NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
21357 | 2hh8 | 7274 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H ASP 7 H ASP 7 -4.759 15.382 -14.672 2 HA ASP 7 HA ASP 7 -7.446 14.203 -14.375 3 1HB ASP 7 1HB ASP 7 -6.317 13.120 -16.229 4 2HB ASP 7 2HB ASP 7 -4.887 12.841 -15.244 5 H GLN 8 H GLN 8 -7.918 13.281 -12.477 6 HA GLN 8 HA GLN 8 -6.364 13.988 -10.222 7 1HB GLN 8 1HB GLN 8 -8.856 13.759 -10.263 8 2HB GLN 8 2HB GLN 8 -8.650 12.016 -10.352 9 1HG GLN 8 1HG GLN 8 -7.678 11.939 -8.188 10 2HG GLN 8 2HG GLN 8 -7.567 13.697 -8.109 11 1HE2 GLN 8 1HE2 GLN 8 -9.678 10.951 -7.962 12 2HE2 GLN 8 2HE2 GLN 8 -11.030 11.765 -7.256 13 H VAL 9 H VAL 9 -6.559 11.137 -12.193 14 HA VAL 9 HA VAL 9 -5.355 9.268 -10.476 15 HB VAL 9 HB VAL 9 -5.258 9.481 -13.491 16 1HG1 VAL 9 1HG1 VAL 9 -4.597 7.134 -13.508 17 2HG1 VAL 9 2HG1 VAL 9 -4.506 7.141 -11.748 18 3HG1 VAL 9 3HG1 VAL 9 -3.389 8.126 -12.691 19 1HG2 VAL 9 1HG2 VAL 9 -6.970 7.826 -11.645 20 2HG2 VAL 9 2HG2 VAL 9 -6.974 7.727 -13.405 21 3HG2 VAL 9 3HG2 VAL 9 -7.497 9.208 -12.604 22 H VAL 10 H VAL 10 -4.009 11.744 -12.586 23 HA VAL 10 HA VAL 10 -1.316 10.943 -12.483 24 HB VAL 10 HB VAL 10 -2.401 13.747 -12.804 25 1HG1 VAL 10 1HG1 VAL 10 -0.291 14.208 -13.948 26 2HG1 VAL 10 2HG1 VAL 10 0.260 12.570 -13.594 27 3HG1 VAL 10 3HG1 VAL 10 -0.021 13.711 -12.279 28 1HG2 VAL 10 1HG2 VAL 10 -3.359 12.243 -14.449 29 2HG2 VAL 10 2HG2 VAL 10 -1.751 11.663 -14.880 30 3HG2 VAL 10 3HG2 VAL 10 -2.203 13.335 -15.211 31 H ILE 11 H ILE 11 -3.172 13.204 -10.472 32 HA ILE 11 HA ILE 11 -1.076 14.110 -8.859 33 HB ILE 11 HB ILE 11 -4.037 13.888 -8.344 34 1HG1 ILE 11 1HG1 ILE 11 -3.779 16.423 -8.306 35 2HG1 ILE 11 2HG1 ILE 11 -2.134 16.177 -8.880 36 1HG2 ILE 11 1HG2 ILE 11 -1.976 15.061 -6.478 37 2HG2 ILE 11 2HG2 ILE 11 -2.936 13.610 -6.189 38 3HG2 ILE 11 3HG2 ILE 11 -3.724 15.185 -6.287 39 1HD1 ILE 11 1HD1 ILE 11 -3.640 16.734 -10.699 40 2HD1 ILE 11 2HD1 ILE 11 -4.643 15.337 -10.312 41 3HD1 ILE 11 3HD1 ILE 11 -2.992 15.105 -10.889 42 H PHE 12 H PHE 12 -3.369 11.436 -8.281 43 HA PHE 12 HA PHE 12 -2.287 10.641 -5.815 44 1HB PHE 12 1HB PHE 12 -3.945 9.243 -7.882 45 2HB PHE 12 2HB PHE 12 -3.315 8.349 -6.505 46 HD1 PHE 12 HD1 PHE 12 -4.192 8.662 -4.315 47 HD2 PHE 12 HD2 PHE 12 -5.588 11.035 -7.559 48 HE1 PHE 12 HE1 PHE 12 -6.087 9.422 -2.940 49 HE2 PHE 12 HE2 PHE 12 -7.483 11.798 -6.194 50 HZ PHE 12 HZ PHE 12 -7.734 10.992 -3.880 51 H LYS 13 H LYS 13 -1.603 9.490 -9.111 52 HA LYS 13 HA LYS 13 0.147 7.423 -8.384 53 1HB LYS 13 1HB LYS 13 -0.860 7.734 -10.642 54 2HB LYS 13 2HB LYS 13 0.244 9.079 -10.914 55 1HG LYS 13 1HG LYS 13 2.128 7.450 -10.526 56 2HG LYS 13 2HG LYS 13 0.915 6.169 -10.577 57 1HD LYS 13 1HD LYS 13 1.881 6.362 -12.756 58 2HD LYS 13 2HD LYS 13 0.237 7.002 -12.831 59 1HE LYS 13 1HE LYS 13 1.664 8.486 -14.048 60 2HE LYS 13 2HE LYS 13 1.194 9.288 -12.552 61 1HZ LYS 13 1HZ LYS 13 3.494 9.662 -12.830 62 2HZ LYS 13 2HZ LYS 13 3.801 8.043 -13.204 63 3HZ LYS 13 3HZ LYS 13 3.377 8.473 -11.617 64 H GLN 14 H GLN 14 0.773 10.831 -9.144 65 HA GLN 14 HA GLN 14 3.569 10.724 -9.103 66 1HB GLN 14 1HB GLN 14 1.632 12.962 -8.558 67 2HB GLN 14 2HB GLN 14 3.374 13.206 -8.546 68 1HG GLN 14 1HG GLN 14 3.537 12.550 -10.851 69 2HG GLN 14 2HG GLN 14 1.827 12.122 -10.890 70 1HE2 GLN 14 1HE2 GLN 14 1.025 14.418 -9.305 71 2HE2 GLN 14 2HE2 GLN 14 1.143 15.798 -10.341 72 H ILE 15 H ILE 15 1.252 11.157 -6.475 73 HA ILE 15 HA ILE 15 3.069 11.785 -4.432 74 HB ILE 15 HB ILE 15 0.506 10.191 -4.205 75 1HG1 ILE 15 1HG1 ILE 15 1.002 13.153 -3.822 76 2HG1 ILE 15 2HG1 ILE 15 0.224 12.437 -5.229 77 1HG2 ILE 15 1HG2 ILE 15 0.516 10.935 -1.853 78 2HG2 ILE 15 2HG2 ILE 15 2.107 11.654 -2.108 79 3HG2 ILE 15 3HG2 ILE 15 1.898 9.909 -2.242 80 1HD1 ILE 15 1HD1 ILE 15 -1.423 13.361 -3.733 81 2HD1 ILE 15 2HD1 ILE 15 -0.801 12.386 -2.403 82 3HD1 ILE 15 3HD1 ILE 15 -1.575 11.604 -3.782 83 H PHE 16 H PHE 16 1.869 8.663 -5.602 84 HA PHE 16 HA PHE 16 3.397 7.112 -3.779 85 1HB PHE 16 1HB PHE 16 1.937 6.423 -6.321 86 2HB PHE 16 2HB PHE 16 2.855 5.224 -5.415 87 HD1 PHE 16 HD1 PHE 16 2.134 4.521 -3.198 88 HD2 PHE 16 HD2 PHE 16 -0.151 7.278 -5.494 89 HE1 PHE 16 HE1 PHE 16 0.200 4.140 -1.725 90 HE2 PHE 16 HE2 PHE 16 -2.087 6.907 -4.024 91 HZ PHE 16 HZ PHE 16 -1.912 5.334 -2.136 92 H ASP 17 H ASP 17 3.910 8.143 -7.131 93 HA ASP 17 HA ASP 17 6.226 6.719 -7.696 94 1HB ASP 17 1HB ASP 17 5.232 9.394 -8.621 95 2HB ASP 17 2HB ASP 17 6.839 8.853 -9.084 96 H LYS 18 H LYS 18 5.853 9.763 -5.954 97 HA LYS 18 HA LYS 18 8.675 10.165 -5.676 98 1HB LYS 18 1HB LYS 18 6.835 11.943 -5.676 99 2HB LYS 18 2HB LYS 18 6.524 11.463 -4.014 100 1HG LYS 18 1HG LYS 18 8.772 12.092 -3.377 101 2HG LYS 18 2HG LYS 18 9.159 12.484 -5.055 102 1HD LYS 18 1HD LYS 18 7.230 14.129 -4.959 103 2HD LYS 18 2HD LYS 18 7.227 13.874 -3.216 104 1HE LYS 18 1HE LYS 18 9.641 14.780 -4.774 105 2HE LYS 18 2HE LYS 18 8.508 15.883 -4.001 106 1HZ LYS 18 1HZ LYS 18 10.432 15.492 -2.609 107 2HZ LYS 18 2HZ LYS 18 10.144 13.825 -2.616 108 3HZ LYS 18 3HZ LYS 18 9.041 14.872 -1.866 109 H VAL 19 H VAL 19 6.075 9.096 -3.482 110 HA VAL 19 HA VAL 19 7.648 9.116 -1.156 111 HB VAL 19 HB VAL 19 5.139 9.103 -1.243 112 1HG1 VAL 19 1HG1 VAL 19 5.481 6.124 -1.534 113 2HG1 VAL 19 2HG1 VAL 19 4.895 7.210 -2.792 114 3HG1 VAL 19 3HG1 VAL 19 3.963 6.996 -1.310 115 1HG2 VAL 19 1HG2 VAL 19 4.888 7.862 0.854 116 2HG2 VAL 19 2HG2 VAL 19 6.348 8.851 0.851 117 3HG2 VAL 19 3HG2 VAL 19 6.463 7.110 0.594 118 H ARG 20 H ARG 20 7.347 6.658 -3.633 119 HA ARG 20 HA ARG 20 8.097 4.403 -2.163 120 1HB ARG 20 1HB ARG 20 8.646 5.090 -5.045 121 2HB ARG 20 2HB ARG 20 8.999 3.521 -4.335 122 1HG ARG 20 1HG ARG 20 6.630 3.221 -3.821 123 2HG ARG 20 2HG ARG 20 6.280 4.795 -4.541 124 1HD ARG 20 1HD ARG 20 7.345 2.335 -5.912 125 2HD ARG 20 2HD ARG 20 5.790 3.126 -6.176 126 HE ARG 20 HE ARG 20 8.332 4.485 -6.799 127 1HH1 ARG 20 1HH1 ARG 20 5.190 3.293 -7.796 128 2HH1 ARG 20 2HH1 ARG 20 5.196 4.171 -9.295 129 1HH2 ARG 20 1HH2 ARG 20 8.363 5.603 -8.757 130 2HH2 ARG 20 2HH2 ARG 20 6.995 5.527 -9.831 131 H ASN 21 H ASN 21 10.031 7.025 -3.403 132 HA ASN 21 HA ASN 21 12.455 5.672 -2.404 133 1HB ASN 21 1HB ASN 21 12.359 6.078 -4.887 134 2HB ASN 21 2HB ASN 21 12.338 7.804 -4.540 135 1HD2 ASN 21 1HD2 ASN 21 14.188 5.405 -2.758 136 2HD2 ASN 21 2HD2 ASN 21 15.747 5.986 -3.235 137 H ASP 22 H ASP 22 10.482 8.515 -2.338 138 HA ASP 22 HA ASP 22 12.452 10.229 -1.157 139 1HB ASP 22 1HB ASP 22 10.570 11.066 -2.546 140 2HB ASP 22 2HB ASP 22 9.450 10.565 -1.283 141 H LEU 23 H LEU 23 9.671 8.397 0.012 142 HA LEU 23 HA LEU 23 9.250 7.415 1.996 143 1HB LEU 23 1HB LEU 23 12.052 8.309 2.572 144 2HB LEU 23 2HB LEU 23 11.075 7.493 3.778 145 HG LEU 23 HG LEU 23 11.814 6.348 1.085 146 1HD1 LEU 23 1HD1 LEU 23 13.749 6.532 2.549 147 2HD1 LEU 23 2HD1 LEU 23 13.258 4.847 2.369 148 3HD1 LEU 23 3HD1 LEU 23 12.861 5.730 3.844 149 1HD2 LEU 23 1HD2 LEU 23 10.381 5.155 3.454 150 2HD2 LEU 23 2HD2 LEU 23 10.920 4.262 2.036 151 3HD2 LEU 23 3HD2 LEU 23 9.685 5.509 1.871 152 H ASN 24 H ASN 24 9.040 10.576 1.568 153 HA ASN 24 HA ASN 24 8.776 11.370 4.321 154 1HB ASN 24 1HB ASN 24 8.162 13.486 3.589 155 2HB ASN 24 2HB ASN 24 9.181 12.933 2.271 156 1HD2 ASN 24 1HD2 ASN 24 8.281 12.549 0.277 157 2HD2 ASN 24 2HD2 ASN 24 6.655 13.014 -0.118 158 H TYR 25 H TYR 25 7.104 11.024 5.619 159 HA TYR 25 HA TYR 25 4.814 9.651 4.423 160 1HB TYR 25 1HB TYR 25 5.953 9.593 7.205 161 2HB TYR 25 2HB TYR 25 4.392 8.885 6.802 162 HD1 TYR 25 HD1 TYR 25 4.432 7.227 4.753 163 HD2 TYR 25 HD2 TYR 25 7.836 8.243 7.090 164 HE1 TYR 25 HE1 TYR 25 5.538 5.157 4.029 165 HE2 TYR 25 HE2 TYR 25 8.953 6.175 6.369 166 HH TYR 25 HH TYR 25 7.813 4.270 3.807 167 H GLN 26 H GLN 26 5.601 12.606 6.012 168 HA GLN 26 HA GLN 26 3.110 13.009 7.313 169 1HB GLN 26 1HB GLN 26 5.130 14.285 7.910 170 2HB GLN 26 2HB GLN 26 5.068 15.099 6.352 171 1HG GLN 26 1HG GLN 26 2.901 16.060 6.943 172 2HG GLN 26 2HG GLN 26 2.965 15.245 8.503 173 1HE2 GLN 26 1HE2 GLN 26 5.827 15.700 8.800 174 2HE2 GLN 26 2HE2 GLN 26 6.008 17.376 9.196 175 H TRP 27 H TRP 27 4.373 14.263 4.223 176 HA TRP 27 HA TRP 27 1.923 15.513 3.502 177 1HB TRP 27 1HB TRP 27 4.127 16.178 2.571 178 2HB TRP 27 2HB TRP 27 4.217 14.637 1.730 179 HD1 TRP 27 HD1 TRP 27 1.836 17.714 1.805 180 HE1 TRP 27 HE1 TRP 27 0.991 18.112 -0.598 181 HE3 TRP 27 HE3 TRP 27 4.096 13.750 -0.509 182 HZ2 TRP 27 HZ2 TRP 27 1.260 16.897 -3.135 183 HZ3 TRP 27 HZ3 TRP 27 3.753 13.443 -2.924 184 HH2 TRP 27 HH2 TRP 27 2.366 14.982 -4.209 185 H PHE 28 H PHE 28 3.367 12.378 2.915 186 HA PHE 28 HA PHE 28 1.585 11.372 1.026 187 1HB PHE 28 1HB PHE 28 3.692 10.266 1.645 188 2HB PHE 28 2HB PHE 28 3.037 9.898 3.235 189 HD1 PHE 28 HD1 PHE 28 2.049 9.421 -0.343 190 HD2 PHE 28 HD2 PHE 28 2.343 7.751 3.560 191 HE1 PHE 28 HE1 PHE 28 1.186 7.283 -1.197 192 HE2 PHE 28 HE2 PHE 28 1.482 5.608 2.710 193 HZ PHE 28 HZ PHE 28 0.903 5.371 0.332 194 H TYR 29 H TYR 29 1.509 10.863 4.572 195 HA TYR 29 HA TYR 29 -1.042 9.618 4.503 196 1HB TYR 29 1HB TYR 29 0.706 10.662 6.698 197 2HB TYR 29 2HB TYR 29 -0.947 10.177 7.054 198 HD1 TYR 29 HD1 TYR 29 -1.581 7.860 7.067 199 HD2 TYR 29 HD2 TYR 29 2.355 8.993 5.931 200 HE1 TYR 29 HE1 TYR 29 -0.863 5.514 7.240 201 HE2 TYR 29 HE2 TYR 29 3.083 6.653 6.099 202 HH TYR 29 HH TYR 29 2.406 4.588 7.232 203 H SER 30 H SER 30 -0.025 12.952 4.882 204 HA SER 30 HA SER 30 -2.449 13.990 5.867 205 1HB SER 30 1HB SER 30 -0.299 15.257 5.799 206 2HB SER 30 2HB SER 30 -0.463 15.380 4.049 207 HG SER 30 HG SER 30 -2.736 16.231 5.007 208 H GLU 31 H GLU 31 -1.224 13.731 2.526 209 HA GLU 31 HA GLU 31 -3.646 14.647 1.364 210 1HB GLU 31 1HB GLU 31 -1.291 13.151 0.212 211 2HB GLU 31 2HB GLU 31 -2.670 13.651 -0.756 212 1HG GLU 31 1HG GLU 31 -0.827 15.467 0.778 213 2HG GLU 31 2HG GLU 31 -0.849 15.230 -0.969 214 H LEU 32 H LEU 32 -2.497 11.517 2.397 215 HA LEU 32 HA LEU 32 -4.353 9.901 1.070 216 1HB LEU 32 1HB LEU 32 -3.018 9.608 3.747 217 2HB LEU 32 2HB LEU 32 -4.148 8.412 3.144 218 HG LEU 32 HG LEU 32 -1.520 9.195 1.888 219 1HD1 LEU 32 1HD1 LEU 32 -1.301 7.779 3.852 220 2HD1 LEU 32 2HD1 LEU 32 -0.904 6.882 2.387 221 3HD1 LEU 32 3HD1 LEU 32 -2.463 6.636 3.173 222 1HD2 LEU 32 1HD2 LEU 32 -1.981 7.488 0.223 223 2HD2 LEU 32 2HD2 LEU 32 -3.231 8.732 0.185 224 3HD2 LEU 32 3HD2 LEU 32 -3.556 7.176 0.949 225 H LYS 33 H LYS 33 -4.602 11.265 4.368 226 HA LYS 33 HA LYS 33 -7.317 10.442 4.649 227 1HB LYS 33 1HB LYS 33 -5.752 10.859 6.554 228 2HB LYS 33 2HB LYS 33 -5.851 12.580 6.207 229 1HG LYS 33 1HG LYS 33 -8.284 12.490 6.624 230 2HG LYS 33 2HG LYS 33 -8.114 10.790 7.067 231 1HD LYS 33 1HD LYS 33 -8.157 12.133 9.070 232 2HD LYS 33 2HD LYS 33 -6.539 11.460 8.860 233 1HE LYS 33 1HE LYS 33 -5.754 13.569 7.952 234 2HE LYS 33 2HE LYS 33 -7.377 14.247 8.062 235 1HZ LYS 33 1HZ LYS 33 -5.701 13.359 10.346 236 2HZ LYS 33 2HZ LYS 33 -7.276 13.975 10.469 237 3HZ LYS 33 3HZ LYS 33 -6.019 14.966 9.909 238 H ARG 34 H ARG 34 -5.812 13.112 3.119 239 HA ARG 34 HA ARG 34 -8.151 14.815 3.347 240 1HB ARG 34 1HB ARG 34 -5.567 15.453 3.321 241 2HB ARG 34 2HB ARG 34 -5.861 15.535 1.588 242 1HG ARG 34 1HG ARG 34 -7.570 17.185 1.901 243 2HG ARG 34 2HG ARG 34 -7.463 17.016 3.653 244 1HD ARG 34 1HD ARG 34 -6.291 19.007 2.975 245 2HD ARG 34 2HD ARG 34 -5.131 17.814 3.555 246 HE ARG 34 HE ARG 34 -4.257 17.630 1.419 247 1HH1 ARG 34 1HH1 ARG 34 -7.205 19.535 1.364 248 2HH1 ARG 34 2HH1 ARG 34 -6.900 20.175 -0.228 249 1HH2 ARG 34 1HH2 ARG 34 -3.864 18.480 -0.656 250 2HH2 ARG 34 2HH2 ARG 34 -4.995 19.600 -1.356 251 H HIS 35 H HIS 35 -7.199 12.320 1.343 252 HA HIS 35 HA HIS 35 -9.114 13.253 -0.689 253 1HB HIS 35 1HB HIS 35 -6.572 11.716 -1.267 254 2HB HIS 35 2HB HIS 35 -7.808 12.121 -2.448 255 HD1 HIS 35 HD1 HIS 35 -8.264 15.060 -1.956 256 HD2 HIS 35 HD2 HIS 35 -4.494 13.323 -1.844 257 HE1 HIS 35 HE1 HIS 35 -6.646 16.936 -2.365 258 HE2 HIS 35 HE2 HIS 35 -4.369 15.900 -2.004 259 H ASN 36 H ASN 36 -7.342 10.350 0.360 260 HA ASN 36 HA ASN 36 -9.573 8.651 -0.361 261 1HB ASN 36 1HB ASN 36 -7.324 7.806 -0.764 262 2HB ASN 36 2HB ASN 36 -6.908 8.020 0.933 263 1HD2 ASN 36 1HD2 ASN 36 -6.451 5.906 1.345 264 2HD2 ASN 36 2HD2 ASN 36 -7.638 4.652 1.333 265 H VAL 37 H VAL 37 -11.190 9.308 1.020 266 HA VAL 37 HA VAL 37 -10.747 9.303 3.881 267 HB VAL 37 HB VAL 37 -13.387 9.630 2.451 268 1HG1 VAL 37 1HG1 VAL 37 -13.580 9.256 4.841 269 2HG1 VAL 37 2HG1 VAL 37 -14.006 10.921 4.446 270 3HG1 VAL 37 3HG1 VAL 37 -12.433 10.557 5.160 271 1HG2 VAL 37 1HG2 VAL 37 -11.371 11.768 3.136 272 2HG2 VAL 37 2HG2 VAL 37 -13.003 12.050 2.528 273 3HG2 VAL 37 3HG2 VAL 37 -11.813 11.232 1.516 274 H SER 38 H SER 38 -11.332 6.952 1.609 275 HA SER 38 HA SER 38 -12.727 5.268 3.573 276 1HB SER 38 1HB SER 38 -12.844 5.065 0.558 277 2HB SER 38 2HB SER 38 -13.615 3.949 1.685 278 HG SER 38 HG SER 38 -14.578 6.207 0.748 279 H HIS 39 H HIS 39 -11.207 4.129 0.581 280 HA HIS 39 HA HIS 39 -8.932 3.037 1.941 281 1HB HIS 39 1HB HIS 39 -9.528 0.656 1.672 282 2HB HIS 39 2HB HIS 39 -10.591 1.481 2.801 283 HD1 HIS 39 HD1 HIS 39 -13.036 1.196 2.413 284 HD2 HIS 39 HD2 HIS 39 -10.797 0.210 -0.950 285 HE1 HIS 39 HE1 HIS 39 -14.674 0.253 0.761 286 HE2 HIS 39 HE2 HIS 39 -13.324 -0.243 -1.307 287 H TYR 40 H TYR 40 -7.366 2.293 0.545 288 HA TYR 40 HA TYR 40 -8.153 2.125 -2.281 289 1HB TYR 40 1HB TYR 40 -5.957 2.889 -2.951 290 2HB TYR 40 2HB TYR 40 -6.671 4.064 -1.860 291 HD1 TYR 40 HD1 TYR 40 -4.020 1.567 -2.288 292 HD2 TYR 40 HD2 TYR 40 -5.692 4.486 0.319 293 HE1 TYR 40 HE1 TYR 40 -1.964 1.532 -0.942 294 HE2 TYR 40 HE2 TYR 40 -3.641 4.458 1.672 295 HH TYR 40 HH TYR 40 -0.764 3.035 0.630 296 H ILE 41 H ILE 41 -7.613 0.357 -3.395 297 HA ILE 41 HA ILE 41 -6.362 -1.824 -1.874 298 HB ILE 41 HB ILE 41 -7.934 -2.019 -4.450 299 1HG1 ILE 41 1HG1 ILE 41 -8.884 -2.606 -1.635 300 2HG1 ILE 41 2HG1 ILE 41 -9.271 -1.132 -2.518 301 1HG2 ILE 41 1HG2 ILE 41 -6.406 -3.876 -4.059 302 2HG2 ILE 41 2HG2 ILE 41 -8.080 -4.398 -3.880 303 3HG2 ILE 41 3HG2 ILE 41 -7.087 -4.115 -2.449 304 1HD1 ILE 41 1HD1 ILE 41 -10.425 -2.445 -4.210 305 2HD1 ILE 41 2HD1 ILE 41 -11.095 -2.732 -2.602 306 3HD1 ILE 41 3HD1 ILE 41 -10.026 -3.925 -3.340 307 H TYR 42 H TYR 42 -4.244 -1.794 -2.188 308 HA TYR 42 HA TYR 42 -3.129 -0.999 -4.764 309 1HB TYR 42 1HB TYR 42 -2.385 -0.235 -2.362 310 2HB TYR 42 2HB TYR 42 -1.531 -1.770 -2.340 311 HD1 TYR 42 HD1 TYR 42 -0.266 -2.097 -4.830 312 HD2 TYR 42 HD2 TYR 42 -1.010 1.535 -2.742 313 HE1 TYR 42 HE1 TYR 42 1.627 -1.047 -5.990 314 HE2 TYR 42 HE2 TYR 42 0.879 2.595 -3.899 315 HH TYR 42 HH TYR 42 2.545 1.009 -6.525 316 H TYR 43 H TYR 43 -2.735 -2.558 -6.237 317 HA TYR 43 HA TYR 43 -2.294 -5.298 -5.302 318 1HB TYR 43 1HB TYR 43 -3.000 -4.151 -7.994 319 2HB TYR 43 2HB TYR 43 -2.463 -5.816 -7.802 320 HD1 TYR 43 HD1 TYR 43 -5.252 -3.578 -7.630 321 HD2 TYR 43 HD2 TYR 43 -3.775 -7.315 -6.243 322 HE1 TYR 43 HE1 TYR 43 -7.548 -4.266 -7.038 323 HE2 TYR 43 HE2 TYR 43 -6.053 -8.019 -5.663 324 HH TYR 43 HH TYR 43 -8.823 -6.395 -6.695 325 H LEU 44 H LEU 44 -0.246 -5.685 -4.820 326 HA LEU 44 HA LEU 44 1.961 -4.342 -5.998 327 1HB LEU 44 1HB LEU 44 1.858 -6.880 -4.359 328 2HB LEU 44 2HB LEU 44 3.335 -6.058 -4.814 329 HG LEU 44 HG LEU 44 2.310 -4.021 -3.563 330 1HD1 LEU 44 1HD1 LEU 44 0.851 -4.648 -1.696 331 2HD1 LEU 44 2HD1 LEU 44 0.731 -6.283 -2.346 332 3HD1 LEU 44 3HD1 LEU 44 0.074 -4.923 -3.258 333 1HD2 LEU 44 1HD2 LEU 44 4.295 -5.238 -2.851 334 2HD2 LEU 44 2HD2 LEU 44 3.283 -6.460 -2.083 335 3HD2 LEU 44 3HD2 LEU 44 3.289 -4.808 -1.468 336 H ALA 45 H ALA 45 -0.000 -6.758 -7.166 337 HA ALA 45 HA ALA 45 1.946 -8.336 -8.549 338 1HB ALA 45 1HB ALA 45 -1.030 -8.165 -9.004 339 2HB ALA 45 2HB ALA 45 -0.234 -9.246 -7.859 340 3HB ALA 45 3HB ALA 45 0.051 -9.429 -9.590 341 H THR 46 H THR 46 0.137 -5.445 -9.245 342 HA THR 46 HA THR 46 1.277 -5.427 -11.964 343 HB THR 46 HB THR 46 -1.286 -4.027 -11.676 344 HG1 THR 46 HG1 THR 46 -1.279 -6.888 -11.649 345 1HG2 THR 46 1HG2 THR 46 -0.213 -6.051 -13.644 346 2HG2 THR 46 2HG2 THR 46 -0.206 -4.296 -13.831 347 3HG2 THR 46 3HG2 THR 46 -1.734 -5.177 -13.818 348 H GLU 47 H GLU 47 1.286 -3.946 -9.050 349 HA GLU 47 HA GLU 47 1.705 -1.882 -8.212 350 1HB GLU 47 1HB GLU 47 3.581 -2.042 -9.913 351 2HB GLU 47 2HB GLU 47 2.566 -1.121 -11.011 352 1HG GLU 47 1HG GLU 47 4.085 0.398 -10.023 353 2HG GLU 47 2HG GLU 47 2.509 0.700 -9.298 354 H ASN 48 H ASN 48 -0.866 -2.587 -9.528 355 HA ASN 48 HA ASN 48 -1.824 0.060 -10.334 356 1HB ASN 48 1HB ASN 48 -3.490 -0.940 -11.563 357 2HB ASN 48 2HB ASN 48 -2.288 -2.217 -11.628 358 1HD2 ASN 48 1HD2 ASN 48 -2.677 -4.149 -10.586 359 2HD2 ASN 48 2HD2 ASN 48 -4.209 -4.539 -9.892 360 H VAL 49 H VAL 49 -3.415 1.119 -9.202 361 HA VAL 49 HA VAL 49 -4.030 -0.047 -6.564 362 HB VAL 49 HB VAL 49 -3.596 2.899 -6.979 363 1HG1 VAL 49 1HG1 VAL 49 -3.231 2.893 -4.566 364 2HG1 VAL 49 2HG1 VAL 49 -3.467 1.146 -4.530 365 3HG1 VAL 49 3HG1 VAL 49 -4.803 2.207 -4.978 366 1HG2 VAL 49 1HG2 VAL 49 -1.534 1.793 -7.669 367 2HG2 VAL 49 2HG2 VAL 49 -1.502 0.887 -6.154 368 3HG2 VAL 49 3HG2 VAL 49 -1.314 2.642 -6.140 369 H HIS 50 H HIS 50 -6.109 -0.094 -6.060 370 HA HIS 50 HA HIS 50 -8.009 1.511 -7.630 371 1HB HIS 50 1HB HIS 50 -8.378 -0.877 -5.809 372 2HB HIS 50 2HB HIS 50 -9.726 0.050 -6.449 373 HD1 HIS 50 HD1 HIS 50 -10.781 -1.471 -8.080 374 HD2 HIS 50 HD2 HIS 50 -6.640 -1.404 -8.478 375 HE1 HIS 50 HE1 HIS 50 -10.267 -2.894 -10.088 376 HE2 HIS 50 HE2 HIS 50 -7.753 -3.021 -10.166 377 H ILE 51 H ILE 51 -7.747 3.542 -6.597 378 HA ILE 51 HA ILE 51 -8.046 3.664 -3.707 379 HB ILE 51 HB ILE 51 -7.825 5.957 -5.670 380 1HG1 ILE 51 1HG1 ILE 51 -5.511 6.116 -4.425 381 2HG1 ILE 51 2HG1 ILE 51 -5.774 4.399 -4.140 382 1HG2 ILE 51 1HG2 ILE 51 -8.933 6.620 -3.620 383 2HG2 ILE 51 2HG2 ILE 51 -7.312 7.313 -3.687 384 3HG2 ILE 51 3HG2 ILE 51 -7.631 5.914 -2.663 385 1HD1 ILE 51 1HD1 ILE 51 -4.401 4.794 -6.105 386 2HD1 ILE 51 2HD1 ILE 51 -5.697 5.744 -6.830 387 3HD1 ILE 51 3HD1 ILE 51 -5.924 4.019 -6.537 388 H VAL 52 H VAL 52 -10.083 3.109 -3.167 389 HA VAL 52 HA VAL 52 -12.334 4.378 -4.494 390 HB VAL 52 HB VAL 52 -12.367 2.544 -2.088 391 1HG1 VAL 52 1HG1 VAL 52 -14.718 2.191 -2.718 392 2HG1 VAL 52 2HG1 VAL 52 -14.540 3.379 -4.009 393 3HG1 VAL 52 3HG1 VAL 52 -14.387 3.878 -2.324 394 1HG2 VAL 52 1HG2 VAL 52 -12.682 1.888 -5.017 395 2HG2 VAL 52 2HG2 VAL 52 -12.986 0.770 -3.688 396 3HG2 VAL 52 3HG2 VAL 52 -11.357 1.389 -3.966 397 H LEU 53 H LEU 53 -12.651 6.422 -3.980 398 HA LEU 53 HA LEU 53 -11.692 7.604 -1.581 399 1HB LEU 53 1HB LEU 53 -13.611 8.710 -3.630 400 2HB LEU 53 2HB LEU 53 -12.780 9.642 -2.399 401 HG LEU 53 HG LEU 53 -11.450 8.175 -4.682 402 1HD1 LEU 53 1HD1 LEU 53 -12.705 10.134 -5.418 403 2HD1 LEU 53 2HD1 LEU 53 -10.965 10.401 -5.547 404 3HD1 LEU 53 3HD1 LEU 53 -11.873 11.123 -4.218 405 1HD2 LEU 53 1HD2 LEU 53 -10.313 9.957 -2.531 406 2HD2 LEU 53 2HD2 LEU 53 -9.427 9.373 -3.940 407 3HD2 LEU 53 3HD2 LEU 53 -10.016 8.229 -2.735 408 H LYS 54 H LYS 54 -13.487 9.317 -0.657 409 HA LYS 54 HA LYS 54 -14.906 8.007 1.278 410 1HB LYS 54 1HB LYS 54 -14.581 10.262 1.652 411 2HB LYS 54 2HB LYS 54 -15.089 10.714 0.035 412 1HG LYS 54 1HG LYS 54 -17.403 10.333 0.623 413 2HG LYS 54 2HG LYS 54 -16.921 9.788 2.232 414 1HD LYS 54 1HD LYS 54 -17.729 12.195 2.017 415 2HD LYS 54 2HD LYS 54 -16.207 11.932 2.866 416 1HE LYS 54 1HE LYS 54 -16.113 13.852 1.326 417 2HE LYS 54 2HE LYS 54 -14.951 12.595 0.910 418 1HZ LYS 54 1HZ LYS 54 -17.551 12.471 -0.415 419 2HZ LYS 54 2HZ LYS 54 -16.001 12.148 -1.033 420 3HZ LYS 54 3HZ LYS 54 -16.532 13.749 -0.861 421 H ASN 55 H ASN 55 -16.498 9.588 -1.487 422 HA ASN 55 HA ASN 55 -18.046 7.232 -2.086 423 1HB ASN 55 1HB ASN 55 -19.311 8.320 -0.176 424 2HB ASN 55 2HB ASN 55 -19.536 9.727 -1.211 425 1HD2 ASN 55 1HD2 ASN 55 -19.603 6.368 -2.252 426 2HD2 ASN 55 2HD2 ASN 55 -21.274 6.364 -2.722 427 H ASP 56 H ASP 56 -16.114 9.133 -3.159 428 HA ASP 56 HA ASP 56 -17.551 10.872 -4.969 429 1HB ASP 56 1HB ASP 56 -14.565 10.472 -4.646 430 2HB ASP 56 2HB ASP 56 -15.369 11.815 -5.455 431 H ASN 57 H ASN 57 -14.695 8.844 -5.552 432 HA ASN 57 HA ASN 57 -15.998 7.221 -7.507 433 1HB ASN 57 1HB ASN 57 -14.806 7.959 -9.480 434 2HB ASN 57 2HB ASN 57 -15.654 9.340 -8.798 435 1HD2 ASN 57 1HD2 ASN 57 -12.585 7.931 -9.520 436 2HD2 ASN 57 2HD2 ASN 57 -11.628 9.315 -9.123 437 H THR 58 H THR 58 -14.169 5.942 -8.752 438 HA THR 58 HA THR 58 -12.147 5.238 -6.731 439 HB THR 58 HB THR 58 -13.024 3.627 -9.141 440 HG1 THR 58 HG1 THR 58 -14.455 4.067 -7.075 441 1HG2 THR 58 1HG2 THR 58 -10.751 3.118 -8.311 442 2HG2 THR 58 2HG2 THR 58 -11.869 1.778 -8.063 443 3HG2 THR 58 3HG2 THR 58 -11.423 2.814 -6.707 444 H VAL 59 H VAL 59 -10.122 5.812 -7.078 445 HA VAL 59 HA VAL 59 -9.324 6.724 -9.745 446 HB VAL 59 HB VAL 59 -7.726 6.881 -7.183 447 1HG1 VAL 59 1HG1 VAL 59 -6.387 7.099 -9.190 448 2HG1 VAL 59 2HG1 VAL 59 -6.499 8.650 -8.359 449 3HG1 VAL 59 3HG1 VAL 59 -7.471 8.351 -9.800 450 1HG2 VAL 59 1HG2 VAL 59 -9.524 8.977 -8.393 451 2HG2 VAL 59 2HG2 VAL 59 -8.470 9.198 -6.994 452 3HG2 VAL 59 3HG2 VAL 59 -9.832 8.080 -6.904 453 H LEU 60 H LEU 60 -8.059 5.497 -11.018 454 HA LEU 60 HA LEU 60 -6.892 3.069 -9.829 455 1HB LEU 60 1HB LEU 60 -8.691 2.587 -11.396 456 2HB LEU 60 2HB LEU 60 -7.907 3.551 -12.631 457 HG LEU 60 HG LEU 60 -6.044 1.943 -12.702 458 1HD1 LEU 60 1HD1 LEU 60 -7.702 0.366 -10.739 459 2HD1 LEU 60 2HD1 LEU 60 -6.153 1.142 -10.404 460 3HD1 LEU 60 3HD1 LEU 60 -6.241 -0.199 -11.548 461 1HD2 LEU 60 1HD2 LEU 60 -7.978 1.704 -14.200 462 2HD2 LEU 60 2HD2 LEU 60 -8.744 0.641 -13.017 463 3HD2 LEU 60 3HD2 LEU 60 -7.243 0.151 -13.804 464 H LEU 61 H LEU 61 -4.764 3.227 -9.624 465 HA LEU 61 HA LEU 61 -3.261 4.937 -11.472 466 1HB LEU 61 1HB LEU 61 -2.171 3.515 -9.050 467 2HB LEU 61 2HB LEU 61 -1.459 4.862 -9.916 468 HG LEU 61 HG LEU 61 -3.945 4.978 -8.209 469 1HD1 LEU 61 1HD1 LEU 61 -1.855 4.734 -6.944 470 2HD1 LEU 61 2HD1 LEU 61 -2.596 6.316 -6.710 471 3HD1 LEU 61 3HD1 LEU 61 -1.201 6.146 -7.776 472 1HD2 LEU 61 1HD2 LEU 61 -4.095 6.521 -10.076 473 2HD2 LEU 61 2HD2 LEU 61 -2.489 7.148 -9.709 474 3HD2 LEU 61 3HD2 LEU 61 -3.813 7.397 -8.572 475 H LYS 62 H LYS 62 -1.565 4.172 -12.712 476 HA LYS 62 HA LYS 62 -1.066 1.278 -12.670 477 1HB LYS 62 1HB LYS 62 -1.320 2.990 -15.155 478 2HB LYS 62 2HB LYS 62 -0.875 1.292 -15.122 479 1HG LYS 62 1HG LYS 62 -3.081 0.748 -14.193 480 2HG LYS 62 2HG LYS 62 -3.523 2.455 -14.293 481 1HD LYS 62 1HD LYS 62 -3.089 2.370 -16.736 482 2HD LYS 62 2HD LYS 62 -2.794 0.638 -16.589 483 1HE LYS 62 1HE LYS 62 -5.076 0.338 -15.737 484 2HE LYS 62 2HE LYS 62 -5.368 2.066 -15.930 485 1HZ LYS 62 1HZ LYS 62 -6.246 0.841 -17.804 486 2HZ LYS 62 2HZ LYS 62 -4.732 0.145 -18.105 487 3HZ LYS 62 3HZ LYS 62 -4.950 1.815 -18.313 488 H GLY 63 H GLY 63 0.987 1.014 -12.078 489 1HA GLY 63 1HA GLY 63 3.032 2.671 -13.401 490 2HA GLY 63 2HA GLY 63 3.076 2.466 -11.655 491 H LEU 64 H LEU 64 5.281 1.718 -12.781 492 HA LEU 64 HA LEU 64 6.711 0.012 -13.361 493 1HB LEU 64 1HB LEU 64 5.218 -0.893 -10.930 494 2HB LEU 64 2HB LEU 64 6.441 -1.928 -11.636 495 HG LEU 64 HG LEU 64 7.391 -0.680 -9.800 496 1HD1 LEU 64 1HD1 LEU 64 8.850 -1.142 -11.687 497 2HD1 LEU 64 2HD1 LEU 64 9.268 0.393 -10.928 498 3HD1 LEU 64 3HD1 LEU 64 8.372 0.377 -12.445 499 1HD2 LEU 64 1HD2 LEU 64 7.542 1.751 -9.816 500 2HD2 LEU 64 2HD2 LEU 64 5.861 1.218 -9.802 501 3HD2 LEU 64 3HD2 LEU 64 6.586 1.808 -11.298 502 H LYS 65 H LYS 65 5.253 -0.231 -15.385 503 HA LYS 65 HA LYS 65 3.497 -2.453 -15.498 504 1HB LYS 65 1HB LYS 65 3.347 -0.493 -17.005 505 2HB LYS 65 2HB LYS 65 4.841 -0.996 -17.780 506 1HG LYS 65 1HG LYS 65 3.843 -2.876 -18.749 507 2HG LYS 65 2HG LYS 65 2.451 -2.802 -17.670 508 1HD LYS 65 1HD LYS 65 1.860 -2.035 -19.908 509 2HD LYS 65 2HD LYS 65 1.728 -0.724 -18.736 510 1HE LYS 65 1HE LYS 65 2.765 0.161 -20.688 511 2HE LYS 65 2HE LYS 65 4.004 0.024 -19.444 512 1HZ LYS 65 1HZ LYS 65 3.569 -1.961 -21.609 513 2HZ LYS 65 2HZ LYS 65 4.829 -1.966 -20.470 514 3HZ LYS 65 3HZ LYS 65 4.745 -0.743 -21.640 515 H ASN 66 H ASN 66 4.520 -4.231 -14.764 516 HA ASN 66 HA ASN 66 6.203 -5.601 -16.711 517 1HB ASN 66 1HB ASN 66 7.838 -4.681 -15.149 518 2HB ASN 66 2HB ASN 66 6.927 -5.307 -13.780 519 1HD2 ASN 66 1HD2 ASN 66 7.140 -7.445 -13.209 520 2HD2 ASN 66 2HD2 ASN 66 8.285 -8.511 -13.943 521 H ILE 67 H ILE 67 4.524 -5.737 -13.625 522 HA ILE 67 HA ILE 67 2.875 -7.069 -12.835 523 HB ILE 67 HB ILE 67 2.868 -8.513 -15.489 524 1HG1 ILE 67 1HG1 ILE 67 1.186 -6.147 -14.617 525 2HG1 ILE 67 2HG1 ILE 67 2.534 -6.057 -15.746 526 1HG2 ILE 67 1HG2 ILE 67 1.735 -9.678 -13.652 527 2HG2 ILE 67 2HG2 ILE 67 0.583 -9.118 -14.866 528 3HG2 ILE 67 3HG2 ILE 67 0.759 -8.242 -13.345 529 1HD1 ILE 67 1HD1 ILE 67 0.006 -7.633 -16.164 530 2HD1 ILE 67 2HD1 ILE 67 1.347 -7.494 -17.302 531 3HD1 ILE 67 3HD1 ILE 67 0.387 -6.073 -16.893 532 H VAL 68 H VAL 68 2.668 -8.990 -11.757 533 HA VAL 68 HA VAL 68 3.298 -10.895 -10.722 534 HB VAL 68 HB VAL 68 4.990 -11.503 -13.156 535 1HG1 VAL 68 1HG1 VAL 68 5.581 -12.892 -11.263 536 2HG1 VAL 68 2HG1 VAL 68 4.685 -13.855 -12.439 537 3HG1 VAL 68 3HG1 VAL 68 3.884 -13.279 -10.978 538 1HG2 VAL 68 1HG2 VAL 68 2.116 -12.205 -12.564 539 2HG2 VAL 68 2HG2 VAL 68 3.062 -12.847 -13.906 540 3HG2 VAL 68 3HG2 VAL 68 2.696 -11.123 -13.831 541 H SER 69 H SER 69 4.362 -9.141 -9.451 542 HA SER 69 HA SER 69 7.243 -9.717 -9.244 543 1HB SER 