37 -7.591 -8.976 -7.340 285 HA VAL 37 HA VAL 37 -8.165 -9.327 -4.592 286 HB VAL 37 HB VAL 37 -9.360 -7.222 -6.400 287 1HG1 VAL 37 1HG1 VAL 37 -9.457 -5.877 -4.367 288 2HG1 VAL 37 2HG1 VAL 37 -8.792 -7.222 -3.440 289 3HG1 VAL 37 3HG1 VAL 37 -10.381 -7.369 -4.194 290 1HG2 VAL 37 1HG2 VAL 37 -6.934 -7.262 -6.684 291 2HG2 VAL 37 2HG2 VAL 37 -6.722 -7.152 -4.936 292 3HG2 VAL 37 3HG2 VAL 37 -7.450 -5.813 -5.822 293 H LYS 38 H LYS 38 -9.685 -10.638 -3.847 294 HA LYS 38 HA LYS 38 -12.042 -11.260 -5.426 295 1HB LYS 38 1HB LYS 38 -11.112 -12.281 -2.732 296 2HB LYS 38 2HB LYS 38 -12.523 -12.875 -3.597 297 1HG LYS 38 1HG LYS 38 -9.715 -12.989 -4.672 298 2HG LYS 38 2HG LYS 38 -10.508 -14.308 -3.811 299 1HD LYS 38 1HD LYS 38 -12.219 -14.440 -5.513 300 2HD LYS 38 2HD LYS 38 -11.537 -13.039 -6.344 301 1HE LYS 38 1HE LYS 38 -9.512 -14.263 -6.825 302 2HE LYS 38 2HE LYS 38 -10.087 -15.645 -5.893 303 1HZ LYS 38 1HZ LYS 38 -11.793 -16.042 -7.469 304 2HZ LYS 38 2HZ LYS 38 -10.353 -15.850 -8.348 305 3HZ LYS 38 3HZ LYS 38 -11.484 -14.587 -8.288 306 H GLU 39 H GLU 39 -11.136 -9.393 -2.647 307 HA GLU 39 HA GLU 39 -13.728 -8.980 -1.582 308 1HB GLU 39 1HB GLU 39 -11.447 -8.529 -0.482 309 2HB GLU 39 2HB GLU 39 -11.447 -7.020 -1.383 310 1HG GLU 39 1HG GLU 39 -12.235 -6.722 0.905 311 2HG GLU 39 2HG GLU 39 -13.486 -6.322 -0.273 312 H ASP 40 H ASP 40 -15.311 -7.575 -2.179 313 HA ASP 40 HA ASP 40 -15.077 -6.510 -4.826 314 1HB ASP 40 1HB ASP 40 -17.178 -7.539 -3.880 315 2HB ASP 40 2HB ASP 40 -17.375 -6.075 -2.919 316 H CYS 41 H CYS 41 -14.796 -4.509 -5.479 317 HA CYS 41 HA CYS 41 -15.069 -2.202 -3.795 318 1HB CYS 41 1HB CYS 41 -12.598 -1.592 -4.174 319 2HB CYS 41 2HB CYS 41 -12.948 -2.792 -2.934 320 HG CYS 41 HG CYS 41 -12.039 -4.954 -4.282 321 H GLU 42 H GLU 42 -16.197 -3.118 -6.182 322 HA GLU 42 HA GLU 42 -16.800 -2.447 -8.253 323 1HB GLU 42 1HB GLU 42 -14.881 -0.152 -7.826 324 2HB GLU 42 2HB GLU 42 -15.997 -0.299 -9.175 325 1HG GLU 42 1HG GLU 42 -16.693 0.028 -6.267 326 2HG GLU 42 2HG GLU 42 -16.921 1.202 -7.563 327 H ILE 43 H ILE 43 -13.290 -2.015 -7.800 328 HA ILE 43 HA ILE 43 -12.807 -3.143 -10.440 329 HB ILE 43 HB ILE 43 -10.405 -2.768 -9.908 330 1HG1 ILE 43 1HG1 ILE 43 -11.459 -1.438 -7.402 331 2HG1 ILE 43 2HG1 ILE 43 -10.646 -2.999 -7.434 332 1HG2 ILE 43 1HG2 ILE 43 -11.701 -1.085 -11.086 333 2HG2 ILE 43 2HG2 ILE 43 -10.516 -0.324 -10.024 334 3HG2 ILE 43 3HG2 ILE 43 -12.214 -0.386 -9.551 335 1HD1 ILE 43 1HD1 ILE 43 -9.133 -1.226 -6.760 336 2HD1 ILE 43 2HD1 ILE 43 -9.445 -0.373 -8.272 337 3HD1 ILE 43 3HD1 ILE 43 -8.630 -1.936 -8.295 338 H LYS 44 H LYS 44 -14.080 -4.917 -8.722 339 HA LYS 44 HA LYS 44 -12.203 -6.755 -7.594 340 1HB LYS 44 1HB LYS 44 -14.417 -6.772 -6.690 341 2HB LYS 44 2HB LYS 44 -15.139 -6.972 -8.281 342 1HG LYS 44 1HG LYS 44 -14.276 -9.223 -8.429 343 2HG LYS 44 2HG LYS 44 -13.422 -9.025 -6.898 344 1HD LYS 44 1HD LYS 44 -15.453 -8.903 -5.678 345 2HD LYS 44 2HD LYS 44 -16.408 -8.747 -7.154 346 1HE LYS 44 1HE LYS 44 -14.760 -11.178 -6.469 347 2HE LYS 44 2HE LYS 44 -16.473 -11.016 -6.083 348 1HZ LYS 44 1HZ LYS 44 -16.983 -10.828 -8.409 349 2HZ LYS 44 2HZ LYS 44 -16.059 -12.234 -8.172 350 3HZ LYS 44 3HZ LYS 44 -15.341 -10.844 -8.828 351 H GLY 45 H GLY 45 -11.091 -8.302 -8.588 352 1HA GLY 45 1HA GLY 45 -10.937 -10.034 -10.278 353 2HA GLY 45 2HA GLY 45 -11.838 -8.980 -11.359 354 H GLU 46 H GLU 46 -9.824 -6.951 -9.812 355 HA GLU 46 HA GLU 46 -8.021 -6.793 -12.025 356 1HB GLU 46 1HB GLU 46 -8.436 -5.234 -9.517 357 2HB GLU 46 2HB GLU 46 -6.937 -5.032 -10.417 358 1HG GLU 46 1HG GLU 46 -9.706 -4.659 -11.531 359 2HG GLU 46 2HG GLU 46 -8.612 -3.369 -11.034 360 H SER 47 H SER 47 -5.795 -6.988 -12.011 361 HA SER 47 HA SER 47 -4.743 -8.862 -10.020 362 1HB SER 47 1HB SER 47 -4.600 -9.548 -12.396 363 2HB SER 47 2HB SER 47 -3.662 -8.099 -12.750 364 HG SER 47 HG SER 47 -2.878 -10.480 -11.640 365 H VAL 48 H VAL 48 -3.184 -8.255 -8.637 366 HA VAL 48 HA VAL 48 -2.087 -5.537 -8.922 367 HB VAL 48 HB VAL 48 -1.545 -5.698 -6.505 368 1HG1 VAL 48 1HG1 VAL 48 -3.842 -5.466 -5.699 369 2HG1 VAL 48 2HG1 VAL 48 -4.438 -6.204 -7.186 370 3HG1 VAL 48 3HG1 VAL 48 -3.617 -4.645 -7.245 371 1HG2 VAL 48 1HG2 VAL 48 -1.342 -8.119 -6.317 372 2HG2 VAL 48 2HG2 VAL 48 -3.064 -8.302 -6.649 373 3HG2 VAL 48 3HG2 VAL 48 -2.532 -7.503 -5.169 374 H ALA 49 H ALA 49 -1.218 -8.439 -9.835 375 HA ALA 49 HA ALA 49 1.270 -8.888 -8.534 376 1HB ALA 49 1HB ALA 49 1.542 -10.725 -10.085 377 2HB ALA 49 2HB ALA 49 0.207 -10.130 -11.071 378 3HB ALA 49 3HB ALA 49 -0.096 -10.724 -9.438 379 H GLY 50 H GLY 50 2.470 -7.069 -8.812 380 1HA GLY 50 1HA GLY 50 4.516 -6.503 -9.975 381 2HA GLY 50 2HA GLY 50 3.699 -6.870 -11.485 382 H ARG 51 H ARG 51 1.748 -5.155 -9.323 383 HA ARG 51 HA ARG 51 2.276 -2.661 -10.800 384 1HB ARG 51 1HB ARG 51 -0.249 -3.781 -9.593 385 2HB ARG 51 2HB ARG 51 -0.099 -2.081 -10.010 386 1HG ARG 51 1HG ARG 51 0.286 -2.674 -12.343 387 2HG ARG 51 2HG ARG 51 0.175 -4.389 -11.927 388 1HD ARG 51 1HD ARG 51 -2.110 -4.166 -11.302 389 2HD ARG 51 2HD ARG 51 -2.028 -2.410 -11.384 390 HE ARG 51 HE ARG 51 -1.418 -3.323 -13.920 391 1HH1 ARG 51 1HH1 ARG 51 -4.095 -3.616 -11.701 392 2HH1 ARG 51 2HH1 ARG 51 -5.321 -3.614 -12.937 393 1HH2 ARG 51 1HH2 ARG 51 -3.019 -3.332 -15.591 394 2HH2 ARG 51 2HH2 ARG 51 -4.703 -3.446 -15.147 395 H ILE 52 H ILE 52 1.487 -0.694 -9.444 396 HA ILE 52 HA ILE 52 2.474 -1.031 -6.687 397 HB ILE 52 HB ILE 52 2.413 1.459 -8.406 398 1HG1 ILE 52 1HG1 ILE 52 4.690 -0.201 -7.298 399 2HG1 ILE 52 2HG1 ILE 52 4.217 -0.068 -8.988 400 1HG2 ILE 52 1HG2 ILE 52 3.324 1.128 -5.546 401 2HG2 ILE 52 2HG2 ILE 52 1.898 2.014 -6.090 402 3HG2 ILE 52 3HG2 ILE 52 3.508 2.586 -6.523 403 1HD1 ILE 52 1HD1 ILE 52 6.193 1.256 -8.518 404 2HD1 ILE 52 2HD1 ILE 52 5.309 2.158 -7.287 405 3HD1 ILE 52 3HD1 ILE 52 4.840 2.289 -8.982 406 H LEU 53 H LEU 53 1.020 -0.863 -5.124 407 HA LEU 53 HA LEU 53 -1.694 -0.150 -5.906 408 1HB LEU 53 1HB LEU 53 -1.289 -2.288 -4.765 409 2HB LEU 53 2HB LEU 53 -0.653 -1.430 -3.377 410 HG LEU 53 HG LEU 53 -2.886 -0.389 -3.043 411 1HD1 LEU 53 1HD1 LEU 53 -4.806 -1.303 -4.240 412 2HD1 LEU 53 2HD1 LEU 53 -3.728 -2.290 -5.228 413 3HD1 LEU 53 3HD1 LEU 53 -3.673 -0.532 -5.350 414 1HD2 LEU 53 1HD2 LEU 53 -3.974 -2.406 -2.184 415 2HD2 LEU 53 2HD2 LEU 53 -2.252 -2.387 -1.802 416 3HD2 LEU 53 3HD2 LEU 53 -2.853 -3.406 -3.111 417 H VAL 54 H VAL 54 -2.434 1.797 -5.553 418 HA VAL 54 HA VAL 54 -1.331 3.399 -3.352 419 HB VAL 54 HB VAL 54 -3.110 4.254 -5.655 420 1HG1 VAL 54 1HG1 VAL 54 -1.719 5.897 -3.546 421 2HG1 VAL 54 2HG1 VAL 54 -3.456 5.618 -3.676 422 3HG1 VAL 54 3HG1 VAL 54 -2.614 6.534 -4.926 423 1HG2 VAL 54 1HG2 VAL 54 -0.856 3.637 -6.387 424 2HG2 VAL 54 2HG2 VAL 54 -0.169 4.752 -5.205 425 3HG2 VAL 54 3HG2 VAL 54 -1.138 5.370 -6.543 426 H PHE 55 H PHE 55 -2.405 3.128 -1.526 427 HA PHE 55 HA PHE 55 -5.335 2.867 -1.600 428 1HB PHE 55 1HB PHE 55 -4.152 0.625 -1.454 429 2HB PHE 55 2HB PHE 55 -3.492 1.147 0.086 430 HD1 PHE 55 HD1 PHE 55 -6.701 0.553 -1.678 431 HD2 PHE 55 HD2 PHE 55 -4.653 0.754 2.043 432 HE1 PHE 55 HE1 PHE 55 -8.684 -0.353 -0.539 433 HE2 PHE 55 HE2 PHE 55 -6.632 -0.147 3.189 434 HZ PHE 55 HZ PHE 55 -8.650 -0.703 1.896 435 HA PRO 56 HA PRO 56 -5.009 5.963 1.582 436 1HB PRO 56 1HB PRO 56 -7.292 5.398 3.007 437 2HB PRO 56 2HB PRO 56 -7.258 6.338 1.512 438 1HG PRO 56 1HG PRO 56 -7.932 3.455 1.928 439 2HG PRO 56 2HG PRO 56 -8.703 4.646 0.864 440 1HD PRO 56 1HD PRO 56 -6.988 2.800 -0.077 441 2HD PRO 56 2HD PRO 56 -7.074 4.435 -0.764 442 H GLY 57 H GLY 57 -5.855 2.676 2.526 443 1HA GLY 57 1HA GLY 57 -4.263 1.470 3.906 444 2HA GLY 57 2HA GLY 57 -4.030 2.954 4.818 445 H GLY 58 H GLY 58 -4.484 1.797 6.692 446 1HA GLY 58 1HA GLY 58 -7.360 1.498 7.188 447 2HA GLY 58 2HA GLY 58 -6.214 0.305 7.784 448 H LYS 59 H LYS 59 -6.516 0.603 9.946 449 HA LYS 59 HA LYS 59 -5.160 2.718 11.224 450 1HB LYS 59 1HB LYS 59 -7.389 3.777 10.386 451 2HB LYS 59 2HB LYS 59 -8.129 2.859 11.689 452 1HG LYS 59 1HG LYS 59 -6.810 4.019 13.327 453 2HG LYS 59 2HG LYS 59 -5.908 4.854 12.060 454 1HD LYS 59 1HD LYS 59 -8.852 5.134 12.659 455 2HD LYS 59 2HD LYS 59 -7.594 6.332 12.973 456 1HE LYS 59 1HE LYS 59 -7.169 6.534 10.586 457 2HE LYS 59 2HE LYS 59 -8.376 5.296 10.248 458 1HZ LYS 59 1HZ LYS 59 -10.026 6.798 11.335 459 2HZ LYS 59 2HZ LYS 59 -9.386 7.383 9.879 460 3HZ LYS 59 3HZ LYS 59 -8.834 8.007 11.356 461 H GLY 60 H GLY 60 -8.160 0.947 11.948 462 1HA GLY 60 1HA GLY 60 -6.719 -0.473 14.091 463 2HA GLY 60 2HA GLY 60 -8.468 -0.279 14.003 464 H SER 61 H SER 61 -5.707 -1.819 12.429 465 HA SER 61 HA SER 61 -7.556 -3.609 11.027 466 1HB SER 61 1HB SER 61 -4.649 -2.978 10.472 467 2HB SER 61 2HB SER 61 -5.657 -4.068 9.519 468 HG SER 61 HG SER 61 -6.411 -2.411 8.518 469 H THR 62 H THR 62 -6.398 -5.782 10.495 470 HA THR 62 HA THR 62 -4.713 -6.848 12.579 471 HB THR 62 HB THR 62 -7.483 -8.005 12.150 472 HG1 THR 62 HG1 THR 62 -6.625 -6.101 13.814 473 1HG2 THR 62 1HG2 THR 62 -5.248 -8.913 13.965 474 2HG2 THR 62 2HG2 THR 62 -5.807 -9.746 12.515 475 3HG2 THR 62 3HG2 THR 62 -6.872 -9.594 13.914 476 H VAL 63 H VAL 63 -6.731 -7.420 9.755 477 HA VAL 63 HA VAL 63 -4.961 -9.489 8.755 478 HB VAL 63 HB VAL 63 -7.378 -8.222 7.450 479 1HG1 VAL 63 1HG1 VAL 63 -5.843 -10.721 6.744 480 2HG1 VAL 63 2HG1 VAL 63 -5.865 -9.218 5.819 481 3HG1 VAL 63 3HG1 VAL 63 -7.334 -10.181 5.972 482 1HG2 VAL 63 1HG2 VAL 63 -7.935 -9.396 9.528 483 2HG2 VAL 63 2HG2 VAL 63 -7.129 -10.843 8.919 484 3HG2 VAL 63 3HG2 VAL 63 -8.575 -10.235 8.115 485 H GLY 64 H GLY 64 -3.534 -9.222 7.055 486 1HA GLY 64 1HA GLY 64 -3.200 -7.672 5.028 487 2HA GLY 64 2HA GLY 64 -3.071 -6.422 6.255 488 H SER 65 H SER 65 -1.756 -8.937 7.768 489 HA SER 65 HA SER 65 0.921 -8.052 7.091 490 1HB SER 65 1HB SER 65 1.527 -9.525 9.082 491 2HB SER 65 2HB SER 65 0.517 -8.121 9.420 492 HG SER 65 HG SER 65 -0.239 -10.047 10.440 493 H TYR 66 H TYR 66 -0.345 -11.284 7.860 494 HA TYR 66 HA TYR 66 1.818 -12.581 6.588 495 1HB TYR 66 1HB TYR 66 -0.850 -13.764 7.380 496 2HB TYR 66 2HB TYR 66 0.644 -14.650 7.087 497 HD1 TYR 66 HD1 TYR 66 -1.397 -13.239 9.565 498 HD2 TYR 66 HD2 TYR 66 2.694 -13.861 8.580 499 HE1 TYR 66 HE1 TYR 66 -0.787 -12.962 11.930 500 HE2 TYR 66 HE2 TYR 66 3.314 -13.592 10.943 501 HH TYR 66 HH TYR 66 0.983 -13.510 13.466 502 H VAL 67 H VAL 67 -1.300 -11.554 5.436 503 HA VAL 67 HA VAL 67 -1.455 -13.297 3.204 504 HB VAL 67 HB VAL 67 -3.139 -11.738 2.301 505 1HG1 VAL 67 1HG1 VAL 67 -3.842 -13.434 3.871 506 2HG1 VAL 67 2HG1 VAL 67 -4.760 -11.953 4.146 507 3HG1 VAL 67 3HG1 VAL 67 -3.436 -12.386 5.228 508 1HG2 VAL 67 1HG2 VAL 67 -2.166 -9.624 3.017 509 2HG2 VAL 67 2HG2 VAL 67 -2.475 -10.042 4.703 510 3HG2 VAL 67 3HG2 VAL 67 -3.825 -9.781 3.599 511 H LEU 68 H LEU 68 0.110 -10.198 3.723 512 HA LEU 68 HA LEU 68 0.663 -9.674 0.982 513 1HB LEU 68 1HB LEU 68 1.396 -8.522 3.572 514 2HB LEU 68 2HB LEU 68 2.673 -8.409 2.376 515 HG LEU 68 HG LEU 68 1.284 -6.390 2.420 516 1HD1 LEU 68 1HD1 LEU 68 0.809 -6.253 0.025 517 2HD1 LEU 68 2HD1 LEU 68 0.963 -8.006 -0.105 518 3HD1 LEU 68 3HD1 LEU 68 2.362 -7.029 0.335 519 1HD2 LEU 68 1HD2 LEU 68 -0.828 -7.358 3.124 520 2HD2 LEU 68 2HD2 LEU 68 -0.959 -8.231 1.599 521 3HD2 LEU 68 3HD2 LEU 68 -1.035 -6.469 1.614 522 H LEU 69 H LEU 69 2.348 -11.375 3.548 523 HA LEU 69 HA LEU 69 4.733 -11.887 2.118 524 1HB LEU 69 1HB LEU 69 4.538 -12.135 4.571 525 2HB LEU 69 2HB LEU 69 3.437 -13.482 4.341 526 HG LEU 69 HG LEU 69 5.249 -14.770 3.268 527 1HD1 LEU 69 1HD1 LEU 69 6.554 -12.924 2.378 528 2HD1 LEU 69 2HD1 LEU 69 7.551 -13.962 3.399 529 3HD1 LEU 69 3HD1 LEU 69 6.970 -12.413 4.014 530 1HD2 LEU 69 1HD2 LEU 69 4.835 -15.004 5.659 531 2HD2 LEU 69 2HD2 LEU 69 5.945 -13.677 5.990 532 3HD2 LEU 69 3HD2 LEU 69 6.551 -15.180 5.292 533 H ASN 70 H ASN 70 1.673 -13.615 2.453 534 HA ASN 70 HA ASN 70 2.290 -15.912 0.969 535 1HB ASN 70 1HB ASN 70 -0.329 -14.440 1.314 536 2HB ASN 70 2HB ASN 70 -0.193 -15.992 0.502 537 1HD2 ASN 70 1HD2 ASN 70 1.832 -17.020 2.292 538 2HD2 ASN 70 2HD2 ASN 70 1.035 -17.360 3.782 539 H LEU 71 H LEU 71 0.883 -12.827 -0.048 540 HA LEU 71 HA LEU 71 0.541 -13.389 -2.755 541 1HB LEU 71 1HB LEU 71 1.180 -10.774 -1.387 542 2HB LEU 71 2HB LEU 71 0.683 -10.909 -3.062 543 HG LEU 71 HG LEU 71 -0.996 -11.754 -0.701 544 1HD1 LEU 71 1HD1 LEU 71 -2.337 -9.769 -1.211 545 2HD1 LEU 71 2HD1 LEU 71 -1.158 -9.291 -2.432 546 3HD1 LEU 71 3HD1 LEU 71 -0.694 -9.344 -0.731 547 1HD2 LEU 71 1HD2 LEU 71 -1.672 -11.475 -3.626 548 2HD2 LEU 71 2HD2 LEU 71 -2.788 -11.924 -2.336 549 3HD2 LEU 71 3HD2 LEU 71 -1.452 -12.994 -2.760 550 H ARG 72 H ARG 72 3.330 -11.965 -1.073 551 HA ARG 72 HA ARG 72 4.860 -11.523 -3.409 552 1HB ARG 72 1HB ARG 72 5.151 -10.584 -0.986 553 2HB ARG 72 2HB ARG 72 6.122 -12.025 -0.736 554 1HG ARG 72 1HG ARG 72 6.859 -10.616 -3.161 555 2HG ARG 72 2HG ARG 72 6.995 -9.604 -1.722 556 1HD ARG 72 1HD ARG 72 9.092 -10.657 -2.000 557 2HD ARG 72 2HD ARG 72 8.297 -11.484 -0.664 558 HE ARG 72 HE ARG 72 7.961 -12.706 -3.271 559 1HH1 ARG 72 1HH1 ARG 72 9.810 -12.597 -0.298 560 2HH1 ARG 72 2HH1 ARG 72 10.459 -14.200 -0.491 561 1HH2 ARG 72 1HH2 ARG 72 8.833 -14.801 -3.554 562 2HH2 ARG 72 2HH2 ARG 72 9.912 -15.449 -2.347 563 H LYS 73 H LYS 73 4.609 -14.227 -1.185 564 HA LYS 73 HA LYS 73 6.813 -15.711 -2.075 565 1HB LYS 73 1HB LYS 73 4.475 -16.155 -0.405 566 2HB LYS 73 2HB LYS 73 4.925 -17.594 -1.311 567 1HG LYS 73 1HG LYS 73 6.799 -15.999 0.425 568 2HG LYS 73 2HG LYS 73 5.978 -17.485 0.913 569 1HD LYS 73 1HD LYS 73 7.090 -18.702 -0.883 570 2HD LYS 73 2HD LYS 73 7.879 -17.217 -1.412 571 1HE LYS 73 1HE LYS 73 9.108 -17.080 0.654 572 2HE LYS 73 2HE LYS 73 8.240 -18.471 1.305 573 1HZ LYS 73 1HZ LYS 73 9.214 -19.854 -0.398 574 2HZ LYS 73 2HZ LYS 73 10.441 -19.069 0.471 575 3HZ LYS 73 3HZ LYS 73 10.014 -18.524 -1.076 576 H ASN 74 H ASN 74 3.596 -15.362 -3.382 577 HA ASN 74 HA ASN 74 4.036 -17.502 -5.306 578 1HB ASN 74 1HB ASN 74 1.779 -16.877 -4.168 579 2HB ASN 74 2HB ASN 74 1.718 -15.585 -5.361 580 1HD2 ASN 74 1HD2 ASN 74 -0.056 -17.821 -5.032 581 2HD2 ASN 74 2HD2 ASN 74 -0.010 -18.725 -6.512 582 H GLY 75 H GLY 75 4.423 -14.107 -5.022 583 1HA GLY 75 1HA GLY 75 5.557 -12.717 -6.541 584 2HA GLY 75 2HA GLY 75 5.331 -13.936 -7.790 585 H VAL 76 H VAL 76 2.595 -13.181 -5.918 586 HA VAL 76 HA VAL 76 1.434 -11.790 -8.235 587 HB VAL 76 HB VAL 76 -0.759 -12.533 -7.395 588 1HG1 VAL 76 1HG1 VAL 76 0.413 -13.892 -9.040 589 2HG1 VAL 76 2HG1 VAL 76 -0.518 -14.908 -7.939 590 3HG1 VAL 76 3HG1 VAL 76 1.230 -14.771 -7.749 591 1HG2 VAL 76 1HG2 VAL 76 -0.858 -14.243 -5.618 592 2HG2 VAL 76 2HG2 VAL 76 -0.293 -12.679 -5.031 593 3HG2 VAL 76 3HG2 VAL 76 0.859 -13.985 -5.307 594 H ALA 77 H ALA 77 2.918 -10.828 -5.700 595 HA ALA 77 HA ALA 77 0.899 -9.168 -4.432 596 1HB ALA 77 1HB ALA 77 2.649 -10.238 -3.069 597 2HB ALA 77 2HB ALA 77 2.684 -8.479 -2.938 598 3HB ALA 77 3HB ALA 77 3.873 -9.313 -3.939 599 HA PRO 78 HA PRO 78 1.950 -5.428 -6.685 600 1HB PRO 78 1HB PRO 78 1.730 -3.924 -4.180 601 2HB PRO 78 2HB PRO 78 0.722 -3.829 -5.626 602 1HG PRO 78 1HG PRO 78 -0.158 -4.879 -3.289 603 2HG PRO 78 2HG PRO 78 -0.744 -5.426 -4.867 604 1HD PRO 78 1HD PRO 78 1.231 -6.704 -3.032 605 2HD PRO 78 2HD PRO 78 -0.007 -7.453 -4.061 606 H LYS 79 H LYS 79 3.830 -4.260 -7.026 607 HA LYS 79 HA LYS 79 6.195 -5.129 -5.785 608 1HB LYS 79 1HB LYS 79 5.599 -2.719 -7.493 609 2HB LYS 79 2HB LYS 79 7.214 -3.144 -6.963 610 1HG LYS 79 1HG LYS 79 6.928 -5.341 -8.124 611 2HG LYS 79 2HG LYS 79 5.416 -4.713 -8.789 612 1HD LYS 79 1HD LYS 79 6.666 -2.831 -9.776 613 2HD LYS 79 2HD LYS 79 8.164 -3.526 -9.162 614 1HE LYS 79 1HE LYS 79 7.756 -5.542 -10.517 615 2HE LYS 79 2HE LYS 79 6.296 -4.792 -11.161 616 1HZ LYS 79 1HZ LYS 79 9.107 -3.942 -11.568 617 2HZ LYS 79 2HZ LYS 79 7.799 -2.935 -11.922 618 3HZ LYS 79 3HZ LYS 79 7.973 -4.409 -12.743 619 H ALA 80 H ALA 80 4.075 -2.421 -5.208 620 HA ALA 80 HA ALA 80 5.284 -1.988 -2.621 621 1HB ALA 80 1HB ALA 80 6.661 -0.559 -4.074 622 2HB ALA 80 2HB ALA 80 5.705 0.382 -2.930 623 3HB ALA 80 3HB ALA 80 5.206 0.276 -4.618 624 H ILE 81 H ILE 81 3.974 -0.730 -1.234 625 HA ILE 81 HA ILE 81 1.296 -0.088 -2.270 626 HB ILE 81 HB ILE 81 0.441 -0.580 0.066 627 1HG1 ILE 81 1HG1 ILE 81 3.051 -2.101 0.279 628 2HG1 ILE 81 2HG1 ILE 81 2.658 -0.636 1.178 629 1HG2 ILE 81 1HG2 ILE 81 -0.075 -2.035 -1.773 630 2HG2 ILE 81 2HG2 ILE 81 0.291 -3.018 -0.356 631 3HG2 ILE 81 3HG2 ILE 81 1.490 -2.836 -1.634 632 1HD1 ILE 81 1HD1 ILE 81 1.261 -3.297 1.389 633 2HD1 ILE 81 2HD1 ILE 81 0.793 -1.829 2.245 634 3HD1 ILE 81 3HD1 ILE 81 2.354 -2.579 2.573 635 H ILE 82 H ILE 82 0.995 2.016 -2.248 636 HA ILE 82 HA ILE 82 2.453 3.645 -0.272 637 HB ILE 82 HB ILE 82 0.978 4.849 -2.593 638 1HG1 ILE 82 1HG1 ILE 82 2.308 3.086 -3.637 639 2HG1 ILE 82 2HG1 ILE 82 3.017 4.660 -3.986 640 1HG2 ILE 82 1HG2 ILE 82 2.734 6.552 -2.426 641 2HG2 ILE 82 2HG2 ILE 82 3.528 5.621 -1.158 642 3HG2 ILE 82 3HG2 ILE 82 1.930 6.315 -0.875 643 1HD1 ILE 82 1HD1 ILE 82 4.712 4.285 -2.289 644 2HD1 ILE 82 2HD1 ILE 82 4.712 2.982 -3.480 645 3HD1 ILE 82 3HD1 ILE 82 3.985 2.727 -1.892 646 H ASN 83 H ASN 83 1.314 4.335 1.416 647 HA ASN 83 HA ASN 83 -1.624 4.336 1.160 648 1HB ASN 83 1HB ASN 83 0.080 3.650 3.567 649 2HB ASN 83 2HB ASN 83 -1.669 3.824 3.609 650 1HD2 ASN 83 1HD2 ASN 83 -2.016 2.605 0.982 651 2HD2 ASN 83 2HD2 ASN 83 -1.752 0.910 1.207 652 H LYS 84 H LYS 84 -2.655 5.674 2.989 653 HA LYS 84 HA LYS 84 -1.229 8.225 3.254 654 1HB LYS 84 1HB LYS 84 -3.529 8.351 2.364 655 2HB LYS 84 2HB LYS 84 -4.131 7.535 3.801 656 1HG LYS 84 1HG LYS 84 -3.205 9.456 5.141 657 2HG LYS 84 2HG LYS 84 -2.925 10.282 3.608 658 1HD LYS 84 1HD LYS 84 -5.600 9.260 4.556 659 2HD LYS 84 2HD LYS 84 -5.048 10.927 4.705 660 1HE LYS 84 1HE LYS 84 -4.891 11.110 2.282 661 2HE LYS 84 2HE LYS 84 -5.386 9.426 2.108 662 1HZ LYS 84 1HZ LYS 84 -7.039 11.561 3.350 663 2HZ LYS 84 2HZ LYS 84 -7.512 9.958 3.077 664 3HZ LYS 84 3HZ LYS 84 -7.229 10.994 1.762 665 H LYS 85 H LYS 85 -2.888 5.693 5.037 666 HA LYS 85 HA LYS 85 -1.443 6.519 7.459 667 1HB LYS 85 1HB LYS 85 -4.282 5.562 7.166 668 2HB LYS 85 2HB LYS 85 -3.420 5.427 8.695 669 1HG LYS 85 1HG LYS 85 -3.925 7.988 7.189 670 2HG LYS 85 2HG LYS 85 -4.805 7.432 8.616 671 1HD LYS 85 1HD LYS 85 -2.828 7.554 9.960 672 2HD LYS 85 2HD LYS 85 -1.829 7.898 8.547 673 1HE LYS 85 1HE LYS 85 -3.065 10.010 8.230 674 2HE LYS 85 2HE LYS 85 -3.977 9.672 9.703 675 1HZ LYS 85 1HZ LYS 85 -1.024 9.957 9.560 676 2HZ LYS 85 2HZ LYS 85 -1.946 9.733 10.967 677 3HZ LYS 85 3HZ LYS 85 -2.088 11.171 10.080 678 H THR 86 H THR 86 0.071 5.089 7.880 679 HA THR 86 HA THR 86 -0.095 2.377 6.930 680 HB THR 86 HB THR 86 2.063 3.636 6.948 681 HG1 THR 86 HG1 THR 86 2.931 1.719 7.057 682 1HG2 THR 86 1HG2 THR 86 3.279 3.879 9.074 683 2HG2 THR 86 2HG2 THR 86 1.854 3.313 9.948 684 3HG2 THR 86 3HG2 THR 86 1.797 4.835 9.059 685 H GLU 87 H GLU 87 0.070 0.523 8.312 686 HA GLU 87 HA GLU 87 -0.938 0.960 11.041 687 1HB GLU 87 1HB GLU 87 -2.560 0.020 9.164 688 2HB GLU 87 2HB GLU 87 -1.718 -1.484 9.498 689 1HG GLU 87 1HG GLU 87 -3.224 0.172 11.515 690 2HG GLU 87 2HG GLU 87 -3.809 -1.299 10.742 691 H THR 88 H THR 88 -0.118 -0.435 12.593 692 HA THR 88 HA THR 88 2.563 -1.106 12.306 693 HB THR 88 HB THR 88 0.668 -2.244 14.364 694 HG1 THR 88 HG1 THR 88 1.918 0.312 14.148 695 1HG2 THR 88 1HG2 THR 88 2.914 -3.227 14.386 696 2HG2 THR 88 2HG2 THR 88 2.648 -2.225 15.814 697 3HG2 THR 88 3HG2 THR 88 3.623 -1.615 14.477 698 H ILE 89 H ILE 89 -0.288 -3.264 12.349 699 HA ILE 89 HA ILE 89 1.216 -5.669 12.218 700 HB ILE 89 HB ILE 89 -1.658 -5.158 11.420 701 1HG1 ILE 89 1HG1 ILE 89 -0.493 -6.212 14.011 702 2HG1 ILE 89 2HG1 ILE 89 -1.142 -4.591 13.771 703 1HG2 ILE 89 1HG2 ILE 89 -1.964 -7.580 11.740 704 2HG2 ILE 89 2HG2 ILE 89 -0.226 -7.753 11.984 705 3HG2 ILE 89 3HG2 ILE 89 -0.849 -7.210 10.426 706 1HD1 ILE 89 1HD1 ILE 89 -2.676 -7.171 13.588 707 2HD1 ILE 89 2HD1 ILE 89 -3.334 -5.562 13.289 708 3HD1 ILE 89 3HD1 ILE 89 -2.750 -5.990 14.897 709 H ILE 90 H ILE 90 -0.407 -3.713 9.764 710 HA ILE 90 HA ILE 90 0.100 -5.411 7.573 711 HB ILE 90 HB ILE 90 -0.269 -2.408 7.546 712 1HG1 ILE 90 1HG1 ILE 90 -2.340 -4.598 7.251 713 2HG1 ILE 90 2HG1 ILE 90 -2.082 -3.665 8.722 714 1HG2 ILE 90 1HG2 ILE 90 -0.675 -4.472 5.379 715 2HG2 ILE 90 2HG2 ILE 90 0.605 -3.260 5.438 716 3HG2 ILE 90 3HG2 ILE 90 -1.073 -2.759 5.249 717 1HD1 ILE 90 1HD1 ILE 90 -2.685 -1.625 7.515 718 2HD1 ILE 90 2HD1 ILE 90 -3.980 -2.823 7.488 719 3HD1 ILE 90 3HD1 ILE 90 -2.971 -2.580 6.060 720 H ALA 91 H ALA 91 1.908 -2.704 8.965 721 HA ALA 91 HA ALA 91 3.894 -2.476 7.006 722 1HB ALA 91 1HB ALA 91 3.536 -0.803 8.753 723 2HB ALA 91 2HB ALA 91 5.217 -1.335 8.709 724 3HB ALA 91 3HB ALA 91 4.134 -1.936 9.964 725 H VAL 92 H VAL 92 3.731 -4.510 9.897 726 HA VAL 92 HA VAL 92 6.308 -5.621 9.718 727 HB VAL 92 HB VAL 92 3.793 -6.871 10.852 728 1HG1 VAL 92 1HG1 VAL 92 5.293 -8.306 12.131 729 2HG1 VAL 92 2HG1 VAL 92 6.687 -7.573 11.338 730 3HG1 VAL 92 3HG1 VAL 92 5.542 -8.530 10.400 731 1HG2 VAL 92 1HG2 VAL 92 4.635 -6.076 13.010 732 2HG2 VAL 92 2HG2 VAL 92 4.353 -4.736 11.896 733 3HG2 VAL 92 3HG2 VAL 92 5.996 -5.303 12.196 734 H GLY 93 H GLY 93 3.198 -6.680 8.377 735 1HA GLY 93 1HA GLY 93 4.111 -9.075 7.207 736 2HA GLY 93 2HA GLY 93 2.693 -8.167 6.702 737 H ALA 94 H ALA 94 3.831 -5.802 5.863 738 HA ALA 94 HA ALA 94 4.741 -6.495 3.274 739 1HB ALA 94 1HB ALA 94 3.469 -4.461 3.709 740 2HB ALA 94 2HB ALA 94 5.008 -4.096 2.927 741 3HB ALA 94 3HB ALA 94 4.810 -3.819 4.658 742 H ALA 95 H ALA 95 6.399 -5.594 6.234 743 HA ALA 95 HA ALA 95 8.961 -5.147 5.118 744 1HB ALA 95 1HB ALA 95 8.236 -6.132 7.882 745 2HB ALA 95 2HB ALA 95 8.377 -4.446 7.382 746 3HB ALA 95 3HB ALA 95 9.801 -5.484 7.388 747 H MET 96 H MET 96 7.303 -8.058 6.268 748 HA MET 96 HA MET 96 9.462 -9.867 6.016 749 1HB MET 96 1HB MET 96 6.513 -10.426 5.622 750 2HB MET 96 2HB MET 96 7.758 -11.630 5.895 751 1HG MET 96 1HG MET 96 8.146 -10.674 8.131 752 2HG MET 96 2HG MET 96 6.824 -9.541 7.843 753 1HE MET 96 1HE MET 96 5.181 -12.005 10.383 754 2HE MET 96 2HE MET 96 5.500 -10.317 9.990 755 3HE MET 96 3HE MET 96 6.837 -11.398 10.380 756 H ALA 97 H ALA 97 6.907 -8.849 3.822 757 HA ALA 97 HA ALA 97 7.747 -10.612 1.714 758 1HB ALA 97 1HB ALA 97 5.917 -9.635 0.456 759 2HB ALA 97 2HB ALA 97 5.722 -8.383 1.682 760 3HB ALA 97 3HB ALA 97 5.390 -10.068 2.083 761 H GLU 98 H GLU 98 9.010 -7.792 2.825 762 HA GLU 98 HA GLU 98 10.429 -6.223 2.004 763 1HB GLU 98 1HB GLU 98 10.715 -8.247 -0.225 764 2HB GLU 98 2HB GLU 98 11.768 -6.858 0.004 765 1HG GLU 98 1HG GLU 98 12.475 -7.724 2.157 766 2HG GLU 98 2HG GLU 98 11.387 -9.097 1.974 767 H ILE 99 H ILE 99 7.794 -5.729 1.592 768 HA ILE 99 HA ILE 99 7.562 -4.651 -1.132 769 HB ILE 99 HB ILE 99 5.400 -5.013 0.954 770 1HG1 ILE 99 1HG1 ILE 99 6.185 -7.168 0.125 771 2HG1 ILE 99 2HG1 ILE 99 4.580 -6.822 -0.510 772 1HG2 ILE 99 1HG2 ILE 99 3.839 -4.480 -0.845 773 2HG2 ILE 99 2HG2 ILE 99 5.189 -4.218 -1.948 774 3HG2 ILE 99 3HG2 ILE 99 4.962 -3.150 -0.564 775 1HD1 ILE 99 1HD1 ILE 99 6.008 -7.811 -2.205 776 2HD1 ILE 99 2HD1 ILE 99 7.179 -6.507 -2.002 777 3HD1 ILE 99 3HD1 ILE 99 5.571 -6.160 -2.642 778 HA PRO 100 HA PRO 100 9.020 -0.979 1.199 779 1HB PRO 100 1HB PRO 100 9.061 0.527 -1.157 780 2HB PRO 100 2HB PRO 100 10.428 -0.341 -0.452 781 1HG PRO 100 1HG PRO 100 8.585 -1.164 -2.648 782 2HG PRO 100 2HG PRO 100 10.325 -1.460 -2.466 783 1HD PRO 100 1HD PRO 100 8.539 -3.390 -2.008 784 2HD PRO 100 2HD PRO 100 9.993 -3.233 -0.998 785 H LEU 101 H LEU 101 7.188 -0.421 2.344 786 HA LEU 101 HA LEU 101 5.055 0.898 0.837 787 1HB LEU 101 1HB LEU 101 3.580 0.426 2.573 788 2HB LEU 101 2HB LEU 101 4.581 -1.006 2.483 789 HG LEU 101 HG LEU 101 5.923 0.335 4.388 790 1HD1 LEU 101 1HD1 LEU 101 4.326 1.384 5.911 791 2HD1 LEU 101 2HD1 LEU 101 3.043 1.166 4.722 792 3HD1 LEU 101 3HD1 LEU 101 4.399 2.238 4.371 793 1HD2 LEU 101 1HD2 LEU 101 3.456 -1.339 4.823 794 2HD2 LEU 101 2HD2 LEU 101 4.732 -1.049 6.005 795 3HD2 LEU 101 3HD2 LEU 101 5.084 -1.949 4.531 796 H VAL 102 H VAL 102 4.571 2.971 1.106 797 HA VAL 102 HA VAL 102 5.960 4.520 3.172 798 HB VAL 102 HB VAL 102 6.407 6.335 1.563 799 1HG1 VAL 102 1HG1 VAL 102 8.186 4.724 2.006 800 2HG1 VAL 102 2HG1 VAL 102 8.254 5.296 0.342 801 3HG1 VAL 102 3HG1 VAL 102 7.596 3.700 0.700 802 1HG2 VAL 102 1HG2 VAL 102 6.217 5.935 -0.845 803 2HG2 VAL 102 2HG2 VAL 102 4.644 5.857 -0.051 804 3HG2 VAL 102 3HG2 VAL 102 5.467 4.371 -0.526 805 H GLU 103 H GLU 103 4.864 6.625 3.563 806 HA GLU 103 HA GLU 103 2.028 6.436 2.802 807 1HB GLU 103 1HB GLU 103 1.426 7.394 4.976 808 2HB GLU 103 2HB GLU 103 2.280 5.869 5.153 809 1HG GLU 103 1HG GLU 103 4.247 6.936 5.866 810 2HG GLU 103 2HG GLU 103 3.659 8.520 5.364 811 H VAL 104 H VAL 104 1.093 8.136 1.954 812 HA VAL 104 HA VAL 104 2.371 10.781 2.249 813 HB VAL 104 HB VAL 104 0.453 9.956 0.057 814 1HG1 VAL 104 1HG1 VAL 104 2.193 12.401 0.373 815 2HG1 VAL 104 2HG1 VAL 104 0.443 12.337 0.584 816 3HG1 VAL 104 3HG1 VAL 104 1.151 12.044 -1.004 817 1HG2 VAL 104 1HG2 VAL 104 2.374 9.930 -1.452 818 2HG2 VAL 104 2HG2 VAL 104 2.549 8.720 -0.182 819 3HG2 VAL 104 3HG2 VAL 104 3.458 10.229 -0.095 820 H ARG 105 H ARG 105 1.336 11.784 3.837 821 HA ARG 105 HA ARG 105 -1.317 10.943 4.601 822 1HB ARG 105 1HB ARG 105 -0.904 12.472 6.561 823 2HB ARG 105 2HB ARG 105 0.234 11.146 6.382 824 1HG ARG 105 1HG ARG 105 1.817 12.726 5.302 825 2HG ARG 105 2HG ARG 105 0.690 14.033 5.674 826 1HD ARG 105 1HD ARG 105 0.861 13.465 8.063 827 2HD ARG 105 2HD ARG 105 2.034 12.211 7.671 828 HE ARG 105 HE ARG 105 2.589 14.993 6.927 829 1HH1 ARG 105 1HH1 ARG 105 3.352 12.163 8.852 830 2HH1 ARG 105 2HH1 ARG 105 4.892 12.782 9.373 831 1HH2 ARG 105 1HH2 ARG 105 4.624 15.807 7.627 832 2HH2 ARG 105 2HH2 ARG 105 5.591 14.859 8.714 833 H ASP 106 H ASP 106 -1.169 12.391 2.138 834 HA ASP 106 HA ASP 106 -3.055 14.514 2.855 835 1HB ASP 106 1HB ASP 106 -0.743 15.476 2.335 836 2HB ASP 106 2HB ASP 106 -1.032 14.962 0.672 837 H GLU 107 H GLU 107 -4.677 14.888 1.380 838 HA GLU 107 HA GLU 107 -5.482 12.597 -0.113 839 1HB GLU 107 1HB GLU 107 -7.003 14.141 1.141 840 2HB GLU 107 2HB GLU 107 -6.708 15.359 -0.084 841 1HG GLU 107 1HG GLU 107 -8.819 14.258 -0.479 842 2HG GLU 107 2HG GLU 107 -7.684 13.898 -1.780 843 H LYS 108 H LYS 108 -3.791 15.504 -0.875 844 HA LYS 108 HA LYS 108 -4.555 15.865 -3.549 845 1HB LYS 108 1HB LYS 108 -2.027 16.572 -2.075 846 2HB LYS 108 2HB LYS 108 -2.333 17.052 -3.732 847 1HG LYS 108 1HG LYS 108 -4.257 18.334 -3.066 848 2HG LYS 108 2HG LYS 108 -4.098 17.756 -1.405 849 1HD LYS 108 1HD LYS 108 -1.882 18.845 -1.280 850 2HD LYS 108 2HD LYS 108 -2.136 19.490 -2.903 851 1HE LYS 108 1HE LYS 108 -4.090 20.713 -2.137 852 2HE LYS 108 2HE LYS 108 -3.907 20.030 -0.523 853 1HZ LYS 108 1HZ LYS 108 -1.815 21.171 -0.284 854 2HZ LYS 108 2HZ LYS 108 -3.021 22.289 -0.700 855 3HZ LYS 108 3HZ LYS 108 -1.911 21.770 -1.869 856 H PHE 109 H PHE 109 -2.276 13.654 -2.104 857 HA PHE 109 HA PHE 109 -0.847 12.911 -4.405 858 1HB PHE 109 1HB PHE 109 -0.131 12.246 -2.170 859 2HB PHE 109 2HB PHE 109 -1.584 11.275 -1.965 860 HD1 PHE 109 HD1 PHE 109 1.398 11.607 -4.164 861 HD2 PHE 109 HD2 PHE 109 -1.525 9.022 -2.473 862 HE1 PHE 109 HE1 PHE 109 2.584 9.665 -5.099 863 HE2 PHE 109 HE2 PHE 109 -0.345 7.073 -3.402 864 HZ PHE 109 HZ PHE 109 1.711 7.392 -4.715 865 H PHE 110 H PHE 110 -3.851 11.689 -3.010 866 HA PHE 110 HA PHE 110 -4.158 9.560 -4.882 867 1HB PHE 110 1HB PHE 110 -6.115 10.826 -2.956 868 2HB PHE 110 2HB PHE 110 -6.438 9.368 -3.886 869 HD1 PHE 110 HD1 PHE 110 -4.449 10.813 -1.159 870 HD2 PHE 110 HD2 PHE 110 -5.488 7.265 -3.265 871 HE1 PHE 110 HE1 PHE 110 -3.409 9.464 0.611 872 HE2 PHE 110 HE2 PHE 110 -4.451 5.907 -1.493 873 HZ PHE 110 HZ PHE 110 -3.410 7.008 0.449 874 H GLU 111 H GLU 111 -4.989 12.895 -4.850 875 HA GLU 111 HA GLU 111 -6.989 12.771 -6.882 876 1HB GLU 111 1HB GLU 111 -5.469 14.918 -5.471 877 2HB GLU 111 2HB GLU 111 -6.424 15.295 -6.882 878 1HG GLU 111 1HG GLU 111 -7.460 13.989 -4.386 879 2HG GLU 111 2HG GLU 111 -7.636 15.688 -4.809 880 H ALA 112 H ALA 112 -3.526 13.347 -6.731 881 HA ALA 112 HA ALA 112 -3.344 14.257 -9.457 882 1HB ALA 112 1HB ALA 112 -0.966 14.422 -9.054 883 2HB ALA 112 2HB ALA 112 -1.133 13.512 -7.551 884 3HB ALA 112 3HB ALA 112 -1.853 15.114 -7.695 885 H VAL 113 H VAL 113 -2.542 11.272 -7.704 886 HA VAL 113 HA VAL 113 -1.410 10.060 -10.064 887 HB VAL 113 HB VAL 113 -0.555 9.533 -7.790 888 1HG1 VAL 113 1HG1 VAL 113 -3.151 8.042 -7.448 889 2HG1 VAL 113 2HG1 VAL 113 -2.669 9.499 -6.581 890 3HG1 VAL 113 3HG1 VAL 113 -1.773 7.999 -6.345 891 1HG2 VAL 113 1HG2 VAL 113 -1.615 7.198 -9.365 892 2HG2 VAL 113 2HG2 VAL 113 -0.353 7.108 -8.137 893 3HG2 VAL 113 3HG2 VAL 113 -0.082 8.033 -9.615 894 H LYS 114 H LYS 114 -2.334 8.547 -11.386 895 HA LYS 114 HA LYS 114 -5.214 8.042 -10.991 896 1HB LYS 114 1HB LYS 114 -3.888 8.295 -13.677 897 2HB LYS 114 2HB LYS 114 -5.605 8.350 -13.300 898 1HG LYS 114 1HG LYS 114 -5.405 10.504 -12.322 899 2HG LYS 114 2HG LYS 114 -3.642 10.434 -12.387 900 1HD LYS 114 1HD LYS 114 -4.155 10.043 -14.963 901 2HD LYS 114 2HD LYS 114 -5.607 10.953 -14.535 902 1HE LYS 114 1HE LYS 114 -3.752 12.391 -15.335 903 2HE LYS 114 2HE LYS 114 -4.274 12.776 -13.696 904 1HZ LYS 114 1HZ LYS 114 -2.026 10.910 -14.144 905 2HZ LYS 114 2HZ LYS 114 -2.367 11.870 -12.787 906 3HZ LYS 114 3HZ LYS 114 -1.767 12.590 -14.203 907 H THR 115 H THR 115 -5.978 5.999 -11.731 908 HA THR 115 HA THR 115 -4.092 3.865 -11.599 909 HB THR 115 HB THR 115 -6.972 3.748 -12.528 910 HG1 THR 115 HG1 THR 115 -7.449 4.075 -10.497 911 1HG2 THR 115 1HG2 THR 115 -6.851 1.407 -11.806 912 2HG2 THR 115 2HG2 THR 115 -5.149 1.617 -11.399 913 3HG2 THR 115 3HG2 THR 115 -5.677 1.744 -13.077 914 H GLY 116 H GLY 116 -2.616 3.957 -13.219 915 1HA GLY 116 1HA GLY 116 -2.701 2.791 -15.562 916 2HA GLY 116 2HA GLY 116 -3.561 4.268 -15.975 917 H ASP 117 H ASP 117 -1.772 5.693 -13.938 918 HA ASP 117 HA ASP 117 0.294 6.403 -15.810 919 1HB ASP 117 1HB ASP 117 -0.355 7.345 -13.018 920 2HB ASP 117 2HB ASP 117 1.088 7.884 -13.869 921 H ARG 118 H ARG 118 2.615 6.591 -14.981 922 HA ARG 118 HA ARG 118 3.314 3.967 -13.834 923 1HB ARG 118 1HB ARG 118 3.988 4.678 -16.228 924 2HB ARG 118 2HB ARG 118 5.176 5.695 -15.442 925 1HG ARG 118 1HG ARG 118 4.983 2.709 -15.101 926 2HG ARG 118 2HG ARG 118 6.059 3.523 -16.232 927 1HD ARG 118 1HD ARG 118 6.097 3.674 -13.223 928 2HD ARG 118 2HD ARG 118 7.316 2.958 -14.278 929 HE ARG 118 HE ARG 118 6.777 5.842 -13.992 930 1HH1 ARG 118 1HH1 ARG 118 8.840 3.211 -15.030 931 2HH1 ARG 118 2HH1 ARG 118 10.249 4.223 -15.219 932 1HH2 ARG 118 1HH2 ARG 118 8.619 7.169 -14.253 933 2HH2 ARG 118 2HH2 ARG 118 10.116 6.473 -14.775 934 H VAL 119 H VAL 119 4.242 3.942 -11.938 935 HA VAL 119 HA VAL 119 5.379 6.461 -10.905 936 HB VAL 119 HB VAL 119 3.810 4.370 -9.381 937 1HG1 VAL 119 1HG1 VAL 119 4.021 5.894 -7.466 938 2HG1 VAL 119 2HG1 VAL 119 5.124 6.899 -8.407 939 3HG1 VAL 119 3HG1 VAL 119 5.577 5.247 -7.985 940 1HG2 VAL 119 1HG2 VAL 119 2.188 6.166 -9.040 941 2HG2 VAL 119 2HG2 VAL 119 2.414 5.825 -10.756 942 3HG2 VAL 119 3HG2 VAL 119 3.169 7.244 -10.032 943 H VAL 120 H VAL 120 7.326 6.394 -9.958 944 HA VAL 120 HA VAL 120 8.491 3.756 -9.344 945 HB VAL 120 HB VAL 120 9.939 6.305 -10.103 946 1HG1 VAL 120 1HG1 VAL 120 11.178 5.104 -8.391 947 2HG1 VAL 120 2HG1 VAL 120 11.995 4.960 -9.948 948 3HG1 VAL 120 3HG1 VAL 120 11.049 3.610 -9.319 949 1HG2 VAL 120 1HG2 VAL 120 10.705 5.040 -12.037 950 2HG2 VAL 120 2HG2 VAL 120 8.944 5.139 -11.999 951 3HG2 VAL 120 3HG2 VAL 120 9.755 3.649 -11.514 952 H VAL 121 H VAL 121 8.385 3.419 -7.237 953 HA VAL 121 HA VAL 121 8.647 5.723 -5.422 954 HB VAL 121 HB VAL 121 7.490 2.997 -4.822 955 1HG1 VAL 121 1HG1 VAL 121 6.707 4.047 -2.746 956 2HG1 VAL 121 2HG1 VAL 121 7.561 5.529 -3.182 957 3HG1 VAL 121 3HG1 VAL 121 8.467 4.048 -2.864 958 1HG2 VAL 121 1HG2 VAL 121 6.093 5.630 -5.287 959 2HG2 VAL 121 2HG2 VAL 121 5.320 4.127 -4.787 960 3HG2 VAL 121 3HG2 VAL 121 6.078 4.242 -6.375 961 H ASN 122 H ASN 122 10.558 5.927 -4.526 962 HA ASN 122 HA ASN 122 12.134 3.497 -3.982 963 1HB ASN 122 1HB ASN 122 13.168 5.213 -5.516 964 2HB ASN 122 2HB ASN 122 13.176 6.334 -4.160 965 1HD2 ASN 122 1HD2 ASN 122 14.704 6.135 -2.582 966 2HD2 ASN 122 2HD2 ASN 122 16.020 5.008 -2.668 967 H ALA 123 H ALA 123 12.198 2.904 -1.929 968 HA ALA 123 HA ALA 123 11.299 4.843 0.079 969 1HB ALA 123 1HB ALA 123 10.756 2.905 1.458 970 2HB ALA 123 2HB ALA 123 11.407 1.835 0.216 971 3HB ALA 123 3HB ALA 123 9.976 2.811 -0.120 972 H ASP 124 H ASP 124 14.153 3.969 -1.092 973 HA ASP 124 HA ASP 124 15.637 3.272 1.215 974 1HB ASP 124 1HB ASP 124 16.444 4.597 -1.372 975 2HB ASP 124 2HB ASP 124 17.597 4.283 -0.080 976 H GLU 125 H GLU 125 14.835 6.382 -0.281 977 HA GLU 125 HA GLU 125 15.479 7.634 2.295 978 1HB GLU 125 1HB GLU 125 16.060 9.639 1.195 979 2HB GLU 125 2HB GLU 125 16.871 8.372 0.312 980 1HG GLU 125 1HG GLU 125 14.294 9.668 -0.540 981 2HG GLU 125 2HG GLU 125 15.893 10.142 -1.111 982 H GLY 126 H GLY 126 13.191 7.387 -0.383 983 1HA GLY 126 1HA GLY 126 10.878 7.060 0.273 984 2HA GLY 126 2HA GLY 126 11.121 8.265 1.528 985 H TYR 127 H TYR 127 10.577 7.733 -1.897 986 HA TYR 127 HA TYR 127 9.154 10.218 -1.992 987 1HB TYR 127 1HB TYR 127 10.358 11.358 -3.689 988 2HB TYR 127 2HB TYR 127 11.548 10.908 -2.478 989 HD1 TYR 127 HD1 TYR 127 10.312 10.243 -5.880 990 HD2 TYR 127 HD2 TYR 127 13.329 9.366 -3.012 991 HE1 TYR 127 HE1 TYR 127 11.690 9.227 -7.645 992 HE2 TYR 127 HE2 TYR 127 14.707 8.345 -4.770 993 HH TYR 127 HH TYR 127 13.857 8.580 -8.147 994 H VAL 128 H VAL 128 7.840 10.421 -3.846 995 HA VAL 128 HA VAL 128 7.520 7.904 -5.356 996 HB VAL 128 HB VAL 128 5.401 9.918 -4.574 997 1HG1 VAL 128 1HG1 VAL 128 5.133 7.331 -6.094 998 2HG1 VAL 128 2HG1 VAL 128 4.950 8.954 -6.761 999 3HG1 VAL 128 3HG1 VAL 128 3.803 8.359 -5.561 1000 1HG2 VAL 128 1HG2 VAL 128 6.130 8.530 -2.703 1001 2HG2 VAL 128 2HG2 VAL 128 5.822 7.078 -3.654 1002 3HG2 VAL 128 3HG2 VAL 128 4.484 8.130 -3.191 1003 H GLU 129 H GLU 129 8.297 8.192 -7.355 1004 HA GLU 129 HA GLU 129 8.135 10.830 -8.592 1005 1HB GLU 129 1HB GLU 129 10.261 9.514 -8.654 1006 2HB GLU 129 2HB GLU 129 9.445 8.317 -9.648 1007 1HG GLU 129 1HG GLU 129 9.229 9.818 -11.451 1008 2HG GLU 129 2HG GLU 129 9.656 11.201 -10.443 1009 H LEU 130 H LEU 130 6.299 11.286 -9.560 1010 HA LEU 130 HA LEU 130 4.676 9.140 -10.684 1011 1HB LEU 130 1HB LEU 130 3.552 10.656 -9.176 1012 2HB LEU 130 2HB LEU 130 4.077 12.040 -10.113 1013 HG LEU 130 HG LEU 130 2.694 11.205 -12.017 1014 1HD1 LEU 130 1HD1 LEU 130 0.969 9.534 -11.544 1015 2HD1 LEU 130 2HD1 LEU 130 1.688 9.249 -9.961 1016 3HD1 LEU 130 3HD1 LEU 130 2.593 8.857 -11.424 1017 1HD2 LEU 130 1HD2 LEU 130 1.260 11.741 -9.421 1018 2HD2 LEU 130 2HD2 LEU 130 0.545 11.876 -11.027 1019 3HD2 LEU 130 3HD2 LEU 130 1.861 12.951 -10.554 1020 H ILE 131 H ILE 131 5.022 8.654 -12.728 1021 HA ILE 131 HA ILE 131 5.466 10.858 -14.628 1022 HB ILE 131 HB ILE 131 6.000 7.947 -15.126 1023 1HG1 ILE 131 1HG1 ILE 131 7.516 8.771 -13.369 1024 2HG1 ILE 131 2HG1 ILE 131 8.393 8.463 -14.865 1025 1HG2 ILE 131 1HG2 ILE 131 6.719 10.436 -16.659 1026 2HG2 ILE 131 2HG2 ILE 131 5.590 9.172 -17.146 1027 3HG2 ILE 131 3HG2 ILE 131 7.314 8.820 -17.042 1028 1HD1 ILE 131 1HD1 ILE 131 8.398 10.839 -15.362 1029 2HD1 ILE 131 2HD1 ILE 131 9.128 10.517 -13.789 1030 3HD1 ILE 131 3HD1 ILE 131 7.489 11.161 -13.887 1031 H GLU 132 H GLU 132 3.790 11.385 -15.709 1032 HA GLU 132 HA GLU 132 1.452 9.701 -15.777 1033 1HB GLU 132 1HB GLU 132 1.947 12.435 -16.975 1034 2HB GLU 132 2HB GLU 132 0.387 11.623 -16.899 1035 1HG GLU 132 1HG GLU 132 0.494 11.641 -14.456 1036 2HG GLU 132 2HG GLU 132 2.053 12.456 -14.533 Start of MODEL 14 1 H VAL 1 H VAL 1 4.683 14.675 -12.209 2 HA VAL 1 HA VAL 1 5.267 16.480 -10.102 3 HB VAL 1 HB VAL 1 3.159 15.648 -9.065 4 1HG1 VAL 1 1HG1 VAL 1 3.116 17.489 -10.656 5 2HG1 VAL 1 2HG1 VAL 1 1.676 16.486 -10.831 6 3HG1 VAL 1 3HG1 VAL 1 2.993 16.349 -11.995 7 1HG2 VAL 1 1HG2 VAL 1 3.052 13.849 -11.486 8 2HG2 VAL 1 2HG2 VAL 1 1.755 14.082 -10.314 9 3HG2 VAL 1 3HG2 VAL 1 3.268 13.324 -9.816 10 H LYS 2 H LYS 2 5.911 16.154 -8.033 11 HA LYS 2 HA LYS 2 6.768 13.416 -7.353 12 1HB LYS 2 1HB LYS 2 8.357 15.864 -6.622 13 2HB LYS 2 2HB LYS 2 8.869 14.181 -6.597 14 1HG LYS 2 1HG LYS 2 8.738 14.131 -9.050 15 2HG LYS 2 2HG LYS 2 8.310 15.842 -9.040 16 1HD LYS 2 1HD LYS 2 10.479 16.235 -7.796 17 2HD LYS 2 2HD LYS 2 10.897 14.564 -8.190 18 1HE LYS 2 1HE LYS 2 10.454 16.875 -10.053 19 2HE LYS 2 2HE LYS 2 11.881 15.852 -9.890 20 1HZ LYS 2 1HZ LYS 2 10.677 15.257 -11.865 21 2HZ LYS 2 2HZ LYS 2 9.245 15.047 -10.986 22 3HZ LYS 2 3HZ LYS 2 10.543 13.984 -10.743 23 H PHE 3 H PHE 3 6.540 12.796 -5.245 24 HA PHE 3 HA PHE 3 5.588 14.815 -3.339 25 1HB PHE 3 1HB PHE 3 4.339 12.084 -3.727 26 2HB PHE 3 2HB PHE 3 3.879 13.260 -2.502 27 HD1 PHE 3 HD1 PHE 3 2.925 15.472 -3.250 28 HD2 PHE 3 HD2 PHE 3 3.416 12.162 -5.880 29 HE1 PHE 3 HE1 PHE 3 1.327 16.485 -4.819 30 HE2 PHE 3 HE2 PHE 3 1.817 13.170 -7.454 31 HZ PHE 3 HZ PHE 3 0.772 15.335 -6.923 32 H ALA 4 H ALA 4 6.049 14.385 -1.173 33 HA ALA 4 HA ALA 4 8.243 12.486 -0.794 34 1HB ALA 4 1HB ALA 4 7.358 14.791 0.939 35 2HB ALA 4 2HB ALA 4 8.700 14.812 -0.204 36 3HB ALA 4 3HB ALA 4 8.769 13.770 1.218 37 H CYS 5 H CYS 5 8.016 10.721 0.430 38 HA CYS 5 HA CYS 5 5.674 10.550 2.201 39 1HB CYS 5 1HB CYS 5 7.014 8.258 0.762 40 2HB CYS 5 2HB CYS 5 5.532 8.191 1.709 41 HG CYS 5 HG CYS 5 5.006 10.430 -0.554 42 H ARG 6 H ARG 6 6.012 8.915 3.982 43 HA ARG 6 HA ARG 6 8.722 9.171 5.057 44 1HB ARG 6 1HB ARG 6 6.578 9.696 6.386 45 2HB ARG 6 2HB ARG 6 6.362 7.955 6.474 46 1HG ARG 6 1HG ARG 6 7.399 8.692 8.490 47 2HG ARG 6 2HG ARG 6 8.593 7.790 7.555 48 1HD ARG 6 1HD ARG 6 8.437 10.755 7.248 49 2HD ARG 6 2HD ARG 6 9.210 10.082 8.678 50 HE ARG 6 HE ARG 6 10.714 8.873 7.099 51 1HH1 ARG 6 1HH1 ARG 6 9.018 11.738 5.984 52 2HH1 ARG 6 2HH1 ARG 6 10.295 12.226 4.910 53 1HH2 ARG 6 1HH2 ARG 6 12.400 9.532 5.675 54 2HH2 ARG 6 2HH2 ARG 6 12.192 10.971 4.724 55 H ALA 7 H ALA 7 10.049 7.448 5.346 56 HA ALA 7 HA ALA 7 9.466 5.155 3.732 57 1HB ALA 7 1HB ALA 7 11.753 4.486 4.191 58 2HB ALA 7 2HB ALA 7 11.886 5.725 5.440 59 3HB ALA 7 3HB ALA 7 11.690 6.193 3.749 60 H ILE 8 H ILE 8 7.875 3.949 4.697 61 HA ILE 8 HA ILE 8 8.195 2.962 7.399 62 HB ILE 8 HB ILE 8 6.264 2.045 5.256 63 1HG1 ILE 8 1HG1 ILE 8 5.960 4.430 5.713 64 2HG1 ILE 8 2HG1 ILE 8 4.609 3.502 6.353 65 1HG2 ILE 8 1HG2 ILE 8 6.545 0.429 7.042 66 2HG2 ILE 8 2HG2 ILE 8 4.949 1.172 7.129 67 3HG2 ILE 8 3HG2 ILE 8 6.218 1.674 8.248 68 1HD1 ILE 8 1HD1 ILE 8 5.294 5.255 7.890 69 2HD1 ILE 8 2HD1 ILE 8 6.921 4.576 7.951 70 3HD1 ILE 8 3HD1 ILE 8 5.558 3.656 8.590 71 H THR 9 H THR 9 8.213 1.610 4.124 72 HA THR 9 HA THR 9 9.983 -0.553 5.064 73 HB THR 9 HB THR 9 8.750 -0.552 2.335 74 HG1 THR 9 HG1 THR 9 7.360 -0.527 4.691 75 1HG2 THR 9 1HG2 THR 9 9.412 -2.690 4.361 76 2HG2 THR 9 2HG2 THR 9 10.256 -2.360 2.848 77 3HG2 THR 9 3HG2 THR 9 8.615 -2.997 2.820 78 H ARG 10 H ARG 10 11.536 -1.184 3.074 79 HA ARG 10 HA ARG 10 12.621 1.318 1.978 80 1HB ARG 10 1HB ARG 10 14.222 -0.981 3.115 81 2HB ARG 10 2HB ARG 10 14.888 0.473 2.380 82 1HG ARG 10 1HG ARG 10 13.893 1.834 4.135 83 2HG ARG 10 2HG ARG 10 13.186 0.394 4.862 84 1HD ARG 10 1HD ARG 10 15.520 -0.494 5.122 85 2HD ARG 10 2HD ARG 10 16.101 1.097 4.623 86 HE ARG 10 HE ARG 10 14.229 0.986 6.861 87 1HH1 ARG 10 1HH1 ARG 10 17.528 1.416 5.753 88 2HH1 ARG 10 2HH1 ARG 10 18.078 2.079 7.267 89 1HH2 ARG 10 1HH2 ARG 10 14.923 1.890 8.815 90 2HH2 ARG 10 2HH2 ARG 10 16.580 2.382 9.005 91 H GLY 11 H GLY 11 14.479 0.585 0.299 92 1HA GLY 11 1HA GLY 11 14.945 -0.759 -1.607 93 2HA GLY 11 2HA GLY 11 13.389 -1.553 -1.389 94 H ARG 12 H ARG 12 13.182 -1.117 -3.724 95 HA ARG 12 HA ARG 12 11.627 1.274 -4.092 96 1HB ARG 12 1HB ARG 12 12.877 2.090 -6.043 97 2HB ARG 12 2HB ARG 12 13.837 2.157 -4.578 98 1HG ARG 12 1HG ARG 12 15.394 1.333 -6.009 99 2HG ARG 12 2HG ARG 12 14.693 -0.189 -5.454 100 1HD ARG 12 1HD ARG 12 14.947 -0.189 -7.872 101 2HD ARG 12 2HD ARG 12 13.241 -0.227 -7.428 102 HE ARG 12 HE ARG 12 14.105 2.442 -7.824 103 1HH1 ARG 12 1HH1 ARG 12 13.312 -0.465 -9.635 104 2HH1 ARG 12 2HH1 ARG 12 12.819 0.426 -11.054 105 1HH2 ARG 12 1HH2 ARG 12 13.489 3.575 -9.684 106 2HH2 ARG 12 2HH2 ARG 12 12.907 2.705 -11.073 107 H ALA 13 H ALA 13 10.239 1.175 -5.845 108 HA ALA 13 HA ALA 13 10.335 -1.137 -7.605 109 1HB ALA 13 1HB ALA 13 7.931 -0.633 -5.859 110 2HB ALA 13 2HB ALA 13 9.120 -1.904 -5.585 111 3HB ALA 13 3HB ALA 13 8.127 -1.924 -7.043 112 H GLU 14 H GLU 14 9.026 -0.902 -9.441 113 HA GLU 14 HA GLU 14 7.627 1.648 -9.762 114 1HB GLU 14 1HB GLU 14 8.638 1.834 -12.053 115 2HB GLU 14 2HB GLU 14 9.774 2.080 -10.733 116 1HG GLU 14 1HG GLU 14 10.642 -0.152 -11.003 117 2HG GLU 14 2HG GLU 14 9.437 -0.504 -12.242 118 H GLY 15 H GLY 15 5.666 1.362 -10.646 119 1HA GLY 15 1HA GLY 15 5.221 -0.657 -12.651 120 2HA GLY 15 2HA GLY 15 4.489 -1.057 -11.104 121 H GLU 16 H GLU 16 2.838 -0.833 -13.187 122 HA GLU 16 HA GLU 16 1.772 1.757 -13.559 123 1HB GLU 16 1HB GLU 16 0.264 -0.834 -13.880 124 2HB GLU 16 2HB GLU 16 0.036 0.667 -14.747 125 1HG GLU 16 1HG GLU 16 2.320 -1.257 -15.027 126 2HG GLU 16 2HG GLU 16 1.059 -0.916 -16.206 127 H ALA 17 H ALA 17 0.370 2.864 -12.330 128 HA ALA 17 HA ALA 17 -0.223 1.842 -9.708 129 1HB ALA 17 1HB ALA 17 -0.949 4.495 -10.929 130 2HB ALA 17 2HB ALA 17 0.539 4.147 -10.050 131 3HB ALA 17 3HB ALA 17 -1.014 4.070 -9.219 132 H LEU 18 H LEU 18 -2.150 1.386 -8.839 133 HA LEU 18 HA LEU 18 -4.495 1.435 -10.615 134 1HB LEU 18 1HB LEU 18 -3.407 -0.834 -10.000 135 2HB LEU 18 2HB LEU 18 -4.069 -0.557 -8.401 136 HG LEU 18 HG LEU 18 -5.823 -0.557 -10.843 137 1HD1 LEU 18 1HD1 LEU 18 -5.073 -2.918 -9.118 138 2HD1 LEU 18 2HD1 LEU 18 -4.575 -2.667 -10.791 139 3HD1 LEU 18 3HD1 LEU 18 -6.280 -2.915 -10.405 140 1HD2 LEU 18 1HD2 LEU 18 -7.561 -1.112 -9.238 141 2HD2 LEU 18 2HD2 LEU 18 -6.737 0.372 -8.756 142 3HD2 LEU 18 3HD2 LEU 18 -6.374 -1.148 -7.934 143 H VAL 19 H VAL 19 -5.940 2.881 -9.886 144 HA VAL 19 HA VAL 19 -5.719 3.684 -7.072 145 HB VAL 19 HB VAL 19 -6.992 5.212 -9.346 146 1HG1 VAL 19 1HG1 VAL 19 -7.969 5.782 -7.203 147 2HG1 VAL 19 2HG1 VAL 19 -6.945 7.102 -7.766 148 3HG1 VAL 19 3HG1 VAL 19 -6.366 6.014 -6.506 149 1HG2 VAL 19 1HG2 VAL 19 -4.320 5.601 -8.003 150 2HG2 VAL 19 2HG2 VAL 19 -5.024 6.652 -9.233 151 3HG2 VAL 19 3HG2 VAL 19 -4.580 4.994 -9.639 152 H THR 20 H THR 20 -7.095 2.657 -5.841 153 HA THR 20 HA THR 20 -9.900 3.177 -6.251 154 HB THR 20 HB THR 20 -9.718 0.996 -7.335 155 HG1 THR 20 HG1 THR 20 -11.313 1.509 -5.274 156 1HG2 THR 20 1HG2 THR 20 -8.560 -0.015 -4.737 157 2HG2 THR 20 2HG2 THR 20 -7.687 0.172 -6.258 158 3HG2 THR 20 3HG2 THR 20 -8.993 -1.006 -6.136 159 H LYS 21 H LYS 21 -9.948 4.450 -4.491 160 HA LYS 21 HA LYS 21 -8.375 3.950 -2.185 161 1HB LYS 21 1HB LYS 21 -10.003 5.776 -1.218 162 2HB LYS 21 2HB LYS 21 -8.765 6.192 -2.392 163 1HG LYS 21 1HG LYS 21 -10.266 6.834 -3.903 164 2HG LYS 21 2HG LYS 21 -11.264 5.402 -3.643 165 1HD LYS 21 1HD LYS 21 -12.329 6.408 -1.753 166 2HD LYS 21 2HD LYS 21 -11.207 7.769 -1.782 167 1HE LYS 21 1HE LYS 21 -12.116 8.568 -3.836 168 2HE LYS 21 2HE LYS 21 -13.080 7.109 -4.045 169 1HZ LYS 21 1HZ LYS 21 -14.551 7.744 -2.402 170 2HZ LYS 21 2HZ LYS 21 -14.194 9.229 -3.145 171 3HZ LYS 21 3HZ LYS 21 -13.459 8.816 -1.673 172 H GLU 22 H GLU 22 -11.918 4.259 -2.271 173 HA GLU 22 HA GLU 22 -13.545 3.286 -1.016 174 1HB GLU 22 1HB GLU 22 -11.774 1.047 -1.898 175 2HB GLU 22 2HB GLU 22 -13.111 0.692 -0.815 176 1HG GLU 22 1HG GLU 22 -13.514 0.438 -3.314 177 2HG GLU 22 2HG GLU 22 -14.714 1.327 -2.379 178 H TYR 23 H TYR 23 -13.559 1.191 0.815 179 HA TYR 23 HA TYR 23 -11.490 1.541 2.773 180 1HB TYR 23 1HB TYR 23 -13.162 2.198 4.584 181 2HB TYR 23 2HB TYR 23 -12.688 3.460 3.459 182 HD1 TYR 23 HD1 TYR 23 -15.433 1.508 4.782 183 HD2 TYR 23 HD2 TYR 23 -14.282 4.163 1.662 184 HE1 TYR 23 HE1 TYR 23 -17.799 1.982 4.318 185 HE2 TYR 23 HE2 TYR 23 -16.642 4.640 1.188 186 HH TYR 23 HH TYR 23 -18.897 3.339 1.551 187 H ILE 24 H ILE 24 -12.166 -0.645 1.371 188 HA ILE 24 HA ILE 24 -14.125 -2.280 2.648 189 HB ILE 24 HB ILE 24 -13.214 -4.110 1.270 190 1HG1 ILE 24 1HG1 ILE 24 -11.240 -2.041 0.271 191 2HG1 ILE 24 2HG1 ILE 24 -10.831 -3.367 1.352 192 1HG2 ILE 24 1HG2 ILE 24 -13.757 -3.121 -0.921 193 2HG2 ILE 24 2HG2 ILE 24 -13.680 -1.516 -0.196 194 3HG2 ILE 24 3HG2 ILE 24 -14.911 -2.664 0.333 195 1HD1 ILE 24 1HD1 ILE 24 -11.857 -3.633 -1.464 196 2HD1 ILE 24 2HD1 ILE 24 -11.463 -4.970 -0.383 197 3HD1 ILE 24 3HD1 ILE 24 -10.194 -3.874 -0.929 198 H SER 25 H SER 25 -13.302 -4.627 3.208 199 HA SER 25 HA SER 25 -11.607 -4.295 5.540 200 1HB SER 25 1HB SER 25 -13.758 -5.476 5.756 201 2HB SER 25 2HB SER 25 -13.227 -6.668 4.574 202 HG SER 25 HG SER 25 -11.743 -6.198 6.940 203 H PHE 26 H PHE 26 -9.543 -4.920 5.637 204 HA PHE 26 HA PHE 26 -8.332 -6.190 3.341 205 1HB PHE 26 1HB PHE 26 -7.297 -4.313 4.792 206 2HB PHE 26 2HB PHE 26 -6.938 -5.593 5.944 207 HD1 PHE 26 HD1 PHE 26 -6.188 -4.240 2.628 208 HD2 PHE 26 HD2 PHE 26 -5.230 -7.230 5.503 209 HE1 PHE 26 HE1 PHE 26 -4.132 -4.769 1.385 210 HE2 PHE 26 HE2 PHE 26 -3.171 -7.765 4.265 211 HZ PHE 26 HZ PHE 26 -2.622 -6.531 2.201 212 H LEU 27 H LEU 27 -9.211 -8.248 3.328 213 HA LEU 27 HA LEU 27 -8.181 -10.023 5.446 214 1HB LEU 27 1HB LEU 27 -10.724 -10.370 3.844 215 2HB LEU 27 2HB LEU 27 -10.094 -11.511 5.016 216 HG LEU 27 HG LEU 27 -11.005 -8.709 5.682 217 1HD1 LEU 27 1HD1 LEU 27 -12.390 -11.360 6.062 218 2HD1 LEU 27 2HD1 LEU 27 -12.876 -10.075 4.955 219 3HD1 LEU 27 3HD1 LEU 27 -12.947 -9.813 6.697 220 1HD2 LEU 27 1HD2 LEU 27 -10.272 -11.044 7.445 221 2HD2 LEU 27 2HD2 LEU 27 -10.892 -9.486 7.996 222 3HD2 LEU 27 3HD2 LEU 27 -9.314 -9.580 7.212 223 H GLY 28 H GLY 28 -9.763 -10.652 2.343 224 1HA GLY 28 1HA GLY 28 -7.258 -11.511 1.143 225 2HA GLY 28 2HA GLY 28 -8.458 -12.770 1.407 226 H GLY 29 H GLY 29 -8.397 -9.437 0.165 227 1HA GLY 29 1HA GLY 29 -10.530 -10.079 -1.697 228 2HA GLY 29 2HA GLY 29 -9.808 -8.497 -1.443 229 H ILE 30 H ILE 30 -7.593 -11.031 -1.905 230 HA ILE 30 HA ILE 30 -7.319 -10.464 -4.770 231 HB ILE 30 HB ILE 30 -5.009 -10.556 -2.809 232 1HG1 ILE 30 1HG1 ILE 30 -6.164 -8.194 -4.305 233 2HG1 ILE 30 2HG1 ILE 30 -6.346 -8.490 -2.582 234 1HG2 ILE 30 1HG2 ILE 30 -5.081 -9.972 -5.766 235 2HG2 ILE 30 2HG2 ILE 30 -4.419 -11.417 -4.999 236 3HG2 ILE 30 3HG2 ILE 30 -3.658 -9.846 -4.735 237 1HD1 ILE 30 1HD1 ILE 30 -3.750 -7.970 -4.008 238 2HD1 ILE 30 2HD1 ILE 30 -3.941 -8.264 -2.280 239 3HD1 ILE 30 3HD1 ILE 30 -4.643 -6.822 -3.013 240 H ASP 31 H ASP 31 -6.946 -12.280 -5.951 241 HA ASP 31 HA ASP 31 -7.107 -14.843 -4.761 242 1HB ASP 31 1HB ASP 31 -7.818 -14.302 -7.100 243 2HB ASP 31 2HB ASP 31 -6.118 -14.176 -7.536 244 H LYS 32 H LYS 32 -5.563 -16.324 -4.252 245 HA LYS 32 HA LYS 32 -2.980 -15.191 -3.687 246 1HB LYS 32 1HB LYS 32 -2.585 -17.276 -2.441 247 2HB LYS 32 2HB LYS 32 -4.092 -16.500 -1.978 248 1HG LYS 32 1HG LYS 32 -5.321 -18.090 -3.403 249 2HG LYS 32 2HG LYS 32 -3.796 -18.888 -3.792 250 1HD LYS 32 1HD LYS 32 -4.931 -20.109 -2.038 251 2HD LYS 32 2HD LYS 32 -3.469 -19.363 -1.391 252 1HE LYS 32 1HE LYS 32 -4.835 -17.517 -0.496 253 2HE LYS 32 2HE LYS 32 -6.285 -18.317 -1.100 254 1HZ LYS 32 1HZ LYS 32 -4.414 -19.465 0.900 255 2HZ LYS 32 2HZ LYS 32 -5.859 -20.172 0.363 256 3HZ LYS 32 3HZ LYS 32 -5.900 -18.735 1.267 257 H GLU 33 H GLU 33 -4.188 -16.810 -6.364 258 HA GLU 33 HA GLU 33 -1.546 -17.984 -6.908 259 1HB GLU 33 1HB GLU 33 -4.264 -18.930 -7.792 260 2HB GLU 33 2HB GLU 33 -2.753 -19.569 -8.420 261 1HG GLU 33 1HG GLU 33 -2.138 -20.133 -6.042 262 2HG GLU 33 2HG GLU 33 -3.799 -19.735 -5.609 263 H THR 34 H THR 34 -4.156 -16.023 -8.246 264 HA THR 34 HA THR 34 -2.338 -15.480 -10.503 265 HB THR 34 HB THR 34 -4.229 -16.687 -11.363 266 HG1 THR 34 HG1 THR 34 -3.963 -13.960 -11.975 267 1HG2 THR 34 1HG2 THR 34 -6.520 -15.782 -11.211 268 2HG2 THR 34 2HG2 THR 34 -5.932 -14.543 -10.101 269 3HG2 THR 34 3HG2 THR 34 -5.868 -16.244 -9.640 270 H GLY 35 H GLY 35 -3.716 -14.102 -7.795 271 1HA GLY 35 1HA GLY 35 -3.552 -11.951 -7.001 272 2HA GLY 35 2HA GLY 35 -2.654 -11.547 -8.453 273 H ILE 36 H ILE 36 -5.863 -12.877 -8.673 274 HA ILE 36 HA ILE 36 -6.857 -10.409 -9.838 275 HB ILE 36 HB ILE 36 -8.217 -13.088 -9.455 276 1HG1 ILE 36 1HG1 ILE 36 -6.338 -13.120 -11.052 277 2HG1 ILE 36 2HG1 ILE 36 -7.884 -13.398 -11.841 278 1HG2 ILE 36 1HG2 ILE 36 -9.930 -12.240 -10.990 279 2HG2 ILE 36 2HG2 ILE 36 -9.143 -10.661 -10.988 280 3HG2 ILE 36 3HG2 ILE 36 -9.854 -11.295 -9.503 281 1HD1 ILE 36 1HD1 ILE 36 -6.344 -10.818 -11.821 282 2HD1 ILE 36 2HD1 ILE 36 -7.905 -11.075 -12.597 283 3HD1 ILE 36 3HD1 ILE 36 -6.481 -11.948 -13.168 284 H VAL 37 H VAL 37 -8.061 -8.958 -8.772 285 HA VAL 37 HA VAL 37 -8.578 -9.149 -6.003 286 HB VAL 37 HB VAL 37 -9.841 -7.300 -8.047 287 1HG1 VAL 37 1HG1 VAL 37 -11.185 -7.373 -6.023 288 2HG1 VAL 37 2HG1 VAL 37 -10.325 -5.837 -6.121 289 3HG1 VAL 37 3HG1 VAL 37 -9.750 -7.102 -5.035 290 1HG2 VAL 37 1HG2 VAL 37 -7.401 -7.133 -7.947 291 2HG2 VAL 37 2HG2 VAL 37 -7.494 -6.878 -6.204 292 3HG2 VAL 37 3HG2 VAL 37 -8.177 -5.684 -7.307 293 H LYS 38 H LYS 38 -10.191 -9.997 -4.894 294 HA LYS 38 HA LYS 38 -12.322 -11.413 -6.288 295 1HB LYS 38 1HB LYS 38 -11.682 -11.253 -3.334 296 2HB LYS 38 2HB LYS 38 -12.828 -12.356 -4.081 297 1HG LYS 38 1HG LYS 38 -9.883 -12.334 -4.684 298 2HG LYS 38 2HG LYS 38 -10.642 -13.372 -3.476 299 1HD LYS 38 1HD LYS 38 -12.032 -14.385 -5.206 300 2HD LYS 38 2HD LYS 38 -11.301 -13.331 -6.420 301 1HE LYS 38 1HE LYS 38 -9.140 -14.328 -6.053 302 2HE LYS 38 2HE LYS 38 -9.771 -15.298 -4.723 303 1HZ LYS 38 1HZ LYS 38 -9.510 -16.485 -6.879 304 2HZ LYS 38 2HZ LYS 38 -10.759 -15.524 -7.514 305 3HZ LYS 38 3HZ LYS 38 -11.067 -16.573 -6.211 306 H GLU 39 H GLU 39 -11.898 -8.759 -4.036 307 HA GLU 39 HA GLU 39 -14.764 -8.476 -3.641 308 1HB GLU 39 1HB GLU 39 -13.049 -8.333 -1.780 309 2HB GLU 39 2HB GLU 39 -12.543 -6.796 -2.474 310 1HG GLU 39 1HG GLU 39 -14.069 -6.481 -0.605 311 2HG GLU 39 2HG GLU 39 -14.767 -5.886 -2.109 312 H ASP 40 H ASP 40 -15.961 -7.138 -4.837 313 HA ASP 40 HA ASP 40 -14.716 -5.417 -6.757 314 1HB ASP 40 1HB ASP 40 -16.793 -6.492 -7.362 315 2HB ASP 40 2HB ASP 40 -17.626 -5.743 -6.002 316 H CYS 41 H CYS 41 -14.343 -3.327 -6.689 317 HA CYS 41 HA CYS 41 -15.357 -1.765 -4.408 318 1HB CYS 41 1HB CYS 41 -12.671 -1.461 -5.774 319 2HB CYS 41 2HB CYS 41 -13.249 -0.531 -4.395 320 HG CYS 41 HG CYS 41 -12.710 -3.913 -4.314 321 H GLU 42 H GLU 42 -14.700 -1.996 -7.782 322 HA GLU 42 HA GLU 42 -16.554 -0.164 -8.675 323 1HB GLU 42 1HB GLU 42 -14.646 1.340 -7.546 324 2HB GLU 42 2HB GLU 42 -13.869 1.086 -9.099 325 1HG GLU 42 1HG GLU 42 -16.573 2.327 -8.640 326 2HG GLU 42 2HG GLU 42 -15.092 3.175 -9.072 327 H ILE 43 H ILE 43 -13.154 -0.810 -9.401 328 HA ILE 43 HA ILE 43 -13.943 -1.987 -11.972 329 HB ILE 43 HB ILE 43 -11.521 -1.450 -12.632 330 1HG1 ILE 43 1HG1 ILE 43 -11.824 0.460 -10.297 331 2HG1 ILE 43 2HG1 ILE 43 -10.728 -0.917 -10.348 332 1HG2 ILE 43 1HG2 ILE 43 -13.463 0.813 -12.186 333 2HG2 ILE 43 2HG2 ILE 43 -13.480 -0.313 -13.542 334 3HG2 ILE 43 3HG2 ILE 43 -12.129 0.800 -13.341 335 1HD1 ILE 43 1HD1 ILE 43 -9.541 1.145 -10.769 336 2HD1 ILE 43 2HD1 ILE 43 -10.614 1.513 -12.118 337 3HD1 ILE 43 3HD1 ILE 43 -9.525 0.128 -12.209 338 H LYS 44 H LYS 44 -14.273 -3.897 -10.600 339 HA LYS 44 HA LYS 44 -11.845 -5.218 -9.666 340 1HB LYS 44 1HB LYS 44 -13.655 -5.261 -8.108 341 2HB LYS 44 2HB LYS 44 -14.789 -5.793 -9.335 342 1HG LYS 44 1HG LYS 44 -12.497 -7.569 -8.667 343 2HG LYS 44 2HG LYS 44 -13.839 -7.445 -7.527 344 1HD LYS 44 1HD LYS 44 -15.396 -7.998 -9.390 345 2HD LYS 44 2HD LYS 44 -13.995 -8.251 -10.432 346 1HE LYS 44 1HE LYS 44 -13.204 -10.005 -8.890 347 2HE LYS 44 2HE LYS 44 -14.664 -9.783 -7.923 348 1HZ LYS 44 1HZ LYS 44 -15.948 -10.317 -9.979 349 2HZ LYS 44 2HZ LYS 44 -15.033 -11.609 -9.376 350 3HZ LYS 44 3HZ LYS 44 -14.488 -10.741 -10.728 351 H GLY 45 H GLY 45 -10.991 -7.033 -10.569 352 1HA GLY 45 1HA GLY 45 -11.820 -9.126 -11.820 353 2HA GLY 45 2HA GLY 45 -12.227 -7.963 -13.071 354 H GLU 46 H GLU 46 -9.564 -6.656 -11.791 355 HA GLU 46 HA GLU 46 -7.909 -7.937 -13.851 356 1HB GLU 46 1HB GLU 46 -7.665 -5.211 -12.569 357 2HB GLU 46 2HB GLU 46 -6.565 -5.856 -13.782 358 1HG GLU 46 1HG GLU 46 -8.496 -6.045 -15.336 359 2HG GLU 46 2HG GLU 46 -9.488 -5.232 -14.126 360 H SER 47 H SER 47 -5.486 -7.670 -13.367 361 HA SER 47 HA SER 47 -5.002 -9.049 -10.845 362 1HB SER 47 1HB SER 47 -3.053 -8.561 -13.106 363 2HB SER 47 2HB SER 47 -2.931 -9.764 -11.825 364 HG SER 47 HG SER 47 -3.759 -10.379 -14.051 365 H VAL 48 H VAL 48 -3.816 -8.215 -9.201 366 HA VAL 48 HA VAL 48 -2.730 -5.505 -9.543 367 HB VAL 48 HB VAL 48 -2.531 -5.470 -7.068 368 1HG1 VAL 48 1HG1 VAL 48 -5.274 -6.139 -8.125 369 2HG1 VAL 48 2HG1 VAL 48 -4.510 -4.550 -8.134 370 3HG1 VAL 48 3HG1 VAL 48 -4.937 -5.316 -6.603 371 1HG2 VAL 48 1HG2 VAL 48 -3.634 -7.223 -5.749 372 2HG2 VAL 48 2HG2 VAL 48 -2.280 -7.866 -6.679 373 3HG2 VAL 48 3HG2 VAL 48 -3.934 -8.139 -7.225 374 H ALA 49 H ALA 49 -1.681 -8.472 -9.998 375 HA ALA 49 HA ALA 49 0.630 -8.771 -8.447 376 1HB ALA 49 1HB ALA 49 -0.027 -9.994 -11.127 377 2HB ALA 49 2HB ALA 49 -0.469 -10.656 -9.553 378 3HB ALA 49 3HB ALA 49 1.229 -10.540 -10.016 379 H GLY 50 H GLY 50 1.814 -6.968 -8.483 380 1HA GLY 50 1HA GLY 50 3.913 -6.163 -9.239 381 2HA GLY 50 2HA GLY 50 3.490 -6.644 -10.872 382 H ARG 51 H ARG 51 0.971 -5.055 -9.250 383 HA ARG 51 HA ARG 51 1.609 -2.566 -10.681 384 1HB ARG 51 1HB ARG 51 -0.992 -3.761 -9.756 385 2HB ARG 51 2HB ARG 51 -0.868 -2.067 -10.202 386 1HG ARG 51 1HG ARG 51 -0.043 -2.759 -12.432 387 2HG ARG 51 2HG ARG 51 -0.315 -4.440 -11.968 388 1HD ARG 51 1HD ARG 51 -2.658 -4.088 -11.770 389 2HD ARG 51 2HD ARG 51 -2.472 -2.341 -11.916 390 HE ARG 51 HE ARG 51 -1.507 -3.809 -14.199 391 1HH1 ARG 51 1HH1 ARG 51 -4.344 -2.382 -12.719 392 2HH1 ARG 51 2HH1 ARG 51 -5.153 -2.111 -14.228 393 1HH2 ARG 51 1HH2 ARG 51 -2.575 -3.453 -16.186 394 2HH2 ARG 51 2HH2 ARG 51 -4.155 -2.721 -16.192 395 H ILE 52 H ILE 52 0.827 -0.540 -9.593 396 HA ILE 52 HA ILE 52 1.775 -0.594 -6.814 397 HB ILE 52 HB ILE 52 1.333 1.768 -8.655 398 1HG1 ILE 52 1HG1 ILE 52 3.185 0.385 -9.424 399 2HG1 ILE 52 2HG1 ILE 52 3.794 1.888 -8.743 400 1HG2 ILE 52 1HG2 ILE 52 2.603 3.038 -6.961 401 2HG2 ILE 52 2HG2 ILE 52 2.571 1.620 -5.910 402 3HG2 ILE 52 3HG2 ILE 52 1.066 2.425 -6.352 403 1HD1 ILE 52 1HD1 ILE 52 4.387 0.727 -6.691 404 2HD1 ILE 52 2HD1 ILE 52 5.159 -0.014 -8.093 405 3HD1 ILE 52 3HD1 ILE 52 3.754 -0.782 -7.353 406 H LEU 53 H LEU 53 0.271 -0.730 -5.298 407 HA LEU 53 HA LEU 53 -2.464 0.078 -5.996 408 1HB LEU 53 1HB LEU 53 -1.921 -2.301 -5.329 409 2HB LEU 53 2HB LEU 53 -1.575 -1.691 -3.725 410 HG LEU 53 HG LEU 53 -3.877 -0.994 -3.437 411 1HD1 LEU 53 1HD1 LEU 53 -4.405 -0.341 -5.711 412 2HD1 LEU 53 2HD1 LEU 53 -5.574 -1.528 -5.133 413 3HD1 LEU 53 3HD1 LEU 53 -4.294 -2.017 -6.244 414 1HD2 LEU 53 1HD2 LEU 53 -3.659 -3.804 -4.506 415 2HD2 LEU 53 2HD2 LEU 53 -4.945 -3.194 -3.466 416 3HD2 LEU 53 3HD2 LEU 53 -3.291 -3.286 -2.862 417 H VAL 54 H VAL 54 -3.383 1.767 -5.028 418 HA VAL 54 HA VAL 54 -2.006 2.945 -2.702 419 HB VAL 54 HB VAL 54 -3.667 4.372 -4.788 420 1HG1 VAL 54 1HG1 VAL 54 -2.007 5.447 -2.510 421 2HG1 VAL 54 2HG1 VAL 54 -3.767 5.442 -2.601 422 3HG1 VAL 54 3HG1 VAL 54 -2.829 6.420 -3.730 423 1HG2 VAL 54 1HG2 VAL 54 -1.576 3.602 -5.744 424 2HG2 VAL 54 2HG2 VAL 54 -0.679 4.293 -4.390 425 3HG2 VAL 54 3HG2 VAL 54 -1.529 5.351 -5.515 426 H PHE 55 H PHE 55 -3.111 3.118 -0.876 427 HA PHE 55 HA PHE 55 -6.050 3.163 -0.952 428 1HB PHE 55 1HB PHE 55 -4.291 1.428 0.766 429 2HB PHE 55 2HB PHE 55 -5.907 1.877 1.288 430 HD1 PHE 55 HD1 PHE 55 -7.736 1.492 -0.670 431 HD2 PHE 55 HD2 PHE 55 -4.072 -0.618 -0.200 432 HE1 PHE 55 HE1 PHE 55 -8.677 -0.411 -1.914 433 HE2 PHE 55 HE2 PHE 55 -5.006 -2.519 -1.448 434 HZ PHE 55 HZ PHE 55 -7.310 -2.419 -2.304 435 HA PRO 56 HA PRO 56 -5.460 6.572 1.861 436 1HB PRO 56 1HB PRO 56 -7.991 6.798 2.790 437 2HB PRO 56 2HB PRO 56 -7.534 7.294 1.158 438 1HG PRO 56 1HG PRO 56 -8.912 4.810 2.071 439 2HG PRO 56 2HG PRO 56 -9.208 5.792 0.625 440 1HD PRO 56 1HD PRO 56 -7.781 3.441 0.631 441 2HD PRO 56 2HD PRO 56 -7.576 4.729 -0.573 442 H GLY 57 H GLY 57 -7.503 3.920 3.078 443 1HA GLY 57 1HA GLY 57 -6.121 2.916 5.132 444 2HA GLY 57 2HA GLY 57 -6.699 4.432 5.816 445 H GLY 58 H GLY 58 -7.627 1.288 4.594 446 1HA GLY 58 1HA GLY 58 -10.446 1.822 5.126 447 2HA GLY 58 2HA GLY 58 -9.797 0.410 4.306 448 H LYS 59 H LYS 59 -10.623 -1.230 5.461 449 HA LYS 59 HA LYS 59 -10.566 -1.129 8.382 450 1HB LYS 59 1HB LYS 59 -11.760 -3.204 6.526 451 2HB LYS 59 2HB LYS 59 -12.005 -3.100 8.264 452 1HG LYS 59 1HG LYS 59 -13.352 -1.204 8.083 453 2HG LYS 59 2HG LYS 59 -12.777 -0.839 6.457 454 1HD LYS 59 1HD LYS 59 -14.984 -1.695 6.240 455 2HD LYS 59 2HD LYS 59 -13.883 -2.956 5.690 456 1HE LYS 59 1HE LYS 59 -15.539 -4.013 7.017 457 2HE LYS 59 2HE LYS 59 -14.058 -3.976 7.973 458 1HZ LYS 59 1HZ LYS 59 -14.893 -2.181 9.260 459 2HZ LYS 59 2HZ LYS 59 -16.115 -3.355 9.204 460 3HZ LYS 59 3HZ LYS 59 -16.231 -1.970 8.235 461 H GLY 60 H GLY 60 -8.783 -1.864 9.350 462 1HA GLY 60 1HA GLY 60 -6.784 -3.379 8.024 463 2HA GLY 60 2HA GLY 60 -6.850 -3.049 9.749 464 H SER 61 H SER 61 -9.182 -4.257 10.468 465 HA SER 61 HA SER 61 -10.152 -6.209 11.043 466 1HB SER 61 1HB SER 61 -9.366 -7.056 8.251 467 2HB SER 61 2HB SER 61 -10.661 -7.744 9.235 468 HG SER 61 HG SER 61 -11.071 -5.145 9.174 469 H THR 62 H THR 62 -7.208 -5.911 11.376 470 HA THR 62 HA THR 62 -5.512 -7.064 12.342 471 HB THR 62 HB THR 62 -7.450 -9.340 12.765 472 HG1 THR 62 HG1 THR 62 -8.398 -8.180 14.356 473 1HG2 THR 62 1HG2 THR 62 -5.178 -8.250 14.442 474 2HG2 THR 62 2HG2 THR 62 -5.140 -9.738 13.497 475 3HG2 THR 62 3HG2 THR 62 -6.222 -9.600 14.884 476 H VAL 63 H VAL 63 -5.992 -7.387 9.441 477 HA VAL 63 HA VAL 63 -4.484 -9.899 9.096 478 HB VAL 63 HB VAL 63 -6.417 -8.655 7.124 479 1HG1 VAL 63 1HG1 VAL 63 -4.739 -11.149 6.870 480 2HG1 VAL 63 2HG1 VAL 63 -4.522 -9.652 5.961 481 3HG1 VAL 63 3HG1 VAL 63 -5.977 -10.623 5.730 482 1HG2 VAL 63 1HG2 VAL 63 -7.723 -10.689 7.449 483 2HG2 VAL 63 2HG2 VAL 63 -7.513 -9.819 8.969 484 3HG2 VAL 63 3HG2 VAL 63 -6.550 -11.257 8.637 485 H GLY 64 H GLY 64 -2.755 -9.846 7.577 486 1HA GLY 64 1HA GLY 64 -1.913 -8.072 5.791 487 2HA GLY 64 2HA GLY 64 -1.579 -7.196 7.280 488 H SER 65 H SER 65 -0.717 -9.187 8.938 489 HA SER 65 HA SER 65 1.961 -9.522 8.055 490 1HB SER 65 1HB SER 65 2.191 -10.807 10.221 491 2HB SER 65 2HB SER 65 1.569 -9.165 10.393 492 HG SER 65 HG SER 65 -0.069 -11.483 10.241 493 H TYR 66 H TYR 66 3.035 -11.305 7.371 494 HA TYR 66 HA TYR 66 3.520 -13.410 6.711 495 1HB TYR 66 1HB TYR 66 0.914 -14.168 8.032 496 2HB TYR 66 2HB TYR 66 2.067 -15.317 7.359 497 HD1 TYR 66 HD1 TYR 66 1.112 -13.485 10.250 498 HD2 TYR 66 HD2 TYR 66 4.470 -15.238 8.312 499 HE1 TYR 66 HE1 TYR 66 2.327 -13.507 12.387 500 HE2 TYR 66 HE2 TYR 66 5.693 -15.266 10.444 501 HH TYR 66 HH TYR 66 4.166 -14.706 13.443 502 H VAL 67 H VAL 67 0.061 -12.732 6.159 503 HA VAL 67 HA VAL 67 -0.204 -14.394 3.926 504 HB VAL 67 HB VAL 67 -2.204 -13.049 3.337 505 1HG1 VAL 67 1HG1 VAL 67 -3.442 -13.535 5.407 506 2HG1 VAL 67 2HG1 VAL 67 -1.911 -13.781 6.246 507 3HG1 VAL 67 3HG1 VAL 67 -2.381 -14.862 4.934 508 1HG2 VAL 67 1HG2 VAL 67 -2.904 -11.235 4.841 509 2HG2 VAL 67 2HG2 VAL 67 -1.421 -10.838 3.972 510 3HG2 VAL 67 3HG2 VAL 67 -1.346 -11.331 5.663 511 H LEU 68 H LEU 68 0.793 -10.999 4.111 512 HA LEU 68 HA LEU 68 0.799 -10.516 1.332 513 1HB LEU 68 1HB LEU 68 2.385 -9.234 3.553 514 2HB LEU 68 2HB LEU 68 2.370 -8.647 1.901 515 HG LEU 68 HG LEU 68 -0.003 -8.782 3.762 516 1HD1 LEU 68 1HD1 LEU 68 1.547 -7.008 4.347 517 2HD1 LEU 68 2HD1 LEU 68 0.080 -6.333 3.637 518 3HD1 LEU 68 3HD1 LEU 68 1.556 -6.437 2.677 519 1HD2 LEU 68 1HD2 LEU 68 0.194 -7.745 0.934 520 2HD2 LEU 68 2HD2 LEU 68 -1.215 -7.617 1.986 521 3HD2 LEU 68 3HD2 LEU 68 -0.659 -9.201 1.449 522 H LEU 69 H LEU 69 3.159 -11.922 3.500 523 HA LEU 69 HA LEU 69 5.379 -11.814 1.758 524 1HB LEU 69 1HB LEU 69 5.660 -12.191 4.138 525 2HB LEU 69 2HB LEU 69 4.747 -13.683 4.043 526 HG LEU 69 HG LEU 69 6.537 -14.666 2.643 527 1HD1 LEU 69 1HD1 LEU 69 7.945 -12.062 3.204 528 2HD1 LEU 69 2HD1 LEU 69 7.449 -12.681 1.629 529 3HD1 LEU 69 3HD1 LEU 69 8.716 -13.502 2.542 530 1HD2 LEU 69 1HD2 LEU 69 8.193 -14.885 4.445 531 2HD2 LEU 69 2HD2 LEU 69 6.539 -15.054 5.033 532 3HD2 LEU 69 3HD2 LEU 69 7.422 -13.550 5.299 533 H ASN 70 H ASN 70 2.922 -14.284 2.368 534 HA ASN 70 HA ASN 70 4.003 -16.262 0.668 535 1HB ASN 70 1HB ASN 70 2.224 -16.564 2.463 536 2HB ASN 70 2HB ASN 70 1.069 -15.922 1.299 537 1HD2 ASN 70 1HD2 ASN 70 0.535 -17.160 -0.522 538 2HD2 ASN 70 2HD2 ASN 70 0.909 -18.845 -0.622 539 H LEU 71 H LEU 71 1.639 -13.692 0.140 540 HA LEU 71 HA LEU 71 0.992 -14.375 -2.530 541 1HB LEU 71 1HB LEU 71 0.876 -11.704 -1.124 542 2HB LEU 71 2HB LEU 71 0.144 -12.045 -2.679 543 HG LEU 71 HG LEU 71 -0.616 -13.386 -0.082 544 1HD1 LEU 71 1HD1 LEU 71 -1.226 -11.026 -0.094 545 2HD1 LEU 71 2HD1 LEU 71 -2.653 -12.053 -0.223 546 3HD1 LEU 71 3HD1 LEU 71 -2.026 -11.235 -1.653 547 1HD2 LEU 71 1HD2 LEU 71 -2.536 -14.212 -1.367 548 2HD2 LEU 71 2HD2 LEU 71 -1.006 -14.814 -2.008 549 3HD2 LEU 71 3HD2 LEU 71 -1.856 -13.504 -2.833 550 H ARG 72 H ARG 72 3.470 -12.335 -1.096 551 HA ARG 72 HA ARG 72 4.332 -11.140 -3.537 552 1HB ARG 72 1HB ARG 72 4.672 -10.458 -0.997 553 2HB ARG 72 2HB ARG 72 6.145 -11.393 -1.177 554 1HG ARG 72 1HG ARG 72 5.449 -9.190 -3.080 555 2HG ARG 72 2HG ARG 72 6.246 -8.868 -1.543 556 1HD ARG 72 1HD ARG 72 7.942 -10.665 -2.343 557 2HD ARG 72 2HD ARG 72 7.267 -10.337 -3.943 558 HE ARG 72 HE ARG 72 7.982 -7.954 -2.522 559 1HH1 ARG 72 1HH1 ARG 72 9.212 -10.475 -4.622 560 2HH1 ARG 72 2HH1 ARG 72 10.608 -9.556 -5.101 561 1HH2 ARG 72 1HH2 ARG 72 9.769 -6.740 -3.179 562 2HH2 ARG 72 2HH2 ARG 72 10.911 -7.411 -4.306 563 H LYS 73 H LYS 73 5.399 -13.898 -1.615 564 HA LYS 73 HA LYS 73 7.723 -14.494 -3.058 565 1HB LYS 73 1HB LYS 73 7.072 -15.343 -0.792 566 2HB LYS 73 2HB LYS 73 5.906 -16.398 -1.579 567 1HG LYS 73 1HG LYS 73 7.630 -17.603 -2.668 568 2HG LYS 73 2HG LYS 73 8.856 -16.457 -2.130 569 1HD LYS 73 1HD LYS 73 8.442 -17.089 0.187 570 2HD LYS 73 2HD LYS 73 7.190 -18.218 -0.332 571 1HE LYS 73 1HE LYS 73 10.091 -18.371 -1.134 572 2HE LYS 73 2HE LYS 73 9.356 -19.310 0.164 573 1HZ LYS 73 1HZ LYS 73 7.861 -20.300 -1.470 574 2HZ LYS 73 2HZ LYS 73 9.486 -20.602 -1.854 575 3HZ LYS 73 3HZ LYS 73 8.619 -19.425 -2.711 576 H ASN 74 H ASN 74 4.350 -15.210 -3.573 577 HA ASN 74 HA ASN 74 4.894 -17.063 -5.736 578 1HB ASN 74 1HB ASN 74 2.924 -17.309 -4.191 579 2HB ASN 74 2HB ASN 74 2.236 -15.862 -4.921 580 1HD2 ASN 74 1HD2 ASN 74 0.431 -17.083 -5.594 581 2HD2 ASN 74 2HD2 ASN 74 0.527 -18.154 -6.948 582 H GLY 75 H GLY 75 4.341 -13.696 -5.283 583 1HA GLY 75 1HA GLY 75 4.873 -12.042 -6.842 584 2HA GLY 75 2HA GLY 75 4.876 -13.266 -8.103 585 H VAL 76 H VAL 76 2.177 -13.073 -5.945 586 HA VAL 76 HA VAL 76 0.561 -12.051 -8.182 587 HB VAL 76 HB VAL 76 -1.370 -13.142 -7.125 588 1HG1 VAL 76 1HG1 VAL 76 -0.102 -14.362 -8.796 589 2HG1 VAL 76 2HG1 VAL 76 -0.683 -15.468 -7.549 590 3HG1 VAL 76 3HG1 VAL 76 1.004 -14.952 -7.556 591 1HG2 VAL 76 1HG2 VAL 76 0.642 -14.198 -5.142 592 2HG2 VAL 76 2HG2 VAL 76 -1.049 -14.683 -5.253 593 3HG2 VAL 76 3HG2 VAL 76 -0.634 -13.031 -4.794 594 H ALA 77 H ALA 77 1.934 -10.990 -5.456 595 HA ALA 77 HA ALA 77 -0.284 -9.424 -4.428 596 1HB ALA 77 1HB ALA 77 2.619 -9.494 -3.595 597 2HB ALA 77 2HB ALA 77 1.307 -10.408 -2.853 598 3HB ALA 77 3HB ALA 77 1.323 -8.647 -2.751 599 HA PRO 78 HA PRO 78 0.644 -5.586 -6.524 600 1HB PRO 78 1HB PRO 78 0.775 -4.273 -3.868 601 2HB PRO 78 2HB PRO 78 -0.238 -3.892 -5.264 602 1HG PRO 78 1HG PRO 78 -1.260 -5.069 -3.095 603 2HG PRO 78 2HG PRO 78 -1.818 -5.492 -4.726 604 1HD PRO 78 1HD PRO 78 0.021 -6.986 -2.902 605 2HD PRO 78 2HD PRO 78 -1.222 -7.605 -4.006 606 H LYS 79 H LYS 79 2.415 -4.282 -6.985 607 HA LYS 79 HA LYS 79 4.907 -5.406 -6.152 608 1HB LYS 79 1HB LYS 79 4.328 -4.551 -8.465 609 2HB LYS 79 2HB LYS 79 4.508 -2.936 -7.804 610 1HG LYS 79 1HG LYS 79 6.813 -3.280 -7.365 611 2HG LYS 79 2HG LYS 79 6.685 -5.001 -7.731 612 1HD LYS 79 1HD LYS 79 6.146 -4.471 -10.052 613 2HD LYS 79 2HD LYS 79 6.243 -2.748 -9.688 614 1HE LYS 79 1HE LYS 79 8.591 -2.957 -9.146 615 2HE LYS 79 2HE LYS 79 8.518 -4.702 -9.383 616 1HZ LYS 79 1HZ LYS 79 9.458 -3.424 -11.281 617 2HZ LYS 79 2HZ LYS 79 7.927 -2.735 -11.526 618 3HZ LYS 79 3HZ LYS 79 8.142 -4.410 -11.693 619 H ALA 80 H ALA 80 3.018 -2.649 -5.308 620 HA ALA 80 HA ALA 80 4.511 -2.214 -2.931 621 1HB ALA 80 1HB ALA 80 5.985 -1.007 -4.480 622 2HB ALA 80 2HB ALA 80 5.203 0.092 -3.344 623 3HB ALA 80 3HB ALA 80 4.622 -0.021 -5.004 624 H ILE 81 H ILE 81 3.386 -0.868 -1.478 625 HA ILE 81 HA ILE 81 0.768 0.085 -2.415 626 HB ILE 81 HB ILE 81 -0.121 -0.483 -0.127 627 1HG1 ILE 81 1HG1 ILE 81 2.376 -2.193 -0.009 628 2HG1 ILE 81 2HG1 ILE 81 2.029 -0.808 1.020 629 1HG2 ILE 81 1HG2 ILE 81 -0.532 -2.842 -0.700 630 2HG2 ILE 81 2HG2 ILE 81 0.735 -2.749 -1.923 631 3HG2 ILE 81 3HG2 ILE 81 -0.723 -1.772 -2.088 632 1HD1 ILE 81 1HD1 ILE 81 0.486 -3.391 0.939 633 2HD1 ILE 81 2HD1 ILE 81 0.104 -1.996 1.949 634 3HD1 ILE 81 3HD1 ILE 81 1.610 -2.878 2.198 635 H ILE 82 H ILE 82 0.439 2.163 -2.053 636 HA ILE 82 HA ILE 82 2.172 3.500 -0.074 637 HB ILE 82 HB ILE 82 0.782 4.999 -2.275 638 1HG1 ILE 82 1HG1 ILE 82 2.003 3.172 -3.398 639 2HG1 ILE 82 2HG1 ILE 82 2.743 4.735 -3.724 640 1HG2 ILE 82 1HG2 ILE 82 3.379 5.454 -0.797 641 2HG2 ILE 82 2HG2 ILE 82 1.841 6.247 -0.459 642 3HG2 ILE 82 3HG2 ILE 82 2.664 6.540 -1.992 643 1HD1 ILE 82 1HD1 ILE 82 4.468 4.257 -2.064 644 2HD1 ILE 82 2HD1 ILE 82 4.413 3.025 -3.325 645 3HD1 ILE 82 3HD1 ILE 82 3.719 2.692 -1.737 646 H ASN 83 H ASN 83 1.176 4.277 1.678 647 HA ASN 83 HA ASN 83 -1.713 4.874 1.514 648 1HB ASN 83 1HB ASN 83 -0.359 3.427 3.809 649 2HB ASN 83 2HB ASN 83 -2.053 3.874 3.727 650 1HD2 ASN 83 1HD2 ASN 83 -2.308 3.120 0.916 651 2HD2 ASN 83 2HD2 ASN 83 -2.318 1.389 0.895 652 H LYS 84 H LYS 84 -2.453 6.282 3.322 653 HA LYS 84 HA LYS 84 -0.259 7.886 4.440 654 1HB LYS 84 1HB LYS 84 -2.105 9.120 3.263 655 2HB LYS 84 2HB LYS 84 -3.218 8.529 4.491 656 1HG LYS 84 1HG LYS 84 -1.975 9.681 6.218 657 2HG LYS 84 2HG LYS 84 -0.792 10.229 5.032 658 1HD LYS 84 1HD LYS 84 -2.612 11.446 3.859 659 2HD LYS 84 2HD LYS 84 -3.710 10.977 5.162 660 1HE LYS 84 1HE LYS 84 -2.238 12.111 6.780 661 2HE LYS 84 2HE LYS 84 -1.198 12.621 5.452 662 1HZ LYS 84 1HZ LYS 84 -4.035 13.394 5.852 663 2HZ LYS 84 2HZ LYS 84 -3.085 13.849 4.524 664 3HZ LYS 84 3HZ LYS 84 -2.681 14.384 6.077 665 H LYS 85 H LYS 85 -3.134 6.030 5.228 666 HA LYS 85 HA LYS 85 -1.990 5.611 7.893 667 1HB LYS 85 1HB LYS 85 -3.926 7.032 8.199 668 2HB LYS 85 2HB LYS 85 -4.915 5.960 7.216 669 1HG LYS 85 1HG LYS 85 -4.759 4.214 8.865 670 2HG LYS 85 2HG LYS 85 -3.630 5.172 9.822 671 1HD LYS 85 1HD LYS 85 -5.345 6.830 10.242 672 2HD LYS 85 2HD LYS 85 -6.477 5.953 9.210 673 1HE LYS 85 1HE LYS 85 -6.787 5.576 11.665 674 2HE LYS 85 2HE LYS 85 -6.549 4.109 10.718 675 1HZ LYS 85 1HZ LYS 85 -4.202 5.385 11.934 676 2HZ LYS 85 2HZ LYS 85 -4.497 3.746 11.628 677 3HZ LYS 85 3HZ LYS 85 -5.248 4.513 12.936 678 H THR 86 H THR 86 -1.141 3.649 7.644 679 HA THR 86 HA THR 86 -2.926 1.524 6.674 680 HB THR 86 HB THR 86 -0.769 1.826 5.405 681 HG1 THR 86 HG1 THR 86 -1.020 -0.229 5.041 682 1HG2 THR 86 1HG2 THR 86 1.310 1.049 6.446 683 2HG2 THR 86 2HG2 THR 86 0.472 0.864 7.985 684 3HG2 THR 86 3HG2 THR 86 0.667 2.467 7.277 685 H GLU 87 H GLU 87 -2.815 -0.510 7.899 686 HA GLU 87 HA GLU 87 -2.765 0.079 10.717 687 1HB GLU 87 1HB GLU 87 -4.500 -1.391 9.601 688 2HB GLU 87 2HB GLU 87 -3.247 -2.614 9.431 689 1HG GLU 87 1HG GLU 87 -4.719 -2.964 11.387 690 2HG GLU 87 2HG GLU 87 -3.015 -2.796 11.810 691 H THR 88 H THR 88 -1.440 -0.893 12.257 692 HA THR 88 HA THR 88 1.269 -1.004 11.594 693 HB THR 88 HB THR 88 0.011 -2.283 14.027 694 HG1 THR 88 HG1 THR 88 0.074 0.334 13.212 695 1HG2 THR 88 1HG2 THR 88 2.406 -2.736 13.732 696 2HG2 THR 88 2HG2 THR 88 2.120 -1.681 15.116 697 3HG2 THR 88 3HG2 THR 88 2.717 -1.004 13.601 698 H ILE 89 H ILE 89 -1.115 -3.551 11.857 699 HA ILE 89 HA ILE 89 0.608 -5.777 11.765 700 HB ILE 89 HB ILE 89 -2.214 -5.584 10.696 701 1HG1 ILE 89 1HG1 ILE 89 -1.303 -6.365 13.473 702 2HG1 ILE 89 2HG1 ILE 89 -1.943 -4.778 13.054 703 1HG2 ILE 89 1HG2 ILE 89 -1.036 -7.610 10.005 704 2HG2 ILE 89 2HG2 ILE 89 -2.316 -7.981 11.160 705 3HG2 ILE 89 3HG2 ILE 89 -0.633 -7.956 11.687 706 1HD1 ILE 89 1HD1 ILE 89 -4.055 -5.807 12.404 707 2HD1 ILE 89 2HD1 ILE 89 -3.640 -6.169 14.081 708 3HD1 ILE 89 3HD1 ILE 89 -3.411 -7.393 12.831 709 H ILE 90 H ILE 90 -0.945 -3.856 9.241 710 HA ILE 90 HA ILE 90 -0.101 -5.508 7.072 711 HB ILE 90 HB ILE 90 -0.978 -2.614 7.021 712 1HG1 ILE 90 1HG1 ILE 90 -2.605 -5.140 6.630 713 2HG1 ILE 90 2HG1 ILE 90 -2.660 -4.097 8.049 714 1HG2 ILE 90 1HG2 ILE 90 -1.550 -3.066 4.672 715 2HG2 ILE 90 2HG2 ILE 90 -0.850 -4.679 4.827 716 3HG2 ILE 90 3HG2 ILE 90 0.175 -3.252 4.985 717 1HD1 ILE 90 1HD1 ILE 90 -3.499 -2.268 6.658 718 2HD1 ILE 90 2HD1 ILE 90 -4.551 -3.681 6.600 719 3HD1 ILE 90 3HD1 ILE 90 -3.468 -3.331 5.252 720 H ALA 91 H ALA 91 1.090 -2.519 8.545 721 HA ALA 91 HA ALA 91 3.106 -1.871 6.739 722 1HB ALA 91 1HB ALA 91 2.369 -0.382 8.528 723 2HB ALA 91 2HB ALA 91 4.118 -0.605 8.569 724 3HB ALA 91 3HB ALA 91 3.094 -1.453 9.728 725 H VAL 92 H VAL 92 3.294 -3.933 9.641 726 HA VAL 92 HA VAL 92 6.038 -4.573 9.309 727 HB VAL 92 HB VAL 92 3.886 -6.075 10.815 728 1HG1 VAL 92 1HG1 VAL 92 6.890 -6.302 11.008 729 2HG1 VAL 92 2HG1 VAL 92 5.813 -7.504 10.300 730 3HG1 VAL 92 3HG1 VAL 92 5.719 -7.144 12.025 731 1HG2 VAL 92 1HG2 VAL 92 4.202 -3.795 11.618 732 2HG2 VAL 92 2HG2 VAL 92 5.937 -4.076 11.758 733 3HG2 VAL 92 3HG2 VAL 92 4.816 -4.963 12.790 734 H GLY 93 H GLY 93 3.037 -6.182 8.342 735 1HA GLY 93 1HA GLY 93 4.166 -8.537 7.319 736 2HA GLY 93 2HA GLY 93 2.626 -7.848 6.823 737 H ALA 94 H ALA 94 3.528 -5.420 5.770 738 HA ALA 94 HA ALA 94 4.321 -6.181 3.171 739 1HB ALA 94 1HB ALA 94 2.991 -4.173 3.640 740 2HB ALA 94 2HB ALA 94 4.439 -3.796 2.707 741 3HB ALA 94 3HB ALA 94 4.388 -3.442 4.433 742 H ALA 95 H ALA 95 6.086 -4.811 5.908 743 HA ALA 95 HA ALA 95 8.533 -4.381 4.582 744 1HB ALA 95 1HB ALA 95 8.020 -3.388 6.751 745 2HB ALA 95 2HB ALA 95 9.521 -4.312 6.816 746 3HB ALA 95 3HB ALA 95 8.039 -4.987 7.492 747 H MET 96 H MET 96 7.183 -7.198 6.207 748 HA MET 96 HA MET 96 9.518 -8.809 6.098 749 1HB MET 96 1HB MET 96 6.599 -9.595 6.257 750 2HB MET 96 2HB MET 96 7.943 -10.705 6.470 751 1HG MET 96 1HG MET 96 8.666 -9.510 8.438 752 2HG MET 96 2HG MET 96 7.398 -8.306 8.199 753 1HE MET 96 1HE MET 96 7.158 -12.211 7.695 754 2HE MET 96 2HE MET 96 6.572 -12.721 9.278 755 3HE MET 96 3HE MET 96 8.192 -12.046 9.113 756 H ALA 97 H ALA 97 6.839 -8.249 3.912 757 HA ALA 97 HA ALA 97 7.608 -10.400 2.135 758 1HB ALA 97 1HB ALA 97 5.456 -8.312 1.837 759 2HB ALA 97 2HB ALA 97 5.248 -9.906 2.566 760 3HB ALA 97 3HB ALA 97 5.649 -9.763 0.854 761 H GLU 98 H GLU 98 8.818 -7.396 2.586 762 HA GLU 98 HA GLU 98 10.007 -5.906 1.360 763 1HB GLU 98 1HB GLU 98 10.087 -8.159 -0.654 764 2HB GLU 98 2HB GLU 98 11.045 -6.689 -0.757 765 1HG GLU 98 1HG GLU 98 12.068 -7.270 1.428 766 2HG GLU 98 2HG GLU 98 11.201 -8.805 1.373 767 H ILE 99 H ILE 99 7.368 -5.546 1.378 768 HA ILE 99 HA ILE 99 6.674 -4.630 -1.329 769 HB ILE 99 HB ILE 99 4.899 -5.016 1.095 770 1HG1 ILE 99 1HG1 ILE 99 5.557 -7.099 -0.052 771 2HG1 ILE 99 2HG1 ILE 99 3.837 -6.764 -0.239 772 1HG2 ILE 99 1HG2 ILE 99 4.181 -4.035 -1.666 773 2HG2 ILE 99 2HG2 ILE 99 4.174 -3.073 -0.188 774 3HG2 ILE 99 3HG2 ILE 99 3.036 -4.407 -0.378 775 1HD1 ILE 99 1HD1 ILE 99 4.797 -7.567 -2.310 776 2HD1 ILE 99 2HD1 ILE 99 5.977 -6.256 -2.294 777 3HD1 ILE 99 3HD1 ILE 99 4.260 -5.896 -2.485 778 HA PRO 100 HA PRO 100 8.487 -0.892 0.597 779 1HB PRO 100 1HB PRO 100 8.065 0.531 -1.789 780 2HB PRO 100 2HB PRO 100 9.560 -0.257 -1.285 781 1HG PRO 100 1HG PRO 100 7.429 -1.228 -3.122 782 2HG PRO 100 2HG PRO 100 9.182 -1.490 -3.194 783 1HD PRO 100 1HD PRO 100 7.530 -3.427 -2.383 784 2HD PRO 100 2HD PRO 100 9.111 -3.191 -1.609 785 H LEU 101 H LEU 101 6.819 -0.447 2.019 786 HA LEU 101 HA LEU 101 4.510 1.040 0.990 787 1HB LEU 101 1HB LEU 101 4.318 -0.943 2.620 788 2HB LEU 101 2HB LEU 101 4.996 0.125 3.827 789 HG LEU 101 HG LEU 101 2.428 0.726 2.352 790 1HD1 LEU 101 1HD1 LEU 101 2.190 -1.360 3.597 791 2HD1 LEU 101 2HD1 LEU 101 1.260 -0.062 4.345 792 3HD1 LEU 101 3HD1 LEU 101 2.794 -0.569 5.052 793 1HD2 LEU 101 1HD2 LEU 101 3.493 2.677 3.346 794 2HD2 LEU 101 2HD2 LEU 101 3.607 1.841 4.895 795 3HD2 LEU 101 3HD2 LEU 101 2.025 2.251 4.232 796 H VAL 102 H VAL 102 4.516 3.180 1.127 797 HA VAL 102 HA VAL 102 6.153 4.446 3.212 798 HB VAL 102 HB VAL 102 6.493 6.383 1.625 799 1HG1 VAL 102 1HG1 VAL 102 8.287 4.844 2.176 800 2HG1 VAL 102 2HG1 VAL 102 8.390 5.329 0.483 801 3HG1 VAL 102 3HG1 VAL 102 7.754 3.739 0.909 802 1HG2 VAL 102 1HG2 VAL 102 4.796 5.841 -0.015 803 2HG2 VAL 102 2HG2 VAL 102 5.626 4.337 -0.411 804 3HG2 VAL 102 3HG2 VAL 102 6.385 5.887 -0.779 805 H GLU 103 H GLU 103 5.354 6.402 4.041 806 HA GLU 103 HA GLU 103 2.439 6.562 3.863 807 1HB GLU 103 1HB GLU 103 3.383 6.191 6.075 808 2HB GLU 103 2HB GLU 103 4.387 7.623 5.919 809 1HG GLU 103 1HG GLU 103 1.522 8.110 5.585 810 2HG GLU 103 2HG GLU 103 1.986 7.513 7.177 811 H VAL 104 H VAL 104 1.597 8.061 2.592 812 HA VAL 104 HA VAL 104 3.188 10.139 1.462 813 HB VAL 104 HB VAL 104 1.022 10.911 0.433 814 1HG1 VAL 104 1HG1 VAL 104 2.507 9.413 -0.742 815 2HG1 VAL 104 2HG1 VAL 104 0.831 8.950 -1.043 816 3HG1 VAL 104 3HG1 VAL 104 1.812 8.025 0.095 817 1HG2 VAL 104 1HG2 VAL 104 -0.055 8.443 1.794 818 2HG2 VAL 104 2HG2 VAL 104 -0.910 9.425 0.601 819 3HG2 VAL 104 3HG2 VAL 104 -0.494 10.111 2.173 820 H ARG 105 H ARG 105 3.369 12.223 1.953 821 HA ARG 105 HA ARG 105 2.266 13.124 4.469 822 1HB ARG 105 1HB ARG 105 4.667 13.503 3.482 823 2HB ARG 105 2HB ARG 105 3.907 14.838 2.626 824 1HG ARG 105 1HG ARG 105 3.767 14.523 5.611 825 2HG ARG 105 2HG ARG 105 5.062 15.397 4.796 826 1HD ARG 105 1HD ARG 105 3.535 17.005 3.932 827 2HD ARG 105 2HD ARG 105 2.144 16.047 4.439 828 HE ARG 105 HE ARG 105 3.821 16.772 6.634 829 1HH1 ARG 105 1HH1 ARG 105 1.354 18.010 4.482 830 2HH1 ARG 105 2HH1 ARG 105 0.667 19.077 5.674 831 1HH2 ARG 105 1HH2 ARG 105 2.962 18.186 8.192 832 2HH2 ARG 105 2HH2 ARG 105 1.604 19.201 7.791 833 H ASP 106 H ASP 106 1.774 13.668 1.053 834 HA ASP 106 HA ASP 106 -0.048 15.899 1.668 835 1HB ASP 106 1HB ASP 106 2.073 16.243 0.212 836 2HB ASP 106 2HB ASP 106 1.160 15.411 -1.041 837 H GLU 107 H GLU 107 -2.094 15.892 0.877 838 HA GLU 107 HA GLU 107 -3.279 13.413 0.095 839 1HB GLU 107 1HB GLU 107 -4.362 15.260 1.447 840 2HB GLU 107 2HB GLU 107 -4.507 16.170 -0.047 841 1HG GLU 107 1HG GLU 107 -5.906 14.413 -0.993 842 2HG GLU 107 2HG GLU 107 -5.754 13.483 0.497 843 H LYS 108 H LYS 108 -1.866 16.063 -1.569 844 HA LYS 108 HA LYS 108 -3.186 16.017 -4.019 845 1HB LYS 108 1HB LYS 108 -0.453 16.788 -3.122 846 2HB LYS 108 2HB LYS 108 -0.771 16.696 -4.845 847 1HG LYS 108 1HG LYS 108 -2.406 18.328 -2.923 848 2HG LYS 108 2HG LYS 108 -1.043 18.962 -3.849 849 1HD LYS 108 1HD LYS 108 -2.178 18.384 -5.930 850 2HD LYS 108 2HD LYS 108 -3.530 17.709 -5.018 851 1HE LYS 108 1HE LYS 108 -4.007 19.892 -4.072 852 2HE LYS 108 2HE LYS 108 -2.619 20.581 -4.914 853 1HZ LYS 108 1HZ LYS 108 -4.823 20.956 -5.997 854 2HZ LYS 108 2HZ LYS 108 -4.895 19.292 -6.323 855 3HZ LYS 108 3HZ LYS 108 -3.661 20.237 -6.994 856 H PHE 109 H PHE 109 -0.959 13.723 -2.678 857 HA PHE 109 HA PHE 109 -0.050 12.496 -5.034 858 1HB PHE 109 1HB PHE 109 0.956 11.981 -2.882 859 2HB PHE 109 2HB PHE 109 -0.558 11.295 -2.302 860 HD1 PHE 109 HD1 PHE 109 -1.092 9.045 -2.692 861 HD2 PHE 109 HD2 PHE 109 2.154 10.837 -4.787 862 HE1 PHE 109 HE1 PHE 109 -0.413 6.832 -3.525 863 HE2 PHE 109 HE2 PHE 109 2.838 8.625 -5.625 864 HZ PHE 109 HZ PHE 109 1.554 6.620 -4.993 865 H PHE 110 H PHE 110 -2.912 11.877 -3.042 866 HA PHE 110 HA PHE 110 -3.858 9.647 -4.503 867 1HB PHE 110 1HB PHE 110 -5.384 11.629 -2.799 868 2HB PHE 110 2HB PHE 110 -6.002 10.076 -3.347 869 HD1 PHE 110 HD1 PHE 110 -4.963 7.975 -2.498 870 HD2 PHE 110 HD2 PHE 110 -4.003 11.798 -0.897 871 HE1 PHE 110 HE1 PHE 110 -4.050 6.898 -0.482 872 HE2 PHE 110 HE2 PHE 110 -3.087 10.728 1.119 873 HZ PHE 110 HZ PHE 110 -3.109 8.279 1.331 874 H GLU 111 H GLU 111 -4.185 13.082 -4.897 875 HA GLU 111 HA GLU 111 -6.344 12.981 -6.765 876 1HB GLU 111 1HB GLU 111 -5.805 14.833 -5.134 877 2HB GLU 111 2HB GLU 111 -4.438 15.239 -6.158 878 1HG GLU 111 1HG GLU 111 -6.012 15.595 -8.017 879 2HG GLU 111 2HG GLU 111 -7.339 15.332 -6.889 880 H ALA 112 H ALA 112 -2.864 13.015 -6.878 881 HA ALA 112 HA ALA 112 -2.792 13.732 -9.692 882 1HB ALA 112 1HB ALA 112 -1.157 14.703 -8.162 883 2HB ALA 112 2HB ALA 112 -0.380 13.764 -9.437 884 3HB ALA 112 3HB ALA 112 -0.527 13.094 -7.812 885 H VAL 113 H VAL 113 -2.353 10.873 -7.697 886 HA VAL 113 HA VAL 113 -1.011 9.308 -9.622 887 HB VAL 113 HB VAL 113 -1.062 8.718 -7.229 888 1HG1 VAL 113 1HG1 VAL 113 -3.004 7.575 -6.272 889 2HG1 VAL 113 2HG1 VAL 113 -3.924 7.924 -7.736 890 3HG1 VAL 113 3HG1 VAL 113 -3.368 9.246 -6.706 891 1HG2 VAL 113 1HG2 VAL 113 -1.325 6.295 -7.516 892 2HG2 VAL 113 2HG2 VAL 113 -0.444 7.031 -8.857 893 3HG2 VAL 113 3HG2 VAL 113 -2.137 6.577 -9.058 894 H LYS 114 H LYS 114 -1.705 8.018 -11.244 895 HA LYS 114 HA LYS 114 -4.577 8.166 -11.890 896 1HB LYS 114 1HB LYS 114 -2.250 8.033 -13.819 897 2HB LYS 114 2HB LYS 114 -3.948 8.171 -14.248 898 1HG LYS 114 1HG LYS 114 -2.348 10.238 -12.751 899 2HG LYS 114 2HG LYS 114 -2.766 10.296 -14.462 900 1HD LYS 114 1HD LYS 114 -4.723 10.286 -12.165 901 2HD LYS 114 2HD LYS 114 -4.259 11.696 -13.122 902 1HE LYS 114 1HE LYS 114 -5.137 10.573 -15.140 903 2HE LYS 114 2HE LYS 114 -5.667 9.225 -14.134 904 1HZ LYS 114 1HZ LYS 114 -7.062 10.820 -12.889 905 2HZ LYS 114 2HZ LYS 114 -7.500 10.681 -14.523 906 3HZ LYS 114 3HZ LYS 114 -6.621 12.031 -13.993 907 H THR 115 H THR 115 -5.615 6.308 -12.458 908 HA THR 115 HA THR 115 -4.380 3.793 -11.998 909 HB THR 115 HB THR 115 -6.995 4.287 -13.437 910 HG1 THR 115 HG1 THR 115 -7.949 4.518 -11.487 911 1HG2 THR 115 1HG2 THR 115 -6.170 1.988 -13.548 912 2HG2 THR 115 2HG2 THR 115 -7.598 2.092 -12.519 913 3HG2 THR 115 3HG2 THR 115 -5.995 1.957 -11.793 914 H GLY 116 H GLY 116 -2.724 3.323 -13.366 915 1HA GLY 116 1HA GLY 116 -2.663 1.994 -15.535 916 2HA GLY 116 2HA GLY 116 -3.280 3.471 -16.259 917 H ASP 117 H ASP 117 -1.611 5.175 -14.497 918 HA ASP 117 HA ASP 117 0.728 5.076 -16.205 919 1HB ASP 117 1HB ASP 117 -0.464 7.138 -14.415 920 2HB ASP 117 2HB ASP 117 1.256 7.247 -14.790 921 H ARG 118 H ARG 118 2.901 5.570 -15.235 922 HA ARG 118 HA ARG 118 3.316 3.389 -13.360 923 1HB ARG 118 1HB ARG 118 4.595 3.448 -15.474 924 2HB ARG 118 2HB ARG 118 5.346 4.953 -14.961 925 1HG ARG 118 1HG ARG 118 6.268 3.749 -12.992 926 2HG ARG 118 2HG ARG 118 5.630 2.251 -13.669 927 1HD ARG 118 1HD ARG 118 7.942 2.412 -14.265 928 2HD ARG 118 2HD ARG 118 6.983 2.685 -15.720 929 HE ARG 118 HE ARG 118 7.378 5.172 -15.068 930 1HH1 ARG 118 1HH1 ARG 118 9.676 2.538 -14.703 931 2HH1 ARG 118 2HH1 ARG 118 11.068 3.560 -14.887 932 1HH2 ARG 118 1HH2 ARG 118 9.241 6.505 -15.336 933 2HH2 ARG 118 2HH2 ARG 118 10.826 5.804 -15.237 934 H VAL 119 H VAL 119 3.794 3.643 -11.320 935 HA VAL 119 HA VAL 119 4.770 6.264 -10.393 936 HB VAL 119 HB VAL 119 3.415 4.057 -8.821 937 1HG1 VAL 119 1HG1 VAL 119 3.475 5.601 -6.926 938 2HG1 VAL 119 2HG1 VAL 119 4.388 6.759 -7.891 939 3HG1 VAL 119 3HG1 VAL 119 5.105 5.204 -7.471 940 1HG2 VAL 119 1HG2 VAL 119 1.922 5.379 -10.289 941 2HG2 VAL 119 2HG2 VAL 119 2.459 6.845 -9.467 942 3HG2 VAL 119 3HG2 VAL 119 1.574 5.607 -8.576 943 H VAL 120 H VAL 120 6.848 6.368 -9.929 944 HA VAL 120 HA VAL 120 8.318 3.902 -9.346 945 HB VAL 120 HB VAL 120 9.403 6.686 -9.835 946 1HG1 VAL 120 1HG1 VAL 120 11.546 5.531 -10.159 947 2HG1 VAL 120 2HG1 VAL 120 10.779 4.002 -9.730 948 3HG1 VAL 120 3HG1 VAL 120 10.909 5.291 -8.532 949 1HG2 VAL 120 1HG2 VAL 120 10.036 5.839 -12.058 950 2HG2 VAL 120 2HG2 VAL 120 8.288 5.868 -11.825 951 3HG2 VAL 120 3HG2 VAL 120 9.167 4.342 -11.718 952 H VAL 121 H VAL 121 8.072 3.407 -7.246 953 HA VAL 121 HA VAL 121 8.258 5.588 -5.296 954 HB VAL 121 HB VAL 121 6.242 4.355 -4.985 955 1HG1 VAL 121 1HG1 VAL 121 6.864 2.311 -6.179 956 2HG1 VAL 121 2HG1 VAL 121 6.169 1.950 -4.598 957 3HG1 VAL 121 3HG1 VAL 121 7.913 1.849 -4.840 958 1HG2 VAL 121 1HG2 VAL 121 7.347 5.017 -2.932 959 2HG2 VAL 121 2HG2 VAL 121 8.275 3.518 -2.918 960 3HG2 VAL 121 3HG2 VAL 121 6.525 3.474 -2.703 961 H ASN 122 H ASN 122 10.180 5.913 -4.469 962 HA ASN 122 HA ASN 122 11.977 3.620 -4.087 963 1HB ASN 122 1HB ASN 122 12.550 6.033 -5.191 964 2HB ASN 122 2HB ASN 122 12.941 6.364 -3.506 965 1HD2 ASN 122 1HD2 ASN 122 14.613 5.194 -2.519 966 2HD2 ASN 122 2HD2 ASN 122 15.818 4.372 -3.448 967 H ALA 123 H ALA 123 11.234 2.723 -2.225 968 HA ALA 123 HA ALA 123 10.164 4.280 -0.090 969 1HB ALA 123 1HB ALA 123 9.896 2.158 1.066 970 2HB ALA 123 2HB ALA 123 10.901 1.357 -0.142 971 3HB ALA 123 3HB ALA 123 9.340 2.036 -0.603 972 H ASP 124 H ASP 124 13.282 3.017 -0.857 973 HA ASP 124 HA ASP 124 14.390 2.889 1.726 974 1HB ASP 124 1HB ASP 124 15.342 1.907 -0.402 975 2HB ASP 124 2HB ASP 124 15.898 3.526 -0.811 976 H GLU 125 H GLU 125 13.703 5.590 -0.322 977 HA GLU 125 HA GLU 125 15.035 7.336 1.628 978 1HB GLU 125 1HB GLU 125 15.311 8.992 -0.137 979 2HB GLU 125 2HB GLU 125 16.097 7.485 -0.576 980 1HG GLU 125 1HG GLU 125 14.199 6.926 -2.016 981 2HG GLU 125 2HG GLU 125 13.429 8.451 -1.581 982 H GLY 126 H GLY 126 12.128 6.201 0.677 983 1HA GLY 126 1HA GLY 126 9.957 6.847 1.045 984 2HA GLY 126 2HA GLY 126 10.610 8.065 2.130 985 H TYR 127 H TYR 127 10.398 7.464 -1.393 986 HA TYR 127 HA TYR 127 9.265 10.110 -1.753 987 1HB TYR 127 1HB TYR 127 11.897 10.152 -1.746 988 2HB TYR 127 2HB TYR 127 11.711 9.494 -3.368 989 HD1 TYR 127 HD1 TYR 127 10.866 12.370 -1.204 990 HD2 TYR 127 HD2 TYR 127 11.130 10.902 -5.190 991 HE1 TYR 127 HE1 TYR 127 10.527 14.647 -2.058 992 HE2 TYR 127 HE2 TYR 127 10.790 13.181 -6.052 993 HH TYR 127 HH TYR 127 9.839 15.306 -5.319 994 H VAL 128 H VAL 128 8.073 10.279 -3.627 995 HA VAL 128 HA VAL 128 8.078 7.906 -5.367 996 HB VAL 128 HB VAL 128 5.631 8.241 -5.709 997 1HG1 VAL 128 1HG1 VAL 128 6.440 6.532 -4.180 998 2HG1 VAL 128 2HG1 VAL 128 4.946 7.247 -3.575 999 3HG1 VAL 128 3HG1 VAL 128 6.495 7.709 -2.868 1000 1HG2 VAL 128 1HG2 VAL 128 5.467 10.577 -5.048 1001 2HG2 VAL 128 2HG2 VAL 128 5.902 10.151 -3.391 1002 3HG2 VAL 128 3HG2 VAL 128 4.382 9.577 -4.078 1003 H GLU 129 H GLU 129 8.101 8.206 -7.482 1004 HA GLU 129 HA GLU 129 7.832 10.948 -8.538 1005 1HB GLU 129 1HB GLU 129 10.139 10.273 -8.679 1006 2HB GLU 129 2HB GLU 129 9.698 8.706 -9.336 1007 1HG GLU 129 1HG GLU 129 10.537 9.940 -11.135 1008 2HG GLU 129 2HG GLU 129 8.787 9.946 -11.335 1009 H LEU 130 H LEU 130 6.012 11.100 -9.708 1010 HA LEU 130 HA LEU 130 4.871 8.676 -10.860 1011 1HB LEU 130 1HB LEU 130 3.347 10.152 -9.658 1012 2HB LEU 130 2HB LEU 130 3.774 11.487 -10.716 1013 HG LEU 130 HG LEU 130 2.861 10.110 -12.638 1014 1HD1 LEU 130 1HD1 LEU 130 1.272 8.340 -12.068 1015 2HD1 LEU 130 2HD1 LEU 130 1.757 8.457 -10.376 1016 3HD1 LEU 130 3HD1 LEU 130 2.921 7.932 -11.592 1017 1HD2 LEU 130 1HD2 LEU 130 0.542 10.690 -12.146 1018 2HD2 LEU 130 2HD2 LEU 130 1.634 11.980 -11.642 1019 3HD2 LEU 130 3HD2 LEU 130 0.942 10.890 -10.441 1020 H ILE 131 H ILE 131 5.109 8.137 -12.916 1021 HA ILE 131 HA ILE 131 6.210 10.144 -14.762 1022 HB ILE 131 HB ILE 131 5.969 7.202 -15.279 1023 1HG1 ILE 131 1HG1 ILE 131 7.305 7.529 -13.232 1024 2HG1 ILE 131 2HG1 ILE 131 8.295 6.947 -14.566 1025 1HG2 ILE 131 1HG2 ILE 131 6.316 8.579 -17.233 1026 2HG2 ILE 131 2HG2 ILE 131 7.768 7.636 -16.897 1027 3HG2 ILE 131 3HG2 ILE 131 7.708 9.345 -16.470 1028 1HD1 ILE 131 1HD1 ILE 131 9.133 9.198 -14.941 1029 2HD1 ILE 131 2HD1 ILE 131 9.430 8.679 -13.283 1030 3HD1 ILE 131 3HD1 ILE 131 8.118 9.804 -13.632 1031 H GLU 132 H GLU 132 4.774 11.117 -15.902 1032 HA GLU 132 HA GLU 132 2.139 9.953 -16.345 1033 1HB GLU 132 1HB GLU 132 3.158 12.750 -16.894 1034 2HB GLU 132 2HB GLU 132 1.484 12.224 -16.983 1035 1HG GLU 132 1HG GLU 132 1.241 12.143 -14.704 1036 2HG GLU 132 2HG GLU 132 2.959 11.866 -14.424 Start of MODEL 15 1 H VAL 1 H VAL 1 5.373 14.688 -12.251 2 HA VAL 1 HA VAL 1 5.497 16.628 -10.057 3 HB VAL 1 HB VAL 1 3.422 14.478 -10.511 4 1HG1 VAL 1 1HG1 VAL 1 3.383 16.957 -8.795 5 2HG1 VAL 1 2HG1 VAL 1 3.553 15.298 -8.220 6 3HG1 VAL 1 3HG1 VAL 1 2.054 15.816 -8.991 7 1HG2 VAL 1 1HG2 VAL 1 1.993 16.241 -11.432 8 2HG2 VAL 1 2HG2 VAL 1 3.439 15.998 -12.412 9 3HG2 VAL 1 3HG2 VAL 1 3.333 17.381 -11.322 10 H LYS 2 H LYS 2 6.161 16.059 -8.045 11 HA LYS 2 HA LYS 2 6.522 13.247 -7.390 12 1HB LYS 2 1HB LYS 2 8.881 13.708 -6.636 13 2HB LYS 2 2HB LYS 2 8.636 13.696 -8.377 14 1HG LYS 2 1HG LYS 2 8.643 16.122 -8.424 15 2HG LYS 2 2HG LYS 2 8.808 16.172 -6.666 16 1HD LYS 2 1HD LYS 2 10.960 16.522 -7.805 17 2HD LYS 2 2HD LYS 2 10.964 15.063 -6.813 18 1HE LYS 2 1HE LYS 2 10.359 13.803 -8.937 19 2HE LYS 2 2HE LYS 2 10.771 15.280 -9.806 20 1HZ LYS 2 1HZ LYS 2 12.647 13.981 -7.925 21 2HZ LYS 2 2HZ LYS 2 12.996 15.132 -9.122 22 3HZ LYS 2 3HZ LYS 2 12.572 13.545 -9.561 23 H PHE 3 H PHE 3 6.684 12.810 -5.197 24 HA PHE 3 HA PHE 3 6.397 15.066 -3.341 25 1HB PHE 3 1HB PHE 3 4.624 12.610 -3.369 26 2HB PHE 3 2HB PHE 3 4.619 13.847 -2.121 27 HD1 PHE 3 HD1 PHE 3 3.919 16.183 -2.739 28 HD2 PHE 3 HD2 PHE 3 3.355 12.848 -5.322 29 HE1 PHE 3 HE1 PHE 3 2.218 17.443 -3.994 30 HE2 PHE 3 HE2 PHE 3 1.658 14.104 -6.584 31 HZ PHE 3 HZ PHE 3 1.088 16.403 -5.921 32 H ALA 4 H ALA 4 7.079 14.599 -1.201 33 HA ALA 4 HA ALA 4 8.602 12.093 -0.925 34 1HB ALA 4 1HB ALA 4 10.067 13.263 0.634 35 2HB ALA 4 2HB ALA 4 9.114 14.734 0.440 36 3HB ALA 4 3HB ALA 4 10.027 14.088 -0.924 37 H CYS 5 H CYS 5 7.617 10.682 0.357 38 HA CYS 5 HA CYS 5 6.024 11.700 2.618 39 1HB CYS 5 1HB CYS 5 5.502 9.276 0.891 40 2HB CYS 5 2HB CYS 5 4.543 9.760 2.289 41 HG CYS 5 HG CYS 5 4.695 12.371 0.389 42 H ARG 6 H ARG 6 5.634 9.589 4.179 43 HA ARG 6 HA ARG 6 8.403 9.034 4.955 44 1HB ARG 6 1HB ARG 6 6.953 10.144 6.595 45 2HB ARG 6 2HB ARG 6 5.859 8.771 6.563 46 1HG ARG 6 1HG ARG 6 7.336 8.783 8.530 47 2HG ARG 6 2HG ARG 6 7.538 7.343 7.531 48 1HD ARG 6 1HD ARG 6 9.321 9.523 6.775 49 2HD ARG 6 2HD ARG 6 9.557 8.980 8.436 50 HE ARG 6 HE ARG 6 9.547 6.651 7.175 51 1HH1 ARG 6 1HH1 ARG 6 11.158 9.627 6.248 52 2HH1 ARG 6 2HH1 ARG 6 12.472 8.812 5.468 53 1HH2 ARG 6 1HH2 ARG 6 11.291 5.592 6.187 54 2HH2 ARG 6 2HH2 ARG 6 12.571 6.517 5.450 55 H ALA 7 H ALA 7 9.261 7.145 4.586 56 HA ALA 7 HA ALA 7 7.619 4.890 3.799 57 1HB ALA 7 1HB ALA 7 9.651 5.461 2.541 58 2HB ALA 7 2HB ALA 7 9.715 3.828 3.204 59 3HB ALA 7 3HB ALA 7 10.618 5.129 3.978 60 H ILE 8 H ILE 8 7.414 2.988 4.883 61 HA ILE 8 HA ILE 8 8.484 2.904 7.626 62 HB ILE 8 HB ILE 8 6.115 1.461 6.415 63 1HG1 ILE 8 1HG1 ILE 8 4.930 2.651 8.356 64 2HG1 ILE 8 2HG1 ILE 8 6.384 3.631 8.501 65 1HG2 ILE 8 1HG2 ILE 8 5.755 0.472 8.627 66 2HG2 ILE 8 2HG2 ILE 8 7.271 1.180 9.184 67 3HG2 ILE 8 3HG2 ILE 8 7.283 -0.047 7.917 68 1HD1 ILE 8 1HD1 ILE 8 4.685 4.789 7.236 69 2HD1 ILE 8 2HD1 ILE 8 4.592 3.454 6.088 70 3HD1 ILE 8 3HD1 ILE 8 6.064 4.417 6.204 71 H THR 9 H THR 9 7.699 0.691 4.935 72 HA THR 9 HA THR 9 10.098 -0.858 5.585 73 HB THR 9 HB THR 9 9.260 -2.402 3.770 74 HG1 THR 9 HG1 THR 9 7.195 -2.071 2.973 75 1HG2 THR 9 1HG2 THR 9 8.833 -2.874 6.133 76 2HG2 THR 9 2HG2 THR 9 7.473 -3.378 5.130 77 3HG2 THR 9 3HG2 THR 9 7.369 -1.889 6.072 78 H ARG 10 H ARG 10 11.512 -1.441 3.632 79 HA ARG 10 HA ARG 10 11.609 0.924 1.896 80 1HB ARG 10 1HB ARG 10 13.893 -0.318 3.393 81 2HB ARG 10 2HB ARG 10 14.139 0.743 2.015 82 1HG ARG 10 1HG ARG 10 12.619 2.388 3.277 83 2HG ARG 10 2HG ARG 10 12.967 1.388 4.689 84 1HD ARG 10 1HD ARG 10 15.179 2.427 2.965 85 2HD ARG 10 2HD ARG 10 14.444 3.457 4.191 86 HE ARG 10 HE ARG 10 15.096 1.069 5.443 87 1HH1 ARG 10 1HH1 ARG 10 16.831 3.551 3.678 88 2HH1 ARG 10 2HH1 ARG 10 18.220 3.499 4.713 89 1HH2 ARG 10 1HH2 ARG 10 16.923 0.984 6.798 90 2HH2 ARG 10 2HH2 ARG 10 18.290 2.009 6.469 91 H GLY 11 H GLY 11 13.710 0.395 0.335 92 1HA GLY 11 1HA GLY 11 14.304 -1.356 -1.305 93 2HA GLY 11 2HA GLY 11 12.613 -1.846 -1.225 94 H ARG 12 H ARG 12 12.797 -1.444 -3.631 95 HA ARG 12 HA ARG 12 11.798 1.247 -4.121 96 1HB ARG 12 1HB ARG 12 14.345 1.132 -4.561 97 2HB ARG 12 2HB ARG 12 13.914 0.160 -5.961 98 1HG ARG 12 1HG ARG 12 12.331 2.133 -6.527 99 2HG ARG 12 2HG ARG 12 13.359 3.042 -5.416 100 1HD ARG 12 1HD ARG 12 14.233 3.363 -7.598 101 2HD ARG 12 2HD ARG 12 15.327 2.261 -6.760 102 HE ARG 12 HE ARG 12 13.857 0.485 -7.980 103 1HH1 ARG 12 1HH1 ARG 12 15.033 3.534 -9.250 104 2HH1 ARG 12 2HH1 ARG 12 14.930 3.018 -10.909 105 1HH2 ARG 12 1HH2 ARG 12 13.760 -0.199 -10.139 106 2HH2 ARG 12 2HH2 ARG 12 14.245 0.877 -11.413 107 H ALA 13 H ALA 13 10.349 1.342 -5.847 108 HA ALA 13 HA ALA 13 10.034 -0.961 -7.570 109 1HB ALA 13 1HB ALA 13 7.835 -0.213 -5.649 110 2HB ALA 13 2HB ALA 13 8.831 -1.666 -5.560 111 3HB ALA 13 3HB ALA 13 7.738 -1.428 -6.923 112 H GLU 14 H GLU 14 8.644 -0.565 -9.342 113 HA GLU 14 HA GLU 14 7.406 2.050 -9.547 114 1HB GLU 14 1HB GLU 14 8.522 2.380 -11.819 115 2HB GLU 14 2HB GLU 14 9.511 2.674 -10.401 116 1HG GLU 14 1HG GLU 14 10.826 1.512 -12.009 117 2HG GLU 14 2HG GLU 14 10.491 0.412 -10.676 118 H GLY 15 H GLY 15 5.935 2.205 -11.385 119 1HA GLY 15 1HA GLY 15 5.603 0.683 -13.529 120 2HA GLY 15 2HA GLY 15 5.000 -0.405 -12.288 121 H GLU 16 H GLU 16 3.024 -0.303 -13.512 122 HA GLU 16 HA GLU 16 1.480 2.037 -13.739 123 1HB GLU 16 1HB GLU 16 0.994 0.051 -15.045 124 2HB GLU 16 2HB GLU 16 0.666 -0.869 -13.586 125 1HG GLU 16 1HG GLU 16 -1.259 0.588 -13.129 126 2HG GLU 16 2HG GLU 16 -0.947 1.439 -14.644 127 H ALA 17 H ALA 17 0.479 3.177 -12.257 128 HA ALA 17 HA ALA 17 0.387 2.290 -9.517 129 1HB ALA 17 1HB ALA 17 -0.655 4.834 -10.760 130 2HB ALA 17 2HB ALA 17 0.955 4.613 -10.077 131 3HB ALA 17 3HB ALA 17 -0.467 4.519 -9.037 132 H LEU 18 H LEU 18 -1.169 1.078 -8.769 133 HA LEU 18 HA LEU 18 -3.802 1.099 -10.051 134 1HB LEU 18 1HB LEU 18 -2.432 -1.026 -9.445 135 2HB LEU 18 2HB LEU 18 -2.927 -0.696 -7.797 136 HG LEU 18 HG LEU 18 -5.322 -0.804 -8.608 137 1HD1 LEU 18 1HD1 LEU 18 -3.988 -1.966 -11.047 138 2HD1 LEU 18 2HD1 LEU 18 -4.854 -0.433 -10.977 139 3HD1 LEU 18 3HD1 LEU 18 -5.722 -1.947 -10.721 140 1HD2 LEU 18 1HD2 LEU 18 -4.303 -2.641 -7.391 141 2HD2 LEU 18 2HD2 LEU 18 -3.588 -3.258 -8.880 142 3HD2 LEU 18 3HD2 LEU 18 -5.340 -3.265 -8.674 143 H VAL 19 H VAL 19 -5.153 2.603 -9.231 144 HA VAL 19 HA VAL 19 -4.812 3.357 -6.410 145 HB VAL 19 HB VAL 19 -6.117 4.938 -8.637 146 1HG1 VAL 19 1HG1 VAL 19 -7.069 5.452 -6.453 147 2HG1 VAL 19 2HG1 VAL 19 -6.090 6.796 -7.042 148 3HG1 VAL 19 3HG1 VAL 19 -5.454 5.720 -5.798 149 1HG2 VAL 19 1HG2 VAL 19 -3.427 5.258 -7.317 150 2HG2 VAL 19 2HG2 VAL 19 -4.144 6.394 -8.459 151 3HG2 VAL 19 3HG2 VAL 19 -3.728 4.761 -8.982 152 H THR 20 H THR 20 -6.196 2.403 -5.130 153 HA THR 20 HA THR 20 -9.006 2.166 -5.992 154 HB THR 20 HB THR 20 -7.616 0.507 -3.874 155 HG1 THR 20 HG1 THR 20 -7.638 0.290 -6.604 156 1HG2 THR 20 1HG2 THR 20 -10.275 0.145 -5.266 157 2HG2 THR 20 2HG2 THR 20 -10.054 0.716 -3.611 158 3HG2 THR 20 3HG2 THR 20 -9.587 -0.928 -4.049 159 H LYS 21 H LYS 21 -9.941 3.981 -5.185 160 HA LYS 21 HA LYS 21 -8.998 5.240 -2.798 161 1HB LYS 21 1HB LYS 21 -11.499 5.770 -4.406 162 2HB LYS 21 2HB LYS 21 -10.868 6.806 -3.133 163 1HG LYS 21 1HG LYS 21 -8.785 7.065 -4.499 164 2HG LYS 21 2HG LYS 21 -9.616 6.216 -5.805 165 1HD LYS 21 1HD LYS 21 -10.482 8.797 -4.505 166 2HD LYS 21 2HD LYS 21 -9.788 8.617 -6.117 167 1HE LYS 21 1HE LYS 21 -11.701 7.397 -6.877 168 2HE LYS 21 2HE LYS 21 -12.356 7.309 -5.241 169 1HZ LYS 21 1HZ LYS 21 -11.975 9.809 -6.801 170 2HZ LYS 21 2HZ LYS 21 -12.640 9.692 -5.245 171 3HZ LYS 21 3HZ LYS 21 -13.456 9.009 -6.565 172 H GLU 22 H GLU 22 -11.093 2.675 -3.349 173 HA GLU 22 HA GLU 22 -12.945 3.129 -1.240 174 1HB GLU 22 1HB GLU 22 -12.185 0.507 -2.529 175 2HB GLU 22 2HB GLU 22 -13.644 0.836 -1.604 176 1HG GLU 22 1HG GLU 22 -12.888 1.947 -4.292 177 2HG GLU 22 2HG GLU 22 -14.215 0.850 -3.914 178 H TYR 23 H TYR 23 -12.780 2.699 0.855 179 HA TYR 23 HA TYR 23 -10.191 2.014 1.890 180 1HB TYR 23 1HB TYR 23 -11.567 2.245 4.133 181 2HB TYR 23 2HB TYR 23 -11.101 3.662 3.202 182 HD1 TYR 23 HD1 TYR 23 -13.921 1.406 4.016 183 HD2 TYR 23 HD2 TYR 23 -12.734 5.064 2.192 184 HE1 TYR 23 HE1 TYR 23 -16.277 2.089 3.859 185 HE2 TYR 23 HE2 TYR 23 -15.086 5.754 2.030 186 HH TYR 23 HH TYR 23 -17.326 4.598 1.925 187 H ILE 24 H ILE 24 -10.355 -0.149 0.821 188 HA ILE 24 HA ILE 24 -11.901 -2.146 2.241 189 HB ILE 24 HB ILE 24 -10.686 -3.784 0.823 190 1HG1 ILE 24 1HG1 ILE 24 -9.426 -1.323 -0.407 191 2HG1 ILE 24 2HG1 ILE 24 -8.581 -2.490 0.603 192 1HG2 ILE 24 1HG2 ILE 24 -12.794 -2.827 0.065 193 2HG2 ILE 24 2HG2 ILE 24 -11.715 -3.110 -1.301 194 3HG2 ILE 24 3HG2 ILE 24 -11.930 -1.476 -0.672 195 1HD1 ILE 24 1HD1 ILE 24 -9.015 -4.225 -1.078 196 2HD1 ILE 24 2HD1 ILE 24 -8.097 -2.868 -1.731 197 3HD1 ILE 24 3HD1 ILE 24 -9.817 -3.022 -2.088 198 H SER 25 H SER 25 -10.992 -3.895 3.354 199 HA SER 25 HA SER 25 -8.622 -3.067 4.851 200 1HB SER 25 1HB SER 25 -11.050 -4.594 5.797 201 2HB SER 25 2HB SER 25 -9.708 -4.052 6.775 202 HG SER 25 HG SER 25 -11.696 -2.515 5.509 203 H PHE 26 H PHE 26 -7.704 -4.998 6.125 204 HA PHE 26 HA PHE 26 -7.148 -7.152 4.278 205 1HB PHE 26 1HB PHE 26 -6.138 -6.508 7.049 206 2HB PHE 26 2HB PHE 26 -5.662 -7.957 6.168 207 HD1 PHE 26 HD1 PHE 26 -4.135 -7.849 4.329 208 HD2 PHE 26 HD2 PHE 26 -5.435 -4.291 6.272 209 HE1 PHE 26 HE1 PHE 26 -2.353 -6.584 3.200 210 HE2 PHE 26 HE2 PHE 26 -3.656 -3.021 5.144 211 HZ PHE 26 HZ PHE 26 -2.112 -4.166 3.605 212 H LEU 27 H LEU 27 -6.796 -9.263 6.146 213 HA LEU 27 HA LEU 27 -7.885 -11.005 7.082 214 1HB LEU 27 1HB LEU 27 -8.793 -9.440 8.697 215 2HB LEU 27 2HB LEU 27 -10.037 -8.938 7.573 216 HG LEU 27 HG LEU 27 -11.043 -11.175 