69 1HB SER 69 5.753 -7.324 -8.123 544 2HB SER 69 2HB SER 69 7.500 -7.558 -8.164 545 HG SER 69 HG SER 69 6.409 -6.197 -9.869 546 H VAL 70 H VAL 70 4.590 -10.920 -8.214 547 HA VAL 70 HA VAL 70 5.157 -10.864 -5.323 548 HB VAL 70 HB VAL 70 2.497 -11.557 -6.565 549 1HG1 VAL 70 1HG1 VAL 70 2.833 -12.275 -4.269 550 2HG1 VAL 70 2HG1 VAL 70 1.615 -11.003 -4.358 551 3HG1 VAL 70 3HG1 VAL 70 3.245 -10.626 -3.801 552 1HG2 VAL 70 1HG2 VAL 70 1.750 -9.270 -6.083 553 2HG2 VAL 70 2HG2 VAL 70 3.016 -9.313 -7.312 554 3HG2 VAL 70 3HG2 VAL 70 3.405 -8.830 -5.655 555 H LYS 71 H LYS 71 5.111 -12.847 -4.215 556 HA LYS 71 HA LYS 71 4.929 -15.240 -5.927 557 1HB LYS 71 1HB LYS 71 6.605 -14.962 -3.424 558 2HB LYS 71 2HB LYS 71 6.551 -16.346 -4.505 559 1HG LYS 71 1HG LYS 71 7.395 -14.735 -6.306 560 2HG LYS 71 2HG LYS 71 7.772 -13.653 -4.963 561 1HD LYS 71 1HD LYS 71 9.734 -14.932 -5.522 562 2HD LYS 71 2HD LYS 71 9.131 -15.457 -3.949 563 1HE LYS 71 1HE LYS 71 8.036 -17.371 -5.012 564 2HE LYS 71 2HE LYS 71 8.635 -16.845 -6.584 565 1HZ LYS 71 1HZ LYS 71 10.026 -18.582 -5.685 566 2HZ LYS 71 2HZ LYS 71 10.295 -17.695 -4.267 567 3HZ LYS 71 3HZ LYS 71 10.905 -17.132 -5.747 568 H PHE 72 H PHE 72 3.675 -16.913 -5.210 569 HA PHE 72 HA PHE 72 1.809 -16.284 -3.111 570 1HB PHE 72 1HB PHE 72 1.234 -17.531 -5.248 571 2HB PHE 72 2HB PHE 72 2.066 -18.923 -4.562 572 HD1 PHE 72 HD1 PHE 72 0.964 -20.363 -3.082 573 HD2 PHE 72 HD2 PHE 72 -0.737 -16.572 -3.993 574 HE1 PHE 72 HE1 PHE 72 -1.102 -21.014 -1.914 575 HE2 PHE 72 HE2 PHE 72 -2.805 -17.212 -2.827 576 HZ PHE 72 HZ PHE 72 -2.988 -19.436 -1.785 577 H SER 73 H SER 73 3.472 -16.084 -1.473 578 HA SER 73 HA SER 73 3.796 -18.634 -0.076 579 1HB SER 73 1HB SER 73 5.992 -16.572 -0.456 580 2HB SER 73 2HB SER 73 6.098 -17.974 0.613 581 HG SER 73 HG SER 73 5.323 -18.685 -1.887 582 H LYS 74 H LYS 74 1.994 -17.903 1.082 583 HA LYS 74 HA LYS 74 1.948 -15.312 2.272 584 1HB LYS 74 1HB LYS 74 -0.223 -16.070 3.206 585 2HB LYS 74 2HB LYS 74 -0.095 -16.255 1.465 586 1HG LYS 74 1HG LYS 74 0.490 -18.672 1.881 587 2HG LYS 74 2HG LYS 74 0.026 -18.403 3.561 588 1HD LYS 74 1HD LYS 74 -1.747 -18.006 1.147 589 2HD LYS 74 2HD LYS 74 -1.822 -19.363 2.272 590 1HE LYS 74 1HE LYS 74 -2.219 -16.484 3.074 591 2HE LYS 74 2HE LYS 74 -3.536 -17.574 2.646 592 1HZ LYS 74 1HZ LYS 74 -3.035 -18.952 4.494 593 2HZ LYS 74 2HZ LYS 74 -3.105 -17.362 5.069 594 3HZ LYS 74 3HZ LYS 74 -1.602 -18.114 4.839 595 H ASP 75 H ASP 75 3.284 -14.887 3.881 596 HA ASP 75 HA ASP 75 3.165 -16.600 6.272 597 1HB ASP 75 1HB ASP 75 5.317 -17.009 5.106 598 2HB ASP 75 2HB ASP 75 5.677 -15.289 5.195 599 H ARG 76 H ARG 76 2.940 -15.514 8.162 600 HA ARG 76 HA ARG 76 2.218 -12.722 7.915 601 1HB ARG 76 1HB ARG 76 2.166 -14.400 10.425 602 2HB ARG 76 2HB ARG 76 1.269 -12.921 10.101 603 1HG ARG 76 1HG ARG 76 -0.056 -14.077 8.424 604 2HG ARG 76 2HG ARG 76 0.864 -15.557 8.704 605 1HD ARG 76 1HD ARG 76 -1.059 -15.861 9.972 606 2HD ARG 76 2HD ARG 76 0.124 -15.306 11.152 607 HE ARG 76 HE ARG 76 -1.785 -13.437 9.913 608 1HH1 ARG 76 1HH1 ARG 76 -0.265 -14.807 12.756 609 2HH1 ARG 76 2HH1 ARG 76 -1.249 -13.904 13.865 610 1HH2 ARG 76 1HH2 ARG 76 -3.079 -12.259 11.351 611 2HH2 ARG 76 2HH2 ARG 76 -2.851 -12.433 13.063 612 H HIS 77 H HIS 77 4.866 -14.593 9.170 613 HA HIS 77 HA HIS 77 5.751 -12.606 11.044 614 1HB HIS 77 1HB HIS 77 6.213 -15.084 11.244 615 2HB HIS 77 2HB HIS 77 7.367 -14.905 9.928 616 HD1 HIS 77 HD1 HIS 77 9.466 -13.281 10.467 617 HD2 HIS 77 HD2 HIS 77 7.177 -14.471 13.728 618 HE1 HIS 77 HE1 HIS 77 10.906 -12.878 12.487 619 HE2 HIS 77 HE2 HIS 77 9.470 -13.509 14.455 620 H LEU 78 H LEU 78 6.594 -13.576 7.755 621 HA LEU 78 HA LEU 78 8.807 -11.905 7.397 622 1HB LEU 78 1HB LEU 78 8.119 -13.654 5.806 623 2HB LEU 78 2HB LEU 78 6.721 -12.696 5.362 624 HG LEU 78 HG LEU 78 8.173 -10.967 4.432 625 1HD1 LEU 78 1HD1 LEU 78 10.431 -12.818 5.195 626 2HD1 LEU 78 2HD1 LEU 78 10.094 -11.240 5.907 627 3HD1 LEU 78 3HD1 LEU 78 10.582 -11.358 4.216 628 1HD2 LEU 78 1HD2 LEU 78 9.036 -12.235 2.530 629 2HD2 LEU 78 2HD2 LEU 78 7.417 -12.768 2.984 630 3HD2 LEU 78 3HD2 LEU 78 8.823 -13.734 3.433 631 H ILE 79 H ILE 79 5.385 -11.216 7.375 632 HA ILE 79 HA ILE 79 5.539 -8.631 6.216 633 HB ILE 79 HB ILE 79 3.442 -9.783 8.069 634 1HG1 ILE 79 1HG1 ILE 79 3.525 -9.593 5.048 635 2HG1 ILE 79 2HG1 ILE 79 3.741 -11.067 5.984 636 1HG2 ILE 79 1HG2 ILE 79 3.344 -7.354 8.038 637 2HG2 ILE 79 2HG2 ILE 79 1.971 -8.032 7.161 638 3HG2 ILE 79 3HG2 ILE 79 3.338 -7.359 6.274 639 1HD1 ILE 79 1HD1 ILE 79 1.503 -10.901 5.031 640 2HD1 ILE 79 2HD1 ILE 79 1.243 -9.394 5.909 641 3HD1 ILE 79 3HD1 ILE 79 1.460 -10.902 6.795 642 H GLU 80 H GLU 80 5.277 -9.736 9.604 643 HA GLU 80 HA GLU 80 5.389 -7.121 10.671 644 1HB GLU 80 1HB GLU 80 5.794 -8.327 12.849 645 2HB GLU 80 2HB GLU 80 4.327 -8.758 11.993 646 1HG GLU 80 1HG GLU 80 4.961 -10.850 12.405 647 2HG GLU 80 2HG GLU 80 6.048 -10.613 11.040 648 H THR 81 H THR 81 7.871 -9.486 9.917 649 HA THR 81 HA THR 81 9.990 -8.179 11.268 650 HB THR 81 HB THR 81 10.136 -9.915 8.790 651 HG1 THR 81 HG1 THR 81 9.360 -10.530 11.261 652 1HG2 THR 81 1HG2 THR 81 12.427 -10.392 9.550 653 2HG2 THR 81 2HG2 THR 81 12.228 -9.231 10.862 654 3HG2 THR 81 3HG2 THR 81 12.202 -8.681 9.186 655 H THR 82 H THR 82 8.534 -7.781 8.090 656 HA THR 82 HA THR 82 10.576 -6.034 7.112 657 HB THR 82 HB THR 82 7.759 -6.395 6.066 658 HG1 THR 82 HG1 THR 82 8.712 -8.376 5.907 659 1HG2 THR 82 1HG2 THR 82 8.839 -4.394 5.190 660 2HG2 THR 82 2HG2 THR 82 8.744 -5.627 3.935 661 3HG2 THR 82 3HG2 THR 82 10.271 -5.328 4.764 662 H SER 83 H SER 83 7.398 -5.570 8.632 663 HA SER 83 HA SER 83 7.418 -2.737 8.365 664 1HB SER 83 1HB SER 83 5.666 -2.870 10.223 665 2HB SER 83 2HB SER 83 5.294 -3.716 8.722 666 HG SER 83 HG SER 83 4.902 -5.241 10.163 667 H ASN 84 H ASN 84 8.620 -4.984 10.783 668 HA ASN 84 HA ASN 84 9.347 -3.076 12.725 669 1HB ASN 84 1HB ASN 84 10.225 -5.862 12.090 670 2HB ASN 84 2HB ASN 84 11.154 -4.914 13.246 671 1HD2 ASN 84 1HD2 ASN 84 9.554 -7.325 13.667 672 2HD2 ASN 84 2HD2 ASN 84 8.372 -6.911 14.861 673 H LYS 85 H LYS 85 11.003 -4.282 9.859 674 HA LYS 85 HA LYS 85 13.454 -2.931 10.305 675 1HB LYS 85 1HB LYS 85 13.015 -4.827 8.671 676 2HB LYS 85 2HB LYS 85 12.259 -3.636 7.622 677 1HG LYS 85 1HG LYS 85 14.371 -2.395 7.524 678 2HG LYS 85 2HG LYS 85 15.126 -3.624 8.545 679 1HD LYS 85 1HD LYS 85 14.509 -5.318 6.798 680 2HD LYS 85 2HD LYS 85 14.004 -3.977 5.767 681 1HE LYS 85 1HE LYS 85 16.308 -3.029 6.022 682 2HE LYS 85 2HE LYS 85 16.766 -4.518 6.846 683 1HZ LYS 85 1HZ LYS 85 15.857 -4.226 4.032 684 2HZ LYS 85 2HZ LYS 85 16.050 -5.718 4.806 685 3HZ LYS 85 3HZ LYS 85 17.392 -4.710 4.578 686 H LEU 86 H LEU 86 10.477 -2.084 8.620 687 HA LEU 86 HA LEU 86 11.291 0.445 7.649 688 1HB LEU 86 1HB LEU 86 9.303 -0.797 6.844 689 2HB LEU 86 2HB LEU 86 8.520 -0.509 8.385 690 HG LEU 86 HG LEU 86 8.722 1.966 7.894 691 1HD1 LEU 86 1HD1 LEU 86 9.380 0.913 5.152 692 2HD1 LEU 86 2HD1 LEU 86 10.441 1.859 6.197 693 3HD1 LEU 86 3HD1 LEU 86 8.975 2.585 5.539 694 1HD2 LEU 86 1HD2 LEU 86 7.054 0.286 6.028 695 2HD2 LEU 86 2HD2 LEU 86 6.773 1.979 6.431 696 3HD2 LEU 86 3HD2 LEU 86 6.624 0.740 7.679 697 H LYS 87 H LYS 87 9.799 -0.618 10.642 698 HA LYS 87 HA LYS 87 9.246 1.827 11.840 699 1HB LYS 87 1HB LYS 87 8.455 -0.238 12.785 700 2HB LYS 87 2HB LYS 87 10.095 -0.822 13.017 701 1HG LYS 87 1HG LYS 87 10.423 1.065 14.648 702 2HG LYS 87 2HG LYS 87 8.687 1.364 14.523 703 1HD LYS 87 1HD LYS 87 9.259 -0.060 16.457 704 2HD LYS 87 2HD LYS 87 8.215 -0.888 15.298 705 1HE LYS 87 1HE LYS 87 10.211 -1.977 14.334 706 2HE LYS 87 2HE LYS 87 11.205 -1.197 15.562 707 1HZ LYS 87 1HZ LYS 87 8.976 -3.070 16.154 708 2HZ LYS 87 2HZ LYS 87 10.079 -2.415 17.266 709 3HZ LYS 87 3HZ LYS 87 10.612 -3.513 16.090 710 H SER 88 H SER 88 12.254 -0.052 11.833 711 HA SER 88 HA SER 88 13.571 1.748 13.632 712 1HB SER 88 1HB SER 88 14.653 -0.527 11.967 713 2HB SER 88 2HB SER 88 15.550 0.325 13.223 714 HG SER 88 HG SER 88 13.885 -0.347 14.702 715 H ARG 89 H ARG 89 14.511 0.791 10.301 716 HA ARG 89 HA ARG 89 16.004 3.313 10.166 717 1HB ARG 89 1HB ARG 89 16.267 0.718 8.670 718 2HB ARG 89 2HB ARG 89 17.114 2.172 8.177 719 1HG ARG 89 1HG ARG 89 17.387 0.890 10.887 720 2HG ARG 89 2HG ARG 89 18.474 0.599 9.530 721 1HD ARG 89 1HD ARG 89 19.533 2.235 10.860 722 2HD ARG 89 2HD ARG 89 18.868 3.096 9.476 723 HE ARG 89 HE ARG 89 17.258 3.020 11.911 724 1HH1 ARG 89 1HH1 ARG 89 19.486 4.838 9.886 725 2HH1 ARG 89 2HH1 ARG 89 18.987 6.378 10.515 726 1HH2 ARG 89 1HH2 ARG 89 16.620 5.050 12.730 727 2HH2 ARG 89 2HH2 ARG 89 17.352 6.504 12.123 728 H GLU 90 H GLU 90 13.197 1.895 8.945 729 HA GLU 90 HA GLU 90 11.632 2.538 7.447 730 1HB GLU 90 1HB GLU 90 13.340 5.010 7.156 731 2HB GLU 90 2HB GLU 90 11.752 4.805 6.428 732 1HG GLU 90 1HG GLU 90 10.763 4.566 8.643 733 2HG GLU 90 2HG GLU 90 12.354 4.764 9.376 734 H ILE 91 H ILE 91 14.853 2.115 6.609 735 HA ILE 91 HA ILE 91 15.996 1.693 4.687 736 HB ILE 91 HB ILE 91 14.916 -0.278 3.419 737 1HG1 ILE 91 1HG1 ILE 91 13.166 -0.294 5.891 738 2HG1 ILE 91 2HG1 ILE 91 12.596 0.204 4.305 739 1HG2 ILE 91 1HG2 ILE 91 15.621 -0.429 6.344 740 2HG2 ILE 91 2HG2 ILE 91 16.745 -0.477 4.988 741 3HG2 ILE 91 3HG2 ILE 91 15.600 -1.796 5.230 742 1HD1 ILE 91 1HD1 ILE 91 11.973 -2.091 4.824 743 2HD1 ILE 91 2HD1 ILE 91 13.677 -2.515 4.996 744 3HD1 ILE 91 3HD1 ILE 91 13.046 -2.011 3.428 745 H THR 92 H THR 92 13.320 0.699 2.805 746 HA THR 92 HA THR 92 12.901 3.249 1.532 747 HB THR 92 HB THR 92 13.911 0.983 -0.203 748 HG1 THR 92 HG1 THR 92 15.330 2.864 1.281 749 1HG2 THR 92 1HG2 THR 92 12.520 2.643 -1.324 750 2HG2 THR 92 2HG2 THR 92 14.197 2.792 -1.853 751 3HG2 THR 92 3HG2 THR 92 13.533 3.940 -0.691 752 H PHE 93 H PHE 93 10.922 3.315 0.502 753 HA PHE 93 HA PHE 93 8.998 1.517 1.474 754 1HB PHE 93 1HB PHE 93 8.569 3.893 0.925 755 2HB PHE 93 2HB PHE 93 8.723 3.511 -0.782 756 HD1 PHE 93 HD1 PHE 93 6.839 2.940 -2.002 757 HD2 PHE 93 HD2 PHE 93 6.751 2.620 2.241 758 HE1 PHE 93 HE1 PHE 93 4.427 2.467 -2.091 759 HE2 PHE 93 HE2 PHE 93 4.341 2.138 2.161 760 HZ PHE 93 HZ PHE 93 3.175 2.064 -0.010 761 H GLN 94 H GLN 94 10.723 1.643 -1.569 762 HA GLN 94 HA GLN 94 9.061 -0.172 -2.970 763 1HB GLN 94 1HB GLN 94 10.947 -0.386 -4.543 764 2HB GLN 94 2HB GLN 94 10.568 1.290 -4.176 765 1HG GLN 94 1HG GLN 94 12.441 1.257 -2.522 766 2HG GLN 94 2HG GLN 94 12.872 -0.335 -3.140 767 1HE2 GLN 94 1HE2 GLN 94 12.103 0.381 -5.889 768 2HE2 GLN 94 2HE2 GLN 94 13.379 1.408 -6.469 769 H GLU 95 H GLU 95 11.953 -0.629 -0.956 770 HA GLU 95 HA GLU 95 12.172 -3.427 -1.437 771 1HB GLU 95 1HB GLU 95 14.040 -2.011 -0.580 772 2HB GLU 95 2HB GLU 95 13.177 -1.858 0.947 773 1HG GLU 95 1HG GLU 95 13.274 -4.317 1.197 774 2HG GLU 95 2HG GLU 95 14.243 -4.395 -0.272 775 H TYR 96 H TYR 96 10.604 -1.445 0.996 776 HA TYR 96 HA TYR 96 9.731 -3.338 2.803 777 1HB TYR 96 1HB TYR 96 9.440 -0.918 3.087 778 2HB TYR 96 2HB TYR 96 8.270 -0.890 1.775 779 HD1 TYR 96 HD1 TYR 96 6.022 -0.882 2.349 780 HD2 TYR 96 HD2 TYR 96 8.827 -2.600 5.043 781 HE1 TYR 96 HE1 TYR 96 4.219 -1.251 3.985 782 HE2 TYR 96 HE2 TYR 96 7.036 -2.980 6.674 783 HH TYR 96 HH TYR 96 3.728 -2.660 5.906 784 H ARG 97 H ARG 97 8.271 -2.372 -0.271 785 HA ARG 97 HA ARG 97 6.057 -4.176 0.052 786 1HB ARG 97 1HB ARG 97 6.947 -2.564 -2.340 787 2HB ARG 97 2HB ARG 97 5.424 -3.436 -2.210 788 1HG ARG 97 1HG ARG 97 4.850 -2.027 -0.248 789 2HG ARG 97 2HG ARG 97 6.319 -1.095 -0.550 790 1HD ARG 97 1HD ARG 97 3.994 -1.441 -2.434 791 2HD ARG 97 2HD ARG 97 4.392 0.014 -1.524 792 HE ARG 97 HE ARG 97 6.551 -0.059 -2.878 793 1HH1 ARG 97 1HH1 ARG 97 3.526 -1.331 -4.039 794 2HH1 ARG 97 2HH1 ARG 97 3.837 -0.952 -5.710 795 1HH2 ARG 97 1HH2 ARG 97 6.993 0.417 -5.108 796 2HH2 ARG 97 2HH2 ARG 97 5.790 0.040 -6.311 797 H ARG 98 H ARG 98 9.234 -4.391 -1.311 798 HA ARG 98 HA ARG 98 8.746 -6.546 -3.090 799 1HB ARG 98 1HB ARG 98 11.258 -5.638 -1.684 800 2HB ARG 98 2HB ARG 98 11.230 -6.985 -2.813 801 1HG ARG 98 1HG ARG 98 10.524 -4.123 -3.421 802 2HG ARG 98 2HG ARG 98 11.979 -4.985 -3.929 803 1HD ARG 98 1HD ARG 98 9.165 -5.758 -4.697 804 2HD ARG 98 2HD ARG 98 10.251 -4.805 -5.708 805 HE ARG 98 HE ARG 98 11.765 -6.830 -5.588 806 1HH1 ARG 98 1HH1 ARG 98 8.290 -7.101 -5.271 807 2HH1 ARG 98 2HH1 ARG 98 8.214 -8.700 -5.943 808 1HH2 ARG 98 1HH2 ARG 98 11.681 -8.924 -6.507 809 2HH2 ARG 98 2HH2 ARG 98 10.147 -9.742 -6.649 810 H ASN 99 H ASN 99 9.766 -6.407 0.300 811 HA ASN 99 HA ASN 99 9.896 -9.224 0.629 812 1HB ASN 99 1HB ASN 99 9.601 -6.983 2.631 813 2HB ASN 99 2HB ASN 99 9.760 -8.673 3.094 814 1HD2 ASN 99 1HD2 ASN 99 11.504 -6.427 3.670 815 2HD2 ASN 99 2HD2 ASN 99 13.062 -6.848 3.049 816 H LEU 100 H LEU 100 7.331 -6.841 1.027 817 HA LEU 100 HA LEU 100 5.423 -8.568 2.190 818 1HB LEU 100 1HB LEU 100 5.167 -6.041 0.582 819 2HB LEU 100 2HB LEU 100 3.765 -6.899 1.191 820 HG LEU 100 HG LEU 100 5.988 -5.835 2.934 821 1HD1 LEU 100 1HD1 LEU 100 3.250 -4.707 2.380 822 2HD1 LEU 100 2HD1 LEU 100 4.783 -4.018 1.849 823 3HD1 LEU 100 3HD1 LEU 100 4.399 -4.095 3.569 824 1HD2 LEU 100 1HD2 LEU 100 4.795 -7.755 3.865 825 2HD2 LEU 100 2HD2 LEU 100 3.257 -6.935 3.591 826 3HD2 LEU 100 3HD2 LEU 100 4.413 -6.276 4.749 827 H ALA 101 H ALA 101 6.199 -7.844 -1.191 828 HA ALA 101 HA ALA 101 4.129 -9.397 -2.325 829 1HB ALA 101 1HB ALA 101 6.846 -8.739 -3.463 830 2HB ALA 101 2HB ALA 101 5.395 -7.747 -3.614 831 3HB ALA 101 3HB ALA 101 5.459 -9.336 -4.374 832 H LYS 102 H LYS 102 7.269 -10.172 -1.035 833 HA LYS 102 HA LYS 102 7.320 -12.868 -2.015 834 1HB LYS 102 1HB LYS 102 9.364 -11.555 -1.431 835 2HB LYS 102 2HB LYS 102 8.883 -11.622 0.258 836 1HG LYS 102 1HG LYS 102 9.070 -14.060 0.216 837 2HG LYS 102 2HG LYS 102 9.566 -13.988 -1.476 838 1HD LYS 102 1HD LYS 102 11.526 -12.661 -0.840 839 2HD LYS 102 2HD LYS 102 11.026 -12.732 0.849 840 1HE LYS 102 1HE LYS 102 11.695 -15.117 -0.867 841 2HE LYS 102 2HE LYS 102 12.784 -14.373 0.301 842 1HZ LYS 102 1HZ LYS 102 11.632 -16.344 1.167 843 2HZ LYS 102 2HZ LYS 102 10.143 -15.558 0.986 844 3HZ LYS 102 3HZ LYS 102 11.298 -14.954 2.073 845 H ALA 103 H ALA 103 5.716 -11.242 0.487 846 HA ALA 103 HA ALA 103 5.397 -13.618 2.152 847 1HB ALA 103 1HB ALA 103 4.335 -10.824 2.562 848 2HB ALA 103 2HB ALA 103 5.830 -11.464 3.245 849 3HB ALA 103 3HB ALA 103 4.277 -12.147 3.727 850 H GLY 104 H GLY 104 4.051 -12.614 -0.602 851 1HA GLY 104 1HA GLY 104 2.227 -13.546 -1.690 852 2HA GLY 104 2HA GLY 104 1.718 -14.253 -0.165 853 H VAL 105 H VAL 105 2.368 -10.879 -0.183 854 HA VAL 105 HA VAL 105 -0.416 -10.312 0.315 855 HB VAL 105 HB VAL 105 1.936 -8.414 0.190 856 1HG1 VAL 105 1HG1 VAL 105 0.486 -6.832 1.338 857 2HG1 VAL 105 2HG1 VAL 105 -0.841 -7.992 1.288 858 3HG1 VAL 105 3HG1 VAL 105 -0.213 -7.305 -0.211 859 1HG2 VAL 105 1HG2 VAL 105 1.877 -8.467 2.626 860 2HG2 VAL 105 2HG2 VAL 105 2.152 -10.083 1.978 861 3HG2 VAL 105 3HG2 VAL 105 0.556 -9.635 2.582 862 H PHE 106 H PHE 106 -1.594 -10.467 -1.491 863 HA PHE 106 HA PHE 106 -0.694 -9.139 -3.928 864 1HB PHE 106 1HB PHE 106 -3.033 -10.959 -3.344 865 2HB PHE 106 2HB PHE 106 -2.816 -10.150 -4.889 866 HD1 PHE 106 HD1 PHE 106 -1.394 -12.663 -2.599 867 HD2 PHE 106 HD2 PHE 106 -1.275 -10.949 -6.490 868 HE1 PHE 106 HE1 PHE 106 0.027 -14.519 -3.366 869 HE2 PHE 106 HE2 PHE 106 0.144 -12.803 -7.269 870 HZ PHE 106 HZ PHE 106 0.796 -14.590 -5.704 871 H ARG 107 H ARG 107 -3.015 -8.807 -1.351 872 HA ARG 107 HA ARG 107 -4.090 -6.413 -2.682 873 1HB ARG 107 1HB ARG 107 -5.441 -8.478 -0.994 874 2HB ARG 107 2HB ARG 107 -6.052 -6.829 -0.991 875 1HG ARG 107 1HG ARG 107 -6.298 -6.945 -3.440 876 2HG ARG 107 2HG ARG 107 -5.762 -8.626 -3.391 877 1HD ARG 107 1HD ARG 107 -7.673 -9.291 -2.159 878 2HD ARG 107 2HD ARG 107 -8.125 -7.620 -1.826 879 HE ARG 107 HE ARG 107 -8.307 -7.595 -4.455 880 1HH1 ARG 107 1HH1 ARG 107 -9.340 -10.123 -2.254 881 2HH1 ARG 107 2HH1 ARG 107 -10.650 -10.642 -3.263 882 1HH2 ARG 107 1HH2 ARG 107 -10.072 -8.258 -5.766 883 2HH2 ARG 107 2HH2 ARG 107 -11.069 -9.589 -5.244 884 H TRP 108 H TRP 108 -2.819 -4.876 -1.889 885 HA TRP 108 HA TRP 108 -2.487 -4.503 0.975 886 1HB TRP 108 1HB TRP 108 -0.647 -3.925 -0.548 887 2HB TRP 108 2HB TRP 108 -1.690 -2.822 -1.426 888 HD1 TRP 108 HD1 TRP 108 -2.813 -0.970 0.777 889 HE1 TRP 108 HE1 TRP 108 -1.273 0.576 2.135 890 HE3 TRP 108 HE3 TRP 108 1.617 -3.440 0.095 891 HZ2 TRP 108 HZ2 TRP 108 1.454 0.731 2.821 892 HZ3 TRP 108 HZ3 TRP 108 3.646 -2.513 1.134 893 HH2 TRP 108 HH2 TRP 108 3.566 -0.473 2.467 894 H VAL 109 H VAL 109 -4.558 -4.158 1.778 895 HA VAL 109 HA VAL 109 -6.154 -2.061 0.471 896 HB VAL 109 HB VAL 109 -7.082 -4.178 2.422 897 1HG1 VAL 109 1HG1 VAL 109 -9.337 -3.458 1.796 898 2HG1 VAL 109 2HG1 VAL 109 -8.653 -2.190 0.780 899 3HG1 VAL 109 3HG1 VAL 109 -8.426 -2.138 2.529 900 1HG2 VAL 109 1HG2 VAL 109 -7.433 -3.991 -0.572 901 2HG2 VAL 109 2HG2 VAL 109 -8.183 -5.197 0.474 902 3HG2 VAL 109 3HG2 VAL 109 -6.429 -5.158 0.286 903 H THR 110 H THR 110 -5.410 -0.206 1.385 904 HA THR 110 HA THR 110 -5.263 -0.045 4.298 905 HB THR 110 HB THR 110 -4.591 2.046 2.218 906 HG1 THR 110 HG1 THR 110 -3.280 -0.011 2.499 907 1HG2 THR 110 1HG2 THR 110 -5.187 3.027 4.383 908 2HG2 THR 110 2HG2 THR 110 -3.462 3.198 4.061 909 3HG2 THR 110 3HG2 THR 110 -4.030 1.965 5.187 910 H ASN 111 H ASN 111 -7.171 0.175 5.220 911 HA ASN 111 HA ASN 111 -9.214 1.843 3.944 912 1HB ASN 111 1HB ASN 111 -9.794 -0.497 4.593 913 2HB ASN 111 2HB ASN 111 -9.486 -0.074 6.273 914 1HD2 ASN 111 1HD2 ASN 111 -11.628 -0.669 6.756 915 2HD2 ASN 111 2HD2 ASN 111 -12.954 0.391 6.406 916 H ILE 112 H ILE 112 -8.299 3.816 4.477 917 HA ILE 112 HA ILE 112 -7.422 4.652 7.001 918 HB ILE 112 HB ILE 112 -8.629 6.309 4.770 919 1HG1 ILE 112 1HG1 ILE 112 -6.636 5.012 4.095 920 2HG1 ILE 112 2HG1 ILE 112 -6.328 6.744 4.090 921 1HG2 ILE 112 1HG2 ILE 112 -6.951 7.175 7.122 922 2HG2 ILE 112 2HG2 ILE 112 -8.660 7.532 6.870 923 3HG2 ILE 112 3HG2 ILE 112 -7.449 8.207 5.781 924 1HD1 ILE 112 1HD1 ILE 112 -4.445 5.525 4.998 925 2HD1 ILE 112 2HD1 ILE 112 -5.484 4.801 6.227 926 3HD1 ILE 112 3HD1 ILE 112 -5.184 6.540 6.238 927 H HIS 113 H HIS 113 -10.593 4.521 5.550 928 HA HIS 113 HA HIS 113 -12.000 6.214 7.268 929 1HB HIS 113 1HB HIS 113 -12.768 5.136 5.080 930 2HB HIS 113 2HB HIS 113 -13.139 3.707 6.039 931 HD1 HIS 113 HD1 HIS 113 -15.644 3.954 5.468 932 HD2 HIS 113 HD2 HIS 113 -14.043 7.167 7.565 933 HE1 HIS 113 HE1 HIS 113 -17.618 5.300 6.252 934 HE2 HIS 113 HE2 HIS 113 -16.627 7.080 7.739 935 H GLU 114 H GLU 114 -10.816 2.982 7.758 936 HA GLU 114 HA GLU 114 -12.289 2.858 10.306 937 1HB GLU 114 1HB GLU 114 -12.624 1.075 8.442 938 2HB GLU 114 2HB GLU 114 -11.067 0.462 8.980 939 1HG GLU 114 1HG GLU 114 -11.961 0.179 11.235 940 2HG GLU 114 2HG GLU 114 -13.524 0.782 10.683 941 H GLN 115 H GLN 115 -9.329 3.458 8.995 942 HA GLN 115 HA GLN 115 -7.316 3.924 9.937 943 1HB GLN 115 1HB GLN 115 -8.580 2.948 12.497 944 2HB GLN 115 2HB GLN 115 -6.987 3.680 12.387 945 1HG GLN 115 1HG GLN 115 -9.527 5.061 11.558 946 2HG GLN 115 2HG GLN 115 -8.803 5.202 13.158 947 1HE2 GLN 115 1HE2 GLN 115 -8.538 6.055 9.799 948 2HE2 GLN 115 2HE2 GLN 115 -7.295 7.242 9.998 949 H LYS 116 H LYS 116 -8.131 1.198 8.897 950 HA LYS 116 HA LYS 116 -5.943 -0.341 10.151 951 1HB LYS 116 1HB LYS 116 -8.592 -1.232 9.084 952 2HB LYS 116 2HB LYS 116 -7.226 -2.327 9.016 953 1HG LYS 116 1HG LYS 116 -8.375 -2.900 10.959 954 2HG LYS 116 2HG LYS 116 -6.991 -1.958 11.514 955 1HD LYS 116 1HD LYS 116 -8.286 -0.168 12.130 956 2HD LYS 116 2HD LYS 116 -9.561 -0.555 10.969 957 1HE LYS 116 1HE LYS 116 -8.947 -2.118 13.477 958 2HE LYS 116 2HE LYS 116 -10.258 -0.951 13.297 959 1HZ LYS 116 1HZ LYS 116 -11.232 -2.333 11.581 960 2HZ LYS 116 2HZ LYS 116 -11.015 -3.241 12.998 961 3HZ LYS 116 3HZ LYS 116 -9.953 -3.438 11.697 962 H ARG 117 H ARG 117 -4.398 -1.206 8.874 963 HA ARG 117 HA ARG 117 -4.757 -1.020 5.953 964 1HB ARG 117 1HB ARG 117 -2.798 0.218 6.787 965 2HB ARG 117 2HB ARG 117 -2.206 -1.237 7.571 966 1HG ARG 117 1HG ARG 117 -1.552 -2.208 5.593 967 2HG ARG 117 2HG ARG 117 -2.687 -1.259 4.630 968 1HD ARG 117 1HD ARG 117 -0.352 -0.570 4.276 969 2HD ARG 117 2HD ARG 117 -1.342 0.728 4.937 970 HE ARG 117 HE ARG 117 0.288 -0.873 6.777 971 1HH1 ARG 117 1HH1 ARG 117 -0.253 2.145 5.090 972 2HH1 ARG 117 2HH1 ARG 117 0.810 3.065 6.110 973 1HH2 ARG 117 1HH2 ARG 117 1.690 0.313 8.136 974 2HH2 ARG 117 2HH2 ARG 117 1.928 2.011 7.831 975 H TYR 118 H TYR 118 -5.498 -2.888 5.192 976 HA TYR 118 HA TYR 118 -4.890 -5.361 6.631 977 1HB TYR 118 1HB TYR 118 -6.927 -4.755 4.480 978 2HB TYR 118 2HB TYR 118 -6.704 -6.335 5.219 979 HD1 TYR 118 HD1 TYR 118 -7.054 -6.510 7.744 980 HD2 TYR 118 HD2 TYR 118 -8.371 -3.193 5.435 981 HE1 TYR 118 HE1 TYR 118 -8.636 -5.912 9.523 982 HE2 TYR 118 HE2 TYR 118 -9.966 -2.582 7.208 983 HH TYR 118 HH TYR 118 -11.141 -3.668 9.097 984 H TYR 119 H TYR 119 -3.727 -6.978 5.805 985 HA TYR 119 HA TYR 119 -2.757 -6.717 3.037 986 1HB TYR 119 1HB TYR 119 -1.498 -8.179 5.373 987 2HB TYR 119 2HB TYR 119 -0.832 -8.087 3.746 988 HD1 TYR 119 HD1 TYR 119 -1.389 -6.277 6.878 989 HD2 TYR 119 HD2 TYR 119 0.199 -6.032 2.939 990 HE1 TYR 119 HE1 TYR 119 -0.188 -4.224 7.496 991 HE2 TYR 119 HE2 TYR 119 1.404 -3.975 3.545 992 HH TYR 119 HH TYR 119 1.689 -2.921 6.822 993 H TYR 120 H TYR 120 -3.903 -7.992 1.736 994 HA TYR 120 HA TYR 120 -4.777 -10.615 2.763 995 1HB TYR 120 1HB TYR 120 -5.921 -8.992 0.480 996 2HB TYR 120 2HB TYR 120 -6.479 -10.582 0.972 997 HD1 TYR 120 HD1 TYR 120 -7.463 -10.820 3.324 998 HD2 TYR 120 HD2 TYR 120 -6.808 -7.067 1.429 999 HE1 TYR 120 HE1 TYR 120 -9.110 -9.780 4.830 1000 HE2 TYR 120 HE2 TYR 120 -8.439 -6.013 2.933 1001 HH TYR 120 HH TYR 120 -10.367 -6.651 4.291 1002 H THR 121 H THR 121 -4.421 -12.448 1.567 1003 HA THR 121 HA THR 121 -2.474 -12.337 -0.580 1004 HB THR 121 HB THR 121 -2.164 -14.154 0.914 1005 HG1 THR 121 HG1 THR 121 -3.336 -15.919 -0.724 1006 1HG2 THR 121 1HG2 THR 121 -3.922 -15.776 1.469 1007 2HG2 THR 121 2HG2 THR 121 -5.075 -14.825 0.535 1008 3HG2 THR 121 3HG2 THR 121 -4.333 -14.138 1.980 1009 H PHE 122 H PHE 122 -3.171 -14.023 -2.487 1010 HA PHE 122 HA PHE 122 -5.098 -12.611 -3.988 1011 1HB PHE 122 1HB PHE 122 -3.212 -13.887 -4.977 1012 2HB PHE 122 2HB PHE 122 -4.003 -15.386 -4.501 1013 HD1 PHE 122 HD1 PHE 122 -5.581 -16.391 -5.890 1014 HD2 PHE 122 HD2 PHE 122 -4.436 -12.351 -6.594 1015 HE1 PHE 122 HE1 PHE 122 -6.829 -16.411 -8.011 1016 HE2 PHE 122 HE2 PHE 122 -5.684 -12.364 -8.715 1017 HZ PHE 122 HZ PHE 122 -6.882 -14.394 -9.427 1018 H ASP 123 H ASP 123 -5.271 -15.514 -2.047 1019 HA ASP 123 HA ASP 123 -8.002 -16.067 -2.841 1020 1HB ASP 123 1HB ASP 123 -7.826 -17.946 -1.235 1021 2HB ASP 123 2HB ASP 123 -6.528 -17.948 -2.424 1022 H ASN 124 H ASN 124 -7.136 -13.583 -1.442 1023 HA ASN 124 HA ASN 124 -7.951 -12.059 -0.030 1024 1HB ASN 124 1HB ASN 124 -10.325 -11.900 0.243 1025 2HB ASN 124 2HB ASN 124 -9.974 -12.477 -1.375 1026 1HD2 ASN 124 1HD2 ASN 124 -11.274 -13.301 1.750 1027 2HD2 ASN 124 2HD2 ASN 124 -12.085 -14.745 1.252 1028 H SER 125 H SER 125 -6.979 -14.737 1.233 1029 HA SER 125 HA SER 125 -8.209 -14.676 3.811 1030 1HB SER 125 1HB SER 125 -5.516 -15.773 2.952 1031 2HB SER 125 2HB SER 125 -6.266 -16.042 4.525 1032 HG SER 125 HG SER 125 -6.846 -17.157 2.046 1033 H LEU 126 H LEU 126 -7.722 -13.450 5.553 1034 HA LEU 126 HA LEU 126 -6.082 -11.150 5.238 1035 1HB LEU 126 1HB LEU 126 -8.055 -11.177 6.706 1036 2HB LEU 126 2HB LEU 126 -7.274 -12.358 7.740 1037 HG LEU 126 HG LEU 126 -5.528 -10.688 8.294 1038 1HD1 LEU 126 1HD1 LEU 126 -5.681 -9.370 6.230 1039 2HD1 LEU 126 2HD1 LEU 126 -5.822 -8.367 7.674 1040 3HD1 LEU 126 3HD1 LEU 126 -7.262 -8.773 6.740 1041 1HD2 LEU 126 1HD2 LEU 126 -8.362 -9.775 8.792 1042 2HD2 LEU 126 2HD2 LEU 126 -6.940 -9.283 9.712 1043 3HD2 LEU 126 3HD2 LEU 126 -7.472 -10.965 9.742 1044 H LEU 127 H LEU 127 -3.949 -11.155 5.260 1045 HA LEU 127 HA LEU 127 -2.492 -13.315 6.534 1046 1HB LEU 127 1HB LEU 127 -1.547 -10.910 4.971 1047 2HB LEU 127 2HB LEU 127 -0.499 -12.179 5.577 1048 HG LEU 127 HG LEU 127 -2.690 -12.540 3.533 1049 1HD1 LEU 127 1HD1 LEU 127 -0.854 -12.943 1.973 1050 2HD1 LEU 127 2HD1 LEU 127 0.309 -12.564 3.244 1051 3HD1 LEU 127 3HD1 LEU 127 -0.782 -11.314 2.647 1052 1HD2 LEU 127 1HD2 LEU 127 -0.639 -14.490 4.567 1053 2HD2 LEU 127 2HD2 LEU 127 -1.828 -14.797 3.300 1054 3HD2 LEU 127 3HD2 LEU 127 -2.360 -14.508 4.957 1055 H PHE 128 H PHE 128 -2.774 -9.801 6.784 1056 HA PHE 128 HA PHE 128 -2.243 -9.822 9.591 1057 1HB PHE 128 1HB PHE 128 0.038 -10.078 8.280 1058 2HB PHE 128 2HB PHE 128 -0.161 -8.352 8.007 1059 HD1 PHE 128 HD1 PHE 128 0.122 -10.944 10.626 1060 HD2 PHE 128 HD2 PHE 128 0.377 -6.799 9.676 1061 HE1 PHE 128 HE1 PHE 128 1.120 -10.499 12.832 1062 HE2 PHE 128 HE2 PHE 128 1.373 -6.348 11.879 1063 HZ PHE 128 HZ PHE 128 1.745 -8.202 13.464 1064 H THR 129 H THR 129 -2.164 -7.509 10.424 1065 HA THR 129 HA THR 129 -2.947 -5.448 8.583 1066 HB THR 129 HB THR 129 -5.116 -6.656 9.166 1067 HG1 THR 129 HG1 THR 129 -4.786 -4.311 8.559 1068 1HG2 THR 129 1HG2 THR 129 -4.645 -5.318 11.836 1069 2HG2 THR 129 2HG2 THR 129 -4.642 -7.060 11.547 1070 3HG2 THR 129 3HG2 THR 129 -6.128 -6.134 11.331 1071 H GLU 130 H GLU 130 -2.923 -3.355 9.551 1072 HA GLU 130 HA GLU 130 -1.888 -3.137 12.261 1073 1HB GLU 130 1HB GLU 130 0.019 -1.717 11.435 1074 2HB GLU 130 2HB GLU 130 0.158 -3.430 11.053 1075 1HG GLU 130 1HG GLU 130 -0.676 -2.965 8.785 1076 2HG GLU 130 2HG GLU 130 -0.736 -1.248 9.179 1077 H SER 131 H SER 131 -1.851 -0.900 13.005 1078 HA SER 131 HA SER 131 -3.948 0.706 11.843 1079 1HB SER 131 1HB SER 131 -2.096 1.417 14.131 1080 2HB SER 131 2HB SER 131 -3.661 2.143 13.759 1081 HG SER 131 HG SER 131 -4.249 -0.321 13.985 1082 H ILE 132 H ILE 132 -3.686 2.572 10.671 1083 HA ILE 132 HA ILE 132 -1.128 2.811 9.381 1084 HB ILE 132 HB ILE 132 -2.491 4.764 8.181 1085 1HG1 ILE 132 1HG1 ILE 132 -4.878 3.908 7.926 1086 2HG1 ILE 132 2HG1 ILE 132 -4.592 2.941 9.367 1087 1HG2 ILE 132 1HG2 ILE 132 -1.529 2.852 7.089 1088 2HG2 ILE 132 2HG2 ILE 132 -3.191 3.059 6.539 1089 3HG2 ILE 132 3HG2 ILE 132 -2.801 1.805 7.716 1090 1HD1 ILE 132 1HD1 ILE 132 -5.794 4.973 9.898 1091 2HD1 ILE 132 2HD1 ILE 132 -4.497 5.944 9.199 1092 3HD1 ILE 132 3HD1 ILE 132 -4.197 4.984 10.648 1093 H GLN 133 H GLN 133 -0.003 3.520 11.335 1094 HA GLN 133 HA GLN 133 0.466 6.346 11.144 1095 1HB GLN 133 1HB GLN 133 -1.212 5.325 13.283 1096 2HB GLN 133 2HB GLN 133 0.237 6.088 13.919 1097 1HG GLN 133 1HG GLN 133 -1.714 7.358 12.014 1098 2HG GLN 133 2HG GLN 133 -1.638 7.643 13.751 1099 1HE2 GLN 133 1HE2 GLN 133 0.047 8.859 14.594 1100 2HE2 GLN 133 2HE2 GLN 133 1.068 9.848 13.605 Start of MODEL 2 1 H ASP 7 H ASP 7 -6.887 16.292 -15.371 2 HA ASP 7 HA ASP 7 -8.078 13.677 -15.277 3 1HB ASP 7 1HB ASP 7 -6.323 14.353 -16.954 4 2HB ASP 7 2HB ASP 7 -5.155 14.357 -15.638 5 H GLN 8 H GLN 8 -8.598 13.058 -13.342 6 HA GLN 8 HA GLN 8 -7.364 13.790 -10.936 7 1HB GLN 8 1HB GLN 8 -9.701 13.061 -11.181 8 2HB GLN 8 2HB GLN 8 -9.156 11.442 -11.580 9 1HG GLN 8 1HG GLN 8 -8.291 11.135 -9.362 10 2HG GLN 8 2HG GLN 8 -8.669 12.811 -8.949 11 1HE2 GLN 8 1HE2 GLN 8 -10.789 13.407 -8.593 12 2HE2 GLN 8 2HE2 GLN 8 -12.062 12.256 -8.359 13 H VAL 9 H VAL 9 -6.735 11.256 -13.196 14 HA VAL 9 HA VAL 9 -5.347 9.448 -11.552 15 HB VAL 9 HB VAL 9 -4.974 9.985 -14.506 16 1HG1 VAL 9 1HG1 VAL 9 -3.085 8.763 -13.535 17 2HG1 VAL 9 2HG1 VAL 9 -4.027 7.747 -14.627 18 3HG1 VAL 9 3HG1 VAL 9 -4.202 7.563 -12.883 19 1HG2 VAL 9 1HG2 VAL 9 -6.479 8.066 -14.813 20 2HG2 VAL 9 2HG2 VAL 9 -7.269 9.399 -13.968 21 3HG2 VAL 9 3HG2 VAL 9 -6.718 7.987 -13.066 22 H VAL 10 H VAL 10 -4.318 12.358 -13.276 23 HA VAL 10 HA VAL 10 -1.541 11.954 -13.118 24 HB VAL 10 HB VAL 10 -3.083 14.555 -13.171 25 1HG1 VAL 10 1HG1 VAL 10 -1.007 15.584 -13.956 26 2HG1 VAL 10 2HG1 VAL 10 -0.161 14.053 -13.737 27 3HG1 VAL 10 3HG1 VAL 10 -0.811 14.908 -12.340 28 1HG2 VAL 10 1HG2 VAL 10 -2.539 14.540 -15.563 29 2HG2 VAL 10 2HG2 VAL 10 -3.515 13.146 -15.099 30 3HG2 VAL 10 3HG2 VAL 10 -1.783 12.957 -15.372 31 H ILE 11 H ILE 11 -3.642 13.896 -11.009 32 HA ILE 11 HA ILE 11 -1.664 14.769 -9.256 33 HB ILE 11 HB ILE 11 -4.614 14.360 -8.747 34 1HG1 ILE 11 1HG1 ILE 11 -4.502 16.947 -8.873 35 2HG1 ILE 11 2HG1 ILE 11 -2.956 16.697 -9.672 36 1HG2 ILE 11 1HG2 ILE 11 -4.356 15.847 -6.824 37 2HG2 ILE 11 2HG2 ILE 11 -2.613 15.879 -7.082 38 3HG2 ILE 11 3HG2 ILE 11 -3.411 14.373 -6.633 39 1HD1 ILE 11 1HD1 ILE 11 -4.064 15.419 -11.425 40 2HD1 ILE 11 2HD1 ILE 11 -4.764 17.031 -11.266 41 3HD1 ILE 11 3HD1 ILE 11 -5.612 15.634 -10.607 42 H PHE 12 H PHE 12 -3.858 11.980 -8.955 43 HA PHE 12 HA PHE 12 -2.918 11.273 -6.378 44 1HB PHE 12 1HB PHE 12 -4.597 9.856 -8.422 45 2HB PHE 12 2HB PHE 12 -4.089 9.044 -6.945 46 HD1 PHE 12 HD1 PHE 12 -5.876 12.056 -8.177 47 HD2 PHE 12 HD2 PHE 12 -5.271 9.328 -4.969 48 HE1 PHE 12 HE1 PHE 12 -7.762 13.065 -6.965 49 HE2 PHE 12 HE2 PHE 12 -7.156 10.335 -3.752 50 HZ PHE 12 HZ PHE 12 -8.406 12.203 -4.750 51 H LYS 13 H LYS 13 -2.064 10.114 -9.629 52 HA LYS 13 HA LYS 13 -0.447 7.971 -8.742 53 1HB LYS 13 1HB LYS 13 -1.316 8.461 -11.127 54 2HB LYS 13 2HB LYS 13 0.090 9.506 -11.278 55 1HG LYS 13 1HG LYS 13 0.880 6.931 -10.278 56 2HG LYS 13 2HG LYS 13 -0.070 6.748 -11.751 57 1HD LYS 13 1HD LYS 13 2.055 6.969 -12.613 58 2HD LYS 13 2HD LYS 13 1.502 8.644 -12.648 59 1HE LYS 13 1HE LYS 13 2.666 9.093 -10.562 60 2HE LYS 13 2HE LYS 13 3.172 7.407 -10.462 61 1HZ LYS 13 1HZ LYS 13 4.381 7.753 -12.585 62 2HZ LYS 13 2HZ LYS 13 4.975 8.692 -11.305 63 3HZ LYS 13 3HZ LYS 13 4.002 9.407 -12.497 64 H GLN 14 H GLN 14 0.190 11.382 -9.317 65 HA GLN 14 HA GLN 14 2.999 11.267 -9.025 66 1HB GLN 14 1HB GLN 14 0.997 13.496 -8.731 67 2HB GLN 14 2HB GLN 14 2.724 13.751 -8.510 68 1HG GLN 14 1HG GLN 14 3.172 13.092 -10.767 69 2HG GLN 14 2HG GLN 14 1.494 12.609 -11.006 70 1HE2 GLN 14 1HE2 GLN 14 0.472 14.915 -9.539 71 2HE2 GLN 14 2HE2 GLN 14 0.644 16.273 -10.601 72 H ILE 15 H ILE 15 0.384 11.460 -6.702 73 HA ILE 15 HA ILE 15 1.917 12.165 -4.437 74 HB ILE 15 HB ILE 15 -0.569 10.443 -4.549 75 1HG1 ILE 15 1HG1 ILE 15 -0.278 13.410 -4.016 76 2HG1 ILE 15 2HG1 ILE 15 -0.847 12.711 -5.529 77 1HG2 ILE 15 1HG2 ILE 15 -0.862 11.095 -2.187 78 2HG2 ILE 15 2HG2 ILE 15 0.709 11.894 -2.231 79 3HG2 ILE 15 3HG2 ILE 15 0.604 10.146 -2.446 80 1HD1 ILE 15 1HD1 ILE 15 -2.191 12.495 -2.847 81 2HD1 ILE 15 2HD1 ILE 15 -2.757 11.738 -4.334 82 3HD1 ILE 15 3HD1 ILE 15 -2.705 13.497 -4.204 83 H PHE 16 H PHE 16 0.915 8.982 -5.679 84 HA PHE 16 HA PHE 16 2.440 7.465 -3.836 85 1HB PHE 16 1HB PHE 16 1.266 6.794 -6.536 86 2HB PHE 16 2HB PHE 16 2.141 5.616 -5.565 87 HD1 PHE 16 HD1 PHE 16 -0.775 7.922 -5.448 88 HD2 PHE 16 HD2 PHE 16 1.036 4.372 -3.961 89 HE1 PHE 16 HE1 PHE 16 -2.848 7.373 -4.238 90 HE2 PHE 16 HE2 PHE 16 -1.030 3.817 -2.751 91 HZ PHE 16 HZ PHE 16 -2.977 5.317 -2.887 92 H ASP 17 H ASP 17 3.175 9.028 -6.817 93 HA ASP 17 HA ASP 17 5.567 7.659 -7.471 94 1HB ASP 17 1HB ASP 17 4.206 9.121 -9.011 95 2HB ASP 17 2HB ASP 17 4.823 10.518 -8.139 96 H LYS 18 H LYS 18 4.904 10.676 -5.729 97 HA LYS 18 HA LYS 18 7.680 11.204 -5.298 98 1HB LYS 18 1HB LYS 18 5.133 12.557 -4.614 99 2HB LYS 18 2HB LYS 18 6.531 12.936 -3.615 100 1HG LYS 18 1HG LYS 18 6.208 14.491 -5.519 101 2HG LYS 18 2HG LYS 18 7.776 13.681 -5.522 102 1HD LYS 18 1HD LYS 18 6.629 11.961 -7.072 103 2HD LYS 18 2HD LYS 18 5.407 13.214 -7.297 104 1HE LYS 18 1HE LYS 18 7.043 14.739 -8.154 105 2HE LYS 18 2HE LYS 18 8.354 13.628 -7.755 106 1HZ LYS 18 1HZ LYS 18 7.165 12.024 -9.321 107 2HZ LYS 18 2HZ LYS 18 8.010 13.319 -10.016 108 3HZ LYS 18 3HZ LYS 18 6.320 13.387 -9.891 109 H VAL 19 H VAL 19 5.126 9.720 -3.369 110 HA VAL 19 HA VAL 19 6.688 9.657 -0.980 111 HB VAL 19 HB VAL 19 4.206 9.351 -1.000 112 1HG1 VAL 19 1HG1 VAL 19 4.854 6.584 -2.000 113 2HG1 VAL 19 2HG1 VAL 19 4.025 7.845 -2.910 114 3HG1 VAL 19 3HG1 VAL 19 3.271 7.157 -1.474 115 1HG2 VAL 19 1HG2 VAL 19 5.826 7.180 0.320 116 2HG2 VAL 19 2HG2 VAL 19 4.172 7.612 0.750 117 3HG2 VAL 19 3HG2 VAL 19 5.475 8.781 0.972 118 H ARG 20 H ARG 20 6.588 7.777 -3.866 119 HA ARG 20 HA ARG 20 7.901 5.456 -2.865 120 1HB ARG 20 1HB ARG 20 6.513 5.526 -4.928 121 2HB ARG 20 2HB ARG 20 7.750 6.511 -5.693 122 1HG ARG 20 1HG ARG 20 9.327 4.703 -5.595 123 2HG ARG 20 2HG ARG 20 8.195 3.718 -4.663 124 1HD ARG 20 1HD ARG 20 7.870 4.665 -7.510 125 2HD ARG 20 2HD ARG 20 8.135 3.008 -6.964 126 HE ARG 20 HE ARG 20 5.736 4.451 -6.090 127 1HH1 ARG 20 1HH1 ARG 20 7.170 1.905 -8.000 128 2HH1 ARG 20 2HH1 ARG 20 5.682 1.016 -8.187 129 1HH2 ARG 20 1HH2 ARG 20 3.779 3.304 -6.328 130 2HH2 ARG 20 2HH2 ARG 20 3.762 1.804 -7.195 131 H ASN 21 H ASN 21 8.947 8.566 -3.974 132 HA ASN 21 HA ASN 21 11.729 7.673 -4.184 133 1HB ASN 21 1HB ASN 21 10.365 10.256 -4.943 134 2HB ASN 21 2HB ASN 21 12.114 10.082 -4.935 135 1HD2 ASN 21 1HD2 ASN 21 9.856 7.572 -5.908 136 2HD2 ASN 21 2HD2 ASN 21 10.297 7.572 -7.578 137 H ASP 22 H ASP 22 9.762 10.082 -2.500 138 HA ASP 22 HA ASP 22 12.024 10.970 -0.924 139 1HB ASP 22 1HB ASP 22 10.464 12.602 -1.805 140 2HB ASP 22 2HB ASP 22 9.125 11.813 -0.982 141 H LEU 23 H LEU 23 9.314 8.856 -0.567 142 HA LEU 23 HA LEU 23 8.747 7.347 1.019 143 1HB LEU 23 1HB LEU 23 11.451 8.042 2.163 144 2HB LEU 23 2HB LEU 23 10.453 6.704 2.700 145 HG LEU 23 HG LEU 23 11.643 7.015 -0.058 146 1HD1 LEU 23 1HD1 LEU 23 12.346 5.140 2.195 147 2HD1 LEU 23 2HD1 LEU 23 13.311 6.512 1.649 148 3HD1 LEU 23 3HD1 LEU 23 13.056 5.133 0.580 149 1HD2 LEU 23 1HD2 LEU 23 10.843 4.721 -0.414 150 2HD2 LEU 23 2HD2 LEU 23 9.515 5.847 -0.140 151 3HD2 LEU 23 3HD2 LEU 23 10.036 4.768 1.153 152 H ASN 24 H ASN 24 8.114 10.240 1.381 153 HA ASN 24 HA ASN 24 8.019 10.516 4.268 154 1HB ASN 24 1HB ASN 24 8.339 12.492 2.728 155 2HB ASN 24 2HB ASN 24 6.675 12.268 2.201 156 1HD2 ASN 24 1HD2 ASN 24 7.795 14.576 3.449 157 2HD2 ASN 24 2HD2 ASN 24 6.946 14.814 4.939 158 H TYR 25 H TYR 25 6.730 8.885 5.012 159 HA TYR 25 HA TYR 25 4.234 8.208 3.850 160 1HB TYR 25 1HB TYR 25 5.518 7.557 6.490 161 2HB TYR 25 2HB TYR 25 3.887 7.020 6.101 162 HD1 TYR 25 HD1 TYR 25 7.449 6.635 5.319 163 HD2 TYR 25 HD2 TYR 25 3.505 5.314 4.432 164 HE1 TYR 25 HE1 TYR 25 8.374 4.685 4.141 165 HE2 TYR 25 HE2 TYR 25 4.415 3.362 3.247 166 HH TYR 25 HH TYR 25 7.698 2.455 3.459 167 H GLN 26 H GLN 26 5.190 10.483 6.340 168 HA GLN 26 HA GLN 26 2.653 10.895 7.493 169 1HB GLN 26 1HB GLN 26 4.733 11.695 8.532 170 2HB GLN 26 2HB GLN 26 4.941 12.854 7.223 171 1HG GLN 26 1HG GLN 26 2.902 13.993 7.878 172 2HG GLN 26 2HG GLN 26 2.637 12.815 9.159 173 1HE2 GLN 26 1HE2 GLN 26 5.515 12.704 9.776 174 2HE2 GLN 26 2HE2 GLN 26 5.839 14.146 10.677 175 H TRP 27 H TRP 27 4.340 12.634 4.898 176 HA TRP 27 HA TRP 27 2.229 14.406 4.290 177 1HB TRP 27 1HB TRP 27 4.476 14.890 3.555 178 2HB TRP 27 2HB TRP 27 4.546 13.398 2.627 179 HD1 TRP 27 HD1 TRP 27 2.655 16.784 2.582 180 HE1 TRP 27 HE1 TRP 27 2.082 17.334 0.132 181 HE3 TRP 27 HE3 TRP 27 4.367 12.506 0.378 182 HZ2 TRP 27 HZ2 TRP 27 2.326 16.104 -2.405 183 HZ3 TRP 27 HZ3 TRP 27 4.161 12.268 -2.063 184 HH2 TRP 27 HH2 TRP 27 3.162 14.034 -3.424 185 H PHE 28 H PHE 28 3.110 11.221 3.061 186 HA PHE 28 HA PHE 28 1.255 10.986 0.998 187 1HB PHE 28 1HB PHE 28 3.081 9.399 1.343 188 2HB PHE 28 2HB PHE 28 2.342 8.848 2.841 189 HD1 PHE 28 HD1 PHE 28 1.317 9.316 -0.725 190 HD2 PHE 28 HD2 PHE 28 1.289 6.832 2.730 191 HE1 PHE 28 HE1 PHE 28 0.087 7.590 -1.979 192 HE2 PHE 28 HE2 PHE 28 0.061 5.104 1.487 193 HZ PHE 28 HZ PHE 28 -0.543 5.480 -0.870 194 H TYR 29 H TYR 29 0.933 9.967 4.407 195 HA TYR 29 HA TYR 29 -1.762 9.139 4.108 196 1HB TYR 29 1HB TYR 29 -0.113 9.786 6.546 197 2HB TYR 29 2HB TYR 29 -1.780 9.231 6.644 198 HD1 TYR 29 HD1 TYR 29 1.400 8.119 7.059 199 HD2 TYR 29 HD2 TYR 29 -2.099 7.095 4.867 200 HE1 TYR 29 HE1 TYR 29 2.174 5.789 6.920 201 HE2 TYR 29 HE2 TYR 29 -1.333 4.763 4.722 202 HH TYR 29 HH TYR 29 1.214 3.544 6.590 203 H SER 30 H SER 30 -0.304 12.230 4.712 204 HA SER 30 HA SER 30 -2.582 13.537 5.760 205 1HB SER 30 1HB SER 30 -0.215 14.630 4.223 206 2HB SER 30 2HB SER 30 -1.434 15.633 5.009 207 HG SER 30 HG SER 30 0.329 13.775 6.256 208 H GLU 31 H GLU 31 -1.363 13.145 2.437 209 HA GLU 31 HA GLU 31 -3.520 14.585 1.270 210 1HB GLU 31 1HB GLU 31 -1.420 12.750 0.167 211 2HB GLU 31 2HB GLU 31 -2.742 13.315 -0.848 212 1HG GLU 31 1HG GLU 31 -0.649 14.967 0.539 213 2HG GLU 31 2HG GLU 31 -0.930 14.792 -1.196 214 H LEU 32 H LEU 32 -3.004 11.220 2.102 215 HA LEU 32 HA LEU 32 -5.331 10.201 0.866 216 1HB LEU 32 1HB LEU 32 -3.887 9.278 3.353 217 2HB LEU 32 2HB LEU 32 -5.172 8.382 2.567 218 HG LEU 32 HG LEU 32 -2.472 9.032 1.382 219 1HD1 LEU 32 1HD1 LEU 32 -3.675 6.425 2.298 220 2HD1 LEU 32 2HD1 LEU 32 -2.388 7.319 3.104 221 3HD1 LEU 32 3HD1 LEU 32 -2.109 6.620 1.510 222 1HD2 LEU 32 1HD2 LEU 32 -4.262 9.033 -0.308 223 2HD2 LEU 32 2HD2 LEU 32 -4.739 7.416 0.212 224 3HD2 LEU 32 3HD2 LEU 32 -3.152 7.678 -0.514 225 H LYS 33 H LYS 33 -4.728 11.697 3.990 226 HA LYS 33 HA LYS 33 -7.259 11.320 5.132 227 1HB LYS 33 1HB LYS 33 -5.338 12.035 6.430 228 2HB LYS 33 2HB LYS 33 -5.234 13.529 5.513 229 1HG LYS 33 1HG LYS 33 -7.418 14.208 6.421 230 2HG LYS 33 2HG LYS 33 -7.446 12.733 7.392 231 1HD LYS 33 1HD LYS 33 -5.423 13.423 8.544 232 2HD LYS 33 2HD LYS 33 -5.310 14.858 7.525 233 1HE LYS 33 1HE LYS 33 -7.443 15.654 8.430 234 2HE LYS 33 2HE LYS 33 -7.527 14.229 9.467 235 1HZ LYS 33 1HZ LYS 33 -6.669 16.139 10.666 236 2HZ LYS 33 2HZ LYS 33 -5.405 16.305 9.548 237 3HZ LYS 33 3HZ LYS 33 -5.483 14.931 10.544 238 H ARG 34 H ARG 34 -6.122 13.631 2.763 239 HA ARG 34 HA ARG 34 -8.582 15.190 3.004 240 1HB ARG 34 1HB ARG 34 -6.226 15.709 1.191 241 2HB ARG 34 2HB ARG 34 -7.537 16.817 1.563 242 1HG ARG 34 1HG ARG 34 -6.757 16.716 3.968 243 2HG ARG 34 2HG ARG 34 -5.318 15.897 3.361 244 1HD ARG 34 1HD ARG 34 -6.285 18.667 2.689 245 2HD ARG 34 2HD ARG 34 -4.816 18.224 3.557 246 HE ARG 34 HE ARG 34 -4.047 17.215 1.403 247 1HH1 ARG 34 1HH1 ARG 34 -6.420 19.799 1.453 248 2HH1 ARG 34 2HH1 ARG 34 -6.078 20.311 -0.168 249 1HH2 ARG 34 1HH2 ARG 34 -3.605 17.869 -0.727 250 2HH2 ARG 34 2HH2 ARG 34 -4.454 19.241 -1.402 251 H HIS 35 H HIS 35 -7.574 12.505 1.292 252 HA HIS 35 HA HIS 35 -9.485 13.120 -0.863 253 1HB HIS 35 1HB HIS 35 -6.755 11.869 -1.182 254 2HB HIS 35 2HB HIS 35 -7.997 11.817 -2.429 255 HD1 HIS 35 HD1 HIS 35 -5.292 13.900 -1.128 256 HD2 HIS 35 HD2 HIS 35 -8.713 14.460 -3.420 257 HE1 HIS 35 HE1 HIS 35 -4.983 16.118 -2.271 258 HE2 HIS 35 HE2 HIS 35 -6.995 16.361 -3.777 259 H ASN 36 H ASN 36 -7.582 10.420 0.468 260 HA ASN 36 HA ASN 36 -9.677 8.551 -0.267 261 1HB ASN 36 1HB ASN 36 -7.310 7.937 -0.630 262 2HB ASN 36 2HB ASN 36 -7.012 8.072 1.099 263 1HD2 ASN 36 1HD2 ASN 36 -7.871 6.505 2.491 264 2HD2 ASN 36 2HD2 ASN 36 -8.410 4.971 1.906 265 H VAL 37 H VAL 37 -11.336 9.190 1.119 266 HA VAL 37 HA VAL 37 -10.980 9.231 3.973 267 HB VAL 37 HB VAL 37 -13.556 9.134 2.386 268 1HG1 VAL 37 1HG1 VAL 37 -13.008 10.026 5.216 269 2HG1 VAL 37 2HG1 VAL 37 -13.869 8.565 4.727 270 3HG1 VAL 37 3HG1 VAL 37 -14.558 10.151 4.383 271 1HG2 VAL 37 1HG2 VAL 37 -13.604 11.562 2.588 272 2HG2 VAL 37 2HG2 VAL 37 -12.172 11.033 1.708 273 3HG2 VAL 37 3HG2 VAL 37 -12.035 11.538 3.392 274 H SER 38 H SER 38 -11.960 6.919 1.546 275 HA SER 38 HA SER 38 -12.762 5.010 3.602 276 1HB SER 38 1HB SER 38 -14.182 5.296 1.585 277 2HB SER 38 2HB SER 38 -12.850 4.708 0.592 278 HG SER 38 HG SER 38 -14.545 3.144 1.314 279 H HIS 39 H HIS 39 -11.192 4.013 0.598 280 HA HIS 39 HA HIS 39 -8.728 3.292 1.849 281 1HB HIS 39 1HB HIS 39 -9.012 0.876 1.886 282 2HB HIS 39 2HB HIS 39 -10.218 1.634 2.916 283 HD1 HIS 39 HD1 HIS 39 -12.693 1.831 1.753 284 HD2 HIS 39 HD2 HIS 39 -10.004 -0.860 0.068 285 HE1 HIS 39 HE1 HIS 39 -14.088 0.231 0.402 286 HE2 HIS 39 HE2 HIS 39 -12.463 -1.516 -0.416 287 H TYR 40 H TYR 40 -7.187 2.709 0.370 288 HA TYR 40 HA TYR 40 -8.128 2.439 -2.403 289 1HB TYR 40 1HB TYR 40 -5.992 3.237 -3.167 290 2HB TYR 40 2HB TYR 40 -6.609 4.363 -1.972 291 HD1 TYR 40 HD1 TYR 40 -4.067 1.794 -2.651 292 HD2 TYR 40 HD2 TYR 40 -5.454 4.723 0.103 293 HE1 TYR 40 HE1 TYR 40 -1.937 1.644 -1.433 294 HE2 TYR 40 HE2 TYR 40 -3.330 4.581 1.330 295 HH TYR 40 HH TYR 40 -0.585 3.072 0.106 296 H ILE 41 H ILE 41 -7.552 0.710 -3.603 297 HA ILE 41 HA ILE 41 -6.316 -1.521 -2.149 298 HB ILE 41 HB ILE 41 -7.872 -1.586 -4.743 299 1HG1 ILE 41 1HG1 ILE 41 -8.795 -2.283 -1.944 300 2HG1 ILE 41 2HG1 ILE 41 -9.255 -0.834 -2.830 301 1HG2 ILE 41 1HG2 ILE 41 -6.988 -3.792 -2.887 302 2HG2 ILE 41 2HG2 ILE 41 -6.342 -3.453 -4.492 303 3HG2 ILE 41 3HG2 ILE 41 -8.009 -3.998 -4.309 304 1HD1 ILE 41 1HD1 ILE 41 -10.353 -2.218 -4.519 305 2HD1 ILE 41 2HD1 ILE 41 -11.013 -2.495 -2.908 306 3HD1 ILE 41 3HD1 ILE 41 -9.903 -3.666 -3.617 307 H TYR 42 H TYR 42 -4.212 -1.696 -2.485 308 HA TYR 42 HA TYR 42 -3.089 -0.941 -5.089 309 1HB TYR 42 1HB TYR 42 -2.200 0.038 -2.905 310 2HB TYR 42 2HB TYR 42 -1.568 -1.565 -2.556 311 HD1 TYR 42 HD1 TYR 42 -1.026 1.524 -4.277 312 HD2 TYR 42 HD2 TYR 42 0.118 -2.569 -4.176 313 HE1 TYR 42 HE1 TYR 42 0.985 2.061 -5.586 314 HE2 TYR 42 HE2 TYR 42 2.132 -2.045 -5.483 315 HH TYR 42 HH TYR 42 2.982 -0.390 -6.973 316 H TYR 43 H TYR 43 -2.614 -2.512 -6.473 317 HA TYR 43 HA TYR 43 -2.391 -5.263 -5.494 318 1HB TYR 43 1HB TYR 43 -2.487 -4.221 -8.338 319 2HB TYR 43 2HB TYR 43 -2.561 -5.910 -7.852 320 HD1 TYR 43 HD1 TYR 43 -4.395 -2.706 -7.837 321 HD2 TYR 43 HD2 TYR 43 -4.622 -6.894 -7.130 322 HE1 TYR 43 HE1 TYR 43 -6.845 -2.549 -7.734 323 HE2 TYR 43 HE2 TYR 43 -7.074 -6.747 -7.027 324 HH TYR 43 HH TYR 43 -8.820 -5.117 -6.613 325 H LEU 44 H LEU 44 -0.391 -5.902 -4.931 326 HA LEU 44 HA LEU 44 1.948 -4.515 -5.707 327 1HB LEU 44 1HB LEU 44 1.500 -7.169 -4.380 328 2HB LEU 44 2HB LEU 44 3.111 -6.673 -4.863 329 HG LEU 44 HG LEU 44 2.628 -4.541 -3.467 330 1HD1 LEU 44 1HD1 LEU 44 0.265 -4.890 -3.106 331 2HD1 LEU 44 2HD1 LEU 44 1.124 -4.931 -1.566 332 3HD1 LEU 44 3HD1 LEU 44 0.587 -6.435 -2.318 333 1HD2 LEU 44 1HD2 LEU 44 3.051 -7.217 -2.146 334 2HD2 LEU 44 2HD2 LEU 44 3.448 -5.648 -1.447 335 3HD2 LEU 44 3HD2 LEU 44 4.297 -6.212 -2.886 336 H ALA 45 H ALA 45 3.650 -5.150 -7.034 337 HA ALA 45 HA ALA 45 4.658 -5.913 -8.902 338 1HB ALA 45 1HB ALA 45 2.613 -8.122 -8.952 339 2HB ALA 45 2HB ALA 45 4.156 -8.177 -8.098 340 3HB ALA 45 3HB ALA 45 4.126 -8.060 -9.858 341 H THR 46 H THR 46 1.134 -6.242 -9.272 342 HA THR 46 HA THR 46 1.098 -5.541 -12.010 343 HB THR 46 HB THR 46 -1.166 -5.166 -10.045 344 HG1 THR 46 HG1 THR 46 -0.039 -7.496 -11.191 345 1HG2 THR 46 1HG2 THR 46 -1.113 -5.812 -12.996 346 2HG2 THR 46 2HG2 THR 46 -1.572 -4.268 -12.281 347 3HG2 THR 46 3HG2 THR 46 -2.562 -5.700 -11.998 348 H GLU 47 H GLU 47 1.058 -3.687 -9.060 349 HA GLU 47 HA GLU 47 1.481 -1.515 -8.626 350 1HB GLU 47 1HB GLU 47 2.079 -1.390 -11.583 351 2HB GLU 47 2HB GLU 47 2.296 -0.033 -10.487 352 1HG GLU 47 1HG GLU 47 3.677 -2.698 -10.258 353 2HG GLU 47 2HG GLU 47 4.387 -1.225 -10.919 354 H ASN 48 H ASN 48 -1.181 -2.587 -9.878 355 HA ASN 48 HA ASN 48 -2.379 -0.099 -10.741 356 1HB ASN 48 1HB ASN 48 -3.485 -2.873 -10.351 357 2HB ASN 48 2HB ASN 48 -4.533 -1.491 -10.656 358 1HD2 ASN 48 1HD2 ASN 48 -4.313 -3.741 -12.328 359 2HD2 ASN 48 2HD2 ASN 48 -3.663 -3.211 -13.848 360 H VAL 49 H VAL 49 -3.594 1.234 -9.576 361 HA VAL 49 HA VAL 49 -4.043 0.533 -6.744 362 HB VAL 49 HB VAL 49 -3.688 3.351 -7.752 363 1HG1 VAL 49 1HG1 VAL 49 -4.791 3.103 -5.602 364 2HG1 VAL 49 2HG1 VAL 49 -3.193 3.825 -5.402 365 3HG1 VAL 49 3HG1 VAL 49 -3.450 2.125 -5.010 366 1HG2 VAL 49 1HG2 VAL 49 -1.371 3.279 -6.960 367 2HG2 VAL 49 2HG2 VAL 49 -1.639 2.155 -8.292 368 3HG2 VAL 49 3HG2 VAL 49 -1.538 1.553 -6.638 369 H HIS 50 H HIS 50 -6.123 0.399 -6.236 370 HA HIS 50 HA HIS 50 -8.068 1.935 -7.835 371 1HB HIS 50 1HB HIS 50 -8.329 -0.672 -6.346 372 2HB HIS 50 2HB HIS 50 -9.741 0.269 -6.803 373 HD1 HIS 50 HD1 HIS 50 -10.756 -0.999 -8.667 374 HD2 HIS 50 HD2 HIS 50 -6.629 -0.646 -9.089 375 HE1 HIS 50 HE1 HIS 50 -10.213 -1.997 -10.912 376 HE2 HIS 50 HE2 HIS 50 -7.706 -1.801 -11.143 377 H ILE 51 H ILE 51 -8.069 3.843 -6.730 378 HA ILE 51 HA ILE 51 -8.265 3.827 -3.821 379 HB ILE 51 HB ILE 51 -8.110 6.179 -5.707 380 1HG1 ILE 51 1HG1 ILE 51 -5.894 4.864 -4.123 381 2HG1 ILE 51 2HG1 ILE 51 -6.155 4.640 -5.851 382 1HG2 ILE 51 1HG2 ILE 51 -7.394 7.415 -3.703 383 2HG2 ILE 51 2HG2 ILE 51 -7.671 5.973 -2.727 384 3HG2 ILE 51 3HG2 ILE 51 -9.024 6.764 -3.535 385 1HD1 ILE 51 1HD1 ILE 51 -5.526 7.235 -4.481 386 2HD1 ILE 51 2HD1 ILE 51 -5.795 7.016 -6.211 387 3HD1 ILE 51 3HD1 ILE 51 -4.408 6.255 -5.430 388 H VAL 52 H VAL 52 -10.328 3.327 -3.207 389 HA VAL 52 HA VAL 52 -12.555 4.738 -4.430 390 HB VAL 52 HB VAL 52 -12.653 2.946 -1.996 391 1HG1 VAL 52 1HG1 VAL 52 -15.021 2.684 -2.664 392 2HG1 VAL 52 2HG1 VAL 52 -14.762 3.874 -3.944 393 3HG1 VAL 52 3HG1 VAL 52 -14.600 4.346 -2.252 394 1HG2 VAL 52 1HG2 VAL 52 -13.062 2.179 -4.888 395 2HG2 VAL 52 2HG2 VAL 52 -13.299 1.131 -3.489 396 3HG2 VAL 52 3HG2 VAL 52 -11.686 1.719 -3.885 397 H LEU 53 H LEU 53 -12.632 6.818 -3.915 398 HA LEU 53 HA LEU 53 -11.434 8.102 -1.784 399 1HB LEU 53 1HB LEU 53 -13.972 8.930 -3.186 400 2HB LEU 53 2HB LEU 53 -12.908 9.985 -2.276 401 HG LEU 53 HG LEU 53 -12.190 8.549 -4.833 402 1HD1 LEU 53 1HD1 LEU 53 -12.272 10.739 -5.856 403 2HD1 LEU 53 2HD1 LEU 53 -12.714 11.471 -4.312 404 3HD1 LEU 53 3HD1 LEU 53 -13.827 10.360 -5.112 405 1HD2 LEU 53 1HD2 LEU 53 -10.164 9.951 -4.758 406 2HD2 LEU 53 2HD2 LEU 53 -10.251 8.823 -3.402 407 3HD2 LEU 53 3HD2 LEU 53 -10.637 10.528 -3.161 408 H LYS 54 H LYS 54 -14.859 7.310 -2.080 409 HA LYS 54 HA LYS 54 -15.039 6.768 0.763 410 1HB LYS 54 1HB LYS 54 -15.554 9.116 0.770 411 2HB LYS 54 2HB LYS 54 -16.586 8.958 -0.641 412 1HG LYS 54 1HG LYS 54 -18.243 7.778 0.639 413 2HG LYS 54 2HG LYS 54 -17.186 7.750 2.051 414 1HD LYS 54 1HD LYS 54 -18.933 9.499 2.189 415 2HD LYS 54 2HD LYS 54 -17.298 10.152 2.241 416 1HE LYS 54 1HE LYS 54 -18.671 11.533 0.819 417 2HE LYS 54 2HE LYS 54 -17.469 10.698 -0.161 418 1HZ LYS 54 1HZ LYS 54 -20.358 10.036 0.085 419 2HZ LYS 54 2HZ LYS 54 -19.230 9.045 -0.695 420 3HZ LYS 54 3HZ LYS 54 -19.536 10.594 -1.291 421 H ASN 55 H ASN 55 -17.237 7.454 -1.918 422 HA ASN 55 HA ASN 55 -17.592 4.697 -2.597 423 1HB ASN 55 1HB ASN 55 -19.929 4.438 -2.018 424 2HB ASN 55 2HB ASN 55 -19.035 4.841 -0.558 425 1HD2 ASN 55 1HD2 ASN 55 -21.841 5.116 -1.095 426 2HD2 ASN 55 2HD2 ASN 55 -22.230 6.796 -0.901 427 H ASP 56 H ASP 56 -16.981 7.412 -3.593 428 HA ASP 56 HA ASP 56 -19.247 8.076 -5.302 429 1HB ASP 56 1HB ASP 56 -16.717 9.685 -4.947 430 2HB ASP 56 2HB ASP 56 -18.296 10.246 -5.487 431 H ASN 57 H ASN 57 -15.744 8.386 -5.704 432 HA ASN 57 HA ASN 57 -15.968 6.928 -8.241 433 1HB ASN 57 1HB ASN 57 -15.819 9.429 -8.560 434 2HB ASN 57 2HB ASN 57 -14.232 9.367 -7.803 435 1HD2 ASN 57 1HD2 ASN 57 -13.130 10.071 -9.609 436 2HD2 ASN 57 2HD2 ASN 57 -12.957 9.105 -11.037 437 H THR 58 H THR 58 -14.037 5.890 -8.924 438 HA THR 58 HA THR 58 -12.144 5.385 -6.726 439 HB THR 58 HB THR 58 -12.901 3.471 -8.941 440 HG1 THR 58 HG1 THR 58 -14.467 4.054 -7.071 441 1HG2 THR 58 1HG2 THR 58 -11.710 1.821 -7.566 442 2HG2 THR 58 2HG2 THR 58 -11.280 3.090 -6.418 443 3HG2 THR 58 3HG2 THR 58 -10.644 3.134 -8.062 444 H VAL 59 H VAL 59 -10.191 6.131 -7.103 445 HA VAL 59 HA VAL 59 -9.387 6.971 -9.753 446 HB VAL 59 HB VAL 59 -7.615 6.940 -7.317 447 1HG1 VAL 59 1HG1 VAL 59 -6.575 7.481 -9.451 448 2HG1 VAL 59 2HG1 VAL 59 -6.604 8.890 -8.390 449 3HG1 VAL 59 3HG1 VAL 59 -7.758 8.760 -9.716 450 1HG2 VAL 59 1HG2 VAL 59 -9.722 7.969 -6.633 451 2HG2 VAL 59 2HG2 VAL 59 -9.641 9.065 -8.012 452 3HG2 VAL 59 3HG2 VAL 59 -8.430 9.167 -6.735 453 H LEU 60 H LEU 60 -8.556 5.542 -11.148 454 HA LEU 60 HA LEU 60 -7.151 3.197 -10.090 455 1HB LEU 60 1HB LEU 60 -9.111 3.060 -11.769 456 2HB LEU 60 2HB LEU 60 -7.952 3.616 -12.960 457 HG LEU 60 HG LEU 60 -7.519 1.129 -11.308 458 1HD1 LEU 60 1HD1 LEU 60 -8.776 1.382 -14.035 459 2HD1 LEU 60 2HD1 LEU 60 -9.577 0.853 -12.554 460 3HD1 LEU 60 3HD1 LEU 60 -8.297 -0.129 -13.265 461 1HD2 LEU 60 1HD2 LEU 60 -5.514 2.067 -12.347 462 2HD2 LEU 60 2HD2 LEU 60 -6.319 2.064 -13.918 463 3HD2 LEU 60 3HD2 LEU 60 -5.965 0.539 -13.102 464 H LEU 61 H LEU 61 -5.040 3.395 -9.943 465 HA LEU 61 HA LEU 61 -3.610 5.029 -11.948 466 1HB LEU 61 1HB LEU 61 -2.606 4.402 -9.181 467 2HB LEU 61 2HB LEU 61 -2.001 5.608 -10.302 468 HG LEU 61 HG LEU 61 -4.713 5.764 -8.993 469 1HD1 LEU 61 1HD1 LEU 61 -3.731 7.369 -7.477 470 2HD1 LEU 61 2HD1 LEU 61 -2.148 7.145 -8.220 471 3HD1 LEU 61 3HD1 LEU 61 -2.902 5.822 -7.330 472 1HD2 LEU 61 1HD2 LEU 61 -3.042 7.794 -10.472 473 2HD2 LEU 61 2HD2 LEU 61 -4.597 8.104 -9.698 474 3HD2 LEU 61 3HD2 LEU 61 -4.502 7.010 -11.079 475 H LYS 62 H LYS 62 -1.409 4.322 -12.408 476 HA LYS 62 HA LYS 62 -0.778 1.579 -11.586 477 1HB LYS 62 1HB LYS 62 -1.508 1.603 -13.980 478 2HB LYS 62 2HB LYS 62 -0.201 2.726 -14.331 479 1HG LYS 62 1HG LYS 62 1.431 1.039 -13.639 480 2HG LYS 62 2HG LYS 62 0.117 -0.086 -13.298 481 1HD LYS 62 1HD LYS 62 0.682 1.137 -15.997 482 2HD LYS 62 2HD LYS 62 1.200 -0.472 -15.496 483 1HE LYS 62 1HE LYS 62 -1.666 0.459 -15.612 484 2HE LYS 62 2HE LYS 62 -0.864 -0.471 -16.874 485 1HZ LYS 62 1HZ LYS 62 -0.471 -2.225 -15.178 486 2HZ LYS 62 2HZ LYS 62 -2.110 -1.955 -15.520 487 3HZ LYS 62 3HZ LYS 62 -1.434 -1.341 -14.095 488 H GLY 63 H GLY 63 0.962 1.663 -10.359 489 1HA GLY 63 1HA GLY 63 2.378 3.967 -9.774 490 2HA GLY 63 2HA GLY 63 2.940 2.344 -9.418 491 H LEU 64 H LEU 64 3.629 1.229 -11.680 492 HA LEU 64 HA LEU 64 5.258 3.138 -13.194 493 1HB LEU 64 1HB LEU 64 6.254 0.576 -11.947 494 2HB LEU 64 2HB LEU 64 7.138 1.485 -13.154 495 HG LEU 64 HG LEU 64 6.377 2.561 -10.433 496 1HD1 LEU 64 1HD1 LEU 64 9.003 1.461 -11.431 497 2HD1 LEU 64 2HD1 LEU 64 7.955 0.718 -10.223 498 3HD1 LEU 64 3HD1 LEU 64 8.745 2.257 -9.879 499 1HD2 LEU 64 1HD2 LEU 64 8.245 3.608 -12.562 500 2HD2 LEU 64 2HD2 LEU 64 7.990 4.321 -10.970 501 3HD2 LEU 64 3HD2 LEU 64 6.672 4.286 -12.141 502 H LYS 65 H LYS 65 5.120 -0.376 -13.116 503 HA LYS 65 HA LYS 65 3.553 -0.615 -15.505 504 1HB LYS 65 1HB LYS 65 5.691 -0.006 -16.512 505 2HB LYS 65 2HB LYS 65 6.516 -1.235 -15.570 506 1HG LYS 65 1HG LYS 65 5.020 -2.917 -16.757 507 2HG LYS 65 2HG LYS 65 4.623 -1.601 -17.864 508 1HD LYS 65 1HD LYS 65 6.941 -1.348 -18.474 509 2HD LYS 65 2HD LYS 65 7.428 -2.538 -17.263 510 1HE LYS 65 1HE LYS 65 5.968 -4.193 -18.498 511 2HE LYS 65 2HE LYS 65 5.856 -2.994 -19.788 512 1HZ LYS 65 1HZ LYS 65 7.619 -4.694 -20.095 513 2HZ LYS 65 2HZ LYS 65 8.428 -4.055 -18.750 514 3HZ LYS 65 3HZ LYS 65 8.193 -3.101 -20.134 515 H ASN 66 H ASN 66 6.170 -2.355 -13.862 516 HA ASN 66 HA ASN 66 4.477 -4.109 -12.434 517 1HB ASN 66 1HB ASN 66 4.377 -5.023 -14.881 518 2HB ASN 66 2HB ASN 66 