7.704 217 1HD1 LEU 27 1HD1 LEU 27 -10.328 -12.745 9.422 218 2HD1 LEU 27 2HD1 LEU 27 -8.969 -11.694 9.819 219 3HD1 LEU 27 3HD1 LEU 27 -9.052 -12.467 8.235 220 1HD2 LEU 27 1HD2 LEU 27 -11.833 -9.389 9.162 221 2HD2 LEU 27 2HD2 LEU 27 -10.634 -9.840 10.375 222 3HD2 LEU 27 3HD2 LEU 27 -11.939 -10.955 9.967 223 H GLY 28 H GLY 28 -8.310 -9.836 4.247 224 1HA GLY 28 1HA GLY 28 -9.063 -11.756 2.734 225 2HA GLY 28 2HA GLY 28 -10.616 -11.512 3.518 226 H GLY 29 H GLY 29 -8.275 -9.090 2.391 227 1HA GLY 29 1HA GLY 29 -10.368 -7.888 0.744 228 2HA GLY 29 2HA GLY 29 -8.799 -7.177 1.116 229 H ILE 30 H ILE 30 -6.903 -8.208 0.112 230 HA ILE 30 HA ILE 30 -7.418 -9.135 -2.583 231 HB ILE 30 HB ILE 30 -4.794 -8.765 -1.108 232 1HG1 ILE 30 1HG1 ILE 30 -4.589 -6.845 -2.824 233 2HG1 ILE 30 2HG1 ILE 30 -6.330 -6.995 -2.999 234 1HG2 ILE 30 1HG2 ILE 30 -5.334 -9.360 -4.010 235 2HG2 ILE 30 2HG2 ILE 30 -4.533 -10.409 -2.840 236 3HG2 ILE 30 3HG2 ILE 30 -3.765 -8.905 -3.348 237 1HD1 ILE 30 1HD1 ILE 30 -6.600 -6.526 -0.613 238 2HD1 ILE 30 2HD1 ILE 30 -5.759 -5.223 -1.454 239 3HD1 ILE 30 3HD1 ILE 30 -4.851 -6.360 -0.458 240 H ASP 31 H ASP 31 -7.262 -11.251 -3.239 241 HA ASP 31 HA ASP 31 -7.448 -13.203 -1.165 242 1HB ASP 31 1HB ASP 31 -8.757 -13.374 -3.254 243 2HB ASP 31 2HB ASP 31 -7.262 -13.670 -4.144 244 H LYS 32 H LYS 32 -6.156 -14.970 -0.797 245 HA LYS 32 HA LYS 32 -3.356 -14.306 -0.873 246 1HB LYS 32 1HB LYS 32 -3.150 -16.311 0.633 247 2HB LYS 32 2HB LYS 32 -4.204 -15.041 1.236 248 1HG LYS 32 1HG LYS 32 -5.512 -17.179 -0.329 249 2HG LYS 32 2HG LYS 32 -4.858 -17.643 1.240 250 1HD LYS 32 1HD LYS 32 -6.179 -15.976 2.351 251 2HD LYS 32 2HD LYS 32 -6.717 -15.303 0.818 252 1HE LYS 32 1HE LYS 32 -7.324 -18.093 1.785 253 2HE LYS 32 2HE LYS 32 -8.418 -16.720 1.926 254 1HZ LYS 32 1HZ LYS 32 -9.085 -17.904 0.027 255 2HZ LYS 32 2HZ LYS 32 -7.506 -18.079 -0.551 256 3HZ LYS 32 3HZ LYS 32 -8.255 -16.556 -0.583 257 H GLU 33 H GLU 33 -5.403 -16.129 -2.822 258 HA GLU 33 HA GLU 33 -3.263 -18.021 -3.525 259 1HB GLU 33 1HB GLU 33 -6.248 -18.248 -3.930 260 2HB GLU 33 2HB GLU 33 -5.060 -19.455 -4.400 261 1HG GLU 33 1HG GLU 33 -4.512 -19.941 -2.168 262 2HG GLU 33 2HG GLU 33 -5.357 -18.513 -1.571 263 H THR 34 H THR 34 -5.726 -15.868 -4.871 264 HA THR 34 HA THR 34 -4.561 -16.239 -7.533 265 HB THR 34 HB THR 34 -6.565 -14.979 -8.318 266 HG1 THR 34 HG1 THR 34 -8.283 -15.057 -6.506 267 1HG2 THR 34 1HG2 THR 34 -8.152 -16.810 -7.902 268 2HG2 THR 34 2HG2 THR 34 -7.093 -17.426 -6.633 269 3HG2 THR 34 3HG2 THR 34 -6.546 -17.413 -8.310 270 H GLY 35 H GLY 35 -4.701 -13.941 -4.967 271 1HA GLY 35 1HA GLY 35 -3.692 -11.875 -4.762 272 2HA GLY 35 2HA GLY 35 -3.029 -12.087 -6.378 273 H ILE 36 H ILE 36 -6.369 -12.563 -6.097 274 HA ILE 36 HA ILE 36 -6.883 -10.044 -7.509 275 HB ILE 36 HB ILE 36 -8.616 -12.508 -7.185 276 1HG1 ILE 36 1HG1 ILE 36 -6.685 -12.997 -8.570 277 2HG1 ILE 36 2HG1 ILE 36 -8.117 -12.888 -9.589 278 1HG2 ILE 36 1HG2 ILE 36 -9.947 -10.488 -7.481 279 2HG2 ILE 36 2HG2 ILE 36 -10.054 -11.539 -8.893 280 3HG2 ILE 36 3HG2 ILE 36 -9.039 -10.097 -8.942 281 1HD1 ILE 36 1HD1 ILE 36 -6.236 -11.809 -10.647 282 2HD1 ILE 36 2HD1 ILE 36 -6.009 -10.771 -9.241 283 3HD1 ILE 36 3HD1 ILE 36 -7.462 -10.614 -10.228 284 H VAL 37 H VAL 37 -8.385 -8.562 -6.732 285 HA VAL 37 HA VAL 37 -8.877 -8.488 -3.939 286 HB VAL 37 HB VAL 37 -10.245 -6.872 -6.101 287 1HG1 VAL 37 1HG1 VAL 37 -10.548 -5.214 -4.300 288 2HG1 VAL 37 2HG1 VAL 37 -9.867 -6.364 -3.149 289 3HG1 VAL 37 3HG1 VAL 37 -11.386 -6.730 -3.970 290 1HG2 VAL 37 1HG2 VAL 37 -8.530 -5.189 -5.745 291 2HG2 VAL 37 2HG2 VAL 37 -7.791 -6.711 -6.246 292 3HG2 VAL 37 3HG2 VAL 37 -7.738 -6.218 -4.553 293 H LYS 38 H LYS 38 -10.290 -9.713 -2.898 294 HA LYS 38 HA LYS 38 -12.513 -10.975 -4.250 295 1HB LYS 38 1HB LYS 38 -11.432 -11.072 -1.446 296 2HB LYS 38 2HB LYS 38 -12.968 -11.819 -1.854 297 1HG LYS 38 1HG LYS 38 -10.369 -12.478 -3.218 298 2HG LYS 38 2HG LYS 38 -11.023 -13.373 -1.845 299 1HD LYS 38 1HD LYS 38 -13.076 -13.807 -3.169 300 2HD LYS 38 2HD LYS 38 -12.314 -13.014 -4.547 301 1HE LYS 38 1HE LYS 38 -12.122 -15.440 -4.706 302 2HE LYS 38 2HE LYS 38 -10.539 -14.683 -4.541 303 1HZ LYS 38 1HZ LYS 38 -11.961 -15.690 -2.161 304 2HZ LYS 38 2HZ LYS 38 -10.293 -15.462 -2.395 305 3HZ LYS 38 3HZ LYS 38 -11.088 -16.756 -3.147 306 H GLU 39 H GLU 39 -11.961 -8.235 -2.245 307 HA GLU 39 HA GLU 39 -14.574 -7.889 -1.222 308 1HB GLU 39 1HB GLU 39 -12.066 -6.617 -0.977 309 2HB GLU 39 2HB GLU 39 -13.194 -5.388 -1.528 310 1HG GLU 39 1HG GLU 39 -13.659 -7.167 0.853 311 2HG GLU 39 2HG GLU 39 -12.977 -5.543 0.937 312 H ASP 40 H ASP 40 -16.209 -6.482 -1.868 313 HA ASP 40 HA ASP 40 -16.487 -6.307 -4.732 314 1HB ASP 40 1HB ASP 40 -18.391 -6.925 -3.255 315 2HB ASP 40 2HB ASP 40 -18.367 -5.296 -2.585 316 H CYS 41 H CYS 41 -16.455 -4.563 -5.988 317 HA CYS 41 HA CYS 41 -16.372 -1.877 -5.042 318 1HB CYS 41 1HB CYS 41 -14.092 -2.591 -4.414 319 2HB CYS 41 2HB CYS 41 -13.805 -3.138 -6.060 320 HG CYS 41 HG CYS 41 -13.140 -0.254 -4.786 321 H GLU 42 H GLU 42 -15.947 -0.387 -6.971 322 HA GLU 42 HA GLU 42 -17.373 -1.251 -9.250 323 1HB GLU 42 1HB GLU 42 -17.197 1.120 -8.625 324 2HB GLU 42 2HB GLU 42 -15.472 1.087 -8.967 325 1HG GLU 42 1HG GLU 42 -15.906 0.658 -11.304 326 2HG GLU 42 2HG GLU 42 -17.638 0.571 -10.991 327 H ILE 43 H ILE 43 -13.963 -1.067 -8.465 328 HA ILE 43 HA ILE 43 -13.346 -2.470 -10.972 329 HB ILE 43 HB ILE 43 -10.937 -1.890 -10.396 330 1HG1 ILE 43 1HG1 ILE 43 -12.299 0.065 -8.526 331 2HG1 ILE 43 2HG1 ILE 43 -11.338 -1.321 -8.021 332 1HG2 ILE 43 1HG2 ILE 43 -12.844 0.370 -10.982 333 2HG2 ILE 43 2HG2 ILE 43 -12.193 -0.769 -12.158 334 3HG2 ILE 43 3HG2 ILE 43 -11.116 0.359 -11.335 335 1HD1 ILE 43 1HD1 ILE 43 -9.368 -0.339 -9.060 336 2HD1 ILE 43 2HD1 ILE 43 -10.074 0.751 -7.867 337 3HD1 ILE 43 3HD1 ILE 43 -10.327 1.043 -9.589 338 H LYS 44 H LYS 44 -14.543 -4.081 -9.298 339 HA LYS 44 HA LYS 44 -12.720 -5.403 -7.509 340 1HB LYS 44 1HB LYS 44 -15.080 -5.399 -6.987 341 2HB LYS 44 2HB LYS 44 -15.474 -6.126 -8.535 342 1HG LYS 44 1HG LYS 44 -13.727 -7.579 -6.596 343 2HG LYS 44 2HG LYS 44 -15.475 -7.564 -6.376 344 1HD LYS 44 1HD LYS 44 -14.137 -8.421 -8.942 345 2HD LYS 44 2HD LYS 44 -14.531 -9.539 -7.639 346 1HE LYS 44 1HE LYS 44 -16.280 -9.644 -9.267 347 2HE LYS 44 2HE LYS 44 -16.911 -8.839 -7.835 348 1HZ LYS 44 1HZ LYS 44 -15.962 -7.428 -10.277 349 2HZ LYS 44 2HZ LYS 44 -16.706 -6.724 -8.925 350 3HZ LYS 44 3HZ LYS 44 -17.584 -7.768 -9.924 351 H GLY 45 H GLY 45 -11.430 -7.086 -7.941 352 1HA GLY 45 1HA GLY 45 -10.954 -9.131 -9.116 353 2HA GLY 45 2HA GLY 45 -11.772 -8.464 -10.519 354 H GLU 46 H GLU 46 -9.852 -6.127 -9.085 355 HA GLU 46 HA GLU 46 -8.070 -5.986 -11.253 356 1HB GLU 46 1HB GLU 46 -7.888 -4.752 -8.503 357 2HB GLU 46 2HB GLU 46 -6.818 -4.354 -9.841 358 1HG GLU 46 1HG GLU 46 -9.778 -3.875 -9.659 359 2HG GLU 46 2HG GLU 46 -8.490 -2.671 -9.713 360 H SER 47 H SER 47 -5.902 -6.428 -11.422 361 HA SER 47 HA SER 47 -4.980 -8.593 -9.660 362 1HB SER 47 1HB SER 47 -4.081 -7.928 -12.477 363 2HB SER 47 2HB SER 47 -3.647 -9.361 -11.542 364 HG SER 47 HG SER 47 -6.265 -9.253 -11.531 365 H VAL 48 H VAL 48 -3.644 -7.841 -8.143 366 HA VAL 48 HA VAL 48 -2.194 -5.376 -8.557 367 HB VAL 48 HB VAL 48 -1.469 -5.648 -6.213 368 1HG1 VAL 48 1HG1 VAL 48 -3.570 -4.518 -6.711 369 2HG1 VAL 48 2HG1 VAL 48 -3.686 -5.411 -5.195 370 3HG1 VAL 48 3HG1 VAL 48 -4.425 -6.058 -6.659 371 1HG2 VAL 48 1HG2 VAL 48 -1.321 -8.074 -6.113 372 2HG2 VAL 48 2HG2 VAL 48 -3.067 -8.207 -6.324 373 3HG2 VAL 48 3HG2 VAL 48 -2.411 -7.475 -4.861 374 H ALA 49 H ALA 49 -1.524 -8.370 -9.534 375 HA ALA 49 HA ALA 49 1.066 -8.876 -8.531 376 1HB ALA 49 1HB ALA 49 -0.238 -9.967 -11.020 377 2HB ALA 49 2HB ALA 49 -0.389 -10.647 -9.401 378 3HB ALA 49 3HB ALA 49 1.181 -10.626 -10.204 379 H GLY 50 H GLY 50 2.196 -6.965 -8.831 380 1HA GLY 50 1HA GLY 50 4.204 -6.441 -10.081 381 2HA GLY 50 2HA GLY 50 3.308 -6.750 -11.557 382 H ARG 51 H ARG 51 1.436 -5.042 -9.340 383 HA ARG 51 HA ARG 51 1.941 -2.567 -10.845 384 1HB ARG 51 1HB ARG 51 -0.483 -3.658 -9.464 385 2HB ARG 51 2HB ARG 51 -0.325 -1.925 -9.698 386 1HG ARG 51 1HG ARG 51 -1.636 -2.785 -11.476 387 2HG ARG 51 2HG ARG 51 -0.062 -2.348 -12.138 388 1HD ARG 51 1HD ARG 51 0.626 -4.685 -12.063 389 2HD ARG 51 2HD ARG 51 -0.932 -5.129 -11.366 390 HE ARG 51 HE ARG 51 -1.473 -3.789 -13.732 391 1HH1 ARG 51 1HH1 ARG 51 0.185 -6.724 -12.757 392 2HH1 ARG 51 2HH1 ARG 51 -0.187 -7.575 -14.229 393 1HH2 ARG 51 1HH2 ARG 51 -1.933 -4.887 -15.677 394 2HH2 ARG 51 2HH2 ARG 51 -1.380 -6.525 -15.886 395 H ILE 52 H ILE 52 1.470 -0.521 -9.566 396 HA ILE 52 HA ILE 52 2.643 -0.717 -6.877 397 HB ILE 52 HB ILE 52 2.096 1.738 -8.568 398 1HG1 ILE 52 1HG1 ILE 52 3.898 0.367 -9.499 399 2HG1 ILE 52 2HG1 ILE 52 4.538 1.863 -8.826 400 1HG2 ILE 52 1HG2 ILE 52 3.403 2.954 -6.899 401 2HG2 ILE 52 2HG2 ILE 52 3.568 1.480 -5.946 402 3HG2 ILE 52 3HG2 ILE 52 1.978 2.210 -6.173 403 1HD1 ILE 52 1HD1 ILE 52 4.616 -0.841 -7.513 404 2HD1 ILE 52 2HD1 ILE 52 5.254 0.656 -6.832 405 3HD1 ILE 52 3HD1 ILE 52 5.965 -0.022 -8.297 406 H LEU 53 H LEU 53 1.129 -1.095 -5.378 407 HA LEU 53 HA LEU 53 -1.632 -0.421 -5.957 408 1HB LEU 53 1HB LEU 53 -1.013 -2.658 -5.147 409 2HB LEU 53 2HB LEU 53 -0.415 -1.950 -3.659 410 HG LEU 53 HG LEU 53 -2.674 -1.229 -3.071 411 1HD1 LEU 53 1HD1 LEU 53 -4.595 -1.966 -4.391 412 2HD1 LEU 53 2HD1 LEU 53 -3.506 -2.615 -5.617 413 3HD1 LEU 53 3HD1 LEU 53 -3.561 -0.878 -5.318 414 1HD2 LEU 53 1HD2 LEU 53 -2.485 -4.136 -3.836 415 2HD2 LEU 53 2HD2 LEU 53 -3.637 -3.451 -2.691 416 3HD2 LEU 53 3HD2 LEU 53 -1.911 -3.414 -2.333 417 H VAL 54 H VAL 54 -2.403 1.502 -5.401 418 HA VAL 54 HA VAL 54 -1.513 2.676 -2.842 419 HB VAL 54 HB VAL 54 -2.461 4.185 -5.287 420 1HG1 VAL 54 1HG1 VAL 54 -1.320 5.169 -2.675 421 2HG1 VAL 54 2HG1 VAL 54 -2.993 5.328 -3.212 422 3HG1 VAL 54 3HG1 VAL 54 -1.705 6.175 -4.070 423 1HG2 VAL 54 1HG2 VAL 54 0.335 3.912 -4.184 424 2HG2 VAL 54 2HG2 VAL 54 -0.151 4.940 -5.531 425 3HG2 VAL 54 3HG2 VAL 54 -0.266 3.186 -5.675 426 H PHE 55 H PHE 55 -3.088 2.247 -1.444 427 HA PHE 55 HA PHE 55 -5.764 3.231 -2.080 428 1HB PHE 55 1HB PHE 55 -6.814 1.312 -0.949 429 2HB PHE 55 2HB PHE 55 -5.889 0.798 -2.354 430 HD1 PHE 55 HD1 PHE 55 -3.618 -0.228 -1.986 431 HD2 PHE 55 HD2 PHE 55 -6.376 0.449 1.177 432 HE1 PHE 55 HE1 PHE 55 -2.413 -1.856 -0.591 433 HE2 PHE 55 HE2 PHE 55 -5.173 -1.174 2.581 434 HZ PHE 55 HZ PHE 55 -3.188 -2.328 1.697 435 HA PRO 56 HA PRO 56 -5.405 5.120 1.977 436 1HB PRO 56 1HB PRO 56 -8.315 4.681 2.248 437 2HB PRO 56 2HB PRO 56 -7.402 6.192 2.287 438 1HG PRO 56 1HG PRO 56 -8.947 5.553 0.195 439 2HG PRO 56 2HG PRO 56 -7.412 6.417 -0.013 440 1HD PRO 56 1HD PRO 56 -8.034 3.522 -0.463 441 2HD PRO 56 2HD PRO 56 -7.024 4.621 -1.425 442 H GLY 57 H GLY 57 -7.777 2.484 1.714 443 1HA GLY 57 1HA GLY 57 -7.758 0.402 2.719 444 2HA GLY 57 2HA GLY 57 -6.265 0.844 3.532 445 H GLY 58 H GLY 58 -8.951 -0.369 4.364 446 1HA GLY 58 1HA GLY 58 -9.653 1.527 6.499 447 2HA GLY 58 2HA GLY 58 -10.565 0.092 6.050 448 H LYS 59 H LYS 59 -7.345 -0.652 6.073 449 HA LYS 59 HA LYS 59 -5.949 -1.820 7.413 450 1HB LYS 59 1HB LYS 59 -7.491 -0.296 9.456 451 2HB LYS 59 2HB LYS 59 -6.528 -1.655 10.004 452 1HG LYS 59 1HG LYS 59 -5.244 0.337 10.252 453 2HG LYS 59 2HG LYS 59 -4.542 -0.616 8.950 454 1HD LYS 59 1HD LYS 59 -6.539 1.449 8.207 455 2HD LYS 59 2HD LYS 59 -4.959 2.010 8.757 456 1HE LYS 59 1HE LYS 59 -3.985 0.373 7.051 457 2HE LYS 59 2HE LYS 59 -5.617 0.276 6.391 458 1HZ LYS 59 1HZ LYS 59 -4.498 1.927 5.164 459 2HZ LYS 59 2HZ LYS 59 -3.852 2.649 6.549 460 3HZ LYS 59 3HZ LYS 59 -5.511 2.780 6.225 461 H GLY 60 H GLY 60 -8.655 -2.266 9.653 462 1HA GLY 60 1HA GLY 60 -10.245 -4.125 8.951 463 2HA GLY 60 2HA GLY 60 -8.772 -5.069 8.791 464 H SER 61 H SER 61 -8.163 -6.194 10.471 465 HA SER 61 HA SER 61 -8.797 -5.364 13.167 466 1HB SER 61 1HB SER 61 -10.859 -6.529 12.347 467 2HB SER 61 2HB SER 61 -9.895 -7.987 12.119 468 HG SER 61 HG SER 61 -11.092 -7.736 14.190 469 H THR 62 H THR 62 -6.329 -5.514 12.218 470 HA THR 62 HA THR 62 -4.298 -6.184 12.971 471 HB THR 62 HB THR 62 -5.744 -8.269 14.612 472 HG1 THR 62 HG1 THR 62 -6.057 -6.691 16.108 473 1HG2 THR 62 1HG2 THR 62 -3.308 -8.595 14.457 474 2HG2 THR 62 2HG2 THR 62 -3.793 -8.114 16.083 475 3HG2 THR 62 3HG2 THR 62 -3.055 -6.937 14.996 476 H VAL 63 H VAL 63 -6.443 -8.425 11.494 477 HA VAL 63 HA VAL 63 -4.469 -10.476 11.000 478 HB VAL 63 HB VAL 63 -7.105 -10.203 9.595 479 1HG1 VAL 63 1HG1 VAL 63 -5.606 -11.932 8.757 480 2HG1 VAL 63 2HG1 VAL 63 -7.013 -12.654 9.537 481 3HG1 VAL 63 3HG1 VAL 63 -5.463 -12.613 10.379 482 1HG2 VAL 63 1HG2 VAL 63 -8.101 -11.556 11.414 483 2HG2 VAL 63 2HG2 VAL 63 -7.602 -9.950 11.944 484 3HG2 VAL 63 3HG2 VAL 63 -6.612 -11.357 12.338 485 H GLY 64 H GLY 64 -3.722 -7.893 10.099 486 1HA GLY 64 1HA GLY 64 -3.901 -8.001 7.186 487 2HA GLY 64 2HA GLY 64 -3.201 -6.697 8.132 488 H SER 65 H SER 65 -1.836 -9.089 9.639 489 HA SER 65 HA SER 65 0.600 -8.896 8.095 490 1HB SER 65 1HB SER 65 1.515 -10.226 10.075 491 2HB SER 65 2HB SER 65 0.878 -8.620 10.437 492 HG SER 65 HG SER 65 -0.265 -9.681 11.859 493 H TYR 66 H TYR 66 1.937 -10.871 7.787 494 HA TYR 66 HA TYR 66 2.365 -12.965 7.045 495 1HB TYR 66 1HB TYR 66 -0.437 -13.620 7.972 496 2HB TYR 66 2HB TYR 66 0.732 -14.800 7.389 497 HD1 TYR 66 HD1 TYR 66 3.035 -14.799 8.653 498 HD2 TYR 66 HD2 TYR 66 -0.577 -13.219 10.242 499 HE1 TYR 66 HE1 TYR 66 3.945 -15.033 10.926 500 HE2 TYR 66 HE2 TYR 66 0.317 -13.441 12.521 501 HH TYR 66 HH TYR 66 3.585 -14.000 13.174 502 H VAL 67 H VAL 67 -0.838 -11.768 6.118 503 HA VAL 67 HA VAL 67 -1.247 -13.247 3.814 504 HB VAL 67 HB VAL 67 -2.036 -10.362 4.233 505 1HG1 VAL 67 1HG1 VAL 67 -3.884 -10.869 2.716 506 2HG1 VAL 67 2HG1 VAL 67 -3.248 -12.497 2.482 507 3HG1 VAL 67 3HG1 VAL 67 -2.322 -11.101 1.929 508 1HG2 VAL 67 1HG2 VAL 67 -3.481 -12.892 5.007 509 2HG2 VAL 67 2HG2 VAL 67 -4.136 -11.259 5.130 510 3HG2 VAL 67 3HG2 VAL 67 -2.748 -11.730 6.111 511 H LEU 68 H LEU 68 0.465 -10.160 4.164 512 HA LEU 68 HA LEU 68 0.935 -9.703 1.444 513 1HB LEU 68 1HB LEU 68 2.489 -8.808 3.867 514 2HB LEU 68 2HB LEU 68 2.765 -8.197 2.246 515 HG LEU 68 HG LEU 68 0.216 -7.899 3.844 516 1HD1 LEU 68 1HD1 LEU 68 2.305 -5.882 3.033 517 2HD1 LEU 68 2HD1 LEU 68 2.007 -6.479 4.666 518 3HD1 LEU 68 3HD1 LEU 68 0.782 -5.515 3.841 519 1HD2 LEU 68 1HD2 LEU 68 -0.538 -6.473 2.003 520 2HD2 LEU 68 2HD2 LEU 68 -0.247 -8.125 1.460 521 3HD2 LEU 68 3HD2 LEU 68 0.927 -6.859 1.099 522 H LEU 69 H LEU 69 2.760 -11.560 3.814 523 HA LEU 69 HA LEU 69 5.029 -12.033 2.143 524 1HB LEU 69 1HB LEU 69 5.132 -12.261 4.595 525 2HB LEU 69 2HB LEU 69 3.971 -13.574 4.528 526 HG LEU 69 HG LEU 69 5.600 -14.952 3.290 527 1HD1 LEU 69 1HD1 LEU 69 6.839 -13.163 2.193 528 2HD1 LEU 69 2HD1 LEU 69 7.918 -14.218 3.104 529 3HD1 LEU 69 3HD1 LEU 69 7.477 -12.638 3.752 530 1HD2 LEU 69 1HD2 LEU 69 6.639 -13.796 5.876 531 2HD2 LEU 69 2HD2 LEU 69 7.140 -15.328 5.161 532 3HD2 LEU 69 3HD2 LEU 69 5.479 -15.114 5.716 533 H ASN 70 H ASN 70 2.027 -13.755 2.800 534 HA ASN 70 HA ASN 70 2.492 -16.079 1.303 535 1HB ASN 70 1HB ASN 70 0.569 -15.631 2.875 536 2HB ASN 70 2HB ASN 70 -0.158 -14.669 1.596 537 1HD2 ASN 70 1HD2 ASN 70 -0.943 -17.183 2.952 538 2HD2 ASN 70 2HD2 ASN 70 -1.238 -18.303 1.671 539 H LEU 71 H LEU 71 1.006 -12.988 0.384 540 HA LEU 71 HA LEU 71 0.419 -13.567 -2.275 541 1HB LEU 71 1HB LEU 71 1.230 -10.921 -1.072 542 2HB LEU 71 2HB LEU 71 0.435 -11.126 -2.619 543 HG LEU 71 HG LEU 71 -0.740 -11.781 0.081 544 1HD1 LEU 71 1HD1 LEU 71 -1.357 -9.595 -1.902 545 2HD1 LEU 71 2HD1 LEU 71 -0.610 -9.396 -0.316 546 3HD1 LEU 71 3HD1 LEU 71 -2.283 -9.939 -0.439 547 1HD2 LEU 71 1HD2 LEU 71 -2.798 -12.234 -1.140 548 2HD2 LEU 71 2HD2 LEU 71 -1.510 -13.330 -1.638 549 3HD2 LEU 71 3HD2 LEU 71 -1.959 -11.970 -2.668 550 H ARG 72 H ARG 72 3.406 -12.332 -0.831 551 HA ARG 72 HA ARG 72 4.679 -11.863 -3.331 552 1HB ARG 72 1HB ARG 72 5.292 -11.511 -0.540 553 2HB ARG 72 2HB ARG 72 6.678 -12.159 -1.389 554 1HG ARG 72 1HG ARG 72 5.198 -9.841 -2.533 555 2HG ARG 72 2HG ARG 72 6.301 -9.582 -1.184 556 1HD ARG 72 1HD ARG 72 7.453 -9.186 -3.239 557 2HD ARG 72 2HD ARG 72 8.100 -10.639 -2.495 558 HE ARG 72 HE ARG 72 7.255 -11.901 -4.237 559 1HH1 ARG 72 1HH1 ARG 72 6.198 -8.562 -4.519 560 2HH1 ARG 72 2HH1 ARG 72 5.658 -8.745 -6.162 561 1HH2 ARG 72 1HH2 ARG 72 6.594 -12.113 -6.414 562 2HH2 ARG 72 2HH2 ARG 72 5.906 -10.754 -7.257 563 H LYS 73 H LYS 73 4.782 -14.539 -0.999 564 HA LYS 73 HA LYS 73 6.682 -16.101 -2.381 565 1HB LYS 73 1HB LYS 73 4.373 -16.941 -0.620 566 2HB LYS 73 2HB LYS 73 5.606 -18.045 -1.212 567 1HG LYS 73 1HG LYS 73 7.317 -16.735 -0.030 568 2HG LYS 73 2HG LYS 73 6.049 -15.678 0.598 569 1HD LYS 73 1HD LYS 73 5.018 -17.560 1.738 570 2HD LYS 73 2HD LYS 73 6.229 -18.653 1.065 571 1HE LYS 73 1HE LYS 73 6.759 -16.353 2.944 572 2HE LYS 73 2HE LYS 73 6.753 -18.062 3.377 573 1HZ LYS 73 1HZ LYS 73 8.997 -17.302 3.058 574 2HZ LYS 73 2HZ LYS 73 8.636 -16.728 1.504 575 3HZ LYS 73 3HZ LYS 73 8.605 -18.394 1.821 576 H ASN 74 H ASN 74 3.248 -15.639 -2.756 577 HA ASN 74 HA ASN 74 2.820 -17.752 -4.626 578 1HB ASN 74 1HB ASN 74 1.099 -16.561 -3.141 579 2HB ASN 74 2HB ASN 74 1.147 -15.253 -4.314 580 1HD2 ASN 74 1HD2 ASN 74 -1.057 -16.954 -3.518 581 2HD2 ASN 74 2HD2 ASN 74 -1.618 -17.719 -4.968 582 H GLY 75 H GLY 75 3.690 -14.362 -4.832 583 1HA GLY 75 1HA GLY 75 4.962 -13.465 -6.626 584 2HA GLY 75 2HA GLY 75 4.337 -14.736 -7.669 585 H VAL 76 H VAL 76 1.894 -13.463 -5.793 586 HA VAL 76 HA VAL 76 0.895 -11.952 -8.102 587 HB VAL 76 HB VAL 76 -1.344 -12.247 -7.083 588 1HG1 VAL 76 1HG1 VAL 76 0.198 -14.806 -7.508 589 2HG1 VAL 76 2HG1 VAL 76 -0.558 -13.823 -8.762 590 3HG1 VAL 76 3HG1 VAL 76 -1.558 -14.643 -7.562 591 1HG2 VAL 76 1HG2 VAL 76 0.123 -13.966 -5.082 592 2HG2 VAL 76 2HG2 VAL 76 -1.629 -13.827 -5.233 593 3HG2 VAL 76 3HG2 VAL 76 -0.673 -12.428 -4.747 594 H ALA 77 H ALA 77 2.604 -11.180 -5.578 595 HA ALA 77 HA ALA 77 0.949 -9.141 -4.366 596 1HB ALA 77 1HB ALA 77 3.878 -9.728 -3.962 597 2HB ALA 77 2HB ALA 77 2.559 -10.415 -3.015 598 3HB ALA 77 3HB ALA 77 2.871 -8.680 -2.964 599 HA PRO 78 HA PRO 78 2.205 -5.806 -7.019 600 1HB PRO 78 1HB PRO 78 1.947 -3.738 -5.260 601 2HB PRO 78 2HB PRO 78 0.572 -4.513 -6.056 602 1HG PRO 78 1HG PRO 78 1.650 -4.934 -3.299 603 2HG PRO 78 2HG PRO 78 -0.036 -4.827 -3.840 604 1HD PRO 78 1HD PRO 78 1.167 -7.191 -3.313 605 2HD PRO 78 2HD PRO 78 -0.079 -7.013 -4.564 606 H LYS 79 H LYS 79 3.905 -4.216 -7.243 607 HA LYS 79 HA LYS 79 6.366 -5.086 -6.124 608 1HB LYS 79 1HB LYS 79 5.682 -2.612 -7.719 609 2HB LYS 79 2HB LYS 79 7.309 -3.129 -7.326 610 1HG LYS 79 1HG LYS 79 6.875 -5.240 -8.574 611 2HG LYS 79 2HG LYS 79 5.325 -4.556 -9.076 612 1HD LYS 79 1HD LYS 79 6.513 -2.659 -10.100 613 2HD LYS 79 2HD LYS 79 8.050 -3.382 -9.626 614 1HE LYS 79 1HE LYS 79 7.531 -5.345 -11.015 615 2HE LYS 79 2HE LYS 79 6.019 -4.582 -11.508 616 1HZ LYS 79 1HZ LYS 79 7.757 -4.280 -13.164 617 2HZ LYS 79 2HZ LYS 79 8.741 -3.505 -12.029 618 3HZ LYS 79 3HZ LYS 79 7.290 -2.787 -12.518 619 H ALA 80 H ALA 80 4.190 -2.393 -5.518 620 HA ALA 80 HA ALA 80 5.434 -1.984 -2.924 621 1HB ALA 80 1HB ALA 80 6.656 -0.441 -4.383 622 2HB ALA 80 2HB ALA 80 5.658 0.427 -3.217 623 3HB ALA 80 3HB ALA 80 5.129 0.285 -4.894 624 H ILE 81 H ILE 81 4.114 -0.674 -1.504 625 HA ILE 81 HA ILE 81 1.326 -0.336 -2.377 626 HB ILE 81 HB ILE 81 2.213 -1.614 0.219 627 1HG1 ILE 81 1HG1 ILE 81 0.558 -2.701 -2.073 628 2HG1 ILE 81 2HG1 ILE 81 2.226 -3.134 -1.723 629 1HG2 ILE 81 1HG2 ILE 81 -0.559 -0.863 -0.701 630 2HG2 ILE 81 2HG2 ILE 81 0.346 -0.110 0.613 631 3HG2 ILE 81 3HG2 ILE 81 -0.176 -1.789 0.748 632 1HD1 ILE 81 1HD1 ILE 81 1.550 -4.129 0.382 633 2HD1 ILE 81 2HD1 ILE 81 0.652 -4.836 -0.963 634 3HD1 ILE 81 3HD1 ILE 81 -0.120 -3.648 0.086 635 H ILE 82 H ILE 82 0.722 1.712 -2.064 636 HA ILE 82 HA ILE 82 2.126 3.255 0.032 637 HB ILE 82 HB ILE 82 0.782 4.527 -2.350 638 1HG1 ILE 82 1HG1 ILE 82 2.416 2.911 -3.241 639 2HG1 ILE 82 2HG1 ILE 82 2.942 4.567 -3.513 640 1HG2 ILE 82 1HG2 ILE 82 3.084 5.434 -0.615 641 2HG2 ILE 82 2HG2 ILE 82 1.403 5.932 -0.415 642 3HG2 ILE 82 3HG2 ILE 82 2.287 6.371 -1.877 643 1HD1 ILE 82 1HD1 ILE 82 4.476 4.390 -1.627 644 2HD1 ILE 82 2HD1 ILE 82 4.791 3.148 -2.840 645 3HD1 ILE 82 3HD1 ILE 82 3.943 2.732 -1.351 646 H ASN 83 H ASN 83 0.872 3.817 1.699 647 HA ASN 83 HA ASN 83 -2.046 4.032 1.264 648 1HB ASN 83 1HB ASN 83 -0.501 2.906 3.586 649 2HB ASN 83 2HB ASN 83 -2.096 3.589 3.843 650 1HD2 ASN 83 1HD2 ASN 83 -1.168 1.865 0.942 651 2HD2 ASN 83 2HD2 ASN 83 -2.171 0.486 1.223 652 H LYS 84 H LYS 84 -3.102 5.416 3.004 653 HA LYS 84 HA LYS 84 -1.553 7.854 3.386 654 1HB LYS 84 1HB LYS 84 -3.888 8.026 2.570 655 2HB LYS 84 2HB LYS 84 -4.450 7.279 4.059 656 1HG LYS 84 1HG LYS 84 -3.564 9.164 5.339 657 2HG LYS 84 2HG LYS 84 -3.000 9.910 3.845 658 1HD LYS 84 1HD LYS 84 -5.299 10.057 3.042 659 2HD LYS 84 2HD LYS 84 -5.873 9.283 4.521 660 1HE LYS 84 1HE LYS 84 -4.940 11.147 5.830 661 2HE LYS 84 2HE LYS 84 -4.430 11.924 4.333 662 1HZ LYS 84 1HZ LYS 84 -6.715 12.122 3.659 663 2HZ LYS 84 2HZ LYS 84 -6.532 12.804 5.203 664 3HZ LYS 84 3HZ LYS 84 -7.243 11.276 5.033 665 H LYS 85 H LYS 85 -3.253 5.395 5.265 666 HA LYS 85 HA LYS 85 -1.812 6.314 7.656 667 1HB LYS 85 1HB LYS 85 -4.453 4.895 7.386 668 2HB LYS 85 2HB LYS 85 -3.556 4.901 8.894 669 1HG LYS 85 1HG LYS 85 -3.604 7.430 8.748 670 2HG LYS 85 2HG LYS 85 -4.795 7.226 7.460 671 1HD LYS 85 1HD LYS 85 -6.265 6.028 8.950 672 2HD LYS 85 2HD LYS 85 -5.049 6.056 10.229 673 1HE LYS 85 1HE LYS 85 -5.173 8.570 10.129 674 2HE LYS 85 2HE LYS 85 -6.578 8.380 9.079 675 1HZ LYS 85 1HZ LYS 85 -6.322 7.363 11.861 676 2HZ LYS 85 2HZ LYS 85 -7.664 7.117 10.852 677 3HZ LYS 85 3HZ LYS 85 -7.261 8.682 11.359 678 H THR 86 H THR 86 -0.151 5.114 8.176 679 HA THR 86 HA THR 86 0.120 2.409 7.187 680 HB THR 86 HB THR 86 2.085 3.883 7.245 681 HG1 THR 86 HG1 THR 86 3.361 2.340 8.751 682 1HG2 THR 86 1HG2 THR 86 1.716 3.813 10.242 683 2HG2 THR 86 2HG2 THR 86 1.562 5.225 9.195 684 3HG2 THR 86 3HG2 THR 86 3.133 4.454 9.411 685 H GLU 87 H GLU 87 0.625 0.608 8.660 686 HA GLU 87 HA GLU 87 -0.390 0.868 11.377 687 1HB GLU 87 1HB GLU 87 -2.153 0.084 9.489 688 2HB GLU 87 2HB GLU 87 -1.421 -1.470 9.861 689 1HG GLU 87 1HG GLU 87 -2.805 0.375 11.795 690 2HG GLU 87 2HG GLU 87 -3.416 -1.154 11.173 691 H THR 88 H THR 88 0.297 -0.822 12.734 692 HA THR 88 HA THR 88 2.863 -1.789 12.392 693 HB THR 88 HB THR 88 0.822 -3.247 14.054 694 HG1 THR 88 HG1 THR 88 0.362 -1.145 14.578 695 1HG2 THR 88 1HG2 THR 88 3.712 -2.491 14.519 696 2HG2 THR 88 2HG2 THR 88 3.121 -4.087 14.060 697 3HG2 THR 88 3HG2 THR 88 2.698 -3.409 15.632 698 H ILE 89 H ILE 89 -0.243 -3.467 11.890 699 HA ILE 89 HA ILE 89 0.864 -5.994 11.328 700 HB ILE 89 HB ILE 89 -1.323 -6.591 10.406 701 1HG1 ILE 89 1HG1 ILE 89 -1.987 -3.653 10.769 702 2HG1 ILE 89 2HG1 ILE 89 -1.821 -4.482 9.225 703 1HG2 ILE 89 1HG2 ILE 89 -2.604 -6.215 12.432 704 2HG2 ILE 89 2HG2 ILE 89 -1.519 -4.912 12.908 705 3HG2 ILE 89 3HG2 ILE 89 -0.926 -6.572 12.829 706 1HD1 ILE 89 1HD1 ILE 89 -3.902 -5.072 11.317 707 2HD1 ILE 89 2HD1 ILE 89 -3.748 -5.866 9.749 708 3HD1 ILE 89 3HD1 ILE 89 -4.153 -4.152 9.834 709 H ILE 90 H ILE 90 0.138 -3.263 9.251 710 HA ILE 90 HA ILE 90 0.535 -4.633 6.784 711 HB ILE 90 HB ILE 90 0.807 -1.667 7.330 712 1HG1 ILE 90 1HG1 ILE 90 -1.606 -3.251 6.418 713 2HG1 ILE 90 2HG1 ILE 90 -1.396 -2.556 8.020 714 1HG2 ILE 90 1HG2 ILE 90 0.322 -1.427 4.938 715 2HG2 ILE 90 2HG2 ILE 90 0.308 -3.182 4.770 716 3HG2 ILE 90 3HG2 ILE 90 1.798 -2.351 5.216 717 1HD1 ILE 90 1HD1 ILE 90 -1.341 -0.317 7.023 718 2HD1 ILE 90 2HD1 ILE 90 -2.847 -1.170 6.684 719 3HD1 ILE 90 3HD1 ILE 90 -1.607 -1.035 5.435 720 H ALA 91 H ALA 91 2.542 -2.584 8.843 721 HA ALA 91 HA ALA 91 4.873 -2.578 7.300 722 1HB ALA 91 1HB ALA 91 4.619 -2.453 10.304 723 2HB ALA 91 2HB ALA 91 4.508 -1.079 9.202 724 3HB ALA 91 3HB ALA 91 6.027 -1.964 9.360 725 H VAL 92 H VAL 92 3.831 -4.775 9.891 726 HA VAL 92 HA VAL 92 6.085 -6.428 9.956 727 HB VAL 92 HB VAL 92 3.188 -7.108 10.509 728 1HG1 VAL 92 1HG1 VAL 92 4.049 -9.050 11.748 729 2HG1 VAL 92 2HG1 VAL 92 5.675 -8.686 11.171 730 3HG1 VAL 92 3HG1 VAL 92 4.417 -9.152 10.025 731 1HG2 VAL 92 1HG2 VAL 92 4.129 -5.369 11.955 732 2HG2 VAL 92 2HG2 VAL 92 5.470 -6.437 12.371 733 3HG2 VAL 92 3HG2 VAL 92 3.826 -6.856 12.855 734 H GLY 93 H GLY 93 3.082 -6.778 8.070 735 1HA GLY 93 1HA GLY 93 3.795 -9.216 6.842 736 2HA GLY 93 2HA GLY 93 2.576 -8.093 6.258 737 H ALA 94 H ALA 94 4.209 -5.863 5.794 738 HA ALA 94 HA ALA 94 5.134 -6.571 3.187 739 1HB ALA 94 1HB ALA 94 4.010 -4.449 3.645 740 2HB ALA 94 2HB ALA 94 5.600 -4.204 2.917 741 3HB ALA 94 3HB ALA 94 5.372 -3.949 4.648 742 H ALA 95 H ALA 95 6.709 -5.916 6.254 743 HA ALA 95 HA ALA 95 9.329 -5.536 5.247 744 1HB ALA 95 1HB ALA 95 8.674 -4.909 7.531 745 2HB ALA 95 2HB ALA 95 10.085 -5.967 7.518 746 3HB ALA 95 3HB ALA 95 8.501 -6.614 7.941 747 H MET 96 H MET 96 7.467 -8.396 6.068 748 HA MET 96 HA MET 96 9.574 -10.292 6.001 749 1HB MET 96 1HB MET 96 6.694 -10.784 5.234 750 2HB MET 96 2HB MET 96 7.857 -11.973 5.788 751 1HG MET 96 1HG MET 96 6.812 -9.708 7.459 752 2HG MET 96 2HG MET 96 6.157 -11.342 7.458 753 1HE MET 96 1HE MET 96 6.929 -10.084 10.149 754 2HE MET 96 2HE MET 96 7.787 -11.445 10.876 755 3HE MET 96 3HE MET 96 6.355 -11.729 9.883 756 H ALA 97 H ALA 97 7.389 -9.024 3.578 757 HA ALA 97 HA ALA 97 8.332 -10.942 1.589 758 1HB ALA 97 1HB ALA 97 5.902 -10.495 2.082 759 2HB ALA 97 2HB ALA 97 6.379 -10.422 0.390 760 3HB ALA 97 3HB ALA 97 6.123 -8.932 1.297 761 H GLU 98 H GLU 98 9.334 -8.032 2.598 762 HA GLU 98 HA GLU 98 10.306 -6.176 1.755 763 1HB GLU 98 1HB GLU 98 11.818 -7.945 0.794 764 2HB GLU 98 2HB GLU 98 10.893 -7.836 -0.695 765 1HG GLU 98 1HG GLU 98 11.461 -5.408 -0.778 766 2HG GLU 98 2HG GLU 98 12.542 -5.676 0.588 767 H ILE 99 H ILE 99 7.922 -5.642 1.664 768 HA ILE 99 HA ILE 99 7.196 -4.820 -1.068 769 HB ILE 99 HB ILE 99 5.342 -5.161 1.300 770 1HG1 ILE 99 1HG1 ILE 99 5.690 -6.849 -1.192 771 2HG1 ILE 99 2HG1 ILE 99 6.148 -7.317 0.440 772 1HG2 ILE 99 1HG2 ILE 99 4.783 -4.475 -1.586 773 2HG2 ILE 99 2HG2 ILE 99 4.600 -3.401 -0.198 774 3HG2 ILE 99 3HG2 ILE 99 3.554 -4.812 -0.368 775 1HD1 ILE 99 1HD1 ILE 99 3.784 -7.216 1.104 776 2HD1 ILE 99 2HD1 ILE 99 4.084 -8.382 -0.184 777 3HD1 ILE 99 3HD1 ILE 99 3.356 -6.820 -0.560 778 HA PRO 100 HA PRO 100 8.737 -0.954 0.883 779 1HB PRO 100 1HB PRO 100 8.193 -0.173 -1.945 780 2HB PRO 100 2HB PRO 100 9.591 0.191 -0.930 781 1HG PRO 100 1HG PRO 100 9.757 -1.666 -2.821 782 2HG PRO 100 2HG PRO 100 10.535 -1.908 -1.244 783 1HD PRO 100 1HD PRO 100 8.028 -3.107 -2.328 784 2HD PRO 100 2HD PRO 100 9.256 -3.824 -1.265 785 H LEU 101 H LEU 101 7.193 -0.032 2.114 786 HA LEU 101 HA LEU 101 4.874 1.101 0.711 787 1HB LEU 101 1HB LEU 101 3.399 0.507 2.416 788 2HB LEU 101 2HB LEU 101 4.388 -0.921 2.202 789 HG LEU 101 HG LEU 101 5.751 0.236 4.202 790 1HD1 LEU 101 1HD1 LEU 101 2.890 1.101 4.608 791 2HD1 LEU 101 2HD1 LEU 101 4.282 2.162 4.378 792 3HD1 LEU 101 3HD1 LEU 101 4.162 1.160 5.826 793 1HD2 LEU 101 1HD2 LEU 101 4.551 -1.261 5.709 794 2HD2 LEU 101 2HD2 LEU 101 4.875 -2.040 4.161 795 3HD2 LEU 101 3HD2 LEU 101 3.259 -1.432 4.521 796 H VAL 102 H VAL 102 4.500 3.190 1.041 797 HA VAL 102 HA VAL 102 5.844 4.511 3.297 798 HB VAL 102 HB VAL 102 6.356 6.450 2.009 799 1HG1 VAL 102 1HG1 VAL 102 7.851 5.598 0.249 800 2HG1 VAL 102 2HG1 VAL 102 7.091 4.015 0.401 801 3HG1 VAL 102 3HG1 VAL 102 7.994 4.693 1.756 802 1HG2 VAL 102 1HG2 VAL 102 4.911 5.183 -0.306 803 2HG2 VAL 102 2HG2 VAL 102 5.795 6.707 -0.351 804 3HG2 VAL 102 3HG2 VAL 102 4.349 6.556 0.647 805 H GLU 103 H GLU 103 4.692 6.314 4.174 806 HA GLU 103 HA GLU 103 1.819 6.149 3.638 807 1HB GLU 103 1HB GLU 103 1.515 7.274 5.795 808 2HB GLU 103 2HB GLU 103 2.470 5.810 5.964 809 1HG GLU 103 1HG GLU 103 4.475 7.048 6.237 810 2HG GLU 103 2HG GLU 103 3.682 8.552 5.768 811 H VAL 104 H VAL 104 0.950 7.596 2.387 812 HA VAL 104 HA VAL 104 2.195 10.241 2.086 813 HB VAL 104 HB VAL 104 0.668 10.581 0.199 814 1HG1 VAL 104 1HG1 VAL 104 1.544 8.872 -1.320 815 2HG1 VAL 104 2HG1 VAL 104 2.065 7.916 0.067 816 3HG1 VAL 104 3HG1 VAL 104 2.794 9.492 -0.241 817 1HG2 VAL 104 1HG2 VAL 104 -0.799 8.790 -0.594 818 2HG2 VAL 104 2HG2 VAL 104 -1.258 9.340 1.017 819 3HG2 VAL 104 3HG2 VAL 104 -0.379 7.823 0.819 820 H ARG 105 H ARG 105 0.841 12.152 2.319 821 HA ARG 105 HA ARG 105 -1.446 11.688 4.112 822 1HB ARG 105 1HB ARG 105 0.646 12.326 5.328 823 2HB ARG 105 2HB ARG 105 0.654 13.843 4.445 824 1HG ARG 105 1HG ARG 105 -1.769 13.123 6.013 825 2HG ARG 105 2HG ARG 105 -0.328 13.668 6.872 826 1HD ARG 105 1HD ARG 105 -0.303 15.718 5.586 827 2HD ARG 105 2HD ARG 105 -1.672 15.161 4.625 828 HE ARG 105 HE ARG 105 -2.244 15.231 7.436 829 1HH1 ARG 105 1HH1 ARG 105 -2.089 17.111 4.493 830 2HH1 ARG 105 2HH1 ARG 105 -3.163 18.347 5.058 831 1HH2 ARG 105 1HH2 ARG 105 -3.683 16.856 8.198 832 2HH2 ARG 105 2HH2 ARG 105 -4.085 18.197 7.161 833 H ASP 106 H ASP 106 -0.306 13.156 1.312 834 HA ASP 106 HA ASP 106 -2.013 15.514 1.552 835 1HB ASP 106 1HB ASP 106 0.465 15.476 0.719 836 2HB ASP 106 2HB ASP 106 -0.253 14.958 -0.805 837 H GLU 107 H GLU 107 -3.763 15.909 0.300 838 HA GLU 107 HA GLU 107 -5.043 13.701 -0.987 839 1HB GLU 107 1HB GLU 107 -6.275 15.508 0.198 840 2HB GLU 107 2HB GLU 107 -5.790 16.630 -1.065 841 1HG GLU 107 1HG GLU 107 -6.964 15.168 -2.713 842 2HG GLU 107 2HG GLU 107 -7.576 14.226 -1.358 843 H LYS 108 H LYS 108 -3.106 16.412 -2.043 844 HA LYS 108 HA LYS 108 -3.877 16.531 -4.736 845 1HB LYS 108 1HB LYS 108 -1.224 17.169 -3.442 846 2HB LYS 108 2HB LYS 108 -1.660 17.600 -5.083 847 1HG LYS 108 1HG LYS 108 -3.431 19.034 -4.292 848 2HG LYS 108 2HG LYS 108 -3.133 18.526 -2.630 849 1HD LYS 108 1HD LYS 108 -1.244 20.066 -4.409 850 2HD LYS 108 2HD LYS 108 -2.140 20.701 -3.026 851 1HE LYS 108 1HE LYS 108 -0.939 18.973 -1.625 852 2HE LYS 108 2HE LYS 108 0.089 18.682 -3.025 853 1HZ LYS 108 1HZ LYS 108 0.691 21.060 -2.968 854 2HZ LYS 108 2HZ LYS 108 1.154 20.223 -1.568 855 3HZ LYS 108 3HZ LYS 108 -0.205 21.231 -1.537 856 H PHE 109 H PHE 109 -1.787 14.350 -3.022 857 HA PHE 109 HA PHE 109 -0.452 13.224 -5.243 858 1HB PHE 109 1HB PHE 109 0.405 12.838 -3.023 859 2HB PHE 109 2HB PHE 109 -1.106 12.093 -2.514 860 HD1 PHE 109 HD1 PHE 109 -1.408 9.794 -2.688 861 HD2 PHE 109 HD2 PHE 109 1.748 11.657 -4.854 862 HE1 PHE 109 HE1 PHE 109 -0.537 7.579 -3.314 863 HE2 PHE 109 HE2 PHE 109 2.621 9.447 -5.486 864 HZ PHE 109 HZ PHE 109 1.482 7.405 -4.715 865 H PHE 110 H PHE 110 -3.424 12.329 -3.536 866 HA PHE 110 HA PHE 110 -3.885 9.955 -5.029 867 1HB PHE 110 1HB PHE 110 -5.747 11.637 -3.343 868 2HB PHE 110 2HB PHE 110 -6.190 10.091 -4.051 869 HD1 PHE 110 HD1 PHE 110 -4.902 8.035 -3.359 870 HD2 PHE 110 HD2 PHE 110 -4.616 11.749 -1.298 871 HE1 PHE 110 HE1 PHE 110 -4.028 6.865 -1.376 872 HE2 PHE 110 HE2 PHE 110 -3.740 10.588 0.684 873 HZ PHE 110 HZ PHE 110 -3.446 8.142 0.645 874 H GLU 111 H GLU 111 -4.655 13.305 -5.520 875 HA GLU 111 HA GLU 111 -6.591 12.722 -7.558 876 1HB GLU 111 1HB GLU 111 -5.599 15.119 -6.172 877 2HB GLU 111 2HB GLU 111 -6.151 15.352 -7.817 878 1HG GLU 111 1HG GLU 111 -7.703 14.252 -5.497 879 2HG GLU 111 2HG GLU 111 -8.007 15.741 -6.392 880 H ALA 112 H ALA 112 -3.224 13.741 -7.392 881 HA ALA 112 HA ALA 112 -2.943 14.309 -10.156 882 1HB ALA 112 1HB ALA 112 -1.355 15.141 -8.498 883 2HB ALA 112 2HB ALA 112 -0.537 14.201 -9.745 884 3HB ALA 112 3HB ALA 112 -0.834 13.489 -8.159 885 H VAL 113 H VAL 113 -2.499 11.390 -8.220 886 HA VAL 113 HA VAL 113 -1.701 9.895 -10.595 887 HB VAL 113 HB VAL 113 -0.509 9.571 -8.401 888 1HG1 VAL 113 1HG1 VAL 113 -2.416 9.652 -6.904 889 2HG1 VAL 113 2HG1 VAL 113 -1.529 8.139 -6.716 890 3HG1 VAL 113 3HG1 VAL 113 -3.049 8.166 -7.610 891 1HG2 VAL 113 1HG2 VAL 113 -0.302 7.941 -10.161 892 2HG2 VAL 113 2HG2 VAL 113 -1.800 7.157 -9.656 893 3HG2 VAL 113 3HG2 VAL 113 -0.386 7.121 -8.601 894 H LYS 114 H LYS 114 -2.931 8.377 -11.574 895 HA LYS 114 HA LYS 114 -5.402 7.500 -10.302 896 1HB LYS 114 1HB LYS 114 -5.239 8.824 -13.006 897 2HB LYS 114 2HB LYS 114 -6.548 7.727 -12.591 898 1HG LYS 114 1HG LYS 114 -5.862 10.262 -11.108 899 2HG LYS 114 2HG LYS 114 -7.173 10.077 -12.278 900 1HD LYS 114 1HD LYS 114 -8.223 8.400 -10.850 901 2HD LYS 114 2HD LYS 114 -6.894 8.530 -9.699 902 1HE LYS 114 1HE LYS 114 -8.768 10.775 -10.445 903 2HE LYS 114 2HE LYS 114 -8.901 9.785 -8.995 904 1HZ LYS 114 1HZ LYS 114 -6.694 11.642 -9.692 905 2HZ LYS 114 2HZ LYS 114 -6.641 10.572 -8.381 906 3HZ LYS 114 3HZ LYS 114 -7.809 11.804 -8.421 907 H THR 115 H THR 115 -6.245 5.540 -11.229 908 HA THR 115 HA THR 115 -4.302 3.590 -11.564 909 HB THR 115 HB THR 115 -7.175 3.375 -12.479 910 HG1 THR 115 HG1 THR 115 -7.479 2.662 -10.241 911 1HG2 THR 115 1HG2 THR 115 -5.224 1.336 -11.402 912 2HG2 THR 115 2HG2 THR 115 -5.761 1.473 -13.076 913 3HG2 THR 115 3HG2 THR 115 -6.910 1.022 -11.815 914 H GLY 116 H GLY 116 -2.966 3.320 -13.250 915 1HA GLY 116 1HA GLY 116 -3.301 2.249 -15.561 916 2HA GLY 116 2HA GLY 116 -4.035 3.793 -15.952 917 H ASP 117 H ASP 117 -2.101 5.365 -14.410 918 HA ASP 117 HA ASP 117 -0.020 5.280 -16.451 919 1HB ASP 117 1HB ASP 117 -1.358 7.417 -15.464 920 2HB ASP 117 2HB ASP 117 0.084 7.446 -14.448 921 H ARG 118 H ARG 118 2.141 6.449 -15.167 922 HA ARG 118 HA ARG 118 2.957 4.079 -13.630 923 1HB ARG 118 1HB ARG 118 4.209 5.675 -15.791 924 2HB ARG 118 2HB ARG 118 5.270 5.026 -14.563 925 1HG ARG 118 1HG ARG 118 5.095 3.591 -16.554 926 2HG ARG 118 2HG ARG 118 4.588 2.780 -15.076 927 1HD ARG 118 1HD ARG 118 3.137 2.382 -17.094 928 2HD ARG 118 2HD ARG 118 2.302 2.953 -15.652 929 HE ARG 118 HE ARG 118 2.660 5.255 -16.878 930 1HH1 ARG 118 1HH1 ARG 118 1.751 2.184 -18.298 931 2HH1 ARG 118 2HH1 ARG 118 0.747 2.901 -19.521 932 1HH2 ARG 118 1HH2 ARG 118 1.310 6.198 -18.441 933 2HH2 ARG 118 2HH2 ARG 118 0.507 5.184 -19.604 934 H VAL 119 H VAL 119 4.122 4.291 -11.789 935 HA VAL 119 HA VAL 119 5.143 6.936 -11.092 936 HB VAL 119 HB VAL 119 2.884 6.619 -10.025 937 1HG1 VAL 119 1HG1 VAL 119 2.984 4.255 -9.507 938 2HG1 VAL 119 2HG1 VAL 119 2.744 5.195 -8.032 939 3HG1 VAL 119 3HG1 VAL 119 4.334 4.534 -8.407 940 1HG2 VAL 119 1HG2 VAL 119 3.606 7.436 -7.817 941 2HG2 VAL 119 2HG2 VAL 119 4.448 8.228 -9.149 942 3HG2 VAL 119 3HG2 VAL 119 5.261 6.974 -8.215 943 H VAL 120 H VAL 120 7.022 6.912 -9.952 944 HA VAL 120 HA VAL 120 8.205 4.259 -9.427 945 HB VAL 120 HB VAL 120 9.641 6.891 -9.853 946 1HG1 VAL 120 1HG1 VAL 120 10.697 4.071 -9.699 947 2HG1 VAL 120 2HG1 VAL 120 10.886 5.320 -8.468 948 3HG1 VAL 120 3HG1 VAL 120 11.648 5.515 -10.046 949 1HG2 VAL 120 1HG2 VAL 120 9.269 4.583 -11.760 950 2HG2 VAL 120 2HG2 VAL 120 10.278 6.002 -12.045 951 3HG2 VAL 120 3HG2 VAL 120 8.529 6.177 -11.900 952 H VAL 121 H VAL 121 8.406 3.716 -7.362 953 HA VAL 121 HA VAL 121 8.417 5.879 -5.358 954 HB VAL 121 HB VAL 121 7.407 3.050 -5.007 955 1HG1 VAL 121 1HG1 VAL 121 6.531 3.897 -2.865 956 2HG1 VAL 121 2HG1 VAL 121 7.349 5.432 -3.159 957 3HG1 VAL 121 3HG1 VAL 121 8.291 3.956 -2.947 958 1HG2 VAL 121 1HG2 VAL 121 5.181 4.044 -4.905 959 2HG2 VAL 121 2HG2 VAL 121 5.944 4.359 -6.464 960 3HG2 VAL 121 3HG2 VAL 121 5.867 5.634 -5.247 961 H ASN 122 H ASN 122 10.367 6.160 -4.548 962 HA ASN 122 HA ASN 122 12.062 3.810 -4.084 963 1HB ASN 122 1HB ASN 122 13.101 5.747 -5.258 964 2HB ASN 122 2HB ASN 122 12.792 6.742 -3.837 965 1HD2 ASN 122 1HD2 ASN 122 15.024 7.133 -3.601 966 2HD2 ASN 122 2HD2 ASN 122 16.094 5.915 -2.985 967 H ALA 123 H ALA 123 11.428 2.882 -2.235 968 HA ALA 123 HA ALA 123 10.304 4.413 -0.079 969 1HB ALA 123 1HB ALA 123 9.474 2.176 -0.651 970 2HB ALA 123 2HB ALA 123 10.000 2.284 1.028 971 3HB ALA 123 3HB ALA 123 11.025 1.490 -0.168 972 H ASP 124 H ASP 124 13.447 3.700 -0.994 973 HA ASP 124 HA ASP 124 14.671 3.339 1.524 974 1HB ASP 124 1HB ASP 124 15.776 2.952 -0.707 975 2HB ASP 124 2HB ASP 124 15.895 4.703 -0.880 976 H GLU 125 H GLU 125 13.759 6.165 -0.336 977 HA GLU 125 HA GLU 125 14.669 7.945 1.814 978 1HB GLU 125 1HB GLU 125 13.597 8.689 -0.915 979 2HB GLU 125 2HB GLU 125 14.400 9.751 0.231 980 1HG GLU 125 1HG GLU 125 16.485 8.578 -0.085 981 2HG GLU 125 2HG GLU 125 15.694 7.417 -1.153 982 H GLY 126 H GLY 126 11.849 6.612 0.338 983 1HA GLY 126 1HA GLY 126 9.589 6.953 0.832 984 2HA GLY 126 2HA GLY 126 10.052 8.258 1.927 985 H TYR 127 H TYR 127 10.132 7.446 -1.530 986 HA TYR 127 HA TYR 127 9.742 10.286 -2.159 987 1HB TYR 127 1HB TYR 127 12.200 9.595 -2.017 988 2HB TYR 127 2HB TYR 127 11.900 8.584 -3.420 989 HD1 TYR 127 HD1 TYR 127 12.527 9.459 -5.450 990 HD2 TYR 127 HD2 TYR 127 11.332 12.130 -2.360 991 HE1 TYR 127 HE1 TYR 127 13.070 11.370 -6.899 992 HE2 TYR 127 HE2 TYR 127 11.865 14.046 -3.803 993 HH TYR 127 HH TYR 127 13.264 14.571 -5.720 994 H VAL 128 H VAL 128 8.258 10.506 -3.735 995 HA VAL 128 HA VAL 128 7.689 8.145 -5.406 996 HB VAL 128 HB VAL 128 5.605 10.074 -4.376 997 1HG1 VAL 128 1HG1 VAL 128 5.383 7.402 -5.747 998 2HG1 VAL 128 2HG1 VAL 128 5.013 8.974 -6.458 999 3HG1 VAL 128 3HG1 VAL 128 4.031 8.350 -5.132 1000 1HG2 VAL 128 1HG2 VAL 128 4.908 8.318 -2.825 1001 2HG2 VAL 128 2HG2 VAL 128 6.568 8.820 -2.499 1002 3HG2 VAL 128 3HG2 VAL 128 6.255 7.309 -3.353 1003 H GLU 129 H GLU 129 8.216 8.616 -7.433 1004 HA GLU 129 HA GLU 129 7.700 11.340 -8.429 1005 1HB GLU 129 1HB GLU 129 9.533 9.192 -9.521 1006 2HB GLU 129 2HB GLU 129 9.256 10.752 -10.281 1007 1HG GLU 129 1HG GLU 129 10.142 11.835 -8.227 1008 2HG GLU 129 2HG GLU 129 10.559 10.230 -7.624 1009 H LEU 130 H LEU 130 5.858 11.518 -9.521 1010 HA LEU 130 HA LEU 130 4.658 9.193 -10.778 1011 1HB LEU 130 1HB LEU 130 3.260 10.787 -9.527 1012 2HB LEU 130 2HB LEU 130 3.738 12.069 -10.623 1013 HG LEU 130 HG LEU 130 2.663 10.749 -12.487 1014 1HD1 LEU 130 1HD1 LEU 130 1.545 9.161 -10.185 1015 2HD1 LEU 130 2HD1 LEU 130 2.667 8.568 -11.410 1016 3HD1 LEU 130 3HD1 LEU 130 1.034 9.049 -11.870 1017 1HD2 LEU 130 1HD2 LEU 130 1.574 12.680 -11.460 1018 2HD2 LEU 130 2HD2 LEU 130 0.883 11.634 -10.219 1019 3HD2 LEU 130 3HD2 LEU 130 0.400 11.440 -11.904 1020 H ILE 131 H ILE 131 4.777 8.736 -12.917 1021 HA ILE 131 HA ILE 131 5.765 10.871 -14.663 1022 HB ILE 131 HB ILE 131 7.647 9.491 -14.344 1023 1HG1 ILE 131 1HG1 ILE 131 6.417 8.681 -16.979 1024 2HG1 ILE 131 2HG1 ILE 131 7.153 10.248 -16.658 1025 1HG2 ILE 131 1HG2 ILE 131 5.893 7.143 -15.023 1026 2HG2 ILE 131 2HG2 ILE 131 6.613 7.500 -13.453 1027 3HG2 ILE 131 3HG2 ILE 131 7.644 7.064 -14.817 1028 1HD1 ILE 131 1HD1 ILE 131 9.296 9.150 -16.239 1029 2HD1 ILE 131 2HD1 ILE 131 8.676 8.786 -17.850 1030 3HD1 ILE 131 3HD1 ILE 131 8.550 7.586 -16.564 1031 H GLU 132 H GLU 132 4.396 11.332 -16.063 1032 HA GLU 132 HA GLU 132 2.124 9.604 -16.576 1033 1HB GLU 132 1HB GLU 132 2.636 12.446 -17.471 1034 2HB GLU 132 2HB GLU 132 1.100 11.593 -17.549 1035 1HG GLU 132 1HG GLU 132 0.872 11.585 -15.196 1036 2HG GLU 132 2HG GLU 132 2.546 12.082 -14.961 Start of MODEL 16 1 H VAL 1 H VAL 1 4.729 17.308 -10.465 2 HA VAL 1 HA VAL 1 3.249 15.374 -8.811 3 HB VAL 1 HB VAL 1 4.372 13.535 -10.065 4 1HG1 VAL 1 1HG1 VAL 1 2.062 14.093 -10.564 5 2HG1 VAL 1 2HG1 VAL 1 2.909 13.609 -12.034 6 3HG1 VAL 1 3HG1 VAL 1 2.590 15.315 -11.721 7 1HG2 VAL 1 1HG2 VAL 1 5.124 15.732 -11.996 8 2HG2 VAL 1 2HG2 VAL 1 5.320 14.002 -12.282 9 3HG2 VAL 1 3HG2 VAL 1 6.240 14.794 -11.002 10 H LYS 2 H LYS 2 5.331 13.517 -8.584 11 HA LYS 2 HA LYS 2 7.251 13.040 -7.460 12 1HB LYS 2 1HB LYS 2 8.012 15.903 -8.094 13 2HB LYS 2 2HB LYS 2 9.101 14.687 -7.442 14 1HG LYS 2 1HG LYS 2 9.065 13.440 -9.445 15 2HG LYS 2 2HG LYS 2 7.682 14.341 -10.066 16 1HD LYS 2 1HD LYS 2 9.070 16.366 -10.183 17 2HD LYS 2 2HD LYS 2 10.452 15.448 -9.587 18 1HE LYS 2 1HE LYS 2 8.956 14.661 -12.067 19 2HE LYS 2 2HE LYS 2 10.283 15.822 -12.102 20 1HZ LYS 2 1HZ LYS 2 10.782 13.353 -12.534 21 2HZ LYS 2 2HZ LYS 2 10.653 13.174 -10.851 22 3HZ LYS 2 3HZ LYS 2 11.811 14.221 -11.506 23 H PHE 3 H PHE 3 6.359 12.679 -5.483 24 HA PHE 3 HA PHE 3 6.192 14.999 -3.673 25 1HB PHE 3 1HB PHE 3 4.408 12.555 -3.664 26 2HB PHE 3 2HB PHE 3 4.299 13.919 -2.560 27 HD1 PHE 3 HD1 PHE 3 3.303 12.575 -5.723 28 HD2 PHE 3 HD2 PHE 3 3.709 16.189 -3.511 29 HE1 PHE 3 HE1 PHE 3 1.757 13.694 -7.272 30 HE2 PHE 3 HE2 PHE 3 2.161 17.312 -5.060 31 HZ PHE 3 HZ PHE 3 1.181 16.064 -6.942 32 H ALA 4 H ALA 4 6.780 14.673 -1.513 33 HA ALA 4 HA ALA 4 8.451 12.311 -1.040 34 1HB ALA 4 1HB ALA 4 9.491 14.509 -0.686 35 2HB ALA 4 2HB ALA 4 9.414 13.573 0.807 36 3HB ALA 4 3HB ALA 4 8.266 14.881 0.528 37 H CYS 5 H CYS 5 7.955 10.826 0.459 38 HA CYS 5 HA CYS 5 5.636 11.317 2.195 39 1HB CYS 5 1HB CYS 5 6.281 8.800 0.635 40 2HB CYS 5 2HB CYS 5 4.954 8.961 1.778 41 HG CYS 5 HG CYS 5 4.845 11.351 -0.503 42 H ARG 6 H ARG 6 5.584 9.418 3.920 43 HA ARG 6 HA ARG 6 8.263 9.386 5.105 44 1HB ARG 6 1HB ARG 6 6.402 10.127 6.524 45 2HB ARG 6 2HB ARG 6 5.590 8.587 6.276 46 1HG ARG 6 1HG ARG 6 7.519 7.461 7.369 47 2HG ARG 6 2HG ARG 6 8.185 9.056 7.726 48 1HD ARG 6 1HD ARG 6 6.196 9.611 9.013 49 2HD ARG 6 2HD ARG 6 5.501 8.034 8.637 50 HE ARG 6 HE ARG 6 8.071 8.131 10.039 51 1HH1 ARG 6 1HH1 ARG 6 4.647 7.373 10.040 52 2HH1 ARG 6 2HH1 ARG 6 4.707 6.580 11.587 53 1HH2 ARG 6 1HH2 ARG 6 8.153 7.056 12.042 54 2HH2 ARG 6 2HH2 ARG 6 6.691 6.403 12.732 55 H ALA 7 H ALA 7 9.514 7.665 4.949 56 HA ALA 7 HA ALA 7 8.389 5.237 3.796 57 1HB ALA 7 1HB ALA 7 11.269 5.958 4.283 58 2HB ALA 7 2HB ALA 7 10.384 6.265 2.790 59 3HB ALA 7 3HB ALA 7 10.667 4.607 3.320 60 H ILE 8 H ILE 8 7.643 3.754 5.123 61 HA ILE 8 HA ILE 8 8.700 3.425 7.790 62 HB ILE 8 HB ILE 8 6.604 1.850 6.276 63 1HG1 ILE 8 1HG1 ILE 8 5.148 2.868 8.154 64 2HG1 ILE 8 2HG1 ILE 8 6.486 3.982 8.402 65 1HG2 ILE 8 1HG2 ILE 8 7.494 1.548 9.144 66 2HG2 ILE 8 2HG2 ILE 8 7.713 0.373 7.848 67 3HG2 ILE 8 3HG2 ILE 8 6.090 0.757 8.422 68 1HD1 ILE 8 1HD1 ILE 8 4.804 5.002 7.020 69 2HD1 ILE 8 2HD1 ILE 8 4.867 3.653 5.887 70 3HD1 ILE 8 3HD1 ILE 8 6.260 4.723 6.064 71 H THR 9 H THR 9 8.499 1.441 4.852 72 HA THR 9 HA THR 9 10.659 -0.243 5.886 73 HB THR 9 HB THR 9 10.043 -1.711 3.894 74 HG1 THR 9 HG1 THR 9 7.761 -1.301 3.249 75 1HG2 THR 9 1HG2 THR 9 8.062 -2.660 5.028 76 2HG2 THR 9 2HG2 THR 9 7.978 -1.220 6.043 77 3HG2 THR 9 3HG2 THR 9 9.369 -2.296 6.155 78 H ARG 10 H ARG 10 11.859 -1.166 3.642 79 HA ARG 10 HA ARG 10 12.801 1.253 2.264 80 1HB ARG 10 1HB ARG 10 14.474 -1.014 3.357 81 2HB ARG 10 2HB ARG 10 15.086 0.183 2.224 82 1HG ARG 10 1HG ARG 10 14.050 0.706 5.006 83 2HG ARG 10 2HG ARG 10 15.731 0.770 4.473 84 1HD ARG 10 1HD ARG 10 15.183 2.622 2.969 85 2HD ARG 10 2HD ARG 10 13.500 2.546 3.480 86 HE ARG 10 HE ARG 10 15.771 3.451 5.127 87 1HH1 ARG 10 1HH1 ARG 10 12.311 3.147 4.603 88 2HH1 ARG 10 2HH1 ARG 10 11.901 4.325 5.813 89 1HH2 ARG 10 1HH2 ARG 10 15.232 5.012 6.685 90 2HH2 ARG 10 2HH2 ARG 10 13.568 5.397 6.993 91 H GLY 11 H GLY 11 14.259 0.488 0.305 92 1HA GLY 11 1HA GLY 11 14.427 -1.035 -1.544 93 2HA GLY 11 2HA GLY 11 12.866 -1.705 -1.084 94 H ARG 12 H ARG 12 13.103 -1.066 -3.676 95 HA ARG 12 HA ARG 12 11.318 1.238 -3.856 96 1HB ARG 12 1HB ARG 12 12.508 2.264 -5.663 97 2HB ARG 12 2HB ARG 12 13.638 2.033 -4.340 98 1HG ARG 12 1HG ARG 12 14.514 0.028 -5.475 99 2HG ARG 12 2HG ARG 12 13.421 0.347 -6.824 100 1HD ARG 12 1HD ARG 12 14.491 2.614 -7.009 101 2HD ARG 12 2HD ARG 12 15.694 2.062 -5.846 102 HE ARG 12 HE ARG 12 15.267 0.760 -8.459 103 1HH1 ARG 12 1HH1 ARG 12 17.363 1.932 -5.924 104 2HH1 ARG 12 2HH1 ARG 12 18.831 1.506 -6.754 105 1HH2 ARG 12 1HH2 ARG 12 17.170 0.218 -9.579 106 2HH2 ARG 12 2HH2 ARG 12 18.720 0.547 -8.855 107 H ALA 13 H ALA 13 9.963 1.245 -5.708 108 HA ALA 13 HA ALA 13 9.975 -1.195 -7.332 109 1HB ALA 13 1HB ALA 13 7.590 -0.233 -5.757 110 2HB ALA 13 2HB ALA 13 8.523 -1.698 -5.448 111 3HB ALA 13 3HB ALA 13 7.579 -1.548 -6.933 112 H GLU 14 H GLU 14 9.295 -0.897 -9.369 113 HA GLU 14 HA GLU 14 8.086 1.693 -10.075 114 1HB GLU 14 1HB GLU 14 10.386 1.844 -10.711 115 2HB GLU 14 2HB GLU 14 10.371 0.227 -11.396 116 1HG GLU 14 1HG GLU 14 8.743 1.085 -13.103 117 2HG GLU 14 2HG GLU 14 9.077 2.704 -12.494 118 H GLY 15 H GLY 15 6.154 1.376 -11.040 119 1HA GLY 15 1HA GLY 15 5.841 -0.289 -13.282 120 2HA GLY 15 2HA GLY 15 5.226 -1.144 -11.878 121 H GLU 16 H GLU 16 3.186 -1.102 -12.968 122 HA GLU 16 HA GLU 16 1.866 1.298 -13.665 123 1HB GLU 16 1HB GLU 16 0.614 -1.372 -13.031 124 2HB GLU 16 2HB GLU 16 -0.005 -0.114 -14.082 125 1HG GLU 16 1HG GLU 16 1.816 -0.495 -15.644 126 2HG GLU 16 2HG GLU 16 2.459 -1.749 -14.584 127 H ALA 17 H ALA 17 0.570 2.605 -12.479 128 HA ALA 17 HA ALA 17 0.339 2.067 -9.627 129 1HB ALA 17 1HB ALA 17 -0.395 4.388 -9.449 130 2HB ALA 17 2HB ALA 17 -0.405 4.528 -11.208 131 3HB ALA 17 3HB ALA 17 1.115 4.273 -10.354 132 H LEU 18 H LEU 18 -1.429 1.306 -8.714 133 HA LEU 18 HA LEU 18 -3.977 1.412 -10.197 134 1HB LEU 18 1HB LEU 18 -2.630 -0.842 -9.590 135 2HB LEU 18 2HB LEU 18 -3.527 -0.645 -8.098 136 HG LEU 18 HG LEU 18 -5.629 -0.544 -9.498 137 1HD1 LEU 18 1HD1 LEU 18 -4.571 0.027 -11.617 138 2HD1 LEU 18 2HD1 LEU 18 -5.496 -1.470 -11.755 139 3HD1 LEU 18 3HD1 LEU 18 -3.735 -1.525 -11.629 140 1HD2 LEU 18 1HD2 LEU 18 -5.755 -2.955 -9.770 141 2HD2 LEU 18 2HD2 LEU 18 -4.946 -2.546 -8.257 142 3HD2 LEU 18 3HD2 LEU 18 -4.000 -3.078 -9.648 143 H VAL 19 H VAL 19 -5.465 2.682 -9.205 144 HA VAL 19 HA VAL 19 -4.883 3.459 -6.436 145 HB VAL 19 HB VAL 19 -6.683 4.850 -8.426 146 1HG1 VAL 19 1HG1 VAL 19 -6.584 6.734 -6.891 147 2HG1 VAL 19 2HG1 VAL 19 -5.549 5.814 -5.800 148 3HG1 VAL 19 3HG1 VAL 19 -7.217 5.306 -6.070 149 1HG2 VAL 19 1HG2 VAL 19 -3.837 5.477 -7.644 150 2HG2 VAL 19 2HG2 VAL 19 -4.860 6.475 -8.678 151 3HG2 VAL 19 3HG2 VAL 19 -4.376 4.863 -9.207 152 H THR 20 H THR 20 -6.128 2.827 -4.837 153 HA THR 20 HA THR 20 -8.945 2.165 -5.398 154 HB THR 20 HB THR 20 -7.232 0.827 -3.294 155 HG1 THR 20 HG1 THR 20 -7.250 0.430 -5.932 156 1HG2 THR 20 1HG2 THR 20 -9.634 0.832 -2.817 157 2HG2 THR 20 2HG2 THR 20 -9.073 -0.794 -3.204 158 3HG2 THR 20 3HG2 THR 20 -9.960 0.143 -4.406 159 H LYS 21 H LYS 21 -10.115 3.785 -4.525 160 HA LYS 21 HA LYS 21 -8.979 5.352 -2.359 161 1HB LYS 21 1HB LYS 21 -11.601 5.741 -3.805 162 2HB LYS 21 2HB LYS 21 -10.816 6.899 -2.742 163 1HG LYS 21 1HG LYS 21 -8.900 6.943 -4.356 164 2HG LYS 21 2HG LYS 21 -9.887 5.969 -5.446 165 1HD LYS 21 1HD LYS 21 -10.521 8.723 -4.400 166 2HD LYS 21 2HD LYS 21 -10.090 8.295 -6.055 167 1HE LYS 21 1HE LYS 21 -12.124 7.014 -6.296 168 2HE LYS 21 2HE LYS 21 -12.538 7.296 -4.607 169 1HZ LYS 21 1HZ LYS 21 -13.791 8.820 -5.855 170 2HZ LYS 21 2HZ LYS 21 -12.467 9.269 -6.813 171 3HZ LYS 21 3HZ LYS 21 -12.525 9.731 -5.181 172 H GLU 22 H GLU 22 -10.451 2.542 -2.250 173 HA GLU 22 HA GLU 22 -12.159 3.241 0.027 174 1HB GLU 22 1HB GLU 22 -12.159 0.795 -1.740 175 2HB GLU 22 2HB GLU 22 -13.108 0.931 -0.265 176 1HG GLU 22 1HG GLU 22 -14.239 2.910 -1.219 177 2HG GLU 22 2HG GLU 22 -13.343 2.661 -2.715 178 H TYR 23 H TYR 23 -11.901 2.255 1.977 179 HA TYR 23 HA TYR 23 -9.235 1.322 2.556 180 1HB TYR 23 1HB TYR 23 -10.117 1.308 4.932 181 2HB TYR 23 2HB TYR 23 -10.163 2.872 4.123 182 HD1 TYR 23 HD1 TYR 23 -12.175 0.114 