6.030 -5.544 -14.584 519 1HD2 ASN 66 1HD2 ASN 66 6.412 -7.056 -12.845 520 2HD2 ASN 66 2HD2 ASN 66 5.152 -8.130 -12.351 521 H ILE 67 H ILE 67 5.666 -4.942 -10.785 522 HA ILE 67 HA ILE 67 8.563 -5.031 -11.009 523 HB ILE 67 HB ILE 67 7.858 -2.660 -10.402 524 1HG1 ILE 67 1HG1 ILE 67 9.548 -3.940 -8.265 525 2HG1 ILE 67 2HG1 ILE 67 10.114 -3.782 -9.925 526 1HG2 ILE 67 1HG2 ILE 67 7.260 -2.255 -8.055 527 2HG2 ILE 67 2HG2 ILE 67 7.147 -3.996 -7.797 528 3HG2 ILE 67 3HG2 ILE 67 6.029 -3.195 -8.901 529 1HD1 ILE 67 1HD1 ILE 67 9.316 -1.549 -8.081 530 2HD1 ILE 67 2HD1 ILE 67 9.773 -1.352 -9.774 531 3HD1 ILE 67 3HD1 ILE 67 10.950 -1.959 -8.604 532 H VAL 68 H VAL 68 9.548 -6.217 -9.294 533 HA VAL 68 HA VAL 68 9.692 -7.790 -7.656 534 HB VAL 68 HB VAL 68 6.812 -7.128 -7.017 535 1HG1 VAL 68 1HG1 VAL 68 7.310 -8.090 -4.809 536 2HG1 VAL 68 2HG1 VAL 68 8.918 -8.539 -5.379 537 3HG1 VAL 68 3HG1 VAL 68 7.488 -9.279 -6.102 538 1HG2 VAL 68 1HG2 VAL 68 8.223 -5.155 -6.816 539 2HG2 VAL 68 2HG2 VAL 68 9.354 -6.050 -5.799 540 3HG2 VAL 68 3HG2 VAL 68 7.720 -5.723 -5.224 541 H SER 69 H SER 69 9.147 -10.036 -7.345 542 HA SER 69 HA SER 69 7.820 -11.154 -9.683 543 1HB SER 69 1HB SER 69 10.080 -11.956 -9.055 544 2HB SER 69 2HB SER 69 9.431 -12.534 -7.522 545 HG SER 69 HG SER 69 7.880 -13.688 -9.103 546 H VAL 70 H VAL 70 7.456 -10.925 -6.222 547 HA VAL 70 HA VAL 70 5.824 -11.497 -4.770 548 HB VAL 70 HB VAL 70 4.238 -12.097 -7.268 549 1HG1 VAL 70 1HG1 VAL 70 3.280 -11.914 -4.411 550 2HG1 VAL 70 2HG1 VAL 70 3.343 -13.379 -5.390 551 3HG1 VAL 70 3HG1 VAL 70 2.248 -12.067 -5.833 552 1HG2 VAL 70 1HG2 VAL 70 4.216 -9.734 -5.394 553 2HG2 VAL 70 2HG2 VAL 70 3.122 -9.968 -6.759 554 3HG2 VAL 70 3HG2 VAL 70 4.850 -9.758 -7.040 555 H LYS 71 H LYS 71 5.501 -13.258 -3.520 556 HA LYS 71 HA LYS 71 5.894 -15.899 -4.743 557 1HB LYS 71 1HB LYS 71 8.057 -14.991 -3.826 558 2HB LYS 71 2HB LYS 71 7.308 -14.980 -2.235 559 1HG LYS 71 1HG LYS 71 6.994 -17.412 -2.390 560 2HG LYS 71 2HG LYS 71 7.808 -17.399 -3.957 561 1HD LYS 71 1HD LYS 71 9.815 -16.471 -2.888 562 2HD LYS 71 2HD LYS 71 8.998 -16.525 -1.327 563 1HE LYS 71 1HE LYS 71 8.708 -18.997 -1.699 564 2HE LYS 71 2HE LYS 71 9.790 -18.836 -3.078 565 1HZ LYS 71 1HZ LYS 71 11.505 -18.001 -1.602 566 2HZ LYS 71 2HZ LYS 71 10.977 -19.526 -1.087 567 3HZ LYS 71 3HZ LYS 71 10.462 -18.130 -0.272 568 H PHE 72 H PHE 72 4.630 -17.476 -3.861 569 HA PHE 72 HA PHE 72 2.525 -16.547 -2.127 570 1HB PHE 72 1HB PHE 72 2.965 -19.103 -3.649 571 2HB PHE 72 2HB PHE 72 1.613 -18.895 -2.541 572 HD1 PHE 72 HD1 PHE 72 2.910 -18.195 -5.824 573 HD2 PHE 72 HD2 PHE 72 -0.057 -17.094 -2.978 574 HE1 PHE 72 HE1 PHE 72 1.611 -17.097 -7.605 575 HE2 PHE 72 HE2 PHE 72 -1.363 -15.999 -4.751 576 HZ PHE 72 HZ PHE 72 -0.526 -15.998 -7.067 577 H SER 73 H SER 73 5.176 -16.879 -0.915 578 HA SER 73 HA SER 73 4.807 -19.078 0.938 579 1HB SER 73 1HB SER 73 6.848 -16.838 0.936 580 2HB SER 73 2HB SER 73 6.872 -18.253 1.992 581 HG SER 73 HG SER 73 6.911 -19.507 -0.017 582 H LYS 74 H LYS 74 2.640 -18.120 1.302 583 HA LYS 74 HA LYS 74 2.159 -15.660 2.519 584 1HB LYS 74 1HB LYS 74 0.540 -18.190 2.846 585 2HB LYS 74 2HB LYS 74 -0.044 -16.534 2.967 586 1HG LYS 74 1HG LYS 74 0.285 -16.171 0.631 587 2HG LYS 74 2HG LYS 74 1.123 -17.714 0.458 588 1HD LYS 74 1HD LYS 74 -1.048 -18.785 1.271 589 2HD LYS 74 2HD LYS 74 -1.794 -17.212 0.973 590 1HE LYS 74 1HE LYS 74 -1.092 -17.298 -1.354 591 2HE LYS 74 2HE LYS 74 -0.278 -18.836 -1.069 592 1HZ LYS 74 1HZ LYS 74 -3.177 -18.261 -1.147 593 2HZ LYS 74 2HZ LYS 74 -2.585 -19.637 -0.348 594 3HZ LYS 74 3HZ LYS 74 -2.295 -19.431 -2.007 595 H ASP 75 H ASP 75 2.931 -14.978 4.403 596 HA ASP 75 HA ASP 75 2.630 -16.660 6.762 597 1HB ASP 75 1HB ASP 75 4.893 -17.187 5.974 598 2HB ASP 75 2HB ASP 75 5.296 -15.471 5.964 599 H ARG 76 H ARG 76 1.882 -15.526 8.392 600 HA ARG 76 HA ARG 76 1.347 -12.747 8.145 601 1HB ARG 76 1HB ARG 76 -0.158 -14.253 9.317 602 2HB ARG 76 2HB ARG 76 1.096 -14.644 10.482 603 1HG ARG 76 1HG ARG 76 1.069 -12.265 11.208 604 2HG ARG 76 2HG ARG 76 -0.319 -12.016 10.147 605 1HD ARG 76 1HD ARG 76 -1.634 -13.585 11.374 606 2HD ARG 76 2HD ARG 76 -0.236 -14.102 12.316 607 HE ARG 76 HE ARG 76 -1.732 -11.603 12.632 608 1HH1 ARG 76 1HH1 ARG 76 0.828 -13.741 13.691 609 2HH1 ARG 76 2HH1 ARG 76 1.077 -12.913 15.200 610 1HH2 ARG 76 1HH2 ARG 76 -1.430 -10.522 14.619 611 2HH2 ARG 76 2HH2 ARG 76 -0.220 -11.084 15.725 612 H HIS 77 H HIS 77 3.805 -14.604 9.832 613 HA HIS 77 HA HIS 77 4.614 -12.531 11.600 614 1HB HIS 77 1HB HIS 77 5.045 -14.898 12.070 615 2HB HIS 77 2HB HIS 77 6.119 -14.987 10.680 616 HD1 HIS 77 HD1 HIS 77 5.884 -13.089 13.977 617 HD2 HIS 77 HD2 HIS 77 8.712 -14.540 11.292 618 HE1 HIS 77 HE1 HIS 77 8.121 -12.669 15.049 619 HE2 HIS 77 HE2 HIS 77 9.782 -13.793 13.523 620 H LEU 78 H LEU 78 5.771 -13.628 8.438 621 HA LEU 78 HA LEU 78 8.031 -11.971 8.280 622 1HB LEU 78 1HB LEU 78 7.540 -13.852 6.741 623 2HB LEU 78 2HB LEU 78 6.266 -12.896 6.009 624 HG LEU 78 HG LEU 78 7.922 -11.264 5.221 625 1HD1 LEU 78 1HD1 LEU 78 10.306 -11.709 5.441 626 2HD1 LEU 78 2HD1 LEU 78 9.960 -13.132 6.421 627 3HD1 LEU 78 3HD1 LEU 78 9.554 -11.527 7.026 628 1HD2 LEU 78 1HD2 LEU 78 7.335 -13.142 3.780 629 2HD2 LEU 78 2HD2 LEU 78 8.611 -14.114 4.515 630 3HD2 LEU 78 3HD2 LEU 78 9.026 -12.688 3.565 631 H ILE 79 H ILE 79 4.640 -11.349 7.572 632 HA ILE 79 HA ILE 79 4.908 -8.806 6.399 633 HB ILE 79 HB ILE 79 2.667 -9.795 8.181 634 1HG1 ILE 79 1HG1 ILE 79 2.921 -9.905 5.166 635 2HG1 ILE 79 2HG1 ILE 79 3.154 -11.278 6.241 636 1HG2 ILE 79 1HG2 ILE 79 2.631 -7.380 7.865 637 2HG2 ILE 79 2HG2 ILE 79 1.296 -8.142 7.000 638 3HG2 ILE 79 3HG2 ILE 79 2.719 -7.593 6.115 639 1HD1 ILE 79 1HD1 ILE 79 0.958 -11.297 5.198 640 2HD1 ILE 79 2HD1 ILE 79 0.598 -9.727 5.916 641 3HD1 ILE 79 3HD1 ILE 79 0.837 -11.136 6.950 642 H GLU 80 H GLU 80 4.487 -9.824 9.762 643 HA GLU 80 HA GLU 80 4.583 -7.320 11.002 644 1HB GLU 80 1HB GLU 80 3.924 -9.388 12.146 645 2HB GLU 80 2HB GLU 80 5.561 -10.008 11.992 646 1HG GLU 80 1HG GLU 80 6.303 -8.029 13.376 647 2HG GLU 80 2HG GLU 80 4.593 -7.741 13.703 648 H THR 81 H THR 81 7.184 -9.644 10.329 649 HA THR 81 HA THR 81 9.317 -8.208 11.392 650 HB THR 81 HB THR 81 9.414 -10.047 8.992 651 HG1 THR 81 HG1 THR 81 9.081 -10.501 11.748 652 1HG2 THR 81 1HG2 THR 81 11.491 -8.801 9.386 653 2HG2 THR 81 2HG2 THR 81 11.697 -10.515 9.744 654 3HG2 THR 81 3HG2 THR 81 11.507 -9.356 11.060 655 H THR 82 H THR 82 7.979 -8.155 8.097 656 HA THR 82 HA THR 82 9.901 -6.359 7.046 657 HB THR 82 HB THR 82 7.071 -6.800 6.067 658 HG1 THR 82 HG1 THR 82 8.080 -8.791 6.105 659 1HG2 THR 82 1HG2 THR 82 8.026 -6.182 3.875 660 2HG2 THR 82 2HG2 THR 82 9.569 -5.840 4.658 661 3HG2 THR 82 3HG2 THR 82 8.149 -4.867 5.044 662 H SER 83 H SER 83 6.690 -5.894 8.468 663 HA SER 83 HA SER 83 6.466 -3.132 8.038 664 1HB SER 83 1HB SER 83 4.574 -4.535 8.721 665 2HB SER 83 2HB SER 83 5.341 -4.833 10.279 666 HG SER 83 HG SER 83 3.768 -2.791 9.531 667 H ASN 84 H ASN 84 7.851 -4.972 10.749 668 HA ASN 84 HA ASN 84 8.583 -2.641 12.216 669 1HB ASN 84 1HB ASN 84 9.355 -5.543 12.448 670 2HB ASN 84 2HB ASN 84 10.053 -4.306 13.487 671 1HD2 ASN 84 1HD2 ASN 84 8.399 -6.543 14.262 672 2HD2 ASN 84 2HD2 ASN 84 6.992 -5.875 15.009 673 H LYS 85 H LYS 85 10.128 -4.586 9.766 674 HA LYS 85 HA LYS 85 12.756 -3.662 9.963 675 1HB LYS 85 1HB LYS 85 11.928 -5.462 8.418 676 2HB LYS 85 2HB LYS 85 11.237 -4.205 7.403 677 1HG LYS 85 1HG LYS 85 13.222 -4.618 6.338 678 2HG LYS 85 2HG LYS 85 13.660 -3.265 7.380 679 1HD LYS 85 1HD LYS 85 15.388 -4.917 7.522 680 2HD LYS 85 2HD LYS 85 14.505 -4.910 9.051 681 1HE LYS 85 1HE LYS 85 13.227 -6.856 8.335 682 2HE LYS 85 2HE LYS 85 14.057 -6.845 6.779 683 1HZ LYS 85 1HZ LYS 85 15.044 -8.480 8.191 684 2HZ LYS 85 2HZ LYS 85 15.278 -7.353 9.438 685 3HZ LYS 85 3HZ LYS 85 16.154 -7.210 7.989 686 H LEU 86 H LEU 86 9.980 -2.322 8.228 687 HA LEU 86 HA LEU 86 11.362 -0.067 7.184 688 1HB LEU 86 1HB LEU 86 9.320 -0.938 6.164 689 2HB LEU 86 2HB LEU 86 8.412 -0.537 7.609 690 HG LEU 86 HG LEU 86 8.990 1.876 7.196 691 1HD1 LEU 86 1HD1 LEU 86 9.720 2.509 4.956 692 2HD1 LEU 86 2HD1 LEU 86 9.911 0.808 4.532 693 3HD1 LEU 86 3HD1 LEU 86 10.937 1.527 5.772 694 1HD2 LEU 86 1HD2 LEU 86 7.431 0.463 5.039 695 2HD2 LEU 86 2HD2 LEU 86 7.311 2.171 5.462 696 3HD2 LEU 86 3HD2 LEU 86 6.811 0.938 6.621 697 H LYS 87 H LYS 87 9.147 -0.489 9.944 698 HA LYS 87 HA LYS 87 9.149 2.254 10.627 699 1HB LYS 87 1HB LYS 87 8.336 -0.198 12.179 700 2HB LYS 87 2HB LYS 87 8.191 1.432 12.834 701 1HG LYS 87 1HG LYS 87 6.827 1.979 10.761 702 2HG LYS 87 2HG LYS 87 6.771 0.239 10.472 703 1HD LYS 87 1HD LYS 87 6.046 1.075 13.198 704 2HD LYS 87 2HD LYS 87 4.948 1.626 11.935 705 1HE LYS 87 1HE LYS 87 4.117 -0.454 12.719 706 2HE LYS 87 2HE LYS 87 4.832 -0.751 11.134 707 1HZ LYS 87 1HZ LYS 87 6.790 -1.634 12.222 708 2HZ LYS 87 2HZ LYS 87 5.410 -2.467 12.740 709 3HZ LYS 87 3HZ LYS 87 6.131 -1.314 13.750 710 H SER 88 H SER 88 11.458 -0.199 11.219 711 HA SER 88 HA SER 88 12.640 1.340 13.409 712 1HB SER 88 1HB SER 88 12.321 -1.143 13.644 713 2HB SER 88 2HB SER 88 13.515 -1.358 12.364 714 HG SER 88 HG SER 88 14.120 0.217 14.629 715 H ARG 89 H ARG 89 13.717 -0.212 10.350 716 HA ARG 89 HA ARG 89 16.215 1.260 10.496 717 1HB ARG 89 1HB ARG 89 15.173 -0.990 8.867 718 2HB ARG 89 2HB ARG 89 16.412 0.017 8.134 719 1HG ARG 89 1HG ARG 89 17.438 -1.882 9.164 720 2HG ARG 89 2HG ARG 89 17.874 -0.436 10.073 721 1HD ARG 89 1HD ARG 89 15.462 -1.831 11.001 722 2HD ARG 89 2HD ARG 89 16.963 -2.739 11.172 723 HE ARG 89 HE ARG 89 16.867 0.006 12.209 724 1HH1 ARG 89 1HH1 ARG 89 16.999 -3.445 12.799 725 2HH1 ARG 89 2HH1 ARG 89 17.418 -3.282 14.476 726 1HH2 ARG 89 1HH2 ARG 89 17.402 0.229 14.442 727 2HH2 ARG 89 2HH2 ARG 89 17.628 -1.198 15.405 728 H GLU 90 H GLU 90 13.175 1.614 8.920 729 HA GLU 90 HA GLU 90 12.409 2.837 7.167 730 1HB GLU 90 1HB GLU 90 14.714 4.646 7.917 731 2HB GLU 90 2HB GLU 90 13.365 5.090 6.879 732 1HG GLU 90 1HG GLU 90 11.823 4.797 8.736 733 2HG GLU 90 2HG GLU 90 13.161 4.314 9.781 734 H ILE 91 H ILE 91 13.113 1.037 5.830 735 HA ILE 91 HA ILE 91 15.573 1.270 4.372 736 HB ILE 91 HB ILE 91 14.565 -0.666 3.021 737 1HG1 ILE 91 1HG1 ILE 91 12.603 -0.611 5.335 738 2HG1 ILE 91 2HG1 ILE 91 12.202 -0.252 3.660 739 1HG2 ILE 91 1HG2 ILE 91 15.029 -0.976 5.987 740 2HG2 ILE 91 2HG2 ILE 91 16.271 -0.930 4.739 741 3HG2 ILE 91 3HG2 ILE 91 15.122 -2.264 4.787 742 1HD1 ILE 91 1HD1 ILE 91 12.768 -2.529 3.027 743 2HD1 ILE 91 2HD1 ILE 91 11.529 -2.502 4.282 744 3HD1 ILE 91 3HD1 ILE 91 13.198 -2.894 4.697 745 H THR 92 H THR 92 13.179 0.241 2.239 746 HA THR 92 HA THR 92 12.558 2.854 1.171 747 HB THR 92 HB THR 92 14.084 0.868 -0.535 748 HG1 THR 92 HG1 THR 92 14.926 2.840 1.170 749 1HG2 THR 92 1HG2 THR 92 13.212 3.709 -1.097 750 2HG2 THR 92 2HG2 THR 92 12.491 2.259 -1.796 751 3HG2 THR 92 3HG2 THR 92 14.160 2.685 -2.177 752 H PHE 93 H PHE 93 10.954 2.738 -0.539 753 HA PHE 93 HA PHE 93 8.821 1.121 0.219 754 1HB PHE 93 1HB PHE 93 8.808 3.363 -1.004 755 2HB PHE 93 2HB PHE 93 9.080 2.445 -2.478 756 HD1 PHE 93 HD1 PHE 93 6.795 2.444 0.465 757 HD2 PHE 93 HD2 PHE 93 7.229 1.897 -3.732 758 HE1 PHE 93 HE1 PHE 93 4.366 2.119 0.262 759 HE2 PHE 93 HE2 PHE 93 4.800 1.567 -3.942 760 HZ PHE 93 HZ PHE 93 3.365 1.676 -1.940 761 H GLN 94 H GLN 94 11.222 0.657 -2.296 762 HA GLN 94 HA GLN 94 9.897 -1.430 -3.679 763 1HB GLN 94 1HB GLN 94 12.796 -0.621 -3.520 764 2HB GLN 94 2HB GLN 94 12.261 -1.991 -4.477 765 1HG GLN 94 1HG GLN 94 12.511 -0.103 -5.910 766 2HG GLN 94 2HG GLN 94 10.796 -0.470 -5.762 767 1HE2 GLN 94 1HE2 GLN 94 13.347 1.726 -4.857 768 2HE2 GLN 94 2HE2 GLN 94 12.317 3.047 -4.418 769 H GLU 95 H GLU 95 12.603 -1.526 -1.365 770 HA GLU 95 HA GLU 95 12.763 -4.324 -1.187 771 1HB GLU 95 1HB GLU 95 13.570 -2.160 0.757 772 2HB GLU 95 2HB GLU 95 13.942 -3.859 1.002 773 1HG GLU 95 1HG GLU 95 15.859 -2.717 0.099 774 2HG GLU 95 2HG GLU 95 15.241 -3.862 -1.087 775 H TYR 96 H TYR 96 10.856 -1.980 0.575 776 HA TYR 96 HA TYR 96 9.911 -3.609 2.645 777 1HB TYR 96 1HB TYR 96 9.656 -1.143 2.546 778 2HB TYR 96 2HB TYR 96 8.476 -1.333 1.255 779 HD1 TYR 96 HD1 TYR 96 9.046 -2.718 4.683 780 HD2 TYR 96 HD2 TYR 96 6.276 -1.096 1.893 781 HE1 TYR 96 HE1 TYR 96 7.266 -2.872 6.369 782 HE2 TYR 96 HE2 TYR 96 4.489 -1.243 3.577 783 HH TYR 96 HH TYR 96 4.010 -2.594 5.651 784 H ARG 97 H ARG 97 8.641 -3.039 -0.620 785 HA ARG 97 HA ARG 97 6.361 -4.723 -0.152 786 1HB ARG 97 1HB ARG 97 7.412 -3.449 -2.671 787 2HB ARG 97 2HB ARG 97 5.911 -4.360 -2.573 788 1HG ARG 97 1HG ARG 97 5.145 -2.740 -0.824 789 2HG ARG 97 2HG ARG 97 6.581 -1.778 -1.183 790 1HD ARG 97 1HD ARG 97 4.439 -2.546 -3.157 791 2HD ARG 97 2HD ARG 97 4.597 -0.973 -2.380 792 HE ARG 97 HE ARG 97 6.929 -1.053 -3.530 793 1HH1 ARG 97 1HH1 ARG 97 3.965 -2.354 -4.802 794 2HH1 ARG 97 2HH1 ARG 97 4.323 -1.968 -6.461 795 1HH2 ARG 97 1HH2 ARG 97 7.447 -0.542 -5.736 796 2HH2 ARG 97 2HH2 ARG 97 6.305 -0.937 -6.984 797 H ARG 98 H ARG 98 9.574 -5.201 -1.377 798 HA ARG 98 HA ARG 98 9.116 -7.591 -2.808 799 1HB ARG 98 1HB ARG 98 11.558 -6.622 -1.324 800 2HB ARG 98 2HB ARG 98 11.534 -8.102 -2.271 801 1HG ARG 98 1HG ARG 98 10.916 -6.752 -4.259 802 2HG ARG 98 2HG ARG 98 11.114 -5.299 -3.276 803 1HD ARG 98 1HD ARG 98 13.448 -6.037 -2.792 804 2HD ARG 98 2HD ARG 98 13.222 -7.341 -3.957 805 HE ARG 98 HE ARG 98 12.814 -5.523 -5.631 806 1HH1 ARG 98 1HH1 ARG 98 14.810 -5.097 -2.809 807 2HH1 ARG 98 2HH1 ARG 98 15.624 -3.687 -3.416 808 1HH2 ARG 98 1HH2 ARG 98 13.950 -3.710 -6.503 809 2HH2 ARG 98 2HH2 ARG 98 15.164 -2.919 -5.536 810 H ASN 99 H ASN 99 9.943 -6.998 0.584 811 HA ASN 99 HA ASN 99 9.957 -9.756 1.296 812 1HB ASN 99 1HB ASN 99 9.856 -7.231 2.945 813 2HB ASN 99 2HB ASN 99 9.838 -8.833 3.671 814 1HD2 ASN 99 1HD2 ASN 99 11.738 -6.490 1.934 815 2HD2 ASN 99 2HD2 ASN 99 13.269 -7.270 2.168 816 H LEU 100 H LEU 100 7.517 -7.223 1.322 817 HA LEU 100 HA LEU 100 5.511 -8.684 2.671 818 1HB LEU 100 1HB LEU 100 5.399 -6.434 0.674 819 2HB LEU 100 2HB LEU 100 3.946 -7.146 1.351 820 HG LEU 100 HG LEU 100 6.133 -5.840 2.973 821 1HD1 LEU 100 1HD1 LEU 100 4.946 -4.228 1.571 822 2HD1 LEU 100 2HD1 LEU 100 4.547 -4.017 3.275 823 3HD1 LEU 100 3HD1 LEU 100 3.406 -4.820 2.195 824 1HD2 LEU 100 1HD2 LEU 100 4.886 -7.590 4.164 825 2HD2 LEU 100 2HD2 LEU 100 3.373 -6.781 3.745 826 3HD2 LEU 100 3HD2 LEU 100 4.540 -5.983 4.801 827 H ALA 101 H ALA 101 6.323 -8.372 -0.768 828 HA ALA 101 HA ALA 101 4.264 -10.081 -1.695 829 1HB ALA 101 1HB ALA 101 6.891 -9.494 -3.036 830 2HB ALA 101 2HB ALA 101 5.481 -8.437 -3.097 831 3HB ALA 101 3HB ALA 101 5.403 -10.052 -3.800 832 H LYS 102 H LYS 102 7.402 -10.644 -0.334 833 HA LYS 102 HA LYS 102 7.662 -13.379 -1.101 834 1HB LYS 102 1HB LYS 102 8.931 -11.624 0.973 835 2HB LYS 102 2HB LYS 102 9.147 -13.364 1.075 836 1HG LYS 102 1HG LYS 102 9.835 -11.723 -1.350 837 2HG LYS 102 2HG LYS 102 10.985 -12.160 -0.086 838 1HD LYS 102 1HD LYS 102 10.318 -14.573 -0.532 839 2HD LYS 102 2HD LYS 102 9.523 -13.976 -1.987 840 1HE LYS 102 1HE LYS 102 12.436 -13.605 -1.317 841 2HE LYS 102 2HE LYS 102 11.801 -14.830 -2.412 842 1HZ LYS 102 1HZ LYS 102 11.656 -11.880 -2.773 843 2HZ LYS 102 2HZ LYS 102 10.925 -13.016 -3.802 844 3HZ LYS 102 3HZ LYS 102 12.613 -12.968 -3.658 845 H ALA 103 H ALA 103 5.808 -11.698 1.255 846 HA ALA 103 HA ALA 103 5.305 -14.105 2.832 847 1HB ALA 103 1HB ALA 103 4.106 -12.620 4.354 848 2HB ALA 103 2HB ALA 103 4.348 -11.273 3.242 849 3HB ALA 103 3HB ALA 103 5.734 -12.024 4.032 850 H GLY 104 H GLY 104 4.226 -13.095 0.004 851 1HA GLY 104 1HA GLY 104 2.436 -14.005 -1.180 852 2HA GLY 104 2HA GLY 104 1.713 -14.500 0.340 853 H VAL 105 H VAL 105 2.614 -11.300 0.575 854 HA VAL 105 HA VAL 105 -0.117 -10.437 0.526 855 HB VAL 105 HB VAL 105 2.395 -8.777 0.812 856 1HG1 VAL 105 1HG1 VAL 105 0.435 -7.480 0.097 857 2HG1 VAL 105 2HG1 VAL 105 0.949 -7.060 1.729 858 3HG1 VAL 105 3HG1 VAL 105 -0.465 -8.087 1.488 859 1HG2 VAL 105 1HG2 VAL 105 2.229 -10.434 2.581 860 2HG2 VAL 105 2HG2 VAL 105 0.565 -9.948 2.911 861 3HG2 VAL 105 3HG2 VAL 105 1.891 -8.826 3.222 862 H PHE 106 H PHE 106 -1.039 -10.377 -1.417 863 HA PHE 106 HA PHE 106 0.344 -8.947 -3.583 864 1HB PHE 106 1HB PHE 106 -0.438 -11.278 -4.053 865 2HB PHE 106 2HB PHE 106 -2.091 -10.739 -3.771 866 HD1 PHE 106 HD1 PHE 106 -3.241 -9.352 -5.387 867 HD2 PHE 106 HD2 PHE 106 0.769 -10.620 -6.047 868 HE1 PHE 106 HE1 PHE 106 -3.429 -8.695 -7.749 869 HE2 PHE 106 HE2 PHE 106 0.585 -9.966 -8.413 870 HZ PHE 106 HZ PHE 106 -1.513 -9.001 -9.265 871 H ARG 107 H ARG 107 -2.447 -8.960 -1.506 872 HA ARG 107 HA ARG 107 -3.551 -6.656 -2.959 873 1HB ARG 107 1HB ARG 107 -5.014 -8.692 -2.580 874 2HB ARG 107 2HB ARG 107 -4.961 -8.310 -0.864 875 1HG ARG 107 1HG ARG 107 -6.895 -7.262 -1.426 876 2HG ARG 107 2HG ARG 107 -5.759 -5.946 -1.723 877 1HD ARG 107 1HD ARG 107 -6.872 -5.863 -3.694 878 2HD ARG 107 2HD ARG 107 -5.688 -7.097 -4.126 879 HE ARG 107 HE ARG 107 -8.368 -7.810 -3.128 880 1HH1 ARG 107 1HH1 ARG 107 -5.828 -8.131 -5.520 881 2HH1 ARG 107 2HH1 ARG 107 -6.693 -9.312 -6.456 882 1HH2 ARG 107 1HH2 ARG 107 -9.489 -9.353 -4.344 883 2HH2 ARG 107 2HH2 ARG 107 -8.777 -9.998 -5.794 884 H TRP 108 H TRP 108 -2.665 -4.889 -2.148 885 HA TRP 108 HA TRP 108 -2.322 -4.580 0.743 886 1HB TRP 108 1HB TRP 108 -0.408 -4.055 -0.697 887 2HB TRP 108 2HB TRP 108 -1.376 -2.916 -1.614 888 HD1 TRP 108 HD1 TRP 108 -2.609 -1.253 0.825 889 HE1 TRP 108 HE1 TRP 108 -1.077 0.304 2.168 890 HE3 TRP 108 HE3 TRP 108 1.897 -3.376 -0.313 891 HZ2 TRP 108 HZ2 TRP 108 1.687 0.608 2.671 892 HZ3 TRP 108 HZ3 TRP 108 3.936 -2.383 0.633 893 HH2 TRP 108 HH2 TRP 108 3.832 -0.433 2.096 894 H VAL 109 H VAL 109 -4.139 -3.849 1.730 895 HA VAL 109 HA VAL 109 -5.665 -1.740 0.341 896 HB VAL 109 HB VAL 109 -6.723 -3.741 2.350 897 1HG1 VAL 109 1HG1 VAL 109 -8.921 -2.813 1.809 898 2HG1 VAL 109 2HG1 VAL 109 -8.160 -1.624 0.752 899 3HG1 VAL 109 3HG1 VAL 109 -7.855 -1.584 2.488 900 1HG2 VAL 109 1HG2 VAL 109 -6.251 -4.786 0.202 901 2HG2 VAL 109 2HG2 VAL 109 -7.171 -3.531 -0.628 902 3HG2 VAL 109 3HG2 VAL 109 -7.991 -4.654 0.457 903 H THR 110 H THR 110 -4.978 0.146 1.208 904 HA THR 110 HA THR 110 -4.619 0.326 4.105 905 HB THR 110 HB THR 110 -4.236 2.486 2.020 906 HG1 THR 110 HG1 THR 110 -2.138 1.923 1.975 907 1HG2 THR 110 1HG2 THR 110 -3.402 2.355 4.919 908 2HG2 THR 110 2HG2 THR 110 -4.682 3.372 4.252 909 3HG2 THR 110 3HG2 THR 110 -3.004 3.648 3.787 910 H ASN 111 H ASN 111 -6.417 0.577 5.237 911 HA ASN 111 HA ASN 111 -8.651 2.056 4.048 912 1HB ASN 111 1HB ASN 111 -8.978 -0.304 4.901 913 2HB ASN 111 2HB ASN 111 -8.696 0.320 6.522 914 1HD2 ASN 111 1HD2 ASN 111 -10.772 -0.309 7.156 915 2HD2 ASN 111 2HD2 ASN 111 -12.172 0.571 6.657 916 H ILE 112 H ILE 112 -8.101 4.147 4.439 917 HA ILE 112 HA ILE 112 -7.007 5.126 6.860 918 HB ILE 112 HB ILE 112 -8.466 6.573 4.639 919 1HG1 ILE 112 1HG1 ILE 112 -6.384 5.480 3.942 920 2HG1 ILE 112 2HG1 ILE 112 -6.216 7.233 3.916 921 1HG2 ILE 112 1HG2 ILE 112 -6.825 7.736 6.888 922 2HG2 ILE 112 2HG2 ILE 112 -8.572 7.878 6.697 923 3HG2 ILE 112 3HG2 ILE 112 -7.492 8.635 5.525 924 1HD1 ILE 112 1HD1 ILE 112 -5.036 7.142 6.055 925 2HD1 ILE 112 2HD1 ILE 112 -4.228 6.175 4.819 926 3HD1 ILE 112 3HD1 ILE 112 -5.195 5.385 6.064 927 H HIS 113 H HIS 113 -10.205 4.447 5.770 928 HA HIS 113 HA HIS 113 -11.755 5.988 7.491 929 1HB HIS 113 1HB HIS 113 -12.633 4.640 5.601 930 2HB HIS 113 2HB HIS 113 -12.317 3.175 6.521 931 HD1 HIS 113 HD1 HIS 113 -14.192 2.357 7.953 932 HD2 HIS 113 HD2 HIS 113 -14.648 6.348 6.886 933 HE1 HIS 113 HE1 HIS 113 -16.470 3.018 8.781 934 HE2 HIS 113 HE2 HIS 113 -16.759 5.421 8.063 935 H GLU 114 H GLU 114 -9.741 3.265 8.187 936 HA GLU 114 HA GLU 114 -10.768 3.225 10.945 937 1HB GLU 114 1HB GLU 114 -9.928 0.812 9.331 938 2HB GLU 114 2HB GLU 114 -10.430 0.795 11.016 939 1HG GLU 114 1HG GLU 114 -12.647 1.446 10.438 940 2HG GLU 114 2HG GLU 114 -12.182 1.738 8.765 941 H GLN 115 H GLN 115 -8.259 4.112 9.188 942 HA GLN 115 HA GLN 115 -6.011 4.350 9.440 943 1HB GLN 115 1HB GLN 115 -6.956 4.102 12.276 944 2HB GLN 115 2HB GLN 115 -5.237 4.221 11.934 945 1HG GLN 115 1HG GLN 115 -6.046 6.396 12.450 946 2HG GLN 115 2HG GLN 115 -5.677 6.346 10.730 947 1HE2 GLN 115 1HE2 GLN 115 -7.012 8.005 10.176 948 2HE2 GLN 115 2HE2 GLN 115 -8.732 7.886 10.218 949 H LYS 116 H LYS 116 -6.825 1.791 8.665 950 HA LYS 116 HA LYS 116 -4.758 0.130 9.939 951 1HB LYS 116 1HB LYS 116 -7.568 -0.720 9.223 952 2HB LYS 116 2HB LYS 116 -6.287 -1.828 9.701 953 1HG LYS 116 1HG LYS 116 -6.177 -0.861 11.886 954 2HG LYS 116 2HG LYS 116 -7.290 0.428 11.425 955 1HD LYS 116 1HD LYS 116 -9.052 -1.254 11.071 956 2HD LYS 116 2HD LYS 116 -7.928 -2.514 11.583 957 1HE LYS 116 1HE LYS 116 -9.378 -1.890 13.425 958 2HE LYS 116 2HE LYS 116 -7.714 -1.423 13.770 959 1HZ LYS 116 1HZ LYS 116 -8.939 0.421 14.395 960 2HZ LYS 116 2HZ LYS 116 -10.014 0.299 13.094 961 3HZ LYS 116 3HZ LYS 116 -8.432 0.845 12.832 962 H ARG 117 H ARG 117 -3.529 -1.061 8.611 963 HA ARG 117 HA ARG 117 -4.171 -1.031 5.741 964 1HB ARG 117 1HB ARG 117 -1.535 -1.499 7.152 965 2HB ARG 117 2HB ARG 117 -1.770 -1.686 5.420 966 1HG ARG 117 1HG ARG 117 -2.548 0.731 5.417 967 2HG ARG 117 2HG ARG 117 -1.904 0.825 7.055 968 1HD ARG 117 1HD ARG 117 -0.334 0.041 4.603 969 2HD ARG 117 2HD ARG 117 -0.302 1.628 5.368 970 HE ARG 117 HE ARG 117 0.358 -0.258 7.322 971 1HH1 ARG 117 1HH1 ARG 117 1.693 1.051 4.365 972 2HH1 ARG 117 2HH1 ARG 117 3.328 0.690 4.792 973 1HH2 ARG 117 1HH2 ARG 117 2.487 -0.718 7.907 974 2HH2 ARG 117 2HH2 ARG 117 3.790 -0.362 6.805 975 H TYR 118 H TYR 118 -5.089 -2.791 5.021 976 HA TYR 118 HA TYR 118 -4.856 -5.265 6.556 977 1HB TYR 118 1HB TYR 118 -6.784 -4.377 4.405 978 2HB TYR 118 2HB TYR 118 -6.782 -5.995 5.098 979 HD1 TYR 118 HD1 TYR 118 -7.457 -2.436 5.770 980 HD2 TYR 118 HD2 TYR 118 -7.662 -6.400 7.297 981 HE1 TYR 118 HE1 TYR 118 -8.924 -1.657 7.585 982 HE2 TYR 118 HE2 TYR 118 -9.131 -5.633 9.111 983 HH TYR 118 HH TYR 118 -10.505 -2.441 9.161 984 H TYR 119 H TYR 119 -3.515 -6.779 5.936 985 HA TYR 119 HA TYR 119 -2.450 -6.730 3.216 986 1HB TYR 119 1HB TYR 119 -1.524 -8.234 5.674 987 2HB TYR 119 2HB TYR 119 -0.725 -8.269 4.106 988 HD1 TYR 119 HD1 TYR 119 0.437 -6.263 3.260 989 HD2 TYR 119 HD2 TYR 119 -1.272 -6.345 7.154 990 HE1 TYR 119 HE1 TYR 119 1.766 -4.290 3.877 991 HE2 TYR 119 HE2 TYR 119 0.053 -4.371 7.783 992 HH TYR 119 HH TYR 119 1.965 -3.147 7.163 993 H TYR 120 H TYR 120 -3.659 -7.842 1.840 994 HA TYR 120 HA TYR 120 -4.751 -10.449 2.659 995 1HB TYR 120 1HB TYR 120 -5.490 -8.645 0.348 996 2HB TYR 120 2HB TYR 120 -6.157 -10.249 0.599 997 HD1 TYR 120 HD1 TYR 120 -6.137 -6.778 1.782 998 HD2 TYR 120 HD2 TYR 120 -7.829 -10.645 2.288 999 HE1 TYR 120 HE1 TYR 120 -7.954 -5.802 3.118 1000 HE2 TYR 120 HE2 TYR 120 -9.648 -9.682 3.633 1001 HH TYR 120 HH TYR 120 -10.259 -6.345 3.761 1002 H THR 121 H THR 121 -4.420 -12.266 1.379 1003 HA THR 121 HA THR 121 -2.176 -12.204 -0.463 1004 HB THR 121 HB THR 121 -2.294 -14.113 1.011 1005 HG1 THR 121 HG1 THR 121 -3.011 -15.680 -1.022 1006 1HG2 THR 121 1HG2 THR 121 -5.018 -14.656 -0.171 1007 2HG2 THR 121 2HG2 THR 121 -4.685 -14.107 1.472 1008 3HG2 THR 121 3HG2 THR 121 -4.158 -15.708 0.954 1009 H PHE 122 H PHE 122 -2.632 -13.630 -2.562 1010 HA PHE 122 HA PHE 122 -4.396 -12.134 -4.187 1011 1HB PHE 122 1HB PHE 122 -2.360 -13.335 -5.000 1012 2HB PHE 122 2HB PHE 122 -3.206 -14.859 -4.759 1013 HD1 PHE 122 HD1 PHE 122 -4.427 -15.779 -6.496 1014 HD2 PHE 122 HD2 PHE 122 -3.497 -11.628 -6.576 1015 HE1 PHE 122 HE1 PHE 122 -5.365 -15.617 -8.764 1016 HE2 PHE 122 HE2 PHE 122 -4.433 -11.459 -8.845 1017 HZ PHE 122 HZ PHE 122 -5.371 -13.454 -9.941 1018 H ASP 123 H ASP 123 -4.854 -14.821 -2.150 1019 HA ASP 123 HA ASP 123 -7.193 -15.907 -3.420 1020 1HB ASP 123 1HB ASP 123 -6.332 -16.357 -0.562 1021 2HB ASP 123 2HB ASP 123 -7.256 -17.437 -1.599 1022 H ASN 124 H ASN 124 -6.722 -13.076 -1.904 1023 HA ASN 124 HA ASN 124 -8.050 -11.487 -0.989 1024 1HB ASN 124 1HB ASN 124 -10.200 -13.438 -1.771 1025 2HB ASN 124 2HB ASN 124 -10.588 -12.000 -0.834 1026 1HD2 ASN 124 1HD2 ASN 124 -9.627 -13.243 -3.912 1027 2HD2 ASN 124 2HD2 ASN 124 -9.794 -11.759 -4.793 1028 H SER 125 H SER 125 -7.023 -13.990 0.485 1029 HA SER 125 HA SER 125 -8.673 -13.940 2.870 1030 1HB SER 125 1HB SER 125 -6.018 -15.335 2.473 1031 2HB SER 125 2HB SER 125 -7.255 -15.699 3.678 1032 HG SER 125 HG SER 125 -8.516 -16.591 2.138 1033 H LEU 126 H LEU 126 -8.163 -12.903 4.749 1034 HA LEU 126 HA LEU 126 -6.090 -10.874 4.569 1035 1HB LEU 126 1HB LEU 126 -8.344 -10.275 5.339 1036 2HB LEU 126 2HB LEU 126 -8.185 -11.392 6.681 1037 HG LEU 126 HG LEU 126 -6.383 -10.020 7.625 1038 1HD1 LEU 126 1HD1 LEU 126 -6.932 -8.192 5.295 1039 2HD1 LEU 126 2HD1 LEU 126 -5.458 -9.119 5.568 1040 3HD1 LEU 126 3HD1 LEU 126 -5.898 -7.817 6.672 1041 1HD2 LEU 126 1HD2 LEU 126 -7.743 -8.083 8.244 1042 2HD2 LEU 126 2HD2 LEU 126 -8.679 -9.579 8.291 1043 3HD2 LEU 126 3HD2 LEU 126 -8.870 -8.462 6.941 1044 H LEU 127 H LEU 127 -4.117 -11.184 5.334 1045 HA LEU 127 HA LEU 127 -3.665 -13.358 7.234 1046 1HB LEU 127 1HB LEU 127 -1.759 -11.691 5.602 1047 2HB LEU 127 2HB LEU 127 -1.234 -12.849 6.806 1048 HG LEU 127 HG LEU 127 -2.706 -14.508 5.365 1049 1HD1 LEU 127 1HD1 LEU 127 -1.901 -12.417 3.357 1050 2HD1 LEU 127 2HD1 LEU 127 -3.551 -12.795 3.849 1051 3HD1 LEU 