5.462 183 HD2 TYR 23 HD2 TYR 23 -12.296 3.891 3.505 184 HE1 TYR 23 HE1 TYR 23 -14.577 0.284 5.949 185 HE2 TYR 23 HE2 TYR 23 -14.701 4.070 3.989 186 HH TYR 23 HH TYR 23 -16.603 2.567 4.468 187 H ILE 24 H ILE 24 -8.644 -0.720 3.175 188 HA ILE 24 HA ILE 24 -10.787 -2.732 3.278 189 HB ILE 24 HB ILE 24 -9.260 -4.367 2.201 190 1HG1 ILE 24 1HG1 ILE 24 -7.618 -1.925 1.492 191 2HG1 ILE 24 2HG1 ILE 24 -7.140 -3.172 2.642 192 1HG2 ILE 24 1HG2 ILE 24 -9.993 -1.961 0.541 193 2HG2 ILE 24 2HG2 ILE 24 -11.038 -3.326 0.936 194 3HG2 ILE 24 3HG2 ILE 24 -9.624 -3.568 -0.090 195 1HD1 ILE 24 1HD1 ILE 24 -7.153 -4.826 0.842 196 2HD1 ILE 24 2HD1 ILE 24 -6.046 -3.496 0.501 197 3HD1 ILE 24 3HD1 ILE 24 -7.613 -3.569 -0.306 198 H SER 25 H SER 25 -10.282 -4.651 4.487 199 HA SER 25 HA SER 25 -8.675 -3.994 6.825 200 1HB SER 25 1HB SER 25 -9.796 -6.084 7.739 201 2HB SER 25 2HB SER 25 -10.884 -4.763 7.313 202 HG SER 25 HG SER 25 -11.707 -5.922 5.745 203 H PHE 26 H PHE 26 -8.019 -5.339 3.975 204 HA PHE 26 HA PHE 26 -6.342 -6.580 3.134 205 1HB PHE 26 1HB PHE 26 -5.431 -6.288 5.942 206 2HB PHE 26 2HB PHE 26 -4.643 -7.521 4.961 207 HD1 PHE 26 HD1 PHE 26 -5.676 -3.939 4.770 208 HD2 PHE 26 HD2 PHE 26 -2.825 -6.910 3.694 209 HE1 PHE 26 HE1 PHE 26 -4.275 -2.208 3.726 210 HE2 PHE 26 HE2 PHE 26 -1.416 -5.184 2.648 211 HZ PHE 26 HZ PHE 26 -2.141 -2.830 2.666 212 H LEU 27 H LEU 27 -8.515 -7.824 5.402 213 HA LEU 27 HA LEU 27 -7.996 -10.575 4.550 214 1HB LEU 27 1HB LEU 27 -9.989 -9.368 6.476 215 2HB LEU 27 2HB LEU 27 -10.092 -11.037 5.955 216 HG LEU 27 HG LEU 27 -9.040 -11.135 8.038 217 1HD1 LEU 27 1HD1 LEU 27 -6.768 -11.893 7.593 218 2HD1 LEU 27 2HD1 LEU 27 -6.822 -11.130 6.005 219 3HD1 LEU 27 3HD1 LEU 27 -7.894 -12.481 6.369 220 1HD2 LEU 27 1HD2 LEU 27 -8.586 -8.787 8.350 221 2HD2 LEU 27 2HD2 LEU 27 -7.286 -8.852 7.161 222 3HD2 LEU 27 3HD2 LEU 27 -7.134 -9.730 8.684 223 H GLY 28 H GLY 28 -8.609 -8.619 2.608 224 1HA GLY 28 1HA GLY 28 -11.435 -8.760 2.004 225 2HA GLY 28 2HA GLY 28 -10.214 -7.874 1.104 226 H GLY 29 H GLY 29 -11.701 -8.877 -0.574 227 1HA GLY 29 1HA GLY 29 -11.325 -11.705 -1.060 228 2HA GLY 29 2HA GLY 29 -12.311 -10.603 -1.999 229 H ILE 30 H ILE 30 -8.879 -10.221 -1.266 230 HA ILE 30 HA ILE 30 -8.237 -10.151 -4.090 231 HB ILE 30 HB ILE 30 -6.260 -10.334 -1.802 232 1HG1 ILE 30 1HG1 ILE 30 -7.399 -7.833 -3.075 233 2HG1 ILE 30 2HG1 ILE 30 -7.815 -8.420 -1.470 234 1HG2 ILE 30 1HG2 ILE 30 -5.356 -10.790 -4.016 235 2HG2 ILE 30 2HG2 ILE 30 -4.744 -9.259 -3.392 236 3HG2 ILE 30 3HG2 ILE 30 -6.016 -9.265 -4.612 237 1HD1 ILE 30 1HD1 ILE 30 -5.089 -7.514 -2.372 238 2HD1 ILE 30 2HD1 ILE 30 -5.495 -8.107 -0.761 239 3HD1 ILE 30 3HD1 ILE 30 -6.208 -6.606 -1.354 240 H ASP 31 H ASP 31 -8.141 -11.968 -5.220 241 HA ASP 31 HA ASP 31 -8.279 -14.533 -4.126 242 1HB ASP 31 1HB ASP 31 -9.008 -13.991 -6.411 243 2HB ASP 31 2HB ASP 31 -7.329 -13.732 -6.880 244 H LYS 32 H LYS 32 -6.821 -15.969 -3.466 245 HA LYS 32 HA LYS 32 -4.138 -14.998 -3.054 246 1HB LYS 32 1HB LYS 32 -3.901 -17.082 -1.689 247 2HB LYS 32 2HB LYS 32 -5.219 -16.030 -1.191 248 1HG LYS 32 1HG LYS 32 -6.735 -17.515 -2.576 249 2HG LYS 32 2HG LYS 32 -5.374 -18.637 -2.664 250 1HD LYS 32 1HD LYS 32 -5.313 -18.792 -0.246 251 2HD LYS 32 2HD LYS 32 -6.604 -17.597 -0.111 252 1HE LYS 32 1HE LYS 32 -8.056 -19.159 -1.429 253 2HE LYS 32 2HE LYS 32 -6.778 -20.364 -1.288 254 1HZ LYS 32 1HZ LYS 32 -8.420 -20.708 0.409 255 2HZ LYS 32 2HZ LYS 32 -8.273 -19.111 0.956 256 3HZ LYS 32 3HZ LYS 32 -6.979 -20.197 1.140 257 H GLU 33 H GLU 33 -5.614 -16.809 -5.458 258 HA GLU 33 HA GLU 33 -3.267 -18.464 -5.994 259 1HB GLU 33 1HB GLU 33 -5.952 -18.314 -7.370 260 2HB GLU 33 2HB GLU 33 -4.668 -19.436 -7.793 261 1HG GLU 33 1HG GLU 33 -4.856 -20.553 -5.698 262 2HG GLU 33 2HG GLU 33 -5.963 -19.324 -5.083 263 H THR 34 H THR 34 -5.140 -15.833 -7.417 264 HA THR 34 HA THR 34 -3.062 -15.564 -9.495 265 HB THR 34 HB THR 34 -4.997 -14.496 -10.836 266 HG1 THR 34 HG1 THR 34 -6.344 -15.772 -8.685 267 1HG2 THR 34 1HG2 THR 34 -5.661 -16.694 -11.693 268 2HG2 THR 34 2HG2 THR 34 -4.966 -17.461 -10.265 269 3HG2 THR 34 3HG2 THR 34 -3.922 -16.616 -11.408 270 H GLY 35 H GLY 35 -4.351 -14.045 -6.825 271 1HA GLY 35 1HA GLY 35 -4.049 -11.945 -5.952 272 2HA GLY 35 2HA GLY 35 -2.924 -11.633 -7.262 273 H ILE 36 H ILE 36 -6.254 -12.549 -7.736 274 HA ILE 36 HA ILE 36 -6.756 -10.045 -9.135 275 HB ILE 36 HB ILE 36 -8.466 -12.527 -8.855 276 1HG1 ILE 36 1HG1 ILE 36 -6.434 -12.870 -10.208 277 2HG1 ILE 36 2HG1 ILE 36 -7.891 -12.955 -11.191 278 1HG2 ILE 36 1HG2 ILE 36 -8.898 -10.075 -10.556 279 2HG2 ILE 36 2HG2 ILE 36 -9.855 -10.562 -9.157 280 3HG2 ILE 36 3HG2 ILE 36 -9.863 -11.550 -10.619 281 1HD1 ILE 36 1HD1 ILE 36 -7.488 -10.673 -11.967 282 2HD1 ILE 36 2HD1 ILE 36 -6.139 -11.747 -12.339 283 3HD1 ILE 36 3HD1 ILE 36 -6.019 -10.610 -10.995 284 H VAL 37 H VAL 37 -7.650 -8.374 -8.087 285 HA VAL 37 HA VAL 37 -8.826 -8.624 -5.510 286 HB VAL 37 HB VAL 37 -9.058 -6.286 -7.417 287 1HG1 VAL 37 1HG1 VAL 37 -10.663 -6.183 -5.601 288 2HG1 VAL 37 2HG1 VAL 37 -9.400 -4.977 -5.357 289 3HG1 VAL 37 3HG1 VAL 37 -9.381 -6.473 -4.425 290 1HG2 VAL 37 1HG2 VAL 37 -6.716 -6.858 -7.038 291 2HG2 VAL 37 2HG2 VAL 37 -6.985 -6.829 -5.294 292 3HG2 VAL 37 3HG2 VAL 37 -7.136 -5.345 -6.233 293 H LYS 38 H LYS 38 -10.516 -9.978 -5.512 294 HA LYS 38 HA LYS 38 -12.718 -9.697 -7.371 295 1HB LYS 38 1HB LYS 38 -12.432 -11.429 -4.906 296 2HB LYS 38 2HB LYS 38 -13.683 -11.571 -6.130 297 1HG LYS 38 1HG LYS 38 -10.901 -11.729 -7.096 298 2HG LYS 38 2HG LYS 38 -11.460 -13.068 -6.095 299 1HD LYS 38 1HD LYS 38 -12.966 -12.055 -8.502 300 2HD LYS 38 2HD LYS 38 -11.787 -13.367 -8.572 301 1HE LYS 38 1HE LYS 38 -14.321 -13.304 -6.935 302 2HE LYS 38 2HE LYS 38 -14.023 -14.282 -8.373 303 1HZ LYS 38 1HZ LYS 38 -12.283 -15.456 -7.176 304 2HZ LYS 38 2HZ LYS 38 -13.755 -15.571 -6.339 305 3HZ LYS 38 3HZ LYS 38 -12.556 -14.509 -5.795 306 H GLU 39 H GLU 39 -11.700 -8.201 -4.619 307 HA GLU 39 HA GLU 39 -14.160 -7.667 -3.304 308 1HB GLU 39 1HB GLU 39 -11.662 -7.325 -2.522 309 2HB GLU 39 2HB GLU 39 -11.855 -5.747 -3.272 310 1HG GLU 39 1HG GLU 39 -12.317 -5.564 -0.935 311 2HG GLU 39 2HG GLU 39 -13.820 -5.344 -1.834 312 H ASP 40 H ASP 40 -15.580 -5.943 -3.622 313 HA ASP 40 HA ASP 40 -15.584 -4.964 -6.323 314 1HB ASP 40 1HB ASP 40 -17.693 -5.622 -5.336 315 2HB ASP 40 2HB ASP 40 -17.488 -4.449 -4.035 316 H CYS 41 H CYS 41 -15.036 -3.065 -7.061 317 HA CYS 41 HA CYS 41 -15.069 -0.636 -5.617 318 1HB CYS 41 1HB CYS 41 -13.002 -1.804 -4.659 319 2HB CYS 41 2HB CYS 41 -12.285 -1.638 -6.259 320 HG CYS 41 HG CYS 41 -13.304 0.948 -4.267 321 H GLU 42 H GLU 42 -15.883 -1.919 -8.103 322 HA GLU 42 HA GLU 42 -16.145 -1.520 -10.294 323 1HB GLU 42 1HB GLU 42 -16.256 0.859 -9.554 324 2HB GLU 42 2HB GLU 42 -14.538 1.000 -9.900 325 1HG GLU 42 1HG GLU 42 -14.843 0.821 -12.183 326 2HG GLU 42 2HG GLU 42 -16.413 0.039 -12.010 327 H ILE 43 H ILE 43 -12.826 -0.933 -9.199 328 HA ILE 43 HA ILE 43 -11.672 -1.913 -11.655 329 HB ILE 43 HB ILE 43 -9.526 -1.841 -10.441 330 1HG1 ILE 43 1HG1 ILE 43 -11.199 -0.933 -8.085 331 2HG1 ILE 43 2HG1 ILE 43 -10.392 -2.493 -8.215 332 1HG2 ILE 43 1HG2 ILE 43 -10.306 0.156 -11.551 333 2HG2 ILE 43 2HG2 ILE 43 -9.491 0.596 -10.049 334 3HG2 ILE 43 3HG2 ILE 43 -11.253 0.612 -10.135 335 1HD1 ILE 43 1HD1 ILE 43 -8.229 -1.368 -8.257 336 2HD1 ILE 43 2HD1 ILE 43 -9.145 -0.959 -6.806 337 3HD1 ILE 43 3HD1 ILE 43 -9.038 0.194 -8.137 338 H LYS 44 H LYS 44 -13.495 -3.475 -9.699 339 HA LYS 44 HA LYS 44 -12.193 -5.719 -8.705 340 1HB LYS 44 1HB LYS 44 -14.437 -5.307 -8.076 341 2HB LYS 44 2HB LYS 44 -14.984 -5.262 -9.743 342 1HG LYS 44 1HG LYS 44 -14.385 -7.707 -9.877 343 2HG LYS 44 2HG LYS 44 -14.169 -7.657 -8.124 344 1HD LYS 44 1HD LYS 44 -16.449 -6.990 -7.801 345 2HD LYS 44 2HD LYS 44 -16.690 -6.800 -9.538 346 1HE LYS 44 1HE LYS 44 -16.287 -9.218 -9.819 347 2HE LYS 44 2HE LYS 44 -16.145 -9.377 -8.070 348 1HZ LYS 44 1HZ LYS 44 -18.556 -8.474 -9.556 349 2HZ LYS 44 2HZ LYS 44 -18.425 -8.556 -7.868 350 3HZ LYS 44 3HZ LYS 44 -18.350 -9.975 -8.790 351 H GLY 45 H GLY 45 -11.160 -7.317 -9.675 352 1HA GLY 45 1HA GLY 45 -11.228 -9.110 -11.340 353 2HA GLY 45 2HA GLY 45 -11.823 -7.922 -12.492 354 H GLU 46 H GLU 46 -9.653 -6.179 -10.918 355 HA GLU 46 HA GLU 46 -7.559 -6.674 -12.854 356 1HB GLU 46 1HB GLU 46 -8.004 -4.571 -10.750 357 2HB GLU 46 2HB GLU 46 -6.468 -4.710 -11.594 358 1HG GLU 46 1HG GLU 46 -9.134 -4.304 -12.925 359 2HG GLU 46 2HG GLU 46 -7.966 -3.029 -12.580 360 H SER 47 H SER 47 -5.449 -7.234 -12.397 361 HA SER 47 HA SER 47 -5.066 -8.682 -9.889 362 1HB SER 47 1HB SER 47 -4.531 -9.857 -11.991 363 2HB SER 47 2HB SER 47 -3.356 -8.605 -12.393 364 HG SER 47 HG SER 47 -3.190 -10.696 -10.574 365 H VAL 48 H VAL 48 -3.285 -8.324 -8.554 366 HA VAL 48 HA VAL 48 -2.141 -5.625 -8.770 367 HB VAL 48 HB VAL 48 -1.637 -5.845 -6.356 368 1HG1 VAL 48 1HG1 VAL 48 -4.517 -6.322 -7.120 369 2HG1 VAL 48 2HG1 VAL 48 -3.696 -4.762 -7.028 370 3HG1 VAL 48 3HG1 VAL 48 -3.970 -5.705 -5.563 371 1HG2 VAL 48 1HG2 VAL 48 -2.588 -7.682 -5.066 372 2HG2 VAL 48 2HG2 VAL 48 -1.454 -8.296 -6.269 373 3HG2 VAL 48 3HG2 VAL 48 -3.192 -8.429 -6.544 374 H ALA 49 H ALA 49 -1.335 -8.577 -9.685 375 HA ALA 49 HA ALA 49 1.120 -9.123 -8.404 376 1HB ALA 49 1HB ALA 49 0.113 -10.151 -11.049 377 2HB ALA 49 2HB ALA 49 -0.250 -10.856 -9.474 378 3HB ALA 49 3HB ALA 49 1.409 -10.846 -10.075 379 H GLY 50 H GLY 50 2.323 -7.273 -8.512 380 1HA GLY 50 1HA GLY 50 4.406 -6.608 -9.471 381 2HA GLY 50 2HA GLY 50 3.774 -7.016 -11.060 382 H ARG 51 H ARG 51 1.644 -5.304 -9.014 383 HA ARG 51 HA ARG 51 2.277 -2.807 -10.443 384 1HB ARG 51 1HB ARG 51 -0.384 -3.910 -9.546 385 2HB ARG 51 2HB ARG 51 -0.166 -2.236 -10.034 386 1HG ARG 51 1HG ARG 51 0.570 -2.976 -12.247 387 2HG ARG 51 2HG ARG 51 0.344 -4.655 -11.754 388 1HD ARG 51 1HD ARG 51 -2.006 -4.342 -11.510 389 2HD ARG 51 2HD ARG 51 -1.852 -2.598 -11.716 390 HE ARG 51 HE ARG 51 -0.836 -3.720 -14.029 391 1HH1 ARG 51 1HH1 ARG 51 -3.887 -3.811 -12.320 392 2HH1 ARG 51 2HH1 ARG 51 -4.858 -3.902 -13.760 393 1HH2 ARG 51 1HH2 ARG 51 -2.099 -3.892 -15.944 394 2HH2 ARG 51 2HH2 ARG 51 -3.835 -3.966 -15.820 395 H ILE 52 H ILE 52 1.477 -0.828 -9.238 396 HA ILE 52 HA ILE 52 2.199 -1.114 -6.393 397 HB ILE 52 HB ILE 52 2.417 1.307 -8.198 398 1HG1 ILE 52 1HG1 ILE 52 4.858 1.155 -7.481 399 2HG1 ILE 52 2HG1 ILE 52 4.485 -0.439 -6.848 400 1HG2 ILE 52 1HG2 ILE 52 3.355 2.479 -6.260 401 2HG2 ILE 52 2HG2 ILE 52 2.998 1.079 -5.250 402 3HG2 ILE 52 3HG2 ILE 52 1.681 1.991 -5.987 403 1HD1 ILE 52 1HD1 ILE 52 4.208 0.414 -9.714 404 2HD1 ILE 52 2HD1 ILE 52 3.877 -1.195 -9.072 405 3HD1 ILE 52 3HD1 ILE 52 5.519 -0.552 -9.039 406 H LEU 53 H LEU 53 0.638 -0.765 -4.949 407 HA LEU 53 HA LEU 53 -1.946 0.158 -5.971 408 1HB LEU 53 1HB LEU 53 -1.083 -1.570 -3.705 409 2HB LEU 53 2HB LEU 53 -2.592 -0.696 -3.545 410 HG LEU 53 HG LEU 53 -2.949 -2.979 -4.334 411 1HD1 LEU 53 1HD1 LEU 53 -4.363 -2.465 -6.245 412 2HD1 LEU 53 2HD1 LEU 53 -3.549 -0.913 -6.439 413 3HD1 LEU 53 3HD1 LEU 53 -4.508 -1.230 -4.994 414 1HD2 LEU 53 1HD2 LEU 53 -1.318 -2.143 -6.727 415 2HD2 LEU 53 2HD2 LEU 53 -2.222 -3.650 -6.580 416 3HD2 LEU 53 3HD2 LEU 53 -0.855 -3.332 -5.511 417 H VAL 54 H VAL 54 -2.985 1.896 -5.242 418 HA VAL 54 HA VAL 54 -1.669 3.513 -3.157 419 HB VAL 54 HB VAL 54 -3.473 4.448 -5.404 420 1HG1 VAL 54 1HG1 VAL 54 -3.717 5.836 -3.439 421 2HG1 VAL 54 2HG1 VAL 54 -2.823 6.706 -4.686 422 3HG1 VAL 54 3HG1 VAL 54 -1.966 6.006 -3.313 423 1HG2 VAL 54 1HG2 VAL 54 -1.285 3.748 -6.233 424 2HG2 VAL 54 2HG2 VAL 54 -0.493 4.781 -5.042 425 3HG2 VAL 54 3HG2 VAL 54 -1.465 5.500 -6.326 426 H PHE 55 H PHE 55 -2.731 3.602 -1.292 427 HA PHE 55 HA PHE 55 -5.672 3.405 -1.291 428 1HB PHE 55 1HB PHE 55 -3.741 2.008 0.571 429 2HB PHE 55 2HB PHE 55 -5.456 2.182 0.912 430 HD1 PHE 55 HD1 PHE 55 -2.937 0.435 -1.043 431 HD2 PHE 55 HD2 PHE 55 -7.111 0.961 -0.394 432 HE1 PHE 55 HE1 PHE 55 -3.387 -1.653 -2.259 433 HE2 PHE 55 HE2 PHE 55 -7.562 -1.127 -1.610 434 HZ PHE 55 HZ PHE 55 -5.701 -2.438 -2.543 435 HA PRO 56 HA PRO 56 -5.321 7.014 1.308 436 1HB PRO 56 1HB PRO 56 -7.953 6.336 2.404 437 2HB PRO 56 2HB PRO 56 -7.481 7.720 1.413 438 1HG PRO 56 1HG PRO 56 -9.049 5.740 0.461 439 2HG PRO 56 2HG PRO 56 -7.898 6.615 -0.564 440 1HD PRO 56 1HD PRO 56 -7.628 3.911 0.706 441 2HD PRO 56 2HD PRO 56 -7.172 4.438 -0.930 442 H GLY 57 H GLY 57 -7.009 4.276 2.862 443 1HA GLY 57 1HA GLY 57 -5.183 4.558 5.148 444 2HA GLY 57 2HA GLY 57 -6.921 4.521 5.414 445 H GLY 58 H GLY 58 -4.116 2.692 5.104 446 1HA GLY 58 1HA GLY 58 -5.430 0.189 4.500 447 2HA GLY 58 2HA GLY 58 -3.745 0.402 4.964 448 H LYS 59 H LYS 59 -6.278 -1.201 5.937 449 HA LYS 59 HA LYS 59 -5.754 -0.735 8.783 450 1HB LYS 59 1HB LYS 59 -7.840 0.452 8.037 451 2HB LYS 59 2HB LYS 59 -8.517 -1.112 7.614 452 1HG LYS 59 1HG LYS 59 -8.632 -1.793 9.854 453 2HG LYS 59 2HG LYS 59 -7.552 -0.502 10.388 454 1HD LYS 59 1HD LYS 59 -9.857 0.002 10.984 455 2HD LYS 59 2HD LYS 59 -9.251 1.161 9.801 456 1HE LYS 59 1HE LYS 59 -10.359 -0.207 8.025 457 2HE LYS 59 2HE LYS 59 -11.092 -1.175 9.305 458 1HZ LYS 59 1HZ LYS 59 -12.014 0.972 10.180 459 2HZ LYS 59 2HZ LYS 59 -12.664 0.453 8.703 460 3HZ LYS 59 3HZ LYS 59 -11.518 1.704 8.732 461 H GLY 60 H GLY 60 -6.613 -2.571 10.127 462 1HA GLY 60 1HA GLY 60 -7.399 -4.943 9.943 463 2HA GLY 60 2HA GLY 60 -6.216 -5.093 8.649 464 H SER 61 H SER 61 -6.727 -4.988 12.062 465 HA SER 61 HA SER 61 -3.835 -5.246 12.514 466 1HB SER 61 1HB SER 61 -5.430 -3.453 13.671 467 2HB SER 61 2HB SER 61 -5.757 -4.798 14.759 468 HG SER 61 HG SER 61 -3.164 -3.804 14.124 469 H THR 62 H THR 62 -5.982 -7.198 11.700 470 HA THR 62 HA THR 62 -5.257 -9.298 13.619 471 HB THR 62 HB THR 62 -7.563 -8.542 14.128 472 HG1 THR 62 HG1 THR 62 -7.099 -11.148 13.122 473 1HG2 THR 62 1HG2 THR 62 -9.375 -8.957 12.539 474 2HG2 THR 62 2HG2 THR 62 -8.202 -9.469 11.325 475 3HG2 THR 62 3HG2 THR 62 -8.214 -7.798 11.892 476 H VAL 63 H VAL 63 -4.504 -8.369 10.829 477 HA VAL 63 HA VAL 63 -5.480 -10.266 8.952 478 HB VAL 63 HB VAL 63 -2.924 -8.662 8.776 479 1HG1 VAL 63 1HG1 VAL 63 -3.118 -10.453 7.123 480 2HG1 VAL 63 2HG1 VAL 63 -3.234 -8.864 6.365 481 3HG1 VAL 63 3HG1 VAL 63 -4.690 -9.825 6.625 482 1HG2 VAL 63 1HG2 VAL 63 -4.791 -7.181 9.259 483 2HG2 VAL 63 2HG2 VAL 63 -5.715 -7.892 7.936 484 3HG2 VAL 63 3HG2 VAL 63 -4.249 -6.973 7.595 485 H GLY 64 H GLY 64 -2.423 -9.974 10.732 486 1HA GLY 64 1HA GLY 64 -1.302 -11.961 11.552 487 2HA GLY 64 2HA GLY 64 -1.896 -12.815 10.131 488 H SER 65 H SER 65 -1.308 -10.454 8.450 489 HA SER 65 HA SER 65 0.313 -9.346 7.337 490 1HB SER 65 1HB SER 65 2.202 -10.297 9.495 491 2HB SER 65 2HB SER 65 2.516 -9.024 8.316 492 HG SER 65 HG SER 65 1.384 -7.677 9.473 493 H TYR 66 H TYR 66 1.008 -12.649 8.299 494 HA TYR 66 HA TYR 66 3.106 -13.189 6.534 495 1HB TYR 66 1HB TYR 66 2.602 -15.546 6.886 496 2HB TYR 66 2HB TYR 66 2.486 -14.667 8.404 497 HD1 TYR 66 HD1 TYR 66 0.678 -16.613 5.912 498 HD2 TYR 66 HD2 TYR 66 0.266 -14.254 9.432 499 HE1 TYR 66 HE1 TYR 66 -1.584 -17.517 6.252 500 HE2 TYR 66 HE2 TYR 66 -1.995 -15.155 9.777 501 HH TYR 66 HH TYR 66 -3.785 -16.188 8.508 502 H VAL 67 H VAL 67 -0.254 -12.817 5.915 503 HA VAL 67 HA VAL 67 -0.562 -14.447 3.663 504 HB VAL 67 HB VAL 67 -2.463 -13.474 4.856 505 1HG1 VAL 67 1HG1 VAL 67 -1.597 -10.856 3.641 506 2HG1 VAL 67 2HG1 VAL 67 -1.571 -11.278 5.354 507 3HG1 VAL 67 3HG1 VAL 67 -3.110 -11.135 4.504 508 1HG2 VAL 67 1HG2 VAL 67 -3.834 -12.881 2.922 509 2HG2 VAL 67 2HG2 VAL 67 -2.789 -14.258 2.571 510 3HG2 VAL 67 3HG2 VAL 67 -2.378 -12.659 1.952 511 H LEU 68 H LEU 68 0.792 -11.221 3.995 512 HA LEU 68 HA LEU 68 0.722 -10.551 1.232 513 1HB LEU 68 1HB LEU 68 2.498 -9.503 3.440 514 2HB LEU 68 2HB LEU 68 2.337 -8.781 1.852 515 HG LEU 68 HG LEU 68 0.147 -9.009 3.916 516 1HD1 LEU 68 1HD1 LEU 68 1.700 -6.630 2.915 517 2HD1 LEU 68 2HD1 LEU 68 1.820 -7.359 4.516 518 3HD1 LEU 68 3HD1 LEU 68 0.324 -6.570 4.016 519 1HD2 LEU 68 1HD2 LEU 68 -1.141 -7.589 2.372 520 2HD2 LEU 68 2HD2 LEU 68 -0.777 -9.173 1.686 521 3HD2 LEU 68 3HD2 LEU 68 0.142 -7.758 1.173 522 H LEU 69 H LEU 69 3.155 -11.997 3.342 523 HA LEU 69 HA LEU 69 5.214 -12.195 1.410 524 1HB LEU 69 1HB LEU 69 5.617 -12.392 3.823 525 2HB LEU 69 2HB LEU 69 4.678 -13.871 3.871 526 HG LEU 69 HG LEU 69 6.349 -14.956 2.405 527 1HD1 LEU 69 1HD1 LEU 69 7.182 -12.956 1.275 528 2HD1 LEU 69 2HD1 LEU 69 8.495 -13.875 2.014 529 3HD1 LEU 69 3HD1 LEU 69 7.906 -12.403 2.785 530 1HD2 LEU 69 1HD2 LEU 69 7.463 -13.726 4.923 531 2HD2 LEU 69 2HD2 LEU 69 8.098 -15.152 4.104 532 3HD2 LEU 69 3HD2 LEU 69 6.490 -15.192 4.826 533 H ASN 70 H ASN 70 2.587 -14.330 2.405 534 HA ASN 70 HA ASN 70 3.234 -16.584 0.867 535 1HB ASN 70 1HB ASN 70 1.478 -16.483 2.651 536 2HB ASN 70 2HB ASN 70 0.452 -15.598 1.528 537 1HD2 ASN 70 1HD2 ASN 70 -0.417 -16.681 -0.259 538 2HD2 ASN 70 2HD2 ASN 70 -0.446 -18.406 -0.357 539 H LEU 71 H LEU 71 1.299 -13.721 0.082 540 HA LEU 71 HA LEU 71 0.593 -14.516 -2.538 541 1HB LEU 71 1HB LEU 71 0.870 -11.753 -1.354 542 2HB LEU 71 2HB LEU 71 0.135 -12.102 -2.906 543 HG LEU 71 HG LEU 71 -0.888 -13.049 -0.229 544 1HD1 LEU 71 1HD1 LEU 71 -1.905 -10.919 -2.106 545 2HD1 LEU 71 2HD1 LEU 71 -1.196 -10.664 -0.512 546 3HD1 LEU 71 3HD1 LEU 71 -2.743 -11.495 -0.665 547 1HD2 LEU 71 1HD2 LEU 71 -2.846 -13.803 -1.481 548 2HD2 LEU 71 2HD2 LEU 71 -1.385 -14.634 -2.013 549 3HD2 LEU 71 3HD2 LEU 71 -2.067 -13.335 -2.992 550 H ARG 72 H ARG 72 3.332 -12.714 -1.231 551 HA ARG 72 HA ARG 72 4.500 -11.993 -3.685 552 1HB ARG 72 1HB ARG 72 5.441 -12.192 -0.881 553 2HB ARG 72 2HB ARG 72 6.670 -12.140 -2.129 554 1HG ARG 72 1HG ARG 72 4.467 -10.125 -1.823 555 2HG ARG 72 2HG ARG 72 6.088 -9.944 -1.155 556 1HD ARG 72 1HD ARG 72 5.521 -10.376 -4.079 557 2HD ARG 72 2HD ARG 72 5.696 -8.793 -3.332 558 HE ARG 72 HE ARG 72 7.862 -10.794 -3.276 559 1HH1 ARG 72 1HH1 ARG 72 6.705 -7.544 -3.868 560 2HH1 ARG 72 2HH1 ARG 72 8.290 -6.888 -4.151 561 1HH2 ARG 72 1HH2 ARG 72 9.950 -9.950 -3.648 562 2HH2 ARG 72 2HH2 ARG 72 10.140 -8.260 -4.012 563 H LYS 73 H LYS 73 4.956 -14.846 -1.633 564 HA LYS 73 HA LYS 73 6.959 -16.066 -3.175 565 1HB LYS 73 1HB LYS 73 5.778 -16.585 -0.801 566 2HB LYS 73 2HB LYS 73 4.994 -17.802 -1.797 567 1HG LYS 73 1HG LYS 73 7.973 -17.460 -1.594 568 2HG LYS 73 2HG LYS 73 7.029 -18.573 -0.605 569 1HD LYS 73 1HD LYS 73 6.321 -19.788 -2.562 570 2HD LYS 73 2HD LYS 73 7.101 -18.609 -3.621 571 1HE LYS 73 1HE LYS 73 9.280 -19.233 -2.727 572 2HE LYS 73 2HE LYS 73 8.513 -20.376 -1.626 573 1HZ LYS 73 1HZ LYS 73 7.778 -21.682 -3.469 574 2HZ LYS 73 2HZ LYS 73 9.443 -21.416 -3.650 575 3HZ LYS 73 3HZ LYS 73 8.337 -20.537 -4.588 576 H ASN 74 H ASN 74 3.500 -15.907 -3.543 577 HA ASN 74 HA ASN 74 3.466 -17.962 -5.591 578 1HB ASN 74 1HB ASN 74 1.584 -17.693 -3.967 579 2HB ASN 74 2HB ASN 74 1.217 -16.138 -4.703 580 1HD2 ASN 74 1HD2 ASN 74 -0.873 -16.971 -5.180 581 2HD2 ASN 74 2HD2 ASN 74 -1.116 -18.027 -6.525 582 H GLY 75 H GLY 75 4.081 -14.646 -5.402 583 1HA GLY 75 1HA GLY 75 4.808 -13.252 -7.106 584 2HA GLY 75 2HA GLY 75 4.424 -14.524 -8.259 585 H VAL 76 H VAL 76 1.977 -13.585 -6.038 586 HA VAL 76 HA VAL 76 0.591 -12.181 -8.227 587 HB VAL 76 HB VAL 76 -1.524 -12.983 -7.266 588 1HG1 VAL 76 1HG1 VAL 76 -0.484 -14.257 -9.048 589 2HG1 VAL 76 2HG1 VAL 76 -1.293 -15.339 -7.915 590 3HG1 VAL 76 3HG1 VAL 76 0.462 -15.169 -7.873 591 1HG2 VAL 76 1HG2 VAL 76 -1.530 -14.707 -5.537 592 2HG2 VAL 76 2HG2 VAL 76 -0.802 -13.215 -4.940 593 3HG2 VAL 76 3HG2 VAL 76 0.223 -14.576 -5.393 594 H ALA 77 H ALA 77 2.283 -11.341 -5.790 595 HA ALA 77 HA ALA 77 0.347 -9.629 -4.413 596 1HB ALA 77 1HB ALA 77 1.919 -10.938 -3.043 597 2HB ALA 77 2HB ALA 77 2.114 -9.199 -2.811 598 3HB ALA 77 3HB ALA 77 3.266 -10.090 -3.805 599 HA PRO 78 HA PRO 78 1.608 -5.917 -6.502 600 1HB PRO 78 1HB PRO 78 1.726 -4.550 -3.892 601 2HB PRO 78 2HB PRO 78 0.687 -4.226 -5.281 602 1HG PRO 78 1HG PRO 78 -0.276 -5.318 -3.031 603 2HG PRO 78 2HG PRO 78 -0.894 -5.771 -4.631 604 1HD PRO 78 1HD PRO 78 1.020 -7.233 -2.850 605 2HD PRO 78 2HD PRO 78 -0.306 -7.874 -3.845 606 H LYS 79 H LYS 79 3.349 -4.340 -6.625 607 HA LYS 79 HA LYS 79 5.865 -5.321 -5.608 608 1HB LYS 79 1HB LYS 79 5.040 -3.047 -7.383 609 2HB LYS 79 2HB LYS 79 6.658 -3.099 -6.710 610 1HG LYS 79 1HG LYS 79 6.958 -5.339 -7.748 611 2HG LYS 79 2HG LYS 79 5.386 -5.126 -8.526 612 1HD LYS 79 1HD LYS 79 6.167 -3.226 -9.744 613 2HD LYS 79 2HD LYS 79 7.672 -3.185 -8.828 614 1HE LYS 79 1HE LYS 79 6.802 -5.365 -10.719 615 2HE LYS 79 2HE LYS 79 8.013 -4.128 -11.053 616 1HZ LYS 79 1HZ LYS 79 9.267 -5.946 -10.428 617 2HZ LYS 79 2HZ LYS 79 8.180 -6.440 -9.229 618 3HZ LYS 79 3HZ LYS 79 9.162 -5.083 -8.968 619 H ALA 80 H ALA 80 3.699 -2.612 -5.034 620 HA ALA 80 HA ALA 80 4.780 -2.170 -2.411 621 1HB ALA 80 1HB ALA 80 5.486 0.123 -2.745 622 2HB ALA 80 2HB ALA 80 5.076 0.028 -4.458 623 3HB ALA 80 3HB ALA 80 6.398 -0.943 -3.815 624 H ILE 81 H ILE 81 3.498 -0.632 -1.196 625 HA ILE 81 HA ILE 81 1.047 0.239 -2.542 626 HB ILE 81 HB ILE 81 -0.353 -0.241 -0.658 627 1HG1 ILE 81 1HG1 ILE 81 1.405 0.074 1.124 628 2HG1 ILE 81 2HG1 ILE 81 0.321 -1.284 1.381 629 1HG2 ILE 81 1HG2 ILE 81 -0.325 -2.690 -0.644 630 2HG2 ILE 81 2HG2 ILE 81 1.277 -2.666 -1.381 631 3HG2 ILE 81 3HG2 ILE 81 -0.109 -2.025 -2.263 632 1HD1 ILE 81 1HD1 ILE 81 3.148 -1.421 0.373 633 2HD1 ILE 81 2HD1 ILE 81 2.066 -2.803 0.539 634 3HD1 ILE 81 3HD1 ILE 81 2.570 -1.895 1.968 635 H ILE 82 H ILE 82 0.653 2.323 -2.310 636 HA ILE 82 HA ILE 82 2.203 3.792 -0.278 637 HB ILE 82 HB ILE 82 0.828 5.119 -2.604 638 1HG1 ILE 82 1HG1 ILE 82 2.197 3.355 -3.614 639 2HG1 ILE 82 2HG1 ILE 82 2.911 4.935 -3.917 640 1HG2 ILE 82 1HG2 ILE 82 3.324 5.808 -1.040 641 2HG2 ILE 82 2HG2 ILE 82 1.723 6.510 -0.791 642 3HG2 ILE 82 3HG2 ILE 82 2.583 6.790 -2.304 643 1HD1 ILE 82 1HD1 ILE 82 4.535 4.551 -2.145 644 2HD1 ILE 82 2HD1 ILE 82 4.603 3.282 -3.369 645 3HD1 ILE 82 3HD1 ILE 82 3.815 2.974 -1.821 646 H ASN 83 H ASN 83 1.073 4.414 1.430 647 HA ASN 83 HA ASN 83 -1.843 4.758 1.133 648 1HB ASN 83 1HB ASN 83 -0.319 3.907 3.610 649 2HB ASN 83 2HB ASN 83 -2.060 4.119 3.502 650 1HD2 ASN 83 1HD2 ASN 83 -2.066 2.922 0.778 651 2HD2 ASN 83 2HD2 ASN 83 -1.918 1.220 1.042 652 H LYS 84 H LYS 84 -2.818 6.444 2.454 653 HA LYS 84 HA LYS 84 -1.032 8.652 3.010 654 1HB LYS 84 1HB LYS 84 -3.442 8.899 2.156 655 2HB LYS 84 2HB LYS 84 -3.946 8.512 3.797 656 1HG LYS 84 1HG LYS 84 -2.697 10.433 4.641 657 2HG LYS 84 2HG LYS 84 -2.179 10.820 3.002 658 1HD LYS 84 1HD LYS 84 -4.679 10.946 2.450 659 2HD LYS 84 2HD LYS 84 -4.924 10.989 4.197 660 1HE LYS 84 1HE LYS 84 -3.302 12.929 2.555 661 2HE LYS 84 2HE LYS 84 -4.855 13.244 3.323 662 1HZ LYS 84 1HZ LYS 84 -2.454 12.467 4.884 663 2HZ LYS 84 2HZ LYS 84 -3.886 13.183 5.448 664 3HZ LYS 84 3HZ LYS 84 -2.804 14.078 4.503 665 H LYS 85 H LYS 85 -2.816 6.194 4.731 666 HA LYS 85 HA LYS 85 -0.940 6.413 6.908 667 1HB LYS 85 1HB LYS 85 -3.035 7.919 7.359 668 2HB LYS 85 2HB LYS 85 -3.842 6.389 7.679 669 1HG LYS 85 1HG LYS 85 -2.927 7.552 9.698 670 2HG LYS 85 2HG LYS 85 -2.372 5.890 9.478 671 1HD LYS 85 1HD LYS 85 -0.276 6.641 8.590 672 2HD LYS 85 2HD LYS 85 -0.831 8.315 8.565 673 1HE LYS 85 1HE LYS 85 -0.839 8.421 10.944 674 2HE LYS 85 2HE LYS 85 -0.582 6.682 11.080 675 1HZ LYS 85 1HZ LYS 85 1.416 8.196 11.408 676 2HZ LYS 85 2HZ LYS 85 1.386 8.421 9.720 677 3HZ LYS 85 3HZ LYS 85 1.603 6.871 10.366 678 H THR 86 H THR 86 -0.834 4.470 8.144 679 HA THR 86 HA THR 86 -2.409 2.227 7.127 680 HB THR 86 HB THR 86 -0.309 2.435 5.763 681 HG1 THR 86 HG1 THR 86 -0.591 0.366 5.582 682 1HG2 THR 86 1HG2 THR 86 1.818 1.787 6.773 683 2HG2 THR 86 2HG2 THR 86 1.051 1.693 8.357 684 3HG2 THR 86 3HG2 THR 86 1.183 3.246 7.534 685 H GLU 87 H GLU 87 -1.428 0.134 8.381 686 HA GLU 87 HA GLU 87 -1.503 0.879 11.237 687 1HB GLU 87 1HB GLU 87 -3.385 -0.551 9.942 688 2HB GLU 87 2HB GLU 87 -2.290 -1.857 10.361 689 1HG GLU 87 1HG GLU 87 -3.464 0.071 12.355 690 2HG GLU 87 2HG GLU 87 -4.155 -1.500 11.969 691 H THR 88 H THR 88 -0.382 -0.625 12.686 692 HA THR 88 HA THR 88 2.291 -1.039 11.994 693 HB THR 88 HB THR 88 0.822 -2.500 14.193 694 HG1 THR 88 HG1 THR 88 0.274 -0.418 14.592 695 1HG2 THR 88 1HG2 THR 88 2.975 -2.308 15.361 696 2HG2 THR 88 2HG2 THR 88 3.662 -1.488 13.958 697 3HG2 THR 88 3HG2 THR 88 3.149 -3.172 13.833 698 H ILE 89 H ILE 89 -0.413 -3.352 12.215 699 HA ILE 89 HA ILE 89 0.964 -5.710 11.672 700 HB ILE 89 HB ILE 89 -1.859 -4.850 11.091 701 1HG1 ILE 89 1HG1 ILE 89 -1.107 -5.256 13.440 702 2HG1 ILE 89 2HG1 ILE 89 -2.424 -6.305 12.923 703 1HG2 ILE 89 1HG2 ILE 89 -1.292 -6.458 9.362 704 2HG2 ILE 89 2HG2 ILE 89 -2.412 -7.168 10.525 705 3HG2 ILE 89 3HG2 ILE 89 -0.698 -7.585 10.582 706 1HD1 ILE 89 1HD1 ILE 89 -0.806 -7.556 14.197 707 2HD1 ILE 89 2HD1 ILE 89 0.485 -7.050 13.105 708 3HD1 ILE 89 3HD1 ILE 89 -0.805 -8.104 12.519 709 H ILE 90 H ILE 90 -0.361 -3.316 9.452 710 HA ILE 90 HA ILE 90 0.051 -4.759 7.069 711 HB ILE 90 HB ILE 90 0.076 -1.752 7.350 712 1HG1 ILE 90 1HG1 ILE 90 -1.890 -2.560 8.506 713 2HG1 ILE 90 2HG1 ILE 90 -2.386 -1.880 6.960 714 1HG2 ILE 90 1HG2 ILE 90 0.739 -2.508 5.161 715 2HG2 ILE 90 2HG2 ILE 90 -0.886 -1.825 5.074 716 3HG2 ILE 90 3HG2 ILE 90 -0.664 -3.574 5.068 717 1HD1 ILE 90 1HD1 ILE 90 -2.052 -4.810 7.561 718 2HD1 ILE 90 2HD1 ILE 90 -2.600 -4.117 6.035 719 3HD1 ILE 90 3HD1 ILE 90 -3.581 -3.937 7.489 720 H ALA 91 H ALA 91 2.012 -2.348 8.763 721 HA ALA 91 HA ALA 91 4.118 -2.191 6.917 722 1HB ALA 91 1HB ALA 91 3.767 -0.552 8.693 723 2HB ALA 91 2HB ALA 91 5.404 -1.205 8.740 724 3HB ALA 91 3HB ALA 91 4.201 -1.762 9.903 725 H VAL 92 H VAL 92 3.628 -4.303 9.719 726 HA VAL 92 HA VAL 92 6.145 -5.539 9.710 727 HB VAL 92 HB VAL 92 3.480 -6.663 10.601 728 1HG1 VAL 92 1HG1 VAL 92 6.273 -7.649 11.184 729 2HG1 VAL 92 2HG1 VAL 92 5.055 -8.475 10.212 730 3HG1 VAL 92 3HG1 VAL 92 4.797 -8.248 11.941 731 1HG2 VAL 92 1HG2 VAL 92 4.274 -6.049 12.850 732 2HG2 VAL 92 2HG2 VAL 92 4.100 -4.648 11.794 733 3HG2 VAL 92 3HG2 VAL 92 5.702 -5.308 12.127 734 H GLY 93 H GLY 93 3.138 -6.416 8.048 735 1HA GLY 93 1HA GLY 93 4.156 -8.805 6.888 736 2HA GLY 93 2HA GLY 93 2.720 -7.932 6.371 737 H ALA 94 H ALA 94 3.896 -5.474 5.750 738 HA ALA 94 HA ALA 94 4.754 -5.946 3.105 739 1HB ALA 94 1HB ALA 94 4.989 -3.417 4.735 740 2HB ALA 94 2HB ALA 94 3.573 -3.910 3.807 741 3HB ALA 94 3HB ALA 94 5.086 -3.537 2.979 742 H ALA 95 H ALA 95 6.499 -5.384 6.099 743 HA ALA 95 HA ALA 95 9.018 -4.804 4.976 744 1HB ALA 95 1HB ALA 95 9.926 -5.354 7.176 745 2HB ALA 95 2HB ALA 95 8.386 -6.085 7.630 746 3HB ALA 95 3HB ALA 95 8.478 -4.354 7.312 747 H MET 96 H MET 96 7.530 -7.873 5.948 748 HA MET 96 HA MET 96 9.882 -9.406 5.363 749 1HB MET 96 1HB MET 96 7.026 -10.237 5.903 750 2HB MET 96 2HB MET 96 8.350 -11.371 5.679 751 1HG MET 96 1HG MET 96 9.489 -10.416 7.623 752 2HG MET 96 2HG MET 96 8.144 -9.298 7.849 753 1HE MET 96 1HE MET 96 5.651 -11.105 7.119 754 2HE MET 96 2HE MET 96 5.681 -10.058 8.537 755 3HE MET 96 3HE MET 96 5.201 -11.747 8.698 756 H ALA 97 H ALA 97 6.857 -8.722 3.679 757 HA ALA 97 HA ALA 97 7.438 -10.511 1.511 758 1HB ALA 97 1HB ALA 97 5.411 -9.599 0.505 759 2HB ALA 97 2HB ALA 97 5.354 -8.348 1.747 760 3HB ALA 97 3HB ALA 97 5.144 -10.042 2.191 761 H GLU 98 H GLU 98 8.834 -7.689 2.318 762 HA GLU 98 HA GLU 98 9.984 -6.043 1.278 763 1HB GLU 98 1HB GLU 98 10.037 -8.138 -0.876 764 2HB GLU 98 2HB GLU 98 10.856 -6.593 -1.047 765 1HG GLU 98 1HG GLU 98 11.867 -7.309 1.300 766 2HG GLU 98 2HG GLU 98 11.515 -8.917 0.658 767 H ILE 99 H ILE 99 7.481 -5.406 1.384 768 HA ILE 99 HA ILE 99 6.779 -4.338 -1.273 769 HB ILE 99 HB ILE 99 4.892 -4.575 1.076 770 1HG1 ILE 99 1HG1 ILE 99 5.664 -6.831 0.407 771 2HG1 ILE 99 2HG1 ILE 99 3.961 -6.579 0.038 772 1HG2 ILE 99 1HG2 ILE 99 3.165 -4.301 -0.633 773 2HG2 ILE 99 2HG2 ILE 99 4.411 -4.188 -1.876 774 3HG2 ILE 99 3HG2 ILE 99 4.288 -2.941 -0.635 775 1HD1 ILE 99 1HD1 ILE 99 6.245 -6.445 -1.914 776 2HD1 ILE 99 2HD1 ILE 99 4.548 -6.158 -2.301 777 3HD1 ILE 99 3HD1 ILE 99 5.071 -7.753 -1.760 778 HA PRO 100 HA PRO 100 8.608 -0.733 0.975 779 1HB PRO 100 1HB PRO 100 8.221 0.736 -1.432 780 2HB PRO 100 2HB PRO 100 9.735 0.099 -0.789 781 1HG PRO 100 1HG PRO 100 7.969 -1.004 -2.885 782 2HG PRO 100 2HG PRO 100 9.707 -1.228 -2.640 783 1HD PRO 100 1HD PRO 100 7.913 -3.176 -2.125 784 2HD PRO 100 2HD PRO 100 9.402 -2.982 -1.175 785 H LEU 101 H LEU 101 7.292 0.318 2.287 786 HA LEU 101 HA LEU 101 4.728 1.308 1.233 787 1HB LEU 101 1HB LEU 101 4.681 -0.633 2.905 788 2HB LEU 101 2HB LEU 101 5.245 0.515 4.098 789 HG LEU 101 HG LEU 101 2.668 0.871 2.562 790 1HD1 LEU 101 1HD1 LEU 101 1.532 0.039 4.552 791 2HD1 LEU 101 2HD1 LEU 101 3.088 -0.334 5.294 792 3HD1 LEU 101 3HD1 LEU 101 2.571 -1.198 3.846 793 1HD2 LEU 101 1HD2 LEU 101 3.556 2.920 3.542 794 2HD2 LEU 101 2HD2 LEU 101 3.691 2.126 5.111 795 3HD2 LEU 101 3HD2 LEU 101 2.102 2.396 4.393 796 H VAL 102 H VAL 102 4.644 3.431 1.175 797 HA VAL 102 HA VAL 102 5.979 4.953 3.305 798 HB VAL 102 HB VAL 102 6.318 6.818 1.737 799 1HG1 VAL 102 1HG1 VAL 102 8.142 5.241 2.060 800 2HG1 VAL 102 2HG1 VAL 102 8.129 5.844 0.404 801 3HG1 VAL 102 3HG1 VAL 102 7.517 4.229 0.759 802 1HG2 VAL 102 1HG2 VAL 102 4.511 6.376 0.180 803 2HG2 VAL 102 2HG2 VAL 102 5.319 4.906 -0.366 804 3HG2 VAL 102 3HG2 VAL 102 6.049 6.481 -0.676 805 H GLU 103 H GLU 103 4.773 6.614 4.230 806 HA GLU 103 HA GLU 103 1.947 6.615 3.451 807 1HB GLU 103 1HB GLU 103 1.450 7.554 5.641 808 2HB GLU 103 2HB GLU 103 2.379 6.073 5.802 809 1HG GLU 103 1HG GLU 103 4.386 7.349 6.259 810 2HG GLU 103 2HG GLU 103 3.504 8.854 6.015 811 H VAL 104 H VAL 104 1.002 8.290 2.593 812 HA VAL 104 HA VAL 104 2.645 10.583 1.867 813 HB VAL 104 HB VAL 104 -0.201 10.058 1.013 814 1HG1 VAL 104 1HG1 VAL 104 0.615 12.283 0.553 815 2HG1 VAL 104 2HG1 VAL 104 0.457 11.379 -0.953 816 3HG1 VAL 104 3HG1 VAL 104 2.049 11.628 -0.236 817 1HG2 VAL 104 1HG2 VAL 104 1.106 8.067 0.509 818 2HG2 VAL 104 2HG2 VAL 104 2.312 9.054 -0.316 819 3HG2 VAL 104 3HG2 VAL 104 0.676 8.931 -0.967 820 H ARG 105 H ARG 105 2.308 12.642 2.562 821 HA ARG 105 HA ARG 105 0.388 13.056 4.708 822 1HB ARG 105 1HB ARG 105 2.438 14.940 3.526 823 2HB ARG 105 2HB ARG 105 1.458 15.264 4.946 824 1HG ARG 105 1HG ARG 105 2.547 13.392 6.103 825 2HG ARG 105 2HG ARG 105 3.564 13.127 4.680 826 1HD ARG 105 1HD ARG 105 4.414 15.422 4.884 827 2HD ARG 105 2HD ARG 105 3.423 15.654 6.320 828 HE ARG 105 HE ARG 105 5.368 13.478 6.383 829 1HH1 ARG 105 1HH1 ARG 105 4.428 16.701 7.376 830 2HH1 ARG 105 2HH1 ARG 105 5.697 16.847 8.560 831 1HH2 ARG 105 1HH2 ARG 105 7.035 13.657 7.927 832 2HH2 ARG 105 2HH2 ARG 105 7.179 15.108 8.883 833 H ASP 106 H ASP 106 0.844 13.881 1.359 834 HA ASP 106 HA ASP 106 -1.064 16.089 1.539 835 1HB ASP 106 1HB ASP 106 1.285 16.172 0.388 836 2HB ASP 106 2HB ASP 106 0.443 15.400 -0.955 837 H GLU 107 H GLU 107 -2.931 16.181 0.500 838 HA GLU 107 HA GLU 107 -4.212 13.809 -0.318 839 1HB GLU 107 1HB GLU 107 -4.985 16.717 -0.515 840 2HB GLU 107 2HB GLU 107 -6.054 15.366 -0.757 841 1HG GLU 107 1HG GLU 107 -5.851 14.686 1.525 842 2HG GLU 107 2HG GLU 107 -4.592 15.890 1.799 843 H LYS 108 H LYS 108 -2.468 16.332 -1.989 844 HA LYS 108 HA LYS 108 -3.737 16.101 -4.497 845 1HB LYS 108 1HB LYS 108 -1.195 17.310 -3.537 846 2HB LYS 108 2HB LYS 108 -1.414 17.075 -5.262 847 1HG LYS 108 1HG LYS 108 -3.567 18.323 -5.088 848 2HG LYS 108 2HG LYS 108 -3.146 18.684 -3.412 849 1HD LYS 108 1HD LYS 108 -1.170 19.867 -4.111 850 2HD LYS 108 2HD LYS 108 -1.434 19.391 -5.790 851 1HE LYS 108 1HE LYS 108 -3.316 21.088 -4.162 852 2HE LYS 108 2HE LYS 108 -2.129 21.716 -5.301 853 1HZ LYS 108 1HZ LYS 108 -4.377 19.894 -5.995 854 2HZ LYS 108 2HZ LYS 108 -3.241 20.529 -7.080 855 3HZ LYS 108 3HZ LYS 108 -4.327 21.565 -6.293 856 H PHE 109 H PHE 109 -1.449 14.067 -2.951 857 HA PHE 109 HA PHE 109 -0.285 12.858 -5.202 858 1HB PHE 109 1HB PHE 109 0.542 12.372 -2.967 859 2HB PHE 109 2HB PHE 109 -1.004 11.655 -2.516 860 HD1 PHE 109 HD1 PHE 109 1.731 11.276 -5.019 861 HD2 PHE 109 HD2 PHE 109 -1.260 9.372 -2.663 862 HE1 PHE 109 HE1 PHE 109 2.525 9.082 -5.791 863 HE2 PHE 109 HE2 PHE 109 -0.466 7.171 -3.430 864 HZ PHE 109 HZ PHE 109 1.428 7.025 -4.999 865 H PHE 110 H PHE 110 -3.277 12.170 -3.451 866 HA PHE 110 HA PHE 110 -4.086 10.014 -5.141 867 1HB PHE 110 1HB PHE 110 -5.714 11.726 -3.243 868 2HB PHE 110 2HB PHE 110 -6.248 10.212 -3.963 869 HD1 PHE 110 HD1 PHE 110 -4.153 11.761 -1.427 870 HD2 PHE 110 HD2 PHE 110 -5.309 8.089 -3.240 871 HE1 PHE 110 HE1 PHE 110 -3.177 10.527 0.464 872 HE2 PHE 110 HE2 PHE 110 -4.337 6.846 -1.352 873 HZ PHE 110 HZ PHE 110 -3.267 8.067 0.500 874 H GLU 111 H GLU 111 -4.494 13.454 -5.115 875 HA GLU 111 HA GLU 111 -6.540 13.712 -7.013 876 1HB GLU 111 1HB GLU 111 -5.758 15.478 -5.469 877 2HB GLU 111 2HB GLU 111 -4.236 15.553 -6.340 878 1HG GLU 111 1HG GLU 111 -5.504 16.208 -8.360 879 2HG GLU 111 2HG GLU 111 -6.952 16.286 -7.361 880 H ALA 112 H ALA 112 -3.010 13.658 -7.266 881 HA ALA 112 HA ALA 112 -3.001 14.123 -10.088 882 1HB ALA 112 1HB ALA 112 -0.596 13.850 -9.922 883 2HB ALA 112 2HB ALA 112 -0.766 13.225 -8.281 884 3HB ALA 112 3HB ALA 112 -1.194 14.899 -8.636 885 H VAL 113 H VAL 113 -2.407 11.265 -8.041 886 HA VAL 113 HA VAL 113 -1.526 9.645 -10.184 887 HB VAL 113 HB VAL 113 -1.009 9.186 -7.788 888 1HG1 VAL 113 1HG1 VAL 113 -2.624 7.932 -6.434 889 2HG1 VAL 113 2HG1 VAL 113 -3.844 8.165 -7.685 890 3HG1 VAL 113 3HG1 VAL 113 -3.205 9.556 -6.809 891 1HG2 VAL 113 1HG2 VAL 113 -0.644 7.502 -9.520 892 2HG2 VAL 113 2HG2 VAL 113 -2.286 6.901 -9.282 893 3HG2 VAL 113 3HG2 VAL 113 -1.099 6.759 -7.985 894 H LYS 114 H LYS 114 -2.552 8.410 -11.613 895 HA LYS 114 HA LYS 114 -5.457 8.024 -11.306 896 1HB LYS 114 1HB LYS 114 -3.915 8.375 -13.885 897 2HB LYS 114 2HB LYS 114 -5.642 8.085 -13.754 898 1HG LYS 114 1HG LYS 114 -4.177 10.529 -12.779 899 2HG LYS 114 2HG LYS 114 -5.169 10.416 -14.233 900 1HD LYS 114 1HD LYS 114 -7.112 9.837 -12.772 901 2HD LYS 114 2HD LYS 114 -6.085 10.156 -11.371 902 1HE LYS 114 1HE LYS 114 -6.836 12.122 -13.533 903 2HE LYS 114 2HE LYS 114 -7.454 12.097 -11.884 904 1HZ LYS 114 1HZ LYS 114 -4.615 12.557 -12.649 905 2HZ LYS 114 2HZ LYS 114 -5.236 12.570 -11.071 906 3HZ LYS 114 3HZ LYS 114 -5.718 13.757 -12.178 907 H THR 115 H THR 115 -6.250 5.977 -11.821 908 HA THR 115 HA THR 115 -4.476 3.779 -11.694 909 HB THR 115 HB THR 115 -7.331 3.769 -12.699 910 HG1 THR 115 HG1 THR 115 -7.805 4.357 -10.731 911 1HG2 THR 115 1HG2 THR 115 -5.639 1.626 -11.403 912 2HG2 THR 115 2HG2 THR 115 -6.147 1.676 -13.091 913 3HG2 THR 115 3HG2 THR 115 -7.346 1.468 -11.814 914 H GLY 116 H GLY 116 -2.986 3.627 -13.301 915 1HA GLY 116 1HA GLY 116 -3.074 2.442 -15.594 916 2HA GLY 116 2HA GLY 116 -3.919 3.906 -16.079 917 H ASP 117 H ASP 117 -2.051 5.344 -14.054 918 HA ASP 117 HA ASP 117 0.052 5.886 -15.972 919 1HB ASP 117 1HB ASP 117 -0.751 7.110 -13.348 920 2HB ASP 117 2HB ASP 117 0.829 7.462 -14.039 921 H ARG 118 H ARG 118 2.325 6.233 -14.872 922 HA ARG 118 HA ARG 118 2.946 3.685 -13.527 923 1HB ARG 118 1HB ARG 118 3.890 3.974 -15.830 924 2HB ARG 118 2HB ARG 118 4.790 5.364 -15.239 925 1HG ARG 118 1HG ARG 118 5.842 3.809 -13.551 926 2HG ARG 118 2HG ARG 118 5.115 2.482 -14.460 927 1HD ARG 118 1HD ARG 118 7.322 2.714 -15.273 928 2HD ARG 118 2HD ARG 118 6.263 3.410 -16.500 929 HE ARG 118 HE ARG 118 6.897 5.583 -15.121 930 1HH1 ARG 118 1HH1 ARG 118 8.898 2.981 -16.324 931 2HH1 ARG 118 2HH1 ARG 118 10.350 3.939 -16.369 932 1HH2 ARG 118 1HH2 ARG 118 8.807 6.868 -15.220 933 2HH2 ARG 118 2HH2 ARG 118 10.295 6.155 -15.761 934 H VAL 119 H VAL 119 4.029 3.751 -11.610 935 HA VAL 119 HA VAL 119 5.030 6.388 -10.771 936 HB VAL 119 HB VAL 119 2.891 5.815 -9.630 937 1HG1 VAL 119 1HG1 VAL 119 3.109 3.412 -9.486 938 2HG1 VAL 119 2HG1 VAL 119 2.910 4.101 -7.872 939 3HG1 VAL 119 3HG1 VAL 119 4.503 3.578 -8.419 940 1HG2 VAL 119 1HG2 VAL 119 3.646 6.377 -7.382 941 2HG2 VAL 119 2HG2 VAL 119 4.499 7.328 -8.599 942 3HG2 VAL 119 3HG2 VAL 119 5.301 5.959 -7.827 943 H VAL 120 H VAL 120 6.974 6.467 -9.844 944 HA VAL 120 HA VAL 120 8.374 3.923 -9.349 945 HB VAL 120 HB VAL 120 9.618 6.635 -9.864 946 1HG1 VAL 120 1HG1 VAL 120 11.698 5.375 -10.129 947 2HG1 VAL 120 2HG1 VAL 120 10.840 3.878 -9.762 948 3HG1 VAL 120 3HG1 VAL 120 11.000 5.128 -8.527 949 1HG2 VAL 120 1HG2 VAL 120 8.454 5.841 -11.862 950 2HG2 VAL 120 2HG2 VAL 120 9.312 4.305 -11.756 951 3HG2 VAL 120 3HG2 VAL 120 10.203 5.789 -12.085 952 H VAL 121 H VAL 121 8.209 3.486 -7.220 953 HA VAL 121 HA VAL 121 8.384 5.744 -5.355 954 HB VAL 121 HB VAL 121 6.356 4.485 -5.043 955 1HG1 VAL 121 1HG1 VAL 121 7.025 2.361 -6.014 956 2HG1 VAL 121 2HG1 VAL 121 6.364 2.121 -4.396 957 3HG1 VAL 121 3HG1 VAL 121 8.108 2.064 -4.653 958 1HG2 VAL 121 1HG2 VAL 121 8.335 3.887 -2.849 959 2HG2 VAL 121 2HG2 VAL 121 6.578 3.877 -2.686 960 3HG2 VAL 121 3HG2 VAL 121 7.421 5.382 -3.049 961 H ASN 122 H ASN 122 10.107 6.024 -4.180 962 HA ASN 122 HA ASN 122 11.975 3.776 -3.815 963 1HB ASN 122 1HB ASN 122 12.948 5.577 -5.169 964 2HB ASN 122 2HB ASN 122 12.573 6.745 -3.906 965 1HD2 ASN 122 1HD2 ASN 122 14.723 7.332 -3.677 966 2HD2 ASN 122 2HD2 ASN 122 15.890 6.305 -2.919 967 H ALA 123 H ALA 123 11.447 2.963 -1.884 968 HA ALA 123 HA ALA 123 10.575 4.697 0.269 969 1HB ALA 123 1HB ALA 123 10.930 1.700 0.216 970 2HB ALA 123 2HB ALA 123 9.424 2.569 -0.086 971 3HB ALA 123 3HB ALA 123 10.174 2.627 1.510 972 H ASP 124 H ASP 124 13.511 3.832 -0.922 973 HA ASP 124 HA ASP 124 14.992 3.379 1.453 974 1HB ASP 124 1HB ASP 124 15.917 2.866 -0.754 975 2HB ASP 124 2HB ASP 124 15.858 4.571 -1.192 976 H GLU 125 H GLU 125 14.065 6.271 -0.334 977 HA GLU 125 HA GLU 125 15.137 7.944 1.830 978 1HB GLU 125 1HB GLU 125 15.848 8.521 -0.469 979 2HB GLU 125 2HB GLU 125 14.165 8.736 -0.927 980 1HG GLU 125 1HG GLU 125 14.003 10.539 0.783 981 2HG GLU 125 2HG GLU 125 15.742 10.386 1.030 982 H GLY 126 H GLY 126 12.221 6.910 0.245 983 1HA GLY 126 1HA GLY 126 10.040 7.122 1.158 984 2HA GLY 126 2HA GLY 126 10.612 8.474 2.135 985 H TYR 127 H TYR 127 10.421 7.602 -1.301 986 HA TYR 127 HA TYR 127 9.427 10.292 -1.895 987 1HB TYR 127 1HB TYR 127 11.864 10.391 -2.103 988 2HB TYR 127 2HB TYR 127 11.852 8.980 -3.147 989 HD1 TYR 127 HD1 TYR 127 12.226 9.410 -5.363 990 HD2 TYR 127 HD2 TYR 127 10.155 12.325 -3.055 991 HE1 TYR 127 HE1 TYR 127 12.106 10.878 -7.333 992 HE2 TYR 127 HE2 TYR 127 10.027 13.798 -5.021 993 HH TYR 127 HH TYR 127 10.921 12.713 -8.201 994 H VAL 128 H VAL 128 7.767 10.165 -3.256 995 HA VAL 128 HA VAL 128 7.509 7.721 -4.871 996 HB VAL 128 HB VAL 128 5.873 7.764 -3.056 997 1HG1 VAL 128 1HG1 VAL 128 4.844 10.310 -4.288 998 2HG1 VAL 128 2HG1 VAL 128 5.664 10.162 -2.733 999 3HG1 VAL 128 3HG1 VAL 128 4.084 9.417 -2.971 1000 1HG2 VAL 128 1HG2 VAL 128 5.263 6.688 -5.139 1001 2HG2 VAL 128 2HG2 VAL 128 4.597 8.209 -5.739 1002 3HG2 VAL 128 3HG2 VAL 128 3.858 7.408 -4.349 1003 H GLU 129 H GLU 129 7.975 8.199 -6.891 1004 HA GLU 129 HA GLU 129 7.241 10.859 -7.886 1005 1HB GLU 129 1HB GLU 129 9.639 10.308 -7.940 1006 2HB GLU 129 2HB GLU 129 9.292 8.908 -8.948 1007 1HG GLU 129 1HG GLU 129 8.628 10.271 -10.763 1008 2HG GLU 129 2HG GLU 129 8.613 11.718 -9.756 1009 H LEU 130 H LEU 130 5.340 10.793 -8.854 1010 HA LEU 130 HA LEU 130 4.496 8.498 -10.390 1011 1HB LEU 130 1HB LEU 130 2.855 9.726 -9.055 1012 2HB LEU 130 2HB LEU 130 3.196 11.190 -9.961 1013 HG LEU 130 HG LEU 130 2.386 9.982 -12.025 1014 1HD1 LEU 130 1HD1 LEU 130 1.424 7.999 -9.972 1015 2HD1 LEU 130 2HD1 LEU 130 2.605 7.702 -11.247 1016 3HD1 LEU 130 3HD1 LEU 130 0.925 8.041 -11.664 1017 1HD2 LEU 130 1HD2 LEU 130 1.025 11.625 -10.837 1018 2HD2 LEU 130 2HD2 LEU 130 0.413 10.355 -9.778 1019 3HD2 LEU 130 3HD2 LEU 130 0.034 10.324 -11.501 1020 H ILE 131 H ILE 131 4.886 8.238 -12.484 1021 HA ILE 131 HA ILE 131 5.879 10.522 -14.026 1022 HB ILE 131 HB ILE 131 5.775 7.656 -14.915 1023 1HG1 ILE 131 1HG1 ILE 131 7.111 7.795 -12.845 1024 2HG1 ILE 131 2HG1 ILE 131 8.125 7.438 -14.240 1025 1HG2 ILE 131 1HG2 ILE 131 6.036 9.264 -16.695 1026 2HG2 ILE 131 2HG2 ILE 131 7.529 8.351 -16.479 1027 3HG2 ILE 131 3HG2 ILE 131 7.405 10.000 -15.860 1028 1HD1 ILE 131 1HD1 ILE 131 7.800 10.142 -12.958 1029 2HD1 ILE 131 2HD1 ILE 131 8.850 9.753 -14.321 1030 3HD1 ILE 131 3HD1 ILE 131 9.164 9.046 -12.736 1031 H GLU 132 H GLU 132 4.534 11.547 -15.261 1032 HA GLU 132 HA GLU 132 1.843 10.676 -15.611 1033 1HB GLU 132 1HB GLU 132 3.327 13.015 -16.812 1034 2HB GLU 132 2HB GLU 132 1.597 12.749 -16.956 1035 1HG GLU 132 1HG GLU 132 1.333 12.975 -14.561 1036 2HG GLU 132 2HG GLU 132 3.078 13.159 -14.369 Start of MODEL 17 1 H VAL 1 H VAL 1 4.253 14.481 -12.561 2 HA VAL 1 HA VAL 1 5.178 16.405 -10.640 3 HB VAL 1 HB VAL 1 3.302 15.559 -9.224 4 1HG1 VAL 1 1HG1 VAL 1 3.015 17.428 -10.775 5 2HG1 VAL 1 2HG1 VAL 1 1.537 16.478 -10.629 6 3HG1 VAL 1 3HG1 VAL 1 2.562 16.299 -12.053 7 1HG2 VAL 1 1HG2 VAL 1 1.653 14.051 -10.281 8 2HG2 VAL 1 2HG2 VAL 1 3.199 13.262 -9.974 9 3HG2 VAL 1 3HG2 VAL 1 2.785 13.779 -11.607 10 H LYS 2 H LYS 2 6.197 16.072 -8.728 11 HA LYS 2 HA LYS 2 6.977 13.307 -8.071 12 1HB LYS 2 1HB LYS 2 8.774 15.736 -8.117 13 2HB LYS 2 2HB LYS 2 9.224 14.182 -7.433 14 1HG LYS 2 1HG LYS 2 8.980 13.152 -9.649 15 2HG LYS 2 2HG LYS 2 8.571 14.733 -10.323 16 1HD LYS 2 1HD LYS 2 11.168 14.015 -8.953 17 2HD LYS 2 2HD LYS 2 10.933 14.169 -10.695 18 1HE LYS 2 1HE LYS 2 10.345 16.525 -10.408 19 2HE LYS 2 2HE LYS 2 10.554 16.370 -8.664 20 1HZ LYS 2 1HZ LYS 2 12.875 15.951 -8.966 21 2HZ LYS 2 2HZ LYS 2 12.486 17.361 -9.821 22 3HZ LYS 2 3HZ LYS 2 12.712 15.899 -10.652 23 H PHE 3 H PHE 3 6.325 12.829 -6.074 24 HA PHE 3 HA PHE 3 6.013 15.056 -4.169 25 1HB PHE 3 1HB PHE 3 4.409 12.496 -4.315 26 2HB PHE 3 2HB PHE 3 4.184 13.786 -3.138 27 HD1 PHE 3 HD1 PHE 3 3.793 16.173 -4.207 28 HD2 PHE 3 HD2 PHE 3 3.054 12.469 -6.167 29 HE1 PHE 3 HE1 PHE 3 2.217 17.297 -5.729 30 HE2 PHE 3 HE2 PHE 3 1.480 13.584 -7.690 31 HZ PHE 3 HZ PHE 3 1.057 16.001 -7.473 32 H ALA 4 H ALA 4 6.131 14.341 -1.848 33 HA ALA 4 HA ALA 4 8.281 12.349 -1.558 34 1HB ALA 4 1HB ALA 4 9.077 14.637 -1.191 35 2HB ALA 4 2HB ALA 4 9.156 13.682 0.289 36 3HB ALA 4 3HB ALA 4 7.860 14.857 0.069 37 H CYS 5 H CYS 5 8.056 10.801 -0.033 38 HA CYS 5 HA CYS 5 5.670 10.943 1.681 39 1HB CYS 5 1HB CYS 5 5.668 8.408 1.471 40 2HB CYS 5 2HB CYS 5 5.200 9.310 0.034 41 HG CYS 5 HG CYS 5 6.979 6.910 -0.240 42 H ARG 6 H ARG 6 5.826 9.415 3.570 43 HA ARG 6 HA ARG 6 8.448 9.694 4.832 44 1HB ARG 6 1HB ARG 6 6.630 10.553 6.127 45 2HB ARG 6 2HB ARG 6 5.691 9.086 5.910 46 1HG ARG 6 1HG ARG 6 7.342 7.869 7.283 47 2HG ARG 6 2HG ARG 6 8.206 9.387 7.544 48 1HD ARG 6 1HD ARG 6 6.279 10.354 8.624 49 2HD ARG 6 2HD ARG 6 5.314 8.928 8.256 50 HE ARG 6 HE ARG 6 7.648 8.377 9.847 51 1HH1 ARG 6 1HH1 ARG 6 4.255 9.263 9.870 52 2HH1 ARG 6 2HH1 ARG 6 4.016 8.775 11.518 53 1HH2 ARG 6 1HH2 ARG 6 7.322 7.693 12.011 54 2HH2 ARG 6 2HH2 ARG 6 5.751 7.878 12.741 55 H ALA 7 H ALA 7 9.778 8.058 4.532 56 HA ALA 7 HA ALA 7 8.940 5.517 3.617 57 1HB ALA 7 1HB ALA 7 11.115 6.492 3.060 58 2HB ALA 7 2HB ALA 7 11.270 4.883 3.767 59 3HB ALA 7 3HB ALA 7 11.617 6.311 4.741 60 H ILE 8 H ILE 8 7.995 3.992 4.778 61 HA ILE 8 HA ILE 8 8.724 3.664 7.603 62 HB ILE 8 HB ILE 8 6.468 2.364 6.053 63 1HG1 ILE 8 1HG1 ILE 8 6.075 4.761 6.297 64 2HG1 ILE 8 2HG1 ILE 8 4.989 3.865 7.350 65 1HG2 ILE 8 1HG2 ILE 8 7.067 2.358 9.011 66 2HG2 ILE 8 2HG2 ILE 8 7.232 0.991 7.910 67 3HG2 ILE 8 3HG2 ILE 8 5.636 1.661 8.248 68 1HD1 ILE 8 1HD1 ILE 8 6.421 4.362 9.257 69 2HD1 ILE 8 2HD1 ILE 8 5.879 5.837 8.455 70 3HD1 ILE 8 3HD1 ILE 8 7.522 5.247 8.201 71 H THR 9 H THR 9 7.953 1.570 4.826 72 HA THR 9 HA THR 9 10.086 -0.279 5.627 73 HB THR 9 HB THR 9 8.391 -0.721 3.203 74 HG1 THR 9 HG1 THR 9 7.350 -0.188 5.592 75 1HG2 THR 9 1HG2 THR 9 9.465 -2.510 5.389 76 2HG2 THR 9 2HG2 THR 9 10.062 -2.390 3.736 77 3HG2 THR 9 3HG2 THR 9 8.466 -3.063 4.046 78 H ARG 10 H ARG 10 11.283 -1.158 3.496 79 HA ARG 10 HA ARG 10 12.043 1.211 1.935 80 1HB ARG 10 1HB ARG 10 13.929 -0.816 3.145 81 2HB ARG 10 2HB ARG 10 14.403 0.490 2.066 82 1HG ARG 10 1HG ARG 10 13.577 2.121 3.712 83 2HG ARG 10 2HG ARG 10 13.164 0.795 4.797 84 1HD ARG 10 1HD ARG 10 15.536 0.127 4.831 85 2HD ARG 10 2HD ARG 10 15.919 1.506 3.803 86 HE ARG 10 HE ARG 10 14.682 1.887 6.452 87 1HH1 ARG 10 1HH1 ARG 10 17.216 2.538 4.125 88 2HH1 ARG 10 2HH1 ARG 10 18.035 3.679 5.147 89 1HH2 ARG 10 1HH2 ARG 10 15.743 3.428 7.789 90 2HH2 ARG 10 2HH2 ARG 10 17.185 4.215 7.202 91 H GLY 11 H GLY 11 13.452 0.567 0.004 92 1HA GLY 11 1HA GLY 11 13.750 -1.439 -1.528 93 2HA GLY 11 2HA GLY 11 12.014 -1.639 -1.323 94 H ARG 12 H ARG 12 13.261 -1.288 -3.822 95 HA ARG 12 HA ARG 12 12.141 1.331 -4.592 96 1HB ARG 12 1HB ARG 12 14.619 0.015 -5.725 97 2HB ARG 12 2HB ARG 12 13.897 1.507 -6.315 98 1HG ARG 12 1HG ARG 12 14.377 2.617 -4.234 99 2HG ARG 12 2HG ARG 12 14.981 1.114 -3.536 100 1HD ARG 12 1HD ARG 12 16.806 2.582 -4.243 101 2HD ARG 12 2HD ARG 12 16.795 1.073 -5.153 102 HE ARG 12 HE ARG 12 15.811 2.308 -7.009 103 1HH1 ARG 12 1HH1 ARG 12 17.331 4.158 -4.456 104 2HH1 ARG 12 2HH1 ARG 12 17.656 5.536 -5.465 105 1HH2 ARG 12 1HH2 ARG 12 16.196 4.119 -8.344 106 2HH2 ARG 12 2HH2 ARG 12 16.969 5.534 -7.673 107 H ALA 13 H ALA 13 10.416 1.030 -5.858 108 HA ALA 13 HA ALA 13 10.450 -1.181 -7.781 109 1HB ALA 13 1HB ALA 13 8.239 -1.930 -7.121 110 2HB ALA 13 2HB ALA 13 8.182 -0.706 -5.853 111 3HB ALA 13 3HB ALA 13 9.351 -2.023 -5.755 112 H GLU 14 H GLU 14 9.254 -0.865 -9.608 113 HA GLU 14 HA GLU 14 7.612 1.559 -9.788 114 1HB GLU 14 1HB GLU 14 8.487 2.111 -11.947 115 2HB GLU 14 2HB GLU 14 9.870 1.895 -10.881 116 1HG GLU 14 1HG GLU 14 10.213 -0.347 -11.776 117 2HG GLU 14 2HG GLU 14 8.822 -0.139 -12.837 118 H GLY 15 H GLY 15 5.775 1.337 -11.097 119 1HA GLY 15 1HA GLY 15 5.421 -0.573 -13.091 120 2HA GLY 15 2HA GLY 15 4.818 -1.283 -11.601 121 H GLU 16 H GLU 16 2.757 -1.323 -12.703 122 HA GLU 16 HA GLU 16 1.430 1.050 -13.459 123 1HB GLU 16 1HB GLU 16 0.357 -1.682 -12.737 124 2HB GLU 16 2HB GLU 16 -0.581 -0.399 -13.465 125 1HG GLU 16 1HG GLU 16 0.791 -0.481 -15.460 126 2HG GLU 16 2HG GLU 16 1.800 -1.727 -14.723 127 H ALA 17 H ALA 17 0.385 2.472 -12.269 128 HA ALA 17 HA ALA 17 0.162 2.150 -9.418 129 1HB ALA 17 1HB ALA 17 -0.825 4.367 -11.210 130 2HB ALA 17 2HB ALA 17 0.748 4.313 -10.417 131 3HB ALA 17 3HB ALA 17 -0.723 4.418 -9.450 132 H LEU 18 H LEU 18 -1.444 1.084 -8.526 133 HA LEU 18 HA LEU 18 -4.055 1.009 -9.878 134 1HB LEU 18 1HB LEU 18 -2.698 -1.111 -9.117 135 2HB LEU 18 2HB LEU 18 -3.311 -0.696 -7.528 136 HG LEU 18 HG LEU 18 -5.630 -0.805 -8.464 137 1HD1 LEU 18 1HD1 LEU 18 -5.941 -1.939 -10.604 138 2HD1 LEU 18 2HD1 LEU 18 -4.193 -1.973 -10.842 139 3HD1 LEU 18 3HD1 LEU 18 -5.049 -0.431 -10.801 140 1HD2 LEU 18 1HD2 LEU 18 -3.955 -3.305 -8.678 141 2HD2 LEU 18 2HD2 LEU 18 -5.710 -3.255 -8.528 142 3HD2 LEU 18 3HD2 LEU 18 -4.697 -2.670 -7.210 143 H VAL 19 H VAL 19 -5.523 2.410 -9.054 144 HA VAL 19 HA VAL 19 -4.854 3.534 -6.440 145 HB VAL 19 HB VAL 19 -4.945 5.153 -8.270 146 1HG1 VAL 19 1HG1 VAL 19 -7.064 5.755 -9.334 147 2HG1 VAL 19 2HG1 VAL 19 -7.846 4.392 -8.533 148 3HG1 VAL 19 3HG1 VAL 19 -6.572 4.106 -9.720 149 1HG2 VAL 19 1HG2 VAL 19 -6.443 6.786 -7.232 150 2HG2 VAL 19 2HG2 VAL 19 -5.482 5.913 -6.036 151 3HG2 VAL 19 3HG2 VAL 19 -7.179 5.497 -6.280 152 H THR 20 H THR 20 -5.863 2.684 -4.810 153 HA THR 20 HA THR 20 -8.642 1.823 -5.167 154 HB THR 20 HB THR 20 -6.826 1.081 -2.871 155 HG1 THR 20 HG1 THR 20 -6.499 0.363 -5.353 156 1HG2 THR 20 1HG2 THR 20 -9.341 -0.198 -3.954 157 2HG2 THR 20 2HG2 THR 20 -9.260 0.823 -2.519 158 3HG2 THR 20 3HG2 THR 20 -8.423 -0.729 -2.543 159 H LYS 21 H LYS 21 -9.538 3.868 -4.955 160 HA LYS 21 HA LYS 21 -9.130 5.483 -2.621 161 1HB LYS 21 1HB LYS 21 -11.131 6.728 -3.512 162 2HB LYS 21 2HB LYS 21 -9.788 6.587 -4.641 163 1HG LYS 21 1HG LYS 21 -10.911 4.754 -5.774 164 2HG LYS 21 2HG LYS 21 -12.251 4.859 -4.632 165 1HD LYS 21 1HD LYS 21 -12.744 7.117 -5.410 166 2HD LYS 21 2HD LYS 21 -11.381 7.037 -6.530 167 1HE LYS 21 1HE LYS 21 -13.479 6.580 -7.679 168 2HE LYS 21 2HE LYS 21 -12.432 5.160 -7.683 169 1HZ LYS 21 1HZ LYS 21 -14.522 4.337 -7.136 170 2HZ LYS 21 2HZ LYS 21 -14.880 5.632 -6.101 171 3HZ LYS 21 3HZ LYS 21 -13.751 4.466 -5.627 172 H GLU 22 H GLU 22 -10.540 2.591 -3.033 173 HA GLU 22 HA GLU 22 -12.790 2.992 -1.228 174 1HB GLU 22 1HB GLU 22 -11.818 0.378 -2.385 175 2HB GLU 22 2HB GLU 22 -13.418 0.759 -1.768 176 1HG GLU 22 1HG GLU 22 -12.189 1.862 -4.287 177 2HG GLU 22 2HG GLU 22 -13.403 0.591 -4.195 178 H TYR 23 H TYR 23 -12.957 1.572 0.691 179 HA TYR 23 HA TYR 23 -10.299 1.015 1.817 180 1HB TYR 23 1HB TYR 23 -11.260 1.409 4.045 181 2HB TYR 23 2HB TYR 23 -11.438 2.821 3.016 182 HD1 TYR 23 HD1 TYR 23 -13.774 3.002 1.777 183 HD2 TYR 23 HD2 TYR 23 -13.068 0.682 5.275 184 HE1 TYR 23 HE1 TYR 23 -16.177 3.059 2.297 185 HE2 TYR 23 HE2 TYR 23 -15.467 0.732 5.798 186 HH TYR 23 HH TYR 23 -17.812 1.696 3.580 187 H ILE 24 H ILE 24 -9.927 -1.083 1.568 188 HA ILE 24 HA ILE 24 -12.103 -2.988 2.060 189 HB ILE 24 HB ILE 24 -9.423 -3.353 0.707 190 1HG1 ILE 24 1HG1 ILE 24 -10.993 -4.181 -1.158 191 2HG1 ILE 24 2HG1 ILE 24 -12.281 -3.410 -0.244 192 1HG2 ILE 24 1HG2 ILE 24 -10.039 -5.693 0.330 193 2HG2 ILE 24 2HG2 ILE 24 -11.477 -5.473 1.328 194 3HG2 ILE 24 3HG2 ILE 24 -9.874 -5.331 2.048 195 1HD1 ILE 24 1HD1 ILE 24 -11.468 -1.992 -2.039 196 2HD1 ILE 24 2HD1 ILE 24 -9.845 -2.033 -1.348 197 3HD1 ILE 24 3HD1 ILE 24 -11.163 -1.265 -0.462 198 H SER 25 H SER 25 -12.147 -4.191 3.851 199 HA SER 25 HA SER 25 -10.177 -3.883 5.887 200 1HB SER 25 1HB SER 25 -11.526 -5.677 7.041 201 2HB SER 25 2HB SER 25 -12.462 -4.267 6.545 202 HG SER 25 HG SER 25 -12.251 -6.470 4.809 203 H PHE 26 H PHE 26 -8.328 -4.957 6.091 204 HA PHE 26 HA PHE 26 -7.573 -6.844 4.094 205 1HB PHE 26 1HB PHE 26 -6.100 -5.899 6.561 206 2HB PHE 26 2HB PHE 26 -5.394 -6.881 5.282 207 HD1 PHE 26 HD1 PHE 26 -5.085 -5.929 3.026 208 HD2 PHE 26 HD2 PHE 26 -6.398 -3.557 6.305 209 HE1 PHE 26 HE1 PHE 26 -4.503 -3.891 1.779 210 HE2 PHE 26 HE2 PHE 26 -5.818 -1.513 5.062 211 HZ PHE 26 HZ PHE 26 -4.871 -1.682 2.794 212 H LEU 27 H LEU 27 -8.988 -8.572 4.400 213 HA LEU 27 HA LEU 27 -8.103 -10.413 6.498 214 1HB LEU 27 1HB LEU 27 -10.408 -9.250 6.826 215 2HB LEU 27 2HB LEU 27 -10.948 -10.308 5.542 216 HG LEU 27 HG LEU 27 -11.486 -11.124 7.801 217 1HD1 LEU 27 1HD1 LEU 27 -11.305 -12.706 5.965 218 2HD1 LEU 27 2HD1 LEU 27 -10.751 -13.425 7.478 219 3HD1 LEU 27 3HD1 LEU 27 -9.578 -12.883 6.277 220 1HD2 LEU 27 1HD2 LEU 27 -9.570 -10.313 9.015 221 2HD2 LEU 27 2HD2 LEU 27 -8.500 -11.362 8.084 222 3HD2 LEU 27 3HD2 LEU 27 -9.681 -12.064 9.189 223 H GLY 28 H GLY 28 -10.352 -10.436 3.724 224 1HA GLY 28 1HA GLY 28 -8.613 -12.383 2.381 225 2HA GLY 28 2HA GLY 28 -10.293 -12.818 2.682 226 H GLY 29 H GLY 29 -9.680 -12.924 0.148 227 1HA GLY 29 1HA GLY 29 -11.385 -11.790 -1.395 228 2HA GLY 29 2HA GLY 29 -10.470 -10.336 -1.023 229 H ILE 30 H ILE 30 -7.991 -10.723 -1.348 230 HA ILE 30 HA ILE 30 -7.592 -11.289 -4.099 231 HB ILE 30 HB ILE 30 -5.488 -10.939 -1.951 232 1HG1 ILE 30 1HG1 ILE 30 -6.730 -8.865 -3.779 233 2HG1 ILE 30 2HG1 ILE 30 -7.091 -9.043 -2.064 234 1HG2 ILE 30 1HG2 ILE 30 -4.022 -10.290 -3.792 235 2HG2 ILE 30 2HG2 ILE 30 -5.326 -10.579 -4.944 236 3HG2 ILE 30 3HG2 ILE 30 -4.646 -11.925 -4.031 237 1HD1 ILE 30 1HD1 ILE 30 -4.413 -8.335 -3.245 238 2HD1 ILE 30 2HD1 ILE 30 -4.769 -8.516 -1.527 239 3HD1 ILE 30 3HD1 ILE 30 -5.532 -7.226 -2.454 240 H ASP 31 H ASP 31 -7.244 -13.176 -5.041 241 HA ASP 31 HA ASP 31 -7.083 -15.641 -3.731 242 1HB ASP 31 1HB ASP 31 -6.132 -14.902 -6.508 243 2HB ASP 31 2HB ASP 31 -6.318 -16.546 -5.920 244 H LYS 32 H LYS 32 -5.440 -16.774 -2.870 245 HA LYS 32 HA LYS 32 -2.879 -15.627 -2.509 246 1HB LYS 32 1HB LYS 32 -3.557 -18.559 -2.238 247 2HB LYS 32 2HB LYS 32 -2.280 -17.674 -1.424 248 1HG LYS 32 1HG LYS 32 -5.223 -17.262 -0.980 249 2HG LYS 32 2HG LYS 32 -4.157 -18.210 0.056 250 1HD LYS 32 1HD LYS 32 -2.790 -16.152 0.405 251 2HD LYS 32 2HD LYS 32 -4.016 -15.247 -0.484 252 1HE LYS 32 1HE LYS 32 -4.420 -15.016 1.881 253 2HE LYS 32 2HE LYS 32 -5.704 -15.990 1.165 254 1HZ LYS 32 1HZ LYS 32 -4.613 -17.986 1.979 255 2HZ LYS 32 2HZ LYS 32 -4.917 -16.921 3.266 256 3HZ LYS 32 3HZ LYS 32 -3.351 -17.061 2.636 257 H GLU 33 H GLU 33 -4.294 -17.410 -5.031 258 HA GLU 33 HA GLU 33 -1.741 -18.449 -6.000 259 1HB GLU 33 1HB GLU 33 -4.509 -19.056 -7.033 260 2HB GLU 33 2HB GLU 33 -3.030 -19.958 -7.343 261 1HG GLU 33 1HG GLU 33 -2.922 -20.553 -4.956 262 2HG GLU 33 2HG GLU 33 -4.439 -19.698 -4.696 263 H THR 34 H THR 34 -4.643 -16.860 -7.385 264 HA THR 34 HA THR 34 -3.110 -16.173 -9.743 265 HB THR 34 HB THR 34 -5.526 -15.028 -10.173 266 HG1 THR 34 HG1 THR 34 -6.932 -15.773 -8.777 267 1HG2 THR 34 1HG2 THR 34 -6.092 -17.091 -11.391 268 2HG2 THR 34 2HG2 THR 34 -4.792 -17.933 -10.548 269 3HG2 THR 34 3HG2 THR 34 -4.418 -16.610 -11.654 270 H GLY 35 H GLY 35 -3.849 -14.655 -6.801 271 1HA GLY 35 1HA GLY 35 -3.389 -12.534 -6.041 272 2HA GLY 35 2HA GLY 35 -2.505 -12.275 -7.536 273 H ILE 36 H ILE 36 -5.866 -13.162 -7.507 274 HA ILE 36 HA ILE 36 -6.565 -10.524 -8.595 275 HB ILE 36 HB ILE 36 -8.128 -13.114 -8.706 276 1HG1 ILE 36 1HG1 ILE 36 -6.076 -13.258 -10.058 277 2HG1 ILE 36 2HG1 ILE 36 -7.511 -13.212 -11.081 278 1HG2 ILE 36 1HG2 ILE 36 -9.571 -11.178 -8.785 279 2HG2 ILE 36 2HG2 ILE 36 -9.514 -11.950 -10.369 280 3HG2 ILE 36 3HG2 ILE 36 -8.599 -10.470 -10.075 281 1HD1 ILE 36 1HD1 ILE 36 -5.714 -10.872 -10.487 282 2HD1 ILE 36 2HD1 ILE 36 -7.108 -10.875 -11.568 283 3HD1 ILE 36 3HD1 ILE 36 -5.688 -11.844 -11.958 284 H VAL 37 H VAL 37 -7.932 -9.210 -7.468 285 HA VAL 37 HA VAL 37 -8.746 -10.091 -4.848 286 HB VAL 37 HB VAL 37 -7.962 -7.838 -4.979 287 1HG1 VAL 37 1HG1 VAL 37 -8.399 -7.343 -7.300 288 2HG1 VAL 37 2HG1 VAL 37 -9.105 -6.097 -6.271 289 3HG1 VAL 37 3HG1 VAL 37 -10.137 -7.330 -6.997 290 1HG2 VAL 37 1HG2 VAL 37 -9.860 -6.589 -4.036 291 2HG2 VAL 37 2HG2 VAL 37 -9.715 -8.211 -3.358 292 3HG2 VAL 37 3HG2 VAL 37 -10.947 -7.870 -4.572 293 H LYS 38 H LYS 38 -10.362 -11.446 -4.740 294 HA LYS 38 HA LYS 38 -12.555 -11.429 -6.601 295 1HB LYS 38 1HB LYS 38 -11.921 -13.067 -4.148 296 2HB LYS 38 2HB LYS 38 -13.405 -13.278 -5.064 297 1HG LYS 38 1HG LYS 38 -10.642 -13.565 -6.228 298 2HG LYS 38 2HG LYS 38 -11.619 -14.906 -5.626 299 1HD LYS 38 1HD LYS 38 -13.398 -14.234 -7.244 300 2HD LYS 38 2HD LYS 38 -12.267 -13.054 -7.909 301 1HE LYS 38 1HE LYS 38 -11.643 -15.987 -7.725 302 2HE LYS 38 2HE LYS 38 -12.437 -15.271 -9.125 303 1HZ LYS 38 1HZ LYS 38 -10.495 -13.763 -9.311 304 2HZ LYS 38 2HZ LYS 38 -10.114 -15.390 -9.556 305 3HZ LYS 38 3HZ LYS 38 -9.724 -14.643 -8.080 306 H GLU 39 H GLU 39 -11.896 -9.969 -3.578 307 HA GLU 39 HA GLU 39 -14.563 -9.778 -2.616 308 1HB GLU 39 1HB GLU 39 -12.567 -9.506 -1.169 309 2HB GLU 39 2HB GLU 39 -12.195 -8.004 -2.000 310 1HG GLU 39 1HG GLU 39 -13.311 -7.706 0.191 311 2HG GLU 39 2HG GLU 39 -14.156 -6.955 -1.159 312 H ASP 40 H ASP 40 -16.094 -8.224 -2.936 313 HA ASP 40 HA ASP 40 -15.751 -6.677 -5.368 314 1HB ASP 40 1HB ASP 40 -17.826 -7.938 -5.058 315 2HB ASP 40 2HB ASP 40 -18.162 -7.054 -3.573 316 H CYS 41 H CYS 41 -15.428 -4.575 -5.485 317 HA CYS 41 HA CYS 41 -16.274 -2.558 -3.815 318 1HB CYS 41 1HB CYS 41 -14.676 -3.851 -2.209 319 2HB CYS 41 2HB CYS 41 -13.385 -3.134 -3.171 320 HG CYS 41 HG CYS 41 -14.824 -0.514 -2.650 321 H GLU 42 H GLU 42 -16.144 -2.771 -6.451 322 HA GLU 42 HA GLU 42 -15.625 -1.608 -8.323 323 1HB GLU 42 1HB GLU 42 -15.475 0.374 -6.863 324 2HB GLU 42 2HB GLU 42 -13.778 0.023 -6.572 325 1HG GLU 42 1HG GLU 42 -13.296 0.354 -8.939 326 2HG GLU 42 2HG GLU 42 -15.000 0.690 -9.242 327 H ILE 43 H ILE 43 -12.724 -2.297 -6.383 328 HA ILE 43 HA ILE 43 -11.024 -2.498 -8.691 329 HB ILE 43 HB ILE 43 -10.462 -3.445 -5.873 330 1HG1 ILE 43 1HG1 ILE 43 -11.172 -1.104 -5.831 331 2HG1 ILE 43 2HG1 ILE 43 -9.447 -1.228 -5.504 332 1HG2 ILE 43 1HG2 ILE 43 -8.117 -3.069 -6.462 333 2HG2 ILE 43 2HG2 ILE 43 -8.600 -2.596 -8.090 334 3HG2 ILE 43 3HG2 ILE 43 -8.867 -4.249 -7.538 335 1HD1 ILE 43 1HD1 ILE 43 -8.961 -0.571 -7.801 336 2HD1 ILE 43 2HD1 ILE 43 -9.940 0.641 -6.974 337 3HD1 ILE 43 3HD1 ILE 43 -10.689 -0.455 -8.135 338 H LYS 44 H LYS 44 -13.271 -4.559 -7.318 339 HA LYS 44 HA LYS 44 -12.146 -7.083 -7.341 340 1HB LYS 44 1HB LYS 44 -14.343 -6.766 -6.465 341 2HB LYS 44 2HB LYS 44 -14.950 -6.197 -8.013 342 1HG LYS 44 1HG LYS 44 -14.628 -8.431 -8.956 343 2HG LYS 44 2HG LYS 44 -14.016 -8.996 -7.399 344 1HD LYS 44 1HD LYS 44 -16.148 -8.542 -6.355 345 2HD LYS 44 2HD LYS 44 -16.768 -7.836 -7.848 346 1HE LYS 44 1HE LYS 44 -17.574 -10.133 -7.477 347 2HE LYS 44 2HE LYS 44 -16.632 -9.977 -8.960 348 1HZ LYS 44 1HZ LYS 44 -14.773 -10.999 -7.932 349 2HZ LYS 44 2HZ LYS 44 -16.114 -11.969 -7.581 350 3HZ LYS 44 3HZ LYS 44 -15.489 -10.937 -6.397 351 H GLY 45 H GLY 45 -11.300 -8.319 -8.844 352 1HA GLY 45 1HA GLY 45 -11.577 -9.472 -10.966 353 2HA GLY 45 2HA GLY 45 -12.188 -7.970 -11.640 354 H GLU 46 H GLU 46 -9.901 -6.647 -10.002 355 HA GLU 46 HA GLU 46 -8.000 -6.775 -12.179 356 1HB GLU 46 1HB GLU 46 -8.309 -5.017 -9.770 357 2HB GLU 46 2HB GLU 46 -6.839 -4.985 -10.737 358 1HG GLU 46 1HG GLU 46 -9.619 -4.460 -11.759 359 2HG GLU 46 2HG GLU 46 -8.405 -3.238 -11.390 360 H SER 47 H SER 47 -5.690 -6.870 -11.758 361 HA SER 47 HA SER 47 -5.073 -8.957 -9.798 362 1HB SER 47 1HB SER 47 -3.000 -9.258 -11.203 363 2HB SER 47 2HB SER 47 -4.511 -9.592 -12.050 364 HG SER 47 HG SER 47 -4.365 -7.572 -13.041 365 H VAL 48 H VAL 48 -3.243 -8.780 -8.449 366 HA VAL 48 HA VAL 48 -2.354 -6.003 -7.999 367 HB VAL 48 HB VAL 48 -2.019 -8.233 -6.010 368 1HG1 VAL 48 1HG1 VAL 48 -2.077 -6.415 -4.390 369 2HG1 VAL 48 2HG1 VAL 48 -2.351 -5.257 -5.693 370 3HG1 VAL 48 3HG1 VAL 48 -0.830 -6.145 -5.609 371 1HG2 VAL 48 1HG2 VAL 48 -4.139 -7.632 -4.978 372 2HG2 VAL 48 2HG2 VAL 48 -4.379 -8.240 -6.616 373 3HG2 VAL 48 3HG2 VAL 48 -4.471 -6.508 -6.295 374 H ALA 49 H ALA 49 -1.353 -8.615 -9.561 375 HA ALA 49 HA ALA 49 1.116 -9.305 -8.378 376 1HB ALA 49 1HB ALA 49 1.467 -10.671 -10.346 377 2HB ALA 49 2HB ALA 49 0.138 -9.858 -11.175 378 3HB ALA 49 3HB ALA 49 -0.186 -10.859 -9.759 379 H GLY 50 H GLY 50 2.248 -7.405 -8.153 380 1HA GLY 50 1HA GLY 50 4.293 -6.489 -8.853 381 2HA GLY 50 2HA GLY 50 3.880 -6.871 -10.512 382 H ARG 51 H ARG 51 1.560 -5.263 -8.527 383 HA ARG 51 HA ARG 51 2.071 -2.792 -10.039 384 1HB ARG 51 1HB ARG 51 -0.481 -3.977 -8.969 385 2HB ARG 51 2HB ARG 51 -0.369 -2.292 -9.461 386 1HG ARG 51 1HG ARG 51 0.272 -2.980 -11.708 387 2HG ARG 51 2HG ARG 51 0.188 -4.673 -11.218 388 1HD ARG 51 1HD ARG 51 -2.148 -4.563 -10.895 389 2HD ARG 51 2HD ARG 51 -2.151 -2.803 -10.989 390 HE ARG 51 HE ARG 51 -1.164 -3.708 -13.412 391 1HH1 ARG 51 1HH1 ARG 51 -4.112 -4.125 -11.574 392 2HH1 ARG 51 2HH1 ARG 51 -5.144 -4.168 -12.972 393 1HH2 ARG 51 1HH2 ARG 51 -2.491 -3.802 -15.258 394 2HH2 ARG 51 2HH2 ARG 51 -4.212 -4.000 -15.082 395 H ILE 52 H ILE 52 1.205 -0.798 -8.893 396 HA ILE 52 HA ILE 52 2.161 -0.851 -6.099 397 HB ILE 52 HB ILE 52 2.205 1.400 -8.126 398 1HG1 ILE 52 1HG1 ILE 52 4.662 1.425 -7.535 399 2HG1 ILE 52 2HG1 ILE 52 4.400 -0.063 -6.643 400 1HG2 ILE 52 1HG2 ILE 52 1.498 2.272 -5.957 401 2HG2 ILE 52 2HG2 ILE 52 3.113 2.836 -6.382 402 3HG2 ILE 52 3HG2 ILE 52 2.916 1.544 -5.200 403 1HD1 ILE 52 1HD1 ILE 52 3.992 0.335 -9.590 404 2HD1 ILE 52 2HD1 ILE 52 3.689 -1.161 -8.705 405 3HD1 ILE 52 3HD1 ILE 52 5.329 -0.518 -8.820 406 H LEU 53 H LEU 53 0.546 -0.734 -4.678 407 HA LEU 53 HA LEU 53 -2.002 0.406 -5.593 408 1HB LEU 53 1HB LEU 53 -1.291 -1.715 -3.618 409 2HB LEU 53 2HB LEU 53 -2.779 -0.817 -3.395 410 HG LEU 53 HG LEU 53 -3.531 -1.520 -5.633 411 1HD1 LEU 53 1HD1 LEU 53 -1.433 -1.825 -6.753 412 2HD1 LEU 53 2HD1 LEU 53 -2.325 -3.347 -6.774 413 3HD1 LEU 53 3HD1 LEU 53 -0.985 -3.126 -5.648 414 1HD2 LEU 53 1HD2 LEU 53 -4.188 -2.792 -3.675 415 2HD2 LEU 53 2HD2 LEU 53 -2.729 -3.774 -3.805 416 3HD2 LEU 53 3HD2 LEU 53 -3.963 -3.858 -5.062 417 H VAL 54 H VAL 54 -2.833 2.157 -4.705 418 HA VAL 54 HA VAL 54 -1.579 3.231 -2.288 419 HB VAL 54 HB VAL 54 -2.649 5.393 -3.036 420 1HG1 VAL 54 1HG1 VAL 54 -0.585 4.137 -4.831 421 2HG1 VAL 54 2HG1 VAL 54 -0.278 5.002 -3.323 422 3HG1 VAL 54 3HG1 VAL 54 -0.919 5.865 -4.721 423 1HG2 VAL 54 1HG2 VAL 54 -3.221 5.599 -5.418 424 2HG2 VAL 54 2HG2 VAL 54 -4.312 4.518 -4.551 425 3HG2 VAL 54 3HG2 VAL 54 -3.049 3.851 -5.585 426 H PHE 55 H PHE 55 -2.742 3.469 -0.493 427 HA PHE 55 HA PHE 55 -5.674 3.207 -0.647 428 1HB PHE 55 1HB PHE 55 -3.818 1.837 1.309 429 2HB PHE 55 2HB PHE 55 -5.555 1.947 1.534 430 HD1 PHE 55 HD1 PHE 55 -7.052 0.558 0.313 431 HD2 PHE 55 HD2 PHE 55 -2.871 0.434 -0.453 432 HE1 PHE 55 HE1 PHE 55 -7.352 -1.533 -0.944 433 HE2 PHE 55 HE2 PHE 55 -3.160 -1.654 -1.719 434 HZ PHE 55 HZ PHE 55 -5.402 -2.641 -1.964 435 HA PRO 56 HA PRO 56 -5.614 6.788 2.040 436 1HB PRO 56 1HB PRO 56 -8.073 6.450 3.197 437 2HB PRO 56 2HB PRO 56 -7.840 7.128 1.583 438 1HG PRO 56 1HG PRO 56 -8.600 4.347 2.379 439 2HG PRO 56 2HG PRO 56 -9.226 5.344 1.054 440 1HD PRO 56 1HD PRO 56 -7.415 3.374 0.658 441 2HD PRO 56 2HD PRO 56 -7.438 4.856 -0.322 442 H GLY 57 H GLY 57 -6.537 3.596 3.242 443 1HA GLY 57 1HA GLY 57 -4.669 3.681 5.352 444 2HA GLY 57 2HA GLY 57 -6.266 4.062 5.980 445 H GLY 58 H GLY 58 -7.925 2.497 5.827 446 1HA GLY 58 1HA GLY 58 -8.530 0.189 5.181 447 2HA GLY 58 2HA GLY 58 -6.866 -0.252 5.549 448 H LYS 59 H LYS 59 -9.388 -1.267 6.687 449 HA LYS 59 HA LYS 59 -9.291 -0.240 9.414 450 1HB LYS 59 1HB LYS 59 -11.218 -2.138 8.071 451 2HB LYS 59 2HB LYS 59 -11.304 -1.685 9.769 452 1HG LYS 59 1HG LYS 59 -11.498 0.700 9.032 453 2HG LYS 59 2HG LYS 59 -11.639 0.108 7.376 454 1HD LYS 59 1HD LYS 59 -13.633 -1.148 7.974 455 2HD LYS 59 2HD LYS 59 -13.476 -0.633 9.656 456 1HE LYS 59 1HE LYS 59 -13.719 1.716 8.910 457 2HE LYS 59 2HE LYS 59 -13.981 1.138 7.265 458 1HZ LYS 59 1HZ LYS 59 -15.940 -0.061 8.048 459 2HZ LYS 59 2HZ LYS 59 -16.072 1.600 8.368 460 3HZ LYS 59 3HZ LYS 59 -15.686 0.526 9.622 461 H GLY 60 H GLY 60 -9.021 -1.592 11.213 462 1HA GLY 60 1HA GLY 60 -6.868 -3.423 10.826 463 2HA GLY 60 2HA GLY 60 -7.572 -2.947 12.362 464 H SER 61 H SER 61 -7.970 -5.052 9.593 465 HA SER 61 HA SER 61 -9.572 -6.887 11.202 466 1HB SER 61 1HB SER 61 -8.689 -7.110 8.311 467 2HB SER 61 2HB SER 61 -9.854 -8.152 9.130 468 HG SER 61 HG SER 61 -10.600 -5.622 9.480 469 H THR 62 H THR 62 -8.832 -9.030 11.655 470 HA THR 62 HA THR 62 -5.947 -8.978 12.034 471 HB THR 62 HB THR 62 -7.249 -9.209 14.070 472 HG1 THR 62 HG1 THR 62 -6.231 -11.279 14.756 473 1HG2 THR 62 1HG2 THR 62 -8.255 -11.819 12.927 474 2HG2 THR 62 2HG2 THR 62 -9.217 -10.362 13.173 475 3HG2 THR 62 3HG2 THR 62 -8.548 -11.220 14.561 476 H VAL 63 H VAL 63 -6.080 -9.452 9.644 477 HA VAL 63 HA VAL 63 -6.452 -12.043 8.664 478 HB VAL 63 HB VAL 63 -6.067 -10.078 7.232 479 1HG1 VAL 63 1HG1 VAL 63 -4.339 -8.964 8.509 480 2HG1 VAL 63 2HG1 VAL 63 -3.798 -9.236 6.853 481 3HG1 VAL 63 3HG1 VAL 63 -3.208 -10.270 8.155 482 1HG2 VAL 63 1HG2 VAL 63 -5.773 -12.280 6.269 483 2HG2 VAL 63 2HG2 VAL 63 -4.090 -12.308 6.797 484 3HG2 VAL 63 3HG2 VAL 63 -4.611 -11.151 5.573 485 H GLY 64 H GLY 64 -3.931 -10.694 10.617 486 1HA GLY 64 1HA GLY 64 -2.533 -11.996 11.994 487 2HA GLY 64 2HA GLY 64 -2.806 -13.370 10.935 488 H SER 65 H SER 65 -2.209 -10.872 8.936 489 HA SER 65 HA SER 65 -0.460 -10.190 7.663 490 1HB SER 65 1HB SER 65 1.268 -11.008 10.013 491 2HB SER 65 2HB SER 65 1.747 -9.955 8.681 492 HG SER 65 HG SER 65 0.216 -9.412 10.907 493 H TYR 66 H TYR 66 2.085 -11.201 7.262 494 HA TYR 66 HA TYR 66 3.339 -12.875 6.392 495 1HB TYR 66 1HB TYR 66 1.285 -14.736 7.597 496 2HB TYR 66 2HB TYR 66 2.817 -15.236 6.891 497 HD1 TYR 66 HD1 TYR 66 4.952 -14.703 8.045 498 HD2 TYR 66 HD2 TYR 66 1.182 -13.755 9.780 499 HE1 TYR 66 HE1 TYR 66 6.039 -14.381 10.230 500 HE2 TYR 66 HE2 TYR 66 2.255 -13.431 11.960 501 HH TYR 66 HH TYR 66 4.225 -14.008 13.151 502 H VAL 67 H VAL 67 -0.089 -12.924 5.738 503 HA VAL 67 HA VAL 67 -0.221 -14.568 3.516 504 HB VAL 67 HB VAL 67 -1.748 -12.003 3.999 505 1HG1 VAL 67 1HG1 VAL 67 -2.389 -14.327 2.186 506 2HG1 VAL 67 2HG1 VAL 67 -1.906 -12.711 1.669 507 3HG1 VAL 67 3HG1 VAL 67 -3.440 -12.948 2.507 508 1HG2 VAL 67 1HG2 VAL 67 -1.988 -13.583 5.827 509 2HG2 VAL 67 2HG2 VAL 67 -2.405 -14.866 4.688 510 3HG2 VAL 67 3HG2 VAL 67 -3.485 -13.486 4.896 511 H LEU 68 H LEU 68 0.690 -11.143 3.668 512 HA LEU 68 HA LEU 68 0.900 -10.706 0.903 513 1HB LEU 68 1HB LEU 68 2.034 -9.366 3.317 514 2HB LEU 68 2HB LEU 68 2.671 -8.937 1.742 515 HG LEU 68 HG LEU 68 0.964 -7.356 2.431 516 1HD1 LEU 68 1HD1 LEU 68 1.173 -7.798 0.065 517 2HD1 LEU 68 2HD1 LEU 68 -0.513 -7.493 0.485 518 3HD1 LEU 68 3HD1 LEU 68 0.039 -9.142 0.192 519 1HD2 LEU 68 1HD2 LEU 68 -1.376 -8.038 2.677 520 2HD2 LEU 68 2HD2 LEU 68 -0.345 -8.763 3.911 521 3HD2 LEU 68 3HD2 LEU 68 -0.892 -9.727 2.538 522 H LEU 69 H LEU 69 3.109 -12.137 3.201 523 HA LEU 69 HA LEU 69 5.406 -12.083 1.534 524 1HB LEU 69 1HB LEU 69 5.566 -12.386 3.957 525 2HB LEU 69 2HB LEU 69 4.704 -13.907 3.838 526 HG LEU 69 HG LEU 69 6.566 -14.872 2.560 527 1HD1 LEU 69 1HD1 LEU 69 7.363 -12.798 1.515 528 2HD1 LEU 69 2HD1 LEU 69 8.662 -13.681 2.315 529 3HD1 LEU 69 3HD1 LEU 69 7.965 -12.253 3.081 530 1HD2 LEU 69 1HD2 LEU 69 8.199 -14.953 4.393 531 2HD2 LEU 69 2HD2 LEU 69 6.544 -15.136 4.972 532 3HD2 LEU 69 3HD2 LEU 69 7.381 -13.597 5.168 533 H ASN 70 H ASN 70 2.875 -14.486 2.175 534 HA ASN 70 HA ASN 70 3.807 -16.551 0.528 535 1HB ASN 70 1HB ASN 70 1.901 -16.720 2.149 536 2HB ASN 70 2HB ASN 70 0.909 -15.820 1.004 537 1HD2 ASN 70 1HD2 ASN 70 0.264 -16.815 -0.917 538 2HD2 ASN 70 2HD2 ASN 70 0.372 -18.523 -1.143 539 H LEU 71 H LEU 71 1.727 -13.790 -0.189 540 HA LEU 71 HA LEU 71 1.252 -14.416 -2.900 541 1HB LEU 71 1HB LEU 71 1.306 -11.711 -1.562 542 2HB LEU 71 2HB LEU 71 0.588 -12.064 -3.121 543 HG LEU 71 HG LEU 71 -0.351 -13.179 -0.476 544 1HD1 LEU 71 1HD1 LEU 71 -2.311 -11.735 -0.860 545 2HD1 LEU 71 2HD1 LEU 71 -1.493 -11.030 -2.255 546 3HD1 LEU 71 3HD1 LEU 71 -0.822 -10.815 -0.639 547 1HD2 LEU 71 1HD2 LEU 71 -1.515 -13.407 -3.248 548 2HD2 LEU 71 2HD2 LEU 71 -2.260 -13.999 -1.764 549 3HD2 LEU 71 3HD2 LEU 71 -0.748 -14.706 -2.337 550 H ARG 72 H ARG 72 3.776 -12.595 -1.269 551 HA ARG 72 HA ARG 72 4.977 -11.513 -3.600 552 1HB ARG 72 1HB ARG 72 5.205 -10.949 -1.008 553 2HB ARG 72 2HB ARG 72 6.585 -12.028 -1.140 554 1HG ARG 72 1HG ARG 72 6.201 -9.660 -2.945 555 2HG ARG 72 2HG ARG 72 7.037 -9.557 -1.398 556 1HD ARG 72 1HD ARG 72 8.623 -11.277 -2.175 557 2HD ARG 72 2HD ARG 72 7.803 -11.303 -3.736 558 HE ARG 72 HE ARG 72 8.586 -8.666 -3.094 559 1HH1 ARG 72 1HH1 ARG 72 9.934 -11.732 -4.115 560 2HH1 ARG 72 2HH1 ARG 72 11.297 -11.014 -4.916 561 1HH2 ARG 72 1HH2 ARG 72 10.347 -7.712 -4.154 562 2HH2 ARG 72 2HH2 ARG 72 11.527 -8.721 -4.944 563 H LYS 73 H LYS 73 5.550 -14.426 -1.690 564 HA LYS 73 HA LYS 73 7.826 -15.390 -3.014 565 1HB LYS 73 1HB LYS 73 5.537 -16.858 -1.700 566 2HB LYS 73 2HB LYS 73 6.993 -17.653 -2.275 567 1HG LYS 73 1HG LYS 73 8.331 -16.596 -0.657 568 2HG LYS 73 2HG LYS 73 7.062 -15.435 -0.258 569 1HD LYS 73 1HD LYS 73 5.707 -17.152 0.721 570 2HD LYS 73 2HD LYS 73 6.806 -18.409 0.158 571 1HE LYS 73 1HE LYS 73 7.635 -16.236 2.063 572 2HE LYS 73 2HE LYS 73 6.976 -17.781 2.599 573 1HZ LYS 73 1HZ LYS 73 8.783 -18.903 1.440 574 2HZ LYS 73 2HZ LYS 73 9.374 -17.828 2.612 575 3HZ LYS 73 3HZ LYS 73 9.433 -17.409 0.972 576 H ASN 74 H ASN 74 4.435 -15.507 -3.848 577 HA ASN 74 HA ASN 74 4.868 -17.356 -6.036 578 1HB ASN 74 1HB ASN 74 2.821 -17.444 -4.620 579 2HB ASN 74 2HB ASN 74 2.358 -15.862 -5.238 580 1HD2 ASN 74 1HD2 ASN 74 0.446 -16.726 -6.057 581 2HD2 ASN 74 2HD2 ASN 74 0.426 -17.669 -7.506 582 H GLY 75 H GLY 75 4.716 -13.953 -5.519 583 1HA GLY 75 1HA GLY 75 5.487 -12.341 -7.043 584 2HA GLY 75 2HA GLY 75 5.299 -13.511 -8.342 585 H VAL 76 H VAL 76 2.668 -13.155 -6.168 586 HA VAL 76 HA VAL 76 1.198 -11.660 -8.238 587 HB VAL 76 HB VAL 76 -0.863 -12.688 -7.310 588 1HG1 VAL 76 1HG1 VAL 76 0.207 -13.645 -9.271 589 2HG1 VAL 76 2HG1 VAL 76 -0.497 -14.915 -8.271 590 3HG1 VAL 76 3HG1 VAL 76 1.245 -14.635 -8.246 591 1HG2 VAL 76 1HG2 VAL 76 1.078 -14.325 -5.675 592 2HG2 VAL 76 2HG2 VAL 76 -0.645 -14.662 -5.848 593 3HG2 VAL 76 3HG2 VAL 76 -0.113 -13.178 -5.059 594 H ALA 77 H ALA 77 2.777 -10.895 -5.702 595 HA ALA 77 HA ALA 77 0.705 -9.462 -4.223 596 1HB ALA 77 1HB ALA 77 2.482 -8.970 -2.609 597 2HB ALA 77 2HB ALA 77 3.656 -9.761 -3.662 598 3HB ALA 77 3HB ALA 77 2.363 -10.701 -2.919 599 HA PRO 78 HA PRO 78 1.696 -5.494 -5.988 600 1HB PRO 78 1HB PRO 78 1.730 -3.910 -3.752 601 2HB PRO 78 2HB PRO 78 0.249 -4.445 -4.553 602 1HG PRO 78 1HG PRO 78 1.604 -5.566 -2.130 603 2HG PRO 78 2HG PRO 78 -0.125 -5.299 -2.423 604 1HD PRO 78 1HD PRO 78 0.987 -7.737 -2.640 605 2HD PRO 78 2HD PRO 78 -0.330 -7.214 -3.704 606 H LYS 79 H LYS 79 3.542 -4.415 -6.505 607 HA LYS 79 HA LYS 79 6.021 -5.191 -5.356 608 1HB LYS 79 1HB LYS 79 5.199 -3.124 -7.365 609 2HB LYS 79 2HB LYS 79 6.833 -3.126 -6.726 610 1HG LYS 79 1HG LYS 79 7.112 -5.444 -7.500 611 2HG LYS 79 2HG LYS 79 5.491 -5.381 -8.188 612 1HD LYS 79 1HD LYS 79 6.143 -3.622 -9.700 613 2HD LYS 79 2HD LYS 79 7.736 -3.519 -8.946 614 1HE LYS 79 1HE LYS 79 8.254 -5.775 -9.681 615 2HE LYS 79 2HE LYS 79 6.639 -5.941 -10.369 616 1HZ LYS 79 1HZ LYS 79 8.682 -3.967 -11.260 617 2HZ LYS 79 2HZ LYS 79 7.142 -4.199 -11.943 618 3HZ LYS 79 3HZ LYS 79 8.312 -5.425 -12.050 619 H ALA 80 H ALA 80 3.777 -2.619 -4.766 620 HA ALA 80 HA ALA 80 5.120 -1.932 -2.330 621 1HB ALA 80 1HB ALA 80 5.471 0.423 -2.822 622 2HB ALA 80 2HB ALA 80 4.911 0.178 -4.476 623 3HB ALA 80 3HB ALA 80 6.405 -0.583 -3.929 624 H ILE 81 H ILE 81 3.791 -0.826 -0.909 625 HA ILE 81 HA ILE 81 1.085 -0.176 -1.875 626 HB ILE 81 HB ILE 81 1.798 -1.293 0.849 627 1HG1 ILE 81 1HG1 ILE 81 0.283 -2.566 -1.443 628 2HG1 ILE 81 2HG1 ILE 81 1.917 -2.988 -0.945 629 1HG2 ILE 81 1HG2 ILE 81 -0.629 -1.366 1.209 630 2HG2 ILE 81 2HG2 ILE 81 -0.879 -0.601 -0.361 631 3HG2 ILE 81 3HG2 ILE 81 -0.061 0.281 0.930 632 1HD1 ILE 81 1HD1 ILE 81 0.318 -4.605 -0.127 633 2HD1 ILE 81 2HD1 ILE 81 -0.583 -3.330 0.694 634 3HD1 ILE 81 3HD1 ILE 81 1.052 -3.733 1.220 635 H ILE 82 H ILE 82 0.731 1.943 -1.713 636 HA ILE 82 HA ILE 82 2.305 3.447 0.280 637 HB ILE 82 HB ILE 82 0.999 4.811 -2.048 638 1HG1 ILE 82 1HG1 ILE 82 2.210 2.874 -3.027 639 2HG1 ILE 82 2HG1 ILE 82 2.928 4.416 -3.481 640 1HG2 ILE 82 1HG2 ILE 82 2.957 6.294 -1.841 641 2HG2 ILE 82 2HG2 ILE 82 3.573 5.278 -0.539 642 3HG2 ILE 82 3HG2 ILE 82 2.062 6.163 -0.327 643 1HD1 ILE 82 1HD1 ILE 82 4.678 4.087 -1.815 644 2HD1 ILE 82 2HD1 ILE 82 4.625 2.750 -2.966 645 3HD1 ILE 82 3HD1 ILE 82 3.949 2.552 -1.349 646 H ASN 83 H ASN 83 1.132 4.072 1.975 647 HA ASN 83 HA ASN 83 -1.771 4.458 1.612 648 1HB ASN 83 1HB ASN 83 -0.240 3.702 4.109 649 2HB ASN 83 2HB ASN 83 -1.965 4.021 4.054 650 1HD2 ASN 83 1HD2 ASN 83 -3.336 2.484 3.281 651 2HD2 ASN 83 2HD2 ASN 83 -2.838 0.878 2.890 652 H LYS 84 H LYS 84 -2.767 6.204 2.693 653 HA LYS 84 HA LYS 84 -1.225 8.578 2.918 654 1HB LYS 84 1HB LYS 84 -3.796 8.273 2.502 655 2HB LYS 84 2HB LYS 84 -3.900 8.237 4.254 656 1HG LYS 84 1HG LYS 84 -2.749 10.504 2.632 657 2HG LYS 84 2HG LYS 84 -4.373 10.459 3.317 658 1HD LYS 84 1HD LYS 84 -3.416 10.317 5.564 659 2HD LYS 84 2HD LYS 84 -1.792 10.363 4.880 660 1HE LYS 84 1HE LYS 84 -2.317 12.555 5.650 661 2HE LYS 84 2HE LYS 84 -2.366 12.586 3.888 662 1HZ LYS 84 1HZ LYS 84 -4.241 13.727 5.107 663 2HZ LYS 84 2HZ LYS 84 -4.802 12.187 5.518 664 3HZ LYS 84 3HZ LYS 84 -4.694 12.645 3.887 665 H LYS 85 H LYS 85 -2.674 6.364 5.264 666 HA LYS 85 HA LYS 85 -0.561 7.070 7.151 667 1HB LYS 85 1HB LYS 85 -2.429 8.495 7.764 668 2HB LYS 85 2HB LYS 85 -3.510 7.111 7.799 669 1HG LYS 85 1HG LYS 85 -2.534 6.262 9.755 670 2HG LYS 85 2HG LYS 85 -1.121 7.311 9.602 671 1HD LYS 85 1HD LYS 85 -2.743 8.039 11.348 672 2HD LYS 85 2HD LYS 85 -2.425 9.253 10.111 673 1HE LYS 85 1HE LYS 85 -4.780 9.216 10.558 674 2HE LYS 85 2HE LYS 85 -4.501 8.541 8.953 675 1HZ LYS 85 1HZ LYS 85 -6.112 7.249 10.215 676 2HZ LYS 85 2HZ LYS 85 -4.962 6.965 11.427 677 3HZ LYS 85 3HZ LYS 85 -4.732 6.325 9.871 678 H THR 86 H THR 86 0.362 5.290 7.880 679 HA THR 86 HA THR 86 -0.774 2.732 7.144 680 HB THR 86 HB THR 86 1.860 3.173 8.534 681 HG1 THR 86 HG1 THR 86 1.232 3.479 5.768 682 1HG2 THR 86 1HG2 THR 86 1.131 0.854 8.249 683 2HG2 THR 86 2HG2 THR 86 2.522 1.203 7.221 684 3HG2 THR 86 3HG2 THR 86 0.903 1.130 6.522 685 H GLU 87 H GLU 87 -1.143 0.999 8.532 686 HA GLU 87 HA GLU 87 -1.118 1.586 11.419 687 1HB GLU 87 1HB GLU 87 -3.354 1.023 9.977 688 2HB GLU 87 2HB GLU 87 -2.856 -0.600 10.424 689 1HG GLU 87 1HG GLU 87 -3.331 1.648 12.374 690 2HG GLU 87 2HG GLU 87 -4.499 0.395 11.973 691 H THR 88 H THR 88 -0.659 -0.285 12.774 692 HA THR 88 HA THR 88 1.798 -1.371 12.212 693 HB THR 88 HB THR 88 -0.201 -2.718 14.017 694 HG1 THR 88 HG1 THR 88 -0.366 -0.616 14.626 695 1HG2 THR 88 1HG2 THR 88 1.792 -3.121 15.406 696 2HG2 THR 88 2HG2 THR 88 2.793 -2.324 14.191 697 3HG2 THR 88 3HG2 THR 88 1.963 -3.829 13.799 698 H ILE 89 H ILE 89 -1.339 -3.069 11.976 699 HA ILE 89 HA ILE 89 -0.342 -5.591 11.330 700 HB ILE 89 HB ILE 89 -2.962 -4.382 10.431 701 1HG1 ILE 89 1HG1 ILE 89 -2.289 -5.990 12.902 702 2HG1 ILE 89 2HG1 ILE 89 -2.625 -4.265 12.867 703 1HG2 ILE 89 1HG2 ILE 89 -2.418 -6.412 9.198 704 2HG2 ILE 89 2HG2 ILE 89 -3.757 -6.694 10.311 705 3HG2 ILE 89 3HG2 ILE 89 -2.141 -7.269 10.715 706 1HD1 ILE 89 1HD1 ILE 89 -4.896 -4.713 12.122 707 2HD1 ILE 89 2HD1 ILE 89 -4.545 -5.531 13.644 708 3HD1 ILE 89 3HD1 ILE 89 -4.563 -6.445 12.135 709 H ILE 90 H ILE 90 -1.157 -2.878 9.237 710 HA ILE 90 HA ILE 90 -0.870 -4.288 6.783 711 HB ILE 90 HB ILE 90 -0.591 -1.300 7.145 712 1HG1 ILE 90 1HG1 ILE 90 -3.164 -2.855 6.793 713 2HG1 ILE 90 2HG1 ILE 90 -2.621 -2.186 8.328 714 1HG2 ILE 90 1HG2 ILE 90 -0.060 -2.139 4.930 715 2HG2 ILE 90 2HG2 ILE 90 -1.579 -1.240 4.893 716 3HG2 ILE 90 3HG2 ILE 90 -1.596 -3.003 4.867 717 1HD1 ILE 90 1HD1 ILE 90 -2.698 0.067 7.339 718 2HD1 ILE 90 2HD1 ILE 90 -4.264 -0.742 7.326 719 3HD1 ILE 90 3HD1 ILE 90 -3.314 -0.636 5.843 720 H ALA 91 H ALA 91 1.232 -2.187 8.701 721 HA ALA 91 HA ALA 91 3.356 -2.063 6.840 722 1HB ALA 91 1HB ALA 91 4.689 -1.214 8.715 723 2HB ALA 91 2HB ALA 91 3.399 -1.672 9.829 724 3HB ALA 91 3HB ALA 91 3.114 -0.426 8.614 725 H VAL 92 H VAL 92 2.772 -4.185 9.632 726 HA VAL 92 HA VAL 92 5.236 -5.545 9.538 727 HB VAL 92 HB VAL 92 2.551 -6.533 10.530 728 1HG1 VAL 92 1HG1 VAL 92 3.805 -8.186 11.814 729 2HG1 VAL 92 2HG1 VAL 92 5.310 -7.624 11.093 730 3HG1 VAL 92 3HG1 VAL 92 4.087 -8.396 10.084 731 1HG2 VAL 92 1HG2 VAL 92 4.873 -5.271 11.996 732 2HG2 VAL 92 2HG2 VAL 92 3.427 -5.936 12.755 733 3HG2 VAL 92 3HG2 VAL 92 3.299 -4.532 11.696 734 H GLY 93 H GLY 93 2.125 -6.221 7.986 735 1HA GLY 93 1HA GLY 93 2.810 -8.700 6.853 736 2HA GLY 93 2HA GLY 93 1.554 -7.623 6.266 737 H ALA 94 H ALA 94 3.112 -5.409 5.585 738 HA ALA 94 HA ALA 94 4.015 -6.262 3.011 739 1HB ALA 94 1HB ALA 94 4.410 -3.885 2.595 740 2HB ALA 94 2HB ALA 94 4.140 -3.539 4.303 741 3HB ALA 94 3HB ALA 94 2.822 -4.159 3.307 742 H ALA 95 H ALA 95 5.603 -5.121 5.946 743 HA ALA 95 HA ALA 95 8.155 -4.631 4.925 744 1HB ALA 95 1HB ALA 95 7.408 -5.615 7.679 745 2HB ALA 95 2HB ALA 95 7.463 -3.934 7.151 746 3HB ALA 95 3HB ALA 95 8.947 -4.882 7.225 747 H MET 96 H MET 96 6.812 -7.635 6.264 748 HA MET 96 HA MET 96 9.228 -9.099 6.111 749 1HB MET 96 1HB MET 96 6.352 -9.988 6.279 750 2HB MET 96 2HB MET 96 7.704 -11.112 6.295 751 1HG MET 96 1HG MET 96 8.577 -10.023 8.306 752 2HG MET 96 2HG MET 96 7.205 -8.916 8.289 753 1HE MET 96 1HE MET 96 4.794 -10.800 7.432 754 2HE MET 96 2HE MET 96 4.719 -9.625 8.746 755 3HE MET 96 3HE MET 96 4.197 -11.288 9.019 756 H ALA 97 H ALA 97 6.694 -8.479 3.799 757 HA ALA 97 HA ALA 97 7.694 -10.473 1.945 758 1HB ALA 97 1HB ALA 97 5.854 -9.783 0.519 759 2HB ALA 97 2HB ALA 97 5.496 -8.440 1.605 760 3HB ALA 97 3HB ALA 97 5.285 -10.102 2.157 761 H GLU 98 H GLU 98 8.799 -7.553 2.818 762 HA GLU 98 HA GLU 98 10.101 -5.943 1.902 763 1HB GLU 98 1HB GLU 98 10.442 -8.038 -0.243 764 2HB GLU 98 2HB GLU 98 11.306 -6.508 -0.247 765 1HG GLU 98 1HG GLU 98 12.208 -7.108 2.005 766 2HG GLU 98 2HG GLU 98 11.493 -8.706 1.791 767 H ILE 99 H ILE 99 7.379 -5.705 1.556 768 HA ILE 99 HA ILE 99 7.087 -4.506 -1.106 769 HB ILE 99 HB ILE 99 4.960 -5.095 0.966 770 1HG1 ILE 99 1HG1 ILE 99 5.580 -6.497 -1.646 771 2HG1 ILE 99 2HG1 ILE 99 5.934 -7.133 -0.042 772 1HG2 ILE 99 1HG2 ILE 99 4.388 -3.187 -0.429 773 2HG2 ILE 99 2HG2 ILE 99 3.372 -4.572 -0.830 774 3HG2 ILE 99 3HG2 ILE 99 4.718 -4.131 -1.881 775 1HD1 ILE 99 1HD1 ILE 99 3.932 -8.136 -1.000 776 2HD1 ILE 99 2HD1 ILE 99 3.189 -6.541 -1.130 777 3HD1 ILE 99 3HD1 ILE 99 3.557 -7.217 0.456 778 HA PRO 100 HA PRO 100 8.484 -0.972 1.434 779 1HB PRO 100 1HB PRO 100 8.338 0.731 -0.796 780 2HB PRO 100 2HB PRO 100 9.775 -0.103 -0.202 781 1HG PRO 100 1HG PRO 100 7.925 -0.847 -2.410 782 2HG PRO 100 2HG PRO 100 9.675 -1.098 -2.272 783 1HD PRO 100 1HD PRO 100 7.954 -3.116 -1.934 784 2HD PRO 100 2HD PRO 100 9.426 -2.988 -0.950 785 H LEU 101 H LEU 101 6.701 -0.635 2.692 786 HA LEU 101 HA LEU 101 4.465 0.868 1.560 787 1HB LEU 101 1HB LEU 101 4.327 -1.198 3.179 788 2HB LEU 101 2HB LEU 101 4.681 -0.015 4.420 789 HG LEU 101 HG LEU 101 2.316 0.130 2.548 790 1HD1 LEU 101 1HD1 LEU 101 0.996 -0.533 4.496 791 2HD1 LEU 101 2HD1 LEU 101 2.483 -0.770 5.415 792 3HD1 LEU 101 3HD1 LEU 101 2.138 -1.789 4.017 793 1HD2 LEU 101 1HD2 LEU 101 3.054 2.308 3.395 794 2HD2 LEU 101 2HD2 LEU 101 2.958 1.694 5.046 795 3HD2 LEU 101 3HD2 LEU 101 1.495 1.839 4.071 796 H VAL 102 H VAL 102 4.318 3.004 1.856 797 HA VAL 102 HA VAL 102 5.934 4.247 3.968 798 HB VAL 102 HB VAL 102 6.546 6.097 2.463 799 1HG1 VAL 102 1HG1 VAL 102 8.068 4.185 2.789 800 2HG1 VAL 102 2HG1 VAL 102 8.258 4.938 1.206 801 3HG1 VAL 102 3HG1 VAL 102 7.379 3.417 1.361 802 1HG2 VAL 102 1HG2 VAL 102 6.259 5.852 0.038 803 2HG2 VAL 102 2HG2 VAL 102 4.712 5.946 0.878 804 3HG2 VAL 102 3HG2 VAL 102 5.309 4.389 0.306 805 H GLU 103 H GLU 103 5.239 6.413 4.534 806 HA GLU 103 HA GLU 103 2.335 6.614 4.547 807 1HB GLU 103 1HB GLU 103 3.496 6.864 6.661 808 2HB GLU 103 2HB GLU 103 4.502 8.145 6.004 809 1HG GLU 103 1HG GLU 103 2.349 9.447 5.662 810 2HG GLU 103 2HG GLU 103 1.579 8.223 6.673 811 H VAL 104 H VAL 104 1.247 7.925 3.212 812 HA VAL 104 HA VAL 104 2.689 9.841 1.581 813 HB VAL 104 HB VAL 104 -0.256 9.148 1.614 814 1HG1 VAL 104 1HG1 VAL 104 0.141 11.416 0.800 815 2HG1 VAL 104 2HG1 VAL 104 -0.375 10.346 -0.504 816 3HG1 VAL 104 3HG1 VAL 104 1.324 10.795 -0.352 817 1HG2 VAL 104 1HG2 VAL 104 1.939 8.358 -0.290 818 2HG2 VAL 104 2HG2 VAL 104 0.226 7.981 -0.481 819 3HG2 VAL 104 3HG2 VAL 104 1.138 7.297 0.867 820 H ARG 105 H ARG 105 3.259 11.593 2.727 821 HA ARG 105 HA ARG 105 1.471 12.895 4.565 822 1HB ARG 105 1HB ARG 105 3.932 12.935 4.846 823 2HB ARG 105 2HB ARG 105 4.070 13.856 3.354 824 1HG ARG 105 1HG ARG 105 2.764 15.674 4.387 825 2HG ARG 105 2HG ARG 105 2.724 14.755 5.894 826 1HD ARG 105 1HD ARG 105 5.185 15.776 4.481 827 2HD ARG 105 2HD ARG 105 4.489 16.417 5.969 828 HE ARG 105 HE ARG 105 4.950 14.011 6.810 829 1HH1 ARG 105 1HH1 ARG 105 6.961 15.824 4.581 830 2HH1 ARG 105 2HH1 ARG 105 8.432 15.032 5.084 831 1HH2 ARG 105 1HH2 ARG 105 6.851 13.002 7.481 832 2HH2 ARG 105 2HH2 ARG 105 8.375 13.433 6.751 833 H ASP 106 H ASP 106 2.491 13.271 1.244 834 HA ASP 106 HA ASP 106 0.985 15.736 0.920 835 1HB ASP 106 1HB ASP 106 3.201 15.475 -0.160 836 2HB ASP 106 2HB ASP 106 2.561 14.135 -1.107 837 H GLU 107 H GLU 107 -1.163 15.404 0.851 838 HA GLU 107 HA GLU 107 -2.316 12.957 -0.035 839 1HB GLU 107 1HB GLU 107 -3.227 14.576 1.707 840 2HB GLU 107 2HB GLU 107 -3.803 15.546 0.363 841 1HG GLU 107 1HG GLU 107 -5.290 13.869 -0.352 842 2HG GLU 107 2HG GLU 107 -4.529 12.650 0.666 843 H LYS 108 H LYS 108 -1.308 15.749 -1.653 844 HA LYS 108 HA LYS 108 -3.069 15.845 -3.833 845 1HB LYS 108 1HB LYS 108 -0.152 16.591 -3.592 846 2HB LYS 108 2HB LYS 108 -1.139 16.949 -4.995 847 1HG LYS 108 1HG LYS 108 -1.773 17.908 -2.222 848 2HG LYS 108 2HG LYS 108 -0.864 18.843 -3.411 849 1HD LYS 108 1HD LYS 108 -3.668 17.798 -3.785 850 2HD LYS 108 2HD LYS 108 -3.246 19.458 -3.357 851 1HE LYS 108 1HE LYS 108 -2.020 19.694 -5.450 852 2HE LYS 108 2HE LYS 108 -2.404 18.028 -5.875 853 1HZ LYS 108 1HZ LYS 108 -4.377 20.208 -5.480 854 2HZ LYS 108 2HZ LYS 108 -4.745 18.607 -5.905 855 3HZ LYS 108 3HZ LYS 108 -3.870 19.593 -6.979 856 H PHE 109 H PHE 109 -0.473 13.680 -3.028 857 HA PHE 109 HA PHE 109 0.112 12.630 -5.550 858 1HB PHE 109 1HB PHE 109 1.467 12.112 -3.600 859 2HB PHE 109 2HB PHE 109 0.116 11.278 -2.844 860 HD1 PHE 109 HD1 PHE 109 0.076 8.995 -2.956 861 HD2 PHE 109 HD2 PHE 109 2.097 11.168 -6.007 862 HE1 PHE 109 HE1 PHE 109 0.809 6.879 -3.975 863 HE2 PHE 109 HE2 PHE 109 2.832 9.056 -7.030 864 HZ PHE 109 HZ PHE 109 2.188 6.909 -6.013 865 H PHE 110 H PHE 110 -2.500 11.906 -3.300 866 HA PHE 110 HA PHE 110 -3.436 9.606 -4.708 867 1HB PHE 110 1HB PHE 110 -4.656 11.345 -2.571 868 2HB PHE 110 2HB PHE 110 -5.542 10.014 -3.309 869 HD1 PHE 110 HD1 PHE 110 -4.544 7.692 -3.168 870 HD2 PHE 110 HD2 PHE 110 -3.165 10.960 -0.815 871 HE1 PHE 110 HE1 PHE 110 -3.522 6.113 -1.585 872 HE2 PHE 110 HE2 PHE 110 -2.139 9.383 0.773 873 HZ PHE 110 HZ PHE 110 -2.316 6.958 0.388 874 H GLU 111 H GLU 111 -3.846 12.993 -5.078 875 HA GLU 111 HA GLU 111 -6.284 12.868 -6.562 876 1HB GLU 111 1HB GLU 111 -4.247 14.961 -5.913 877 2HB GLU 111 2HB GLU 111 -5.470 15.263 -7.120 878 1HG GLU 111 1HG GLU 111 -7.208 14.752 -5.424 879 2HG GLU 111 2HG GLU 111 -5.922 14.596 -4.228 880 H ALA 112 H ALA 112 -2.866 12.845 -7.258 881 HA ALA 112 HA ALA 112 -3.265 13.253 -10.097 882 1HB ALA 112 1HB ALA 112 -0.731 12.590 -8.607 883 2HB ALA 112 2HB ALA 112 -1.329 14.219 -8.920 884 3HB ALA 112 3HB ALA 112 -0.860 13.179 -10.266 885 H VAL 113 H VAL 113 -2.735 10.565 -7.922 886 HA VAL 113 HA VAL 113 -1.863 8.766 -9.963 887 HB VAL 113 HB VAL 113 -1.177 8.445 -7.631 888 1HG1 VAL 113 1HG1 VAL 113 -3.214 9.152 -6.505 889 2HG1 VAL 113 2HG1 VAL 113 -2.722 7.545 -5.970 890 3HG1 VAL 113 3HG1 VAL 113 -4.056 7.724 -7.110 891 1HG2 VAL 113 1HG2 VAL 113 -1.536 6.030 -7.497 892 2HG2 VAL 113 2HG2 VAL 113 -1.140 6.538 -9.138 893 3HG2 VAL 113 3HG2 VAL 113 -2.808 6.154 -8.713 894 H LYS 114 H LYS 114 -3.008 7.631 -11.340 895 HA LYS 114 HA LYS 114 -5.810 6.973 -10.723 896 1HB LYS 114 1HB LYS 114 -4.683 7.894 -13.378 897 2HB LYS 114 2HB LYS 114 -6.274 7.180 -13.187 898 1HG LYS 114 1HG LYS 114 -5.564 9.591 -11.586 899 2HG LYS 114 2HG LYS 114 -5.967 9.770 -13.294 900 1HD LYS 114 1HD LYS 114 -8.009 10.079 -12.207 901 2HD LYS 114 2HD LYS 114 -8.069 8.397 -12.727 902 1HE LYS 114 1HE LYS 114 -7.473 7.658 -10.503 903 2HE LYS 114 2HE LYS 114 -7.284 9.325 -9.968 904 1HZ LYS 114 1HZ LYS 114 -9.395 8.640 -9.237 905 2HZ LYS 114 2HZ LYS 114 -9.787 7.924 -10.719 906 3HZ LYS 114 3HZ LYS 114 -9.699 9.614 -10.593 907 H THR 115 H THR 115 -6.560 5.029 -11.942 908 HA THR 115 HA THR 115 -4.658 2.942 -11.750 909 HB THR 115 HB THR 115 -7.385 2.931 -13.065 910 HG1 THR 115 HG1 THR 115 -8.153 2.535 -11.104 911 1HG2 THR 115 1HG2 THR 115 -5.636 0.635 -12.175 912 2HG2 THR 115 2HG2 THR 115 -6.033 1.056 -13.841 913 3HG2 THR 115 3HG2 THR 115 -7.297 0.491 -12.747 914 H GLY 116 H GLY 116 -3.175 2.310 -13.186 915 1HA GLY 116 1HA GLY 116 -2.669 1.445 -15.376 916 2HA GLY 116 2HA GLY 116 -3.766 2.637 -16.057 917 H ASP 117 H ASP 117 -2.146 4.237 -13.732 918 HA ASP 117 HA ASP 117 -0.358 5.490 -15.649 919 1HB ASP 117 1HB ASP 117 -1.827 6.653 -13.826 920 2HB ASP 117 2HB ASP 117 -0.527 6.198 -12.729 921 H ARG 118 H ARG 118 1.956 6.085 -14.566 922 HA ARG 118 HA ARG 118 2.951 3.566 -13.397 923 1HB ARG 118 1HB ARG 118 3.761 3.957 -15.725 924 2HB ARG 118 2HB ARG 118 4.569 5.412 -15.153 925 1HG ARG 118 1HG ARG 118 5.769 3.930 -13.495 926 2HG ARG 118 2HG ARG 118 5.130 2.556 -14.398 927 1HD ARG 118 1HD ARG 118 7.327 2.974 -15.202 928 2HD ARG 118 2HD ARG 118 6.206 3.527 -16.445 929 HE ARG 118 HE ARG 118 6.630 5.800 -15.675 930 1HH1 ARG 118 1HH1 ARG 118 8.919 3.313 -14.687 931 2HH1 ARG 118 2HH1 ARG 118 10.206 4.450 -14.408 932 1HH2 ARG 118 1HH2 ARG 118 8.344 7.270 -15.308 933 2HH2 ARG 118 2HH2 ARG 118 9.876 6.685 -14.740 934 H VAL 119 H VAL 119 3.674 3.745 -11.441 935 HA VAL 119 HA VAL 119 4.746 6.352 -10.573 936 HB VAL 119 HB VAL 119 3.194 4.348 -8.921 937 1HG1 VAL 119 1HG1 VAL 119 4.995 5.253 -7.577 938 2HG1 VAL 119 2HG1 VAL 119 3.456 5.944 -7.060 939 3HG1 VAL 119 3HG1 VAL 119 4.562 6.895 -8.054 940 1HG2 VAL 119 1HG2 VAL 119 2.583 7.219 -9.623 941 2HG2 VAL 119 2HG2 VAL 119 1.578 6.138 -8.656 942 3HG2 VAL 119 3HG2 VAL 119 1.840 5.804 -10.368 943 H VAL 120 H VAL 120 6.785 6.363 -9.975 944 HA VAL 120 HA VAL 120 8.122 3.823 -9.336 945 HB VAL 120 HB VAL 120 9.365 6.517 -9.926 946 1HG1 VAL 120 1HG1 VAL 120 11.449 5.271 -10.168 947 2HG1 VAL 120 2HG1 VAL 120 10.610 3.773 -9.762 948 3HG1 VAL 120 3HG1 VAL 120 10.766 5.050 -8.556 949 1HG2 VAL 120 1HG2 VAL 120 8.963 4.132 -11.726 950 2HG2 VAL 120 2HG2 VAL 120 9.957 5.534 -12.119 951 3HG2 VAL 120 3HG2 VAL 120 8.217 5.722 -11.895 952 H VAL 121 H VAL 121 8.128 3.392 -7.222 953 HA VAL 121 HA VAL 121 8.114 5.653 -5.357 954 HB VAL 121 HB VAL 121 6.272 4.154 -4.997 955 1HG1 VAL 121 1HG1 VAL 121 7.203 2.143 -6.013 956 2HG1 VAL 121 2HG1 VAL 121 6.574 1.809 -4.399 957 3HG1 VAL 121 3HG1 VAL 121 8.312 1.964 -4.654 958 1HG2 VAL 121 1HG2 VAL 121 6.615 3.563 -2.657 959 2HG2 VAL 121 2HG2 VAL 121 7.295 5.151 -3.016 960 3HG2 VAL 121 3HG2 VAL 121 8.357 3.751 -2.857 961 H ASN 122 H ASN 122 9.941 6.239 -4.503 962 HA ASN 122 HA ASN 122 12.064 4.260 -4.102 963 1HB ASN 122 1HB ASN 122 12.036 7.268 -4.216 964 2HB ASN 122 2HB ASN 122 13.381 6.410 -3.474 965 1HD2 ASN 122 1HD2 ASN 122 14.765 7.257 -5.037 966 2HD2 ASN 122 2HD2 ASN 122 14.808 6.635 -6.646 967 H ALA 123 H ALA 123 11.290 3.216 -2.253 968 HA ALA 123 HA ALA 123 10.837 4.762 0.158 969 1HB ALA 123 1HB ALA 123 9.594 2.685 -0.199 970 2HB ALA 123 2HB ALA 123 10.589 2.590 1.254 971 3HB ALA 123 3HB ALA 123 11.108 1.780 -0.224 972 H ASP 124 H ASP 124 13.387 4.049 -1.622 973 HA ASP 124 HA ASP 124 15.348 3.499 0.424 974 1HB ASP 124 1HB ASP 124 15.488 2.686 -1.960 975 2HB ASP 124 2HB ASP 124 15.737 4.354 -2.455 976 H GLU 125 H GLU 125 13.558 6.091 -0.347 977 HA GLU 125 HA GLU 125 15.493 8.016 0.670 978 1HB GLU 125 1HB GLU 125 15.305 7.809 -2.004 979 2HB GLU 125 2HB GLU 125 13.938 8.873 -1.725 980 1HG GLU 125 1HG GLU 125 16.777 9.411 -0.893 981 2HG GLU 125 2HG GLU 125 15.965 10.099 -2.297 982 H GLY 126 H GLY 126 12.220 7.342 -0.493 983 1HA GLY 126 1HA GLY 126 10.267 7.782 0.822 984 2HA GLY 126 2HA GLY 126 11.140 9.089 1.617 985 H TYR 127 H TYR 127 10.432 8.169 -1.744 986 HA TYR 127 HA TYR 127 9.286 10.757 -2.304 987 1HB TYR 127 1HB TYR 127 11.902 10.893 -2.324 988 2HB TYR 127 2HB TYR 127 11.760 10.036 -3.853 989 HD1 TYR 127 HD1 TYR 127 10.900 13.153 -2.075 990 HD2 TYR 127 HD2 TYR 127 11.089 11.175 -5.837 991 HE1 TYR 127 HE1 TYR 127 10.537 15.299 -3.213 992 HE2 TYR 127 HE2 TYR 127 10.726 13.319 -6.984 993 HH TYR 127 HH TYR 127 9.716 15.532 -6.473 994 H VAL 128 H VAL 128 8.049 10.695 -4.167 995 HA VAL 128 HA VAL 128 8.116 8.153 -5.651 996 HB VAL 128 HB VAL 128 5.627 8.339 -5.897 997 1HG1 VAL 128 1HG1 VAL 128 6.665 8.034 -3.082 998 2HG1 VAL 128 2HG1 VAL 128 6.646 6.779 -4.320 999 3HG1 VAL 128 3HG1 VAL 128 5.127 7.418 -3.690 1000 1HG2 VAL 128 1HG2 VAL 128 5.911 10.383 -3.694 1001 2HG2 VAL 128 2HG2 VAL 128 4.393 9.700 -4.280 1002 3HG2 VAL 128 3HG2 VAL 128 5.379 10.704 -5.343 1003 H GLU 129 H GLU 129 8.316 8.341 -7.757 1004 HA GLU 129 HA GLU 129 7.861 10.966 -8.987 1005 1HB GLU 129 1HB GLU 129 9.442 8.565 -9.921 1006 2HB GLU 129 2HB GLU 129 9.178 10.004 -10.897 1007 1HG GLU 129 1HG GLU 129 10.351 11.358 -9.260 1008 2HG GLU 129 2HG GLU 129 10.566 9.945 -8.228 1009 H LEU 130 H LEU 130 5.930 11.195 -9.834 1010 HA LEU 130 HA LEU 130 4.647 8.862 -11.082 1011 1HB LEU 130 1HB LEU 130 3.473 9.952 -9.152 1012 2HB LEU 130 2HB LEU 130 3.345 11.412 -10.112 1013 HG LEU 130 HG LEU 130 2.186 8.861 -11.179 1014 1HD1 LEU 130 1HD1 LEU 130 0.067 9.409 -10.042 1015 2HD1 LEU 130 2HD1 LEU 130 0.904 10.665 -9.129 1016 3HD1 LEU 130 3HD1 LEU 130 1.346 8.972 -8.911 1017 1HD2 LEU 130 1HD2 LEU 130 1.384 11.766 -11.383 1018 2HD2 LEU 130 2HD2 LEU 130 0.584 10.415 -12.186 1019 3HD2 LEU 130 3HD2 LEU 130 2.240 10.840 -12.618 1020 H ILE 131 H ILE 131 4.311 8.892 -13.220 1021 HA ILE 131 HA ILE 131 4.612 11.469 -14.620 1022 HB ILE 131 HB ILE 131 5.409 8.779 -15.694 1023 1HG1 ILE 131 1HG1 ILE 131 7.740 9.924 -15.746 1024 2HG1 ILE 131 2HG1 ILE 131 7.055 11.034 -14.568 1025 1HG2 ILE 131 1HG2 ILE 131 4.582 10.253 -17.422 1026 2HG2 ILE 131 2HG2 ILE 131 6.323 10.029 -17.593 1027 3HG2 ILE 131 3HG2 ILE 131 5.691 11.520 -16.895 1028 1HD1 ILE 131 1HD1 ILE 131 7.334 8.055 -14.243 1029 2HD1 ILE 131 2HD1 ILE 131 6.620 9.155 -13.063 1030 3HD1 ILE 131 3HD1 ILE 131 8.331 9.293 -13.475 1031 H GLU 132 H GLU 132 2.771 12.040 -15.333 1032 HA GLU 132 HA GLU 132 0.473 10.476 -15.356 1033 1HB GLU 132 1HB GLU 132 0.856 12.949 -17.045 1034 2HB GLU 132 2HB GLU 132 -0.648 12.315 -16.396 1035 1HG GLU 132 1HG GLU 132 -0.277 14.021 -14.944 1036 2HG GLU 132 2HG GLU 132 0.557 12.719 -14.096 Start of MODEL 18 1 H VAL 1 H VAL 1 7.220 16.195 -11.810 2 HA VAL 1 HA VAL 1 6.244 16.789 -9.849 3 HB VAL 1 HB VAL 1 3.890 15.049 -10.595 4 1HG1 VAL 1 1HG1 VAL 1 4.164 17.265 -8.575 5 2HG1 VAL 1 2HG1 VAL 1 3.995 15.545 -8.223 6 3HG1 VAL 1 3HG1 VAL 1 2.666 16.425 -8.977 7 1HG2 VAL 1 1HG2 VAL 1 2.799 17.115 -11.335 8 2HG2 VAL 1 2HG2 VAL 1 4.246 16.779 -12.286 9 3HG2 VAL 1 3HG2 VAL 1 4.287 18.010 -11.024 10 H LYS 2 H LYS 2 6.843 16.064 -7.947 11 HA LYS 2 HA LYS 2 6.910 13.161 -7.472 12 1HB LYS 2 1HB LYS 2 9.206 15.063 -6.959 13 2HB LYS 2 2HB LYS 2 9.185 13.348 -6.573 14 1HG LYS 2 1HG LYS 2 9.086 12.780 -8.914 15 2HG LYS 2 2HG LYS 2 8.963 14.484 -9.354 16 1HD LYS 2 1HD LYS 2 11.229 13.734 -9.697 17 2HD LYS 2 2HD LYS 2 11.188 14.863 -8.344 18 1HE LYS 2 1HE LYS 2 11.172 12.956 -6.784 19 2HE LYS 2 2HE LYS 2 11.285 11.856 -8.156 20 1HZ LYS 2 1HZ LYS 2 13.302 13.848 -7.285 21 2HZ LYS 2 2HZ LYS 2 13.396 12.990 -8.746 22 3HZ LYS 2 3HZ LYS 2 13.450 12.155 -7.269 23 H PHE 3 H PHE 3 5.932 12.710 -5.617 24 HA PHE 3 HA PHE 3 5.594 14.855 -3.651 25 1HB PHE 3 1HB PHE 3 4.204 12.173 -3.850 26 2HB PHE 3 2HB PHE 3 3.837 13.427 -2.674 27 HD1 PHE 3 HD1 PHE 3 2.817 15.556 -3.421 28 HD2 PHE 3 HD2 PHE 3 3.348 12.254 -6.052 29 HE1 PHE 3 HE1 PHE 3 1.190 16.540 -4.980 30 HE2 PHE 3 HE2 PHE 3 1.723 13.236 -7.618 31 HZ PHE 3 HZ PHE 3 0.642 15.384 -7.083 32 H ALA 4 H ALA 4 6.040 14.527 -1.450 33 HA ALA 4 HA ALA 4 8.124 12.523 -0.966 34 1HB ALA 4 1HB ALA 4 7.438 15.006 0.608 35 2HB ALA 4 2HB ALA 4 8.749 14.857 -0.562 36 3HB ALA 4 3HB ALA 4 8.786 13.917 0.930 37 H CYS 5 H CYS 5 7.744 10.837 0.299 38 HA CYS 5 HA CYS 5 5.422 10.929 2.104 39 1HB CYS 5 1HB CYS 5 5.413 8.394 1.738 40 2HB CYS 5 2HB CYS 5 4.858 9.396 0.402 41 HG CYS 5 HG CYS 5 6.377 8.270 -1.306 42 H ARG 6 H ARG 6 5.651 9.239 3.903 43 HA ARG 6 HA ARG 6 8.332 9.527 5.028 44 1HB ARG 6 1HB ARG 6 6.355 10.170 6.393 45 2HB ARG 6 2HB ARG 6 5.815 8.498 6.351 46 1HG ARG 6 1HG ARG 6 6.962 9.100 8.448 47 2HG ARG 6 2HG ARG 6 7.761 7.787 7.578 48 1HD ARG 6 1HD ARG 6 9.415 9.320 6.708 49 2HD ARG 6 2HD ARG 6 8.582 10.688 7.444 50 HE ARG 6 HE ARG 6 9.096 9.353 9.618 51 1HH1 ARG 6 1HH1 ARG 6 11.185 9.554 6.812 52 2HH1 ARG 6 2HH1 ARG 6 12.655 9.520 7.748 53 1HH2 ARG 6 1HH2 ARG 6 11.005 9.290 10.841 54 2HH2 ARG 6 2HH2 ARG 6 12.548 9.380 10.046 55 H ALA 7 H ALA 7 9.732 7.965 4.931 56 HA ALA 7 HA ALA 7 9.120 5.482 3.695 57 1HB ALA 7 1HB ALA 7 11.266 6.597 3.394 58 2HB ALA 7 2HB ALA 7 11.483 4.972 4.041 59 3HB ALA 7 3HB ALA 7 11.631 6.371 5.105 60 H ILE 8 H ILE 8 8.228 3.780 4.623 61 HA ILE 8 HA ILE 8 8.682 3.290 7.481 62 HB ILE 8 HB ILE 8 6.717 1.932 5.615 63 1HG1 ILE 8 1HG1 ILE 8 6.125 4.283 5.941 64 2HG1 ILE 8 2HG1 ILE 8 4.988 3.240 6.786 65 1HG2 ILE 8 1HG2 ILE 8 6.968 1.814 8.616 66 2HG2 ILE 8 2HG2 ILE 8 7.400 0.528 7.489 67 3HG2 ILE 8 3HG2 ILE 8 5.718 1.033 7.650 68 1HD1 ILE 8 1HD1 ILE 8 7.267 4.739 8.053 69 2HD1 ILE 8 2HD1 ILE 8 6.107 3.712 8.896 70 3HD1 ILE 8 3HD1 ILE 8 5.565 5.194 8.109 71 H THR 9 H THR 9 8.744 1.666 4.326 72 HA THR 9 HA THR 9 10.678 -0.277 5.417 73 HB THR 9 HB THR 9 9.436 -0.782 2.771 74 HG1 THR 9 HG1 THR 9 7.975 -0.659 5.199 75 1HG2 THR 9 1HG2 THR 9 9.811 -2.492 5.235 76 2HG2 THR 9 2HG2 THR 9 10.928 -2.404 3.876 77 3HG2 THR 9 3HG2 THR 9 9.309 -3.064 3.644 78 H ARG 10 H ARG 10 11.794 -1.141 3.003 79 HA ARG 10 HA ARG 10 12.802 1.289 1.705 80 1HB ARG 10 1HB ARG 10 14.486 -1.042 2.639 81 2HB ARG 10 2HB ARG 10 15.064 0.268 1.622 82 1HG ARG 10 1HG ARG 10 14.549 1.858 3.437 83 2HG ARG 10 2HG ARG 10 14.074 0.498 4.456 84 1HD ARG 10 1HD ARG 10 16.326 -0.445 4.232 85 2HD ARG 10 2HD ARG 10 16.794 0.928 3.229 86 HE ARG 10 HE ARG 10 15.889 1.316 6.012 87 1HH1 ARG 10 1HH1 ARG 10 18.240 1.727 3.468 88 2HH1 ARG 10 2HH1 ARG 10 19.327 2.684 4.420 89 1HH2 ARG 10 1HH2 ARG 10 17.293 2.595 7.302 90 2HH2 ARG 10 2HH2 ARG 10 18.765 3.209 6.608 91 H GLY 11 H GLY 11 14.061 0.657 -0.361 92 1HA GLY 11 1HA GLY 11 14.270 -1.046 -2.108 93 2HA GLY 11 2HA GLY 11 12.667 -1.610 -1.656 94 H ARG 12 H ARG 12 13.587 -0.774 -4.285 95 HA ARG 12 HA ARG 12 11.682 1.435 -4.693 96 1HB ARG 12 1HB ARG 12 14.294 0.934 -6.121 97 2HB ARG 12 2HB ARG 12 13.042 1.977 -6.777 98 1HG ARG 12 1HG ARG 12 14.495 3.446 -5.734 99 2HG ARG 12 2HG ARG 12 13.204 3.241 -4.552 100 1HD ARG 12 1HD ARG 12 15.332 3.150 -3.429 101 2HD ARG 12 2HD ARG 12 14.592 1.550 -3.397 102 HE ARG 12 HE ARG 12 16.357 1.920 -5.624 103 1HH1 ARG 12 1HH1 ARG 12 16.241 1.102 -2.211 104 2HH1 ARG 12 2HH1 ARG 12 17.735 0.215 -2.261 105 1HH2 ARG 12 1HH2 ARG 12 18.289 0.766 -5.686 106 2HH2 ARG 12 2HH2 ARG 12 18.897 -0.007 -4.249 107 H ALA 13 H ALA 13 10.035 0.997 -6.002 108 HA ALA 13 HA ALA 13 10.235 -1.340 -7.771 109 1HB ALA 13 1HB ALA 13 7.937 -0.805 -5.892 110 2HB ALA 13 2HB ALA 13 9.156 -2.068 -5.702 111 3HB ALA 13 3HB ALA 13 8.041 -2.118 -7.067 112 H GLU 14 H GLU 14 9.369 -1.068 -9.721 113 HA GLU 14 HA GLU 14 7.834 1.400 -10.203 114 