127 3HD1 LEU 127 -2.588 -13.999 2.989 1052 1HD2 LEU 127 1HD2 LEU 127 -0.681 -15.121 4.151 1053 2HD2 LEU 127 2HD2 LEU 127 -0.316 -14.716 5.829 1054 3HD2 LEU 127 3HD2 LEU 127 0.035 -13.559 4.545 1055 H PHE 128 H PHE 128 -3.138 -9.862 6.920 1056 HA PHE 128 HA PHE 128 -2.646 -9.763 9.809 1057 1HB PHE 128 1HB PHE 128 -0.489 -9.891 8.399 1058 2HB PHE 128 2HB PHE 128 -0.875 -8.250 7.902 1059 HD1 PHE 128 HD1 PHE 128 0.132 -10.389 10.687 1060 HD2 PHE 128 HD2 PHE 128 -0.643 -6.400 9.437 1061 HE1 PHE 128 HE1 PHE 128 1.240 -9.552 12.713 1062 HE2 PHE 128 HE2 PHE 128 0.457 -5.546 11.467 1063 HZ PHE 128 HZ PHE 128 1.403 -7.121 13.108 1064 H THR 129 H THR 129 -3.653 -8.134 10.772 1065 HA THR 129 HA THR 129 -4.555 -5.851 9.152 1066 HB THR 129 HB THR 129 -5.523 -6.709 11.893 1067 HG1 THR 129 HG1 THR 129 -6.069 -7.802 9.598 1068 1HG2 THR 129 1HG2 THR 129 -7.312 -5.091 11.539 1069 2HG2 THR 129 2HG2 THR 129 -6.620 -4.643 9.980 1070 3HG2 THR 129 3HG2 THR 129 -5.740 -4.295 11.468 1071 H GLU 130 H GLU 130 -3.058 -4.288 9.234 1072 HA GLU 130 HA GLU 130 -1.581 -3.860 11.736 1073 1HB GLU 130 1HB GLU 130 -0.314 -4.238 9.611 1074 2HB GLU 130 2HB GLU 130 -1.029 -2.762 8.974 1075 1HG GLU 130 1HG GLU 130 -0.004 -1.627 11.035 1076 2HG GLU 130 2HG GLU 130 0.977 -3.089 11.163 1077 H SER 131 H SER 131 -1.693 -1.911 12.816 1078 HA SER 131 HA SER 131 -3.589 0.053 11.716 1079 1HB SER 131 1HB SER 131 -4.053 -0.950 13.992 1080 2HB SER 131 2HB SER 131 -2.605 -0.127 14.573 1081 HG SER 131 HG SER 131 -4.301 1.527 13.198 1082 H ILE 132 H ILE 132 -2.820 1.933 10.994 1083 HA ILE 132 HA ILE 132 0.027 2.383 11.163 1084 HB ILE 132 HB ILE 132 -0.517 4.396 9.689 1085 1HG1 ILE 132 1HG1 ILE 132 -3.167 2.936 9.507 1086 2HG1 ILE 132 2HG1 ILE 132 -2.923 4.529 10.216 1087 1HG2 ILE 132 1HG2 ILE 132 0.475 2.348 8.856 1088 2HG2 ILE 132 2HG2 ILE 132 -0.702 2.970 7.698 1089 3HG2 ILE 132 3HG2 ILE 132 -1.119 1.603 8.731 1090 1HD1 ILE 132 1HD1 ILE 132 -3.859 4.710 7.997 1091 2HD1 ILE 132 2HD1 ILE 132 -2.515 3.787 7.329 1092 3HD1 ILE 132 3HD1 ILE 132 -2.230 5.382 8.025 1093 H GLN 133 H GLN 133 0.169 2.813 13.388 1094 HA GLN 133 HA GLN 133 0.203 5.594 13.969 1095 1HB GLN 133 1HB GLN 133 -1.292 5.543 15.926 1096 2HB GLN 133 2HB GLN 133 -2.164 5.227 14.432 1097 1HG GLN 133 1HG GLN 133 -2.038 2.799 14.952 1098 2HG GLN 133 2HG GLN 133 -1.338 3.219 16.515 1099 1HE2 GLN 133 1HE2 GLN 133 -3.796 5.120 14.931 1100 2HE2 GLN 133 2HE2 GLN 133 -5.074 4.768 16.045 Start of MODEL 3 1 H ASP 7 H ASP 7 -8.382 13.805 -14.649 2 HA ASP 7 HA ASP 7 -5.452 13.988 -14.516 3 1HB ASP 7 1HB ASP 7 -5.700 16.332 -14.115 4 2HB ASP 7 2HB ASP 7 -6.671 15.876 -15.499 5 H GLN 8 H GLN 8 -8.297 13.654 -12.550 6 HA GLN 8 HA GLN 8 -7.150 14.235 -10.049 7 1HB GLN 8 1HB GLN 8 -9.573 13.785 -10.484 8 2HB GLN 8 2HB GLN 8 -9.182 12.084 -10.691 9 1HG GLN 8 1HG GLN 8 -8.476 11.923 -8.396 10 2HG GLN 8 2HG GLN 8 -8.709 13.657 -8.173 11 1HE2 GLN 8 1HE2 GLN 8 -10.784 14.489 -8.045 12 2HE2 GLN 8 2HE2 GLN 8 -12.159 13.478 -7.739 13 H VAL 9 H VAL 9 -6.640 11.786 -12.340 14 HA VAL 9 HA VAL 9 -5.495 9.752 -10.716 15 HB VAL 9 HB VAL 9 -4.842 10.366 -13.604 16 1HG1 VAL 9 1HG1 VAL 9 -4.747 7.792 -12.041 17 2HG1 VAL 9 2HG1 VAL 9 -3.360 8.742 -12.577 18 3HG1 VAL 9 3HG1 VAL 9 -4.408 7.961 -13.763 19 1HG2 VAL 9 1HG2 VAL 9 -6.663 8.817 -14.198 20 2HG2 VAL 9 2HG2 VAL 9 -7.246 10.271 -13.385 21 3HG2 VAL 9 3HG2 VAL 9 -7.133 8.747 -12.499 22 H VAL 10 H VAL 10 -4.297 12.641 -12.313 23 HA VAL 10 HA VAL 10 -1.534 12.162 -12.070 24 HB VAL 10 HB VAL 10 -3.022 14.800 -12.184 25 1HG1 VAL 10 1HG1 VAL 10 -0.096 14.194 -12.625 26 2HG1 VAL 10 2HG1 VAL 10 -0.786 15.159 -11.322 27 3HG1 VAL 10 3HG1 VAL 10 -0.878 15.733 -12.985 28 1HG2 VAL 10 1HG2 VAL 10 -3.468 13.402 -14.109 29 2HG2 VAL 10 2HG2 VAL 10 -1.740 13.142 -14.351 30 3HG2 VAL 10 3HG2 VAL 10 -2.426 14.751 -14.566 31 H ILE 11 H ILE 11 -3.868 13.706 -9.908 32 HA ILE 11 HA ILE 11 -1.987 14.657 -8.026 33 HB ILE 11 HB ILE 11 -4.931 14.046 -7.762 34 1HG1 ILE 11 1HG1 ILE 11 -4.962 16.585 -7.420 35 2HG1 ILE 11 2HG1 ILE 11 -3.298 16.573 -7.988 36 1HG2 ILE 11 1HG2 ILE 11 -4.889 15.129 -5.569 37 2HG2 ILE 11 2HG2 ILE 11 -3.131 15.251 -5.661 38 3HG2 ILE 11 3HG2 ILE 11 -3.904 13.666 -5.586 39 1HD1 ILE 11 1HD1 ILE 11 -4.008 15.659 -10.114 40 2HD1 ILE 11 2HD1 ILE 11 -4.882 17.150 -9.752 41 3HD1 ILE 11 3HD1 ILE 11 -5.674 15.588 -9.543 42 H PHE 12 H PHE 12 -4.041 11.730 -7.984 43 HA PHE 12 HA PHE 12 -3.095 10.738 -5.543 44 1HB PHE 12 1HB PHE 12 -4.401 9.430 -7.906 45 2HB PHE 12 2HB PHE 12 -3.856 8.474 -6.535 46 HD1 PHE 12 HD1 PHE 12 -6.263 10.954 -7.701 47 HD2 PHE 12 HD2 PHE 12 -4.956 8.613 -4.402 48 HE1 PHE 12 HE1 PHE 12 -8.371 11.436 -6.530 49 HE2 PHE 12 HE2 PHE 12 -7.060 9.091 -3.223 50 HZ PHE 12 HZ PHE 12 -8.773 10.506 -4.289 51 H LYS 13 H LYS 13 -2.029 9.958 -8.862 52 HA LYS 13 HA LYS 13 -0.127 8.038 -8.082 53 1HB LYS 13 1HB LYS 13 -0.917 8.180 -10.379 54 2HB LYS 13 2HB LYS 13 -0.193 9.775 -10.558 55 1HG LYS 13 1HG LYS 13 2.030 8.764 -10.194 56 2HG LYS 13 2HG LYS 13 1.265 7.174 -10.137 57 1HD LYS 13 1HD LYS 13 0.448 7.482 -12.420 58 2HD LYS 13 2HD LYS 13 1.192 9.083 -12.474 59 1HE LYS 13 1HE LYS 13 2.682 6.495 -12.060 60 2HE LYS 13 2HE LYS 13 2.538 7.337 -13.601 61 1HZ LYS 13 1HZ LYS 13 3.822 8.436 -11.145 62 2HZ LYS 13 2HZ LYS 13 3.688 9.233 -12.638 63 3HZ LYS 13 3HZ LYS 13 4.632 7.833 -12.509 64 H GLN 14 H GLN 14 0.086 11.528 -8.529 65 HA GLN 14 HA GLN 14 2.838 11.888 -8.351 66 1HB GLN 14 1HB GLN 14 1.273 13.684 -8.929 67 2HB GLN 14 2HB GLN 14 0.634 13.667 -7.291 68 1HG GLN 14 1HG GLN 14 2.772 14.412 -6.423 69 2HG GLN 14 2HG GLN 14 3.466 14.359 -8.043 70 1HE2 GLN 14 1HE2 GLN 14 1.016 15.394 -9.270 71 2HE2 GLN 14 2HE2 GLN 14 0.993 17.090 -8.914 72 H ILE 15 H ILE 15 0.430 11.487 -5.820 73 HA ILE 15 HA ILE 15 2.039 12.004 -3.586 74 HB ILE 15 HB ILE 15 -0.214 9.996 -3.759 75 1HG1 ILE 15 1HG1 ILE 15 -0.386 12.924 -3.019 76 2HG1 ILE 15 2HG1 ILE 15 -0.797 12.292 -4.610 77 1HG2 ILE 15 1HG2 ILE 15 -0.492 10.461 -1.369 78 2HG2 ILE 15 2HG2 ILE 15 0.900 11.540 -1.419 79 3HG2 ILE 15 3HG2 ILE 15 1.110 9.815 -1.721 80 1HD1 ILE 15 1HD1 ILE 15 -2.141 11.567 -2.017 81 2HD1 ILE 15 2HD1 ILE 15 -2.555 10.925 -3.607 82 3HD1 ILE 15 3HD1 ILE 15 -2.780 12.640 -3.261 83 H PHE 16 H PHE 16 1.311 8.950 -5.255 84 HA PHE 16 HA PHE 16 2.930 7.357 -3.547 85 1HB PHE 16 1HB PHE 16 1.714 6.842 -6.260 86 2HB PHE 16 2HB PHE 16 2.672 5.637 -5.408 87 HD1 PHE 16 HD1 PHE 16 -0.475 7.514 -5.420 88 HD2 PHE 16 HD2 PHE 16 1.822 4.514 -3.463 89 HE1 PHE 16 HE1 PHE 16 -2.471 6.808 -4.171 90 HE2 PHE 16 HE2 PHE 16 -0.176 3.796 -2.215 91 HZ PHE 16 HZ PHE 16 -2.325 4.946 -2.565 92 H ASP 17 H ASP 17 3.536 8.966 -6.638 93 HA ASP 17 HA ASP 17 5.993 7.772 -7.253 94 1HB ASP 17 1HB ASP 17 4.951 10.542 -7.829 95 2HB ASP 17 2HB ASP 17 6.515 9.987 -8.406 96 H LYS 18 H LYS 18 5.237 10.494 -5.140 97 HA LYS 18 HA LYS 18 7.995 11.185 -4.751 98 1HB LYS 18 1HB LYS 18 5.512 12.084 -3.280 99 2HB LYS 18 2HB LYS 18 7.113 12.788 -3.091 100 1HG LYS 18 1HG LYS 18 5.501 12.752 -5.636 101 2HG LYS 18 2HG LYS 18 5.697 14.134 -4.556 102 1HD LYS 18 1HD LYS 18 8.064 14.208 -5.004 103 2HD LYS 18 2HD LYS 18 7.970 12.725 -5.955 104 1HE LYS 18 1HE LYS 18 6.563 15.307 -6.633 105 2HE LYS 18 2HE LYS 18 8.088 14.777 -7.340 106 1HZ LYS 18 1HZ LYS 18 6.977 12.842 -8.239 107 2HZ LYS 18 2HZ LYS 18 6.207 14.255 -8.772 108 3HZ LYS 18 3HZ LYS 18 5.508 13.322 -7.542 109 H VAL 19 H VAL 19 5.519 9.517 -2.821 110 HA VAL 19 HA VAL 19 7.124 9.287 -0.500 111 HB VAL 19 HB VAL 19 4.635 9.062 -0.518 112 1HG1 VAL 19 1HG1 VAL 19 3.632 6.912 -1.052 113 2HG1 VAL 19 2HG1 VAL 19 5.199 6.298 -1.577 114 3HG1 VAL 19 3HG1 VAL 19 4.422 7.606 -2.469 115 1HG2 VAL 19 1HG2 VAL 19 4.553 7.321 1.211 116 2HG2 VAL 19 2HG2 VAL 19 5.931 8.399 1.429 117 3HG2 VAL 19 3HG2 VAL 19 6.169 6.791 0.747 118 H ARG 20 H ARG 20 6.928 7.449 -3.422 119 HA ARG 20 HA ARG 20 7.975 4.990 -2.736 120 1HB ARG 20 1HB ARG 20 7.231 5.476 -4.988 121 2HB ARG 20 2HB ARG 20 8.499 6.677 -5.189 122 1HG ARG 20 1HG ARG 20 10.120 4.715 -4.781 123 2HG ARG 20 2HG ARG 20 8.721 3.697 -5.128 124 1HD ARG 20 1HD ARG 20 10.021 4.044 -7.148 125 2HD ARG 20 2HD ARG 20 8.450 4.831 -7.290 126 HE ARG 20 HE ARG 20 9.537 6.946 -6.972 127 1HH1 ARG 20 1HH1 ARG 20 11.695 4.232 -7.453 128 2HH1 ARG 20 2HH1 ARG 20 13.038 5.213 -7.943 129 1HH2 ARG 20 1HH2 ARG 20 11.303 8.252 -7.601 130 2HH2 ARG 20 2HH2 ARG 20 12.818 7.505 -8.014 131 H ASN 21 H ASN 21 9.707 7.999 -3.420 132 HA ASN 21 HA ASN 21 12.243 6.635 -2.840 133 1HB ASN 21 1HB ASN 21 12.077 7.689 -5.047 134 2HB ASN 21 2HB ASN 21 11.711 9.236 -4.286 135 1HD2 ASN 21 1HD2 ASN 21 13.344 10.407 -3.330 136 2HD2 ASN 21 2HD2 ASN 21 15.015 10.031 -3.548 137 H ASP 22 H ASP 22 10.369 9.544 -2.059 138 HA ASP 22 HA ASP 22 12.503 10.553 -0.397 139 1HB ASP 22 1HB ASP 22 11.123 12.077 -1.765 140 2HB ASP 22 2HB ASP 22 9.710 11.637 -0.809 141 H LEU 23 H LEU 23 9.519 8.834 0.017 142 HA LEU 23 HA LEU 23 8.562 7.806 1.796 143 1HB LEU 23 1HB LEU 23 11.205 8.395 3.132 144 2HB LEU 23 2HB LEU 23 9.960 7.357 3.799 145 HG LEU 23 HG LEU 23 11.437 6.850 1.213 146 1HD1 LEU 23 1HD1 LEU 23 12.896 6.620 3.147 147 2HD1 LEU 23 2HD1 LEU 23 12.528 5.042 2.449 148 3HD1 LEU 23 3HD1 LEU 23 11.716 5.564 3.925 149 1HD2 LEU 23 1HD2 LEU 23 10.377 4.649 1.307 150 2HD2 LEU 23 2HD2 LEU 23 9.170 5.934 1.216 151 3HD2 LEU 23 3HD2 LEU 23 9.493 5.131 2.754 152 H ASN 24 H ASN 24 8.172 10.631 1.381 153 HA ASN 24 HA ASN 24 8.040 11.833 3.992 154 1HB ASN 24 1HB ASN 24 6.841 13.689 2.814 155 2HB ASN 24 2HB ASN 24 8.435 13.334 2.169 156 1HD2 ASN 24 1HD2 ASN 24 6.174 14.683 0.935 157 2HD2 ASN 24 2HD2 ASN 24 5.804 13.792 -0.500 158 H TYR 25 H TYR 25 6.813 10.411 5.176 159 HA TYR 25 HA TYR 25 4.274 9.447 4.330 160 1HB TYR 25 1HB TYR 25 5.938 9.270 6.771 161 2HB TYR 25 2HB TYR 25 4.211 9.020 6.986 162 HD1 TYR 25 HD1 TYR 25 5.894 8.046 3.863 163 HD2 TYR 25 HD2 TYR 25 4.489 6.717 7.654 164 HE1 TYR 25 HE1 TYR 25 6.115 5.709 3.120 165 HE2 TYR 25 HE2 TYR 25 4.702 4.381 6.921 166 HH TYR 25 HH TYR 25 6.376 3.470 4.111 167 H GLN 26 H GLN 26 5.311 12.243 6.136 168 HA GLN 26 HA GLN 26 2.847 12.830 7.384 169 1HB GLN 26 1HB GLN 26 5.141 14.643 6.628 170 2HB GLN 26 2HB GLN 26 3.787 15.127 7.641 171 1HG GLN 26 1HG GLN 26 5.719 12.903 8.270 172 2HG GLN 26 2HG GLN 26 5.776 14.529 8.945 173 1HE2 GLN 26 1HE2 GLN 26 4.263 15.148 10.469 174 2HE2 GLN 26 2HE2 GLN 26 3.243 14.007 11.278 175 H TRP 27 H TRP 27 4.180 13.679 4.234 176 HA TRP 27 HA TRP 27 1.833 15.223 3.539 177 1HB TRP 27 1HB TRP 27 4.067 15.789 2.603 178 2HB TRP 27 2HB TRP 27 4.083 14.241 1.764 179 HD1 TRP 27 HD1 TRP 27 1.860 17.426 1.859 180 HE1 TRP 27 HE1 TRP 27 0.970 17.838 -0.519 181 HE3 TRP 27 HE3 TRP 27 3.831 13.320 -0.478 182 HZ2 TRP 27 HZ2 TRP 27 1.086 16.596 -3.043 183 HZ3 TRP 27 HZ3 TRP 27 3.390 13.013 -2.879 184 HH2 TRP 27 HH2 TRP 27 2.046 14.617 -4.133 185 H PHE 28 H PHE 28 3.174 12.039 2.944 186 HA PHE 28 HA PHE 28 1.484 11.056 0.998 187 1HB PHE 28 1HB PHE 28 3.477 9.887 1.826 188 2HB PHE 28 2HB PHE 28 2.682 9.589 3.364 189 HD1 PHE 28 HD1 PHE 28 1.999 7.441 3.672 190 HD2 PHE 28 HD2 PHE 28 1.879 9.079 -0.251 191 HE1 PHE 28 HE1 PHE 28 1.156 5.298 2.811 192 HE2 PHE 28 HE2 PHE 28 1.027 6.939 -1.123 193 HZ PHE 28 HZ PHE 28 0.667 5.043 0.414 194 H TYR 29 H TYR 29 1.049 10.719 4.536 195 HA TYR 29 HA TYR 29 -1.525 9.528 4.227 196 1HB TYR 29 1HB TYR 29 -0.085 10.637 6.629 197 2HB TYR 29 2HB TYR 29 -1.693 9.925 6.724 198 HD1 TYR 29 HD1 TYR 29 1.524 9.211 7.459 199 HD2 TYR 29 HD2 TYR 29 -1.672 7.582 5.171 200 HE1 TYR 29 HE1 TYR 29 2.527 6.975 7.654 201 HE2 TYR 29 HE2 TYR 29 -0.676 5.346 5.359 202 HH TYR 29 HH TYR 29 1.794 4.617 7.542 203 H SER 30 H SER 30 -0.399 12.795 4.540 204 HA SER 30 HA SER 30 -2.800 13.963 5.457 205 1HB SER 30 1HB SER 30 -0.520 15.058 5.429 206 2HB SER 30 2HB SER 30 -0.731 15.292 3.695 207 HG SER 30 HG SER 30 -1.390 17.059 5.228 208 H GLU 31 H GLU 31 -1.436 13.622 2.179 209 HA GLU 31 HA GLU 31 -3.736 14.653 0.883 210 1HB GLU 31 1HB GLU 31 -1.331 13.122 -0.035 211 2HB GLU 31 2HB GLU 31 -2.672 13.410 -1.136 212 1HG GLU 31 1HG GLU 31 -1.077 15.518 0.306 213 2HG GLU 31 2HG GLU 31 -0.941 15.092 -1.401 214 H LEU 32 H LEU 32 -2.688 11.357 1.687 215 HA LEU 32 HA LEU 32 -4.711 9.983 0.335 216 1HB LEU 32 1HB LEU 32 -3.255 9.330 2.889 217 2HB LEU 32 2HB LEU 32 -4.452 8.255 2.192 218 HG LEU 32 HG LEU 32 -1.837 9.093 0.943 219 1HD1 LEU 32 1HD1 LEU 32 -1.637 7.435 2.711 220 2HD1 LEU 32 2HD1 LEU 32 -1.315 6.713 1.133 221 3HD1 LEU 32 3HD1 LEU 32 -2.864 6.439 1.930 222 1HD2 LEU 32 1HD2 LEU 32 -3.574 8.918 -0.770 223 2HD2 LEU 32 2HD2 LEU 32 -4.018 7.322 -0.167 224 3HD2 LEU 32 3HD2 LEU 32 -2.431 7.581 -0.889 225 H LYS 33 H LYS 33 -4.687 11.321 3.618 226 HA LYS 33 HA LYS 33 -7.318 10.454 4.248 227 1HB LYS 33 1HB LYS 33 -5.565 10.961 5.913 228 2HB LYS 33 2HB LYS 33 -5.651 12.656 5.468 229 1HG LYS 33 1HG LYS 33 -7.907 12.807 6.308 230 2HG LYS 33 2HG LYS 33 -7.921 11.074 6.655 231 1HD LYS 33 1HD LYS 33 -7.489 12.383 8.680 232 2HD LYS 33 2HD LYS 33 -6.101 11.377 8.261 233 1HE LYS 33 1HE LYS 33 -5.201 13.436 7.047 234 2HE LYS 33 2HE LYS 33 -6.439 14.342 7.917 235 1HZ LYS 33 1HZ LYS 33 -4.299 12.697 9.158 236 2HZ LYS 33 2HZ LYS 33 -5.491 13.559 10.002 237 3HZ LYS 33 3HZ LYS 33 -4.332 14.389 9.082 238 H ARG 34 H ARG 34 -6.059 13.131 2.507 239 HA ARG 34 HA ARG 34 -8.475 14.723 2.791 240 1HB ARG 34 1HB ARG 34 -5.740 15.179 1.713 241 2HB ARG 34 2HB ARG 34 -7.049 16.169 1.079 242 1HG ARG 34 1HG ARG 34 -7.446 17.180 3.117 243 2HG ARG 34 2HG ARG 34 -6.682 15.879 4.028 244 1HD ARG 34 1HD ARG 34 -5.448 18.131 3.798 245 2HD ARG 34 2HD ARG 34 -4.542 16.640 3.566 246 HE ARG 34 HE ARG 34 -4.380 17.097 1.277 247 1HH1 ARG 34 1HH1 ARG 34 -6.247 19.569 2.936 248 2HH1 ARG 34 2HH1 ARG 34 -6.048 20.732 1.663 249 1HH2 ARG 34 1HH2 ARG 34 -4.125 18.602 -0.365 250 2HH2 ARG 34 2HH2 ARG 34 -4.841 20.189 -0.228 251 H HIS 35 H HIS 35 -7.508 12.212 0.830 252 HA HIS 35 HA HIS 35 -9.411 13.066 -1.250 253 1HB HIS 35 1HB HIS 35 -6.823 11.580 -1.763 254 2HB HIS 35 2HB HIS 35 -8.039 11.960 -2.974 255 HD1 HIS 35 HD1 HIS 35 -8.546 14.854 -2.743 256 HD2 HIS 35 HD2 HIS 35 -4.755 13.257 -2.101 257 HE1 HIS 35 HE1 HIS 35 -6.933 16.758 -3.093 258 HE2 HIS 35 HE2 HIS 35 -4.662 15.810 -2.513 259 H ASN 36 H ASN 36 -7.589 10.233 -0.107 260 HA ASN 36 HA ASN 36 -9.770 8.458 -0.835 261 1HB ASN 36 1HB ASN 36 -7.504 7.681 -1.287 262 2HB ASN 36 2HB ASN 36 -7.054 7.918 0.399 263 1HD2 ASN 36 1HD2 ASN 36 -6.489 5.814 0.759 264 2HD2 ASN 36 2HD2 ASN 36 -7.634 4.524 0.803 265 H VAL 37 H VAL 37 -11.386 9.049 0.576 266 HA VAL 37 HA VAL 37 -10.878 9.106 3.432 267 HB VAL 37 HB VAL 37 -13.535 9.406 2.030 268 1HG1 VAL 37 1HG1 VAL 37 -13.713 9.036 4.423 269 2HG1 VAL 37 2HG1 VAL 37 -14.136 10.704 4.034 270 3HG1 VAL 37 3HG1 VAL 37 -12.557 10.332 4.727 271 1HG2 VAL 37 1HG2 VAL 37 -11.981 11.009 1.081 272 2HG2 VAL 37 2HG2 VAL 37 -11.503 11.530 2.697 273 3HG2 VAL 37 3HG2 VAL 37 -13.143 11.831 2.123 274 H SER 38 H SER 38 -11.548 6.734 1.182 275 HA SER 38 HA SER 38 -12.954 5.099 3.175 276 1HB SER 38 1HB SER 38 -14.186 5.446 1.051 277 2HB SER 38 2HB SER 38 -12.857 4.681 0.179 278 HG SER 38 HG SER 38 -14.872 3.563 1.667 279 H HIS 39 H HIS 39 -11.156 4.040 0.315 280 HA HIS 39 HA HIS 39 -8.873 3.070 1.642 281 1HB HIS 39 1HB HIS 39 -9.333 0.699 1.769 282 2HB HIS 39 2HB HIS 39 -10.553 1.553 2.703 283 HD1 HIS 39 HD1 HIS 39 -12.891 1.982 1.186 284 HD2 HIS 39 HD2 HIS 39 -10.372 -1.160 0.134 285 HE1 HIS 39 HE1 HIS 39 -14.293 0.418 -0.197 286 HE2 HIS 39 HE2 HIS 39 -12.798 -1.550 -0.695 287 H TYR 40 H TYR 40 -7.433 2.034 0.185 288 HA TYR 40 HA TYR 40 -8.436 1.790 -2.569 289 1HB TYR 40 1HB TYR 40 -6.416 2.712 -3.474 290 2HB TYR 40 2HB TYR 40 -7.029 3.846 -2.280 291 HD1 TYR 40 HD1 TYR 40 -4.353 1.489 -3.102 292 HD2 TYR 40 HD2 TYR 40 -5.804 4.252 -0.212 293 HE1 TYR 40 HE1 TYR 40 -2.151 1.495 -2.014 294 HE2 TYR 40 HE2 TYR 40 -3.604 4.262 0.889 295 HH TYR 40 HH TYR 40 -1.625 2.682 1.056 296 H ILE 41 H ILE 41 -7.641 0.109 -3.779 297 HA ILE 41 HA ILE 41 -6.165 -1.930 -2.252 298 HB ILE 41 HB ILE 41 -7.890 -2.346 -4.707 299 1HG1 ILE 41 1HG1 ILE 41 -9.285 -3.681 -2.945 300 2HG1 ILE 41 2HG1 ILE 41 -8.469 -2.655 -1.770 301 1HG2 ILE 41 1HG2 ILE 41 -6.091 -3.967 -4.537 302 2HG2 ILE 41 2HG2 ILE 41 -7.641 -4.736 -4.199 303 3HG2 ILE 41 3HG2 ILE 41 -6.550 -4.332 -2.875 304 1HD1 ILE 41 1HD1 ILE 41 -9.381 -0.676 -2.858 305 2HD1 ILE 41 2HD1 ILE 41 -10.662 -1.783 -2.364 306 3HD1 ILE 41 3HD1 ILE 41 -10.176 -1.694 -4.058 307 H TYR 42 H TYR 42 -4.096 -1.920 -2.706 308 HA TYR 42 HA TYR 42 -3.173 -1.210 -5.392 309 1HB TYR 42 1HB TYR 42 -2.179 -0.221 -3.242 310 2HB TYR 42 2HB TYR 42 -1.471 -1.805 -2.965 311 HD1 TYR 42 HD1 TYR 42 -0.765 1.346 -4.132 312 HD2 TYR 42 HD2 TYR 42 -0.223 -2.725 -5.236 313 HE1 TYR 42 HE1 TYR 42 1.156 1.984 -5.525 314 HE2 TYR 42 HE2 TYR 42 1.700 -2.096 -6.631 315 HH TYR 42 HH TYR 42 2.470 0.032 -7.848 316 H TYR 43 H TYR 43 -2.933 -2.833 -6.792 317 HA TYR 43 HA TYR 43 -2.502 -5.549 -5.822 318 1HB TYR 43 1HB TYR 43 -2.885 -4.492 -8.635 319 2HB TYR 43 2HB TYR 43 -2.763 -6.196 -8.197 320 HD1 TYR 43 HD1 TYR 43 -4.528 -7.110 -6.558 321 HD2 TYR 43 HD2 TYR 43 -4.971 -3.437 -8.660 322 HE1 TYR 43 HE1 TYR 43 -6.957 -7.196 -6.193 323 HE2 TYR 43 HE2 TYR 43 -7.401 -3.518 -8.298 324 HH TYR 43 HH TYR 43 -9.136 -5.339 -7.870 325 H LEU 44 H LEU 44 -0.489 -6.241 -5.487 326 HA LEU 44 HA LEU 44 1.768 -4.802 -6.475 327 1HB LEU 44 1HB LEU 44 1.511 -7.406 -4.986 328 2HB LEU 44 2HB LEU 44 3.061 -6.770 -5.503 329 HG LEU 44 HG LEU 44 2.482 -4.672 -4.164 330 1HD1 LEU 44 1HD1 LEU 44 0.416 -6.535 -3.007 331 2HD1 LEU 44 2HD1 LEU 44 0.101 -5.044 -3.898 332 3HD1 LEU 44 3HD1 LEU 44 0.895 -4.980 -2.324 333 1HD2 LEU 44 1HD2 LEU 44 2.864 -7.278 -2.702 334 2HD2 LEU 44 2HD2 LEU 44 3.221 -5.672 -2.067 335 3HD2 LEU 44 3HD2 LEU 44 4.136 -6.301 -3.435 336 H ALA 45 H ALA 45 3.616 -6.100 -7.513 337 HA ALA 45 HA ALA 45 4.504 -7.167 -9.298 338 1HB ALA 45 1HB ALA 45 3.409 -9.080 -10.302 339 2HB ALA 45 2HB ALA 45 1.896 -8.663 -9.499 340 3HB ALA 45 3HB ALA 45 3.294 -9.160 -8.545 341 H THR 46 H THR 46 1.090 -6.379 -9.932 342 HA THR 46 HA THR 46 1.776 -5.454 -12.609 343 HB THR 46 HB THR 46 -0.714 -5.014 -12.757 344 HG1 THR 46 HG1 THR 46 -1.240 -6.695 -10.641 345 1HG2 THR 46 1HG2 THR 46 0.151 -7.828 -12.076 346 2HG2 THR 46 2HG2 THR 46 0.293 -7.057 -13.656 347 3HG2 THR 46 3HG2 THR 46 -1.300 -7.386 -12.973 348 H GLU 47 H GLU 47 1.035 -4.245 -9.459 349 HA GLU 47 HA GLU 47 1.176 -2.215 -8.504 350 1HB GLU 47 1HB GLU 47 2.544 -1.528 -11.101 351 2HB GLU 47 2HB GLU 47 2.357 -0.374 -9.786 352 1HG GLU 47 1HG GLU 47 3.616 -1.802 -8.305 353 2HG GLU 47 2HG GLU 47 3.738 -3.034 -9.557 354 H ASN 48 H ASN 48 -1.152 -3.033 -10.047 355 HA ASN 48 HA ASN 48 -2.297 -0.554 -11.033 356 1HB ASN 48 1HB ASN 48 -3.546 -3.280 -10.592 357 2HB ASN 48 2HB ASN 48 -4.353 -1.912 -11.349 358 1HD2 ASN 48 1HD2 ASN 48 -3.778 -4.555 -12.421 359 2HD2 ASN 48 2HD2 ASN 48 -2.829 -4.299 -13.848 360 H VAL 49 H VAL 49 -3.580 0.806 -9.864 361 HA VAL 49 HA VAL 49 -4.158 -0.029 -7.087 362 HB VAL 49 HB VAL 49 -3.748 2.837 -7.907 363 1HG1 VAL 49 1HG1 VAL 49 -3.528 1.408 -5.263 364 2HG1 VAL 49 2HG1 VAL 49 -4.858 2.445 -5.781 365 3HG1 VAL 49 3HG1 VAL 49 -3.252 3.129 -5.526 366 1HG2 VAL 49 1HG2 VAL 49 -1.707 1.691 -8.534 367 2HG2 VAL 49 2HG2 VAL 49 -1.630 0.914 -6.953 368 3HG2 VAL 49 3HG2 VAL 49 -1.433 2.662 -7.086 369 H HIS 50 H HIS 50 -6.210 0.083 -6.424 370 HA HIS 50 HA HIS 50 -8.139 1.615 -8.054 371 1HB HIS 50 1HB HIS 50 -8.427 -0.976 -6.547 372 2HB HIS 50 2HB HIS 50 -9.834 0.013 -6.912 373 HD1 HIS 50 HD1 HIS 50 -11.010 -1.164 -8.720 374 HD2 HIS 50 HD2 HIS 50 -6.898 -1.054 -9.372 375 HE1 HIS 50 HE1 HIS 50 -10.652 -2.208 -10.982 376 HE2 HIS 50 HE2 HIS 50 -8.150 -2.243 -11.311 377 H ILE 51 H ILE 51 -8.455 3.521 -7.035 378 HA ILE 51 HA ILE 51 -8.647 3.531 -4.097 379 HB ILE 51 HB ILE 51 -8.418 5.910 -5.951 380 1HG1 ILE 51 1HG1 ILE 51 -6.085 6.020 -4.746 381 2HG1 ILE 51 2HG1 ILE 51 -6.334 4.292 -4.524 382 1HG2 ILE 51 1HG2 ILE 51 -7.919 7.165 -3.906 383 2HG2 ILE 51 2HG2 ILE 51 -8.184 5.706 -2.951 384 3HG2 ILE 51 3HG2 ILE 51 -9.519 6.426 -3.850 385 1HD1 ILE 51 1HD1 ILE 51 -5.000 4.719 -6.492 386 2HD1 ILE 51 2HD1 ILE 51 -6.264 5.756 -7.152 387 3HD1 ILE 51 3HD1 ILE 51 -6.559 4.031 -6.949 388 H VAL 52 H VAL 52 -10.680 3.303 -3.370 389 HA VAL 52 HA VAL 52 -12.878 4.396 -4.951 390 HB VAL 52 HB VAL 52 -13.104 2.893 -2.343 391 1HG1 VAL 52 1HG1 VAL 52 -15.084 4.145 -2.927 392 2HG1 VAL 52 2HG1 VAL 52 -15.390 2.425 -3.170 393 3HG1 VAL 52 3HG1 VAL 52 -15.075 3.470 -4.556 394 1HG2 VAL 52 1HG2 VAL 52 -13.170 1.790 -5.152 395 2HG2 VAL 52 2HG2 VAL 52 -13.565 0.888 -3.688 396 3HG2 VAL 52 3HG2 VAL 52 -11.924 1.486 -3.939 397 H LEU 53 H LEU 53 -13.655 6.340 -4.571 398 HA LEU 53 HA LEU 53 -12.567 7.922 -2.446 399 1HB LEU 53 1HB LEU 53 -14.600 8.514 -4.582 400 2HB LEU 53 2HB LEU 53 -14.040 9.705 -3.429 401 HG LEU 53 HG LEU 53 -12.460 8.351 -5.609 402 1HD1 LEU 53 1HD1 LEU 53 -13.073 11.244 -5.031 403 2HD1 LEU 53 2HD1 LEU 53 -13.801 10.256 -6.297 404 3HD1 LEU 53 3HD1 LEU 53 -12.083 10.646 -6.361 405 1HD2 LEU 53 1HD2 LEU 53 -11.432 10.103 -3.379 406 2HD2 LEU 53 2HD2 LEU 53 -10.511 9.615 -4.799 407 3HD2 LEU 53 3HD2 LEU 53 -11.049 8.400 -3.642 408 H LYS 54 H LYS 54 -14.383 9.616 -1.638 409 HA LYS 54 HA LYS 54 -15.762 8.234 0.410 410 1HB LYS 54 1HB LYS 54 -14.841 10.530 0.640 411 2HB LYS 54 2HB LYS 54 -16.048 11.111 -0.499 412 1HG LYS 54 1HG LYS 54 -17.807 10.315 1.096 413 2HG LYS 54 2HG LYS 54 -16.516 9.991 2.252 414 1HD LYS 54 1HD LYS 54 -17.170 12.670 1.020 415 2HD LYS 54 2HD LYS 54 -17.552 12.165 2.666 416 1HE LYS 54 1HE LYS 54 -15.133 11.913 3.112 417 2HE LYS 54 2HE LYS 54 -14.795 12.508 1.486 418 1HZ LYS 54 1HZ LYS 54 -16.134 14.003 3.674 419 2HZ LYS 54 2HZ LYS 54 -15.957 14.578 2.090 420 3HZ LYS 54 3HZ LYS 54 -14.584 14.298 3.049 421 H ASN 55 H ASN 55 -16.646 9.288 -2.778 422 HA ASN 55 HA ASN 55 -19.408 8.481 -2.266 423 1HB ASN 55 1HB ASN 55 -19.262 10.963 -2.182 424 2HB ASN 55 2HB ASN 55 -18.637 10.958 -3.825 425 1HD2 ASN 55 1HD2 ASN 55 -21.169 8.793 -2.685 426 2HD2 ASN 55 2HD2 ASN 55 -22.437 9.494 -3.635 427 H ASP 56 H ASP 56 -18.109 6.628 -3.253 428 HA ASP 56 HA ASP 56 -18.613 5.041 -4.792 429 1HB ASP 56 1HB ASP 56 -20.701 6.071 -5.338 430 2HB ASP 56 2HB ASP 56 -19.903 7.312 -6.296 431 H ASN 57 H ASN 57 -17.409 8.019 -6.320 432 HA ASN 57 HA ASN 57 -16.416 6.879 -8.634 433 1HB ASN 57 1HB ASN 57 -16.616 9.294 -8.307 434 2HB ASN 57 2HB ASN 57 -15.298 9.255 -7.140 435 1HD2 ASN 57 1HD2 ASN 57 -13.196 9.109 -7.862 436 2HD2 ASN 57 2HD2 ASN 57 -12.767 9.250 -9.527 437 H THR 58 H THR 58 -14.722 5.715 -9.196 438 HA THR 58 HA THR 58 -12.721 5.111 -7.129 439 HB THR 58 HB THR 58 -13.559 3.314 -9.417 440 HG1 THR 58 HG1 THR 58 -14.821 3.870 -7.093 441 1HG2 THR 58 1HG2 THR 58 -11.313 2.876 -8.536 442 2HG2 THR 58 2HG2 THR 58 -12.424 1.571 -8.117 443 3HG2 THR 58 3HG2 THR 58 -11.970 2.769 -6.904 444 H VAL 59 H VAL 59 -10.694 5.651 -7.558 445 HA VAL 59 HA VAL 59 -9.983 6.525 -10.270 446 HB VAL 59 HB VAL 59 -8.377 6.876 -7.731 447 1HG1 VAL 59 1HG1 VAL 59 -8.238 8.258 -10.406 448 2HG1 VAL 59 2HG1 VAL 59 -7.072 7.103 -9.760 449 3HG1 VAL 59 3HG1 VAL 59 -7.275 8.678 -8.989 450 1HG2 VAL 59 1HG2 VAL 59 -9.263 9.166 -7.645 451 2HG2 VAL 59 2HG2 VAL 59 -10.532 7.959 -7.441 452 3HG2 VAL 59 3HG2 VAL 59 -10.343 8.787 -8.988 453 H LEU 60 H LEU 60 -8.331 5.555 -11.426 454 HA LEU 60 HA LEU 60 -7.128 3.168 -10.195 455 1HB LEU 60 1HB LEU 60 -8.109 3.616 -12.999 456 2HB LEU 60 2HB LEU 60 -6.922 2.380 -12.640 457 HG LEU 60 HG LEU 60 -8.612 1.434 -10.981 458 1HD1 LEU 60 1HD1 LEU 60 -10.062 3.396 -10.830 459 2HD1 LEU 60 2HD1 LEU 60 -10.950 1.968 -11.360 460 3HD1 LEU 60 3HD1 LEU 60 -10.493 3.206 -12.530 461 1HD2 LEU 60 1HD2 LEU 60 -8.118 0.388 -13.123 462 2HD2 LEU 60 2HD2 LEU 60 -9.300 1.431 -13.915 463 3HD2 LEU 60 3HD2 LEU 60 -9.830 0.241 -12.724 464 H LEU 61 H LEU 61 -5.061 3.477 -9.784 465 HA LEU 61 HA LEU 61 -3.448 5.090 -11.649 466 1HB LEU 61 1HB LEU 61 -2.487 4.002 -9.013 467 2HB LEU 61 2HB LEU 61 -1.807 5.309 -9.961 468 HG LEU 61 HG LEU 61 -4.435 5.452 -8.488 469 1HD1 LEU 61 1HD1 LEU 61 -2.484 5.268 -6.999 470 2HD1 LEU 61 2HD1 LEU 61 -3.267 6.844 -6.901 471 3HD1 LEU 61 3HD1 LEU 61 -1.763 6.663 -7.805 472 1HD2 LEU 61 1HD2 LEU 61 -4.382 6.914 -10.425 473 2HD2 LEU 61 2HD2 LEU 61 -2.817 7.554 -9.924 474 3HD2 LEU 61 3HD2 LEU 61 -4.250 7.859 -8.943 475 H LYS 62 H LYS 62 -1.209 4.179 -12.056 476 HA LYS 62 HA LYS 62 -0.972 1.325 -11.686 477 1HB LYS 62 1HB LYS 62 -2.224 1.450 -13.787 478 2HB LYS 62 2HB LYS 62 -0.999 2.520 -14.461 479 1HG LYS 62 1HG LYS 62 0.646 0.790 -14.403 480 2HG LYS 62 2HG LYS 62 -0.438 -0.279 -13.515 481 1HD LYS 62 1HD LYS 62 -1.947 -0.346 -15.440 482 2HD LYS 62 2HD LYS 62 -0.854 0.722 -16.329 483 1HE LYS 62 1HE LYS 62 -0.582 -1.688 -16.890 484 2HE LYS 62 2HE LYS 62 0.887 -0.923 -16.287 485 1HZ LYS 62 1HZ LYS 62 0.424 -3.154 -15.336 486 2HZ LYS 62 2HZ LYS 62 -0.954 -2.513 -14.584 487 3HZ LYS 62 3HZ LYS 62 0.582 -1.935 -14.168 488 H GLY 63 H GLY 63 0.989 0.933 -11.051 489 1HA GLY 63 1HA GLY 63 3.215 2.662 -11.791 490 2HA GLY 63 2HA GLY 63 3.282 1.269 -10.715 491 H LEU 64 H LEU 64 5.320 1.004 -12.154 492 HA LEU 64 HA LEU 64 4.853 -1.048 -14.036 493 1HB LEU 64 1HB LEU 64 