1HB GLU 14 1HB GLU 14 10.038 1.488 -11.244 115 2HB GLU 14 2HB GLU 14 9.762 -0.063 -12.024 116 1HG GLU 14 1HG GLU 14 7.845 1.000 -13.244 117 2HG GLU 14 2HG GLU 14 8.384 2.547 -12.592 118 H GLY 15 H GLY 15 5.825 1.143 -10.974 119 1HA GLY 15 1HA GLY 15 5.174 -0.892 -12.874 120 2HA GLY 15 2HA GLY 15 4.509 -1.249 -11.286 121 H GLU 16 H GLU 16 2.620 -1.034 -13.007 122 HA GLU 16 HA GLU 16 1.704 1.625 -13.480 123 1HB GLU 16 1HB GLU 16 0.458 -1.105 -13.729 124 2HB GLU 16 2HB GLU 16 -0.476 0.353 -13.968 125 1HG GLU 16 1HG GLU 16 0.158 -0.352 -16.106 126 2HG GLU 16 2HG GLU 16 1.209 1.009 -15.725 127 H ALA 17 H ALA 17 0.423 2.861 -12.258 128 HA ALA 17 HA ALA 17 -0.029 2.075 -9.526 129 1HB ALA 17 1HB ALA 17 -0.857 4.349 -9.229 130 2HB ALA 17 2HB ALA 17 -0.792 4.608 -10.972 131 3HB ALA 17 3HB ALA 17 0.696 4.342 -10.063 132 H LEU 18 H LEU 18 -1.732 1.040 -8.850 133 HA LEU 18 HA LEU 18 -4.259 1.237 -10.343 134 1HB LEU 18 1HB LEU 18 -3.136 -1.008 -10.035 135 2HB LEU 18 2HB LEU 18 -3.417 -0.843 -8.316 136 HG LEU 18 HG LEU 18 -5.712 -0.768 -10.257 137 1HD1 LEU 18 1HD1 LEU 18 -5.969 -3.175 -9.937 138 2HD1 LEU 18 2HD1 LEU 18 -4.456 -3.219 -9.031 139 3HD1 LEU 18 3HD1 LEU 18 -4.446 -2.795 -10.743 140 1HD2 LEU 18 1HD2 LEU 18 -6.963 -1.586 -8.340 141 2HD2 LEU 18 2HD2 LEU 18 -6.123 -0.090 -7.934 142 3HD2 LEU 18 3HD2 LEU 18 -5.486 -1.636 -7.375 143 H VAL 19 H VAL 19 -5.681 2.612 -9.449 144 HA VAL 19 HA VAL 19 -5.380 3.206 -6.589 145 HB VAL 19 HB VAL 19 -6.791 4.854 -8.697 146 1HG1 VAL 19 1HG1 VAL 19 -6.050 5.492 -5.841 147 2HG1 VAL 19 2HG1 VAL 19 -7.679 5.217 -6.460 148 3HG1 VAL 19 3HG1 VAL 19 -6.757 6.623 -6.993 149 1HG2 VAL 19 1HG2 VAL 19 -4.851 6.375 -8.489 150 2HG2 VAL 19 2HG2 VAL 19 -4.413 4.799 -9.150 151 3HG2 VAL 19 3HG2 VAL 19 -4.054 5.182 -7.466 152 H THR 20 H THR 20 -6.695 2.061 -5.386 153 HA THR 20 HA THR 20 -9.564 2.197 -5.963 154 HB THR 20 HB THR 20 -8.427 -0.134 -6.482 155 HG1 THR 20 HG1 THR 20 -10.815 0.105 -4.915 156 1HG2 THR 20 1HG2 THR 20 -8.505 -1.667 -4.551 157 2HG2 THR 20 2HG2 THR 20 -8.790 -0.289 -3.489 158 3HG2 THR 20 3HG2 THR 20 -7.268 -0.423 -4.368 159 H LYS 21 H LYS 21 -10.721 2.788 -4.241 160 HA LYS 21 HA LYS 21 -9.116 3.630 -1.961 161 1HB LYS 21 1HB LYS 21 -11.901 4.390 -2.853 162 2HB LYS 21 2HB LYS 21 -11.103 5.039 -1.426 163 1HG LYS 21 1HG LYS 21 -9.630 6.300 -2.649 164 2HG LYS 21 2HG LYS 21 -9.730 5.248 -4.060 165 1HD LYS 21 1HD LYS 21 -10.810 7.367 -4.521 166 2HD LYS 21 2HD LYS 21 -12.009 6.073 -4.493 167 1HE LYS 21 1HE LYS 21 -12.886 7.996 -3.343 168 2HE LYS 21 2HE LYS 21 -12.583 6.713 -2.176 169 1HZ LYS 21 1HZ LYS 21 -10.589 8.842 -2.675 170 2HZ LYS 21 2HZ LYS 21 -10.736 7.819 -1.323 171 3HZ LYS 21 3HZ LYS 21 -11.864 9.060 -1.576 172 H GLU 22 H GLU 22 -12.534 2.823 -2.011 173 HA GLU 22 HA GLU 22 -13.819 1.680 -0.490 174 1HB GLU 22 1HB GLU 22 -11.687 -0.268 -1.332 175 2HB GLU 22 2HB GLU 22 -12.997 -0.756 -0.269 176 1HG GLU 22 1HG GLU 22 -13.447 -1.326 -2.599 177 2HG GLU 22 2HG GLU 22 -14.632 -0.191 -1.960 178 H TYR 23 H TYR 23 -13.374 -0.232 1.391 179 HA TYR 23 HA TYR 23 -11.083 0.468 3.042 180 1HB TYR 23 1HB TYR 23 -13.028 1.825 3.903 181 2HB TYR 23 2HB TYR 23 -13.871 0.315 4.220 182 HD1 TYR 23 HD1 TYR 23 -13.287 -1.063 6.099 183 HD2 TYR 23 HD2 TYR 23 -11.073 2.463 5.239 184 HE1 TYR 23 HE1 TYR 23 -12.242 -1.184 8.321 185 HE2 TYR 23 HE2 TYR 23 -10.019 2.353 7.456 186 HH TYR 23 HH TYR 23 -10.581 1.377 9.709 187 H ILE 24 H ILE 24 -10.117 -1.490 2.922 188 HA ILE 24 HA ILE 24 -11.845 -3.865 3.139 189 HB ILE 24 HB ILE 24 -9.151 -3.667 1.778 190 1HG1 ILE 24 1HG1 ILE 24 -11.903 -3.870 0.535 191 2HG1 ILE 24 2HG1 ILE 24 -10.954 -2.389 0.620 192 1HG2 ILE 24 1HG2 ILE 24 -9.689 -5.883 0.889 193 2HG2 ILE 24 2HG2 ILE 24 -11.192 -5.889 1.811 194 3HG2 ILE 24 3HG2 ILE 24 -9.642 -5.895 2.654 195 1HD1 ILE 24 1HD1 ILE 24 -9.223 -3.428 -0.750 196 2HD1 ILE 24 2HD1 ILE 24 -10.786 -3.418 -1.570 197 3HD1 ILE 24 3HD1 ILE 24 -10.182 -4.906 -0.838 198 H SER 25 H SER 25 -11.527 -5.215 4.780 199 HA SER 25 HA SER 25 -9.345 -4.893 6.616 200 1HB SER 25 1HB SER 25 -10.304 -7.017 7.611 201 2HB SER 25 2HB SER 25 -11.441 -5.672 7.500 202 HG SER 25 HG SER 25 -11.309 -7.409 5.323 203 H PHE 26 H PHE 26 -7.380 -5.815 6.476 204 HA PHE 26 HA PHE 26 -6.776 -7.321 4.091 205 1HB PHE 26 1HB PHE 26 -5.079 -6.217 6.321 206 2HB PHE 26 2HB PHE 26 -4.406 -7.209 5.031 207 HD1 PHE 26 HD1 PHE 26 -4.269 -6.375 2.761 208 HD2 PHE 26 HD2 PHE 26 -5.841 -3.960 5.893 209 HE1 PHE 26 HE1 PHE 26 -4.057 -4.390 1.327 210 HE2 PHE 26 HE2 PHE 26 -5.634 -1.969 4.461 211 HZ PHE 26 HZ PHE 26 -4.743 -2.182 2.177 212 H LEU 27 H LEU 27 -8.455 -8.719 5.855 213 HA LEU 27 HA LEU 27 -6.918 -10.827 7.092 214 1HB LEU 27 1HB LEU 27 -9.461 -9.925 7.420 215 2HB LEU 27 2HB LEU 27 -9.755 -11.265 6.332 216 HG LEU 27 HG LEU 27 -10.078 -11.911 8.662 217 1HD1 LEU 27 1HD1 LEU 27 -8.658 -13.892 8.712 218 2HD1 LEU 27 2HD1 LEU 27 -7.655 -13.205 7.433 219 3HD1 LEU 27 3HD1 LEU 27 -9.338 -13.617 7.107 220 1HD2 LEU 27 1HD2 LEU 27 -7.168 -11.213 9.011 221 2HD2 LEU 27 2HD2 LEU 27 -8.189 -12.009 10.209 222 3HD2 LEU 27 3HD2 LEU 27 -8.539 -10.353 9.710 223 H GLY 28 H GLY 28 -8.421 -10.078 4.064 224 1HA GLY 28 1HA GLY 28 -6.973 -12.193 2.726 225 2HA GLY 28 2HA GLY 28 -8.725 -12.357 2.669 226 H GLY 29 H GLY 29 -9.806 -11.290 1.121 227 1HA GLY 29 1HA GLY 29 -10.366 -9.488 -0.244 228 2HA GLY 29 2HA GLY 29 -8.836 -8.731 0.164 229 H ILE 30 H ILE 30 -7.132 -10.852 -0.596 230 HA ILE 30 HA ILE 30 -7.463 -10.710 -3.524 231 HB ILE 30 HB ILE 30 -4.854 -10.803 -1.991 232 1HG1 ILE 30 1HG1 ILE 30 -6.192 -8.471 -3.385 233 2HG1 ILE 30 2HG1 ILE 30 -6.054 -8.672 -1.642 234 1HG2 ILE 30 1HG2 ILE 30 -4.728 -11.788 -4.222 235 2HG2 ILE 30 2HG2 ILE 30 -3.830 -10.272 -4.146 236 3HG2 ILE 30 3HG2 ILE 30 -5.415 -10.320 -4.916 237 1HD1 ILE 30 1HD1 ILE 30 -3.624 -8.531 -1.820 238 2HD1 ILE 30 2HD1 ILE 30 -4.409 -7.099 -2.484 239 3HD1 ILE 30 3HD1 ILE 30 -3.766 -8.332 -3.566 240 H ASP 31 H ASP 31 -7.077 -12.512 -4.730 241 HA ASP 31 HA ASP 31 -7.318 -15.048 -3.442 242 1HB ASP 31 1HB ASP 31 -8.382 -14.569 -5.602 243 2HB ASP 31 2HB ASP 31 -6.798 -14.360 -6.343 244 H LYS 32 H LYS 32 -5.819 -16.629 -3.155 245 HA LYS 32 HA LYS 32 -3.097 -15.690 -3.014 246 1HB LYS 32 1HB LYS 32 -2.703 -17.860 -1.830 247 2HB LYS 32 2HB LYS 32 -3.930 -16.839 -1.093 248 1HG LYS 32 1HG LYS 32 -5.688 -18.198 -2.038 249 2HG LYS 32 2HG LYS 32 -4.502 -19.173 -2.911 250 1HD LYS 32 1HD LYS 32 -3.605 -20.032 -0.867 251 2HD LYS 32 2HD LYS 32 -4.567 -18.908 0.091 252 1HE LYS 32 1HE LYS 32 -5.510 -21.167 0.127 253 2HE LYS 32 2HE LYS 32 -6.611 -20.010 -0.617 254 1HZ LYS 32 1HZ LYS 32 -6.435 -22.161 -1.796 255 2HZ LYS 32 2HZ LYS 32 -4.811 -21.807 -2.152 256 3HZ LYS 32 3HZ LYS 32 -6.049 -20.825 -2.765 257 H GLU 33 H GLU 33 -4.772 -17.156 -5.465 258 HA GLU 33 HA GLU 33 -2.440 -18.754 -6.293 259 1HB GLU 33 1HB GLU 33 -5.326 -19.015 -7.144 260 2HB GLU 33 2HB GLU 33 -4.000 -20.027 -7.693 261 1HG GLU 33 1HG GLU 33 -3.717 -20.982 -5.545 262 2HG GLU 33 2HG GLU 33 -4.795 -19.797 -4.807 263 H THR 34 H THR 34 -5.048 -16.715 -7.598 264 HA THR 34 HA THR 34 -3.452 -16.309 -10.022 265 HB THR 34 HB THR 34 -6.293 -15.502 -9.626 266 HG1 THR 34 HG1 THR 34 -6.245 -17.720 -9.279 267 1HG2 THR 34 1HG2 THR 34 -5.152 -14.529 -11.563 268 2HG2 THR 34 2HG2 THR 34 -6.399 -15.672 -12.065 269 3HG2 THR 34 3HG2 THR 34 -4.701 -16.148 -12.101 270 H GLY 35 H GLY 35 -4.360 -14.702 -7.161 271 1HA GLY 35 1HA GLY 35 -3.700 -12.606 -6.417 272 2HA GLY 35 2HA GLY 35 -2.992 -12.307 -7.999 273 H ILE 36 H ILE 36 -6.251 -13.357 -7.897 274 HA ILE 36 HA ILE 36 -7.175 -10.760 -8.830 275 HB ILE 36 HB ILE 36 -8.628 -13.402 -8.544 276 1HG1 ILE 36 1HG1 ILE 36 -6.897 -13.377 -10.301 277 2HG1 ILE 36 2HG1 ILE 36 -8.518 -13.519 -10.975 278 1HG2 ILE 36 1HG2 ILE 36 -9.582 -10.824 -9.785 279 2HG2 ILE 36 2HG2 ILE 36 -10.185 -11.560 -8.298 280 3HG2 ILE 36 3HG2 ILE 36 -10.431 -12.369 -9.846 281 1HD1 ILE 36 1HD1 ILE 36 -7.152 -12.012 -12.286 282 2HD1 ILE 36 2HD1 ILE 36 -6.854 -11.016 -10.862 283 3HD1 ILE 36 3HD1 ILE 36 -8.483 -11.141 -11.527 284 H VAL 37 H VAL 37 -8.302 -9.354 -7.569 285 HA VAL 37 HA VAL 37 -8.616 -9.816 -4.802 286 HB VAL 37 HB VAL 37 -10.108 -7.763 -4.868 287 1HG1 VAL 37 1HG1 VAL 37 -7.359 -7.592 -6.104 288 2HG1 VAL 37 2HG1 VAL 37 -7.739 -7.603 -4.383 289 3HG1 VAL 37 3HG1 VAL 37 -8.237 -6.243 -5.387 290 1HG2 VAL 37 1HG2 VAL 37 -10.931 -8.000 -7.159 291 2HG2 VAL 37 2HG2 VAL 37 -9.296 -7.761 -7.776 292 3HG2 VAL 37 3HG2 VAL 37 -10.121 -6.449 -6.933 293 H LYS 38 H LYS 38 -9.948 -11.174 -3.904 294 HA LYS 38 HA LYS 38 -12.357 -12.122 -5.167 295 1HB LYS 38 1HB LYS 38 -10.963 -12.668 -2.562 296 2HB LYS 38 2HB LYS 38 -12.615 -13.216 -2.806 297 1HG LYS 38 1HG LYS 38 -10.350 -13.930 -4.651 298 2HG LYS 38 2HG LYS 38 -10.830 -14.911 -3.265 299 1HD LYS 38 1HD LYS 38 -13.176 -14.879 -4.279 300 2HD LYS 38 2HD LYS 38 -12.405 -14.277 -5.746 301 1HE LYS 38 1HE LYS 38 -11.648 -16.838 -4.347 302 2HE LYS 38 2HE LYS 38 -12.760 -16.745 -5.710 303 1HZ LYS 38 1HZ LYS 38 -10.867 -15.660 -6.947 304 2HZ LYS 38 2HZ LYS 38 -10.690 -17.308 -6.604 305 3HZ LYS 38 3HZ LYS 38 -9.856 -16.165 -5.679 306 H GLU 39 H GLU 39 -11.505 -9.469 -3.327 307 HA GLU 39 HA GLU 39 -14.154 -9.104 -2.157 308 1HB GLU 39 1HB GLU 39 -12.105 -8.618 -0.813 309 2HB GLU 39 2HB GLU 39 -11.701 -7.342 -1.952 310 1HG GLU 39 1HG GLU 39 -12.761 -6.495 0.099 311 2HG GLU 39 2HG GLU 39 -13.685 -6.113 -1.355 312 H ASP 40 H ASP 40 -15.439 -7.287 -2.631 313 HA ASP 40 HA ASP 40 -15.244 -6.419 -5.379 314 1HB ASP 40 1HB ASP 40 -17.449 -6.943 -4.480 315 2HB ASP 40 2HB ASP 40 -17.250 -5.727 -3.221 316 H CYS 41 H CYS 41 -14.687 -4.443 -6.105 317 HA CYS 41 HA CYS 41 -14.087 -2.276 -4.272 318 1HB CYS 41 1HB CYS 41 -11.937 -3.442 -6.065 319 2HB CYS 41 2HB CYS 41 -11.763 -2.066 -4.981 320 HG CYS 41 HG CYS 41 -12.765 -4.425 -3.068 321 H GLU 42 H GLU 42 -12.802 -0.558 -5.909 322 HA GLU 42 HA GLU 42 -14.704 0.244 -7.804 323 1HB GLU 42 1HB GLU 42 -12.383 1.313 -6.733 324 2HB GLU 42 2HB GLU 42 -11.989 1.112 -8.434 325 1HG GLU 42 1HG GLU 42 -14.339 2.625 -7.319 326 2HG GLU 42 2HG GLU 42 -12.871 3.326 -7.998 327 H ILE 43 H ILE 43 -11.559 -1.363 -8.296 328 HA ILE 43 HA ILE 43 -12.536 -2.204 -10.943 329 HB ILE 43 HB ILE 43 -10.111 -2.472 -11.568 330 1HG1 ILE 43 1HG1 ILE 43 -9.415 -2.252 -9.055 331 2HG1 ILE 43 2HG1 ILE 43 -8.388 -1.566 -10.299 332 1HG2 ILE 43 1HG2 ILE 43 -11.454 -0.670 -12.434 333 2HG2 ILE 43 2HG2 ILE 43 -9.829 -0.081 -12.084 334 3HG2 ILE 43 3HG2 ILE 43 -11.156 0.293 -10.986 335 1HD1 ILE 43 1HD1 ILE 43 -8.617 -0.074 -8.392 336 2HD1 ILE 43 2HD1 ILE 43 -10.366 -0.041 -8.624 337 3HD1 ILE 43 3HD1 ILE 43 -9.301 0.646 -9.850 338 H LYS 44 H LYS 44 -13.336 -3.731 -8.951 339 HA LYS 44 HA LYS 44 -11.667 -5.848 -8.183 340 1HB LYS 44 1HB LYS 44 -13.713 -5.556 -7.012 341 2HB LYS 44 2HB LYS 44 -14.660 -5.630 -8.487 342 1HG LYS 44 1HG LYS 44 -13.077 -8.029 -7.785 343 2HG LYS 44 2HG LYS 44 -14.475 -7.655 -6.776 344 1HD LYS 44 1HD LYS 44 -15.929 -7.663 -8.700 345 2HD LYS 44 2HD LYS 44 -14.555 -7.864 -9.788 346 1HE LYS 44 1HE LYS 44 -14.088 -10.046 -8.741 347 2HE LYS 44 2HE LYS 44 -15.511 -9.841 -7.722 348 1HZ LYS 44 1HZ LYS 44 -15.620 -9.843 -10.686 349 2HZ LYS 44 2HZ LYS 44 -16.928 -9.933 -9.606 350 3HZ LYS 44 3HZ LYS 44 -15.847 -11.232 -9.747 351 H GLY 45 H GLY 45 -10.884 -7.547 -9.221 352 1HA GLY 45 1HA GLY 45 -11.353 -9.380 -10.819 353 2HA GLY 45 2HA GLY 45 -11.966 -8.142 -11.906 354 H GLU 46 H GLU 46 -9.482 -6.657 -10.505 355 HA GLU 46 HA GLU 46 -7.731 -7.151 -12.754 356 1HB GLU 46 1HB GLU 46 -7.786 -5.150 -10.522 357 2HB GLU 46 2HB GLU 46 -6.327 -5.361 -11.481 358 1HG GLU 46 1HG GLU 46 -9.013 -4.777 -12.696 359 2HG GLU 46 2HG GLU 46 -7.882 -3.517 -12.205 360 H SER 47 H SER 47 -5.633 -7.885 -12.651 361 HA SER 47 HA SER 47 -4.986 -9.543 -10.340 362 1HB SER 47 1HB SER 47 -3.492 -9.278 -12.964 363 2HB SER 47 2HB SER 47 -3.316 -10.559 -11.764 364 HG SER 47 HG SER 47 -5.358 -11.291 -12.269 365 H VAL 48 H VAL 48 -3.832 -8.625 -8.748 366 HA VAL 48 HA VAL 48 -2.434 -6.134 -9.212 367 HB VAL 48 HB VAL 48 -1.993 -6.186 -6.766 368 1HG1 VAL 48 1HG1 VAL 48 -3.999 -5.113 -7.660 369 2HG1 VAL 48 2HG1 VAL 48 -4.321 -5.851 -6.090 370 3HG1 VAL 48 3HG1 VAL 48 -4.865 -6.648 -7.566 371 1HG2 VAL 48 1HG2 VAL 48 -1.889 -8.606 -6.455 372 2HG2 VAL 48 2HG2 VAL 48 -3.602 -8.738 -6.854 373 3HG2 VAL 48 3HG2 VAL 48 -3.098 -7.886 -5.394 374 H ALA 49 H ALA 49 -1.394 -8.724 -10.309 375 HA ALA 49 HA ALA 49 0.930 -9.381 -8.765 376 1HB ALA 49 1HB ALA 49 0.107 -10.358 -11.497 377 2HB ALA 49 2HB ALA 49 -0.326 -11.114 -9.964 378 3HB ALA 49 3HB ALA 49 1.363 -11.048 -10.467 379 H GLY 50 H GLY 50 2.123 -7.476 -8.766 380 1HA GLY 50 1HA GLY 50 4.304 -6.889 -9.550 381 2HA GLY 50 2HA GLY 50 3.811 -7.341 -11.172 382 H ARG 51 H ARG 51 1.586 -5.408 -9.400 383 HA ARG 51 HA ARG 51 2.551 -3.017 -10.815 384 1HB ARG 51 1HB ARG 51 0.247 -2.304 -11.053 385 2HB ARG 51 2HB ARG 51 0.455 -3.898 -11.759 386 1HG ARG 51 1HG ARG 51 -0.342 -4.622 -9.320 387 2HG ARG 51 2HG ARG 51 -1.131 -3.045 -9.416 388 1HD ARG 51 1HD ARG 51 -1.423 -5.354 -11.328 389 2HD ARG 51 2HD ARG 51 -2.642 -4.731 -10.223 390 HE ARG 51 HE ARG 51 -2.115 -2.592 -11.775 391 1HH1 ARG 51 1HH1 ARG 51 -2.846 -5.931 -12.512 392 2HH1 ARG 51 2HH1 ARG 51 -3.690 -5.565 -13.985 393 1HH2 ARG 51 1HH2 ARG 51 -3.226 -2.095 -13.739 394 2HH2 ARG 51 2HH2 ARG 51 -3.880 -3.385 -14.699 395 H ILE 52 H ILE 52 1.234 -1.018 -9.679 396 HA ILE 52 HA ILE 52 2.138 -1.185 -6.880 397 HB ILE 52 HB ILE 52 1.713 1.266 -8.603 398 1HG1 ILE 52 1HG1 ILE 52 3.642 -0.056 -9.346 399 2HG1 ILE 52 2HG1 ILE 52 4.161 1.461 -8.617 400 1HG2 ILE 52 1HG2 ILE 52 1.329 1.734 -6.246 401 2HG2 ILE 52 2HG2 ILE 52 2.822 2.494 -6.796 402 3HG2 ILE 52 3HG2 ILE 52 2.886 1.017 -5.834 403 1HD1 ILE 52 1HD1 ILE 52 4.204 -1.253 -7.312 404 2HD1 ILE 52 2HD1 ILE 52 4.689 0.260 -6.546 405 3HD1 ILE 52 3HD1 ILE 52 5.593 -0.358 -7.929 406 H LEU 53 H LEU 53 0.730 -0.781 -5.226 407 HA LEU 53 HA LEU 53 -2.057 -0.277 -6.015 408 1HB LEU 53 1HB LEU 53 -1.645 -2.426 -4.899 409 2HB LEU 53 2HB LEU 53 -0.979 -1.582 -3.516 410 HG LEU 53 HG LEU 53 -3.181 -0.538 -3.111 411 1HD1 LEU 53 1HD1 LEU 53 -4.066 -0.540 -5.356 412 2HD1 LEU 53 2HD1 LEU 53 -5.153 -1.429 -4.287 413 3HD1 LEU 53 3HD1 LEU 53 -4.080 -2.306 -5.379 414 1HD2 LEU 53 1HD2 LEU 53 -4.297 -2.543 -2.285 415 2HD2 LEU 53 2HD2 LEU 53 -2.565 -2.594 -1.954 416 3HD2 LEU 53 3HD2 LEU 53 -3.238 -3.547 -3.275 417 H VAL 54 H VAL 54 -2.932 1.588 -5.506 418 HA VAL 54 HA VAL 54 -1.743 3.177 -3.332 419 HB VAL 54 HB VAL 54 -3.593 4.112 -5.541 420 1HG1 VAL 54 1HG1 VAL 54 -2.966 6.364 -4.789 421 2HG1 VAL 54 2HG1 VAL 54 -2.039 5.654 -3.468 422 3HG1 VAL 54 3HG1 VAL 54 -3.788 5.448 -3.527 423 1HG2 VAL 54 1HG2 VAL 54 -1.617 5.211 -6.491 424 2HG2 VAL 54 2HG2 VAL 54 -1.428 3.459 -6.449 425 3HG2 VAL 54 3HG2 VAL 54 -0.607 4.464 -5.254 426 H PHE 55 H PHE 55 -2.813 2.993 -1.465 427 HA PHE 55 HA PHE 55 -5.740 2.638 -1.535 428 1HB PHE 55 1HB PHE 55 -4.316 0.486 -1.223 429 2HB PHE 55 2HB PHE 55 -3.966 1.122 0.376 430 HD1 PHE 55 HD1 PHE 55 -5.572 1.007 2.123 431 HD2 PHE 55 HD2 PHE 55 -6.616 -0.132 -1.842 432 HE1 PHE 55 HE1 PHE 55 -7.645 -0.019 2.965 433 HE2 PHE 55 HE2 PHE 55 -8.690 -1.154 -1.008 434 HZ PHE 55 HZ PHE 55 -9.207 -1.098 1.398 435 HA PRO 56 HA PRO 56 -5.533 5.860 1.508 436 1HB PRO 56 1HB PRO 56 -7.977 5.540 2.677 437 2HB PRO 56 2HB PRO 56 -7.739 6.297 1.099 438 1HG PRO 56 1HG PRO 56 -8.603 3.516 1.758 439 2HG PRO 56 2HG PRO 56 -9.192 4.602 0.488 440 1HD PRO 56 1HD PRO 56 -7.454 2.572 0.008 441 2HD PRO 56 2HD PRO 56 -7.467 4.076 -0.935 442 H GLY 57 H GLY 57 -7.120 2.949 2.881 443 1HA GLY 57 1HA GLY 57 -5.114 2.413 4.768 444 2HA GLY 57 2HA GLY 57 -6.316 3.452 5.522 445 H GLY 58 H GLY 58 -5.540 0.640 6.019 446 1HA GLY 58 1HA GLY 58 -8.208 -0.398 6.328 447 2HA GLY 58 2HA GLY 58 -7.204 -1.329 5.219 448 H LYS 59 H LYS 59 -8.171 -2.456 7.580 449 HA LYS 59 HA LYS 59 -5.863 -2.395 9.400 450 1HB LYS 59 1HB LYS 59 -8.691 -3.346 9.886 451 2HB LYS 59 2HB LYS 59 -7.389 -3.425 11.061 452 1HG LYS 59 1HG LYS 59 -7.217 -0.945 10.949 453 2HG LYS 59 2HG LYS 59 -8.655 -0.946 9.921 454 1HD LYS 59 1HD LYS 59 -8.497 -2.083 12.713 455 2HD LYS 59 2HD LYS 59 -9.200 -0.523 12.287 456 1HE LYS 59 1HE LYS 59 -10.178 -3.023 10.967 457 2HE LYS 59 2HE LYS 59 -10.743 -2.597 12.582 458 1HZ LYS 59 1HZ LYS 59 -11.522 -0.491 11.712 459 2HZ LYS 59 2HZ LYS 59 -12.226 -1.784 10.876 460 3HZ LYS 59 3HZ LYS 59 -10.969 -0.899 10.160 461 H GLY 60 H GLY 60 -4.753 -4.213 9.906 462 1HA GLY 60 1HA GLY 60 -5.720 -6.765 8.747 463 2HA GLY 60 2HA GLY 60 -4.012 -6.339 8.852 464 H SER 61 H SER 61 -6.675 -6.028 11.144 465 HA SER 61 HA SER 61 -5.185 -6.273 13.433 466 1HB SER 61 1HB SER 61 -8.071 -7.107 13.110 467 2HB SER 61 2HB SER 61 -7.280 -6.588 14.600 468 HG SER 61 HG SER 61 -6.778 -4.622 13.103 469 H THR 62 H THR 62 -3.810 -7.855 13.771 470 HA THR 62 HA THR 62 -2.952 -9.866 14.335 471 HB THR 62 HB THR 62 -5.727 -10.788 15.049 472 HG1 THR 62 HG1 THR 62 -5.826 -8.929 16.125 473 1HG2 THR 62 1HG2 THR 62 -3.849 -12.340 15.394 474 2HG2 THR 62 2HG2 THR 62 -4.549 -11.830 16.930 475 3HG2 THR 62 3HG2 THR 62 -3.029 -11.125 16.376 476 H VAL 63 H VAL 63 -3.828 -9.529 11.571 477 HA VAL 63 HA VAL 63 -4.881 -12.062 10.725 478 HB VAL 63 HB VAL 63 -5.153 -9.980 9.387 479 1HG1 VAL 63 1HG1 VAL 63 -2.226 -10.340 8.783 480 2HG1 VAL 63 2HG1 VAL 63 -2.961 -9.002 9.667 481 3HG1 VAL 63 3HG1 VAL 63 -3.313 -9.226 7.952 482 1HG2 VAL 63 1HG2 VAL 63 -3.793 -12.274 7.986 483 2HG2 VAL 63 2HG2 VAL 63 -4.762 -11.028 7.197 484 3HG2 VAL 63 3HG2 VAL 63 -5.514 -12.133 8.350 485 H GLY 64 H GLY 64 -1.770 -10.791 11.455 486 1HA GLY 64 1HA GLY 64 0.033 -12.288 11.981 487 2HA GLY 64 2HA GLY 64 -0.585 -13.396 10.765 488 H SER 65 H SER 65 -0.988 -10.740 9.182 489 HA SER 65 HA SER 65 0.080 -9.499 7.615 490 1HB SER 65 1HB SER 65 2.580 -10.051 9.232 491 2HB SER 65 2HB SER 65 2.365 -8.766 8.042 492 HG SER 65 HG SER 65 1.416 -7.605 9.514 493 H TYR 66 H TYR 66 0.179 -12.624 7.709 494 HA TYR 66 HA TYR 66 2.459 -13.297 6.114 495 1HB TYR 66 1HB TYR 66 1.596 -15.532 6.097 496 2HB TYR 66 2HB TYR 66 1.299 -14.876 7.703 497 HD1 TYR 66 HD1 TYR 66 -1.070 -13.895 8.133 498 HD2 TYR 66 HD2 TYR 66 -0.153 -16.501 4.898 499 HE1 TYR 66 HE1 TYR 66 -3.452 -14.476 7.928 500 HE2 TYR 66 HE2 TYR 66 -2.530 -17.082 4.684 501 HH TYR 66 HH TYR 66 -4.996 -15.334 6.164 502 H VAL 67 H VAL 67 -0.614 -12.015 5.448 503 HA VAL 67 HA VAL 67 -1.332 -13.201 3.041 504 HB VAL 67 HB VAL 67 -1.781 -10.316 3.820 505 1HG1 VAL 67 1HG1 VAL 67 -3.724 -10.421 2.362 506 2HG1 VAL 67 2HG1 VAL 67 -3.334 -12.088 1.938 507 3HG1 VAL 67 3HG1 VAL 67 -2.250 -10.782 1.462 508 1HG2 VAL 67 1HG2 VAL 67 -3.428 -12.771 4.418 509 2HG2 VAL 67 2HG2 VAL 67 -3.935 -11.109 4.721 510 3HG2 VAL 67 3HG2 VAL 67 -2.551 -11.780 5.584 511 H LEU 68 H LEU 68 0.449 -10.144 3.496 512 HA LEU 68 HA LEU 68 0.910 -9.646 0.782 513 1HB LEU 68 1HB LEU 68 2.559 -8.797 3.166 514 2HB LEU 68 2HB LEU 68 2.684 -8.108 1.559 515 HG LEU 68 HG LEU 68 0.255 -7.966 3.347 516 1HD1 LEU 68 1HD1 LEU 68 0.782 -5.576 3.470 517 2HD1 LEU 68 2HD1 LEU 68 2.266 -5.865 2.560 518 3HD1 LEU 68 3HD1 LEU 68 2.060 -6.574 4.163 519 1HD2 LEU 68 1HD2 LEU 68 0.785 -6.789 0.623 520 2HD2 LEU 68 2HD2 LEU 68 -0.585 -6.379 1.656 521 3HD2 LEU 68 3HD2 LEU 68 -0.410 -8.021 1.033 522 H LEU 69 H LEU 69 2.824 -11.412 3.159 523 HA LEU 69 HA LEU 69 5.100 -11.781 1.523 524 1HB LEU 69 1HB LEU 69 5.156 -12.017 3.963 525 2HB LEU 69 2HB LEU 69 4.102 -13.413 3.859 526 HG LEU 69 HG LEU 69 5.866 -14.623 2.610 527 1HD1 LEU 69 1HD1 LEU 69 8.120 -13.723 2.522 528 2HD1 LEU 69 2HD1 LEU 69 7.567 -12.222 3.264 529 3HD1 LEU 69 3HD1 LEU 69 6.999 -12.672 1.655 530 1HD2 LEU 69 1HD2 LEU 69 6.740 -13.511 5.273 531 2HD2 LEU 69 2HD2 LEU 69 7.329 -14.995 4.523 532 3HD2 LEU 69 3HD2 LEU 69 5.645 -14.873 5.031 533 H ASN 70 H ASN 70 2.365 -13.919 2.302 534 HA ASN 70 HA ASN 70 3.132 -16.137 0.797 535 1HB ASN 70 1HB ASN 70 1.270 -16.076 2.444 536 2HB ASN 70 2HB ASN 70 0.311 -15.172 1.277 537 1HD2 ASN 70 1HD2 ASN 70 -0.505 -16.224 -0.521 538 2HD2 ASN 70 2HD2 ASN 70 -0.522 -17.947 -0.658 539 H LEU 71 H LEU 71 1.204 -13.325 -0.150 540 HA LEU 71 HA LEU 71 0.619 -14.252 -2.757 541 1HB LEU 71 1HB LEU 71 0.702 -11.427 -1.698 542 2HB LEU 71 2HB LEU 71 -0.021 -11.918 -3.217 543 HG LEU 71 HG LEU 71 -0.951 -12.802 -0.484 544 1HD1 LEU 71 1HD1 LEU 71 -2.144 -10.824 -2.422 545 2HD1 LEU 71 2HD1 LEU 71 -1.380 -10.438 -0.881 546 3HD1 LEU 71 3HD1 LEU 71 -2.879 -11.366 -0.912 547 1HD2 LEU 71 1HD2 LEU 71 -2.872 -13.719 -1.677 548 2HD2 LEU 71 2HD2 LEU 71 -1.372 -14.470 -2.224 549 3HD2 LEU 71 3HD2 LEU 71 -2.155 -13.240 -3.217 550 H ARG 72 H ARG 72 3.298 -12.371 -1.417 551 HA ARG 72 HA ARG 72 4.256 -11.607 -4.006 552 1HB ARG 72 1HB ARG 72 4.657 -10.546 -1.584 553 2HB ARG 72 2HB ARG 72 6.093 -11.554 -1.675 554 1HG ARG 72 1HG ARG 72 5.719 -10.094 -4.128 555 2HG ARG 72 2HG ARG 72 5.743 -9.006 -2.741 556 1HD ARG 72 1HD ARG 72 7.975 -9.249 -3.553 557 2HD ARG 72 2HD ARG 72 7.854 -10.076 -2.005 558 HE ARG 72 HE ARG 72 7.400 -11.915 -4.099 559 1HH1 ARG 72 1HH1 ARG 72 9.952 -10.041 -2.624 560 2HH1 ARG 72 2HH1 ARG 72 11.216 -11.153 -3.060 561 1HH2 ARG 72 1HH2 ARG 72 9.047 -13.394 -4.702 562 2HH2 ARG 72 2HH2 ARG 72 10.699 -13.048 -4.274 563 H LYS 73 H LYS 73 4.827 -14.259 -1.819 564 HA LYS 73 HA LYS 73 7.173 -15.244 -3.077 565 1HB LYS 73 1HB LYS 73 5.041 -16.724 -1.515 566 2HB LYS 73 2HB LYS 73 6.609 -17.386 -1.959 567 1HG LYS 73 1HG LYS 73 7.729 -15.723 -0.598 568 2HG LYS 73 2HG LYS 73 6.181 -14.980 -0.200 569 1HD LYS 73 1HD LYS 73 6.611 -16.289 1.661 570 2HD LYS 73 2HD LYS 73 5.554 -17.324 0.703 571 1HE LYS 73 1HE LYS 73 8.566 -17.481 0.710 572 2HE LYS 73 2HE LYS 73 7.510 -18.502 1.681 573 1HZ LYS 73 1HZ LYS 73 6.492 -19.269 -0.431 574 2HZ LYS 73 2HZ LYS 73 8.125 -19.690 -0.258 575 3HZ LYS 73 3HZ LYS 73 7.688 -18.412 -1.282 576 H ASN 74 H ASN 74 3.742 -15.630 -3.650 577 HA ASN 74 HA ASN 74 4.056 -17.641 -5.691 578 1HB ASN 74 1HB ASN 74 2.010 -17.528 -4.322 579 2HB ASN 74 2HB ASN 74 1.667 -15.923 -4.955 580 1HD2 ASN 74 1HD2 ASN 74 -0.324 -16.588 -5.734 581 2HD2 ASN 74 2HD2 ASN 74 -0.478 -17.568 -7.149 582 H GLY 75 H GLY 75 4.025 -14.190 -5.508 583 1HA GLY 75 1HA GLY 75 4.926 -12.781 -7.164 584 2HA GLY 75 2HA GLY 75 4.696 -14.059 -8.347 585 H VAL 76 H VAL 76 2.084 -13.286 -6.233 586 HA VAL 76 HA VAL 76 0.713 -11.971 -8.488 587 HB VAL 76 HB VAL 76 -1.410 -12.823 -7.547 588 1HG1 VAL 76 1HG1 VAL 76 -0.316 -14.038 -9.343 589 2HG1 VAL 76 2HG1 VAL 76 -1.100 -15.161 -8.230 590 3HG1 VAL 76 3HG1 VAL 76 0.647 -14.938 -8.169 591 1HG2 VAL 76 1HG2 VAL 76 -1.357 -14.596 -5.849 592 2HG2 VAL 76 2HG2 VAL 76 -0.727 -13.074 -5.219 593 3HG2 VAL 76 3HG2 VAL 76 0.382 -14.368 -5.672 594 H ALA 77 H ALA 77 2.249 -11.062 -5.935 595 HA ALA 77 HA ALA 77 0.179 -9.367 -4.745 596 1HB ALA 77 1HB ALA 77 1.850 -8.834 -3.045 597 2HB ALA 77 2HB ALA 77 3.049 -9.793 -3.914 598 3HB ALA 77 3HB ALA 77 1.638 -10.577 -3.201 599 HA PRO 78 HA PRO 78 1.537 -5.687 -6.824 600 1HB PRO 78 1HB PRO 78 1.275 -4.245 -4.267 601 2HB PRO 78 2HB PRO 78 0.410 -3.999 -5.786 602 1HG PRO 78 1HG PRO 78 -0.788 -5.066 -3.633 603 2HG PRO 78 2HG PRO 78 -1.199 -5.570 -5.282 604 1HD PRO 78 1HD PRO 78 0.511 -6.947 -3.248 605 2HD PRO 78 2HD PRO 78 -0.651 -7.638 -4.399 606 H LYS 79 H LYS 79 3.417 -4.523 -7.085 607 HA LYS 79 HA LYS 79 5.753 -5.429 -5.818 608 1HB LYS 79 1HB LYS 79 5.165 -3.022 -7.526 609 2HB LYS 79 2HB LYS 79 6.766 -3.351 -6.893 610 1HG LYS 79 1HG LYS 79 6.702 -5.555 -8.040 611 2HG LYS 79 2HG LYS 79 5.179 -5.059 -8.783 612 1HD LYS 79 1HD LYS 79 6.255 -3.194 -9.862 613 2HD LYS 79 2HD LYS 79 7.768 -3.534 -9.025 614 1HE LYS 79 1HE LYS 79 7.841 -5.733 -10.187 615 2HE LYS 79 2HE LYS 79 6.413 -5.251 -11.103 616 1HZ LYS 79 1HZ LYS 79 8.520 -4.871 -12.298 617 2HZ LYS 79 2HZ LYS 79 8.985 -3.762 -11.101 618 3HZ LYS 79 3HZ LYS 79 7.631 -3.444 -12.068 619 H ALA 80 H ALA 80 3.660 -2.681 -5.223 620 HA ALA 80 HA ALA 80 4.701 -2.364 -2.574 621 1HB ALA 80 1HB ALA 80 5.135 -0.138 -4.559 622 2HB ALA 80 2HB ALA 80 6.390 -1.110 -3.793 623 3HB ALA 80 3HB ALA 80 5.395 -0.030 -2.817 624 H ILE 81 H ILE 81 3.489 -0.811 -1.334 625 HA ILE 81 HA ILE 81 0.951 0.015 -2.559 626 HB ILE 81 HB ILE 81 1.189 -1.174 0.216 627 1HG1 ILE 81 1HG1 ILE 81 -0.036 -2.396 -2.270 628 2HG1 ILE 81 2HG1 ILE 81 1.509 -2.872 -1.577 629 1HG2 ILE 81 1HG2 ILE 81 -1.208 -0.332 -1.407 630 2HG2 ILE 81 2HG2 ILE 81 -0.578 0.475 0.029 631 3HG2 ILE 81 3HG2 ILE 81 -1.271 -1.142 0.157 632 1HD1 ILE 81 1HD1 ILE 81 -0.254 -4.427 -0.974 633 2HD1 ILE 81 2HD1 ILE 81 -1.173 -3.115 -0.234 634 3HD1 ILE 81 3HD1 ILE 81 0.378 -3.604 0.452 635 H ILE 82 H ILE 82 0.610 2.130 -2.274 636 HA ILE 82 HA ILE 82 2.149 3.514 -0.175 637 HB ILE 82 HB ILE 82 0.667 4.971 -2.346 638 1HG1 ILE 82 1HG1 ILE 82 2.002 3.266 -3.524 639 2HG1 ILE 82 2HG1 ILE 82 2.647 4.879 -3.798 640 1HG2 ILE 82 1HG2 ILE 82 2.443 6.629 -2.019 641 2HG2 ILE 82 2HG2 ILE 82 3.224 5.571 -0.845 642 3HG2 ILE 82 3HG2 ILE 82 1.633 6.252 -0.497 643 1HD1 ILE 82 1HD1 ILE 82 4.398 4.455 -2.153 644 2HD1 ILE 82 2HD1 ILE 82 4.422 3.267 -3.456 645 3HD1 ILE 82 3HD1 ILE 82 3.749 2.837 -1.882 646 H ASN 83 H ASN 83 1.037 4.035 1.617 647 HA ASN 83 HA ASN 83 -1.891 4.248 1.368 648 1HB ASN 83 1HB ASN 83 -0.255 3.227 3.691 649 2HB ASN 83 2HB ASN 83 -1.984 3.538 3.768 650 1HD2 ASN 83 1HD2 ASN 83 -3.388 2.238 2.514 651 2HD2 ASN 83 2HD2 ASN 83 -2.902 0.664 1.994 652 H LYS 84 H LYS 84 -2.985 5.655 2.769 653 HA LYS 84 HA LYS 84 -1.581 8.136 3.270 654 1HB LYS 84 1HB LYS 84 -3.918 7.917 2.287 655 2HB LYS 84 2HB LYS 84 -4.455 7.448 3.891 656 1HG LYS 84 1HG LYS 84 -3.829 9.597 4.776 657 2HG LYS 84 2HG LYS 84 -3.136 10.070 3.222 658 1HD LYS 84 1HD LYS 84 -5.388 9.753 2.203 659 2HD LYS 84 2HD LYS 84 -6.030 9.476 3.822 660 1HE LYS 84 1HE LYS 84 -5.322 11.707 4.494 661 2HE LYS 84 2HE LYS 84 -4.633 11.981 2.895 662 1HZ LYS 84 1HZ LYS 84 -6.864 11.701 1.953 663 2HZ LYS 84 2HZ LYS 84 -6.792 12.999 3.043 664 3HZ LYS 84 3HZ LYS 84 -7.504 11.532 3.517 665 H LYS 85 H LYS 85 -3.188 5.575 5.058 666 HA LYS 85 HA LYS 85 -1.807 6.490 7.490 667 1HB LYS 85 1HB LYS 85 -4.531 5.197 7.258 668 2HB LYS 85 2HB LYS 85 -3.661 5.370 8.776 669 1HG LYS 85 1HG LYS 85 -3.661 7.818 8.462 670 2HG LYS 85 2HG LYS 85 -4.626 7.603 7.001 671 1HD LYS 85 1HD LYS 85 -6.428 6.631 8.277 672 2HD LYS 85 2HD LYS 85 -5.451 6.669 9.746 673 1HE LYS 85 1HE LYS 85 -5.383 9.126 9.610 674 2HE LYS 85 2HE LYS 85 -6.402 9.061 8.172 675 1HZ LYS 85 1HZ LYS 85 -8.170 8.101 9.462 676 2HZ LYS 85 2HZ LYS 85 -7.654 9.527 10.224 677 3HZ LYS 85 3HZ LYS 85 -7.185 8.019 10.841 678 H THR 86 H THR 86 -0.128 5.167 7.742 679 HA THR 86 HA THR 86 -0.162 2.481 6.720 680 HB THR 86 HB THR 86 2.133 2.370 7.819 681 HG1 THR 86 HG1 THR 86 1.349 4.401 9.150 682 1HG2 THR 86 1HG2 THR 86 1.625 4.598 5.845 683 2HG2 THR 86 2HG2 THR 86 1.806 2.890 5.443 684 3HG2 THR 86 3HG2 THR 86 3.168 3.784 6.118 685 H GLU 87 H GLU 87 -1.299 0.993 7.772 686 HA GLU 87 HA GLU 87 -1.722 1.029 10.595 687 1HB GLU 87 1HB GLU 87 -3.110 -0.055 8.613 688 2HB GLU 87 2HB GLU 87 -2.088 -1.444 8.945 689 1HG GLU 87 1HG GLU 87 -3.529 -0.151 11.203 690 2HG GLU 87 2HG GLU 87 -4.431 -1.163 10.081 691 H THR 88 H THR 88 -0.652 -0.081 12.175 692 HA THR 88 HA THR 88 2.082 -0.484 11.873 693 HB THR 88 HB THR 88 0.359 -1.693 14.038 694 HG1 THR 88 HG1 THR 88 1.387 0.958 13.718 695 1HG2 THR 88 1HG2 THR 88 3.222 -0.724 14.041 696 2HG2 THR 88 2HG2 THR 88 2.706 -2.410 14.047 697 3HG2 THR 88 3HG2 THR 88 2.351 -1.376 15.429 698 H ILE 89 H ILE 89 -0.560 -2.851 11.919 699 HA ILE 89 HA ILE 89 1.145 -5.135 11.908 700 HB ILE 89 HB ILE 89 -1.746 -4.927 11.044 701 1HG1 ILE 89 1HG1 ILE 89 -0.557 -5.621 13.741 702 2HG1 ILE 89 2HG1 ILE 89 -1.327 -4.091 13.339 703 1HG2 ILE 89 1HG2 ILE 89 -0.676 -6.987 10.284 704 2HG2 ILE 89 2HG2 ILE 89 -1.849 -7.317 11.560 705 3HG2 ILE 89 3HG2 ILE 89 -0.124 -7.313 11.928 706 1HD1 ILE 89 1HD1 ILE 89 -3.438 -5.258 12.958 707 2HD1 ILE 89 2HD1 ILE 89 -2.822 -5.524 14.590 708 3HD1 ILE 89 3HD1 ILE 89 -2.660 -6.787 13.369 709 H ILE 90 H ILE 90 -0.297 -3.155 9.407 710 HA ILE 90 HA ILE 90 0.284 -4.851 7.209 711 HB ILE 90 HB ILE 90 -0.030 -1.842 7.263 712 1HG1 ILE 90 1HG1 ILE 90 -2.030 -2.963 8.079 713 2HG1 ILE 90 2HG1 ILE 90 -2.334 -2.318 6.468 714 1HG2 ILE 90 1HG2 ILE 90 1.129 -2.550 5.259 715 2HG2 ILE 90 2HG2 ILE 90 -0.515 -2.055 4.860 716 3HG2 ILE 90 3HG2 ILE 90 -0.108 -3.769 4.945 717 1HD1 ILE 90 1HD1 ILE 90 -1.733 -5.187 7.156 718 2HD1 ILE 90 2HD1 ILE 90 -1.994 -4.555 5.530 719 3HD1 ILE 90 3HD1 ILE 90 -3.304 -4.518 6.710 720 H ALA 91 H ALA 91 2.041 -2.278 8.845 721 HA ALA 91 HA ALA 91 4.199 -2.023 7.087 722 1HB ALA 91 1HB ALA 91 4.205 -1.657 10.082 723 2HB ALA 91 2HB ALA 91 3.737 -0.439 8.895 724 3HB ALA 91 3HB ALA 91 5.401 -1.020 8.950 725 H VAL 92 H VAL 92 3.753 -4.166 9.876 726 HA VAL 92 HA VAL 92 6.283 -5.372 9.855 727 HB VAL 92 HB VAL 92 3.650 -6.641 10.645 728 1HG1 VAL 92 1HG1 VAL 92 6.474 -7.366 11.415 729 2HG1 VAL 92 2HG1 VAL 92 5.413 -8.296 10.356 730 3HG1 VAL 92 3HG1 VAL 92 5.009 -8.104 12.062 731 1HG2 VAL 92 1HG2 VAL 92 5.642 -5.070 12.274 732 2HG2 VAL 92 2HG2 VAL 92 4.262 -5.951 12.930 733 3HG2 VAL 92 3HG2 VAL 92 3.999 -4.579 11.854 734 H GLY 93 H GLY 93 3.290 -6.247 8.175 735 1HA GLY 93 1HA GLY 93 4.304 -8.623 6.991 736 2HA GLY 93 2HA GLY 93 2.870 -7.745 6.484 737 H ALA 94 H ALA 94 4.002 -5.304 5.806 738 HA ALA 94 HA ALA 94 4.803 -5.788 3.161 739 1HB ALA 94 1HB ALA 94 5.142 -3.273 4.795 740 2HB ALA 94 2HB ALA 94 3.710 -3.721 3.869 741 3HB ALA 94 3HB ALA 94 5.228 -3.388 3.037 742 H ALA 95 H ALA 95 6.647 -5.107 6.079 743 HA ALA 95 HA ALA 95 9.145 -4.679 4.853 744 1HB ALA 95 1HB ALA 95 8.660 -4.020 7.155 745 2HB ALA 95 2HB ALA 95 10.092 -5.044 7.069 746 3HB ALA 95 3HB ALA 95 8.560 -5.719 7.622 747 H MET 96 H MET 96 7.445 -7.611 5.742 748 HA MET 96 HA MET 96 9.767 -9.299 5.560 749 1HB MET 96 1HB MET 96 6.828 -9.985 5.678 750 2HB MET 96 2HB MET 96 8.130 -11.162 5.733 751 1HG MET 96 1HG MET 96 8.974 -10.083 7.789 752 2HG MET 96 2HG MET 96 7.580 -9.003 7.756 753 1HE MET 96 1HE MET 96 5.326 -11.050 6.665 754 2HE MET 96 2HE MET 96 5.047 -9.880 7.955 755 3HE MET 96 3HE MET 96 4.624 -11.577 8.194 756 H ALA 97 H ALA 97 7.067 -8.481 3.448 757 HA ALA 97 HA ALA 97 7.842 -10.439 1.453 758 1HB ALA 97 1HB ALA 97 5.489 -10.006 1.877 759 2HB ALA 97 2HB ALA 97 5.915 -9.609 0.211 760 3HB ALA 97 3HB ALA 97 5.699 -8.323 1.400 761 H GLU 98 H GLU 98 9.087 -7.544 2.268 762 HA GLU 98 HA GLU 98 10.207 -5.852 1.275 763 1HB GLU 98 1HB GLU 98 11.490 -7.748 0.265 764 2HB GLU 98 2HB GLU 98 10.424 -7.673 -1.132 765 1HG GLU 98 1HG GLU 98 11.177 -5.457 -1.661 766 2HG GLU 98 2HG GLU 98 12.123 -5.376 -0.177 767 H ILE 99 H ILE 99 7.684 -5.414 1.359 768 HA ILE 99 HA ILE 99 6.929 -4.298 -1.260 769 HB ILE 99 HB ILE 99 5.157 -4.701 1.166 770 1HG1 ILE 99 1HG1 ILE 99 5.814 -6.867 0.251 771 2HG1 ILE 99 2HG1 ILE 99 4.122 -6.540 -0.111 772 1HG2 ILE 99 1HG2 ILE 99 4.454 -3.966 -1.674 773 2HG2 ILE 99 2HG2 ILE 99 4.457 -2.868 -0.294 774 3HG2 ILE 99 3HG2 ILE 99 3.315 -4.210 -0.350 775 1HD1 ILE 99 1HD1 ILE 99 4.726 -5.915 -2.383 776 2HD1 ILE 99 2HD1 ILE 99 5.270 -7.548 -2.001 777 3HD1 ILE 99 3HD1 ILE 99 6.426 -6.216 -2.021 778 HA PRO 100 HA PRO 100 8.857 -0.809 1.036 779 1HB PRO 100 1HB PRO 100 8.480 0.833 -1.231 780 2HB PRO 100 2HB PRO 100 9.966 0.014 -0.749 781 1HG PRO 100 1HG PRO 100 7.927 -0.788 -2.749 782 2HG PRO 100 2HG PRO 100 9.673 -1.092 -2.732 783 1HD PRO 100 1HD PRO 100 7.905 -3.030 -2.174 784 2HD PRO 100 2HD PRO 100 9.464 -2.926 -1.330 785 H LEU 101 H LEU 101 7.256 -0.383 2.495 786 HA LEU 101 HA LEU 101 4.805 0.906 1.605 787 1HB LEU 101 1HB LEU 101 4.668 -0.879 3.278 788 2HB LEU 101 2HB LEU 101 5.725 0.023 4.345 789 HG LEU 101 HG LEU 101 4.001 1.795 4.514 790 1HD1 LEU 101 1HD1 LEU 101 1.742 1.341 3.729 791 2HD1 LEU 101 2HD1 LEU 101 2.297 -0.149 2.966 792 3HD1 LEU 101 3HD1 LEU 101 2.880 1.411 2.384 793 1HD2 LEU 101 1HD2 LEU 101 3.070 -0.978 5.242 794 2HD2 LEU 101 2HD2 LEU 101 2.477 0.529 5.941 795 3HD2 LEU 101 3HD2 LEU 101 4.152 0.039 6.195 796 H VAL 102 H VAL 102 4.445 3.011 1.747 797 HA VAL 102 HA VAL 102 6.108 4.638 3.522 798 HB VAL 102 HB VAL 102 6.154 6.435 1.752 799 1HG1 VAL 102 1HG1 VAL 102 7.618 3.872 1.120 800 2HG1 VAL 102 2HG1 VAL 102 8.133 5.112 2.263 801 3HG1 VAL 102 3HG1 VAL 102 8.056 5.480 0.541 802 1HG2 VAL 102 1HG2 VAL 102 5.370 4.148 -0.053 803 2HG2 VAL 102 2HG2 VAL 102 5.877 5.755 -0.577 804 3HG2 VAL 102 3HG2 VAL 102 4.378 5.555 0.330 805 H GLU 103 H GLU 103 5.137 6.529 4.260 806 HA GLU 103 HA GLU 103 2.209 6.412 4.186 807 1HB GLU 103 1HB GLU 103 3.255 6.245 6.390 808 2HB GLU 103 2HB GLU 103 4.104 7.760 6.120 809 1HG GLU 103 1HG GLU 103 1.905 8.898 5.980 810 2HG GLU 103 2HG GLU 103 1.140 7.373 6.425 811 H VAL 104 H VAL 104 1.154 7.859 2.974 812 HA VAL 104 HA VAL 104 2.483 10.433 2.450 813 HB VAL 104 HB VAL 104 0.844 10.682 0.555 814 1HG1 VAL 104 1HG1 VAL 104 3.137 10.059 0.138 815 2HG1 VAL 104 2HG1 VAL 104 2.072 9.172 -0.952 816 3HG1 VAL 104 3HG1 VAL 104 2.765 8.365 0.454 817 1HG2 VAL 104 1HG2 VAL 104 -0.201 8.651 -0.332 818 2HG2 VAL 104 2HG2 VAL 104 -0.835 9.072 1.260 819 3HG2 VAL 104 3HG2 VAL 104 0.332 7.759 1.093 820 H ARG 105 H ARG 105 1.795 12.055 3.609 821 HA ARG 105 HA ARG 105 -0.904 12.071 4.727 822 1HB ARG 105 1HB ARG 105 1.387 14.020 5.102 823 2HB ARG 105 2HB ARG 105 -0.132 14.038 5.986 824 1HG ARG 105 1HG ARG 105 1.762 11.714 6.054 825 2HG ARG 105 2HG ARG 105 1.851 13.066 7.184 826 1HD ARG 105 1HD ARG 105 -0.435 12.604 7.919 827 2HD ARG 105 2HD ARG 105 -0.533 11.261 6.777 828 HE ARG 105 HE ARG 105 1.286 10.212 8.067 829 1HH1 ARG 105 1HH1 ARG 105 -0.616 12.715 9.608 830 2HH1 ARG 105 2HH1 ARG 105 -0.311 12.126 11.216 831 1HH2 ARG 105 1HH2 ARG 105 1.661 9.423 10.154 832 2HH2 ARG 105 2HH2 ARG 105 1.000 10.264 11.530 833 H ASP 106 H ASP 106 0.236 12.731 1.850 834 HA ASP 106 HA ASP 106 -0.699 15.481 1.576 835 1HB ASP 106 1HB ASP 106 1.545 14.847 0.711 836 2HB ASP 106 2HB ASP 106 0.763 13.749 -0.426 837 H GLU 107 H GLU 107 -2.604 15.929 0.774 838 HA GLU 107 HA GLU 107 -4.397 13.902 -0.125 839 1HB GLU 107 1HB GLU 107 -5.107 15.907 1.146 840 2HB GLU 107 2HB GLU 107 -4.675 16.915 -0.225 841 1HG GLU 107 1HG GLU 107 -7.050 16.582 -0.179 842 2HG GLU 107 2HG GLU 107 -6.364 15.771 -1.585 843 H LYS 108 H LYS 108 -2.343 16.249 -1.696 844 HA LYS 108 HA LYS 108 -3.622 16.275 -4.211 845 1HB LYS 108 1HB LYS 108 -0.916 17.082 -3.212 846 2HB LYS 108 2HB LYS 108 -1.235 17.046 -4.936 847 1HG LYS 108 1HG LYS 108 -1.538 19.277 -4.067 848 2HG LYS 108 2HG LYS 108 -3.074 18.630 -4.632 849 1HD LYS 108 1HD LYS 108 -3.738 18.143 -2.351 850 2HD LYS 108 2HD LYS 108 -2.170 18.691 -1.754 851 1HE LYS 108 1HE LYS 108 -2.618 20.936 -2.524 852 2HE LYS 108 2HE LYS 108 -4.132 20.414 -3.259 853 1HZ LYS 108 1HZ LYS 108 -4.423 21.522 -1.096 854 2HZ LYS 108 2HZ LYS 108 -3.547 20.272 -0.348 855 3HZ LYS 108 3HZ LYS 108 -5.027 19.936 -1.109 856 H PHE 109 H PHE 109 -1.234 14.187 -2.755 857 HA PHE 109 HA PHE 109 -0.215 12.876 -4.969 858 1HB PHE 109 1HB PHE 109 0.705 12.444 -2.797 859 2HB PHE 109 2HB PHE 109 -0.835 11.837 -2.198 860 HD1 PHE 109 HD1 PHE 109 -1.286 9.564 -2.248 861 HD2 PHE 109 HD2 PHE 109 1.807 11.130 -4.720 862 HE1 PHE 109 HE1 PHE 109 -0.645 7.276 -2.884 863 HE2 PHE 109 HE2 PHE 109 2.454 8.843 -5.361 864 HZ PHE 109 HZ PHE 109 1.224 6.914 -4.446 865 H PHE 110 H PHE 110 -3.171 12.100 -3.136 866 HA PHE 110 HA PHE 110 -3.759 9.778 -4.672 867 1HB PHE 110 1HB PHE 110 -5.438 11.430 -2.786 868 2HB PHE 110 2HB PHE 110 -6.027 9.966 -3.566 869 HD1 PHE 110 HD1 PHE 110 -5.143 7.787 -2.958 870 HD2 PHE 110 HD2 PHE 110 -3.809 11.333 -1.021 871 HE1 PHE 110 HE1 PHE 110 -4.151 6.426 -1.163 872 HE2 PHE 110 HE2 PHE 110 -2.816 9.981 0.774 873 HZ PHE 110 HZ PHE 110 -2.987 7.525 0.708 874 H GLU 111 H GLU 111 -4.339 13.121 -5.115 875 HA GLU 111 HA GLU 111 -6.505 12.776 -6.968 876 1HB GLU 111 1HB GLU 111 -4.990 15.046 -5.786 877 2HB GLU 111 2HB GLU 111 -5.959 15.310 -7.218 878 1HG GLU 111 1HG GLU 111 -6.975 14.121 -4.661 879 2HG GLU 111 2HG GLU 111 -7.138 15.811 -5.122 880 H ALA 112 H ALA 112 -3.057 13.352 -7.037 881 HA ALA 112 HA ALA 112 -3.002 13.935 -9.855 882 1HB ALA 112 1HB ALA 112 -0.589 14.037 -9.593 883 2HB ALA 112 2HB ALA 112 -0.723 13.364 -7.968 884 3HB ALA 112 3HB ALA 112 -1.391 14.957 -8.318 885 H VAL 113 H VAL 113 -2.453 11.123 -7.808 886 HA VAL 113 HA VAL 113 -1.345 9.568 -9.965 887 HB VAL 113 HB VAL 113 -0.693 9.134 -7.619 888 1HG1 VAL 113 1HG1 VAL 113 -3.480 8.026 -7.296 889 2HG1 VAL 113 2HG1 VAL 113 -2.858 9.492 -6.536 890 3HG1 VAL 113 3HG1 VAL 113 -2.173 7.923 -6.114 891 1HG2 VAL 113 1HG2 VAL 113 -0.805 6.687 -7.736 892 2HG2 VAL 113 2HG2 VAL 113 -0.369 7.409 -9.284 893 3HG2 VAL 113 3HG2 VAL 113 -2.009 6.813 -9.020 894 H LYS 114 H LYS 114 -2.412 8.506 -11.458 895 HA LYS 114 HA LYS 114 -5.285 7.968 -11.045 896 1HB LYS 114 1HB LYS 114 -3.926 8.345 -13.706 897 2HB LYS 114 2HB LYS 114 -5.652 8.364 -13.358 898 1HG LYS 114 1HG LYS 114 -5.477 10.451 -12.229 899 2HG LYS 114 2HG LYS 114 -3.713 10.393 -12.287 900 1HD LYS 114 1HD LYS 114 -4.342 10.155 -14.915 901 2HD LYS 114 2HD LYS 114 -5.647 11.194 -14.333 902 1HE LYS 114 1HE LYS 114 -3.804 12.578 -15.053 903 2HE LYS 114 2HE LYS 114 -3.948 12.673 -13.297 904 1HZ LYS 114 1HZ LYS 114 -1.666 12.406 -13.743 905 2HZ LYS 114 2HZ LYS 114 -1.935 11.185 -14.884 906 3HZ LYS 114 3HZ LYS 114 -2.187 10.869 -13.238 907 H THR 115 H THR 115 -6.093 5.993 -11.927 908 HA THR 115 HA THR 115 -4.314 3.792 -11.750 909 HB THR 115 HB THR 115 -7.078 3.795 -12.979 910 HG1 THR 115 HG1 THR 115 -7.132 4.672 -10.858 911 1HG2 THR 115 1HG2 THR 115 -5.771 1.744 -13.366 912 2HG2 THR 115 2HG2 THR 115 -7.130 1.453 -12.281 913 3HG2 THR 115 3HG2 THR 115 -5.498 1.599 -11.629 914 H GLY 116 H GLY 116 -2.672 3.897 -13.206 915 1HA GLY 116 1HA GLY 116 -2.451 2.829 -15.559 916 2HA GLY 116 2HA GLY 116 -3.338 4.268 -16.044 917 H ASP 117 H ASP 117 -1.709 5.499 -13.629 918 HA ASP 117 HA ASP 117 0.437 6.519 -15.268 919 1HB ASP 117 1HB ASP 117 -0.306 7.012 -12.377 920 2HB ASP 117 2HB ASP 117 1.059 7.783 -13.174 921 H ARG 118 H ARG 118 2.712 6.440 -14.593 922 HA ARG 118 HA ARG 118 3.338 3.891 -13.270 923 1HB ARG 118 1HB ARG 118 4.343 3.990 -15.429 924 2HB ARG 118 2HB ARG 118 4.959 5.612 -15.147 925 1HG ARG 118 1HG ARG 118 6.498 4.765 -13.476 926 2HG ARG 118 2HG ARG 118 5.844 3.140 -13.670 927 1HD ARG 118 1HD ARG 118 7.967 3.441 -14.868 928 2HD ARG 118 2HD ARG 118 6.633 3.057 -15.953 929 HE ARG 118 HE ARG 118 6.599 5.625 -16.262 930 1HH1 ARG 118 1HH1 ARG 118 9.513 3.763 -15.646 931 2HH1 ARG 118 2HH1 ARG 118 10.489 4.724 -16.726 932 1HH2 ARG 118 1HH2 ARG 118 7.923 6.878 -17.680 933 2HH2 ARG 118 2HH2 ARG 118 9.600 6.467 -17.862 934 H VAL 119 H VAL 119 3.797 4.067 -11.201 935 HA VAL 119 HA VAL 119 5.364 6.400 -10.335 936 HB VAL 119 HB VAL 119 3.152 6.574 -9.381 937 1HG1 VAL 119 1HG1 VAL 119 2.467 4.241 -9.536 938 2HG1 VAL 119 2HG1 VAL 119 2.205 4.875 -7.911 939 3HG1 VAL 119 3HG1 VAL 119 3.581 3.817 -8.234 940 1HG2 VAL 119 1HG2 VAL 119 3.701 6.594 -6.988 941 2HG2 VAL 119 2HG2 VAL 119 4.996 7.281 -7.970 942 3HG2 VAL 119 3HG2 VAL 119 5.151 5.648 -7.322 943 H VAL 120 H VAL 120 7.342 5.894 -9.736 944 HA VAL 120 HA VAL 120 7.862 3.165 -8.818 945 HB VAL 120 HB VAL 120 9.345 3.871 -10.604 946 1HG1 VAL 120 1HG1 VAL 120 10.927 5.709 -10.348 947 2HG1 VAL 120 2HG1 VAL 120 10.195 6.123 -8.797 948 3HG1 VAL 120 3HG1 VAL 120 9.259 6.282 -10.283 949 1HG2 VAL 120 1HG2 VAL 120 10.785 3.776 -7.956 950 2HG2 VAL 120 2HG2 VAL 120 11.507 3.465 -9.536 951 3HG2 VAL 120 3HG2 VAL 120 10.260 2.387 -8.909 952 H VAL 121 H VAL 121 7.847 2.818 -6.755 953 HA VAL 121 HA VAL 121 7.858 5.008 -4.888 954 HB VAL 121 HB VAL 121 6.354 3.150 -4.481 955 1HG1 VAL 121 1HG1 VAL 121 8.837 1.462 -4.219 956 2HG1 VAL 121 2HG1 VAL 121 7.622 1.355 -5.495 957 3HG1 VAL 121 3HG1 VAL 121 7.198 0.934 -3.836 958 1HG2 VAL 121 1HG2 VAL 121 6.910 2.670 -2.136 959 2HG2 VAL 121 2HG2 VAL 121 7.151 4.370 -2.539 960 3HG2 VAL 121 3HG2 VAL 121 8.540 3.292 -2.405 961 H ASN 122 H ASN 122 9.523 5.790 -3.811 962 HA ASN 122 HA ASN 122 11.964 4.159 -3.641 963 1HB ASN 122 1HB ASN 122 12.189 6.265 -4.973 964 2HB ASN 122 2HB ASN 122 11.741 7.178 -3.538 965 1HD2 ASN 122 1HD2 ASN 122 14.172 7.231 -5.144 966 2HD2 ASN 122 2HD2 ASN 122 15.471 6.935 -4.037 967 H ALA 123 H ALA 123 11.580 3.141 -1.731 968 HA ALA 123 HA ALA 123 10.502 4.639 0.510 969 1HB ALA 123 1HB ALA 123 10.395 2.485 1.642 970 2HB ALA 123 2HB ALA 123 11.261 1.730 0.303 971 3HB ALA 123 3HB ALA 123 9.653 2.405 0.045 972 H ASP 124 H ASP 124 13.542 3.951 -0.725 973 HA ASP 124 HA ASP 124 14.962 3.785 1.757 974 1HB ASP 124 1HB ASP 124 15.866 4.308 -1.076 975 2HB ASP 124 2HB ASP 124 16.977 4.263 0.286 976 H GLU 125 H GLU 125 14.171 6.336 -0.545 977 HA GLU 125 HA GLU 125 15.434 8.300 1.229 978 1HB GLU 125 1HB GLU 125 14.417 8.598 -1.599 979 2HB GLU 125 2HB GLU 125 15.211 9.859 -0.666 980 1HG GLU 125 1HG GLU 125 17.236 8.484 -0.554 981 2HG GLU 125 2HG GLU 125 16.433 7.245 -1.519 982 H GLY 126 H GLY 126 12.387 7.044 0.434 983 1HA GLY 126 1HA GLY 126 10.314 7.592 1.315 984 2HA GLY 126 2HA GLY 126 11.050 8.983 2.100 985 H TYR 127 H TYR 127 10.203 7.794 -1.140 986 HA TYR 127 HA TYR 127 9.100 10.385 -1.849 987 1HB TYR 127 1HB TYR 127 11.794 9.698 -2.498 988 2HB TYR 127 2HB TYR 127 10.857 9.675 -3.985 989 HD1 TYR 127 HD1 TYR 127 12.202 11.754 -1.310 990 HD2 TYR 127 HD2 TYR 127 9.815 11.722 -4.829 991 HE1 TYR 127 HE1 TYR 127 12.388 14.202 -1.452 992 HE2 TYR 127 HE2 TYR 127 9.993 14.169 -4.982 993 HH TYR 127 HH TYR 127 10.465 16.082 -3.597 994 H VAL 128 H VAL 128 7.610 10.238 -3.490 995 HA VAL 128 HA VAL 128 7.441 7.648 -4.878 996 HB VAL 128 HB VAL 128 4.992 8.278 -5.288 997 1HG1 VAL 128 1HG1 VAL 128 5.615 6.475 -3.809 998 2HG1 VAL 128 2HG1 VAL 128 4.299 7.395 -3.079 999 3HG1 VAL 128 3HG1 VAL 128 5.953 7.614 -2.506 1000 1HG2 VAL 128 1HG2 VAL 128 5.094 10.610 -4.611 1001 2HG2 VAL 128 2HG2 VAL 128 5.581 10.135 -2.984 1002 3HG2 VAL 128 3HG2 VAL 128 3.971 9.725 -3.577 1003 H GLU 129 H GLU 129 8.290 7.855 -6.797 1004 HA GLU 129 HA GLU 129 8.298 10.458 -8.114 1005 1HB GLU 129 1HB GLU 129 10.375 9.040 -7.759 1006 2HB GLU 129 2HB GLU 129 9.722 7.930 -8.951 1007 1HG GLU 129 1HG GLU 129 9.804 9.649 -10.645 1008 2HG GLU 129 2HG GLU 129 10.361 10.825 -9.452 1009 H LEU 130 H LEU 130 6.598 10.851 -9.370 1010 HA LEU 130 HA LEU 130 5.220 8.618 -10.658 1011 1HB LEU 130 1HB LEU 130 3.928 10.207 -9.262 1012 2HB LEU 130 2HB LEU 130 4.367 11.497 -10.363 1013 HG LEU 130 HG LEU 130 3.192 10.244 -12.189 1014 1HD1 LEU 130 1HD1 LEU 130 1.630 8.489 -11.567 1015 2HD1 LEU 130 2HD1 LEU 130 2.183 8.566 -9.894 1016 3HD1 LEU 130 3HD1 LEU 130 3.282 8.023 -11.164 1017 1HD2 LEU 130 1HD2 LEU 130 1.538 11.022 -9.789 1018 2HD2 LEU 130 2HD2 LEU 130 0.946 10.870 -11.444 1019 3HD2 LEU 130 3HD2 LEU 130 2.132 12.112 -11.041 1020 H ILE 131 H ILE 131 5.327 8.260 -12.761 1021 HA ILE 131 HA ILE 131 6.175 10.457 -14.536 1022 HB ILE 131 HB ILE 131 6.722 7.574 -15.140 1023 1HG1 ILE 131 1HG1 ILE 131 7.931 8.162 -13.050 1024 2HG1 ILE 131 2HG1 ILE 131 9.024 7.844 -14.391 1025 1HG2 ILE 131 1HG2 ILE 131 7.869 10.139 -16.207 1026 2HG2 ILE 131 2HG2 ILE 131 6.708 9.090 -17.020 1027 3HG2 ILE 131 3HG2 ILE 131 8.349 8.519 -16.713 1028 1HD1 ILE 131 1HD1 ILE 131 9.329 10.244 -14.710 1029 2HD1 ILE 131 2HD1 ILE 131 9.759 9.748 -13.074 1030 3HD1 ILE 131 3HD1 ILE 131 8.223 10.562 -13.373 1031 H GLU 132 H GLU 132 4.640 11.010 -15.837 1032 HA GLU 132 HA GLU 132 2.287 9.489 -16.253 1033 1HB GLU 132 1HB GLU 132 3.306 11.822 -17.885 1034 2HB GLU 132 2HB GLU 132 1.657 11.220 -17.843 1035 1HG GLU 132 1HG GLU 132 1.414 12.954 -16.419 1036 2HG GLU 132 2HG GLU 132 1.943 11.742 -15.255 Start of MODEL 19 1 H VAL 1 H VAL 1 4.296 14.366 -11.766 2 HA VAL 1 HA VAL 1 4.891 16.487 -9.823 3 HB VAL 1 HB VAL 1 2.951 15.457 -8.513 4 1HG1 VAL 1 1HG1 VAL 1 2.432 16.789 -11.170 5 2HG1 VAL 1 2HG1 VAL 1 2.765 17.594 -9.637 6 3HG1 VAL 1 3HG1 VAL 1 1.273 16.677 -9.847 7 1HG2 VAL 1 1HG2 VAL 1 2.807 13.348 -9.747 8 2HG2 VAL 1 2HG2 VAL 1 2.374 14.230 -11.212 9 3HG2 VAL 1 3HG2 VAL 1 1.288 14.239 -9.822 10 H LYS 2 H LYS 2 6.425 16.031 -8.447 11 HA LYS 2 HA LYS 2 6.886 13.223 -7.694 12 1HB LYS 2 1HB LYS 2 8.855 15.469 -8.178 13 2HB LYS 2 2HB LYS 2 9.298 13.956 -7.396 14 1HG LYS 2 1HG LYS 2 9.126 12.743 -9.328 15 2HG LYS 2 2HG LYS 2 7.920 13.823 -10.025 16 1HD LYS 2 1HD LYS 2 9.961 14.047 -11.267 17 2HD LYS 2 2HD LYS 2 9.699 15.523 -10.343 18 1HE LYS 2 1HE LYS 2 12.030 14.873 -10.251 19 2HE LYS 2 2HE LYS 2 11.295 14.743 -8.655 20 1HZ LYS 2 1HZ LYS 2 11.192 12.395 -8.865 21 2HZ LYS 2 2HZ LYS 2 12.765 12.858 -9.288 22 3HZ LYS 2 3HZ LYS 2 11.653 12.433 -10.493 23 H PHE 3 H PHE 3 6.360 12.853 -5.645 24 HA PHE 3 HA PHE 3 6.332 15.146 -3.799 25 1HB PHE 3 1HB PHE 3 4.554 12.702 -3.873 26 2HB PHE 3 2HB PHE 3 4.531 13.904 -2.589 27 HD1 PHE 3 HD1 PHE 3 3.867 16.250 -3.136 28 HD2 PHE 3 HD2 PHE 3 3.380 13.034 -5.879 29 HE1 PHE 3 HE1 PHE 3 2.234 17.582 -4.402 30 HE2 PHE 3 HE2 PHE 3 1.748 14.362 -7.152 31 HZ PHE 3 HZ PHE 3 1.174 16.641 -6.416 32 H ALA 4 H ALA 4 6.781 14.785 -1.603 33 HA ALA 4 HA ALA 4 8.549 12.492 -1.098 34 1HB ALA 4 1HB ALA 4 9.525 14.702 -0.709 35 2HB ALA 4 2HB ALA 4 9.396 13.792 0.796 36 3HB ALA 4 3HB ALA 4 8.239 15.075 0.439 37 H CYS 5 H CYS 5 8.035 10.980 0.362 38 HA CYS 5 HA CYS 5 5.529 11.307 1.880 39 1HB CYS 5 1HB CYS 5 6.623 8.648 0.998 40 2HB CYS 5 2HB CYS 5 4.967 9.077 1.412 41 HG CYS 5 HG CYS 5 6.592 10.048 -1.437 42 H ARG 6 H ARG 6 5.557 9.439 3.703 43 HA ARG 6 HA ARG 6 8.168 9.690 5.013 44 1HB ARG 6 1HB ARG 6 5.805 10.246 6.089 45 2HB ARG 6 2HB ARG 6 5.847 8.530 6.465 46 1HG ARG 6 1HG ARG 6 6.755 9.584 8.345 47 2HG ARG 6 2HG ARG 6 8.148 8.964 7.457 48 1HD ARG 6 1HD ARG 6 7.164 11.806 7.638 49 2HD ARG 6 2HD ARG 6 8.727 11.161 8.134 50 HE ARG 6 HE ARG 6 8.152 10.923 5.311 51 1HH1 ARG 6 1HH1 ARG 6 9.625 12.908 7.798 52 2HH1 ARG 6 2HH1 ARG 6 10.567 13.830 6.655 53 1HH2 ARG 6 1HH2 ARG 6 9.392 12.095 3.841 54 2HH2 ARG 6 2HH2 ARG 6 10.421 13.378 4.405 55 H ALA 7 H ALA 7 9.463 8.040 5.231 56 HA ALA 7 HA ALA 7 8.801 5.604 3.855 57 1HB ALA 7 1HB ALA 7 11.139 5.029 4.169 58 2HB ALA 7 2HB ALA 7 11.345 6.398 5.261 59 3HB ALA 7 3HB ALA 7 10.978 6.676 3.558 60 H ILE 8 H ILE 8 8.123 3.785 4.716 61 HA ILE 8 HA ILE 8 8.518 3.344 7.602 62 HB ILE 8 HB ILE 8 6.423 2.104 5.801 63 1HG1 ILE 8 1HG1 ILE 8 5.954 4.468 6.188 64 2HG1 ILE 8 2HG1 ILE 8 4.811 3.471 7.083 65 1HG2 ILE 8 1HG2 ILE 8 5.461 1.226 7.877 66 2HG2 ILE 8 2HG2 ILE 8 6.815 1.898 8.785 67 3HG2 ILE 8 3HG2 ILE 8 7.095 0.618 7.604 68 1HD1 ILE 8 1HD1 ILE 8 6.064 3.858 9.128 69 2HD1 ILE 8 2HD1 ILE 8 5.571 5.382 8.389 70 3HD1 ILE 8 3HD1 ILE 8 7.238 4.825 8.237 71 H THR 9 H THR 9 8.278 1.643 4.486 72 HA THR 9 HA THR 9 10.266 -0.307 5.419 73 HB THR 9 HB THR 9 9.080 -0.432 2.689 74 HG1 THR 9 HG1 THR 9 7.617 -0.404 4.999 75 1HG2 THR 9 1HG2 THR 9 9.737 -2.489 4.796 76 2HG2 THR 9 2HG2 THR 9 10.664 -2.142 3.336 77 3HG2 THR 9 3HG2 THR 9 9.058 -2.860 3.213 78 H ARG 10 H ARG 10 11.899 -0.857 3.519 79 HA ARG 10 HA ARG 10 12.754 1.689 2.318 80 1HB ARG 10 1HB ARG 10 14.602 -0.297 3.645 81 2HB ARG 10 2HB ARG 10 15.098 1.168 2.804 82 1HG ARG 10 1HG ARG 10 13.660 2.431 4.466 83 2HG ARG 10 2HG ARG 10 13.581 0.927 5.381 84 1HD ARG 10 1HD ARG 10 15.344 2.127 6.336 85 2HD ARG 10 2HD ARG 10 16.121 0.928 5.304 86 HE ARG 10 HE ARG 10 16.416 2.757 3.651 87 1HH1 ARG 10 1HH1 ARG 10 15.940 3.510 7.042 88 2HH1 ARG 10 2HH1 ARG 10 16.701 5.067 6.937 89 1HH2 ARG 10 1HH2 ARG 10 17.435 4.795 3.503 90 2HH2 ARG 10 2HH2 ARG 10 17.545 5.803 4.915 91 H GLY 11 H GLY 11 14.761 1.094 0.768 92 1HA GLY 11 1HA GLY 11 15.422 -0.265 -1.079 93 2HA GLY 11 2HA GLY 11 13.934 -1.185 -0.889 94 H ARG 12 H ARG 12 13.695 -0.827 -3.221 95 HA ARG 12 HA ARG 12 12.108 1.602 -3.597 96 1HB ARG 12 1HB ARG 12 13.053 2.050 -5.794 97 2HB ARG 12 2HB ARG 12 14.310 2.108 -4.568 98 1HG ARG 12 1HG ARG 12 15.047 -0.123 -5.207 99 2HG ARG 12 2HG ARG 12 13.775 -0.193 -6.427 100 1HD ARG 12 1HD ARG 12 14.750 1.731 -7.564 101 2HD ARG 12 2HD ARG 12 16.011 1.824 -6.338 102 HE ARG 12 HE ARG 12 16.165 -0.728 -7.376 103 1HH1 ARG 12 1HH1 ARG 12 16.415 2.535 -8.598 104 2HH1 ARG 12 2HH1 ARG 12 17.519 2.123 -9.868 105 1HH2 ARG 12 1HH2 ARG 12 17.643 -1.288 -9.043 106 2HH2 ARG 12 2HH2 ARG 12 18.230 -0.049 -10.118 107 H ALA 13 H ALA 13 10.676 1.460 -5.479 108 HA ALA 13 HA ALA 13 10.092 -1.241 -6.413 109 1HB ALA 13 1HB ALA 13 8.821 -1.040 -4.337 110 2HB ALA 13 2HB ALA 13 7.745 -1.091 -5.734 111 3HB ALA 13 3HB ALA 13 8.076 0.443 -4.931 112 H GLU 14 H GLU 14 8.475 -1.231 -8.134 113 HA GLU 14 HA GLU 14 7.921 1.297 -9.430 114 1HB GLU 14 1HB GLU 14 9.052 0.584 -11.541 115 2HB GLU 14 2HB GLU 14 10.174 0.895 -10.223 116 1HG GLU 14 1HG GLU 14 10.280 -1.530 -9.783 117 2HG GLU 14 2HG GLU 14 9.226 -1.802 -11.168 118 H GLY 15 H GLY 15 6.151 1.148 -10.799 119 1HA GLY 15 1HA GLY 15 5.402 -1.095 -12.254 120 2HA GLY 15 2HA GLY 15 4.588 -1.224 -10.703 121 H GLU 16 H GLU 16 3.000 -1.139 -12.775 122 HA GLU 16 HA GLU 16 2.154 1.487 -13.506 123 1HB GLU 16 1HB GLU 16 1.734 -0.512 -14.898 124 2HB GLU 16 2HB GLU 16 0.686 -1.159 -13.646 125 1HG GLU 16 1HG GLU 16 -0.892 0.618 -13.974 126 2HG GLU 16 2HG GLU 16 0.194 1.423 -15.106 127 H ALA 17 H ALA 17 0.611 2.754 -12.603 128 HA ALA 17 HA ALA 17 0.026 2.233 -9.833 129 1HB ALA 17 1HB ALA 17 -0.869 4.486 -9.801 130 2HB ALA 17 2HB ALA 17 -0.762 4.571 -11.560 131 3HB ALA 17 3HB ALA 17 0.706 4.453 -10.591 132 H LEU 18 H LEU 18 -1.736 1.383 -9.043 133 HA LEU 18 HA LEU 18 -4.231 1.483 -10.612 134 1HB LEU 18 1HB LEU 18 -2.964 -0.756 -9.754 135 2HB LEU 18 2HB LEU 18 -3.959 -0.422 -8.351 136 HG LEU 18 HG LEU 18 -5.953 -0.391 -9.900 137 1HD1 LEU 18 1HD1 LEU 18 -4.767 0.007 -11.981 138 2HD1 LEU 18 2HD1 LEU 18 -5.669 -1.506 -12.070 139 3HD1 LEU 18 3HD1 LEU 18 -3.923 -1.533 -11.816 140 1HD2 LEU 18 1HD2 LEU 18 -4.344 -2.934 -9.676 141 2HD2 LEU 18 2HD2 LEU 18 -6.064 -2.848 -10.057 142 3HD2 LEU 18 3HD2 LEU 18 -5.481 -2.303 -8.484 143 H VAL 19 H VAL 19 -5.536 3.040 -9.799 144 HA VAL 19 HA VAL 19 -5.095 3.810 -6.995 145 HB VAL 19 HB VAL 19 -6.220 5.484 -9.242 146 1HG1 VAL 19 1HG1 VAL 19 -5.942 7.363 -7.696 147 2HG1 VAL 19 2HG1 VAL 19 -5.409 6.248 -6.438 148 3HG1 VAL 19 3HG1 VAL 19 -7.060 6.160 -7.051 149 1HG2 VAL 19 1HG2 VAL 19 -4.072 6.670 -9.154 150 2HG2 VAL 19 2HG2 VAL 19 -3.872 4.977 -9.610 151 3HG2 VAL 19 3HG2 VAL 19 -3.486 5.501 -7.971 152 H THR 20 H THR 20 -6.694 3.764 -5.570 153 HA THR 20 HA THR 20 -9.454 3.894 -6.481 154 HB THR 20 HB THR 20 -9.258 1.533 -6.396 155 HG1 THR 20 HG1 THR 20 -10.239 1.934 -3.791 156 1HG2 THR 20 1HG2 THR 20 -7.975 1.803 -3.678 157 2HG2 THR 20 2HG2 THR 20 -7.133 1.390 -5.170 158 3HG2 THR 20 3HG2 THR 20 -8.343 0.292 -4.508 159 H LYS 21 H LYS 21 -10.322 5.506 -5.368 160 HA LYS 21 HA LYS 21 -9.258 6.263 -2.789 161 1HB LYS 21 1HB LYS 21 -10.087 7.891 -4.580 162 2HB LYS 21 2HB LYS 21 -11.714 7.402 -4.124 163 1HG LYS 21 1HG LYS 21 -11.095 9.466 -3.014 164 2HG LYS 21 2HG LYS 21 -11.304 8.168 -1.837 165 1HD LYS 21 1HD LYS 21 -8.835 7.828 -1.874 166 2HD LYS 21 2HD LYS 21 -8.697 9.254 -2.904 167 1HE LYS 21 1HE LYS 21 -9.871 9.186 -0.128 168 2HE LYS 21 2HE LYS 21 -8.264 9.773 -0.544 169 1HZ LYS 21 1HZ LYS 21 -9.290 11.491 -1.903 170 2HZ LYS 21 2HZ LYS 21 -9.826 11.587 -0.299 171 3HZ LYS 21 3HZ LYS 21 -10.834 10.927 -1.485 172 H GLU 22 H GLU 22 -11.477 4.087 -3.953 173 HA GLU 22 HA GLU 22 -13.238 4.031 -1.663 174 1HB GLU 22 1HB GLU 22 -13.620 3.224 -4.159 175 2HB GLU 22 2HB GLU 22 -12.912 1.737 -3.563 176 1HG GLU 22 1HG GLU 22 -15.288 3.036 -2.268 177 2HG GLU 22 2HG GLU 22 -15.433 1.882 -3.588 178 H TYR 23 H TYR 23 -13.190 2.348 -0.087 179 HA TYR 23 HA TYR 23 -10.424 1.754 0.618 180 1HB TYR 23 1HB TYR 23 -12.928 1.297 2.252 181 2HB TYR 23 2HB TYR 23 -11.269 1.291 2.838 182 HD1 TYR 23 HD1 TYR 23 -14.187 3.229 2.453 183 HD2 TYR 23 HD2 TYR 23 -9.940 3.522 2.458 184 HE1 TYR 23 HE1 TYR 23 -14.358 5.638 2.919 185 HE2 TYR 23 HE2 TYR 23 -10.102 5.928 2.929 186 HH TYR 23 HH TYR 23 -11.877 7.760 2.495 187 H ILE 24 H ILE 24 -9.816 -0.376 1.448 188 HA ILE 24 HA ILE 24 -11.577 -2.581 0.803 189 HB ILE 24 HB ILE 24 -10.502 -2.279 -1.345 190 1HG1 ILE 24 1HG1 ILE 24 -9.305 -4.644 0.115 191 2HG1 ILE 24 2HG1 ILE 24 -10.929 -4.578 -0.564 192 1HG2 ILE 24 1HG2 ILE 24 -8.074 -2.476 -1.628 193 2HG2 ILE 24 2HG2 ILE 24 -7.881 -2.507 0.125 194 3HG2 ILE 24 3HG2 ILE 24 -8.519 -1.065 -0.666 195 1HD1 ILE 24 1HD1 ILE 24 -9.953 -4.298 -2.802 196 2HD1 ILE 24 2HD1 ILE 24 -9.463 -5.803 -2.025 197 3HD1 ILE 24 3HD1 ILE 24 -8.343 -4.442 -2.095 198 H SER 25 H SER 25 -11.452 -4.088 2.164 199 HA SER 25 HA SER 25 -9.669 -3.864 4.382 200 1HB SER 25 1HB SER 25 -11.472 -6.206 3.922 201 2HB SER 25 2HB SER 25 -11.105 -5.339 5.408 202 HG SER 25 HG SER 25 -12.962 -4.760 3.428 203 H PHE 26 H PHE 26 -7.932 -5.092 4.883 204 HA PHE 26 HA PHE 26 -6.615 -6.413 2.730 205 1HB PHE 26 1HB PHE 26 -5.870 -6.181 5.649 206 2HB PHE 26 2HB PHE 26 -4.812 -6.805 4.390 207 HD1 PHE 26 HD1 PHE 26 -3.599 -5.361 2.993 208 HD2 PHE 26 HD2 PHE 26 -6.568 -3.792 5.599 209 HE1 PHE 26 HE1 PHE 26 -2.791 -3.086 2.536 210 HE2 PHE 26 HE2 PHE 26 -5.769 -1.510 5.147 211 HZ PHE 26 HZ PHE 26 -3.878 -1.155 3.609 212 H LEU 27 H LEU 27 -8.720 -7.518 5.195 213 HA LEU 27 HA LEU 27 -7.620 -10.081 5.670 214 1HB LEU 27 1HB LEU 27 -9.382 -8.768 7.018 215 2HB LEU 27 2HB LEU 27 -10.549 -9.416 5.884 216 HG LEU 27 HG LEU 27 -10.419 -10.667 8.031 217 1HD1 LEU 27 1HD1 LEU 27 -10.329 -12.912 7.058 218 2HD1 LEU 27 2HD1 LEU 27 -9.627 -12.240 5.587 219 3HD1 LEU 27 3HD1 LEU 27 -11.268 -11.799 6.064 220 1HD2 LEU 27 1HD2 LEU 27 -8.503 -12.121 8.450 221 2HD2 LEU 27 2HD2 LEU 27 -8.034 -10.423 8.455 222 3HD2 LEU 27 3HD2 LEU 27 -7.670 -11.433 7.057 223 H GLY 28 H GLY 28 -10.628 -9.320 3.878 224 1HA GLY 28 1HA GLY 28 -10.042 -11.665 2.172 225 2HA GLY 28 2HA GLY 28 -11.666 -11.134 2.590 226 H GLY 29 H GLY 29 -8.989 -9.060 1.681 227 1HA GLY 29 1HA GLY 29 -10.683 -7.981 -0.444 228 2HA GLY 29 2HA GLY 29 -9.319 -7.167 0.302 229 H ILE 30 H ILE 30 -7.818 -9.861 -0.066 230 HA ILE 30 HA ILE 30 -7.280 -9.516 -2.941 231 HB ILE 30 HB ILE 30 -5.140 -9.874 -0.831 232 1HG1 ILE 30 1HG1 ILE 30 -5.840 -7.404 -2.441 233 2HG1 ILE 30 2HG1 ILE 30 -6.206 -7.634 -0.736 234 1HG2 ILE 30 1HG2 ILE 30 -4.569 -10.860 -2.987 235 2HG2 ILE 30 2HG2 ILE 30 -3.580 -9.438 -2.664 236 3HG2 ILE 30 3HG2 ILE 30 -4.930 -9.333 -3.794 237 1HD1 ILE 30 1HD1 ILE 30 -4.258 -6.241 -0.997 238 2HD1 ILE 30 2HD1 ILE 30 -3.464 -7.486 -1.962 239 3HD1 ILE 30 3HD1 ILE 30 -3.806 -7.777 -0.258 240 H ASP 31 H ASP 31 -7.104 -11.336 -4.063 241 HA ASP 31 HA ASP 31 -7.615 -13.882 -2.908 242 1HB ASP 31 1HB ASP 31 -8.180 -13.141 -5.272 243 2HB ASP 31 2HB ASP 31 -6.477 -13.318 -5.652 244 H LYS 32 H LYS 32 -6.209 -15.399 -2.164 245 HA LYS 32 HA LYS 32 -3.475 -14.548 -1.841 246 1HB LYS 32 1HB LYS 32 -3.218 -16.540 -0.442 247 2HB LYS 32 2HB LYS 32 -4.632 -15.605 0.020 248 1HG LYS 32 1HG LYS 32 -6.083 -17.180 -1.109 249 2HG LYS 32 2HG LYS 32 -4.684 -18.094 -1.675 250 1HD LYS 32 1HD LYS 32 -5.439 -17.664 1.219 251 2HD LYS 32 2HD LYS 32 -5.745 -19.135 0.293 252 1HE LYS 32 1HE LYS 32 -3.324 -19.400 -0.054 253 2HE LYS 32 2HE LYS 32 -3.040 -17.947 0.903 254 1HZ LYS 32 1HZ LYS 32 -4.387 -20.392 1.926 255 2HZ LYS 32 2HZ LYS 32 -3.943 -19.023 2.828 256 3HZ LYS 32 3HZ LYS 32 -2.747 -20.028 2.163 257 H GLU 33 H GLU 33 -5.059 -16.193 -4.260 258 HA GLU 33 HA GLU 33 -2.734 -17.848 -4.933 259 1HB GLU 33 1HB GLU 33 -5.510 -17.811 -6.135 260 2HB GLU 33 2HB GLU 33 -4.223 -18.925 -6.573 261 1HG GLU 33 1HG GLU 33 -4.257 -19.886 -4.354 262 2HG GLU 33 2HG GLU 33 -5.478 -18.718 -3.848 263 H THR 34 H THR 34 -5.017 -15.622 -6.527 264 HA THR 34 HA THR 34 -3.056 -15.276 -8.684 265 HB THR 34 HB THR 34 -5.042 -14.223 -9.891 266 HG1 THR 34 HG1 THR 34 -6.315 -15.327 -7.588 267 1HG2 THR 34 1HG2 THR 34 -5.982 -16.406 -10.492 268 2HG2 THR 34 2HG2 THR 34 -5.201 -17.128 -9.085 269 3HG2 THR 34 3HG2 THR 34 -4.222 -16.470 -10.395 270 H GLY 35 H GLY 35 -4.095 -13.653 -5.948 271 1HA GLY 35 1HA GLY 35 -3.591 -11.543 -5.180 272 2HA GLY 35 2HA GLY 35 -2.667 -11.285 -6.652 273 H ILE 36 H ILE 36 -5.948 -12.238 -6.983 274 HA ILE 36 HA ILE 36 -6.664 -9.677 -8.133 275 HB ILE 36 HB ILE 36 -8.301 -12.198 -7.744 276 1HG1 ILE 36 1HG1 ILE 36 -6.387 -12.451 -9.304 277 2HG1 ILE 36 2HG1 ILE 36 -7.945 -12.621 -10.102 278 1HG2 ILE 36 1HG2 ILE 36 -9.754 -10.271 -7.870 279 2HG2 ILE 36 2HG2 ILE 36 -9.870 -11.208 -9.359 280 3HG2 ILE 36 3HG2 ILE 36 -8.936 -9.713 -9.329 281 1HD1 ILE 36 1HD1 ILE 36 -6.377 -11.342 -11.451 282 2HD1 ILE 36 2HD1 ILE 36 -6.210 -10.163 -10.149 283 3HD1 ILE 36 3HD1 ILE 36 -7.759 -10.358 -10.969 284 H VAL 37 H VAL 37 -7.688 -8.074 -7.021 285 HA VAL 37 HA VAL 37 -8.357 -8.322 -4.298 286 HB VAL 37 HB VAL 37 -9.668 -6.166 -4.649 287 1HG1 VAL 37 1HG1 VAL 37 -7.392 -6.145 -3.848 288 2HG1 VAL 37 2HG1 VAL 37 -7.623 -4.829 -5.001 289 3HG1 VAL 37 3HG1 VAL 37 -6.776 -6.298 -5.494 290 1HG2 VAL 37 1HG2 VAL 37 -8.487 -6.415 -7.412 291 2HG2 VAL 37 2HG2 VAL 37 -9.275 -4.982 -6.752 292 3HG2 VAL 37 3HG2 VAL 37 -10.202 -6.461 -7.002 293 H LYS 38 H LYS 38 -9.990 -9.250 -3.345 294 HA LYS 38 HA LYS 38 -12.138 -10.353 -4.956 295 1HB LYS 38 1HB LYS 38 -11.641 -10.745 -2.000 296 2HB LYS 38 2HB LYS 38 -12.640 -11.739 -3.050 297 1HG LYS 38 1HG LYS 38 -9.684 -11.431 -3.453 298 2HG LYS 38 2HG LYS 38 -10.383 -12.671 -2.411 299 1HD LYS 38 1HD LYS 38 -11.289 -12.365 -5.252 300 2HD LYS 38 2HD LYS 38 -9.821 -13.258 -4.872 301 1HE LYS 38 1HE LYS 38 -11.301 -14.549 -3.200 302 2HE LYS 38 2HE LYS 38 -12.652 -13.875 -4.112 303 1HZ LYS 38 1HZ LYS 38 -11.777 -14.898 -6.118 304 2HZ LYS 38 2HZ LYS 38 -12.019 -16.073 -4.919 305 3HZ LYS 38 3HZ LYS 38 -10.451 -15.520 -5.257 306 H GLU 39 H GLU 39 -11.674 -8.067 -2.340 307 HA GLU 39 HA GLU 39 -14.482 -7.586 -1.968 308 1HB GLU 39 1HB GLU 39 -12.662 -7.242 -0.216 309 2HB GLU 39 2HB GLU 39 -12.197 -5.808 -1.116 310 1HG GLU 39 1HG GLU 39 -14.354 -4.808 -0.738 311 2HG GLU 39 2HG GLU 39 -14.926 -6.272 0.063 312 H ASP 40 H ASP 40 -15.611 -6.655 -3.556 313 HA ASP 40 HA ASP 40 -14.237 -4.736 -5.308 314 1HB ASP 40 1HB ASP 40 -14.881 -6.688 -6.520 315 2HB ASP 40 2HB ASP 40 -16.497 -6.659 -5.835 316 H CYS 41 H CYS 41 -15.138 -2.835 -5.838 317 HA CYS 41 HA CYS 41 -17.641 -2.066 -4.506 318 1HB CYS 41 1HB CYS 41 -16.850 0.283 -4.918 319 2HB CYS 41 2HB CYS 41 -15.836 -0.638 -3.813 320 HG CYS 41 HG CYS 41 -14.163 0.945 -5.359 321 H GLU 42 H GLU 42 -15.780 -1.645 -7.491 322 HA GLU 42 HA GLU 42 -17.931 -2.208 -9.213 323 1HB GLU 42 1HB GLU 42 -18.265 0.004 -10.231 324 2HB GLU 42 2HB GLU 42 -18.767 -0.017 -8.548 325 1HG GLU 42 1HG GLU 42 -16.692 1.097 -7.910 326 2HG GLU 42 2HG GLU 42 -16.174 1.103 -9.596 327 H ILE 43 H ILE 43 -14.758 -0.842 -8.687 328 HA ILE 43 HA ILE 43 -14.022 -1.502 -11.462 329 HB ILE 43 HB ILE 43 -12.070 0.044 -11.078 330 1HG1 ILE 43 1HG1 ILE 43 -13.711 0.862 -8.669 331 2HG1 ILE 43 2HG1 ILE 43 -12.152 0.047 -8.617 332 1HG2 ILE 43 1HG2 ILE 43 -13.392 2.082 -11.457 333 2HG2 ILE 43 2HG2 ILE 43 -14.843 1.213 -10.957 334 3HG2 ILE 43 3HG2 ILE 43 -13.973 0.713 -12.407 335 1HD1 ILE 43 1HD1 ILE 43 -11.948 2.427 -8.159 336 2HD1 ILE 43 2HD1 ILE 43 -12.656 2.795 -9.732 337 3HD1 ILE 43 3HD1 ILE 43 -11.095 1.979 -9.637 338 H LYS 44 H LYS 44 -13.966 -3.028 -8.709 339 HA LYS 44 HA LYS 44 -11.134 -3.611 -8.535 340 1HB LYS 44 1HB LYS 44 -13.551 -4.053 -6.849 341 2HB LYS 44 2HB LYS 44 -12.157 -5.079 -6.613 342 1HG LYS 44 1HG LYS 44 -10.877 -3.391 -5.752 343 2HG LYS 44 2HG LYS 44 -11.723 -2.144 -6.673 344 1HD LYS 44 1HD LYS 44 -13.390 -1.940 -5.128 345 2HD LYS 44 2HD LYS 44 -13.262 -3.620 -4.607 346 1HE LYS 44 1HE LYS 44 -11.170 -3.085 -3.445 347 2HE LYS 44 2HE LYS 44 -11.331 -1.398 -3.939 348 1HZ LYS 44 1HZ LYS 44 -13.294 -2.866 -2.255 349 2HZ LYS 44 2HZ LYS 44 -13.362 -1.223 -2.659 350 3HZ LYS 44 3HZ LYS 44 -12.124 -1.799 -1.661 351 H GLY 45 H GLY 45 -10.322 -5.711 -8.752 352 1HA GLY 45 1HA GLY 45 -11.171 -8.102 -9.284 353 2HA GLY 45 2HA GLY 45 -11.848 -7.295 -10.692 354 H GLU 46 H GLU 46 -9.124 -5.652 -10.016 355 HA GLU 46 HA GLU 46 -7.564 -7.030 -12.017 356 1HB GLU 46 1HB GLU 46 -7.349 -4.415 -10.569 357 2HB GLU 46 2HB GLU 46 -5.960 -5.059 -11.434 358 1HG GLU 46 1HG GLU 46 -8.658 -4.600 -12.677 359 2HG GLU 46 2HG GLU 46 -7.327 -3.442 -12.733 360 H SER 47 H SER 47 -5.344 -7.610 -11.683 361 HA SER 47 HA SER 47 -4.843 -8.704 -9.040 362 1HB SER 47 1HB SER 47 -4.411 -10.088 -11.046 363 2HB SER 47 2HB SER 47 -3.221 -8.907 -11.594 364 HG SER 47 HG SER 47 -3.007 -10.876 -9.684 365 H VAL 48 H VAL 48 -2.975 -8.248 -7.840 366 HA VAL 48 HA VAL 48 -1.825 -5.595 -8.366 367 HB VAL 48 HB VAL 48 -1.127 -5.669 -5.967 368 1HG1 VAL 48 1HG1 VAL 48 -3.167 -4.514 -6.633 369 2HG1 VAL 48 2HG1 VAL 48 -3.367 -5.272 -5.053 370 3HG1 VAL 48 3HG1 VAL 48 -4.081 -6.015 -6.486 371 1HG2 VAL 48 1HG2 VAL 48 -2.819 -8.172 -5.905 372 2HG2 VAL 48 2HG2 VAL 48 -2.153 -7.348 -4.495 373 3HG2 VAL 48 3HG2 VAL 48 -1.073 -8.092 -5.674 374 H ALA 49 H ALA 49 -1.077 -8.457 -9.302 375 HA ALA 49 HA ALA 49 1.385 -9.121 -8.090 376 1HB ALA 49 1HB ALA 49 1.581 -10.806 -9.797 377 2HB ALA 49 2HB ALA 49 0.327 -10.025 -10.761 378 3HB ALA 49 3HB ALA 49 -0.079 -10.756 -9.209 379 H GLY 50 H GLY 50 2.564 -7.188 -8.182 380 1HA GLY 50 1HA GLY 50 4.744 -6.743 -9.101 381 2HA GLY 50 2HA GLY 50 4.095 -7.077 -10.697 382 H ARG 51 H ARG 51 1.793 -5.266 -9.213 383 HA ARG 51 HA ARG 51 2.924 -2.826 -10.398 384 1HB ARG 51 1HB ARG 51 0.483 -2.089 -10.542 385 2HB ARG 51 2HB ARG 51 1.014 -3.336 -11.658 386 1HG ARG 51 1HG ARG 51 -0.123 -5.019 -10.480 387 2HG ARG 51 2HG ARG 51 -0.347 -3.986 -9.068 388 1HD ARG 51 1HD ARG 51 -2.393 -4.315 -10.468 389 2HD ARG 51 2HD ARG 51 -1.939 -2.636 -10.198 390 HE ARG 51 HE ARG 51 -0.901 -2.801 -12.509 391 1HH1 ARG 51 1HH1 ARG 51 -3.594 -4.827 -11.561 392 2HH1 ARG 51 2HH1 ARG 51 -4.325 -4.832 -13.143 393 1HH2 ARG 51 1HH2 ARG 51 -1.854 -2.793 -14.605 394 2HH2 ARG 51 2HH2 ARG 51 -3.317 -3.698 -14.875 395 H ILE 52 H ILE 52 1.270 -0.918 -9.412 396 HA ILE 52 HA ILE 52 1.839 -1.034 -6.520 397 HB ILE 52 HB ILE 52 2.030 1.340 -8.385 398 1HG1 ILE 52 1HG1 ILE 52 4.134 -0.105 -6.761 399 2HG1 ILE 52 2HG1 ILE 52 3.930 -0.206 -8.504 400 1HG2 ILE 52 1HG2 ILE 52 1.108 2.034 -6.238 401 2HG2 ILE 52 2HG2 ILE 52 2.759 2.622 -6.423 402 3HG2 ILE 52 3HG2 ILE 52 2.431 1.228 -5.395 403 1HD1 ILE 52 1HD1 ILE 52 5.760 1.267 -7.937 404 2HD1 ILE 52 2HD1 ILE 52 4.686 2.255 -6.948 405 3HD1 ILE 52 3HD1 ILE 52 4.455 2.179 -8.695 406 H LEU 53 H LEU 53 0.080 -0.901 -5.292 407 HA LEU 53 HA LEU 53 -2.387 0.145 -6.498 408 1HB LEU 53 1HB LEU 53 -2.404 -2.200 -5.688 409 2HB LEU 53 2HB LEU 53 -2.033 -1.623 -4.076 410 HG LEU 53 HG LEU 53 -4.191 -0.410 -4.033 411 1HD1 LEU 53 1HD1 LEU 53 -4.468 -0.064 -6.426 412 2HD1 LEU 53 2HD1 LEU 53 -5.869 -0.889 -5.741 413 3HD1 LEU 53 3HD1 LEU 53 -4.671 -1.799 -6.662 414 1HD2 LEU 53 1HD2 LEU 53 -5.601 -2.379 -3.779 415 2HD2 LEU 53 2HD2 LEU 53 -3.997 -2.665 -3.101 416 3HD2 LEU 53 3HD2 LEU 53 -4.426 -3.347 -4.671 417 H VAL 54 H VAL 54 -3.069 2.077 -5.865 418 HA VAL 54 HA VAL 54 -2.033 3.153 -3.323 419 HB VAL 54 HB VAL 54 -3.047 4.707 -5.708 420 1HG1 VAL 54 1HG1 VAL 54 -3.330 5.907 -3.613 421 2HG1 VAL 54 2HG1 VAL 54 -2.045 6.641 -4.576 422 3HG1 VAL 54 3HG1 VAL 54 -1.639 5.615 -3.202 423 1HG2 VAL 54 1HG2 VAL 54 -0.664 5.307 -6.058 424 2HG2 VAL 54 2HG2 VAL 54 -0.993 3.594 -6.315 425 3HG2 VAL 54 3HG2 VAL 54 -0.221 4.129 -4.822 426 H PHE 55 H PHE 55 -3.527 2.801 -1.825 427 HA PHE 55 HA PHE 55 -6.159 4.001 -2.247 428 1HB PHE 55 1HB PHE 55 -7.241 2.141 -1.008 429 2HB PHE 55 2HB PHE 55 -6.552 1.628 -2.541 430 HD1 PHE 55 HD1 PHE 55 -6.679 1.070 0.974 431 HD2 PHE 55 HD2 PHE 55 -4.292 0.462 -2.494 432 HE1 PHE 55 HE1 PHE 55 -5.460 -0.728 2.128 433 HE2 PHE 55 HE2 PHE 55 -3.068 -1.332 -1.346 434 HZ PHE 55 HZ PHE 55 -3.651 -1.932 0.968 435 HA PRO 56 HA PRO 56 -5.375 6.008 1.598 436 1HB PRO 56 1HB PRO 56 -8.188 5.546 2.371 437 2HB PRO 56 2HB PRO 56 -7.321 7.066 2.133 438 1HG PRO 56 1HG PRO 56 -9.158 6.220 0.377 439 2HG PRO 56 2HG PRO 56 -7.701 7.088 -0.142 440 1HD PRO 56 1HD PRO 56 -8.305 4.158 -0.253 441 2HD PRO 56 2HD PRO 56 -7.483 5.186 -1.446 442 H GLY 57 H GLY 57 -7.422 3.120 1.837 443 1HA GLY 57 1HA GLY 57 -5.870 1.619 3.514 444 2HA GLY 57 2HA GLY 57 -6.802 2.649 4.594 445 H GLY 58 H GLY 58 -7.754 0.636 5.388 446 1HA GLY 58 1HA GLY 58 -10.334 0.247 4.499 447 2HA GLY 58 2HA GLY 58 -9.370 -0.950 3.654 448 H LYS 59 H LYS 59 -9.949 0.300 6.931 449 HA LYS 59 HA LYS 59 -10.526 -0.736 8.855 450 1HB LYS 59 1HB LYS 59 -10.841 -3.195 7.125 451 2HB LYS 59 2HB LYS 59 -11.401 -3.038 8.786 452 1HG LYS 59 1HG LYS 59 -12.941 -1.296 8.154 453 2HG LYS 59 2HG LYS 59 -12.319 -1.303 6.506 454 1HD LYS 59 1HD LYS 59 -13.098 -3.628 6.249 455 2HD LYS 59 2HD LYS 59 -13.775 -3.562 7.879 456 1HE LYS 59 1HE LYS 59 -15.219 -1.696 7.183 457 2HE LYS 59 2HE LYS 59 -14.553 -1.801 5.555 458 1HZ LYS 59 1HZ LYS 59 -16.056 -3.967 6.927 459 2HZ LYS 59 2HZ LYS 59 -15.466 -4.008 5.335 460 3HZ LYS 59 3HZ LYS 59 -16.696 -2.919 5.756 461 H GLY 60 H GLY 60 -9.296 -1.271 10.506 462 1HA GLY 60 1HA GLY 60 -6.667 -2.414 9.951 463 2HA GLY 60 2HA GLY 60 -7.172 -1.640 11.445 464 H SER 61 H SER 61 -7.652 -4.549 9.493 465 HA SER 61 HA SER 61 -8.673 -6.028 11.761 466 1HB SER 61 1HB SER 61 -7.936 -7.052 9.009 467 2HB SER 61 2HB SER 61 -8.961 -7.851 10.200 468 HG SER 61 HG SER 61 -10.387 -6.009 9.993 469 H THR 62 H THR 62 -7.680 -8.349 11.988 470 HA THR 62 HA THR 62 -4.972 -8.027 12.875 471 HB THR 62 HB THR 62 -6.569 -9.383 14.142 472 HG1 THR 62 HG1 THR 62 -4.359 -10.804 13.041 473 1HG2 THR 62 1HG2 THR 62 -6.523 -11.274 11.784 474 2HG2 THR 62 2HG2 THR 62 -7.886 -10.266 12.267 475 3HG2 THR 62 3HG2 THR 62 -7.329 -11.560 13.326 476 H VAL 63 H VAL 63 -5.120 -7.624 10.098 477 HA VAL 63 HA VAL 63 -3.688 -9.967 9.047 478 HB VAL 63 HB VAL 63 -5.953 -9.957 8.123 479 1HG1 VAL 63 1HG1 VAL 63 -6.458 -7.600 8.356 480 2HG1 VAL 63 2HG1 VAL 63 -6.727 -8.127 6.694 481 3HG1 VAL 63 3HG1 VAL 63 -5.280 -7.205 7.106 482 1HG2 VAL 63 1HG2 VAL 63 -3.894 -9.127 6.082 483 2HG2 VAL 63 2HG2 VAL 63 -5.407 -9.968 5.740 484 3HG2 VAL 63 3HG2 VAL 63 -4.153 -10.760 6.695 485 H GLY 64 H GLY 64 -2.046 -9.501 7.518 486 1HA GLY 64 1HA GLY 64 -1.241 -7.362 6.207 487 2HA GLY 64 2HA GLY 64 -0.934 -6.820 7.851 488 H SER 65 H SER 65 0.069 -8.955 9.103 489 HA SER 65 HA SER 65 2.697 -9.178 8.097 490 1HB SER 65 1HB SER 65 1.377 -10.939 10.171 491 2HB SER 65 2HB SER 65 3.104 -10.619 9.988 492 HG SER 65 HG SER 65 2.205 -8.276 10.238 493 H TYR 66 H TYR 66 0.090 -11.590 8.392 494 HA TYR 66 HA TYR 66 1.434 -13.253 6.408 495 1HB TYR 66 1HB TYR 66 -0.333 -14.923 6.943 496 2HB TYR 66 2HB TYR 66 0.615 -14.448 8.346 497 HD1 TYR 66 HD1 TYR 66 -2.678 -14.550 6.855 498 HD2 TYR 66 HD2 TYR 66 -0.387 -12.941 10.052 499 HE1 TYR 66 HE1 TYR 66 -4.751 -14.033 8.068 500 HE2 TYR 66 HE2 TYR 66 -2.453 -12.417 11.276 501 HH TYR 66 HH TYR 66 -4.826 -12.003 10.782 502 H VAL 67 H VAL 67 -0.473 -14.403 4.966 503 HA VAL 67 HA VAL 67 -1.811 -14.149 3.149 504 HB VAL 67 HB VAL 67 -2.579 -11.491 4.382 505 1HG1 VAL 67 1HG1 VAL 67 -3.790 -12.899 1.997 506 2HG1 VAL 67 2HG1 VAL 67 -2.857 -11.403 1.954 507 3HG1 VAL 67 3HG1 VAL 67 -4.420 -11.442 2.768 508 1HG2 VAL 67 1HG2 VAL 67 -4.000 -14.149 4.245 509 2HG2 VAL 67 2HG2 VAL 67 -4.706 -12.657 4.865 510 3HG2 VAL 67 3HG2 VAL 67 -3.325 -13.387 5.685 511 H LEU 68 H LEU 68 -0.456 -10.902 3.809 512 HA LEU 68 HA LEU 68 0.203 -10.362 1.120 513 1HB LEU 68 1HB LEU 68 1.221 -9.240 3.724 514 2HB LEU 68 2HB LEU 68 1.846 -8.696 2.180 515 HG LEU 68 HG LEU 68 -0.539 -8.084 1.567 516 1HD1 LEU 68 1HD1 LEU 68 -0.964 -8.435 4.532 517 2HD1 LEU 68 2HD1 LEU 68 -1.689 -9.418 3.260 518 3HD1 LEU 68 3HD1 LEU 68 -2.102 -7.709 3.395 519 1HD2 LEU 68 1HD2 LEU 68 -0.454 -5.984 2.835 520 2HD2 LEU 68 2HD2 LEU 68 1.112 -6.423 2.153 521 3HD2 LEU 68 3HD2 LEU 68 0.795 -6.675 3.869 522 H LEU 69 H LEU 69 2.021 -11.777 3.784 523 HA LEU 69 HA LEU 69 4.469 -12.142 2.464 524 1HB LEU 69 1HB LEU 69 4.186 -12.415 4.883 525 2HB LEU 69 2HB LEU 69 3.174 -13.822 4.618 526 HG LEU 69 HG LEU 69 5.136 -14.961 3.569 527 1HD1 LEU 69 1HD1 LEU 69 7.362 -14.032 3.980 528 2HD1 LEU 69 2HD1 LEU 69 6.627 -12.558 4.611 529 3HD1 LEU 69 3HD1 LEU 69 6.406 -12.999 2.917 530 1HD2 LEU 69 1HD2 LEU 69 4.517 -15.388 5.884 531 2HD2 LEU 69 2HD2 LEU 69 5.487 -14.013 6.411 532 3HD2 LEU 69 3HD2 LEU 69 6.270 -15.420 5.690 533 H ASN 70 H ASN 70 1.543 -14.107 2.608 534 HA ASN 70 HA ASN 70 2.501 -16.383 1.246 535 1HB ASN 70 1HB ASN 70 0.370 -16.284 2.561 536 2HB ASN 70 2HB ASN 70 -0.337 -15.327 1.261 537 1HD2 ASN 70 1HD2 ASN 70 -0.756 -16.320 -0.740 538 2HD2 ASN 70 2HD2 ASN 70 -0.816 -18.036 -0.901 539 H LEU 71 H LEU 71 1.008 -13.387 0.137 540 HA LEU 71 HA LEU 71 0.718 -14.008 -2.569 541 1HB LEU 71 1HB LEU 71 1.421 -11.344 -1.327 542 2HB LEU 71 2HB LEU 71 0.830 -11.573 -2.960 543 HG LEU 71 HG LEU 71 -0.717 -12.189 -0.440 544 1HD1 LEU 71 1HD1 LEU 71 -2.069 -10.266 -1.038 545 2HD1 LEU 71 2HD1 LEU 71 -1.043 -9.956 -2.438 546 3HD1 LEU 71 3HD1 LEU 71 -0.385 -9.792 -0.809 547 1HD2 LEU 71 1HD2 LEU 71 -2.609 -12.515 -1.947 548 2HD2 LEU 71 2HD2 LEU 71 -1.313 -13.663 -2.288 549 3HD2 LEU 71 3HD2 LEU 71 -1.551 -12.265 -3.336 550 H ARG 72 H ARG 72 3.501 -12.785 -0.778 551 HA ARG 72 HA ARG 72 5.176 -12.361 -3.024 552 1HB ARG 72 1HB ARG 72 5.452 -11.506 -0.610 553 2HB ARG 72 2HB ARG 72 6.173 -13.077 -0.281 554 1HG ARG 72 1HG ARG 72 7.460 -12.207 -2.569 555 2HG ARG 72 2HG ARG 72 7.302 -10.758 -1.576 556 1HD ARG 72 1HD ARG 72 9.283 -11.596 -0.804 557 2HD ARG 72 2HD ARG 72 8.153 -12.337 0.326 558 HE ARG 72 HE ARG 72 8.347 -14.392 -0.972 559 1HH1 ARG 72 1HH1 ARG 72 10.822 -11.946 -1.318 560 2HH1 ARG 72 2HH1 ARG 72 11.947 -13.002 -2.132 561 1HH2 ARG 72 1HH2 ARG 72 9.816 -15.814 -1.982 562 2HH2 ARG 72 2HH2 ARG 72 11.363 -15.222 -2.522 563 H LYS 73 H LYS 73 4.503 -15.125 -0.982 564 HA LYS 73 HA LYS 73 6.676 -16.732 -1.811 565 1HB LYS 73 1HB LYS 73 4.007 -17.463 -0.609 566 2HB LYS 73 2HB LYS 73 5.303 -18.618 -0.887 567 1HG LYS 73 1HG LYS 73 6.763 -17.255 0.581 568 2HG LYS 73 2HG LYS 73 5.373 -16.228 0.937 569 1HD LYS 73 1HD LYS 73 4.193 -18.071 1.923 570 2HD LYS 73 2HD LYS 73 5.449 -19.202 1.416 571 1HE LYS 73 1HE LYS 73 7.058 -18.024 2.865 572 2HE LYS 73 2HE LYS 73 5.766 -16.947 3.395 573 1HZ LYS 73 1HZ LYS 73 6.175 -18.757 4.966 574 2HZ LYS 73 2HZ LYS 73 5.786 -19.895 3.768 575 3HZ LYS 73 3HZ LYS 73 4.601 -18.819 4.335 576 H ASN 74 H ASN 74 3.570 -16.057 -3.223 577 HA ASN 74 HA ASN 74 4.011 -18.176 -5.200 578 1HB ASN 74 1HB ASN 74 1.732 -17.826 -4.070 579 2HB ASN 74 2HB ASN 74 1.587 -16.387 -5.077 580 1HD2 ASN 74 1HD2 ASN 74 -0.184 -17.239 -6.199 581 2HD2 ASN 74 2HD2 ASN 74 -0.009 -18.516 -7.355 582 H GLY 75 H GLY 75 4.349 -14.815 -4.745 583 1HA GLY 75 1HA GLY 75 5.729 -13.542 -6.190 584 2HA GLY 75 2HA GLY 75 5.261 -14.590 -7.519 585 H VAL 76 H VAL 76 2.517 -13.894 -5.853 586 HA VAL 76 HA VAL 76 1.721 -11.990 -7.915 587 HB VAL 76 HB VAL 76 -0.597 -12.446 -7.140 588 1HG1 VAL 76 1HG1 VAL 76 -0.722 -14.719 -8.024 589 2HG1 VAL 76 2HG1 VAL 76 1.020 -14.902 -7.817 590 3HG1 VAL 76 3HG1 VAL 76 0.390 -13.727 -8.971 591 1HG2 VAL 76 1HG2 VAL 76 0.734 -14.457 -5.321 592 2HG2 VAL 76 2HG2 VAL 76 -1.003 -14.304 -5.594 593 3HG2 VAL 76 3HG2 VAL 76 -0.114 -12.997 -4.811 594 H ALA 77 H ALA 77 3.289 -11.380 -5.377 595 HA ALA 77 HA ALA 77 1.539 -9.667 -3.861 596 1HB ALA 77 1HB ALA 77 3.376 -10.832 -2.763 597 2HB ALA 77 2HB ALA 77 3.546 -9.086 -2.600 598 3HB ALA 77 3HB ALA 77 4.539 -9.961 -3.763 599 HA PRO 78 HA PRO 78 2.172 -5.920 -6.191 600 1HB PRO 78 1HB PRO 78 1.977 -4.415 -3.693 601 2HB PRO 78 2HB PRO 78 0.865 -4.442 -5.062 602 1HG PRO 78 1HG PRO 78 0.265 -5.540 -2.652 603 2HG PRO 78 2HG PRO 78 -0.381 -6.149 -4.186 604 1HD PRO 78 1HD PRO 78 1.831 -7.232 -2.495 605 2HD PRO 78 2HD PRO 78 0.591 -8.097 -3.429 606 H LYS 79 H LYS 79 3.786 -4.286 -6.480 607 HA LYS 79 HA LYS 79 6.271 -4.935 -5.150 608 1HB LYS 79 1HB LYS 79 5.530 -3.303 -7.535 609 2HB LYS 79 2HB LYS 79 7.067 -2.995 -6.739 610 1HG LYS 79 1HG LYS 79 7.557 -5.453 -6.971 611 2HG LYS 79 2HG LYS 79 6.127 -5.554 -8.001 612 1HD LYS 79 1HD LYS 79 7.080 -4.049 -9.593 613 2HD LYS 79 2HD LYS 79 8.431 -3.681 -8.519 614 1HE LYS 79 1HE LYS 79 9.105 -5.222 -10.284 615 2HE LYS 79 2HE LYS 79 9.209 -5.988 -8.700 616 1HZ LYS 79 1HZ LYS 79 8.222 -7.537 -10.155 617 2HZ LYS 79 2HZ LYS 79 7.130 -6.397 -10.776 618 3HZ LYS 79 3HZ LYS 79 6.967 -6.948 -9.183 619 H ALA 80 H ALA 80 3.922 -2.335 -5.177 620 HA ALA 80 HA ALA 80 5.153 -1.279 -2.769 621 1HB ALA 80 1HB ALA 80 6.282 -0.055 -4.596 622 2HB ALA 80 2HB ALA 80 5.320 0.994 -3.554 623 3HB ALA 80 3HB ALA 80 4.710 0.528 -5.141 624 H ILE 81 H ILE 81 3.744 -0.271 -1.438 625 HA ILE 81 HA ILE 81 1.033 0.321 -2.430 626 HB ILE 81 HB ILE 81 1.718 -0.872 0.271 627 1HG1 ILE 81 1HG1 ILE 81 1.814 -2.519 -1.587 628 2HG1 ILE 81 2HG1 ILE 81 0.515 -2.858 -0.449 629 1HG2 ILE 81 1HG2 ILE 81 -0.129 0.705 0.400 630 2HG2 ILE 81 2HG2 ILE 81 -0.700 -0.947 0.638 631 3HG2 ILE 81 3HG2 ILE 81 -0.957 -0.139 -0.909 632 1HD1 ILE 81 1HD1 ILE 81 -0.235 -3.213 -2.711 633 2HD1 ILE 81 2HD1 ILE 81 0.230 -1.570 -3.154 634 3HD1 ILE 81 3HD1 ILE 81 -1.085 -1.837 -2.009 635 H ILE 82 H ILE 82 0.510 2.419 -2.074 636 HA ILE 82 HA ILE 82 2.008 3.857 0.025 637 HB ILE 82 HB ILE 82 0.795 5.330 -2.286 638 1HG1 ILE 82 1HG1 ILE 82 2.149 3.531 -3.325 639 2HG1 ILE 82 2HG1 ILE 82 2.836 5.125 -3.602 640 1HG2 ILE 82 1HG2 ILE 82 3.251 5.809 -0.592 641 2HG2 ILE 82 2HG2 ILE 82 1.679 6.585 -0.388 642 3HG2 ILE 82 3HG2 ILE 82 2.633 6.891 -1.840 643 1HD1 ILE 82 1HD1 ILE 82 4.571 3.518 -3.114 644 2HD1 ILE 82 2HD1 ILE 82 3.791 3.103 -1.588 645 3HD1 ILE 82 3HD1 ILE 82 4.471 4.713 -1.821 646 H ASN 83 H ASN 83 0.717 4.425 1.683 647 HA ASN 83 HA ASN 83 -2.161 4.799 1.130 648 1HB ASN 83 1HB ASN 83 -1.000 3.747 3.716 649 2HB ASN 83 2HB ASN 83 -2.698 3.842 3.278 650 1HD2 ASN 83 1HD2 ASN 83 -3.478 2.423 1.634 651 2HD2 ASN 83 2HD2 ASN 83 -2.675 0.922 1.332 652 H LYS 84 H LYS 84 -3.288 6.136 2.790 653 HA LYS 84 HA LYS 84 -1.827 8.552 3.274 654 1HB LYS 84 1HB LYS 84 -3.928 9.420 4.130 655 2HB LYS 84 2HB LYS 84 -4.187 8.593 2.611 656 1HG LYS 84 1HG LYS 84 -5.953 7.768 3.743 657 2HG LYS 84 2HG LYS 84 -4.752 6.584 4.255 658 1HD LYS 84 1HD LYS 84 -6.059 7.387 6.154 659 2HD LYS 84 2HD LYS 84 -4.365 7.859 6.308 660 1HE LYS 84 1HE LYS 84 -4.905 10.098 5.503 661 2HE LYS 84 2HE LYS 84 -6.591 9.628 5.290 662 1HZ LYS 84 1HZ LYS 84 -6.196 10.861 7.362 663 2HZ LYS 84 2HZ LYS 84 -5.149 9.638 7.890 664 3HZ LYS 84 3HZ LYS 84 -6.797 9.302 7.649 665 H LYS 85 H LYS 85 -2.887 5.818 5.111 666 HA LYS 85 HA LYS 85 -0.955 6.594 7.166 667 1HB LYS 85 1HB LYS 85 -3.169 7.061 8.139 668 2HB LYS 85 2HB LYS 85 -3.676 5.411 7.787 669 1HG LYS 85 1HG LYS 85 -1.724 4.663 9.229 670 2HG LYS 85 2HG LYS 85 -1.603 6.340 9.752 671 1HD LYS 85 1HD LYS 85 -3.905 6.249 10.577 672 2HD LYS 85 2HD LYS 85 -4.028 4.569 10.049 673 1HE LYS 85 1HE LYS 85 -2.093 5.643 12.104 674 2HE LYS 85 2HE LYS 85 -3.561 4.732 12.452 675 1HZ LYS 85 1HZ LYS 85 -1.406 3.452 12.456 676 2HZ LYS 85 2HZ LYS 85 -1.380 3.627 10.774 677 3HZ LYS 85 3HZ LYS 85 -2.651 2.791 11.523 678 H THR 86 H THR 86 0.448 5.022 7.567 679 HA THR 86 HA THR 86 -0.051 2.378 6.449 680 HB THR 86 HB THR 86 2.313 1.938 7.226 681 HG1 THR 86 HG1 THR 86 2.136 4.727 7.835 682 1HG2 THR 86 1HG2 THR 86 3.336 3.284 5.438 683 2HG2 THR 86 2HG2 THR 86 1.873 4.267 5.350 684 3HG2 THR 86 3HG2 THR 86 1.815 2.558 4.918 685 H GLU 87 H GLU 87 0.235 0.446 7.794 686 HA GLU 87 HA GLU 87 -0.363 0.994 10.618 687 1HB GLU 87 1HB GLU 87 -2.343 0.197 9.250 688 2HB GLU 87 2HB GLU 87 -1.497 -1.338 9.080 689 1HG GLU 87 1HG GLU 87 -3.215 -1.201 10.921 690 2HG GLU 87 2HG GLU 87 -1.615 -1.783 11.383 691 H THR 88 H THR 88 0.409 -0.442 12.141 692 HA THR 88 HA THR 88 3.056 -1.195 11.723 693 HB THR 88 HB THR 88 1.251 -2.211 13.922 694 HG1 THR 88 HG1 THR 88 1.048 -0.042 14.057 695 1HG2 THR 88 1HG2 THR 88 3.461 -3.282 13.817 696 2HG2 THR 88 2HG2 THR 88 3.321 -2.249 15.241 697 3HG2 THR 88 3HG2 THR 88 4.229 -1.697 13.834 698 H ILE 89 H ILE 89 0.193 -3.296 12.043 699 HA ILE 89 HA ILE 89 1.524 -5.749 11.848 700 HB ILE 89 HB ILE 89 -1.286 -5.128 10.901 701 1HG1 ILE 89 1HG1 ILE 89 -0.313 -6.066 13.614 702 2HG1 ILE 89 2HG1 ILE 89 -0.911 -4.450 13.248 703 1HG2 ILE 89 1HG2 ILE 89 -0.016 -7.739 11.728 704 2HG2 ILE 89 2HG2 ILE 89 -0.475 -7.277 10.089 705 3HG2 ILE 89 3HG2 ILE 89 -1.717 -7.508 11.319 706 1HD1 ILE 89 1HD1 ILE 89 -2.508 -6.995 13.064 707 2HD1 ILE 89 2HD1 ILE 89 -3.104 -5.370 12.728 708 3HD1 ILE 89 3HD1 ILE 89 -2.599 -5.804 14.363 709 H ILE 90 H ILE 90 0.166 -3.658 9.368 710 HA ILE 90 HA ILE 90 0.616 -5.429 7.191 711 HB ILE 90 HB ILE 90 0.283 -2.425 7.121 712 1HG1 ILE 90 1HG1 ILE 90 -1.836 -4.576 6.891 713 2HG1 ILE 90 2HG1 ILE 90 -1.548 -3.616 8.336 714 1HG2 ILE 90 1HG2 ILE 90 -0.163 -4.533 5.009 715 2HG2 ILE 90 2HG2 ILE 90 1.126 -3.329 5.034 716 3HG2 ILE 90 3HG2 ILE 90 -0.553 -2.822 4.839 717 1HD1 ILE 90 1HD1 ILE 90 -2.411 -2.558 5.663 718 2HD1 ILE 90 2HD1 ILE 90 -2.111 -1.588 7.104 719 3HD1 ILE 90 3HD1 ILE 90 -3.432 -2.759 7.087 720 H ALA 91 H ALA 91 2.404 -2.707 8.578 721 HA ALA 91 HA ALA 91 4.391 -2.473 6.625 722 1HB ALA 91 1HB ALA 91 5.710 -1.342 8.354 723 2HB ALA 91 2HB ALA 91 4.582 -1.915 9.581 724 3HB ALA 91 3HB ALA 91 4.036 -0.788 8.340 725 H VAL 92 H VAL 92 4.311 -4.453 9.575 726 HA VAL 92 HA VAL 92 6.892 -5.535 9.358 727 HB VAL 92 HB VAL 92 4.423 -6.779 10.590 728 1HG1 VAL 92 1HG1 VAL 92 7.340 -7.445 10.977 729 2HG1 VAL 92 2HG1 VAL 92 6.140 -8.456 10.171 730 3HG1 VAL 92 3HG1 VAL 92 6.002 -8.129 11.900 731 1HG2 VAL 92 1HG2 VAL 92 4.968 -4.614 11.572 732 2HG2 VAL 92 2HG2 VAL 92 6.635 -5.136 11.822 733 3HG2 VAL 92 3HG2 VAL 92 5.325 -5.918 12.705 734 H GLY 93 H GLY 93 3.768 -6.702 8.150 735 1HA GLY 93 1HA GLY 93 4.754 -9.099 7.010 736 2HA GLY 93 2HA GLY 93 3.234 -8.315 6.611 737 H ALA 94 H ALA 94 4.213 -5.869 5.676 738 HA ALA 94 HA ALA 94 4.798 -6.529 2.996 739 1HB ALA 94 1HB ALA 94 4.965 -4.148 2.616 740 2HB ALA 94 2HB ALA 94 5.097 -3.853 4.349 741 3HB ALA 94 3HB ALA 94 3.596 -4.492 3.675 742 H ALA 95 H ALA 95 6.833 -5.279 5.622 743 HA ALA 95 HA ALA 95 9.233 -5.002 4.177 744 1HB ALA 95 1HB ALA 95 8.945 -4.095 6.415 745 2HB ALA 95 2HB ALA 95 10.342 -5.172 6.368 746 3HB ALA 95 3HB ALA 95 8.826 -5.723 7.084 747 H MET 96 H MET 96 7.602 -7.802 5.489 748 HA MET 96 HA MET 96 9.860 -9.581 5.141 749 1HB MET 96 1HB MET 96 6.989 -9.999 5.964 750 2HB MET 96 2HB MET 96 8.079 -11.348 5.680 751 1HG MET 96 1HG MET 96 9.511 -10.659 7.449 752 2HG MET 96 2HG MET 96 8.637 -9.141 7.637 753 1HE MET 96 1HE MET 96 8.342 -13.071 7.944 754 2HE MET 96 2HE MET 96 6.933 -12.617 6.983 755 3HE MET 96 3HE MET 96 6.721 -13.228 8.622 756 H ALA 97 H ALA 97 7.016 -8.620 3.364 757 HA ALA 97 HA ALA 97 7.349 -10.796 1.451 758 1HB ALA 97 1HB ALA 97 5.222 -8.666 1.604 759 2HB ALA 97 2HB ALA 97 5.100 -10.288 2.288 760 3HB ALA 97 3HB ALA 97 5.217 -10.071 0.541 761 H GLU 98 H GLU 98 9.085 -8.242 1.758 762 HA GLU 98 HA GLU 98 10.205 -6.777 0.429 763 1HB GLU 98 1HB GLU 98 9.546 -9.014 -1.445 764 2HB GLU 98 2HB GLU 98 10.287 -7.556 -2.086 765 1HG GLU 98 1HG GLU 98 11.985 -9.180 -1.654 766 2HG GLU 98 2HG GLU 98 12.159 -7.856 -0.506 767 H ILE 99 H ILE 99 7.570 -6.062 0.966 768 HA ILE 99 HA ILE 99 6.820 -4.618 -1.498 769 HB ILE 99 HB ILE 99 5.035 -5.166 0.880 770 1HG1 ILE 99 1HG1 ILE 99 5.044 -6.526 -1.822 771 2HG1 ILE 99 2HG1 ILE 99 5.618 -7.255 -0.325 772 1HG2 ILE 99 1HG2 ILE 99 3.241 -4.430 -0.638 773 2HG2 ILE 99 2HG2 ILE 99 4.451 -4.065 -1.866 774 3HG2 ILE 99 3HG2 ILE 99 4.434 -3.162 -0.352 775 1HD1 ILE 99 1HD1 ILE 99 3.360 -7.078 0.608 776 2HD1 ILE 99 2HD1 ILE 99 3.397 -8.041 -0.869 777 3HD1 ILE 99 3HD1 ILE 99 2.799 -6.384 -0.912 778 HA PRO 100 HA PRO 100 8.556 -1.470 1.387 779 1HB PRO 100 1HB PRO 100 9.345 0.211 -0.631 780 2HB PRO 100 2HB PRO 100 10.352 -1.079 0.033 781 1HG PRO 100 1HG PRO 100 8.716 -1.046 -2.463 782 2HG PRO 100 2HG PRO 100 10.315 -1.753 -2.175 783 1HD PRO 100 1HD PRO 100 8.051 -3.239 -2.253 784 2HD PRO 100 2HD PRO 100 9.441 -3.664 -1.235 785 H LEU 101 H LEU 101 6.835 -0.486 2.284 786 HA LEU 101 HA LEU 101 5.140 1.126 0.510 787 1HB LEU 101 1HB LEU 101 3.451 1.032 2.371 788 2HB LEU 101 2HB LEU 101 3.757 -0.471 1.533 789 HG LEU 101 HG LEU 101 5.284 -1.080 3.494 790 1HD1 LEU 101 1HD1 LEU 101 3.783 1.201 4.770 791 2HD1 LEU 101 2HD1 LEU 101 5.519 1.135 4.467 792 3HD1 LEU 101 3HD1 LEU 101 4.781 0.021 5.619 793 1HD2 LEU 101 1HD2 LEU 101 3.390 -1.832 4.844 794 2HD2 LEU 101 2HD2 LEU 101 3.103 -2.088 3.123 795 3HD2 LEU 101 3HD2 LEU 101 2.325 -0.742 3.956 796 H VAL 102 H VAL 102 4.486 3.193 1.148 797 HA VAL 102 HA VAL 102 5.942 4.399 3.385 798 HB VAL 102 HB VAL 102 6.396 6.435 2.044 799 1HG1 VAL 102 1HG1 VAL 102 8.144 4.765 2.397 800 2HG1 VAL 102 2HG1 VAL 102 8.323 5.567 0.838 801 3HG1 VAL 102 3HG1 VAL 102 7.654 3.937 0.920 802 1HG2 VAL 102 1HG2 VAL 102 4.723 6.165 0.308 803 2HG2 VAL 102 2HG2 VAL 102 5.551 4.727 -0.295 804 3HG2 VAL 102 3HG2 VAL 102 6.329 6.307 -0.409 805 H GLU 103 H GLU 103 5.013 6.560 3.946 806 HA GLU 103 HA GLU 103 2.087 6.359 3.687 807 1HB GLU 103 1HB GLU 103 3.064 6.035 5.955 808 2HB GLU 103 2HB GLU 103 3.704 7.669 5.882 809 1HG GLU 103 1HG GLU 103 1.504 8.601 5.864 810 2HG GLU 103 2HG GLU 103 0.778 7.005 5.696 811 H VAL 104 H VAL 104 1.034 7.919 2.668 812 HA VAL 104 HA VAL 104 2.373 10.515 2.282 813 HB VAL 104 HB VAL 104 0.684 10.864 0.428 814 1HG1 VAL 104 1HG1 VAL 104 2.996 10.328 -0.041 815 2HG1 VAL 104 2HG1 VAL 104 1.934 9.523 -1.196 816 3HG1 VAL 104 3HG1 VAL 104 2.653 8.607 0.128 817 1HG2 VAL 104 1HG2 VAL 104 -0.932 9.162 1.043 818 2HG2 VAL 104 2HG2 VAL 104 0.272 7.898 0.788 819 3HG2 VAL 104 3HG2 VAL 104 -0.307 8.854 -0.577 820 H ARG 105 H ARG 105 1.585 12.188 3.356 821 HA ARG 105 HA ARG 105 -1.065 11.932 4.590 822 1HB ARG 105 1HB ARG 105 1.156 13.899 5.188 823 2HB ARG 105 2HB ARG 105 -0.340 13.718 6.096 824 1HG ARG 105 1HG ARG 105 0.316 11.455 6.737 825 2HG ARG 105 2HG ARG 105 1.814 11.629 5.821 826 1HD ARG 105 1HD ARG 105 2.300 12.037 8.124 827 2HD ARG 105 2HD ARG 105 2.391 13.575 7.265 828 HE ARG 105 HE ARG 105 -0.178 13.021 8.471 829 1HH1 ARG 105 1HH1 ARG 105 2.941 14.571 8.795 830 2HH1 ARG 105 2HH1 ARG 105 2.472 15.512 10.187 831 1HH2 ARG 105 1HH2 ARG 105 -0.806 14.252 10.277 832 2HH2 ARG 105 2HH2 ARG 105 0.334 15.326 11.036 833 H ASP 106 H ASP 106 -0.145 12.841 1.775 834 HA ASP 106 HA ASP 106 -1.433 15.480 1.761 835 1HB ASP 106 1HB ASP 106 0.840 15.514 0.886 836 2HB ASP 106 2HB ASP 106 0.441 14.231 -0.257 837 H GLU 107 H GLU 107 -3.381 15.632 0.967 838 HA GLU 107 HA GLU 107 -4.751 13.407 -0.166 839 1HB GLU 107 1HB GLU 107 -5.799 15.189 1.251 840 2HB GLU 107 2HB GLU 107 -5.601 16.308 -0.086 841 1HG GLU 107 1HG GLU 107 -7.863 15.509 -0.028 842 2HG GLU 107 2HG GLU 107 -7.056 14.890 -1.467 843 H LYS 108 H LYS 108 -3.054 16.154 -1.454 844 HA LYS 108 HA LYS 108 -4.259 16.312 -3.981 845 1HB LYS 108 1HB LYS 108 -1.426 17.011 -3.197 846 2HB LYS 108 2HB LYS 108 -2.266 17.564 -4.631 847 1HG LYS 108 1HG LYS 108 -3.889 18.741 -3.207 848 2HG LYS 108 2HG LYS 108 -2.979 18.227 -1.788 849 1HD LYS 108 1HD LYS 108 -1.743 19.821 -4.023 850 2HD LYS 108 2HD LYS 108 -2.536 20.579 -2.647 851 1HE LYS 108 1HE LYS 108 -0.192 20.533 -2.203 852 2HE LYS 108 2HE LYS 108 -0.963 19.354 -1.149 853 1HZ LYS 108 1HZ LYS 108 0.307 18.610 -3.726 854 2HZ LYS 108 2HZ LYS 108 -0.162 17.577 -2.460 855 3HZ LYS 108 3HZ LYS 108 1.154 18.630 -2.255 856 H PHE 109 H PHE 109 -1.805 14.206 -2.688 857 HA PHE 109 HA PHE 109 -0.674 13.244 -5.057 858 1HB PHE 109 1HB PHE 109 0.314 12.771 -2.886 859 2HB PHE 109 2HB PHE 109 -1.103 11.843 -2.409 860 HD1 PHE 109 HD1 PHE 109 -1.118 9.554 -2.704 861 HD2 PHE 109 HD2 PHE 109 1.584 11.919 -4.983 862 HE1 PHE 109 HE1 PHE 109 -0.082 7.505 -3.589 863 HE2 PHE 109 HE2 PHE 109 2.626 9.876 -5.872 864 HZ PHE 109 HZ PHE 109 1.793 7.665 -5.178 865 H PHE 110 H PHE 110 -3.455 12.022 -3.199 866 HA PHE 110 HA PHE 110 -4.013 9.840 -4.912 867 1HB PHE 110 1HB PHE 110 -5.819 11.338 -3.002 868 2HB PHE 110 2HB PHE 110 -6.240 9.822 -3.787 869 HD1 PHE 110 HD1 PHE 110 -4.313 11.408 -1.150 870 HD2 PHE 110 HD2 PHE 110 -5.114 7.748 -3.162 871 HE1 PHE 110 HE1 PHE 110 -3.276 10.165 0.704 872 HE2 PHE 110 HE2 PHE 110 -4.080 6.498 -1.317 873 HZ PHE 110 HZ PHE 110 -3.159 7.706 0.621 874 H GLU 111 H GLU 111 -4.791 13.195 -5.023 875 HA GLU 111 HA GLU 111 -6.931 12.990 -6.900 876 1HB GLU 111 1HB GLU 111 -6.621 14.771 -5.163 877 2HB GLU 111 2HB GLU 111 -5.267 15.374 -6.097 878 1HG GLU 111 1HG GLU 111 -6.694 15.889 -7.934 879 2HG GLU 111 2HG GLU 111 -8.073 15.158 -7.115 880 H ALA 112 H ALA 112 -3.487 13.303 -6.996 881 HA ALA 112 HA ALA 112 -3.444 14.171 -9.778 882 1HB ALA 112 1HB ALA 112 -1.865 15.189 -8.218 883 2HB ALA 112 2HB ALA 112 -1.022 14.316 -9.498 884 3HB ALA 112 3HB ALA 112 -1.160 13.606 -7.889 885 H VAL 113 H VAL 113 -2.617 11.306 -7.863 886 HA VAL 113 HA VAL 113 -1.363 9.925 -10.010 887 HB VAL 113 HB VAL 113 -0.922 9.401 -7.635 888 1HG1 VAL 113 1HG1 VAL 113 -3.675 8.181 -7.667 889 2HG1 VAL 113 2HG1 VAL 113 -3.156 9.581 -6.729 890 3HG1 VAL 113 3HG1 VAL 113 -2.484 7.987 -6.381 891 1HG2 VAL 113 1HG2 VAL 113 -0.799 6.986 -7.887 892 2HG2 VAL 113 2HG2 VAL 113 -0.358 7.798 -9.389 893 3HG2 VAL 113 3HG2 VAL 113 -1.947 7.055 -9.223 894 H LYS 114 H LYS 114 -2.151 8.535 -11.501 895 HA LYS 114 HA LYS 114 -5.071 8.134 -11.539 896 1HB LYS 114 1HB LYS 114 -3.280 8.501 -13.949 897 2HB LYS 114 2HB LYS 114 -5.029 8.329 -13.956 898 1HG LYS 114 1HG LYS 114 -3.477 10.629 -12.788 899 2HG LYS 114 2HG LYS 114 -4.390 10.636 -14.299 900 1HD LYS 114 1HD LYS 114 -6.456 10.331 -13.122 901 2HD LYS 114 2HD LYS 114 -5.604 10.099 -11.592 902 1HE LYS 114 1HE LYS 114 -4.739 12.405 -11.769 903 2HE LYS 114 2HE LYS 114 -5.683 12.623 -13.241 904 1HZ LYS 114 1HZ LYS 114 -6.836 11.957 -10.586 905 2HZ LYS 114 2HZ LYS 114 -7.695 12.327 -12.004 906 3HZ LYS 114 3HZ LYS 114 -6.764 13.519 -11.241 907 H THR 115 H THR 115 -5.835 6.182 -12.401 908 HA THR 115 HA THR 115 -4.149 3.915 -12.079 909 HB THR 115 HB THR 115 -6.894 4.103 -13.336 910 HG1 THR 115 HG1 THR 115 -7.601 3.516 -11.235 911 1HG2 THR 115 1HG2 THR 115 -7.080 1.727 -12.821 912 2HG2 THR 115 2HG2 THR 115 -5.439 1.722 -12.180 913 3HG2 THR 115 3HG2 THR 115 -5.711 2.017 -13.898 914 H GLY 116 H GLY 116 -2.846 3.004 -13.516 915 1HA GLY 116 1HA GLY 116 -2.255 2.221 -15.678 916 2HA GLY 116 2HA GLY 116 -3.331 3.423 -16.379 917 H ASP 117 H ASP 117 -1.525 4.759 -13.899 918 HA ASP 117 HA ASP 117 0.266 6.022 -15.840 919 1HB ASP 117 1HB ASP 117 -1.227 7.343 -14.202 920 2HB ASP 117 2HB ASP 117 -0.077 6.851 -12.961 921 H ARG 118 H ARG 118 2.481 6.697 -14.524 922 HA ARG 118 HA ARG 118 3.538 4.057 -13.730 923 1HB ARG 118 1HB ARG 118 4.237 4.779 -15.982 924 2HB ARG 118 2HB ARG 118 4.986 6.202 -15.278 925 1HG ARG 118 1HG ARG 118 6.015 3.993 -13.882 926 2HG ARG 118 2HG ARG 118 6.033 3.561 -15.594 927 1HD ARG 118 1HD ARG 118 8.109 4.617 -15.105 928 2HD ARG 118 2HD ARG 118 7.146 5.753 -16.048 929 HE ARG 118 HE ARG 118 6.592 6.436 -13.479 930 1HH1 ARG 118 1HH1 ARG 118 9.554 6.054 -15.323 931 2HH1 ARG 118 2HH1 ARG 118 10.437 7.210 -14.374 932 1HH2 ARG 118 1HH2 ARG 118 7.782 7.910 -12.188 933 2HH2 ARG 118 2HH2 ARG 118 9.447 8.255 -12.581 934 H VAL 119 H VAL 119 4.106 4.022 -11.716 935 HA VAL 119 HA VAL 119 5.190 6.463 -10.472 936 HB VAL 119 HB VAL 119 3.842 4.144 -9.075 937 1HG1 VAL 119 1HG1 VAL 119 4.716 6.839 -8.041 938 2HG1 VAL 119 2HG1 VAL 119 5.478 5.291 -7.678 939 3HG1 VAL 119 3HG1 VAL 119 3.838 5.620 -7.118 940 1HG2 VAL 119 1HG2 VAL 119 1.944 5.628 -8.741 941 2HG2 VAL 119 2HG2 VAL 119 2.267 5.408 -10.462 942 3HG2 VAL 119 3HG2 VAL 119 2.761 6.895 -9.656 943 H VAL 120 H VAL 120 7.258 6.402 -9.875 944 HA VAL 120 HA VAL 120 8.464 3.779 -9.287 945 HB VAL 120 HB VAL 120 9.802 6.321 -10.233 946 1HG1 VAL 120 1HG1 VAL 120 11.089 3.717 -9.417 947 2HG1 VAL 120 2HG1 VAL 120 11.172 5.231 -8.516 948 3HG1 VAL 120 3HG1 VAL 120 11.913 5.112 -10.112 949 1HG2 VAL 120 1HG2 VAL 120 9.610 3.573 -11.457 950 2HG2 VAL 120 2HG2 VAL 120 10.494 4.942 -12.131 951 3HG2 VAL 120 3HG2 VAL 120 8.737 5.010 -11.989 952 H VAL 121 H VAL 121 8.783 3.398 -7.220 953 HA VAL 121 HA VAL 121 8.752 5.691 -5.364 954 HB VAL 121 HB VAL 121 8.036 2.811 -4.779 955 1HG1 VAL 121 1HG1 VAL 121 8.815 3.988 -2.810 956 2HG1 VAL 121 2HG1 VAL 121 7.073 3.734 -2.703 957 3HG1 VAL 121 3HG1 VAL 121 7.709 5.320 -3.136 958 1HG2 VAL 121 1HG2 VAL 121 6.240 5.172 -5.306 959 2HG2 VAL 121 2HG2 VAL 121 5.701 3.609 -4.696 960 3HG2 VAL 121 3HG2 VAL 121 6.411 3.730 -6.306 961 H ASN 122 H ASN 122 10.643 6.118 -4.374 962 HA ASN 122 HA ASN 122 12.466 3.848 -3.894 963 1HB ASN 122 1HB ASN 122 13.407 5.865 -5.098 964 2HB ASN 122 2HB ASN 122 13.140 6.791 -3.623 965 1HD2 ASN 122 1HD2 ASN 122 15.355 7.191 -3.355 966 2HD2 ASN 122 2HD2 ASN 122 16.446 5.943 -2.847 967 H ALA 123 H ALA 123 11.687 2.970 -2.070 968 HA ALA 123 HA ALA 123 10.373 4.486 -0.053 969 1HB ALA 123 1HB ALA 123 9.730 2.191 -0.580 970 2HB ALA 123 2HB ALA 123 10.144 2.375 1.124 971 3HB ALA 123 3HB ALA 123 11.288 1.619 0.015 972 H ASP 124 H ASP 124 13.661 3.596 -0.572 973 HA ASP 124 HA ASP 124 14.575 3.589 2.091 974 1HB ASP 124 1HB ASP 124 15.900 2.895 0.032 975 2HB ASP 124 2HB ASP 124 16.171 4.611 -0.263 976 H GLU 125 H GLU 125 14.061 6.191 -0.223 977 HA GLU 125 HA GLU 125 14.772 8.234 1.716 978 1HB GLU 125 1HB GLU 125 13.537 8.455 -1.039 979 2HB GLU 125 2HB GLU 125 14.033 9.815 -0.047 980 1HG GLU 125 1HG GLU 125 16.344 9.115 -0.190 981 2HG GLU 125 2HG GLU 125 15.873 7.690 -1.121 982 H GLY 126 H GLY 126 11.956 6.677 0.377 983 1HA GLY 126 1HA GLY 126 9.718 6.843 1.032 984 2HA GLY 126 2HA GLY 126 10.155 8.176 2.104 985 H TYR 127 H TYR 127 10.373 7.486 -1.379 986 HA TYR 127 HA TYR 127 9.332 10.173 -1.919 987 1HB TYR 127 1HB TYR 127 11.813 10.261 -1.812 988 2HB TYR 127 2HB TYR 127 11.892 9.039 -3.073 989 HD1 TYR 127 HD1 TYR 127 10.881 12.523 -2.347 990 HD2 TYR 127 HD2 TYR 127 11.708 9.630 -5.355 991 HE1 TYR 127 HE1 TYR 127 10.891 14.300 -4.044 992 HE2 TYR 127 HE2 TYR 127 11.717 11.401 -7.063 993 HH TYR 127 HH TYR 127 11.805 14.713 -6.266 994 H VAL 128 H VAL 128 8.049 10.268 -3.693 995 HA VAL 128 HA VAL 128 7.938 7.859 -5.384 996 HB VAL 128 HB VAL 128 5.525 8.294 -5.718 997 1HG1 VAL 128 1HG1 VAL 128 6.218 6.655 -4.079 998 2HG1 VAL 128 2HG1 VAL 128 4.784 7.505 -3.506 999 3HG1 VAL 128 3HG1 VAL 128 6.370 7.908 -2.849 1000 1HG2 VAL 128 1HG2 VAL 128 4.334 9.804 -4.198 1001 2HG2 VAL 128 2HG2 VAL 128 5.481 10.678 -5.213 1002 3HG2 VAL 128 3HG2 VAL 128 5.875 10.341 -3.528 1003 H GLU 129 H GLU 129 8.203 8.163 -7.504 1004 HA GLU 129 HA GLU 129 7.997 10.920 -8.515 1005 1HB GLU 129 1HB GLU 129 10.209 9.879 -8.807 1006 2HB GLU 129 2HB GLU 129 9.467 8.558 -9.698 1007 1HG GLU 129 1HG GLU 129 8.716 10.160 -11.406 1008 2HG GLU 129 2HG GLU 129 9.535 11.450 -10.527 1009 H LEU 130 H LEU 130 6.059 11.252 -9.311 1010 HA LEU 130 HA LEU 130 4.708 9.114 -10.799 1011 1HB LEU 130 1HB LEU 130 3.489 10.029 -8.882 1012 2HB LEU 130 2HB LEU 130 3.630 11.646 -9.541 1013 HG LEU 130 HG LEU 130 2.231 10.931 -11.470 1014 1HD1 LEU 130 1HD1 LEU 130 0.953 8.848 -11.260 1015 2HD1 LEU 130 2HD1 LEU 130 1.906 8.418 -9.838 1016 3HD1 LEU 130 3HD1 LEU 130 2.685 8.551 -11.414 1017 1HD2 LEU 130 1HD2 LEU 130 1.265 12.087 -9.548 1018 2HD2 LEU 130 2HD2 LEU 130 0.993 10.538 -8.750 1019 3HD2 LEU 130 3HD2 LEU 130 0.132 10.927 -10.238 1020 H ILE 131 H ILE 131 5.162 9.251 -12.918 1021 HA ILE 131 HA ILE 131 5.373 11.919 -14.129 1022 HB ILE 131 HB ILE 131 6.064 9.306 -15.422 1023 1HG1 ILE 131 1HG1 ILE 131 7.553 9.592 -13.522 1024 2HG1 ILE 131 2HG1 ILE 131 8.442 9.911 -15.007 1025 1HG2 ILE 131 1HG2 ILE 131 5.571 11.092 -16.973 1026 2HG2 ILE 131 2HG2 ILE 131 7.291 10.701 -17.015 1027 3HG2 ILE 131 3HG2 ILE 131 6.735 12.140 -16.160 1028 1HD1 ILE 131 1HD1 ILE 131 9.030 11.510 -13.308 1029 2HD1 ILE 131 2HD1 ILE 131 7.337 11.963 -13.110 1030 3HD1 ILE 131 3HD1 ILE 131 8.173 12.315 -14.623 1031 H GLU 132 H GLU 132 3.619 12.630 -14.887 1032 HA GLU 132 HA GLU 132 1.268 11.172 -15.340 1033 1HB GLU 132 1HB GLU 132 2.006 13.923 -16.368 1034 2HB GLU 132 2HB GLU 132 0.377 13.282 -16.172 1035 1HG GLU 132 1HG GLU 132 0.489 13.366 -13.843 1036 2HG GLU 132 2HG GLU 132 2.247 13.486 -13.839 Start of MODEL 20 1 H VAL 1 H VAL 1 5.085 14.065 -11.719 2 HA VAL 1 HA VAL 1 6.213 16.494 -10.477 3 HB VAL 1 HB VAL 1 3.694 15.140 -9.525 4 1HG1 VAL 1 1HG1 VAL 1 4.841 17.877 -8.998 5 2HG1 VAL 1 2HG1 VAL 1 4.887 16.506 -7.889 6 3HG1 VAL 1 3HG1 VAL 1 3.342 17.236 -8.330 7 1HG2 VAL 1 1HG2 VAL 1 2.419 16.916 -10.611 8 2HG2 VAL 1 2HG2 VAL 1 3.305 15.955 -11.797 9 3HG2 VAL 1 3HG2 VAL 1 3.901 17.548 -11.328 10 H LYS 2 H LYS 2 7.502 16.186 -8.816 11 HA LYS 2 HA LYS 2 7.741 13.538 -7.615 12 1HB LYS 2 1HB LYS 2 9.375 16.066 -7.385 13 2HB LYS 2 2HB LYS 2 9.685 14.638 -6.410 14 1HG LYS 2 1HG LYS 2 10.274 13.354 -8.311 15 2HG LYS 2 2HG LYS 2 9.677 14.595 -9.415 16 1HD LYS 2 1HD LYS 2 11.433 16.104 -8.753 17 2HD LYS 2 2HD LYS 2 11.974 14.985 -7.500 18 1HE LYS 2 1HE LYS 2 11.914 14.229 -10.406 19 2HE LYS 2 2HE LYS 2 13.297 15.041 -9.678 20 1HZ LYS 2 1HZ LYS 2 13.650 12.683 -9.668 21 2HZ LYS 2 2HZ LYS 2 12.183 12.401 -8.877 22 3HZ LYS 2 3HZ LYS 2 13.441 13.201 -8.073 23 H PHE 3 H PHE 3 7.066 13.050 -5.601 24 HA PHE 3 HA PHE 3 6.001 15.242 -3.940 25 1HB PHE 3 1HB PHE 3 4.868 12.474 -4.374 26 2HB PHE 3 2HB PHE 3 4.341 13.542 -3.079 27 HD1 PHE 3 HD1 PHE 3 4.140 12.789 -6.619 28 HD2 PHE 3 HD2 PHE 3 3.156 15.633 -3.611 29 HE1 PHE 3 HE1 PHE 3 2.498 13.819 -8.134 30 HE2 PHE 3 HE2 PHE 3 1.512 16.668 -5.121 31 HZ PHE 3 HZ PHE 3 1.179 15.761 -7.385 32 H ALA 4 H ALA 4 5.996 14.805 -1.629 33 HA ALA 4 HA ALA 4 8.308 13.132 -0.893 34 1HB ALA 4 1HB ALA 4 7.229 15.581 0.502 35 2HB ALA 4 2HB ALA 4 8.652 15.529 -0.540 36 3HB ALA 4 3HB ALA 4 8.643 14.647 0.988 37 H CYS 5 H CYS 5 7.781 11.324 0.095 38 HA CYS 5 HA CYS 5 5.514 11.315 1.968 39 