5.639 0.070 -16.082 494 2HB LEU 64 2HB LEU 64 4.099 0.684 -15.512 495 HG LEU 64 HG LEU 64 6.461 2.197 -14.595 496 1HD1 LEU 64 1HD1 LEU 64 7.163 1.617 -16.846 497 2HD1 LEU 64 2HD1 LEU 64 6.739 3.326 -16.744 498 3HD1 LEU 64 3HD1 LEU 64 5.622 2.183 -17.490 499 1HD2 LEU 64 1HD2 LEU 64 3.836 2.987 -15.866 500 2HD2 LEU 64 2HD2 LEU 64 5.009 4.086 -15.140 501 3HD2 LEU 64 3HD2 LEU 64 4.161 2.910 -14.135 502 H LYS 65 H LYS 65 6.430 -1.083 -11.930 503 HA LYS 65 HA LYS 65 9.158 -1.032 -13.047 504 1HB LYS 65 1HB LYS 65 8.270 -1.461 -10.180 505 2HB LYS 65 2HB LYS 65 9.935 -1.376 -10.740 506 1HG LYS 65 1HG LYS 65 7.916 0.853 -10.836 507 2HG LYS 65 2HG LYS 65 9.254 0.707 -9.697 508 1HD LYS 65 1HD LYS 65 10.862 0.958 -11.452 509 2HD LYS 65 2HD LYS 65 9.604 0.867 -12.689 510 1HE LYS 65 1HE LYS 65 9.819 3.027 -10.594 511 2HE LYS 65 2HE LYS 65 10.392 3.177 -12.254 512 1HZ LYS 65 1HZ LYS 65 8.207 3.048 -13.078 513 2HZ LYS 65 2HZ LYS 65 8.129 4.131 -11.772 514 3HZ LYS 65 3HZ LYS 65 7.572 2.540 -11.588 515 H ASN 66 H ASN 66 6.532 -2.938 -11.975 516 HA ASN 66 HA ASN 66 5.972 -5.112 -12.248 517 1HB ASN 66 1HB ASN 66 6.813 -4.711 -14.567 518 2HB ASN 66 2HB ASN 66 8.389 -5.309 -14.059 519 1HD2 ASN 66 1HD2 ASN 66 5.216 -6.521 -13.117 520 2HD2 ASN 66 2HD2 ASN 66 5.406 -8.083 -13.833 521 H ILE 67 H ILE 67 6.409 -5.651 -10.096 522 HA ILE 67 HA ILE 67 8.929 -7.118 -9.706 523 HB ILE 67 HB ILE 67 7.077 -6.012 -7.583 524 1HG1 ILE 67 1HG1 ILE 67 9.811 -5.076 -8.492 525 2HG1 ILE 67 2HG1 ILE 67 8.289 -4.251 -8.812 526 1HG2 ILE 67 1HG2 ILE 67 9.778 -7.341 -7.336 527 2HG2 ILE 67 2HG2 ILE 67 8.230 -8.037 -6.858 528 3HG2 ILE 67 3HG2 ILE 67 8.859 -6.622 -6.013 529 1HD1 ILE 67 1HD1 ILE 67 9.496 -3.190 -7.004 530 2HD1 ILE 67 2HD1 ILE 67 9.519 -4.706 -6.105 531 3HD1 ILE 67 3HD1 ILE 67 7.988 -3.890 -6.418 532 H VAL 68 H VAL 68 8.192 -9.011 -10.709 533 HA VAL 68 HA VAL 68 5.883 -10.337 -9.509 534 HB VAL 68 HB VAL 68 7.588 -11.304 -11.814 535 1HG1 VAL 68 1HG1 VAL 68 5.699 -12.803 -12.270 536 2HG1 VAL 68 2HG1 VAL 68 4.874 -12.198 -10.832 537 3HG1 VAL 68 3HG1 VAL 68 6.385 -13.094 -10.670 538 1HG2 VAL 68 1HG2 VAL 68 5.768 -10.544 -13.263 539 2HG2 VAL 68 2HG2 VAL 68 6.488 -9.199 -12.376 540 3HG2 VAL 68 3HG2 VAL 68 4.935 -9.864 -11.865 541 H SER 69 H SER 69 7.157 -10.372 -7.511 542 HA SER 69 HA SER 69 8.704 -12.874 -7.376 543 1HB SER 69 1HB SER 69 9.139 -10.406 -5.665 544 2HB SER 69 2HB SER 69 10.092 -11.892 -5.632 545 HG SER 69 HG SER 69 9.864 -10.719 -8.116 546 H VAL 70 H VAL 70 5.849 -12.026 -7.042 547 HA VAL 70 HA VAL 70 5.215 -12.196 -4.258 548 HB VAL 70 HB VAL 70 3.361 -12.550 -6.620 549 1HG1 VAL 70 1HG1 VAL 70 2.425 -13.322 -4.510 550 2HG1 VAL 70 2HG1 VAL 70 1.610 -11.857 -5.057 551 3HG1 VAL 70 3HG1 VAL 70 2.801 -11.773 -3.758 552 1HG2 VAL 70 1HG2 VAL 70 2.856 -10.180 -6.433 553 2HG2 VAL 70 2HG2 VAL 70 4.573 -10.421 -6.765 554 3HG2 VAL 70 3HG2 VAL 70 4.037 -10.013 -5.134 555 H LYS 71 H LYS 71 5.404 -14.027 -3.165 556 HA LYS 71 HA LYS 71 5.177 -16.619 -4.398 557 1HB LYS 71 1HB LYS 71 5.249 -15.838 -1.468 558 2HB LYS 71 2HB LYS 71 5.408 -17.475 -2.092 559 1HG LYS 71 1HG LYS 71 7.319 -15.249 -2.758 560 2HG LYS 71 2HG LYS 71 7.549 -16.373 -1.419 561 1HD LYS 71 1HD LYS 71 7.268 -17.168 -4.317 562 2HD LYS 71 2HD LYS 71 8.800 -17.023 -3.453 563 1HE LYS 71 1HE LYS 71 7.998 -18.736 -1.846 564 2HE LYS 71 2HE LYS 71 6.544 -18.927 -2.824 565 1HZ LYS 71 1HZ LYS 71 7.979 -19.575 -4.697 566 2HZ LYS 71 2HZ LYS 71 8.123 -20.627 -3.375 567 3HZ LYS 71 3HZ LYS 71 9.336 -19.484 -3.682 568 H PHE 72 H PHE 72 3.353 -17.901 -4.481 569 HA PHE 72 HA PHE 72 0.865 -16.587 -3.845 570 1HB PHE 72 1HB PHE 72 -0.229 -18.464 -4.946 571 2HB PHE 72 2HB PHE 72 1.085 -17.853 -5.936 572 HD1 PHE 72 HD1 PHE 72 3.380 -19.142 -5.623 573 HD2 PHE 72 HD2 PHE 72 -0.457 -20.718 -4.684 574 HE1 PHE 72 HE1 PHE 72 4.264 -21.425 -5.851 575 HE2 PHE 72 HE2 PHE 72 0.422 -23.003 -4.904 576 HZ PHE 72 HZ PHE 72 2.783 -23.359 -5.489 577 H SER 73 H SER 73 2.504 -17.195 -1.627 578 HA SER 73 HA SER 73 1.024 -19.267 -0.184 579 1HB SER 73 1HB SER 73 3.534 -17.734 0.548 580 2HB SER 73 2HB SER 73 2.803 -19.011 1.520 581 HG SER 73 HG SER 73 3.326 -20.493 -0.007 582 H LYS 74 H LYS 74 1.331 -18.253 2.410 583 HA LYS 74 HA LYS 74 0.302 -15.581 2.535 584 1HB LYS 74 1HB LYS 74 -1.815 -16.298 3.724 585 2HB LYS 74 2HB LYS 74 -1.780 -16.566 1.988 586 1HG LYS 74 1HG LYS 74 -1.254 -18.932 2.381 587 2HG LYS 74 2HG LYS 74 -1.336 -18.644 4.120 588 1HD LYS 74 1HD LYS 74 -3.670 -17.997 3.928 589 2HD LYS 74 2HD LYS 74 -3.602 -18.203 2.178 590 1HE LYS 74 1HE LYS 74 -3.185 -20.380 4.226 591 2HE LYS 74 2HE LYS 74 -4.652 -20.124 3.285 592 1HZ LYS 74 1HZ LYS 74 -1.973 -20.875 2.236 593 2HZ LYS 74 2HZ LYS 74 -3.304 -20.483 1.260 594 3HZ LYS 74 3HZ LYS 74 -3.366 -21.845 2.267 595 H ASP 75 H ASP 75 1.784 -14.965 4.010 596 HA ASP 75 HA ASP 75 1.539 -16.177 6.670 597 1HB ASP 75 1HB ASP 75 3.578 -17.136 5.833 598 2HB ASP 75 2HB ASP 75 4.139 -15.570 5.252 599 H ARG 76 H ARG 76 1.872 -14.771 8.395 600 HA ARG 76 HA ARG 76 1.710 -11.931 7.690 601 1HB ARG 76 1HB ARG 76 0.958 -11.653 10.075 602 2HB ARG 76 2HB ARG 76 -0.120 -12.600 9.060 603 1HG ARG 76 1HG ARG 76 0.566 -14.624 10.065 604 2HG ARG 76 2HG ARG 76 1.926 -13.845 10.872 605 1HD ARG 76 1HD ARG 76 -0.935 -13.090 11.408 606 2HD ARG 76 2HD ARG 76 -0.104 -14.364 12.302 607 HE ARG 76 HE ARG 76 1.606 -12.332 12.603 608 1HH1 ARG 76 1HH1 ARG 76 -1.891 -12.465 12.968 609 2HH1 ARG 76 2HH1 ARG 76 -1.927 -11.222 14.183 610 1HH2 ARG 76 1HH2 ARG 76 1.547 -10.714 14.215 611 2HH2 ARG 76 2HH2 ARG 76 0.013 -10.221 14.888 612 H HIS 77 H HIS 77 3.839 -14.240 9.060 613 HA HIS 77 HA HIS 77 5.099 -12.576 10.996 614 1HB HIS 77 1HB HIS 77 6.123 -15.090 9.659 615 2HB HIS 77 2HB HIS 77 6.845 -14.320 11.068 616 HD1 HIS 77 HD1 HIS 77 4.146 -16.601 10.020 617 HD2 HIS 77 HD2 HIS 77 5.257 -14.508 13.446 618 HE1 HIS 77 HE1 HIS 77 2.848 -17.646 11.913 619 HE2 HIS 77 HE2 HIS 77 3.380 -16.225 13.930 620 H LEU 78 H LEU 78 5.883 -13.465 7.653 621 HA LEU 78 HA LEU 78 8.313 -12.031 7.531 622 1HB LEU 78 1HB LEU 78 7.562 -13.734 5.875 623 2HB LEU 78 2HB LEU 78 6.387 -12.581 5.273 624 HG LEU 78 HG LEU 78 8.166 -11.095 4.526 625 1HD1 LEU 78 1HD1 LEU 78 9.791 -11.592 6.295 626 2HD1 LEU 78 2HD1 LEU 78 10.509 -11.727 4.690 627 3HD1 LEU 78 3HD1 LEU 78 10.071 -13.181 5.583 628 1HD2 LEU 78 1HD2 LEU 78 7.415 -12.852 3.000 629 2HD2 LEU 78 2HD2 LEU 78 8.636 -13.944 3.649 630 3HD2 LEU 78 3HD2 LEU 78 9.125 -12.494 2.773 631 H ILE 79 H ILE 79 4.987 -11.051 7.295 632 HA ILE 79 HA ILE 79 5.492 -8.415 6.312 633 HB ILE 79 HB ILE 79 3.140 -9.331 7.983 634 1HG1 ILE 79 1HG1 ILE 79 3.389 -9.284 4.965 635 2HG1 ILE 79 2HG1 ILE 79 3.486 -10.741 5.950 636 1HG2 ILE 79 1HG2 ILE 79 1.967 -7.471 6.895 637 2HG2 ILE 79 2HG2 ILE 79 3.451 -7.031 6.051 638 3HG2 ILE 79 3HG2 ILE 79 3.366 -6.911 7.810 639 1HD1 ILE 79 1HD1 ILE 79 1.203 -10.406 6.699 640 2HD1 ILE 79 2HD1 ILE 79 1.285 -10.464 4.939 641 3HD1 ILE 79 3HD1 ILE 79 1.105 -8.913 5.762 642 H GLU 80 H GLU 80 4.855 -9.789 9.524 643 HA GLU 80 HA GLU 80 5.045 -7.458 11.035 644 1HB GLU 80 1HB GLU 80 5.803 -10.274 11.827 645 2HB GLU 80 2HB GLU 80 5.465 -8.956 12.934 646 1HG GLU 80 1HG GLU 80 3.177 -8.862 12.172 647 2HG GLU 80 2HG GLU 80 3.504 -10.116 10.979 648 H THR 81 H THR 81 7.553 -9.762 10.077 649 HA THR 81 HA THR 81 9.637 -8.528 11.542 650 HB THR 81 HB THR 81 11.135 -9.813 9.910 651 HG1 THR 81 HG1 THR 81 8.748 -11.161 9.203 652 1HG2 THR 81 1HG2 THR 81 9.044 -11.335 11.475 653 2HG2 THR 81 2HG2 THR 81 10.537 -10.660 12.130 654 3HG2 THR 81 3HG2 THR 81 10.603 -11.967 10.948 655 H THR 82 H THR 82 8.441 -8.125 8.240 656 HA THR 82 HA THR 82 10.512 -6.326 7.455 657 HB THR 82 HB THR 82 7.766 -6.710 6.244 658 HG1 THR 82 HG1 THR 82 8.781 -8.632 6.005 659 1HG2 THR 82 1HG2 THR 82 10.282 -5.488 5.097 660 2HG2 THR 82 2HG2 THR 82 8.814 -4.614 5.536 661 3HG2 THR 82 3HG2 THR 82 8.783 -5.778 4.211 662 H SER 83 H SER 83 7.290 -5.949 8.845 663 HA SER 83 HA SER 83 7.124 -3.149 8.726 664 1HB SER 83 1HB SER 83 5.259 -4.704 9.352 665 2HB SER 83 2HB SER 83 6.049 -4.958 10.909 666 HG SER 83 HG SER 83 4.455 -2.925 10.085 667 H ASN 84 H ASN 84 8.390 -5.309 11.245 668 HA ASN 84 HA ASN 84 9.424 -3.320 12.950 669 1HB ASN 84 1HB ASN 84 9.177 -5.583 13.752 670 2HB ASN 84 2HB ASN 84 10.238 -6.198 12.492 671 1HD2 ASN 84 1HD2 ASN 84 12.413 -6.146 12.773 672 2HD2 ASN 84 2HD2 ASN 84 13.178 -5.645 14.240 673 H LYS 85 H LYS 85 10.693 -4.908 10.108 674 HA LYS 85 HA LYS 85 13.351 -3.960 10.278 675 1HB LYS 85 1HB LYS 85 12.455 -5.871 8.870 676 2HB LYS 85 2HB LYS 85 11.844 -4.658 7.758 677 1HG LYS 85 1HG LYS 85 14.060 -3.913 7.252 678 2HG LYS 85 2HG LYS 85 14.740 -4.952 8.508 679 1HD LYS 85 1HD LYS 85 13.746 -6.905 7.271 680 2HD LYS 85 2HD LYS 85 13.381 -5.789 5.956 681 1HE LYS 85 1HE LYS 85 15.706 -5.300 5.645 682 2HE LYS 85 2HE LYS 85 16.138 -6.223 7.085 683 1HZ LYS 85 1HZ LYS 85 16.590 -7.534 5.160 684 2HZ LYS 85 2HZ LYS 85 15.028 -7.299 4.546 685 3HZ LYS 85 3HZ LYS 85 15.254 -8.219 5.953 686 H LEU 86 H LEU 86 10.387 -2.597 9.013 687 HA LEU 86 HA LEU 86 11.629 -0.405 7.666 688 1HB LEU 86 1HB LEU 86 9.395 -1.201 7.061 689 2HB LEU 86 2HB LEU 86 8.795 -0.764 8.646 690 HG LEU 86 HG LEU 86 9.272 1.620 8.134 691 1HD1 LEU 86 1HD1 LEU 86 11.043 1.312 6.497 692 2HD1 LEU 86 2HD1 LEU 86 9.722 2.259 5.811 693 3HD1 LEU 86 3HD1 LEU 86 9.902 0.558 5.384 694 1HD2 LEU 86 1HD2 LEU 86 7.467 0.165 6.206 695 2HD2 LEU 86 2HD2 LEU 86 7.426 1.900 6.523 696 3HD2 LEU 86 3HD2 LEU 86 7.039 0.760 7.811 697 H LYS 87 H LYS 87 10.481 -1.012 10.907 698 HA LYS 87 HA LYS 87 10.746 1.699 11.798 699 1HB LYS 87 1HB LYS 87 9.234 0.152 12.936 700 2HB LYS 87 2HB LYS 87 10.582 -0.900 13.340 701 1HG LYS 87 1HG LYS 87 9.905 0.401 15.263 702 2HG LYS 87 2HG LYS 87 11.529 0.861 14.750 703 1HD LYS 87 1HD LYS 87 10.608 2.812 13.597 704 2HD LYS 87 2HD LYS 87 8.983 2.349 14.106 705 1HE LYS 87 1HE LYS 87 9.635 2.601 16.443 706 2HE LYS 87 2HE LYS 87 11.271 3.029 15.950 707 1HZ LYS 87 1HZ LYS 87 9.916 4.974 16.495 708 2HZ LYS 87 2HZ LYS 87 8.825 4.572 15.261 709 3HZ LYS 87 3HZ LYS 87 10.422 4.995 14.874 710 H SER 88 H SER 88 12.706 -1.229 11.994 711 HA SER 88 HA SER 88 14.809 0.001 13.494 712 1HB SER 88 1HB SER 88 14.425 -2.363 13.751 713 2HB SER 88 2HB SER 88 14.614 -2.632 12.020 714 HG SER 88 HG SER 88 16.590 -1.930 13.931 715 H ARG 89 H ARG 89 14.751 -1.343 10.182 716 HA ARG 89 HA ARG 89 17.306 -0.090 9.620 717 1HB ARG 89 1HB ARG 89 15.521 -1.750 7.832 718 2HB ARG 89 2HB ARG 89 17.191 -1.306 7.507 719 1HG ARG 89 1HG ARG 89 16.265 -3.056 9.781 720 2HG ARG 89 2HG ARG 89 16.968 -3.625 8.265 721 1HD ARG 89 1HD ARG 89 18.852 -3.603 9.529 722 2HD ARG 89 2HD ARG 89 18.881 -1.934 8.966 723 HE ARG 89 HE ARG 89 17.501 -2.339 11.480 724 1HH1 ARG 89 1HH1 ARG 89 20.522 -1.543 9.899 725 2HH1 ARG 89 2HH1 ARG 89 21.254 -0.897 11.339 726 1HH2 ARG 89 1HH2 ARG 89 18.457 -1.477 13.377 727 2HH2 ARG 89 2HH2 ARG 89 20.079 -0.847 13.309 728 H GLU 90 H GLU 90 13.957 0.369 8.883 729 HA GLU 90 HA GLU 90 12.783 1.874 7.682 730 1HB GLU 90 1HB GLU 90 14.055 3.414 9.216 731 2HB GLU 90 2HB GLU 90 15.206 3.659 7.912 732 1HG GLU 90 1HG GLU 90 13.420 4.554 6.505 733 2HG GLU 90 2HG GLU 90 12.269 4.312 7.817 734 H ILE 91 H ILE 91 13.445 0.096 6.073 735 HA ILE 91 HA ILE 91 15.075 0.827 3.862 736 HB ILE 91 HB ILE 91 13.879 -1.048 2.699 737 1HG1 ILE 91 1HG1 ILE 91 12.457 -1.271 5.368 738 2HG1 ILE 91 2HG1 ILE 91 11.713 -0.843 3.834 739 1HG2 ILE 91 1HG2 ILE 91 14.840 -2.810 4.116 740 2HG2 ILE 91 2HG2 ILE 91 15.019 -1.646 5.427 741 3HG2 ILE 91 3HG2 ILE 91 15.933 -1.439 3.935 742 1HD1 ILE 91 1HD1 ILE 91 12.192 -3.056 2.962 743 2HD1 ILE 91 2HD1 ILE 91 11.263 -3.156 4.462 744 3HD1 ILE 91 3HD1 ILE 91 12.994 -3.489 4.472 745 H THR 92 H THR 92 14.085 0.917 1.592 746 HA THR 92 HA THR 92 12.384 3.193 1.455 747 HB THR 92 HB THR 92 12.673 1.644 -1.023 748 HG1 THR 92 HG1 THR 92 14.719 1.176 -0.811 749 1HG2 THR 92 1HG2 THR 92 12.020 4.014 -0.943 750 2HG2 THR 92 2HG2 THR 92 13.518 3.788 -1.847 751 3HG2 THR 92 3HG2 THR 92 13.567 4.412 -0.198 752 H PHE 93 H PHE 93 10.390 3.267 0.138 753 HA PHE 93 HA PHE 93 8.397 1.626 1.176 754 1HB PHE 93 1HB PHE 93 8.006 3.882 0.255 755 2HB PHE 93 2HB PHE 93 8.324 3.270 -1.365 756 HD1 PHE 93 HD1 PHE 93 6.031 2.954 1.528 757 HD2 PHE 93 HD2 PHE 93 6.610 2.315 -2.641 758 HE1 PHE 93 HE1 PHE 93 3.646 2.397 1.284 759 HE2 PHE 93 HE2 PHE 93 4.228 1.752 -2.890 760 HZ PHE 93 HZ PHE 93 2.742 1.795 -0.928 761 H GLN 94 H GLN 94 10.096 1.445 -1.917 762 HA GLN 94 HA GLN 94 8.506 -0.671 -2.954 763 1HB GLN 94 1HB GLN 94 10.546 -0.913 -4.537 764 2HB GLN 94 2HB GLN 94 9.549 0.530 -4.628 765 1HG GLN 94 1HG GLN 94 11.159 1.832 -3.498 766 2HG GLN 94 2HG GLN 94 12.074 0.402 -3.012 767 1HE2 GLN 94 1HE2 GLN 94 13.439 -0.567 -4.434 768 2HE2 GLN 94 2HE2 GLN 94 13.866 0.127 -5.965 769 H GLU 95 H GLU 95 11.267 -0.570 -0.854 770 HA GLU 95 HA GLU 95 11.907 -3.358 -1.220 771 1HB GLU 95 1HB GLU 95 12.894 -1.180 0.586 772 2HB GLU 95 2HB GLU 95 13.253 -2.853 0.980 773 1HG GLU 95 1HG GLU 95 15.075 -1.808 -0.244 774 2HG GLU 95 2HG GLU 95 14.375 -3.144 -1.149 775 H TYR 96 H TYR 96 10.085 -1.393 1.059 776 HA TYR 96 HA TYR 96 9.450 -3.431 2.887 777 1HB TYR 96 1HB TYR 96 9.023 -1.114 3.445 778 2HB TYR 96 2HB TYR 96 7.909 -0.945 2.095 779 HD1 TYR 96 HD1 TYR 96 8.374 -2.705 5.345 780 HD2 TYR 96 HD2 TYR 96 5.634 -1.389 2.370 781 HE1 TYR 96 HE1 TYR 96 6.493 -3.320 6.811 782 HE2 TYR 96 HE2 TYR 96 3.751 -1.998 3.823 783 HH TYR 96 HH TYR 96 4.082 -2.727 7.109 784 H ARG 97 H ARG 97 7.712 -2.275 -0.011 785 HA ARG 97 HA ARG 97 5.655 -4.224 0.174 786 1HB ARG 97 1HB ARG 97 4.928 -3.493 -1.970 787 2HB ARG 97 2HB ARG 97 5.515 -2.069 -1.125 788 1HG ARG 97 1HG ARG 97 7.572 -2.123 -2.393 789 2HG ARG 97 2HG ARG 97 7.068 -3.617 -3.190 790 1HD ARG 97 1HD ARG 97 5.065 -2.349 -4.039 791 2HD ARG 97 2HD ARG 97 5.832 -0.881 -3.434 792 HE ARG 97 HE ARG 97 7.690 -2.149 -5.057 793 1HH1 ARG 97 1HH1 ARG 97 4.544 -0.668 -5.382 794 2HH1 ARG 97 2HH1 ARG 97 4.753 -0.260 -7.054 795 1HH2 ARG 97 1HH2 ARG 97 7.973 -1.601 -7.297 796 2HH2 ARG 97 2HH2 ARG 97 6.678 -0.800 -8.141 797 H ARG 98 H ARG 98 8.866 -4.277 -1.087 798 HA ARG 98 HA ARG 98 8.731 -6.428 -2.875 799 1HB ARG 98 1HB ARG 98 10.691 -4.844 -2.358 800 2HB ARG 98 2HB ARG 98 11.044 -5.913 -1.008 801 1HG ARG 98 1HG ARG 98 12.392 -6.892 -2.511 802 2HG ARG 98 2HG ARG 98 10.904 -7.715 -2.988 803 1HD ARG 98 1HD ARG 98 12.076 -6.825 -4.932 804 2HD ARG 98 2HD ARG 98 10.515 -6.030 -4.712 805 HE ARG 98 HE ARG 98 12.079 -4.317 -3.453 806 1HH1 ARG 98 1HH1 ARG 98 12.639 -5.946 -6.509 807 2HH1 ARG 98 2HH1 ARG 98 13.630 -4.662 -7.136 808 1HH2 ARG 98 1HH2 ARG 98 13.385 -2.647 -4.274 809 2HH2 ARG 98 2HH2 ARG 98 14.051 -2.789 -5.882 810 H ASN 99 H ASN 99 9.411 -6.353 0.603 811 HA ASN 99 HA ASN 99 9.677 -9.180 0.840 812 1HB ASN 99 1HB ASN 99 9.370 -6.988 2.884 813 2HB ASN 99 2HB ASN 99 9.535 -8.684 3.326 814 1HD2 ASN 99 1HD2 ASN 99 11.132 -5.892 1.998 815 2HD2 ASN 99 2HD2 ASN 99 12.736 -6.527 2.092 816 H LEU 100 H LEU 100 7.004 -6.940 1.226 817 HA LEU 100 HA LEU 100 5.228 -8.758 2.466 818 1HB LEU 100 1HB LEU 100 4.976 -6.164 1.063 819 2HB LEU 100 2HB LEU 100 3.528 -7.150 1.144 820 HG LEU 100 HG LEU 100 3.664 -7.182 3.588 821 1HD1 LEU 100 1HD1 LEU 100 6.064 -7.039 3.887 822 2HD1 LEU 100 2HD1 LEU 100 5.263 -5.733 4.756 823 3HD1 LEU 100 3HD1 LEU 100 6.070 -5.405 3.223 824 1HD2 LEU 100 1HD2 LEU 100 3.125 -4.845 3.981 825 2HD2 LEU 100 2HD2 LEU 100 2.404 -5.419 2.476 826 3HD2 LEU 100 3HD2 LEU 100 3.849 -4.410 2.434 827 H ALA 101 H ALA 101 5.915 -8.013 -0.916 828 HA ALA 101 HA ALA 101 3.994 -9.695 -2.093 829 1HB ALA 101 1HB ALA 101 5.476 -9.674 -4.062 830 2HB ALA 101 2HB ALA 101 6.741 -8.928 -3.084 831 3HB ALA 101 3HB ALA 101 5.236 -8.061 -3.391 832 H LYS 102 H LYS 102 7.184 -10.282 -0.795 833 HA LYS 102 HA LYS 102 7.468 -12.961 -1.676 834 1HB LYS 102 1HB LYS 102 9.273 -11.351 -0.865 835 2HB LYS 102 2HB LYS 102 8.742 -11.729 0.765 836 1HG LYS 102 1HG LYS 102 9.295 -14.083 0.394 837 2HG LYS 102 2HG LYS 102 9.855 -13.683 -1.235 838 1HD LYS 102 1HD LYS 102 11.433 -12.029 -0.128 839 2HD LYS 102 2HD LYS 102 11.014 -12.802 1.402 840 1HE LYS 102 1HE LYS 102 13.063 -13.748 0.539 841 2HE LYS 102 2HE LYS 102 11.781 -14.958 0.489 842 1HZ LYS 102 1HZ LYS 102 12.471 -13.288 -1.861 843 2HZ LYS 102 2HZ LYS 102 11.573 -14.728 -1.822 844 3HZ LYS 102 3HZ LYS 102 13.243 -14.764 -1.541 845 H ALA 103 H ALA 103 5.698 -11.490 0.897 846 HA ALA 103 HA ALA 103 5.451 -13.953 2.432 847 1HB ALA 103 1HB ALA 103 4.159 -12.614 4.002 848 2HB ALA 103 2HB ALA 103 4.172 -11.256 2.875 849 3HB ALA 103 3HB ALA 103 5.678 -11.810 3.607 850 H GLY 104 H GLY 104 3.970 -12.580 -0.231 851 1HA GLY 104 1HA GLY 104 2.289 -13.789 -1.413 852 2HA GLY 104 2HA GLY 104 1.667 -14.367 0.124 853 H VAL 105 H VAL 105 2.394 -11.093 0.296 854 HA VAL 105 HA VAL 105 -0.397 -10.406 0.423 855 HB VAL 105 HB VAL 105 2.019 -8.595 0.616 856 1HG1 VAL 105 1HG1 VAL 105 0.023 -7.347 0.051 857 2HG1 VAL 105 2HG1 VAL 105 0.462 -7.039 1.732 858 3HG1 VAL 105 3HG1 VAL 105 -0.870 -8.133 1.353 859 1HG2 VAL 105 1HG2 VAL 105 2.030 -10.304 2.353 860 2HG2 VAL 105 2HG2 VAL 105 0.375 -9.885 2.790 861 3HG2 VAL 105 3HG2 VAL 105 1.674 -8.718 3.036 862 H PHE 106 H PHE 106 -1.400 -10.380 -1.482 863 HA PHE 106 HA PHE 106 -0.165 -8.901 -3.703 864 1HB PHE 106 1HB PHE 106 -0.904 -11.289 -4.069 865 2HB PHE 106 2HB PHE 106 -2.560 -10.746 -3.828 866 HD1 PHE 106 HD1 PHE 106 -3.723 -9.511 -5.526 867 HD2 PHE 106 HD2 PHE 106 0.360 -10.594 -6.038 868 HE1 PHE 106 HE1 PHE 106 -3.874 -8.936 -7.913 869 HE2 PHE 106 HE2 PHE 106 0.216 -10.018 -8.426 870 HZ PHE 106 HZ PHE 106 -1.902 -9.187 -9.367 871 H ARG 107 H ARG 107 -2.806 -8.956 -1.474 872 HA ARG 107 HA ARG 107 -4.137 -6.751 -2.882 873 1HB ARG 107 1HB ARG 107 -5.128 -8.417 -0.560 874 2HB ARG 107 2HB ARG 107 -6.052 -7.201 -1.431 875 1HG ARG 107 1HG ARG 107 -4.944 -9.648 -2.769 876 2HG ARG 107 2HG ARG 107 -6.525 -9.620 -1.987 877 1HD ARG 107 1HD ARG 107 -7.175 -7.742 -3.456 878 2HD ARG 107 2HD ARG 107 -5.618 -7.875 -4.275 879 HE ARG 107 HE ARG 107 -6.440 -10.290 -4.699 880 1HH1 ARG 107 1HH1 ARG 107 -8.472 -7.440 -4.670 881 2HH1 ARG 107 2HH1 ARG 107 -9.634 -8.093 -5.789 882 1HH2 ARG 107 1HH2 ARG 107 -7.975 -11.170 -6.160 883 2HH2 ARG 107 2HH2 ARG 107 -9.339 -10.201 -6.644 884 H TRP 108 H TRP 108 -2.792 -5.076 -2.291 885 HA TRP 108 HA TRP 108 -2.293 -4.538 0.522 886 1HB TRP 108 1HB TRP 108 -0.569 -4.121 -1.239 887 2HB TRP 108 2HB TRP 108 -1.619 -2.900 -1.939 888 HD1 TRP 108 HD1 TRP 108 -2.383 -1.090 0.415 889 HE1 TRP 108 HE1 TRP 108 -0.615 0.244 1.724 890 HE3 TRP 108 HE3 TRP 108 1.748 -3.870 -0.735 891 HZ2 TRP 108 HZ2 TRP 108 2.162 0.141 2.195 892 HZ3 TRP 108 HZ3 TRP 108 3.926 -3.176 0.178 893 HH2 TRP 108 HH2 TRP 108 4.127 -1.215 1.609 894 H VAL 109 H VAL 109 -4.237 -4.004 1.472 895 HA VAL 109 HA VAL 109 -5.808 -1.885 0.162 896 HB VAL 109 HB VAL 109 -6.809 -3.797 2.273 897 1HG1 VAL 109 1HG1 VAL 109 -8.088 -1.746 2.103 898 2HG1 VAL 109 2HG1 VAL 109 -9.023 -3.092 1.446 899 3HG1 VAL 109 3HG1 VAL 109 -8.233 -1.951 0.359 900 1HG2 VAL 109 1HG2 VAL 109 -6.176 -5.108 0.345 901 2HG2 VAL 109 2HG2 VAL 109 -7.049 -4.011 -0.725 902 3HG2 VAL 109 3HG2 VAL 109 -7.934 -4.999 0.436 903 H THR 110 H THR 110 -5.101 -0.010 1.009 904 HA THR 110 HA THR 110 -4.715 0.167 3.905 905 HB THR 110 HB THR 110 -4.188 2.293 1.822 906 HG1 THR 110 HG1 THR 110 -2.886 0.054 2.181 907 1HG2 THR 110 1HG2 THR 110 -3.276 2.021 4.689 908 2HG2 THR 110 2HG2 THR 110 -4.480 3.164 4.090 909 3HG2 THR 110 3HG2 THR 110 -2.797 3.302 3.577 910 H ASN 111 H ASN 111 -6.454 0.616 5.055 911 HA ASN 111 HA ASN 111 -8.603 2.202 3.856 912 1HB ASN 111 1HB ASN 111 -8.513 0.494 6.350 913 2HB ASN 111 2HB ASN 111 -9.890 1.492 5.905 914 1HD2 ASN 111 1HD2 ASN 111 -11.322 -0.116 5.638 915 2HD2 ASN 111 2HD2 ASN 111 -11.199 -1.326 4.400 916 H ILE 112 H ILE 112 -8.292 4.312 4.118 917 HA ILE 112 HA ILE 112 -6.944 5.435 6.379 918 HB ILE 112 HB ILE 112 -8.659 6.789 4.281 919 1HG1 ILE 112 1HG1 ILE 112 -6.706 5.666 3.322 920 2HG1 ILE 112 2HG1 ILE 112 -6.510 7.412 3.247 921 1HG2 ILE 112 1HG2 ILE 112 -6.701 7.999 6.231 922 2HG2 ILE 112 2HG2 ILE 112 -8.456 8.124 6.327 923 3HG2 ILE 112 3HG2 ILE 112 -7.593 8.862 4.980 924 1HD1 ILE 112 1HD1 ILE 112 -5.217 5.544 5.222 925 2HD1 ILE 112 2HD1 ILE 112 -5.059 7.301 5.237 926 3HD1 ILE 112 3HD1 ILE 112 -4.432 6.369 3.876 927 H HIS 113 H HIS 113 -10.234 4.753 5.463 928 HA HIS 113 HA HIS 113 -11.553 6.269 7.441 929 1HB HIS 113 1HB HIS 113 -12.670 5.270 5.456 930 2HB HIS 113 2HB HIS 113 -12.451 3.675 6.164 931 HD1 HIS 113 HD1 HIS 113 -14.161 2.894 7.827 932 HD2 HIS 113 HD2 HIS 113 -14.531 6.935 6.886 933 HE1 HIS 113 HE1 HIS 113 -16.336 3.639 8.852 934 HE2 HIS 113 HE2 HIS 113 -16.620 6.032 8.115 935 H GLU 114 H GLU 114 -10.295 2.971 7.403 936 HA GLU 114 HA GLU 114 -11.107 2.482 10.141 937 1HB GLU 114 1HB GLU 114 -9.678 0.857 8.054 938 2HB GLU 114 2HB GLU 114 -9.733 0.328 9.727 939 1HG GLU 114 1HG GLU 114 -11.450 -0.730 8.351 940 2HG GLU 114 2HG GLU 114 -12.140 0.226 9.661 941 H GLN 115 H GLN 115 -8.533 3.983 8.621 942 HA GLN 115 HA GLN 115 -6.508 4.770 9.290 943 1HB GLN 115 1HB GLN 115 -7.473 3.954 12.043 944 2HB GLN 115 2HB GLN 115 -6.069 4.960 11.722 945 1HG GLN 115 1HG GLN 115 -8.883 5.690 10.941 946 2HG GLN 115 2HG GLN 115 -8.103 6.199 12.436 947 1HE2 GLN 115 1HE2 GLN 115 -5.494 6.477 11.065 948 2HE2 GLN 115 2HE2 GLN 115 -5.604 7.951 10.176 949 H LYS 116 H LYS 116 -6.698 2.026 8.403 950 HA LYS 116 HA LYS 116 -4.397 0.877 9.801 951 1HB LYS 116 1HB LYS 116 -7.002 -0.605 9.402 952 2HB LYS 116 2HB LYS 116 -5.507 -1.336 9.965 953 1HG LYS 116 1HG LYS 116 -5.544 0.022 11.959 954 2HG LYS 116 2HG LYS 116 -6.971 0.879 11.379 955 1HD LYS 116 1HD LYS 116 -8.233 -1.237 11.427 956 2HD LYS 116 2HD LYS 116 -6.806 -2.049 12.073 957 1HE LYS 116 1HE LYS 116 -8.315 -1.499 13.879 958 2HE LYS 116 2HE LYS 116 -6.847 -0.532 14.013 959 1HZ LYS 116 1HZ LYS 116 -8.133 1.265 12.826 960 2HZ LYS 116 2HZ LYS 116 -8.630 0.928 14.410 961 3HZ LYS 116 3HZ LYS 116 -9.526 0.344 13.095 962 H ARG 117 H ARG 117 -3.180 -0.573 8.621 963 HA ARG 117 HA ARG 117 -3.698 -0.700 5.743 964 1HB ARG 117 1HB ARG 117 -1.297 -1.454 7.421 965 2HB ARG 117 2HB ARG 117 -1.396 -1.724 5.689 966 1HG ARG 117 1HG ARG 117 -1.469 0.637 5.268 967 2HG ARG 117 2HG ARG 117 -1.567 0.982 7.000 968 1HD ARG 117 1HD ARG 117 0.626 0.210 7.383 969 2HD ARG 117 2HD ARG 117 0.711 -0.566 5.805 970 HE ARG 117 HE ARG 117 0.375 2.208 5.468 971 1HH1 ARG 117 1HH1 ARG 117 2.744 -0.065 6.680 972 2HH1 ARG 117 2HH1 ARG 117 4.102 0.846 6.087 973 1HH2 ARG 117 1HH2 ARG 117 2.174 3.432 4.713 974 2HH2 ARG 117 2HH2 ARG 117 3.785 2.842 4.973 975 H TYR 118 H TYR 118 -4.858 -2.399 5.054 976 HA TYR 118 HA TYR 118 -4.763 -4.899 6.584 977 1HB TYR 118 1HB TYR 118 -6.705 -3.916 4.486 978 2HB TYR 118 2HB TYR 118 -6.773 -5.514 5.222 979 HD1 TYR 118 HD1 TYR 118 -7.352 -1.938 5.732 980 HD2 TYR 118 HD2 TYR 118 -7.481 -5.791 7.530 981 HE1 TYR 118 HE1 TYR 118 -8.712 -1.028 7.570 982 HE2 TYR 118 HE2 TYR 118 -8.846 -4.893 9.368 983 HH TYR 118 HH TYR 118 -10.346 -1.878 9.243 984 H TYR 119 H TYR 119 -3.517 -6.483 5.866 985 HA TYR 119 HA TYR 119 -2.745 -6.456 3.029 986 1HB TYR 119 1HB TYR 119 -1.355 -7.730 5.394 987 2HB TYR 119 2HB TYR 119 -0.797 -7.804 3.725 988 HD1 TYR 119 HD1 TYR 119 -0.828 -5.284 2.615 989 HD2 TYR 119 HD2 TYR 119 -0.188 -6.249 6.708 990 HE1 TYR 119 HE1 TYR 119 0.391 -3.169 2.912 991 HE2 TYR 119 HE2 TYR 119 1.030 -4.136 7.020 992 HH TYR 119 HH TYR 119 2.271 -2.506 5.672 993 H TYR 120 H TYR 120 -3.974 -7.744 1.883 994 HA TYR 120 HA TYR 120 -4.799 -10.350 2.988 995 1HB TYR 120 1HB TYR 120 -5.840 -8.852 0.566 996 2HB TYR 120 2HB TYR 120 -6.445 -10.395 1.148 997 HD1 TYR 120 HD1 TYR 120 -6.206 -6.792 1.922 998 HD2 TYR 120 HD2 TYR 120 -8.048 -10.496 2.898 999 HE1 TYR 120 HE1 TYR 120 -7.850 -5.601 3.306 1000 HE2 TYR 120 HE2 TYR 120 -9.701 -9.316 4.286 1001 HH TYR 120 HH TYR 120 -9.897 -7.185 5.498 1002 H THR 121 H THR 121 -4.262 -12.231 1.932 1003 HA THR 121 HA THR 121 -2.125 -12.127 0.004 1004 HB THR 121 HB THR 121 -2.120 -13.937 1.614 1005 HG1 THR 121 HG1 THR 121 -1.222 -14.937 -0.022 1006 1HG2 THR 121 1HG2 THR 121 -4.519 -14.093 2.028 1007 2HG2 THR 121 2HG2 THR 121 -3.842 -15.673 1.639 1008 3HG2 THR 121 3HG2 THR 121 -4.761 -14.784 0.425 1009 H PHE 122 H PHE 122 -2.444 -13.631 -2.032 1010 HA PHE 122 HA PHE 122 -4.383 -12.454 -3.707 1011 1HB PHE 122 1HB PHE 122 -2.247 -13.518 -4.475 1012 2HB PHE 122 2HB PHE 122 -2.947 -15.092 -4.115 1013 HD1 PHE 122 HD1 PHE 122 -3.604 -12.026 -6.123 1014 HD2 PHE 122 HD2 PHE 122 -4.041 -16.243 -5.784 1015 HE1 PHE 122 HE1 PHE 122 -4.562 -12.106 -8.388 1016 HE2 PHE 122 HE2 PHE 122 -5.001 -16.331 -8.047 1017 HZ PHE 122 HZ PHE 122 -5.262 -14.263 -9.353 1018 H ASP 123 H ASP 123 -4.514 -14.993 -1.471 1019 HA ASP 123 HA ASP 123 -6.785 -16.380 -2.532 1020 1HB ASP 123 1HB ASP 123 -5.108 -17.526 -1.167 1021 2HB ASP 123 2HB ASP 123 -5.460 -16.462 0.189 1022 H ASN 124 H ASN 124 -6.559 -13.371 -1.274 1023 HA ASN 124 HA ASN 124 -8.160 -11.858 -0.696 1024 1HB ASN 124 1HB ASN 124 -9.908 -12.718 -1.945 1025 2HB ASN 124 2HB ASN 124 -9.889 -14.268 -1.117 1026 1HD2 ASN 124 1HD2 ASN 124 -11.073 -14.533 0.755 1027 2HD2 ASN 124 2HD2 ASN 124 -12.235 -13.375 1.298 1028 H SER 125 H SER 125 -7.175 -14.430 1.155 1029 HA SER 125 HA SER 125 -8.666 -13.882 3.537 1030 1HB SER 125 1HB SER 125 -6.190 -15.548 3.046 1031 2HB SER 125 2HB SER 125 -7.060 -15.484 4.577 1032 HG SER 125 HG SER 125 -7.667 -16.841 2.263 1033 H LEU 126 H LEU 126 -8.132 -12.633 5.238 1034 HA LEU 126 HA LEU 126 -6.112 -10.635 4.876 1035 1HB LEU 126 1HB LEU 126 -8.269 -10.125 5.930 1036 2HB LEU 126 2HB LEU 126 -7.898 -11.230 7.238 1037 HG LEU 126 HG LEU 126 -6.041 -9.782 7.943 1038 1HD1 LEU 126 1HD1 LEU 126 -7.000 -7.961 5.737 1039 2HD1 LEU 126 2HD1 LEU 126 -5.460 -8.820 5.782 1040 3HD1 LEU 126 3HD1 LEU 126 -5.796 -7.549 6.960 1041 1HD2 LEU 126 1HD2 LEU 126 -7.397 -7.955 8.806 1042 2HD2 LEU 126 2HD2 LEU 126 -8.277 -9.481 8.896 1043 3HD2 LEU 126 3HD2 LEU 126 -8.658 -8.318 7.628 1044 H LEU 127 H LEU 127 -4.085 -10.637 5.605 1045 HA LEU 127 HA LEU 127 -3.257 -12.922 7.242 1046 1HB LEU 127 1HB LEU 127 -1.604 -11.043 5.560 1047 2HB LEU 127 2HB LEU 127 -0.995 -12.441 6.424 1048 HG LEU 127 HG LEU 127 -2.933 -12.484 4.114 1049 1HD1 LEU 127 1HD1 LEU 127 -0.660 -11.972 3.438 1050 2HD1 LEU 127 2HD1 LEU 127 -1.105 -13.603 2.934 1051 3HD1 LEU 127 3HD1 LEU 127 -0.062 -13.366 4.336 1052 1HD2 LEU 127 1HD2 LEU 127 -3.376 -14.241 5.795 1053 2HD2 LEU 127 2HD2 LEU 127 -1.711 -14.795 5.615 1054 3HD2 LEU 127 3HD2 LEU 127 -2.826 -14.883 4.250 1055 H PHE 128 H PHE 128 -2.464 -9.461 6.892 1056 HA PHE 128 HA PHE 128 -2.120 -9.333 9.793 1057 1HB PHE 128 1HB PHE 128 0.106 -9.765 8.702 1058 2HB PHE 128 2HB PHE 128 -0.073 -8.236 7.851 1059 HD1 PHE 128 HD1 PHE 128 0.682 -6.269 8.822 1060 HD2 PHE 128 HD2 PHE 128 0.045 -9.700 11.263 1061 HE1 PHE 128 HE1 PHE 128 1.698 -5.095 10.729 1062 HE2 PHE 128 HE2 PHE 128 1.059 -8.527 13.175 1063 HZ PHE 128 HZ PHE 128 1.882 -6.222 12.911 1064 H THR 129 H THR 129 -2.165 -7.153 10.632 1065 HA THR 129 HA THR 129 -3.084 -5.076 8.802 1066 HB THR 129 HB THR 129 -4.630 -5.824 11.294 1067 HG1 THR 129 HG1 THR 129 -4.813 -6.642 8.660 1068 1HG2 THR 129 1HG2 THR 129 -4.718 -3.440 10.778 1069 2HG2 THR 129 2HG2 THR 129 -6.275 -4.204 10.460 1070 3HG2 THR 129 3HG2 THR 129 -5.200 -3.806 9.119 1071 H GLU 130 H GLU 130 -1.556 -3.575 9.171 1072 HA GLU 130 HA GLU 130 -0.904 -2.938 11.966 1073 1HB GLU 130 1HB GLU 130 1.032 -1.646 10.981 1074 2HB GLU 130 2HB GLU 130 1.115 -3.389 10.805 1075 1HG GLU 130 1HG GLU 130 0.434 -3.226 8.493 1076 2HG GLU 130 2HG GLU 130 0.218 -1.484 8.655 1077 H SER 131 H SER 131 -1.534 -1.053 12.815 1078 HA SER 131 HA SER 131 -3.323 0.542 11.197 1079 1HB SER 131 1HB SER 131 -3.791 1.659 13.428 1080 2HB SER 131 2HB SER 131 -4.176 -0.059 13.337 1081 HG SER 131 HG SER 131 -2.066 1.238 14.676 1082 H ILE 132 H ILE 132 -3.054 2.653 10.644 1083 HA ILE 132 HA ILE 132 -0.405 3.797 10.947 1084 HB ILE 132 HB ILE 132 -1.263 5.659 9.563 1085 1HG1 ILE 132 1HG1 ILE 132 -3.829 4.049 9.435 1086 2HG1 ILE 132 2HG1 ILE 132 -3.630 5.544 10.341 1087 1HG2 ILE 132 1HG2 ILE 132 -0.252 3.717 8.506 1088 2HG2 ILE 132 2HG2 ILE 132 -1.542 4.372 7.498 1089 3HG2 ILE 132 3HG2 ILE 132 -1.820 2.911 8.448 1090 1HD1 ILE 132 1HD1 ILE 132 -4.750 5.933 8.225 1091 2HD1 ILE 132 2HD1 ILE 132 -3.378 5.244 7.357 1092 3HD1 ILE 132 3HD1 ILE 132 -3.185 6.743 8.265 1093 H GLN 133 H GLN 133 -3.031 3.547 12.801 1094 HA GLN 133 HA GLN 133 -2.560 6.081 14.200 1095 1HB GLN 133 1HB GLN 133 -4.916 4.298 13.916 1096 2HB GLN 133 2HB GLN 133 -4.686 5.051 15.488 1097 1HG GLN 133 1HG GLN 133 -4.749 6.591 12.907 1098 2HG GLN 133 2HG GLN 133 -6.172 6.291 13.906 1099 1HE2 GLN 133 1HE2 GLN 133 -6.464 8.494 14.265 1100 2HE2 GLN 133 2HE2 GLN 133 -5.450 9.384 15.353 Start of MODEL 4 1 H ASP 7 H ASP 7 -5.386 14.798 -15.064 2 HA ASP 7 HA ASP 7 -7.968 14.167 -13.838 3 1HB ASP 7 1HB ASP 7 -7.029 12.795 -15.776 4 2HB ASP 7 2HB ASP 7 -5.809 12.210 -14.651 5 H GLN 8 H GLN 8 -8.024 12.891 -11.919 6 HA GLN 8 HA GLN 8 -6.307 13.893 -9.891 7 1HB GLN 8 1HB GLN 8 -8.735 13.313 -9.661 8 2HB GLN 8 2HB GLN 8 -8.284 11.619 -9.730 9 1HG GLN 8 1HG GLN 8 -6.990 11.859 -7.698 10 2HG GLN 8 2HG GLN 8 -7.376 13.579 -7.641 11 1HE2 GLN 8 1HE2 GLN 8 -9.659 11.182 -8.685 12 2HE2 GLN 8 2HE2 GLN 8 -10.713 11.289 -7.319 13 H VAL 9 H VAL 9 -6.254 11.116 -11.935 14 HA VAL 9 HA VAL 9 -4.692 9.314 -10.511 15 HB VAL 9 HB VAL 9 -4.649 9.963 -13.466 16 1HG1 VAL 9 1HG1 VAL 9 -3.561 7.774 -13.777 17 2HG1 VAL 9 2HG1 VAL 9 -3.385 7.633 -12.025 18 3HG1 VAL 9 3HG1 VAL 9 -2.543 8.914 -12.898 19 1HG2 VAL 9 1HG2 VAL 9 -6.774 9.110 -12.597 20 2HG2 VAL 9 2HG2 VAL 9 -5.935 7.704 -11.936 21 3HG2 VAL 9 3HG2 VAL 9 -6.002 7.953 -13.681 22 H VAL 10 H VAL 10 -3.730 12.212 -12.274 23 HA VAL 10 HA VAL 10 -0.946 11.884 -12.172 24 HB VAL 10 HB VAL 10 -2.532 14.461 -12.118 25 1HG1 VAL 10 1HG1 VAL 10 0.354 13.971 -12.855 26 2HG1 VAL 10 2HG1 VAL 10 -0.225 14.814 -11.418 27 3HG1 VAL 10 3HG1 VAL 10 -0.503 15.504 -13.017 28 1HG2 VAL 10 1HG2 VAL 10 -2.143 14.497 -14.537 29 2HG2 VAL 10 2HG2 VAL 10 -3.083 13.087 -14.046 30 3HG2 VAL 10 3HG2 VAL 10 -1.371 12.914 -14.431 31 H ILE 11 H ILE 11 -3.198 13.421 -9.924 32 HA ILE 11 HA ILE 11 -1.270 14.438 -8.147 33 HB ILE 11 HB ILE 11 -4.186 13.760 -7.728 34 1HG1 ILE 11 1HG1 ILE 11 -4.306 16.312 -7.555 35 2HG1 ILE 11 2HG1 ILE 11 -2.669 16.327 -8.197 36 1HG2 ILE 11 1HG2 ILE 11 -4.073 14.997 -5.620 37 2HG2 ILE 11 2HG2 ILE 11 -2.327 15.155 -5.810 38 3HG2 ILE 11 3HG2 ILE 11 -3.048 13.561 -5.590 39 1HD1 ILE 11 1HD1 ILE 11 -5.100 15.210 -9.570 40 2HD1 ILE 11 2HD1 ILE 11 -3.460 15.204 -10.216 41 3HD1 ILE 11 3HD1 ILE 11 -4.294 16.733 -9.941 42 H PHE 12 H PHE 12 -3.255 11.474 -7.960 43 HA PHE 12 HA PHE 12 -2.187 10.610 -5.513 44 1HB PHE 12 1HB PHE 12 -3.741 9.294 -7.687 45 2HB PHE 12 2HB PHE 12 -2.995 8.283 -6.454 46 HD1 PHE 12 HD1 PHE 12 -3.530 8.787 -4.025 47 HD2 PHE 12 HD2 PHE 12 -5.774 10.357 -7.280 48 HE1 PHE 12 HE1 PHE 12 -5.418 9.219 -2.509 49 HE2 PHE 12 HE2 PHE 12 -7.664 10.796 -5.767 50 HZ PHE 12 HZ PHE 12 -7.489 10.228 -3.379 51 H LYS 13 H LYS 13 -1.295 9.653 -8.847 52 HA LYS 13 HA LYS 13 0.653 7.784 -8.031 53 1HB LYS 13 1HB LYS 13 -0.248 7.828 -10.320 54 2HB LYS 13 2HB LYS 13 0.560 9.366 -10.609 55 1HG LYS 13 1HG LYS 13 2.732 8.199 -10.142 56 2HG LYS 13 2HG LYS 13 1.833 6.683 -10.115 57 1HD LYS 13 1HD LYS 13 2.713 6.861 -12.292 58 2HD LYS 13 2HD LYS 13 1.011 7.302 -12.435 59 1HE LYS 13 1HE LYS 13 2.307 8.858 -13.721 60 2HE LYS 13 2HE LYS 13 1.675 9.696 -12.305 61 1HZ LYS 13 1HZ LYS 13 3.863 9.363 -11.238 62 2HZ LYS 13 2HZ LYS 13 3.961 10.295 -12.646 63 3HZ LYS 13 3HZ LYS 13 4.450 8.671 -12.669 64 H GLN 14 H GLN 14 0.740 11.245 -8.470 65 HA GLN 14 HA GLN 14 3.568 11.522 -8.411 66 1HB GLN 14 1HB GLN 14 2.010 13.215 -9.328 67 2HB GLN 14 2HB GLN 14 1.425 13.533 -7.702 68 1HG GLN 14 1HG GLN 14 3.473 14.492 -7.049 69 2HG GLN 14 2HG GLN 14 4.301 13.883 -8.483 70 1HE2 GLN 14 1HE2 GLN 14 1.100 15.191 -8.713 71 2HE2 GLN 14 2HE2 GLN 14 1.528 16.666 -9.517 72 H ILE 15 H ILE 15 1.054 11.442 -5.952 73 HA ILE 15 HA ILE 15 2.635 12.180 -3.736 74 HB ILE 15 HB ILE 15 0.254 10.313 -3.819 75 1HG1 ILE 15 1HG1 ILE 15 0.383 13.262 -3.149 76 2HG1 ILE 15 2HG1 ILE 15 -0.166 12.611 -4.690 77 1HG2 ILE 15 1HG2 ILE 15 1.507 11.757 -1.486 78 2HG2 ILE 15 2HG2 ILE 15 1.546 10.020 -1.776 79 3HG2 ILE 15 3HG2 ILE 15 0.015 10.822 -1.432 80 1HD1 ILE 15 1HD1 ILE 15 -2.034 13.218 -3.262 81 2HD1 ILE 15 2HD1 ILE 15 -1.450 12.118 -2.014 82 3HD1 ILE 15 3HD1 ILE 15 -2.006 11.481 -3.563 83 H PHE 16 H PHE 16 1.728 8.960 -4.963 84 HA PHE 16 HA PHE 16 3.360 7.506 -3.184 85 1HB PHE 16 1HB PHE 16 2.139 6.810 -5.848 86 2HB PHE 16 2HB PHE 16 3.104 5.660 -4.931 87 HD1 PHE 16 HD1 PHE 16 -0.040 7.554 -5.013 88 HD2 PHE 16 HD2 PHE 16 2.252 4.624 -2.951 89 HE1 PHE 16 HE1 PHE 16 -2.035 6.902 -3.733 90 HE2 PHE 16 HE2 PHE 16 0.260 3.964 -1.665 91 HZ PHE 16 HZ PHE 16 -1.889 5.104 -2.056 92 H ASP 17 H ASP 17 3.981 8.957 -6.304 93 HA ASP 17 HA ASP 17 6.379 7.671 -6.965 94 1HB ASP 17 1HB ASP 17 4.895 9.339 -8.321 95 2HB ASP 17 2HB ASP 17 5.903 10.575 -7.580 96 H LYS 18 H LYS 18 5.782 10.655 -5.149 97 HA LYS 18 HA LYS 18 8.513 11.241 -4.669 98 1HB LYS 18 1HB LYS 18 6.778 12.965 -4.556 99 2HB LYS 18 2HB LYS 18 6.043 12.152 -3.181 100 1HG LYS 18 1HG LYS 18 7.319 14.036 -2.410 101 2HG LYS 18 2HG LYS 18 8.099 12.546 -1.881 102 1HD LYS 18 1HD LYS 18 9.815 14.005 -2.656 103 2HD LYS 18 2HD LYS 18 9.616 12.743 -3.872 104 1HE LYS 18 1HE LYS 18 9.826 14.847 -4.998 105 2HE LYS 18 2HE LYS 18 8.159 14.297 -5.157 106 1HZ LYS 18 1HZ LYS 18 9.143 16.321 -3.216 107 2HZ LYS 18 2HZ LYS 18 7.541 15.783 -3.347 108 3HZ LYS 18 3HZ LYS 18 8.250 16.643 -4.621 109 H VAL 19 H VAL 19 5.990 9.832 -2.570 110 HA VAL 19 HA VAL 19 7.695 9.538 -0.331 111 HB VAL 19 HB VAL 19 5.187 9.582 -0.233 112 1HG1 VAL 19 1HG1 VAL 19 3.961 7.489 -0.548 113 2HG1 VAL 19 2HG1 VAL 19 5.432 6.719 -1.139 114 3HG1 VAL 19 3HG1 VAL 19 4.702 8.041 -2.050 115 1HG2 VAL 19 1HG2 VAL 19 6.520 7.245 1.128 116 2HG2 VAL 19 2HG2 VAL 19 5.010 8.008 1.624 117 3HG2 VAL 19 3HG2 VAL 19 6.521 8.915 1.695 118 H ARG 20 H ARG 20 7.308 7.695 -3.182 119 HA ARG 20 HA ARG 20 8.064 5.145 -2.418 120 1HB ARG 20 1HB ARG 20 7.344 5.526 -4.649 121 2HB ARG 20 2HB ARG 20 8.599 6.724 -4.926 122 1HG ARG 20 1HG ARG 20 10.296 4.953 -4.796 123 2HG ARG 20 2HG ARG 20 9.012 3.763 -4.568 124 1HD ARG 20 1HD ARG 20 9.874 3.974 -6.919 125 2HD ARG 20 2HD ARG 20 8.132 4.169 -6.737 126 HE ARG 20 HE ARG 20 8.448 6.553 -6.998 127 1HH1 ARG 20 1HH1 ARG 20 11.242 4.586 -7.765 128 2HH1 ARG 20 2HH1 ARG 20 11.907 5.760 -8.866 129 1HH2 ARG 20 1HH2 ARG 20 9.322 8.091 -8.439 130 2HH2 ARG 20 2HH2 ARG 20 10.827 7.730 -9.247 131 H ASN 21 H ASN 21 10.137 7.905 -3.267 132 HA ASN 21 HA ASN 21 12.481 6.329 -2.454 133 1HB ASN 21 1HB ASN 21 12.313 8.889 -4.054 134 2HB ASN 21 2HB ASN 21 13.810 8.078 -3.614 135 1HD2 ASN 21 1HD2 ASN 21 12.742 8.704 -6.230 136 2HD2 ASN 21 2HD2 ASN 21 12.611 7.207 -7.081 137 H ASP 22 H ASP 22 10.751 9.323 -1.814 138 HA ASP 22 HA ASP 22 12.827 10.393 -0.123 139 1HB ASP 22 1HB ASP 22 11.289 11.787 -1.536 140 2HB ASP 22 2HB ASP 22 9.980 11.356 -0.440 141 H LEU 23 H LEU 23 9.880 8.599 0.288 142 HA LEU 23 HA LEU 23 8.893 7.588 2.052 143 1HB LEU 23 1HB LEU 23 11.642 7.953 3.223 144 2HB LEU 23 2HB LEU 23 10.360 7.085 4.046 145 HG LEU 23 HG LEU 23 11.610 6.329 1.405 146 1HD1 LEU 23 1HD1 LEU 23 12.392 4.369 2.661 147 2HD1 LEU 23 2HD1 LEU 23 11.721 5.065 4.136 148 3HD1 LEU 23 3HD1 LEU 23 13.046 5.876 3.300 149 1HD2 LEU 23 1HD2 LEU 23 9.248 5.771 1.412 150 2HD2 LEU 23 2HD2 LEU 23 9.419 4.994 2.984 151 3HD2 LEU 23 3HD2 LEU 23 10.221 4.310 1.573 152 H ASN 24 H ASN 24 8.699 10.477 1.800 153 HA ASN 24 HA ASN 24 8.589 11.504 4.476 154 1HB ASN 24 1HB ASN 24 7.447 13.458 3.438 155 2HB ASN 24 2HB ASN 24 8.991 13.080 2.691 156 1HD2 ASN 24 1HD2 ASN 24 6.761 14.585 1.645 157 2HD2 ASN 24 2HD2 ASN 24 6.266 13.790 0.193 158 H TYR 25 H TYR 25 7.373 9.597 5.222 159 HA TYR 25 HA TYR 25 4.748 9.022 4.452 160 1HB TYR 25 1HB TYR 25 6.258 8.530 7.009 161 2HB TYR 25 2HB TYR 25 4.585 8.022 6.814 162 HD1 TYR 25 HD1 TYR 25 4.130 6.610 4.606 163 HD2 TYR 25 HD2 TYR 25 7.929 7.006 6.492 164 HE1 TYR 25 HE1 TYR 25 4.869 4.518 3.547 165 HE2 TYR 25 HE2 TYR 25 8.678 4.907 5.430 166 HH TYR 25 HH TYR 25 6.954 3.409 2.914 167 H GLN 26 H GLN 26 5.988 11.587 6.398 168 HA GLN 26 HA GLN 26 3.716 12.198 7.941 169 1HB GLN 26 1HB GLN 26 5.737 14.148 6.813 170 2HB GLN 26 2HB GLN 26 4.644 14.449 8.152 171 1HG GLN 26 1HG GLN 26 6.744 14.039 9.110 172 2HG GLN 26 2HG GLN 26 5.807 12.568 9.365 173 1HE2 GLN 26 1HE2 GLN 26 7.711 11.367 9.620 174 2HE2 GLN 26 2HE2 GLN 26 8.703 10.929 8.267 175 H TRP 27 H TRP 27 4.687 13.154 4.693 176 HA TRP 27 HA TRP 27 2.321 14.761 4.276 177 1HB TRP 27 1HB TRP 27 4.454 15.418 3.263 178 2HB TRP 27 2HB TRP 27 4.522 13.896 2.386 179 HD1 TRP 27 HD1 TRP 27 2.138 16.959 2.588 180 HE1 TRP 27 HE1 TRP 27 1.239 17.417 0.216 181 HE3 TRP 27 HE3 TRP 27 4.374 13.074 0.124 182 HZ2 TRP 27 HZ2 TRP 27 1.465 16.275 -2.358 183 HZ3 TRP 27 HZ3 TRP 27 3.979 12.828 -2.290 184 HH2 TRP 27 HH2 TRP 27 2.554 14.398 -3.506 185 H PHE 28 H PHE 28 3.499 11.566 3.529 186 HA PHE 28 HA PHE 28 1.607 10.776 1.624 187 1HB PHE 28 1HB PHE 28 3.625 9.483 2.125 188 2HB PHE 28 2HB PHE 28 3.018 9.131 3.738 189 HD1 PHE 28 HD1 PHE 28 2.024 7.100 4.087 190 HD2 PHE 28 HD2 PHE 28 1.979 8.763 0.174 191 HE1 PHE 28 HE1 PHE 28 0.961 5.052 3.235 192 HE2 PHE 28 HE2 PHE 28 0.915 6.720 -0.689 193 HZ PHE 28 HZ PHE 28 0.408 4.860 0.842 194 H TYR 29 H TYR 29 1.567 10.467 5.169 195 HA TYR 29 HA TYR 29 -0.947 9.176 5.282 196 1HB TYR 29 1HB TYR 29 0.767 10.551 7.320 197 2HB TYR 29 2HB TYR 29 -0.860 10.028 7.739 198 HD1 TYR 29 HD1 TYR 29 2.476 9.083 7.857 199 HD2 TYR 29 HD2 TYR 29 -1.358 7.499 6.920 200 HE1 TYR 29 HE1 TYR 29 3.314 6.813 8.297 201 HE2 TYR 29 HE2 TYR 29 -0.531 5.226 7.362 202 HH TYR 29 HH TYR 29 2.468 4.623 8.887 203 H SER 30 H SER 30 -0.037 12.581 5.297 204 HA SER 30 HA SER 30 -2.583 13.493 6.189 205 1HB SER 30 1HB SER 30 -1.719 15.726 5.338 206 2HB SER 30 2HB SER 30 -0.744 14.943 6.577 207 HG SER 30 HG SER 30 -0.253 15.100 3.794 208 H GLU 31 H GLU 31 -1.052 13.141 2.999 209 HA GLU 31 HA GLU 31 -3.184 14.319 1.552 210 1HB GLU 31 1HB GLU 31 -0.906 12.529 0.786 211 2HB GLU 31 2HB GLU 31 -2.158 12.932 -0.383 212 1HG GLU 31 1HG GLU 31 -0.423 14.896 1.097 213 2HG GLU 31 2HG GLU 31 -0.248 14.416 -0.591 214 H LEU 32 H LEU 32 -2.565 11.036 2.641 215 HA LEU 32 HA LEU 32 -4.598 9.739 1.217 216 1HB LEU 32 1HB LEU 32 -3.457 9.176 3.952 217 2HB LEU 32 2HB LEU 32 -4.593 8.115 3.145 218 HG LEU 32 HG LEU 32 -1.822 8.813 2.174 219 1HD1 LEU 32 1HD1 LEU 32 -2.966 6.263 3.298 220 2HD1 LEU 32 2HD1 LEU 32 -1.810 7.328 4.095 221 3HD1 LEU 32 3HD1 LEU 32 -1.345 6.459 2.632 222 1HD2 LEU 32 1HD2 LEU 32 -2.242 7.107 0.451 223 2HD2 LEU 32 2HD2 LEU 32 -3.330 8.487 0.300 224 3HD2 LEU 32 3HD2 LEU 32 -3.913 6.979 1.004 225 H LYS 33 H LYS 33 -4.667 11.153 4.481 226 HA LYS 33 HA LYS 33 -7.421 10.661 4.913 227 1HB LYS 33 1HB LYS 33 -5.582 12.676 6.215 228 2HB LYS 33 2HB LYS 33 -7.180 12.249 6.806 229 1HG LYS 33 1HG LYS 33 -4.888 10.314 6.529 230 2HG LYS 33 2HG LYS 33 -5.335 11.141 8.022 231 1HD LYS 33 1HD LYS 33 -7.505 10.065 8.012 232 2HD LYS 33 2HD LYS 33 -7.160 9.322 6.450 233 1HE LYS 33 1HE LYS 33 -6.845 7.670 8.153 234 2HE LYS 33 2HE LYS 33 -5.265 8.111 7.510 235 1HZ LYS 33 1HZ LYS 33 -6.383 9.304 9.985 236 2HZ LYS 33 2HZ LYS 33 -4.783 9.373 9.431 237 3HZ LYS 33 3HZ LYS 33 -5.424 7.909 9.991 238 H ARG 34 H ARG 34 -5.853 12.954 2.981 239 HA ARG 34 HA ARG 34 -8.009 14.912 3.182 240 1HB ARG 34 1HB ARG 34 -5.197 14.972 2.240 241 2HB ARG 34 2HB ARG 34 -6.326 16.067 1.452 242 1HG ARG 34 1HG ARG 34 -6.654 17.315 3.332 243 2HG ARG 34 2HG ARG 34 -6.307 15.970 4.417 244 1HD ARG 34 1HD ARG 34 -4.584 17.778 4.411 245 2HD ARG 34 2HD ARG 34 -3.967 16.169 4.053 246 HE ARG 34 HE ARG 34 -3.597 16.819 1.824 247 1HH1 ARG 34 1HH1 ARG 34 -4.990 19.432 3.704 248 2HH1 ARG 34 2HH1 ARG 34 -4.381 20.677 2.647 249 1HH2 ARG 34 1HH2 ARG 34 -2.816 18.430 0.444 250 2HH2 ARG 34 2HH2 ARG 34 -3.151 20.103 0.787 251 H HIS 35 H HIS 35 -7.134 12.281 1.208 252 HA HIS 35 HA HIS 35 -9.012 13.256 -0.838 253 1HB HIS 35 1HB HIS 35 -6.400 11.824 -1.371 254 2HB HIS 35 2HB HIS 35 -7.654 12.072 -2.579 255 HD1 HIS 35 HD1 HIS 35 -8.121 14.597 -3.286 256 HD2 HIS 35 HD2 HIS 35 -4.705 13.958 -0.988 257 HE1 HIS 35 HE1 HIS 35 -6.713 16.669 -3.557 258 HE2 HIS 35 HE2 HIS 35 -4.624 16.242 -2.205 259 H ASN 36 H ASN 36 -7.225 10.313 0.070 260 HA ASN 36 HA ASN 36 -9.412 8.638 -0.772 261 1HB ASN 36 1HB ASN 36 -7.135 7.843 -1.111 262 2HB ASN 36 2HB ASN 36 -6.803 7.971 0.614 263 1HD2 ASN 36 1HD2 ASN 36 -6.302 5.827 0.847 264 2HD2 ASN 36 2HD2 ASN 36 -7.486 4.573 0.759 265 H VAL 37 H VAL 37 -11.094 9.222 0.539 266 HA VAL 37 HA VAL 37 -10.864 9.285 3.393 267 HB VAL 37 HB VAL 37 -13.368 9.255 1.699 268 1HG1 VAL 37 1HG1 VAL 37 -14.415 10.333 3.646 269 2HG1 VAL 37 2HG1 VAL 37 -12.914 10.129 4.550 270 3HG1 VAL 37 3HG1 VAL 37 -13.823 8.713 4.021 271 1HG2 VAL 37 1HG2 VAL 37 -13.322 11.698 1.911 272 2HG2 VAL 37 2HG2 VAL 37 -11.896 11.095 1.065 273 3HG2 VAL 37 3HG2 VAL 37 -11.775 11.593 2.753 274 H SER 38 H SER 38 -11.790 6.872 1.026 275 HA SER 38 HA SER 38 -12.904 5.204 3.150 276 1HB SER 38 1HB SER 38 -14.275 5.485 1.120 277 2HB SER 38 2HB SER 38 -12.990 4.748 0.161 278 HG SER 38 HG SER 38 -14.062 3.397 2.403 279 H HIS 39 H HIS 39 -11.041 4.278 0.216 280 HA HIS 39 HA HIS 39 -8.976 3.020 1.717 281 1HB HIS 39 1HB HIS 39 -9.589 0.689 1.417 282 2HB HIS 39 2HB HIS 39 -10.864 1.513 2.304 283 HD1 HIS 39 HD1 HIS 39 -13.075 2.091 0.877 284 HD2 HIS 39 HD2 HIS 39 -10.395 -0.556 -0.896 285 HE1 HIS 39 HE1 HIS 39 -14.348 0.969 -0.975 286 HE2 HIS 39 HE2 HIS 39 -12.758 -0.729 -1.943 287 H TYR 40 H TYR 40 -7.319 2.246 0.410 288 HA TYR 40 HA TYR 40 -7.916 2.081 -2.467 289 1HB TYR 40 1HB TYR 40 -5.784 2.937 -3.070 290 2HB TYR 40 2HB TYR 40 -6.463 4.053 -1.899 291 HD1 TYR 40 HD1 TYR 40 -5.385 4.419 0.229 292 HD2 TYR 40 HD2 TYR 40 -3.872 1.513 -2.485 293 HE1 TYR 40 HE1 TYR 40 -3.288 4.324 1.506 294 HE2 TYR 40 HE2 TYR 40 -1.775 1.406 -1.210 295 HH TYR 40 HH TYR 40 -0.486 2.834 0.334 296 H ILE 41 H ILE 41 -7.409 0.245 -3.448 297 HA ILE 41 HA ILE 41 -6.169 -1.858 -1.800 298 HB ILE 41 HB ILE 41 -7.889 -2.232 -4.255 299 1HG1 ILE 41 1HG1 ILE 41 -8.779 -2.574 -1.392 300 2HG1 ILE 41 2HG1 ILE 41 -9.026 -1.076 -2.282 301 1HG2 ILE 41 1HG2 ILE 41 -8.119 -4.529 -3.398 302 2HG2 ILE 41 2HG2 ILE 41 -7.016 -4.135 -2.081 303 3HG2 ILE 41 3HG2 ILE 41 -6.441 -4.116 -3.747 304 1HD1 ILE 41 1HD1 ILE 41 -11.014 -2.459 -2.318 305 2HD1 ILE 41 2HD1 ILE 41 -10.097 -3.776 -3.052 306 3HD1 ILE 41 3HD1 ILE 41 -10.343 -2.270 -3.940 307 H TYR 42 H TYR 42 -4.081 -2.061 -2.288 308 HA TYR 42 HA TYR 42 -3.152 -1.514 -4.992 309 1HB TYR 42 1HB TYR 42 -2.008 -0.834 -2.739 310 2HB TYR 42 2HB TYR 42 -1.407 -2.485 -2.749 311 HD1 TYR 42 HD1 TYR 42 -0.556 -3.072 -5.370 312 HD2 TYR 42 HD2 TYR 42 -0.420 0.672 -3.363 313 HE1 TYR 42 HE1 TYR 42 1.296 -2.369 -6.823 314 HE2 TYR 42 HE2 TYR 42 1.430 1.392 -4.815 315 HH TYR 42 HH TYR 42 2.219 -0.081 -7.647 316 H TYR 43 H TYR 43 -3.396 -3.139 -6.409 317 HA TYR 43 HA TYR 43 -3.110 -5.905 -5.547 318 1HB TYR 43 1HB TYR 43 -3.547 -4.815 -8.343 319 2HB TYR 43 2HB TYR 43 -3.702 -6.494 -7.837 320 HD1 TYR 43 HD1 TYR 43 -5.475 -6.950 -5.966 321 HD2 TYR 43 HD2 TYR 43 -5.425 -3.477 -8.419 322 HE1 TYR 43 HE1 TYR 43 -7.860 -6.577 -5.476 323 HE2 TYR 43 HE2 TYR 43 -7.801 -3.097 -7.941 324 HH TYR 43 HH TYR 43 -9.527 -4.952 -5.537 325 H LEU 44 H LEU 44 -1.029 -6.303 -5.057 326 HA LEU 44 HA LEU 44 1.164 -4.917 -6.004 327 1HB LEU 44 1HB LEU 44 0.991 -7.653 -4.768 328 2HB LEU 44 2HB LEU 44 2.516 -6.870 -5.132 329 HG LEU 44 HG LEU 44 1.694 -4.946 -3.652 330 1HD1 LEU 44 1HD1 LEU 44 -0.197 -7.088 -2.699 331 2HD1 LEU 44 2HD1 LEU 44 -0.661 -5.621 -3.560 332 3HD1 LEU 44 3HD1 LEU 44 0.060 -5.512 -1.955 333 1HD2 LEU 44 1HD2 LEU 44 2.268 -7.637 -2.428 334 2HD2 LEU 44 2HD2 LEU 44 2.442 -6.077 -1.623 335 3HD2 LEU 44 3HD2 LEU 44 3.463 -6.475 -3.004 336 H ALA 45 H ALA 45 0.005 -8.099 -7.126 337 HA ALA 45 HA ALA 45 2.225 -8.529 -8.842 338 1HB ALA 45 1HB ALA 45 0.983 -10.431 -9.699 339 2HB ALA 45 2HB ALA 45 -0.480 -9.849 -8.907 340 3HB ALA 45 3HB ALA 45 0.898 -10.369 -7.938 341 H THR 46 H THR 46 -0.423 -6.491 -9.194 342 HA THR 46 HA THR 46 -0.058 -6.435 -12.121 343 HB THR 46 HB THR 46 -2.431 -5.252 -10.678 344 HG1 THR 46 HG1 THR 46 -1.967 -7.938 -11.482 345 1HG2 THR 46 1HG2 THR 46 -3.529 -5.579 -12.850 346 2HG2 THR 46 2HG2 THR 46 -2.047 -6.283 -13.496 347 3HG2 THR 46 3HG2 THR 46 -2.081 -4.586 -13.014 348 H GLU 47 H GLU 47 0.672 -4.926 -9.271 349 HA GLU 47 HA GLU 47 1.170 -2.858 -8.527 350 1HB GLU 47 1HB GLU 47 2.142 -2.685 -11.374 351 2HB GLU 47 2HB GLU 47 2.446 -1.425 -10.183 352 1HG GLU 47 1HG GLU 47 3.485 -3.211 -8.737 353 2HG GLU 47 2HG GLU 47 3.397 -4.274 -10.141 354 H ASN 48 H ASN 48 -1.525 -3.232 -9.480 355 HA ASN 48 HA ASN 48 -2.231 -0.558 -10.452 356 1HB ASN 48 1HB ASN 48 -3.633 -3.190 -10.401 357 2HB ASN 48 2HB ASN 48 -4.617 -1.735 -10.314 358 1HD2 ASN 48 1HD2 ASN 48 -1.590 -2.007 -12.089 359 2HD2 ASN 48 2HD2 ASN 48 -2.300 -1.856 -13.661 360 H VAL 49 H VAL 49 -2.971 0.944 -9.117 361 HA VAL 49 HA VAL 49 -3.609 0.164 -6.357 362 HB VAL 49 HB VAL 49 -3.238 2.981 -7.369 363 1HG1 VAL 49 1HG1 VAL 49 -4.298 2.760 -5.196 364 2HG1 VAL 49 2HG1 VAL 49 -2.679 3.440 -5.028 365 3HG1 VAL 49 3HG1 VAL 49 -2.969 1.745 -4.632 366 1HG2 VAL 49 1HG2 VAL 49 -0.900 2.849 -6.609 367 2HG2 VAL 49 2HG2 VAL 49 -1.224 1.762 -7.961 368 3HG2 VAL 49 3HG2 VAL 49 -1.104 1.121 -6.321 369 H HIS 50 H HIS 50 -5.697 -0.260 -6.093 370 HA HIS 50 HA HIS 50 -7.719 1.089 -7.710 371 1HB HIS 50 1HB HIS 50 -7.676 -1.401 -7.372 372 2HB HIS 50 2HB HIS 50 -8.008 -1.135 -5.670 373 HD1 HIS 50 HD1 HIS 50 -10.014 -2.849 -6.718 374 HD2 HIS 50 HD2 HIS 50 -10.278 1.247 -7.402 375 HE1 HIS 50 HE1 HIS 50 -12.429 -2.403 -7.260 376 HE2 HIS 50 HE2 HIS 50 -12.591 0.095 -7.568 377 H ILE 51 H ILE 51 -7.651 3.172 -6.769 378 HA ILE 51 HA ILE 51 -8.128 3.433 -3.894 379 HB ILE 51 HB ILE 51 -7.732 5.630 -5.925 380 1HG1 ILE 51 1HG1 ILE 51 -5.608 4.454 -4.135 381 2HG1 ILE 51 2HG1 ILE 51 -5.848 3.920 -5.796 382 1HG2 ILE 51 1HG2 ILE 51 -7.052 6.948 -3.957 383 2HG2 ILE 51 2HG2 ILE 51 -7.434 5.572 -2.922 384 3HG2 ILE 51 3HG2 ILE 51 -8.715 6.371 -3.832 385 1HD1 ILE 51 1HD1 ILE 51 -5.425 6.197 -6.571 386 2HD1 ILE 51 2HD1 ILE 51 -4.064 5.537 -5.663 387 3HD1 ILE 51 3HD1 ILE 51 -5.149 6.703 -4.905 388 H VAL 52 H VAL 52 -10.215 3.361 -3.270 389 HA VAL 52 HA VAL 52 -12.209 4.700 -4.980 390 HB VAL 52 HB VAL 52 -12.723 2.856 -2.632 391 1HG1 VAL 52 1HG1 VAL 52 -14.547 4.405 -3.076 392 2HG1 VAL 52 2HG1 VAL 52 -15.007 2.764 -3.533 393 3HG1 VAL 52 3HG1 VAL 52 -14.558 3.932 -4.776 394 1HG2 VAL 52 1HG2 VAL 52 -12.820 2.237 -5.585 395 2HG2 VAL 52 2HG2 VAL 52 -13.289 1.145 -4.283 396 3HG2 VAL 52 3HG2 VAL 52 -11.607 1.651 -4.448 397 H LEU 53 H LEU 53 -12.734 6.694 -4.412 398 HA LEU 53 HA LEU 53 -11.962 7.778 -1.860 399 1HB LEU 53 1HB LEU 53 -13.593 9.048 -4.062 400 2HB LEU 53 2HB LEU 53 -12.845 9.882 -2.713 401 HG LEU 53 HG LEU 53 -11.429 8.520 -5.003 402 1HD1 LEU 53 1HD1 LEU 53 -10.639 10.764 -5.512 403 2HD1 LEU 53 2HD1 LEU 53 -11.568 11.408 -4.159 404 3HD1 LEU 53 3HD1 LEU 53 -12.400 10.692 -5.540 405 1HD2 LEU 53 1HD2 LEU 53 -9.357 9.312 -3.981 406 2HD2 LEU 53 2HD2 LEU 53 -10.194 8.168 -2.932 407 3HD2 LEU 53 3HD2 LEU 53 -10.263 9.894 -2.585 408 H LYS 54 H LYS 54 -14.044 9.562 -1.330 409 HA LYS 54 HA LYS 54 -15.762 7.895 0.175 410 1HB LYS 54 1HB LYS 54 -17.028 10.152 0.517 411 2HB LYS 54 2HB LYS 54 -15.436 9.918 1.221 412 1HG LYS 54 1HG LYS 54 -14.488 11.118 -0.773 413 2HG LYS 54 2HG LYS 54 -16.148 11.509 -1.231 414 1HD LYS 54 1HD LYS 54 -16.484 12.627 0.914 415 2HD LYS 54 2HD LYS 54 -14.831 12.233 1.384 416 1HE LYS 54 1HE LYS 54 -14.942 14.525 0.631 417 2HE LYS 54 2HE LYS 54 -14.001 13.568 -0.511 418 1HZ LYS 54 1HZ LYS 54 -15.815 13.516 -2.021 419 2HZ LYS 54 2HZ LYS 54 -15.612 15.135 -1.543 420 3HZ LYS 54 3HZ LYS 54 -16.873 14.208 -0.885 421 H ASN 55 H ASN 55 -16.844 10.292 -2.268 422 HA ASN 55 HA ASN 55 -18.500 8.224 -3.488 423 1HB ASN 55 1HB ASN 55 -19.631 10.857 -2.504 424 2HB ASN 55 2HB ASN 55 -20.492 9.695 -3.507 425 1HD2 ASN 55 1HD2 ASN 55 -21.117 7.699 -2.598 426 2HD2 ASN 55 2HD2 ASN 55 -21.244 7.509 -0.882 427 H ASP 56 H ASP 56 -16.140 10.104 -4.016 428 HA ASP 56 HA ASP 56 -17.080 11.844 -6.113 429 1HB ASP 56 1HB ASP 56 -14.302 11.154 -5.144 430 2HB ASP 56 2HB ASP 56 -14.622 12.293 -6.448 431 H ASN 57 H ASN 57 -14.477 9.426 -6.211 432 HA ASN 57 HA ASN 57 -15.651 7.926 -8.316 433 1HB ASN 57 1HB ASN 57 -14.171 8.501 -10.140 434 2HB ASN 57 2HB ASN 57 -14.957 9.973 -9.584 435 1HD2 ASN 57 1HD2 ASN 57 -12.441 9.499 -11.045 436 2HD2 ASN 57 2HD2 ASN 57 -11.211 10.297 -10.120 437 H THR 58 H THR 58 -13.563 6.724 -9.451 438 HA THR 58 HA THR 58 -11.926 5.748 -7.213 439 HB THR 58 HB THR 58 -12.724 4.177 -9.669 440 HG1 THR 58 HG1 THR 58 -14.120 4.737 -7.378 441 1HG2 THR 58 1HG2 THR 58 -10.672 3.430 -8.555 442 2HG2 THR 58 2HG2 THR 58 -11.972 2.251 -8.360 443 3HG2 THR 58 3HG2 THR 58 -11.542 3.320 -7.024 444 H VAL 59 H VAL 59 -9.759 5.675 -7.502 445 HA VAL 59 HA VAL 59 -8.722 6.570 -10.116 446 HB VAL 59 HB VAL 59 -7.388 6.859 -7.418 447 1HG1 VAL 59 1HG1 VAL 59 -5.825 6.758 -9.289 448 2HG1 VAL 59 2HG1 VAL 59 -5.866 8.376 -8.588 449 3HG1 VAL 59 3HG1 VAL 59 -6.705 8.051 -10.105 450 1HG2 VAL 59 1HG2 VAL 59 -7.932 9.247 -7.582 451 2HG2 VAL 59 2HG2 VAL 59 -9.378 8.242 -7.490 452 3HG2 VAL 59 3HG2 VAL 59 -8.874 8.923 -9.036 453 H LEU 60 H LEU 60 -7.588 5.085 -11.204 454 HA LEU 60 HA LEU 60 -6.433 2.857 -9.665 455 1HB LEU 60 1HB LEU 60 -7.540 2.856 -12.475 456 2HB LEU 60 2HB LEU 60 -6.614 1.534 -11.794 457 HG LEU 60 HG LEU 60 -8.446 1.516 -9.948 458 1HD1 LEU 60 1HD1 LEU 60 -9.926 2.903 -12.179 459 2HD1 LEU 60 2HD1 LEU 60 -9.527 3.603 -10.608 460 3HD1 LEU 60 3HD1 LEU 60 -10.639 2.236 -10.708 461 1HD2 LEU 60 1HD2 LEU 60 -8.074 -0.284 -11.534 462 2HD2 LEU 60 2HD2 LEU 60 -9.006 0.577 -12.757 463 3HD2 LEU 60 3HD2 LEU 60 -9.800 -0.012 -11.298 464 H LEU 61 H LEU 61 -4.373 3.507 -9.391 465 HA LEU 61 HA LEU 61 -2.863 4.711 -11.545 466 1HB LEU 61 1HB LEU 61 -1.762 3.684 -8.937 467 2HB LEU 61 2HB LEU 61 -1.070 4.903 -9.990 468 HG LEU 61 HG LEU 61 -3.611 5.260 -8.400 