1HB CYS 5 1HB CYS 5 5.449 8.830 1.465 40 2HB CYS 5 2HB CYS 5 4.968 9.882 0.138 41 HG CYS 5 HG CYS 5 6.681 9.002 -1.572 42 H ARG 6 H ARG 6 5.815 9.445 3.626 43 HA ARG 6 HA ARG 6 8.589 9.593 4.594 44 1HB ARG 6 1HB ARG 6 6.844 10.477 6.125 45 2HB ARG 6 2HB ARG 6 6.106 8.881 6.167 46 1HG ARG 6 1HG ARG 6 7.977 7.943 7.276 47 2HG ARG 6 2HG ARG 6 8.952 9.383 6.988 48 1HD ARG 6 1HD ARG 6 8.247 9.388 9.276 49 2HD ARG 6 2HD ARG 6 7.390 10.666 8.420 50 HE ARG 6 HE ARG 6 5.800 8.343 8.413 51 1HH1 ARG 6 1HH1 ARG 6 6.974 10.826 10.599 52 2HH1 ARG 6 2HH1 ARG 6 5.665 10.627 11.726 53 1HH2 ARG 6 1HH2 ARG 6 4.076 8.089 9.868 54 2HH2 ARG 6 2HH2 ARG 6 4.016 9.066 11.317 55 H ALA 7 H ALA 7 9.780 7.801 4.867 56 HA ALA 7 HA ALA 7 8.781 5.441 3.524 57 1HB ALA 7 1HB ALA 7 11.081 4.679 3.565 58 2HB ALA 7 2HB ALA 7 11.520 6.006 4.640 59 3HB ALA 7 3HB ALA 7 10.994 6.344 2.991 60 H ILE 8 H ILE 8 8.205 3.580 4.424 61 HA ILE 8 HA ILE 8 8.817 3.134 7.270 62 HB ILE 8 HB ILE 8 6.558 2.070 5.566 63 1HG1 ILE 8 1HG1 ILE 8 5.208 2.913 7.554 64 2HG1 ILE 8 2HG1 ILE 8 6.683 3.687 8.115 65 1HG2 ILE 8 1HG2 ILE 8 7.458 0.187 6.806 66 2HG2 ILE 8 2HG2 ILE 8 5.890 0.660 7.460 67 3HG2 ILE 8 3HG2 ILE 8 7.369 1.108 8.308 68 1HD1 ILE 8 1HD1 ILE 8 6.763 4.998 6.049 69 2HD1 ILE 8 2HD1 ILE 8 5.272 5.262 6.953 70 3HD1 ILE 8 3HD1 ILE 8 5.264 4.233 5.521 71 H THR 9 H THR 9 8.441 1.424 4.170 72 HA THR 9 HA THR 9 10.362 -0.609 5.033 73 HB THR 9 HB THR 9 9.282 -0.614 2.264 74 HG1 THR 9 HG1 THR 9 7.714 -0.659 4.587 75 1HG2 THR 9 1HG2 THR 9 9.569 -2.712 4.425 76 2HG2 THR 9 2HG2 THR 9 10.634 -2.480 3.040 77 3HG2 THR 9 3HG2 THR 9 8.977 -3.019 2.791 78 H ARG 10 H ARG 10 11.888 -1.227 3.020 79 HA ARG 10 HA ARG 10 13.066 1.299 2.056 80 1HB ARG 10 1HB ARG 10 14.578 -1.176 2.917 81 2HB ARG 10 2HB ARG 10 15.289 0.318 2.319 82 1HG ARG 10 1HG ARG 10 13.717 0.000 4.868 83 2HG ARG 10 2HG ARG 10 15.467 0.170 4.736 84 1HD ARG 10 1HD ARG 10 15.244 2.403 3.877 85 2HD ARG 10 2HD ARG 10 13.491 2.234 3.773 86 HE ARG 10 HE ARG 10 14.268 1.796 6.429 87 1HH1 ARG 10 1HH1 ARG 10 14.161 4.396 4.088 88 2HH1 ARG 10 2HH1 ARG 10 13.912 5.635 5.278 89 1HH2 ARG 10 1HH2 ARG 10 13.949 3.431 8.008 90 2HH2 ARG 10 2HH2 ARG 10 13.823 5.091 7.506 91 H GLY 11 H GLY 11 14.750 0.710 0.206 92 1HA GLY 11 1HA GLY 11 15.178 -0.565 -1.747 93 2HA GLY 11 2HA GLY 11 13.656 -1.410 -1.504 94 H ARG 12 H ARG 12 13.413 -0.977 -3.820 95 HA ARG 12 HA ARG 12 12.307 1.722 -4.283 96 1HB ARG 12 1HB ARG 12 13.531 -0.133 -6.333 97 2HB ARG 12 2HB ARG 12 12.873 1.465 -6.647 98 1HG ARG 12 1HG ARG 12 14.622 2.480 -5.324 99 2HG ARG 12 2HG ARG 12 15.254 0.886 -4.903 100 1HD ARG 12 1HD ARG 12 15.610 0.470 -7.339 101 2HD ARG 12 2HD ARG 12 15.156 2.146 -7.642 102 HE ARG 12 HE ARG 12 17.088 2.718 -6.130 103 1HH1 ARG 12 1HH1 ARG 12 17.002 -0.224 -8.031 104 2HH1 ARG 12 2HH1 ARG 12 18.730 -0.416 -8.062 105 1HH2 ARG 12 1HH2 ARG 12 19.347 2.465 -6.144 106 2HH2 ARG 12 2HH2 ARG 12 20.071 1.117 -6.972 107 H ALA 13 H ALA 13 10.370 1.853 -5.448 108 HA ALA 13 HA ALA 13 9.012 -0.714 -5.966 109 1HB ALA 13 1HB ALA 13 6.936 0.231 -5.127 110 2HB ALA 13 2HB ALA 13 7.764 1.738 -4.731 111 3HB ALA 13 3HB ALA 13 8.176 0.250 -3.875 112 H GLU 14 H GLU 14 8.556 -0.831 -8.087 113 HA GLU 14 HA GLU 14 7.901 1.659 -9.498 114 1HB GLU 14 1HB GLU 14 10.299 1.119 -9.789 115 2HB GLU 14 2HB GLU 14 9.858 -0.450 -10.437 116 1HG GLU 14 1HG GLU 14 8.882 2.057 -11.734 117 2HG GLU 14 2HG GLU 14 10.509 1.458 -12.037 118 H GLY 15 H GLY 15 5.988 1.443 -10.478 119 1HA GLY 15 1HA GLY 15 5.448 -0.470 -12.421 120 2HA GLY 15 2HA GLY 15 4.754 -1.083 -10.927 121 H GLU 16 H GLU 16 2.849 -0.819 -12.561 122 HA GLU 16 HA GLU 16 1.737 1.770 -12.852 123 1HB GLU 16 1HB GLU 16 0.443 -0.961 -12.960 124 2HB GLU 16 2HB GLU 16 -0.325 0.532 -13.439 125 1HG GLU 16 1HG GLU 16 0.347 -0.469 -15.434 126 2HG GLU 16 2HG GLU 16 1.536 0.794 -15.134 127 H ALA 17 H ALA 17 0.323 2.856 -11.557 128 HA ALA 17 HA ALA 17 -0.066 1.769 -8.871 129 1HB ALA 17 1HB ALA 17 -0.689 4.030 -8.239 130 2HB ALA 17 2HB ALA 17 -0.605 4.540 -9.925 131 3HB ALA 17 3HB ALA 17 0.859 4.028 -9.086 132 H LEU 18 H LEU 18 -1.898 0.848 -8.318 133 HA LEU 18 HA LEU 18 -4.326 1.473 -9.847 134 1HB LEU 18 1HB LEU 18 -3.345 -0.952 -8.476 135 2HB LEU 18 2HB LEU 18 -5.057 -0.617 -8.294 136 HG LEU 18 HG LEU 18 -5.231 -0.496 -10.782 137 1HD1 LEU 18 1HD1 LEU 18 -3.434 -1.504 -12.111 138 2HD1 LEU 18 2HD1 LEU 18 -2.426 -1.593 -10.666 139 3HD1 LEU 18 3HD1 LEU 18 -2.909 -0.022 -11.307 140 1HD2 LEU 18 1HD2 LEU 18 -5.899 -2.489 -9.563 141 2HD2 LEU 18 2HD2 LEU 18 -4.242 -3.092 -9.601 142 3HD2 LEU 18 3HD2 LEU 18 -5.156 -2.928 -11.100 143 H VAL 19 H VAL 19 -5.938 2.522 -8.922 144 HA VAL 19 HA VAL 19 -5.508 3.355 -6.136 145 HB VAL 19 HB VAL 19 -5.539 5.163 -7.807 146 1HG1 VAL 19 1HG1 VAL 19 -7.055 4.192 -9.432 147 2HG1 VAL 19 2HG1 VAL 19 -7.622 5.784 -8.932 148 3HG1 VAL 19 3HG1 VAL 19 -8.393 4.333 -8.293 149 1HG2 VAL 19 1HG2 VAL 19 -6.209 5.670 -5.536 150 2HG2 VAL 19 2HG2 VAL 19 -7.872 5.206 -5.897 151 3HG2 VAL 19 3HG2 VAL 19 -7.163 6.623 -6.674 152 H THR 20 H THR 20 -6.989 3.007 -4.575 153 HA THR 20 HA THR 20 -9.727 2.340 -5.292 154 HB THR 20 HB THR 20 -8.071 0.477 -3.577 155 HG1 THR 20 HG1 THR 20 -8.458 0.637 -6.253 156 1HG2 THR 20 1HG2 THR 20 -10.059 -0.959 -3.619 157 2HG2 THR 20 2HG2 THR 20 -10.930 0.268 -4.537 158 3HG2 THR 20 3HG2 THR 20 -10.423 0.601 -2.881 159 H LYS 21 H LYS 21 -10.774 3.847 -4.161 160 HA LYS 21 HA LYS 21 -9.751 4.627 -1.536 161 1HB LYS 21 1HB LYS 21 -11.834 5.916 -3.301 162 2HB LYS 21 2HB LYS 21 -11.311 6.544 -1.744 163 1HG LYS 21 1HG LYS 21 -9.048 6.826 -2.605 164 2HG LYS 21 2HG LYS 21 -9.554 6.169 -4.162 165 1HD LYS 21 1HD LYS 21 -10.692 8.652 -2.885 166 2HD LYS 21 2HD LYS 21 -9.451 8.640 -4.139 167 1HE LYS 21 1HE LYS 21 -10.986 7.551 -5.677 168 2HE LYS 21 2HE LYS 21 -12.222 7.481 -4.421 169 1HZ LYS 21 1HZ LYS 21 -11.068 9.963 -5.577 170 2HZ LYS 21 2HZ LYS 21 -12.261 9.894 -4.372 171 3HZ LYS 21 3HZ LYS 21 -12.599 9.321 -5.932 172 H GLU 22 H GLU 22 -10.577 2.371 -0.968 173 HA GLU 22 HA GLU 22 -13.105 2.769 0.432 174 1HB GLU 22 1HB GLU 22 -12.500 0.483 -1.435 175 2HB GLU 22 2HB GLU 22 -13.603 0.274 -0.082 176 1HG GLU 22 1HG GLU 22 -13.924 2.303 -2.284 177 2HG GLU 22 2HG GLU 22 -14.755 0.750 -2.194 178 H TYR 23 H TYR 23 -13.345 1.155 2.214 179 HA TYR 23 HA TYR 23 -10.746 0.842 3.461 180 1HB TYR 23 1HB TYR 23 -13.554 0.587 4.528 181 2HB TYR 23 2HB TYR 23 -12.131 0.204 5.488 182 HD1 TYR 23 HD1 TYR 23 -10.527 1.997 6.088 183 HD2 TYR 23 HD2 TYR 23 -14.206 2.862 4.130 184 HE1 TYR 23 HE1 TYR 23 -10.309 4.359 6.736 185 HE2 TYR 23 HE2 TYR 23 -13.996 5.228 4.774 186 HH TYR 23 HH TYR 23 -11.133 6.584 5.928 187 H ILE 24 H ILE 24 -10.033 -0.910 2.080 188 HA ILE 24 HA ILE 24 -11.140 -3.499 2.956 189 HB ILE 24 HB ILE 24 -9.415 -2.891 0.535 190 1HG1 ILE 24 1HG1 ILE 24 -11.455 -4.110 -0.564 191 2HG1 ILE 24 2HG1 ILE 24 -12.295 -3.643 0.909 192 1HG2 ILE 24 1HG2 ILE 24 -8.715 -4.995 1.536 193 2HG2 ILE 24 2HG2 ILE 24 -9.553 -5.278 0.010 194 3HG2 ILE 24 3HG2 ILE 24 -10.386 -5.565 1.537 195 1HD1 ILE 24 1HD1 ILE 24 -11.796 -1.304 0.450 196 2HD1 ILE 24 2HD1 ILE 24 -12.684 -2.055 -0.877 197 3HD1 ILE 24 3HD1 ILE 24 -10.948 -1.776 -1.023 198 H SER 25 H SER 25 -10.203 -4.287 4.553 199 HA SER 25 HA SER 25 -7.514 -3.566 5.297 200 1HB SER 25 1HB SER 25 -9.528 -5.380 6.633 201 2HB SER 25 2HB SER 25 -8.090 -4.690 7.352 202 HG SER 25 HG SER 25 -9.228 -2.600 6.567 203 H PHE 26 H PHE 26 -7.698 -5.105 2.918 204 HA PHE 26 HA PHE 26 -6.849 -6.901 1.844 205 1HB PHE 26 1HB PHE 26 -5.387 -7.207 4.463 206 2HB PHE 26 2HB PHE 26 -5.150 -8.323 3.123 207 HD1 PHE 26 HD1 PHE 26 -4.891 -4.757 4.099 208 HD2 PHE 26 HD2 PHE 26 -3.709 -7.798 1.367 209 HE1 PHE 26 HE1 PHE 26 -3.221 -3.234 3.130 210 HE2 PHE 26 HE2 PHE 26 -2.039 -6.281 0.394 211 HZ PHE 26 HZ PHE 26 -1.789 -3.995 1.276 212 H LEU 27 H LEU 27 -6.919 -8.438 5.012 213 HA LEU 27 HA LEU 27 -7.950 -10.277 5.825 214 1HB LEU 27 1HB LEU 27 -10.205 -9.378 4.032 215 2HB LEU 27 2HB LEU 27 -10.344 -10.540 5.337 216 HG LEU 27 HG LEU 27 -9.585 -7.635 5.686 217 1HD1 LEU 27 1HD1 LEU 27 -12.176 -9.062 6.278 218 2HD1 LEU 27 2HD1 LEU 27 -11.910 -7.887 4.989 219 3HD1 LEU 27 3HD1 LEU 27 -11.804 -7.384 6.676 220 1HD2 LEU 27 1HD2 LEU 27 -8.619 -9.132 7.374 221 2HD2 LEU 27 2HD2 LEU 27 -10.228 -9.760 7.729 222 3HD2 LEU 27 3HD2 LEU 27 -9.847 -8.070 8.062 223 H GLY 28 H GLY 28 -9.630 -10.542 2.748 224 1HA GLY 28 1HA GLY 28 -7.799 -12.536 1.729 225 2HA GLY 28 2HA GLY 28 -9.357 -13.175 2.240 226 H GLY 29 H GLY 29 -9.115 -9.959 0.965 227 1HA GLY 29 1HA GLY 29 -11.085 -10.546 -1.020 228 2HA GLY 29 2HA GLY 29 -10.276 -9.005 -0.781 229 H ILE 30 H ILE 30 -7.633 -10.506 -1.043 230 HA ILE 30 HA ILE 30 -7.532 -10.313 -3.953 231 HB ILE 30 HB ILE 30 -5.206 -10.692 -2.060 232 1HG1 ILE 30 1HG1 ILE 30 -6.286 -8.118 -3.237 233 2HG1 ILE 30 2HG1 ILE 30 -6.454 -8.608 -1.556 234 1HG2 ILE 30 1HG2 ILE 30 -5.331 -9.738 -4.916 235 2HG2 ILE 30 2HG2 ILE 30 -4.753 -11.312 -4.369 236 3HG2 ILE 30 3HG2 ILE 30 -3.875 -9.847 -3.927 237 1HD1 ILE 30 1HD1 ILE 30 -4.027 -8.543 -1.297 238 2HD1 ILE 30 2HD1 ILE 30 -4.672 -6.987 -1.816 239 3HD1 ILE 30 3HD1 ILE 30 -3.864 -8.039 -2.978 240 H ASP 31 H ASP 31 -7.467 -12.011 -5.210 241 HA ASP 31 HA ASP 31 -7.555 -14.684 -4.270 242 1HB ASP 31 1HB ASP 31 -8.607 -14.047 -6.367 243 2HB ASP 31 2HB ASP 31 -7.060 -13.529 -7.020 244 H LYS 32 H LYS 32 -5.899 -15.905 -3.612 245 HA LYS 32 HA LYS 32 -3.226 -14.848 -3.891 246 1HB LYS 32 1HB LYS 32 -2.560 -16.520 -2.286 247 2HB LYS 32 2HB LYS 32 -4.034 -15.743 -1.732 248 1HG LYS 32 1HG LYS 32 -5.325 -17.675 -2.559 249 2HG LYS 32 2HG LYS 32 -3.809 -18.457 -3.014 250 1HD LYS 32 1HD LYS 32 -4.413 -19.345 -0.898 251 2HD LYS 32 2HD LYS 32 -3.095 -18.207 -0.606 252 1HE LYS 32 1HE LYS 32 -4.829 -17.933 1.069 253 2HE LYS 32 2HE LYS 32 -4.735 -16.497 0.050 254 1HZ LYS 32 1HZ LYS 32 -6.688 -18.684 -0.400 255 2HZ LYS 32 2HZ LYS 32 -6.680 -17.144 -1.110 256 3HZ LYS 32 3HZ LYS 32 -7.033 -17.316 0.537 257 H GLU 33 H GLU 33 -5.062 -16.692 -5.860 258 HA GLU 33 HA GLU 33 -3.024 -18.576 -6.668 259 1HB GLU 33 1HB GLU 33 -5.658 -17.898 -7.957 260 2HB GLU 33 2HB GLU 33 -4.602 -19.223 -8.422 261 1HG GLU 33 1HG GLU 33 -6.076 -18.902 -5.826 262 2HG GLU 33 2HG GLU 33 -6.395 -20.058 -7.107 263 H THR 34 H THR 34 -4.568 -15.653 -7.950 264 HA THR 34 HA THR 34 -2.413 -15.471 -9.962 265 HB THR 34 HB THR 34 -4.171 -14.351 -11.431 266 HG1 THR 34 HG1 THR 34 -5.790 -15.431 -9.352 267 1HG2 THR 34 1HG2 THR 34 -3.313 -16.611 -11.843 268 2HG2 THR 34 2HG2 THR 34 -5.027 -16.496 -12.239 269 3HG2 THR 34 3HG2 THR 34 -4.519 -17.271 -10.738 270 H GLY 35 H GLY 35 -3.791 -13.926 -7.328 271 1HA GLY 35 1HA GLY 35 -3.259 -11.867 -6.417 272 2HA GLY 35 2HA GLY 35 -2.291 -11.527 -7.842 273 H ILE 36 H ILE 36 -5.629 -12.463 -8.014 274 HA ILE 36 HA ILE 36 -6.329 -9.842 -9.128 275 HB ILE 36 HB ILE 36 -7.822 -12.476 -9.176 276 1HG1 ILE 36 1HG1 ILE 36 -5.785 -12.440 -10.577 277 2HG1 ILE 36 2HG1 ILE 36 -7.256 -12.570 -11.535 278 1HG2 ILE 36 1HG2 ILE 36 -9.309 -11.377 -10.803 279 2HG2 ILE 36 2HG2 ILE 36 -8.485 -9.850 -10.489 280 3HG2 ILE 36 3HG2 ILE 36 -9.384 -10.647 -9.200 281 1HD1 ILE 36 1HD1 ILE 36 -5.688 -11.061 -12.572 282 2HD1 ILE 36 2HD1 ILE 36 -5.625 -10.079 -11.107 283 3HD1 ILE 36 3HD1 ILE 36 -7.121 -10.181 -12.038 284 H VAL 37 H VAL 37 -7.433 -8.426 -7.849 285 HA VAL 37 HA VAL 37 -8.424 -9.250 -5.293 286 HB VAL 37 HB VAL 37 -9.158 -6.681 -6.700 287 1HG1 VAL 37 1HG1 VAL 37 -10.454 -7.197 -4.706 288 2HG1 VAL 37 2HG1 VAL 37 -9.375 -5.835 -4.405 289 3HG1 VAL 37 3HG1 VAL 37 -8.970 -7.436 -3.784 290 1HG2 VAL 37 1HG2 VAL 37 -6.735 -6.907 -6.742 291 2HG2 VAL 37 2HG2 VAL 37 -6.723 -7.253 -5.013 292 3HG2 VAL 37 3HG2 VAL 37 -7.222 -5.663 -5.592 293 H LYS 38 H LYS 38 -10.096 -10.584 -5.197 294 HA LYS 38 HA LYS 38 -12.022 -10.731 -7.325 295 1HB LYS 38 1HB LYS 38 -11.991 -12.210 -4.685 296 2HB LYS 38 2HB LYS 38 -12.901 -12.651 -6.125 297 1HG LYS 38 1HG LYS 38 -9.891 -12.574 -5.962 298 2HG LYS 38 2HG LYS 38 -10.874 -14.025 -5.764 299 1HD LYS 38 1HD LYS 38 -11.314 -12.408 -8.213 300 2HD LYS 38 2HD LYS 38 -9.807 -13.319 -8.106 301 1HE LYS 38 1HE LYS 38 -12.490 -14.573 -7.595 302 2HE LYS 38 2HE LYS 38 -11.787 -14.478 -9.207 303 1HZ LYS 38 1HZ LYS 38 -10.350 -15.703 -6.923 304 2HZ LYS 38 2HZ LYS 38 -9.998 -15.843 -8.573 305 3HZ LYS 38 3HZ LYS 38 -11.376 -16.595 -7.931 306 H GLU 39 H GLU 39 -11.771 -9.165 -4.299 307 HA GLU 39 HA GLU 39 -14.640 -8.737 -4.060 308 1HB GLU 39 1HB GLU 39 -12.969 -9.103 -2.104 309 2HB GLU 39 2HB GLU 39 -12.532 -7.418 -2.362 310 1HG GLU 39 1HG GLU 39 -14.157 -7.573 -0.599 311 2HG GLU 39 2HG GLU 39 -14.887 -6.782 -1.996 312 H ASP 40 H ASP 40 -15.505 -7.248 -5.351 313 HA ASP 40 HA ASP 40 -13.866 -4.978 -6.220 314 1HB ASP 40 1HB ASP 40 -14.899 -6.190 -8.038 315 2HB ASP 40 2HB ASP 40 -16.481 -6.074 -7.274 316 H CYS 41 H CYS 41 -14.737 -2.869 -6.242 317 HA CYS 41 HA CYS 41 -17.026 -2.344 -4.513 318 1HB CYS 41 1HB CYS 41 -15.739 -0.551 -3.333 319 2HB CYS 41 2HB CYS 41 -15.177 -2.181 -2.979 320 HG CYS 41 HG CYS 41 -13.230 0.101 -3.469 321 H GLU 42 H GLU 42 -14.659 -1.192 -6.844 322 HA GLU 42 HA GLU 42 -16.627 0.686 -7.911 323 1HB GLU 42 1HB GLU 42 -13.824 1.401 -7.047 324 2HB GLU 42 2HB GLU 42 -14.737 2.375 -8.188 325 1HG GLU 42 1HG GLU 42 -15.730 1.716 -5.431 326 2HG GLU 42 2HG GLU 42 -14.769 3.147 -5.798 327 H ILE 43 H ILE 43 -13.250 -0.343 -8.391 328 HA ILE 43 HA ILE 43 -13.807 -0.742 -11.256 329 HB ILE 43 HB ILE 43 -11.611 0.278 -11.783 330 1HG1 ILE 43 1HG1 ILE 43 -11.663 1.126 -8.876 331 2HG1 ILE 43 2HG1 ILE 43 -10.557 -0.049 -9.579 332 1HG2 ILE 43 1HG2 ILE 43 -12.292 2.610 -11.513 333 2HG2 ILE 43 2HG2 ILE 43 -13.503 2.124 -10.326 334 3HG2 ILE 43 3HG2 ILE 43 -13.652 1.600 -12.005 335 1HD1 ILE 43 1HD1 ILE 43 -9.607 1.714 -10.989 336 2HD1 ILE 43 2HD1 ILE 43 -9.468 2.090 -9.271 337 3HD1 ILE 43 3HD1 ILE 43 -10.703 2.882 -10.251 338 H LYS 44 H LYS 44 -13.348 -2.544 -8.862 339 HA LYS 44 HA LYS 44 -10.601 -3.405 -9.105 340 1HB LYS 44 1HB LYS 44 -12.331 -3.280 -7.015 341 2HB LYS 44 2HB LYS 44 -12.444 -4.983 -7.438 342 1HG LYS 44 1HG LYS 44 -10.760 -4.581 -5.720 343 2HG LYS 44 2HG LYS 44 -10.048 -5.231 -7.198 344 1HD LYS 44 1HD LYS 44 -9.365 -2.978 -7.862 345 2HD LYS 44 2HD LYS 44 -10.077 -2.322 -6.386 346 1HE LYS 44 1HE LYS 44 -8.513 -3.618 -5.045 347 2HE LYS 44 2HE LYS 44 -7.840 -4.341 -6.506 348 1HZ LYS 44 1HZ LYS 44 -6.466 -2.525 -5.682 349 2HZ LYS 44 2HZ LYS 44 -7.764 -1.444 -5.830 350 3HZ LYS 44 3HZ LYS 44 -7.095 -2.163 -7.210 351 H GLY 45 H GLY 45 -10.681 -6.088 -8.666 352 1HA GLY 45 1HA GLY 45 -11.268 -8.126 -9.745 353 2HA GLY 45 2HA GLY 45 -12.024 -7.192 -11.031 354 H GLU 46 H GLU 46 -9.235 -5.658 -10.352 355 HA GLU 46 HA GLU 46 -7.914 -6.823 -12.663 356 1HB GLU 46 1HB GLU 46 -7.585 -4.236 -11.170 357 2HB GLU 46 2HB GLU 46 -6.421 -4.768 -12.378 358 1HG GLU 46 1HG GLU 46 -9.362 -4.371 -12.871 359 2HG GLU 46 2HG GLU 46 -8.095 -3.214 -13.276 360 H SER 47 H SER 47 -5.372 -6.441 -12.444 361 HA SER 47 HA SER 47 -4.618 -8.398 -10.420 362 1HB SER 47 1HB SER 47 -2.942 -7.305 -12.690 363 2HB SER 47 2HB SER 47 -2.670 -8.786 -11.771 364 HG SER 47 HG SER 47 -4.849 -8.257 -13.525 365 H VAL 48 H VAL 48 -3.432 -7.920 -8.673 366 HA VAL 48 HA VAL 48 -2.060 -5.314 -8.582 367 HB VAL 48 HB VAL 48 -1.916 -5.640 -6.135 368 1HG1 VAL 48 1HG1 VAL 48 -3.754 -4.356 -7.041 369 2HG1 VAL 48 2HG1 VAL 48 -4.299 -5.283 -5.643 370 3HG1 VAL 48 3HG1 VAL 48 -4.701 -5.825 -7.273 371 1HG2 VAL 48 1HG2 VAL 48 -3.238 -7.408 -5.061 372 2HG2 VAL 48 2HG2 VAL 48 -1.935 -8.067 -6.052 373 3HG2 VAL 48 3HG2 VAL 48 -3.595 -8.094 -6.647 374 H ALA 49 H ALA 49 -1.466 -8.361 -9.394 375 HA ALA 49 HA ALA 49 0.817 -9.118 -7.969 376 1HB ALA 49 1HB ALA 49 -0.016 -9.933 -10.748 377 2HB ALA 49 2HB ALA 49 -0.562 -10.693 -9.253 378 3HB ALA 49 3HB ALA 49 1.140 -10.772 -9.713 379 H GLY 50 H GLY 50 2.252 -7.560 -7.844 380 1HA GLY 50 1HA GLY 50 4.337 -6.752 -8.497 381 2HA GLY 50 2HA GLY 50 3.981 -7.210 -10.154 382 H ARG 51 H ARG 51 1.598 -5.395 -8.451 383 HA ARG 51 HA ARG 51 2.475 -2.968 -9.872 384 1HB ARG 51 1HB ARG 51 -0.231 -4.200 -9.614 385 2HB ARG 51 2HB ARG 51 -0.121 -2.445 -9.641 386 1HG ARG 51 1HG ARG 51 -0.528 -3.252 -11.861 387 2HG ARG 51 2HG ARG 51 1.102 -2.585 -11.780 388 1HD ARG 51 1HD ARG 51 1.853 -4.993 -11.339 389 2HD ARG 51 2HD ARG 51 0.247 -5.457 -11.901 390 HE ARG 51 HE ARG 51 1.609 -3.685 -13.708 391 1HH1 ARG 51 1HH1 ARG 51 1.316 -7.042 -12.708 392 2HH1 ARG 51 2HH1 ARG 51 1.779 -7.672 -14.257 393 1HH2 ARG 51 1HH2 ARG 51 2.240 -4.524 -15.739 394 2HH2 ARG 51 2HH2 ARG 51 2.302 -6.247 -15.977 395 H ILE 52 H ILE 52 1.552 -0.939 -8.881 396 HA ILE 52 HA ILE 52 2.062 -1.074 -6.005 397 HB ILE 52 HB ILE 52 1.945 1.284 -7.898 398 1HG1 ILE 52 1HG1 ILE 52 4.239 -0.048 -6.445 399 2HG1 ILE 52 2HG1 ILE 52 3.915 -0.137 -8.172 400 1HG2 ILE 52 1HG2 ILE 52 2.567 1.222 -4.944 401 2HG2 ILE 52 2HG2 ILE 52 1.157 1.963 -5.703 402 3HG2 ILE 52 3HG2 ILE 52 2.767 2.620 -6.001 403 1HD1 ILE 52 1HD1 ILE 52 4.663 2.332 -6.630 404 2HD1 ILE 52 2HD1 ILE 52 4.302 2.270 -8.355 405 3HD1 ILE 52 3HD1 ILE 52 5.705 1.412 -7.715 406 H LEU 53 H LEU 53 0.477 -0.958 -4.588 407 HA LEU 53 HA LEU 53 -2.221 -0.404 -5.590 408 1HB LEU 53 1HB LEU 53 -1.613 -2.588 -4.473 409 2HB LEU 53 2HB LEU 53 -1.407 -1.687 -2.984 410 HG LEU 53 HG LEU 53 -3.749 -1.104 -2.943 411 1HD1 LEU 53 1HD1 LEU 53 -4.090 -0.843 -5.356 412 2HD1 LEU 53 2HD1 LEU 53 -5.303 -1.905 -4.641 413 3HD1 LEU 53 3HD1 LEU 53 -3.963 -2.590 -5.561 414 1HD2 LEU 53 1HD2 LEU 53 -3.158 -3.234 -1.967 415 2HD2 LEU 53 2HD2 LEU 53 -3.274 -4.021 -3.541 416 3HD2 LEU 53 3HD2 LEU 53 -4.722 -3.374 -2.770 417 H VAL 54 H VAL 54 -3.314 1.361 -4.974 418 HA VAL 54 HA VAL 54 -2.117 3.042 -2.872 419 HB VAL 54 HB VAL 54 -3.902 3.879 -5.166 420 1HG1 VAL 54 1HG1 VAL 54 -3.337 6.159 -4.506 421 2HG1 VAL 54 2HG1 VAL 54 -2.415 5.540 -3.136 422 3HG1 VAL 54 3HG1 VAL 54 -4.162 5.302 -3.205 423 1HG2 VAL 54 1HG2 VAL 54 -1.894 4.933 -6.094 424 2HG2 VAL 54 2HG2 VAL 54 -1.696 3.187 -5.948 425 3HG2 VAL 54 3HG2 VAL 54 -0.933 4.262 -4.777 426 H PHE 55 H PHE 55 -3.168 3.144 -1.049 427 HA PHE 55 HA PHE 55 -6.106 3.158 -1.044 428 1HB PHE 55 1HB PHE 55 -4.283 1.385 0.521 429 2HB PHE 55 2HB PHE 55 -5.718 2.003 1.328 430 HD1 PHE 55 HD1 PHE 55 -4.442 -0.236 -1.248 431 HD2 PHE 55 HD2 PHE 55 -7.932 1.344 0.605 432 HE1 PHE 55 HE1 PHE 55 -5.789 -2.033 -2.251 433 HE2 PHE 55 HE2 PHE 55 -9.282 -0.452 -0.396 434 HZ PHE 55 HZ PHE 55 -8.209 -2.145 -1.826 435 HA PRO 56 HA PRO 56 -5.484 6.749 1.536 436 1HB PRO 56 1HB PRO 56 -8.150 6.238 2.647 437 2HB PRO 56 2HB PRO 56 -7.593 7.600 1.671 438 1HG PRO 56 1HG PRO 56 -9.293 5.734 0.709 439 2HG PRO 56 2HG PRO 56 -8.101 6.552 -0.317 440 1HD PRO 56 1HD PRO 56 -8.008 3.813 0.890 441 2HD PRO 56 2HD PRO 56 -7.503 4.351 -0.727 442 H GLY 57 H GLY 57 -7.362 4.148 3.074 443 1HA GLY 57 1HA GLY 57 -5.365 3.693 5.079 444 2HA GLY 57 2HA GLY 57 -6.765 4.555 5.707 445 H GLY 58 H GLY 58 -5.946 1.705 3.750 446 1HA GLY 58 1HA GLY 58 -8.429 0.419 3.984 447 2HA GLY 58 2HA GLY 58 -6.911 -0.366 3.581 448 H LYS 59 H LYS 59 -5.666 0.464 6.104 449 HA LYS 59 HA LYS 59 -5.393 -0.168 8.264 450 1HB LYS 59 1HB LYS 59 -7.732 0.643 8.567 451 2HB LYS 59 2HB LYS 59 -8.312 -0.973 8.195 452 1HG LYS 59 1HG LYS 59 -7.042 -1.816 10.155 453 2HG LYS 59 2HG LYS 59 -6.645 -0.146 10.560 454 1HD LYS 59 1HD LYS 59 -9.433 -1.265 10.323 455 2HD LYS 59 2HD LYS 59 -8.567 -1.017 11.838 456 1HE LYS 59 1HE LYS 59 -8.415 1.396 11.300 457 2HE LYS 59 2HE LYS 59 -9.391 1.102 9.858 458 1HZ LYS 59 1HZ LYS 59 -11.163 0.273 11.295 459 2HZ LYS 59 2HZ LYS 59 -10.772 1.878 11.668 460 3HZ LYS 59 3HZ LYS 59 -10.228 0.615 12.666 461 H GLY 60 H GLY 60 -5.332 -2.138 9.662 462 1HA GLY 60 1HA GLY 60 -5.584 -4.620 8.089 463 2HA GLY 60 2HA GLY 60 -4.197 -4.312 9.124 464 H SER 61 H SER 61 -7.493 -5.295 8.992 465 HA SER 61 HA SER 61 -7.701 -5.374 11.899 466 1HB SER 61 1HB SER 61 -9.782 -6.008 9.791 467 2HB SER 61 2HB SER 61 -10.067 -5.878 11.528 468 HG SER 61 HG SER 61 -9.965 -3.926 9.666 469 H THR 62 H THR 62 -6.387 -7.077 12.481 470 HA THR 62 HA THR 62 -5.886 -9.231 13.018 471 HB THR 62 HB THR 62 -8.654 -9.995 12.077 472 HG1 THR 62 HG1 THR 62 -7.834 -8.503 14.356 473 1HG2 THR 62 1HG2 THR 62 -8.544 -11.553 13.966 474 2HG2 THR 62 2HG2 THR 62 -6.940 -10.950 14.380 475 3HG2 THR 62 3HG2 THR 62 -7.193 -11.813 12.863 476 H VAL 63 H VAL 63 -4.925 -8.492 10.568 477 HA VAL 63 HA VAL 63 -5.690 -10.385 8.541 478 HB VAL 63 HB VAL 63 -3.355 -8.469 8.556 479 1HG1 VAL 63 1HG1 VAL 63 -3.034 -10.250 6.948 480 2HG1 VAL 63 2HG1 VAL 63 -3.420 -8.748 6.106 481 3HG1 VAL 63 3HG1 VAL 63 -4.653 -9.994 6.300 482 1HG2 VAL 63 1HG2 VAL 63 -4.778 -7.014 7.199 483 2HG2 VAL 63 2HG2 VAL 63 -5.492 -7.310 8.785 484 3HG2 VAL 63 3HG2 VAL 63 -6.111 -8.156 7.369 485 H GLY 64 H GLY 64 -3.050 -10.038 10.840 486 1HA GLY 64 1HA GLY 64 -1.647 -11.727 11.632 487 2HA GLY 64 2HA GLY 64 -2.301 -12.807 10.407 488 H SER 65 H SER 65 -1.818 -10.847 8.279 489 HA SER 65 HA SER 65 -0.262 -10.053 6.850 490 1HB SER 65 1HB SER 65 1.656 -10.285 9.174 491 2HB SER 65 2HB SER 65 1.931 -9.377 7.686 492 HG SER 65 HG SER 65 0.978 -7.794 8.677 493 H TYR 66 H TYR 66 -0.323 -13.093 7.972 494 HA TYR 66 HA TYR 66 2.082 -14.201 6.932 495 1HB TYR 66 1HB TYR 66 1.004 -16.362 7.263 496 2HB TYR 66 2HB TYR 66 0.670 -15.328 8.647 497 HD1 TYR 66 HD1 TYR 66 -0.752 -17.338 6.047 498 HD2 TYR 66 HD2 TYR 66 -1.597 -14.154 8.739 499 HE1 TYR 66 HE1 TYR 66 -3.161 -17.713 5.728 500 HE2 TYR 66 HE2 TYR 66 -4.007 -14.521 8.430 501 HH TYR 66 HH TYR 66 -5.488 -15.503 6.578 502 H VAL 67 H VAL 67 -1.002 -13.356 5.591 503 HA VAL 67 HA VAL 67 -0.860 -15.033 3.303 504 HB VAL 67 HB VAL 67 -3.000 -14.230 4.152 505 1HG1 VAL 67 1HG1 VAL 67 -2.155 -11.499 3.201 506 2HG1 VAL 67 2HG1 VAL 67 -2.308 -12.002 4.885 507 3HG1 VAL 67 3HG1 VAL 67 -3.735 -11.938 3.849 508 1HG2 VAL 67 1HG2 VAL 67 -2.882 -14.904 1.823 509 2HG2 VAL 67 2HG2 VAL 67 -2.426 -13.266 1.354 510 3HG2 VAL 67 3HG2 VAL 67 -4.027 -13.578 2.025 511 H LEU 68 H LEU 68 0.328 -11.820 4.021 512 HA LEU 68 HA LEU 68 0.650 -10.977 1.335 513 1HB LEU 68 1HB LEU 68 2.001 -10.074 3.872 514 2HB LEU 68 2HB LEU 68 2.318 -9.345 2.309 515 HG LEU 68 HG LEU 68 -0.268 -8.978 2.249 516 1HD1 LEU 68 1HD1 LEU 68 0.220 -9.250 5.209 517 2HD1 LEU 68 2HD1 LEU 68 -0.809 -10.286 4.218 518 3HD1 LEU 68 3HD1 LEU 68 -1.236 -8.592 4.461 519 1HD2 LEU 68 1HD2 LEU 68 1.576 -7.377 4.014 520 2HD2 LEU 68 2HD2 LEU 68 0.029 -6.816 3.377 521 3HD2 LEU 68 3HD2 LEU 68 1.353 -7.189 2.274 522 H LEU 69 H LEU 69 2.811 -12.610 3.613 523 HA LEU 69 HA LEU 69 5.046 -12.659 1.867 524 1HB LEU 69 1HB LEU 69 5.201 -13.042 4.310 525 2HB LEU 69 2HB LEU 69 4.357 -14.566 4.111 526 HG LEU 69 HG LEU 69 6.222 -15.408 2.730 527 1HD1 LEU 69 1HD1 LEU 69 7.543 -12.794 3.450 528 2HD1 LEU 69 2HD1 LEU 69 7.021 -13.293 1.840 529 3HD1 LEU 69 3HD1 LEU 69 8.326 -14.159 2.651 530 1HD2 LEU 69 1HD2 LEU 69 6.183 -15.842 5.134 531 2HD2 LEU 69 2HD2 LEU 69 7.067 -14.345 5.424 532 3HD2 LEU 69 3HD2 LEU 69 7.835 -15.668 4.545 533 H ASN 70 H ASN 70 2.301 -14.789 2.419 534 HA ASN 70 HA ASN 70 3.005 -16.951 0.789 535 1HB ASN 70 1HB ASN 70 1.099 -17.151 2.225 536 2HB ASN 70 2HB ASN 70 0.317 -15.754 1.492 537 1HD2 ASN 70 1HD2 ASN 70 1.054 -19.125 1.174 538 2HD2 ASN 70 2HD2 ASN 70 -0.003 -19.434 -0.168 539 H LEU 71 H LEU 71 1.210 -13.987 0.010 540 HA LEU 71 HA LEU 71 0.784 -14.475 -2.703 541 1HB LEU 71 1HB LEU 71 1.296 -11.804 -1.389 542 2HB LEU 71 2HB LEU 71 0.531 -12.055 -2.944 543 HG LEU 71 HG LEU 71 -0.592 -12.877 -0.267 544 1HD1 LEU 71 1HD1 LEU 71 -0.662 -10.474 -0.630 545 2HD1 LEU 71 2HD1 LEU 71 -2.279 -11.171 -0.719 546 3HD1 LEU 71 3HD1 LEU 71 -1.431 -10.722 -2.198 547 1HD2 LEU 71 1HD2 LEU 71 -1.226 -14.453 -2.017 548 2HD2 LEU 71 2HD2 LEU 71 -1.770 -13.119 -3.033 549 3HD2 LEU 71 3HD2 LEU 71 -2.606 -13.473 -1.521 550 H ARG 72 H ARG 72 3.542 -13.056 -1.027 551 HA ARG 72 HA ARG 72 4.942 -12.239 -3.344 552 1HB ARG 72 1HB ARG 72 5.399 -11.323 -1.107 553 2HB ARG 72 2HB ARG 72 6.000 -12.884 -0.583 554 1HG ARG 72 1HG ARG 72 7.274 -11.518 -2.915 555 2HG ARG 72 2HG ARG 72 7.658 -11.004 -1.272 556 1HD ARG 72 1HD ARG 72 8.365 -13.256 -0.709 557 2HD ARG 72 2HD ARG 72 7.911 -13.821 -2.316 558 HE ARG 72 HE ARG 72 10.035 -11.804 -1.912 559 1HH1 ARG 72 1HH1 ARG 72 8.833 -14.752 -3.357 560 2HH1 ARG 72 2HH1 ARG 72 10.296 -15.084 -4.230 561 1HH2 ARG 72 1HH2 ARG 72 11.979 -12.247 -3.000 562 2HH2 ARG 72 2HH2 ARG 72 12.111 -13.671 -3.991 563 H LYS 73 H LYS 73 5.078 -15.195 -1.399 564 HA LYS 73 HA LYS 73 7.263 -16.339 -2.769 565 1HB LYS 73 1HB LYS 73 5.032 -17.624 -1.199 566 2HB LYS 73 2HB LYS 73 6.415 -18.508 -1.827 567 1HG LYS 73 1HG LYS 73 7.880 -16.945 -0.517 568 2HG LYS 73 2HG LYS 73 6.409 -16.334 0.246 569 1HD LYS 73 1HD LYS 73 5.898 -18.547 1.097 570 2HD LYS 73 2HD LYS 73 7.303 -19.216 0.264 571 1HE LYS 73 1HE LYS 73 8.735 -17.673 1.617 572 2HE LYS 73 2HE LYS 73 7.296 -17.230 2.534 573 1HZ LYS 73 1HZ LYS 73 8.556 -18.935 3.673 574 2HZ LYS 73 2HZ LYS 73 8.453 -19.958 2.326 575 3HZ LYS 73 3HZ LYS 73 7.051 -19.552 3.190 576 H ASN 74 H ASN 74 3.874 -16.170 -3.517 577 HA ASN 74 HA ASN 74 4.132 -18.156 -5.636 578 1HB ASN 74 1HB ASN 74 2.070 -18.012 -4.199 579 2HB ASN 74 2HB ASN 74 1.719 -16.461 -4.954 580 1HD2 ASN 74 1HD2 ASN 74 -0.233 -17.243 -5.798 581 2HD2 ASN 74 2HD2 ASN 74 -0.269 -18.330 -7.143 582 H GLY 75 H GLY 75 4.412 -14.799 -5.183 583 1HA GLY 75 1HA GLY 75 5.234 -13.253 -6.712 584 2HA GLY 75 2HA GLY 75 5.008 -14.435 -7.991 585 H VAL 76 H VAL 76 2.433 -13.652 -5.794 586 HA VAL 76 HA VAL 76 1.068 -12.228 -7.985 587 HB VAL 76 HB VAL 76 -1.062 -13.088 -7.088 588 1HG1 VAL 76 1HG1 VAL 76 0.957 -15.222 -7.770 589 2HG1 VAL 76 2HG1 VAL 76 0.018 -14.261 -8.912 590 3HG1 VAL 76 3HG1 VAL 76 -0.796 -15.406 -7.846 591 1HG2 VAL 76 1HG2 VAL 76 0.685 -14.734 -5.255 592 2HG2 VAL 76 2HG2 VAL 76 -1.059 -14.916 -5.453 593 3HG2 VAL 76 3HG2 VAL 76 -0.401 -13.431 -4.769 594 H ALA 77 H ALA 77 2.661 -11.517 -5.406 595 HA ALA 77 HA ALA 77 0.746 -10.024 -3.851 596 1HB ALA 77 1HB ALA 77 3.762 -10.038 -3.722 597 2HB ALA 77 2HB ALA 77 2.692 -11.093 -2.799 598 3HB ALA 77 3HB ALA 77 2.667 -9.352 -2.520 599 HA PRO 78 HA PRO 78 1.221 -6.030 -5.830 600 1HB PRO 78 1HB PRO 78 1.535 -4.871 -3.135 601 2HB PRO 78 2HB PRO 78 0.320 -4.530 -4.371 602 1HG PRO 78 1HG PRO 78 -0.271 -5.903 -2.131 603 2HG PRO 78 2HG PRO 78 -1.055 -6.243 -3.683 604 1HD PRO 78 1HD PRO 78 1.109 -7.743 -2.282 605 2HD PRO 78 2HD PRO 78 -0.242 -8.355 -3.257 606 H LYS 79 H LYS 79 2.896 -4.613 -6.347 607 HA LYS 79 HA LYS 79 5.519 -5.505 -5.498 608 1HB LYS 79 1HB LYS 79 4.779 -4.889 -7.895 609 2HB LYS 79 2HB LYS 79 4.984 -3.233 -7.362 610 1HG LYS 79 1HG LYS 79 7.317 -3.647 -6.869 611 2HG LYS 79 2HG LYS 79 7.129 -5.338 -7.334 612 1HD LYS 79 1HD LYS 79 6.475 -4.597 -9.598 613 2HD LYS 79 2HD LYS 79 6.775 -2.930 -9.114 614 1HE LYS 79 1HE LYS 79 9.120 -3.511 -8.649 615 2HE LYS 79 2HE LYS 79 8.810 -5.156 -9.197 616 1HZ LYS 79 1HZ LYS 79 8.180 -4.205 -11.381 617 2HZ LYS 79 2HZ LYS 79 9.801 -3.928 -10.973 618 3HZ LYS 79 3HZ LYS 79 8.664 -2.675 -10.831 619 H ALA 80 H ALA 80 3.294 -2.989 -4.879 620 HA ALA 80 HA ALA 80 4.785 -2.090 -2.630 621 1HB ALA 80 1HB ALA 80 5.951 -0.823 -4.372 622 2HB ALA 80 2HB ALA 80 5.052 0.236 -3.286 623 3HB ALA 80 3HB ALA 80 4.415 -0.127 -4.891 624 H ILE 81 H ILE 81 3.584 -0.451 -1.411 625 HA ILE 81 HA ILE 81 0.889 0.127 -2.329 626 HB ILE 81 HB ILE 81 0.440 -1.890 -1.140 627 1HG1 ILE 81 1HG1 ILE 81 -0.183 0.447 0.680 628 2HG1 ILE 81 2HG1 ILE 81 -1.119 -0.023 -0.737 629 1HG2 ILE 81 1HG2 ILE 81 1.115 -2.266 1.193 630 2HG2 ILE 81 2HG2 ILE 81 2.051 -0.770 1.148 631 3HG2 ILE 81 3HG2 ILE 81 2.497 -2.121 0.105 632 1HD1 ILE 81 1HD1 ILE 81 -0.729 -1.654 1.764 633 2HD1 ILE 81 2HD1 ILE 81 -1.635 -2.162 0.339 634 3HD1 ILE 81 3HD1 ILE 81 -2.190 -0.785 1.291 635 H ILE 82 H ILE 82 0.681 2.244 -2.129 636 HA ILE 82 HA ILE 82 2.196 3.602 0.007 637 HB ILE 82 HB ILE 82 1.101 5.022 -2.413 638 1HG1 ILE 82 1HG1 ILE 82 2.451 3.173 -3.295 639 2HG1 ILE 82 2HG1 ILE 82 3.271 4.709 -3.541 640 1HG2 ILE 82 1HG2 ILE 82 3.474 5.565 -0.622 641 2HG2 ILE 82 2HG2 ILE 82 1.910 6.375 -0.538 642 3HG2 ILE 82 3HG2 ILE 82 2.936 6.584 -1.956 643 1HD1 ILE 82 1HD1 ILE 82 4.702 4.242 -1.611 644 2HD1 ILE 82 2HD1 ILE 82 4.834 2.998 -2.854 645 3HD1 ILE 82 3HD1 ILE 82 3.890 2.692 -1.396 646 H ASN 83 H ASN 83 1.055 4.588 1.567 647 HA ASN 83 HA ASN 83 -1.856 4.811 1.150 648 1HB ASN 83 1HB ASN 83 -0.387 3.928 3.645 649 2HB ASN 83 2HB ASN 83 -2.110 4.266 3.577 650 1HD2 ASN 83 1HD2 ASN 83 -2.347 3.113 0.881 651 2HD2 ASN 83 2HD2 ASN 83 -2.278 1.398 1.103 652 H LYS 84 H LYS 84 -2.951 6.387 2.462 653 HA LYS 84 HA LYS 84 -1.458 8.800 2.951 654 1HB LYS 84 1HB LYS 84 -3.893 8.675 2.184 655 2HB LYS 84 2HB LYS 84 -4.294 8.192 3.824 656 1HG LYS 84 1HG LYS 84 -3.439 10.309 4.672 657 2HG LYS 84 2HG LYS 84 -2.990 10.792 3.036 658 1HD LYS 84 1HD LYS 84 -5.414 10.511 2.405 659 2HD LYS 84 2HD LYS 84 -5.763 10.316 4.124 660 1HE LYS 84 1HE LYS 84 -4.828 12.533 4.566 661 2HE LYS 84 2HE LYS 84 -4.463 12.725 2.853 662 1HZ LYS 84 1HZ LYS 84 -6.465 13.863 3.208 663 2HZ LYS 84 2HZ LYS 84 -7.123 12.621 4.148 664 3HZ LYS 84 3HZ LYS 84 -6.934 12.405 2.477 665 H LYS 85 H LYS 85 -2.998 6.258 4.830 666 HA LYS 85 HA LYS 85 -0.905 6.466 6.795 667 1HB LYS 85 1HB LYS 85 -2.387 6.499 8.716 668 2HB LYS 85 2HB LYS 85 -2.652 7.937 7.748 669 1HG LYS 85 1HG LYS 85 -4.715 7.155 6.960 670 2HG LYS 85 2HG LYS 85 -4.380 5.502 7.479 671 1HD LYS 85 1HD LYS 85 -4.442 6.240 9.821 672 2HD LYS 85 2HD LYS 85 -4.811 7.878 9.284 673 1HE LYS 85 1HE LYS 85 -6.907 7.182 8.375 674 2HE LYS 85 2HE LYS 85 -6.522 5.483 8.645 675 1HZ LYS 85 1HZ LYS 85 -8.051 6.472 10.318 676 2HZ LYS 85 2HZ LYS 85 -6.783 7.478 10.826 677 3HZ LYS 85 3HZ LYS 85 -6.642 5.793 10.982 678 H THR 86 H THR 86 -0.781 4.466 8.079 679 HA THR 86 HA THR 86 -2.485 2.299 7.124 680 HB THR 86 HB THR 86 -0.489 2.420 5.608 681 HG1 THR 86 HG1 THR 86 -0.757 0.341 5.429 682 1HG2 THR 86 1HG2 THR 86 1.669 1.611 6.474 683 2HG2 THR 86 2HG2 THR 86 1.009 1.627 8.108 684 3HG2 THR 86 3HG2 THR 86 1.189 3.136 7.216 685 H GLU 87 H GLU 87 -1.768 0.182 8.304 686 HA GLU 87 HA GLU 87 -1.487 0.896 11.146 687 1HB GLU 87 1HB GLU 87 -2.832 -1.515 9.905 688 2HB GLU 87 2HB GLU 87 -2.718 -1.185 11.627 689 1HG GLU 87 1HG GLU 87 -4.162 0.515 9.607 690 2HG GLU 87 2HG GLU 87 -4.913 -0.625 10.720 691 H THR 88 H THR 88 -0.633 -0.999 12.491 692 HA THR 88 HA THR 88 2.058 -1.248 11.856 693 HB THR 88 HB THR 88 0.472 -2.889 13.832 694 HG1 THR 88 HG1 THR 88 1.993 -0.809 14.779 695 1HG2 THR 88 1HG2 THR 88 2.675 -3.852 13.415 696 2HG2 THR 88 2HG2 THR 88 2.626 -3.110 15.014 697 3HG2 THR 88 3HG2 THR 88 3.429 -2.280 13.681 698 H ILE 89 H ILE 89 -0.445 -3.840 11.737 699 HA ILE 89 HA ILE 89 1.410 -5.854 11.078 700 HB ILE 89 HB ILE 89 -0.517 -7.216 10.323 701 1HG1 ILE 89 1HG1 ILE 89 -2.173 -4.816 11.109 702 2HG1 ILE 89 2HG1 ILE 89 -1.891 -5.349 9.451 703 1HG2 ILE 89 1HG2 ILE 89 -1.595 -7.366 12.524 704 2HG2 ILE 89 2HG2 ILE 89 -0.812 -5.854 12.991 705 3HG2 ILE 89 3HG2 ILE 89 0.164 -7.280 12.630 706 1HD1 ILE 89 1HD1 ILE 89 -2.995 -7.464 9.946 707 2HD1 ILE 89 2HD1 ILE 89 -4.050 -6.087 10.263 708 3HD1 ILE 89 3HD1 ILE 89 -3.276 -6.931 11.605 709 H ILE 90 H ILE 90 -0.318 -3.582 9.079 710 HA ILE 90 HA ILE 90 0.045 -4.891 6.601 711 HB ILE 90 HB ILE 90 -0.148 -1.914 7.106 712 1HG1 ILE 90 1HG1 ILE 90 -2.057 -3.088 8.078 713 2HG1 ILE 90 2HG1 ILE 90 -2.557 -2.197 6.646 714 1HG2 ILE 90 1HG2 ILE 90 -0.666 -3.544 4.623 715 2HG2 ILE 90 2HG2 ILE 90 0.674 -2.430 4.883 716 3HG2 ILE 90 3HG2 ILE 90 -0.977 -1.815 4.790 717 1HD1 ILE 90 1HD1 ILE 90 -3.598 -4.399 6.770 718 2HD1 ILE 90 2HD1 ILE 90 -2.006 -5.154 6.754 719 3HD1 ILE 90 3HD1 ILE 90 -2.566 -4.247 5.348 720 H ALA 91 H ALA 91 1.924 -2.457 8.342 721 HA ALA 91 HA ALA 91 3.984 -2.188 6.444 722 1HB ALA 91 1HB ALA 91 3.591 -0.559 8.217 723 2HB ALA 91 2HB ALA 91 5.254 -1.145 8.245 724 3HB ALA 91 3HB ALA 91 4.088 -1.746 9.424 725 H VAL 92 H VAL 92 3.727 -4.194 9.361 726 HA VAL 92 HA VAL 92 6.287 -5.345 9.227 727 HB VAL 92 HB VAL 92 3.752 -6.472 10.433 728 1HG1 VAL 92 1HG1 VAL 92 6.630 -7.264 10.885 729 2HG1 VAL 92 2HG1 VAL 92 5.392 -8.239 10.094 730 3HG1 VAL 92 3HG1 VAL 92 5.251 -7.856 11.810 731 1HG2 VAL 92 1HG2 VAL 92 6.011 -4.908 11.678 732 2HG2 VAL 92 2HG2 VAL 92 4.635 -5.597 12.540 733 3HG2 VAL 92 3HG2 VAL 92 4.381 -4.309 11.362 734 H GLY 93 H GLY 93 3.158 -6.483 7.975 735 1HA GLY 93 1HA GLY 93 4.072 -8.970 7.016 736 2HA GLY 93 2HA GLY 93 2.629 -8.130 6.470 737 H ALA 94 H ALA 94 3.771 -5.821 5.422 738 HA ALA 94 HA ALA 94 4.552 -6.806 2.864 739 1HB ALA 94 1HB ALA 94 4.500 -3.976 3.887 740 2HB ALA 94 2HB ALA 94 3.150 -4.823 3.133 741 3HB ALA 94 3HB ALA 94 4.605 -4.469 2.199 742 H ALA 95 H ALA 95 6.274 -5.287 5.553 743 HA ALA 95 HA ALA 95 8.731 -4.807 4.273 744 1HB ALA 95 1HB ALA 95 8.259 -5.574 7.157 745 2HB ALA 95 2HB ALA 95 8.165 -3.940 6.499 746 3HB ALA 95 3HB ALA 95 9.704 -4.801 6.506 747 H MET 96 H MET 96 7.321 -7.736 5.584 748 HA MET 96 HA MET 96 9.756 -9.265 5.293 749 1HB MET 96 1HB MET 96 6.918 -10.124 5.891 750 2HB MET 96 2HB MET 96 8.304 -11.205 5.874 751 1HG MET 96 1HG MET 96 9.323 -9.901 7.682 752 2HG MET 96 2HG MET 96 7.900 -8.864 7.719 753 1HE MET 96 1HE MET 96 5.455 -9.749 8.365 754 2HE MET 96 2HE MET 96 5.116 -11.414 8.836 755 3HE MET 96 3HE MET 96 5.585 -11.048 7.176 756 H ALA 97 H ALA 97 6.709 -8.867 3.560 757 HA ALA 97 HA ALA 97 7.343 -10.860 1.588 758 1HB ALA 97 1HB ALA 97 5.152 -8.792 1.616 759 2HB ALA 97 2HB ALA 97 5.035 -10.424 2.274 760 3HB ALA 97 3HB ALA 97 5.255 -10.184 0.540 761 H GLU 98 H GLU 98 8.704 -7.975 2.051 762 HA GLU 98 HA GLU 98 10.035 -6.643 0.785 763 1HB GLU 98 1HB GLU 98 9.544 -8.634 -1.440 764 2HB GLU 98 2HB GLU 98 10.865 -7.477 -1.337 765 1HG GLU 98 1HG GLU 98 11.710 -8.627 0.654 766 2HG GLU 98 2HG GLU 98 10.398 -9.796 0.529 767 H ILE 99 H ILE 99 7.270 -6.122 0.972 768 HA ILE 99 HA ILE 99 6.653 -4.805 -1.591 769 HB ILE 99 HB ILE 99 4.748 -5.384 0.689 770 1HG1 ILE 99 1HG1 ILE 99 5.019 -6.830 -1.955 771 2HG1 ILE 99 2HG1 ILE 99 5.579 -7.459 -0.409 772 1HG2 ILE 99 1HG2 ILE 99 3.008 -4.829 -0.948 773 2HG2 ILE 99 2HG2 ILE 99 4.253 -4.451 -2.139 774 3HG2 ILE 99 3HG2 ILE 99 4.103 -3.473 -0.679 775 1HD1 ILE 99 1HD1 ILE 99 2.725 -6.836 -1.136 776 2HD1 ILE 99 2HD1 ILE 99 3.282 -7.457 0.418 777 3HD1 ILE 99 3HD1 ILE 99 3.454 -8.438 -1.037 778 HA PRO 100 HA PRO 100 8.184 -1.439 1.142 779 1HB PRO 100 1HB PRO 100 8.218 -0.031 -1.464 780 2HB PRO 100 2HB PRO 100 9.488 -0.180 -0.245 781 1HG PRO 100 1HG PRO 100 9.620 -1.537 -2.539 782 2HG PRO 100 2HG PRO 100 10.166 -2.256 -1.013 783 1HD PRO 100 1HD PRO 100 7.628 -2.718 -2.523 784 2HD PRO 100 2HD PRO 100 8.651 -3.882 -1.657 785 H LEU 101 H LEU 101 6.627 -0.472 2.281 786 HA LEU 101 HA LEU 101 4.617 1.074 0.784 787 1HB LEU 101 1HB LEU 101 3.043 0.816 2.547 788 2HB LEU 101 2HB LEU 101 3.645 -0.777 2.144 789 HG LEU 101 HG LEU 101 4.872 0.700 4.438 790 1HD1 LEU 101 1HD1 LEU 101 2.280 -0.846 4.519 791 2HD1 LEU 101 2HD1 LEU 101 2.466 0.887 4.796 792 3HD1 LEU 101 3HD1 LEU 101 3.178 -0.268 5.923 793 1HD2 LEU 101 1HD2 LEU 101 5.221 -1.541 5.272 794 2HD2 LEU 101 2HD2 LEU 101 5.821 -1.430 3.616 795 3HD2 LEU 101 3HD2 LEU 101 4.274 -2.210 3.944 796 H VAL 102 H VAL 102 4.267 3.167 1.340 797 HA VAL 102 HA VAL 102 5.799 4.302 3.564 798 HB VAL 102 HB VAL 102 6.561 6.199 2.220 799 1HG1 VAL 102 1HG1 VAL 102 7.371 3.607 0.919 800 2HG1 VAL 102 2HG1 VAL 102 8.012 4.218 2.442 801 3HG1 VAL 102 3HG1 VAL 102 8.297 5.109 0.946 802 1HG2 VAL 102 1HG2 VAL 102 4.801 6.258 0.555 803 2HG2 VAL 102 2HG2 VAL 102 5.366 4.732 -0.124 804 3HG2 VAL 102 3HG2 VAL 102 6.378 6.171 -0.229 805 H GLU 103 H GLU 103 5.042 6.510 4.118 806 HA GLU 103 HA GLU 103 2.138 6.684 3.745 807 1HB GLU 103 1HB GLU 103 3.971 8.068 5.706 808 2HB GLU 103 2HB GLU 103 2.235 8.317 5.620 809 1HG GLU 103 1HG GLU 103 1.861 5.993 6.224 810 2HG GLU 103 2HG GLU 103 3.605 5.722 6.277 811 H VAL 104 H VAL 104 1.466 7.975 2.159 812 HA VAL 104 HA VAL 104 2.845 10.557 1.861 813 HB VAL 104 HB VAL 104 3.009 9.294 -0.213 814 1HG1 VAL 104 1HG1 VAL 104 0.001 9.241 -0.277 815 2HG1 VAL 104 2HG1 VAL 104 1.035 7.864 0.095 816 3HG1 VAL 104 3HG1 VAL 104 1.099 8.609 -1.503 817 1HG2 VAL 104 1HG2 VAL 104 2.013 10.923 -1.745 818 2HG2 VAL 104 2HG2 VAL 104 2.786 11.709 -0.370 819 3HG2 VAL 104 3HG2 VAL 104 1.029 11.558 -0.427 820 H ARG 105 H ARG 105 1.773 12.023 2.967 821 HA ARG 105 HA ARG 105 -1.115 11.703 3.304 822 1HB ARG 105 1HB ARG 105 0.774 12.114 5.169 823 2HB ARG 105 2HB ARG 105 0.384 13.787 4.794 824 1HG ARG 105 1HG ARG 105 -1.832 13.551 5.503 825 2HG ARG 105 2HG ARG 105 -1.748 11.788 5.456 826 1HD ARG 105 1HD ARG 105 -0.351 13.624 7.399 827 2HD ARG 105 2HD ARG 105 -1.685 12.524 7.751 828 HE ARG 105 HE ARG 105 1.074 11.719 7.099 829 1HH1 ARG 105 1HH1 ARG 105 -2.081 10.980 8.445 830 2HH1 ARG 105 2HH1 ARG 105 -1.564 9.465 9.117 831 1HH2 ARG 105 1HH2 ARG 105 1.747 9.744 7.989 832 2HH2 ARG 105 2HH2 ARG 105 0.607 8.738 8.827 833 H ASP 106 H ASP 106 0.543 12.918 1.013 834 HA ASP 106 HA ASP 106 -0.457 15.649 0.939 835 1HB ASP 106 1HB ASP 106 1.835 15.123 0.131 836 2HB ASP 106 2HB ASP 106 1.135 14.115 -1.133 837 H GLU 107 H GLU 107 -2.372 16.126 0.116 838 HA GLU 107 HA GLU 107 -4.082 14.128 -0.924 839 1HB GLU 107 1HB GLU 107 -4.836 16.107 0.366 840 2HB GLU 107 2HB GLU 107 -4.418 17.127 -1.002 841 1HG GLU 107 1HG GLU 107 -6.078 15.972 -2.375 842 2HG GLU 107 2HG GLU 107 -6.498 14.950 -1.000 843 H LYS 108 H LYS 108 -2.055 16.555 -2.422 844 HA LYS 108 HA LYS 108 -3.397 16.583 -4.917 845 1HB LYS 108 1HB LYS 108 -0.642 17.506 -4.108 846 2HB LYS 108 2HB LYS 108 -1.367 17.802 -5.679 847 1HG LYS 108 1HG LYS 108 -2.409 18.767 -3.031 848 2HG LYS 108 2HG LYS 108 -1.616 19.744 -4.269 849 1HD LYS 108 1HD LYS 108 -3.429 19.375 -5.804 850 2HD LYS 108 2HD LYS 108 -4.182 18.221 -4.703 851 1HE LYS 108 1HE LYS 108 -5.317 20.370 -4.611 852 2HE LYS 108 2HE LYS 108 -4.532 20.012 -3.073 853 1HZ LYS 108 1HZ LYS 108 -4.205 22.315 -3.781 854 2HZ LYS 108 2HZ LYS 108 -3.412 21.780 -5.184 855 3HZ LYS 108 3HZ LYS 108 -2.732 21.485 -3.663 856 H PHE 109 H PHE 109 -0.939 14.577 -3.523 857 HA PHE 109 HA PHE 109 0.027 13.365 -5.869 858 1HB PHE 109 1HB PHE 109 1.097 12.963 -3.724 859 2HB PHE 109 2HB PHE 109 -0.362 12.198 -3.102 860 HD1 PHE 109 HD1 PHE 109 2.228 11.852 -5.749 861 HD2 PHE 109 HD2 PHE 109 -0.641 9.900 -3.287 862 HE1 PHE 109 HE1 PHE 109 3.055 9.671 -6.527 863 HE2 PHE 109 HE2 PHE 109 0.182 7.712 -4.059 864 HZ PHE 109 HZ PHE 109 2.033 7.597 -5.680 865 H PHE 110 H PHE 110 -2.684 12.476 -3.753 866 HA PHE 110 HA PHE 110 -3.512 10.253 -5.324 867 1HB PHE 110 1HB PHE 110 -5.064 11.860 -3.282 868 2HB PHE 110 2HB PHE 110 -5.534 10.289 -3.917 869 HD1 PHE 110 HD1 PHE 110 -3.680 12.031 -1.419 870 HD2 PHE 110 HD2 PHE 110 -3.980 8.319 -3.482 871 HE1 PHE 110 HE1 PHE 110 -2.402 10.932 0.375 872 HE2 PHE 110 HE2 PHE 110 -2.707 7.215 -1.690 873 HZ PHE 110 HZ PHE 110 -1.915 8.522 0.241 874 H GLU 111 H GLU 111 -4.145 13.646 -5.408 875 HA GLU 111 HA GLU 111 -6.507 13.556 -6.971 876 1HB GLU 111 1HB GLU 111 -4.558 15.621 -6.090 877 2HB GLU 111 2HB GLU 111 -5.704 16.007 -7.351 878 1HG GLU 111 1HG GLU 111 -6.354 15.060 -4.578 879 2HG GLU 111 2HG GLU 111 -6.551 16.694 -5.199 880 H ALA 112 H ALA 112 -3.096 13.574 -7.679 881 HA ALA 112 HA ALA 112 -3.549 14.251 -10.474 882 1HB ALA 112 1HB ALA 112 -0.959 13.667 -9.049 883 2HB ALA 112 2HB ALA 112 -1.662 15.267 -9.285 884 3HB ALA 112 3HB ALA 112 -1.135 14.321 -10.678 885 H VAL 113 H VAL 113 -2.710 11.439 -8.532 886 HA VAL 113 HA VAL 113 -1.925 9.906 -10.862 887 HB VAL 113 HB VAL 113 -0.734 9.603 -8.713 888 1HG1 VAL 113 1HG1 VAL 113 -3.315 8.371 -7.754 889 2HG1 VAL 113 2HG1 VAL 113 -2.588 9.864 -7.163 890 3HG1 VAL 113 3HG1 VAL 113 -1.773 8.322 -6.897 891 1HG2 VAL 113 1HG2 VAL 113 -0.666 7.156 -8.754 892 2HG2 VAL 113 2HG2 VAL 113 -0.678 7.836 -10.381 893 3HG2 VAL 113 3HG2 VAL 113 -2.149 7.134 -9.708 894 H LYS 114 H LYS 114 -3.091 8.376 -11.891 895 HA LYS 114 HA LYS 114 -5.681 7.612 -10.726 896 1HB LYS 114 1HB LYS 114 -5.010 8.293 -13.573 897 2HB LYS 114 2HB LYS 114 -6.378 7.259 -13.186 898 1HG LYS 114 1HG LYS 114 -7.352 9.038 -11.836 899 2HG LYS 114 2HG LYS 114 -5.966 10.070 -12.194 900 1HD LYS 114 1HD LYS 114 -6.514 10.054 -14.539 901 2HD LYS 114 2HD LYS 114 -7.841 8.926 -14.256 902 1HE LYS 114 1HE LYS 114 -8.997 10.579 -12.913 903 2HE LYS 114 2HE LYS 114 -7.644 11.697 -13.086 904 1HZ LYS 114 1HZ LYS 114 -9.355 10.704 -15.304 905 2HZ LYS 114 2HZ LYS 114 -8.062 11.787 -15.459 906 3HZ LYS 114 3HZ LYS 114 -9.445 12.239 -14.592 907 H THR 115 H THR 115 -6.462 5.487 -11.676 908 HA THR 115 HA THR 115 -4.480 3.550 -11.135 909 HB THR 115 HB THR 115 -6.789 3.128 -10.538 910 HG1 THR 115 HG1 THR 115 -6.262 1.260 -12.584 911 1HG2 THR 115 1HG2 THR 115 -8.512 2.653 -12.215 912 2HG2 THR 115 2HG2 THR 115 -7.383 3.084 -13.499 913 3HG2 THR 115 3HG2 THR 115 -7.920 4.309 -12.349 914 H GLY 116 H GLY 116 -2.857 3.189 -12.466 915 1HA GLY 116 1HA GLY 116 -2.492 1.831 -14.578 916 2HA GLY 116 2HA GLY 116 -3.405 3.110 -15.367 917 H ASP 117 H ASP 117 -2.086 5.121 -13.519 918 HA ASP 117 HA ASP 117 0.030 5.850 -15.246 919 1HB ASP 117 1HB ASP 117 -0.765 6.818 -12.504 920 2HB ASP 117 2HB ASP 117 0.652 7.450 -13.333 921 H ARG 118 H ARG 118 2.303 5.974 -14.790 922 HA ARG 118 HA ARG 118 3.136 3.550 -13.371 923 1HB ARG 118 1HB ARG 118 3.716 4.184 -15.848 924 2HB ARG 118 2HB ARG 118 4.964 5.164 -15.107 925 1HG ARG 118 1HG ARG 118 4.628 2.194 -14.745 926 2HG ARG 118 2HG ARG 118 5.778 2.969 -15.831 927 1HD ARG 118 1HD ARG 118 5.721 3.141 -12.821 928 2HD ARG 118 2HD ARG 118 6.908 2.292 -13.810 929 HE ARG 118 HE ARG 118 6.601 5.226 -13.681 930 1HH1 ARG 118 1HH1 ARG 118 8.524 2.354 -14.256 931 2HH1 ARG 118 2HH1 ARG 118 10.013 3.234 -14.438 932 1HH2 ARG 118 1HH2 ARG 118 8.569 6.385 -13.900 933 2HH2 ARG 118 2HH2 ARG 118 10.044 5.528 -14.229 934 H VAL 119 H VAL 119 4.054 3.708 -11.495 935 HA VAL 119 HA VAL 119 5.157 6.323 -10.670 936 HB VAL 119 HB VAL 119 3.705 4.331 -8.912 937 1HG1 VAL 119 1HG1 VAL 119 4.702 7.116 -8.326 938 2HG1 VAL 119 2HG1 VAL 119 5.368 5.613 -7.685 939 3HG1 VAL 119 3HG1 VAL 119 3.740 6.120 -7.237 940 1HG2 VAL 119 1HG2 VAL 119 1.906 6.016 -8.826 941 2HG2 VAL 119 2HG2 VAL 119 2.142 5.365 -10.446 942 3HG2 VAL 119 3HG2 VAL 119 2.762 6.965 -10.040 943 H VAL 120 H VAL 120 7.128 6.315 -9.662 944 HA VAL 120 HA VAL 120 8.100 3.726 -8.693 945 HB VAL 120 HB VAL 120 9.376 4.489 -10.727 946 1HG1 VAL 120 1HG1 VAL 120 9.434 6.878 -10.287 947 2HG1 VAL 120 2HG1 VAL 120 11.062 6.219 -10.461 948 3HG1 VAL 120 3HG1 VAL 120 10.431 6.593 -8.858 949 1HG2 VAL 120 1HG2 VAL 120 10.887 4.143 -8.150 950 2HG2 VAL 120 2HG2 VAL 120 11.579 3.964 -9.761 951 3HG2 VAL 120 3HG2 VAL 120 10.309 2.867 -9.221 952 H VAL 121 H VAL 121 8.372 3.653 -6.644 953 HA VAL 121 HA VAL 121 8.520 6.178 -5.148 954 HB VAL 121 HB VAL 121 7.701 3.455 -4.127 955 1HG1 VAL 121 1HG1 VAL 121 6.830 4.703 -2.201 956 2HG1 VAL 121 2HG1 VAL 121 7.474 6.195 -2.887 957 3HG1 VAL 121 3HG1 VAL 121 8.572 4.909 -2.385 958 1HG2 VAL 121 1HG2 VAL 121 5.963 5.785 -4.931 959 2HG2 VAL 121 2HG2 VAL 121 5.406 4.293 -4.171 960 3HG2 VAL 121 3HG2 VAL 121 6.109 4.248 -5.786 961 H ASN 122 H ASN 122 10.307 6.657 -4.096 962 HA ASN 122 HA ASN 122 12.420 4.655 -3.839 963 1HB ASN 122 1HB ASN 122 12.896 6.940 -4.774 964 2HB ASN 122 2HB ASN 122 12.492 7.614 -3.202 965 1HD2 ASN 122 1HD2 ASN 122 14.968 7.690 -4.737 966 2HD2 ASN 122 2HD2 ASN 122 16.191 7.032 -3.704 967 H ALA 123 H ALA 123 11.930 3.388 -2.127 968 HA ALA 123 HA ALA 123 10.735 4.533 0.245 969 1HB ALA 123 1HB ALA 123 9.915 2.396 -0.593 970 2HB ALA 123 2HB ALA 123 10.575 2.222 1.032 971 3HB ALA 123 3HB ALA 123 11.511 1.682 -0.361 972 H ASP 124 H ASP 124 13.879 3.891 -0.859 973 HA ASP 124 HA ASP 124 15.117 3.374 1.647 974 1HB ASP 124 1HB ASP 124 16.227 2.903 -0.510 975 2HB ASP 124 2HB ASP 124 16.307 4.633 -0.836 976 H GLU 125 H GLU 125 14.526 6.289 -0.248 977 HA GLU 125 HA GLU 125 15.584 7.955 1.904 978 1HB GLU 125 1HB GLU 125 14.569 8.666 -0.852 979 2HB GLU 125 2HB GLU 125 15.227 9.818 0.303 980 1HG GLU 125 1HG GLU 125 17.373 8.656 0.241 981 2HG GLU 125 2HG GLU 125 16.710 7.501 -0.915 982 H GLY 126 H GLY 126 12.559 7.325 0.190 983 1HA GLY 126 1HA GLY 126 10.408 7.628 1.197 984 2HA GLY 126 2HA GLY 126 11.118 8.842 2.259 985 H TYR 127 H TYR 127 10.452 8.173 -1.151 986 HA TYR 127 HA TYR 127 9.612 10.869 -1.675 987 1HB TYR 127 1HB TYR 127 12.255 10.731 -1.629 988 2HB TYR 127 2HB TYR 127 12.041 10.010 -3.217 989 HD1 TYR 127 HD1 TYR 127 11.822 11.381 -5.098 990 HD2 TYR 127 HD2 TYR 127 11.188 13.037 -1.230 991 HE1 TYR 127 HE1 TYR 127 11.726 13.635 -6.081 992 HE2 TYR 127 HE2 TYR 127 11.085 15.293 -2.202 993 HH TYR 127 HH TYR 127 11.862 16.475 -4.173 994 H VAL 128 H VAL 128 8.834 11.040 -3.938 995 HA VAL 128 HA VAL 128 8.794 8.577 -5.467 996 HB VAL 128 HB VAL 128 6.954 8.167 -3.945 997 1HG1 VAL 128 1HG1 VAL 128 5.834 10.808 -4.870 998 2HG1 VAL 128 2HG1 VAL 128 6.456 10.443 -3.261 999 3HG1 VAL 128 3HG1 VAL 128 4.995 9.644 -3.845 1000 1HG2 VAL 128 1HG2 VAL 128 6.657 7.404 -6.224 1001 2HG2 VAL 128 2HG2 VAL 128 5.968 8.963 -6.679 1002 3HG2 VAL 128 3HG2 VAL 128 5.111 7.915 -5.548 1003 H GLU 129 H GLU 129 8.588 8.948 -7.623 1004 HA GLU 129 HA GLU 129 7.666 11.629 -8.423 1005 1HB GLU 129 1HB GLU 129 9.059 11.080 -10.576 1006 2HB GLU 129 2HB GLU 129 9.842 11.740 -9.151 1007 1HG GLU 129 1HG GLU 129 9.727 8.787 -9.447 1008 2HG GLU 129 2HG GLU 129 10.834 9.691 -10.478 1009 H LEU 130 H LEU 130 5.848 11.662 -9.454 1010 HA LEU 130 HA LEU 130 4.655 9.213 -10.434 1011 1HB LEU 130 1HB LEU 130 3.281 10.765 -9.182 1012 2HB LEU 130 2HB LEU 130 3.658 12.058 -10.305 1013 HG LEU 130 HG LEU 130 2.489 10.740 -12.092 1014 1HD1 LEU 130 1HD1 LEU 130 1.597 9.067 -9.755 1015 2HD1 LEU 130 2HD1 LEU 130 2.649 8.542 -11.069 1016 3HD1 LEU 130 3HD1 LEU 130 0.969 8.968 -11.399 1017 1HD2 LEU 130 1HD2 LEU 130 0.853 11.507 -9.676 1018 2HD2 LEU 130 2HD2 LEU 130 0.250 11.341 -11.324 1019 3HD2 LEU 130 3HD2 LEU 130 1.416 12.605 -10.936 1020 H ILE 131 H ILE 131 4.564 8.576 -12.515 1021 HA ILE 131 HA ILE 131 5.567 10.438 -14.547 1022 HB ILE 131 HB ILE 131 5.120 7.485 -14.842 1023 1HG1 ILE 131 1HG1 ILE 131 6.851 7.893 -13.150 1024 2HG1 ILE 131 2HG1 ILE 131 7.559 7.226 -14.618 1025 1HG2 ILE 131 1HG2 ILE 131 6.567 7.718 -16.819 1026 2HG2 ILE 131 2HG2 ILE 131 6.599 9.462 -16.555 1027 3HG2 ILE 131 3HG2 ILE 131 5.080 8.657 -16.943 1028 1HD1 ILE 131 1HD1 ILE 131 8.289 9.465 -15.271 1029 2HD1 ILE 131 2HD1 ILE 131 8.941 8.993 -13.701 1030 3HD1 ILE 131 3HD1 ILE 131 7.588 10.123 -13.793 1031 H GLU 132 H GLU 132 4.213 11.377 -15.781 1032 HA GLU 132 HA GLU 132 1.409 10.657 -15.749 1033 1HB GLU 132 1HB GLU 132 2.770 12.910 -17.236 1034 2HB GLU 132 2HB GLU 132 1.053 12.755 -16.888 1035 1HG GLU 132 1HG GLU 132 1.379 13.173 -14.595 1036 2HG GLU 132 2HG GLU 132 3.127 12.973 -14.734
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