469 1HD1 LEU 61 1HD1 LEU 61 -1.630 5.070 -6.970 470 2HD1 LEU 61 2HD1 LEU 61 -2.286 6.708 -6.967 471 3HD1 LEU 61 3HD1 LEU 61 -0.841 6.338 -7.906 472 1HD2 LEU 61 1HD2 LEU 61 -3.555 6.597 -10.442 473 2HD2 LEU 61 2HD2 LEU 61 -1.961 7.213 -10.003 474 3HD2 LEU 61 3HD2 LEU 61 -3.366 7.616 -9.016 475 H LYS 62 H LYS 62 -1.531 3.675 -12.922 476 HA LYS 62 HA LYS 62 -1.157 0.789 -12.505 477 1HB LYS 62 1HB LYS 62 -0.653 0.686 -14.916 478 2HB LYS 62 2HB LYS 62 -2.244 1.360 -14.604 479 1HG LYS 62 1HG LYS 62 -1.203 3.642 -14.869 480 2HG LYS 62 2HG LYS 62 0.243 2.818 -15.453 481 1HD LYS 62 1HD LYS 62 -1.050 3.476 -17.355 482 2HD LYS 62 2HD LYS 62 -1.177 1.722 -17.192 483 1HE LYS 62 1HE LYS 62 -3.350 1.969 -16.115 484 2HE LYS 62 2HE LYS 62 -3.218 3.723 -16.224 485 1HZ LYS 62 1HZ LYS 62 -3.132 3.469 -18.668 486 2HZ LYS 62 2HZ LYS 62 -4.592 2.939 -17.987 487 3HZ LYS 62 3HZ LYS 62 -3.434 1.809 -18.480 488 H GLY 63 H GLY 63 0.703 0.227 -11.645 489 1HA GLY 63 1HA GLY 63 3.016 1.952 -11.748 490 2HA GLY 63 2HA GLY 63 2.897 0.402 -10.928 491 H LEU 64 H LEU 64 4.902 -0.288 -11.697 492 HA LEU 64 HA LEU 64 5.614 -0.120 -14.454 493 1HB LEU 64 1HB LEU 64 6.821 -1.822 -12.274 494 2HB LEU 64 2HB LEU 64 7.558 -1.460 -13.823 495 HG LEU 64 HG LEU 64 6.969 0.545 -11.641 496 1HD1 LEU 64 1HD1 LEU 64 9.410 0.680 -11.445 497 2HD1 LEU 64 2HD1 LEU 64 9.567 -0.633 -12.610 498 3HD1 LEU 64 3HD1 LEU 64 8.800 -0.927 -11.050 499 1HD2 LEU 64 1HD2 LEU 64 6.781 1.567 -13.837 500 2HD2 LEU 64 2HD2 LEU 64 8.340 0.890 -14.306 501 3HD2 LEU 64 3HD2 LEU 64 8.253 2.109 -13.034 502 H LYS 65 H LYS 65 3.970 -2.421 -12.498 503 HA LYS 65 HA LYS 65 2.864 -4.351 -12.935 504 1HB LYS 65 1HB LYS 65 3.397 -3.671 -15.832 505 2HB LYS 65 2HB LYS 65 2.274 -4.897 -15.261 506 1HG LYS 65 1HG LYS 65 0.830 -3.268 -14.325 507 2HG LYS 65 2HG LYS 65 2.028 -1.990 -14.542 508 1HD LYS 65 1HD LYS 65 0.630 -3.503 -16.749 509 2HD LYS 65 2HD LYS 65 0.280 -1.851 -16.242 510 1HE LYS 65 1HE LYS 65 2.905 -2.826 -17.354 511 2HE LYS 65 2HE LYS 65 1.687 -1.920 -18.249 512 1HZ LYS 65 1HZ LYS 65 2.070 -0.013 -16.981 513 2HZ LYS 65 2HZ LYS 65 3.625 -0.623 -17.282 514 3HZ LYS 65 3HZ LYS 65 2.900 -0.856 -15.768 515 H ASN 66 H ASN 66 5.787 -4.159 -12.637 516 HA ASN 66 HA ASN 66 6.749 -6.440 -14.219 517 1HB ASN 66 1HB ASN 66 8.059 -4.253 -14.079 518 2HB ASN 66 2HB ASN 66 8.366 -4.650 -12.395 519 1HD2 ASN 66 1HD2 ASN 66 8.587 -7.575 -13.072 520 2HD2 ASN 66 2HD2 ASN 66 10.152 -7.728 -13.795 521 H ILE 67 H ILE 67 6.220 -5.290 -10.935 522 HA ILE 67 HA ILE 67 7.348 -7.674 -9.777 523 HB ILE 67 HB ILE 67 5.898 -5.330 -8.541 524 1HG1 ILE 67 1HG1 ILE 67 8.103 -5.053 -7.376 525 2HG1 ILE 67 2HG1 ILE 67 8.738 -6.363 -8.359 526 1HG2 ILE 67 1HG2 ILE 67 6.949 -7.780 -7.124 527 2HG2 ILE 67 2HG2 ILE 67 5.259 -7.292 -7.259 528 3HG2 ILE 67 3HG2 ILE 67 6.390 -6.302 -6.335 529 1HD1 ILE 67 1HD1 ILE 67 9.416 -4.223 -9.241 530 2HD1 ILE 67 2HD1 ILE 67 7.733 -3.712 -9.364 531 3HD1 ILE 67 3HD1 ILE 67 8.332 -5.030 -10.373 532 H VAL 68 H VAL 68 6.148 -9.190 -10.904 533 HA VAL 68 HA VAL 68 3.410 -9.592 -9.933 534 HB VAL 68 HB VAL 68 3.803 -9.509 -12.425 535 1HG1 VAL 68 1HG1 VAL 68 5.233 -12.114 -11.958 536 2HG1 VAL 68 2HG1 VAL 68 5.973 -10.600 -12.478 537 3HG1 VAL 68 3HG1 VAL 68 4.818 -11.424 -13.527 538 1HG2 VAL 68 1HG2 VAL 68 2.426 -11.484 -12.949 539 2HG2 VAL 68 2HG2 VAL 68 1.814 -10.580 -11.564 540 3HG2 VAL 68 3HG2 VAL 68 2.699 -12.085 -11.313 541 H SER 69 H SER 69 6.004 -10.028 -8.642 542 HA SER 69 HA SER 69 6.450 -12.871 -8.623 543 1HB SER 69 1HB SER 69 8.273 -12.119 -6.973 544 2HB SER 69 2HB SER 69 8.399 -11.580 -8.647 545 HG SER 69 HG SER 69 8.727 -9.914 -7.020 546 H VAL 70 H VAL 70 3.949 -11.655 -7.457 547 HA VAL 70 HA VAL 70 4.017 -12.172 -4.660 548 HB VAL 70 HB VAL 70 1.657 -12.260 -6.560 549 1HG1 VAL 70 1HG1 VAL 70 0.280 -11.983 -4.547 550 2HG1 VAL 70 2HG1 VAL 70 1.726 -12.107 -3.546 551 3HG1 VAL 70 3HG1 VAL 70 1.201 -13.487 -4.508 552 1HG2 VAL 70 1HG2 VAL 70 2.709 -10.079 -6.555 553 2HG2 VAL 70 2HG2 VAL 70 2.695 -10.043 -4.793 554 3HG2 VAL 70 3HG2 VAL 70 1.176 -10.002 -5.687 555 H LYS 71 H LYS 71 4.406 -14.077 -3.791 556 HA LYS 71 HA LYS 71 4.159 -16.461 -5.459 557 1HB LYS 71 1HB LYS 71 5.542 -16.159 -2.785 558 2HB LYS 71 2HB LYS 71 5.721 -17.484 -3.932 559 1HG LYS 71 1HG LYS 71 6.691 -15.913 -5.557 560 2HG LYS 71 2HG LYS 71 6.565 -14.628 -4.358 561 1HD LYS 71 1HD LYS 71 8.071 -15.892 -2.879 562 2HD LYS 71 2HD LYS 71 8.221 -17.139 -4.121 563 1HE LYS 71 1HE LYS 71 9.078 -15.392 -5.677 564 2HE LYS 71 2HE LYS 71 9.062 -14.251 -4.336 565 1HZ LYS 71 1HZ LYS 71 11.257 -15.213 -4.710 566 2HZ LYS 71 2HZ LYS 71 10.641 -16.766 -4.424 567 3HZ LYS 71 3HZ LYS 71 10.664 -15.620 -3.174 568 H PHE 72 H PHE 72 3.349 -18.466 -4.500 569 HA PHE 72 HA PHE 72 0.930 -17.981 -3.047 570 1HB PHE 72 1HB PHE 72 0.619 -20.470 -3.179 571 2HB PHE 72 2HB PHE 72 0.785 -19.662 -4.727 572 HD1 PHE 72 HD1 PHE 72 1.928 -22.309 -2.656 573 HD2 PHE 72 HD2 PHE 72 3.108 -19.746 -5.839 574 HE1 PHE 72 HE1 PHE 72 3.684 -23.912 -3.284 575 HE2 PHE 72 HE2 PHE 72 4.871 -21.342 -6.474 576 HZ PHE 72 HZ PHE 72 5.157 -23.428 -5.195 577 H SER 73 H SER 73 1.871 -17.036 -1.212 578 HA SER 73 HA SER 73 2.723 -19.006 0.787 579 1HB SER 73 1HB SER 73 3.968 -16.283 0.307 580 2HB SER 73 2HB SER 73 4.340 -17.337 1.674 581 HG SER 73 HG SER 73 4.551 -18.666 -0.679 582 H LYS 74 H LYS 74 2.594 -17.974 3.036 583 HA LYS 74 HA LYS 74 0.724 -15.825 3.344 584 1HB LYS 74 1HB LYS 74 -0.801 -17.349 4.798 585 2HB LYS 74 2HB LYS 74 -1.018 -17.315 3.056 586 1HG LYS 74 1HG LYS 74 0.257 -19.390 2.853 587 2HG LYS 74 2HG LYS 74 0.477 -19.423 4.604 588 1HD LYS 74 1HD LYS 74 -1.825 -19.761 4.989 589 2HD LYS 74 2HD LYS 74 -2.243 -19.338 3.328 590 1HE LYS 74 1HE LYS 74 -2.396 -21.746 3.698 591 2HE LYS 74 2HE LYS 74 -1.137 -21.357 2.527 592 1HZ LYS 74 1HZ LYS 74 -0.721 -22.039 5.392 593 2HZ LYS 74 2HZ LYS 74 0.509 -21.600 4.305 594 3HZ LYS 74 3HZ LYS 74 -0.369 -23.028 4.056 595 H ASP 75 H ASP 75 2.468 -14.944 4.452 596 HA ASP 75 HA ASP 75 2.635 -15.900 7.221 597 1HB ASP 75 1HB ASP 75 4.733 -16.603 6.316 598 2HB ASP 75 2HB ASP 75 4.964 -15.066 5.487 599 H ARG 76 H ARG 76 2.546 -14.354 8.741 600 HA ARG 76 HA ARG 76 2.053 -11.633 7.778 601 1HB ARG 76 1HB ARG 76 0.979 -11.281 9.993 602 2HB ARG 76 2HB ARG 76 0.217 -12.533 9.021 603 1HG ARG 76 1HG ARG 76 1.381 -14.245 10.332 604 2HG ARG 76 2HG ARG 76 2.106 -12.977 11.324 605 1HD ARG 76 1HD ARG 76 -0.099 -12.249 12.042 606 2HD ARG 76 2HD ARG 76 -0.854 -13.456 11.002 607 HE ARG 76 HE ARG 76 0.820 -14.875 12.658 608 1HH1 ARG 76 1HH1 ARG 76 -1.844 -12.650 13.136 609 2HH1 ARG 76 2HH1 ARG 76 -2.394 -13.419 14.593 610 1HH2 ARG 76 1HH2 ARG 76 0.087 -15.899 14.547 611 2HH2 ARG 76 2HH2 ARG 76 -1.308 -15.287 15.388 612 H HIS 77 H HIS 77 4.391 -13.487 9.410 613 HA HIS 77 HA HIS 77 5.300 -11.412 11.172 614 1HB HIS 77 1HB HIS 77 5.663 -13.790 11.699 615 2HB HIS 77 2HB HIS 77 6.724 -13.936 10.302 616 HD1 HIS 77 HD1 HIS 77 6.633 -11.397 13.165 617 HD2 HIS 77 HD2 HIS 77 9.250 -14.017 11.263 618 HE1 HIS 77 HE1 HIS 77 8.859 -11.044 14.257 619 HE2 HIS 77 HE2 HIS 77 10.362 -12.798 13.259 620 H LEU 78 H LEU 78 6.221 -12.585 7.971 621 HA LEU 78 HA LEU 78 8.482 -10.977 7.591 622 1HB LEU 78 1HB LEU 78 7.796 -12.771 6.055 623 2HB LEU 78 2HB LEU 78 6.415 -11.815 5.558 624 HG LEU 78 HG LEU 78 7.894 -10.139 4.569 625 1HD1 LEU 78 1HD1 LEU 78 10.304 -10.575 4.392 626 2HD1 LEU 78 2HD1 LEU 78 10.122 -11.964 5.463 627 3HD1 LEU 78 3HD1 LEU 78 9.794 -10.339 6.062 628 1HD2 LEU 78 1HD2 LEU 78 7.137 -12.014 3.199 629 2HD2 LEU 78 2HD2 LEU 78 8.552 -12.946 3.692 630 3HD2 LEU 78 3HD2 LEU 78 8.751 -11.484 2.725 631 H ILE 79 H ILE 79 5.056 -10.303 7.038 632 HA ILE 79 HA ILE 79 5.323 -7.698 6.020 633 HB ILE 79 HB ILE 79 3.048 -8.736 7.723 634 1HG1 ILE 79 1HG1 ILE 79 3.373 -8.877 4.714 635 2HG1 ILE 79 2HG1 ILE 79 3.605 -10.238 5.807 636 1HG2 ILE 79 1HG2 ILE 79 3.148 -6.562 5.629 637 2HG2 ILE 79 2HG2 ILE 79 3.007 -6.322 7.371 638 3HG2 ILE 79 3HG2 ILE 79 1.702 -7.106 6.481 639 1HD1 ILE 79 1HD1 ILE 79 1.040 -8.730 5.360 640 2HD1 ILE 79 2HD1 ILE 79 1.258 -10.058 6.500 641 3HD1 ILE 79 3HD1 ILE 79 1.430 -10.345 4.769 642 H GLU 80 H GLU 80 4.774 -8.849 9.336 643 HA GLU 80 HA GLU 80 4.830 -6.433 10.697 644 1HB GLU 80 1HB GLU 80 4.206 -8.479 11.813 645 2HB GLU 80 2HB GLU 80 5.796 -9.173 11.536 646 1HG GLU 80 1HG GLU 80 6.778 -7.505 13.032 647 2HG GLU 80 2HG GLU 80 5.177 -6.824 13.315 648 H THR 81 H THR 81 7.529 -8.551 9.810 649 HA THR 81 HA THR 81 9.558 -7.004 11.012 650 HB THR 81 HB THR 81 9.858 -8.866 8.645 651 HG1 THR 81 HG1 THR 81 8.807 -9.920 10.392 652 1HG2 THR 81 1HG2 THR 81 11.839 -7.515 9.099 653 2HG2 THR 81 2HG2 THR 81 12.128 -9.196 9.545 654 3HG2 THR 81 3HG2 THR 81 11.796 -7.996 10.794 655 H THR 82 H THR 82 8.125 -6.977 7.783 656 HA THR 82 HA THR 82 10.013 -5.170 6.659 657 HB THR 82 HB THR 82 7.189 -5.730 5.716 658 HG1 THR 82 HG1 THR 82 8.309 -7.673 5.782 659 1HG2 THR 82 1HG2 THR 82 8.218 -3.765 4.681 660 2HG2 THR 82 2HG2 THR 82 8.072 -5.088 3.525 661 3HG2 THR 82 3HG2 THR 82 9.635 -4.725 4.258 662 H SER 83 H SER 83 6.859 -4.790 8.217 663 HA SER 83 HA SER 83 6.508 -2.041 7.835 664 1HB SER 83 1HB SER 83 4.775 -3.551 8.770 665 2HB SER 83 2HB SER 83 5.734 -3.727 10.240 666 HG SER 83 HG SER 83 4.169 -2.173 10.591 667 H ASN 84 H ASN 84 8.113 -3.825 10.438 668 HA ASN 84 HA ASN 84 9.068 -1.625 11.906 669 1HB ASN 84 1HB ASN 84 9.015 -3.901 12.804 670 2HB ASN 84 2HB ASN 84 10.196 -4.423 11.611 671 1HD2 ASN 84 1HD2 ASN 84 11.711 -5.078 13.039 672 2HD2 ASN 84 2HD2 ASN 84 12.588 -4.009 14.076 673 H LYS 85 H LYS 85 10.375 -3.361 9.141 674 HA LYS 85 HA LYS 85 12.992 -2.349 9.229 675 1HB LYS 85 1HB LYS 85 12.403 -4.318 7.926 676 2HB LYS 85 2HB LYS 85 11.390 -3.346 6.870 677 1HG LYS 85 1HG LYS 85 13.278 -2.230 5.954 678 2HG LYS 85 2HG LYS 85 14.351 -2.917 7.175 679 1HD LYS 85 1HD LYS 85 14.527 -4.017 4.949 680 2HD LYS 85 2HD LYS 85 14.084 -5.119 6.252 681 1HE LYS 85 1HE LYS 85 11.796 -5.128 5.558 682 2HE LYS 85 2HE LYS 85 12.088 -3.838 4.392 683 1HZ LYS 85 1HZ LYS 85 13.234 -5.252 2.981 684 2HZ LYS 85 2HZ LYS 85 11.982 -6.244 3.553 685 3HZ LYS 85 3HZ LYS 85 13.544 -6.400 4.194 686 H LEU 86 H LEU 86 10.140 -1.162 7.410 687 HA LEU 86 HA LEU 86 11.529 1.040 6.251 688 1HB LEU 86 1HB LEU 86 8.644 0.350 6.642 689 2HB LEU 86 2HB LEU 86 9.075 1.970 6.151 690 HG LEU 86 HG LEU 86 8.453 0.501 4.263 691 1HD1 LEU 86 1HD1 LEU 86 9.905 2.423 3.895 692 2HD1 LEU 86 2HD1 LEU 86 10.361 1.084 2.843 693 3HD1 LEU 86 3HD1 LEU 86 11.317 1.441 4.280 694 1HD2 LEU 86 1HD2 LEU 86 9.999 -1.251 3.578 695 2HD2 LEU 86 2HD2 LEU 86 9.330 -1.577 5.179 696 3HD2 LEU 86 3HD2 LEU 86 10.971 -0.956 5.021 697 H LYS 87 H LYS 87 9.618 0.578 9.112 698 HA LYS 87 HA LYS 87 9.386 3.185 10.030 699 1HB LYS 87 1HB LYS 87 8.105 1.337 10.904 700 2HB LYS 87 2HB LYS 87 9.562 0.552 11.489 701 1HG LYS 87 1HG LYS 87 8.388 1.530 13.329 702 2HG LYS 87 2HG LYS 87 9.888 2.414 13.070 703 1HD LYS 87 1HD LYS 87 8.714 4.208 11.995 704 2HD LYS 87 2HD LYS 87 7.204 3.295 12.024 705 1HE LYS 87 1HE LYS 87 7.281 4.992 13.795 706 2HE LYS 87 2HE LYS 87 7.179 3.359 14.450 707 1HZ LYS 87 1HZ LYS 87 9.575 3.425 14.844 708 2HZ LYS 87 2HZ LYS 87 8.776 4.671 15.668 709 3HZ LYS 87 3HZ LYS 87 9.641 5.014 14.252 710 H SER 88 H SER 88 11.922 0.780 10.740 711 HA SER 88 HA SER 88 13.293 2.745 12.397 712 1HB SER 88 1HB SER 88 12.977 0.449 13.246 713 2HB SER 88 2HB SER 88 13.951 -0.170 11.914 714 HG SER 88 HG SER 88 14.937 1.792 13.704 715 H ARG 89 H ARG 89 13.808 1.026 9.338 716 HA ARG 89 HA ARG 89 16.595 1.888 9.307 717 1HB ARG 89 1HB ARG 89 15.126 0.181 7.294 718 2HB ARG 89 2HB ARG 89 16.864 0.432 7.383 719 1HG ARG 89 1HG ARG 89 15.140 -0.984 9.402 720 2HG ARG 89 2HG ARG 89 16.308 -1.716 8.301 721 1HD ARG 89 1HD ARG 89 16.964 0.267 10.472 722 2HD ARG 89 2HD ARG 89 17.178 -1.477 10.594 723 HE ARG 89 HE ARG 89 18.531 -0.195 8.371 724 1HH1 ARG 89 1HH1 ARG 89 18.746 -1.298 11.689 725 2HH1 ARG 89 2HH1 ARG 89 20.477 -1.472 11.651 726 1HH2 ARG 89 1HH2 ARG 89 20.785 -0.392 8.316 727 2HH2 ARG 89 2HH2 ARG 89 21.644 -0.969 9.716 728 H GLU 90 H GLU 90 13.577 2.695 7.787 729 HA GLU 90 HA GLU 90 12.979 4.208 6.194 730 1HB GLU 90 1HB GLU 90 15.641 5.466 6.886 731 2HB GLU 90 2HB GLU 90 14.346 6.244 5.991 732 1HG GLU 90 1HG GLU 90 12.914 6.191 7.920 733 2HG GLU 90 2HG GLU 90 14.118 5.272 8.826 734 H ILE 91 H ILE 91 13.885 1.949 5.087 735 HA ILE 91 HA ILE 91 16.043 2.333 3.270 736 HB ILE 91 HB ILE 91 14.939 0.243 2.142 737 1HG1 ILE 91 1HG1 ILE 91 13.734 0.011 4.897 738 2HG1 ILE 91 2HG1 ILE 91 12.808 0.628 3.534 739 1HG2 ILE 91 1HG2 ILE 91 16.063 -1.191 3.793 740 2HG2 ILE 91 2HG2 ILE 91 16.178 0.187 4.888 741 3HG2 ILE 91 3HG2 ILE 91 17.035 0.211 3.346 742 1HD1 ILE 91 1HD1 ILE 91 13.177 -1.476 2.346 743 2HD1 ILE 91 2HD1 ILE 91 12.363 -1.717 3.892 744 3HD1 ILE 91 3HD1 ILE 91 14.081 -2.090 3.732 745 H THR 92 H THR 92 13.080 1.126 1.886 746 HA THR 92 HA THR 92 12.506 3.543 0.422 747 HB THR 92 HB THR 92 13.453 1.088 -1.078 748 HG1 THR 92 HG1 THR 92 14.765 3.310 -0.112 749 1HG2 THR 92 1HG2 THR 92 11.728 2.337 -2.282 750 2HG2 THR 92 2HG2 THR 92 13.299 2.521 -3.063 751 3HG2 THR 92 3HG2 THR 92 12.651 3.826 -2.069 752 H PHE 93 H PHE 93 10.447 3.516 -0.493 753 HA PHE 93 HA PHE 93 8.598 1.892 0.872 754 1HB PHE 93 1HB PHE 93 8.131 4.190 0.088 755 2HB PHE 93 2HB PHE 93 8.146 3.607 -1.572 756 HD1 PHE 93 HD1 PHE 93 6.483 2.767 1.665 757 HD2 PHE 93 HD2 PHE 93 6.112 3.242 -2.547 758 HE1 PHE 93 HE1 PHE 93 4.074 2.286 1.826 759 HE2 PHE 93 HE2 PHE 93 3.704 2.758 -2.393 760 HZ PHE 93 HZ PHE 93 2.681 2.281 -0.206 761 H GLN 94 H GLN 94 9.953 1.663 -2.376 762 HA GLN 94 HA GLN 94 8.091 -0.273 -3.297 763 1HB GLN 94 1HB GLN 94 9.593 -0.617 -5.178 764 2HB GLN 94 2HB GLN 94 9.388 1.098 -4.862 765 1HG GLN 94 1HG GLN 94 11.583 1.315 -4.828 766 2HG GLN 94 2HG GLN 94 11.641 0.282 -3.399 767 1HE2 GLN 94 1HE2 GLN 94 13.483 0.574 -5.694 768 2HE2 GLN 94 2HE2 GLN 94 13.667 -1.019 -6.344 769 H GLU 95 H GLU 95 11.025 -0.453 -1.453 770 HA GLU 95 HA GLU 95 11.525 -3.235 -1.762 771 1HB GLU 95 1HB GLU 95 12.858 -1.142 -0.613 772 2HB GLU 95 2HB GLU 95 12.256 -1.979 0.810 773 1HG GLU 95 1HG GLU 95 13.881 -3.268 -1.373 774 2HG GLU 95 2HG GLU 95 14.543 -2.638 0.133 775 H TYR 96 H TYR 96 9.720 -1.282 0.562 776 HA TYR 96 HA TYR 96 8.790 -3.270 2.274 777 1HB TYR 96 1HB TYR 96 8.451 -0.901 2.729 778 2HB TYR 96 2HB TYR 96 7.414 -0.746 1.324 779 HD1 TYR 96 HD1 TYR 96 7.649 -2.064 4.752 780 HD2 TYR 96 HD2 TYR 96 5.099 -1.419 1.411 781 HE1 TYR 96 HE1 TYR 96 5.694 -2.538 6.164 782 HE2 TYR 96 HE2 TYR 96 3.138 -1.894 2.814 783 HH TYR 96 HH TYR 96 2.582 -3.057 4.861 784 H ARG 97 H ARG 97 7.424 -2.071 -0.757 785 HA ARG 97 HA ARG 97 5.098 -3.627 -0.799 786 1HB ARG 97 1HB ARG 97 5.595 -1.647 -2.248 787 2HB ARG 97 2HB ARG 97 6.682 -2.662 -3.186 788 1HG ARG 97 1HG ARG 97 4.755 -4.136 -3.716 789 2HG ARG 97 2HG ARG 97 3.704 -2.982 -2.889 790 1HD ARG 97 1HD ARG 97 3.617 -2.526 -5.239 791 2HD ARG 97 2HD ARG 97 4.513 -1.225 -4.457 792 HE ARG 97 HE ARG 97 6.406 -3.052 -5.262 793 1HH1 ARG 97 1HH1 ARG 97 3.997 -1.039 -6.823 794 2HH1 ARG 97 2HH1 ARG 97 4.826 -1.037 -8.357 795 1HH2 ARG 97 1HH2 ARG 97 7.504 -2.986 -7.282 796 2HH2 ARG 97 2HH2 ARG 97 6.795 -2.120 -8.607 797 H ARG 98 H ARG 98 8.360 -4.316 -1.956 798 HA ARG 98 HA ARG 98 7.724 -6.651 -3.430 799 1HB ARG 98 1HB ARG 98 10.331 -5.788 -2.168 800 2HB ARG 98 2HB ARG 98 10.163 -7.121 -3.303 801 1HG ARG 98 1HG ARG 98 9.460 -5.618 -5.039 802 2HG ARG 98 2HG ARG 98 9.446 -4.263 -3.911 803 1HD ARG 98 1HD ARG 98 11.447 -4.164 -5.227 804 2HD ARG 98 2HD ARG 98 11.874 -4.585 -3.570 805 HE ARG 98 HE ARG 98 11.851 -6.980 -4.519 806 1HH1 ARG 98 1HH1 ARG 98 12.842 -4.114 -6.249 807 2HH1 ARG 98 2HH1 ARG 98 13.950 -4.959 -7.287 808 1HH2 ARG 98 1HH2 ARG 98 13.337 -8.103 -5.870 809 2HH2 ARG 98 2HH2 ARG 98 14.255 -7.218 -7.048 810 H ASN 99 H ASN 99 8.689 -6.130 -0.084 811 HA ASN 99 HA ASN 99 9.065 -8.874 0.534 812 1HB ASN 99 1HB ASN 99 8.726 -6.396 2.186 813 2HB ASN 99 2HB ASN 99 8.747 -7.981 2.950 814 1HD2 ASN 99 1HD2 ASN 99 10.585 -5.707 1.037 815 2HD2 ASN 99 2HD2 ASN 99 12.141 -6.391 1.364 816 H LEU 100 H LEU 100 6.284 -6.743 0.607 817 HA LEU 100 HA LEU 100 4.569 -8.549 1.971 818 1HB LEU 100 1HB LEU 100 4.200 -6.114 0.313 819 2HB LEU 100 2HB LEU 100 2.810 -7.159 0.527 820 HG LEU 100 HG LEU 100 2.939 -6.888 2.950 821 1HD1 LEU 100 1HD1 LEU 100 4.507 -5.298 3.951 822 2HD1 LEU 100 2HD1 LEU 100 5.299 -5.106 2.384 823 3HD1 LEU 100 3HD1 LEU 100 5.338 -6.665 3.209 824 1HD2 LEU 100 1HD2 LEU 100 3.058 -4.257 1.483 825 2HD2 LEU 100 2HD2 LEU 100 2.365 -4.518 3.083 826 3HD2 LEU 100 3HD2 LEU 100 1.632 -5.279 1.670 827 H ALA 101 H ALA 101 5.291 -8.023 -1.455 828 HA ALA 101 HA ALA 101 3.475 -9.913 -2.493 829 1HB ALA 101 1HB ALA 101 4.883 -9.887 -4.502 830 2HB ALA 101 2HB ALA 101 6.133 -9.019 -3.609 831 3HB ALA 101 3HB ALA 101 4.571 -8.257 -3.905 832 H LYS 102 H LYS 102 6.742 -10.169 -1.255 833 HA LYS 102 HA LYS 102 7.239 -12.870 -1.887 834 1HB LYS 102 1HB LYS 102 8.955 -11.221 -1.175 835 2HB LYS 102 2HB LYS 102 8.274 -11.240 0.444 836 1HG LYS 102 1HG LYS 102 8.782 -13.717 0.484 837 2HG LYS 102 2HG LYS 102 9.718 -13.447 -0.989 838 1HD LYS 102 1HD LYS 102 11.050 -11.745 0.213 839 2HD LYS 102 2HD LYS 102 10.150 -12.112 1.683 840 1HE LYS 102 1HE LYS 102 10.937 -14.483 1.458 841 2HE LYS 102 2HE LYS 102 11.988 -13.937 0.152 842 1HZ LYS 102 1HZ LYS 102 12.806 -12.244 1.896 843 2HZ LYS 102 2HZ LYS 102 13.359 -13.844 1.986 844 3HZ LYS 102 3HZ LYS 102 12.127 -13.315 3.028 845 H ALA 103 H ALA 103 5.492 -11.313 0.711 846 HA ALA 103 HA ALA 103 5.294 -13.682 2.333 847 1HB ALA 103 1HB ALA 103 3.781 -11.084 2.536 848 2HB ALA 103 2HB ALA 103 5.316 -11.438 3.329 849 3HB ALA 103 3HB ALA 103 3.866 -12.344 3.767 850 H GLY 104 H GLY 104 3.682 -12.482 -0.394 851 1HA GLY 104 1HA GLY 104 2.150 -13.902 -1.573 852 2HA GLY 104 2HA GLY 104 1.592 -14.517 -0.025 853 H VAL 105 H VAL 105 2.005 -11.165 0.003 854 HA VAL 105 HA VAL 105 -0.825 -10.751 0.282 855 HB VAL 105 HB VAL 105 1.424 -8.730 0.216 856 1HG1 VAL 105 1HG1 VAL 105 -0.171 -7.201 1.270 857 2HG1 VAL 105 2HG1 VAL 105 -1.438 -8.420 1.125 858 3HG1 VAL 105 3HG1 VAL 105 -0.724 -7.709 -0.324 859 1HG2 VAL 105 1HG2 VAL 105 1.694 -10.276 2.057 860 2HG2 VAL 105 2HG2 VAL 105 0.015 -10.040 2.540 861 3HG2 VAL 105 3HG2 VAL 105 1.165 -8.709 2.671 862 H PHE 106 H PHE 106 -2.187 -10.360 -1.293 863 HA PHE 106 HA PHE 106 -1.190 -9.054 -3.734 864 1HB PHE 106 1HB PHE 106 -1.777 -11.424 -4.135 865 2HB PHE 106 2HB PHE 106 -3.407 -11.108 -3.552 866 HD1 PHE 106 HD1 PHE 106 -1.116 -9.349 -5.917 867 HD2 PHE 106 HD2 PHE 106 -4.920 -11.143 -5.274 868 HE1 PHE 106 HE1 PHE 106 -1.798 -8.709 -8.192 869 HE2 PHE 106 HE2 PHE 106 -5.608 -10.503 -7.549 870 HZ PHE 106 HZ PHE 106 -4.046 -9.283 -9.009 871 H ARG 107 H ARG 107 -3.597 -9.218 -1.249 872 HA ARG 107 HA ARG 107 -5.032 -6.954 -2.456 873 1HB ARG 107 1HB ARG 107 -5.823 -9.132 -0.646 874 2HB ARG 107 2HB ARG 107 -6.430 -7.554 -0.188 875 1HG ARG 107 1HG ARG 107 -8.107 -8.575 -1.473 876 2HG ARG 107 2HG ARG 107 -7.366 -7.358 -2.509 877 1HD ARG 107 1HD ARG 107 -6.359 -8.926 -3.858 878 2HD ARG 107 2HD ARG 107 -6.353 -10.157 -2.594 879 HE ARG 107 HE ARG 107 -8.906 -10.078 -2.959 880 1HH1 ARG 107 1HH1 ARG 107 -6.525 -9.638 -5.486 881 2HH1 ARG 107 2HH1 ARG 107 -7.528 -10.335 -6.719 882 1HH2 ARG 107 1HH2 ARG 107 -10.235 -10.962 -4.593 883 2HH2 ARG 107 2HH2 ARG 107 -9.632 -11.051 -6.222 884 H TRP 108 H TRP 108 -3.483 -5.372 -1.949 885 HA TRP 108 HA TRP 108 -2.936 -4.859 0.863 886 1HB TRP 108 1HB TRP 108 -1.182 -4.503 -0.864 887 2HB TRP 108 2HB TRP 108 -2.187 -3.272 -1.609 888 HD1 TRP 108 HD1 TRP 108 -2.855 -2.140 1.574 889 HE1 TRP 108 HE1 TRP 108 -1.102 -0.510 2.512 890 HE3 TRP 108 HE3 TRP 108 1.036 -3.265 -1.538 891 HZ2 TRP 108 HZ2 TRP 108 1.578 0.199 2.006 892 HZ3 TRP 108 HZ3 TRP 108 3.164 -2.066 -1.242 893 HH2 TRP 108 HH2 TRP 108 3.428 -0.370 0.495 894 H VAL 109 H VAL 109 -5.100 -4.526 1.553 895 HA VAL 109 HA VAL 109 -6.548 -2.301 0.321 896 HB VAL 109 HB VAL 109 -7.559 -4.166 2.470 897 1HG1 VAL 109 1HG1 VAL 109 -9.767 -3.448 1.671 898 2HG1 VAL 109 2HG1 VAL 109 -8.985 -2.347 0.536 899 3HG1 VAL 109 3HG1 VAL 109 -8.808 -2.095 2.274 900 1HG2 VAL 109 1HG2 VAL 109 -8.651 -5.449 0.719 901 2HG2 VAL 109 2HG2 VAL 109 -6.903 -5.451 0.479 902 3HG2 VAL 109 3HG2 VAL 109 -7.929 -4.415 -0.512 903 H THR 110 H THR 110 -5.590 -0.481 1.127 904 HA THR 110 HA THR 110 -5.284 -0.209 4.010 905 HB THR 110 HB THR 110 -4.669 1.751 1.789 906 HG1 THR 110 HG1 THR 110 -3.280 -0.066 1.824 907 1HG2 THR 110 1HG2 THR 110 -5.161 2.898 3.900 908 2HG2 THR 110 2HG2 THR 110 -3.447 3.011 3.501 909 3HG2 THR 110 3HG2 THR 110 -3.993 1.874 4.734 910 H ASN 111 H ASN 111 -7.174 0.037 4.996 911 HA ASN 111 HA ASN 111 -9.238 1.738 3.859 912 1HB ASN 111 1HB ASN 111 -9.117 -0.135 6.207 913 2HB ASN 111 2HB ASN 111 -10.432 1.024 6.047 914 1HD2 ASN 111 1HD2 ASN 111 -12.003 0.698 4.549 915 2HD2 ASN 111 2HD2 ASN 111 -12.125 -0.741 3.578 916 H ILE 112 H ILE 112 -9.194 3.811 4.199 917 HA ILE 112 HA ILE 112 -7.524 5.000 6.214 918 HB ILE 112 HB ILE 112 -9.392 6.167 4.155 919 1HG1 ILE 112 1HG1 ILE 112 -7.346 5.157 3.273 920 2HG1 ILE 112 2HG1 ILE 112 -7.320 6.905 3.075 921 1HG2 ILE 112 1HG2 ILE 112 -9.337 7.646 6.096 922 2HG2 ILE 112 2HG2 ILE 112 -8.519 8.366 4.711 923 3HG2 ILE 112 3HG2 ILE 112 -7.576 7.671 6.029 924 1HD1 ILE 112 1HD1 ILE 112 -5.154 6.057 3.757 925 2HD1 ILE 112 2HD1 ILE 112 -5.870 5.350 5.206 926 3HD1 ILE 112 3HD1 ILE 112 -5.839 7.102 5.000 927 H HIS 113 H HIS 113 -11.012 4.864 5.575 928 HA HIS 113 HA HIS 113 -11.786 6.342 7.847 929 1HB HIS 113 1HB HIS 113 -13.301 5.925 5.953 930 2HB HIS 113 2HB HIS 113 -13.325 4.209 6.345 931 HD1 HIS 113 HD1 HIS 113 -14.609 7.532 7.542 932 HD2 HIS 113 HD2 HIS 113 -15.002 3.488 8.444 933 HE1 HIS 113 HE1 HIS 113 -16.537 7.373 9.147 934 HE2 HIS 113 HE2 HIS 113 -16.613 4.952 9.836 935 H GLU 114 H GLU 114 -11.018 2.982 7.357 936 HA GLU 114 HA GLU 114 -11.940 2.185 9.983 937 1HB GLU 114 1HB GLU 114 -10.517 0.685 7.781 938 2HB GLU 114 2HB GLU 114 -10.983 -0.041 9.310 939 1HG GLU 114 1HG GLU 114 -12.550 -0.561 7.506 940 2HG GLU 114 2HG GLU 114 -13.313 0.311 8.830 941 H GLN 115 H GLN 115 -9.151 3.513 8.641 942 HA GLN 115 HA GLN 115 -7.122 4.081 9.480 943 1HB GLN 115 1HB GLN 115 -8.291 3.174 12.120 944 2HB GLN 115 2HB GLN 115 -6.832 4.133 11.920 945 1HG GLN 115 1HG GLN 115 -9.568 5.011 11.037 946 2HG GLN 115 2HG GLN 115 -8.827 5.443 12.576 947 1HE2 GLN 115 1HE2 GLN 115 -9.707 7.089 10.306 948 2HE2 GLN 115 2HE2 GLN 115 -8.336 8.041 9.875 949 H LYS 116 H LYS 116 -7.547 1.373 8.468 950 HA LYS 116 HA LYS 116 -5.230 0.121 9.729 951 1HB LYS 116 1HB LYS 116 -7.950 -1.145 9.535 952 2HB LYS 116 2HB LYS 116 -6.490 -2.120 9.614 953 1HG LYS 116 1HG LYS 116 -5.927 -1.146 11.763 954 2HG LYS 116 2HG LYS 116 -7.342 -0.095 11.676 955 1HD LYS 116 1HD LYS 116 -8.820 -1.988 11.765 956 2HD LYS 116 2HD LYS 116 -7.462 -3.109 11.655 957 1HE LYS 116 1HE LYS 116 -8.348 -2.865 13.954 958 2HE LYS 116 2HE LYS 116 -6.647 -2.419 13.808 959 1HZ LYS 116 1HZ LYS 116 -7.301 -0.098 13.748 960 2HZ LYS 116 2HZ LYS 116 -7.867 -0.835 15.161 961 3HZ LYS 116 3HZ LYS 116 -8.936 -0.519 13.880 962 H ARG 117 H ARG 117 -3.970 -1.031 8.393 963 HA ARG 117 HA ARG 117 -4.754 -1.218 5.577 964 1HB ARG 117 1HB ARG 117 -2.099 -1.528 6.985 965 2HB ARG 117 2HB ARG 117 -2.325 -1.851 5.273 966 1HG ARG 117 1HG ARG 117 -2.787 0.406 4.802 967 2HG ARG 117 2HG ARG 117 -2.995 0.797 6.510 968 1HD ARG 117 1HD ARG 117 -0.397 -0.188 5.366 969 2HD ARG 117 2HD ARG 117 -0.816 1.524 5.444 970 HE ARG 117 HE ARG 117 -1.174 0.412 7.990 971 1HH1 ARG 117 1HH1 ARG 117 1.450 1.003 5.756 972 2HH1 ARG 117 2HH1 ARG 117 2.608 1.335 6.999 973 1HH2 ARG 117 1HH2 ARG 117 0.342 0.883 9.641 974 2HH2 ARG 117 2HH2 ARG 117 1.980 1.253 9.211 975 H TYR 118 H TYR 118 -5.803 -3.048 5.099 976 HA TYR 118 HA TYR 118 -5.228 -5.471 6.639 977 1HB TYR 118 1HB TYR 118 -7.411 -4.913 4.617 978 2HB TYR 118 2HB TYR 118 -7.273 -6.360 5.606 979 HD1 TYR 118 HD1 TYR 118 -7.783 -6.277 8.005 980 HD2 TYR 118 HD2 TYR 118 -8.227 -2.844 5.539 981 HE1 TYR 118 HE1 TYR 118 -9.148 -5.208 9.752 982 HE2 TYR 118 HE2 TYR 118 -9.590 -1.762 7.274 983 HH TYR 118 HH TYR 118 -11.025 -2.450 9.180 984 H TYR 119 H TYR 119 -3.723 -6.800 5.844 985 HA TYR 119 HA TYR 119 -3.209 -6.773 2.956 986 1HB TYR 119 1HB TYR 119 -1.525 -7.972 5.166 987 2HB TYR 119 2HB TYR 119 -1.062 -7.789 3.476 988 HD1 TYR 119 HD1 TYR 119 -0.921 -6.339 6.695 989 HD2 TYR 119 HD2 TYR 119 -1.061 -5.337 2.559 990 HE1 TYR 119 HE1 TYR 119 0.007 -4.122 7.207 991 HE2 TYR 119 HE2 TYR 119 -0.132 -3.117 3.063 992 HH TYR 119 HH TYR 119 1.273 -2.328 6.023 993 H TYR 120 H TYR 120 -4.473 -8.187 1.951 994 HA TYR 120 HA TYR 120 -4.850 -10.859 3.125 995 1HB TYR 120 1HB TYR 120 -6.283 -9.586 0.783 996 2HB TYR 120 2HB TYR 120 -6.667 -11.137 1.511 997 HD1 TYR 120 HD1 TYR 120 -7.811 -11.243 3.669 998 HD2 TYR 120 HD2 TYR 120 -6.964 -7.512 1.812 999 HE1 TYR 120 HE1 TYR 120 -9.431 -10.141 5.152 1000 HE2 TYR 120 HE2 TYR 120 -8.579 -6.401 3.296 1001 HH TYR 120 HH TYR 120 -9.879 -7.891 6.049 1002 H THR 121 H THR 121 -4.298 -12.697 1.976 1003 HA THR 121 HA THR 121 -2.377 -12.440 -0.143 1004 HB THR 121 HB THR 121 -2.193 -14.280 1.460 1005 HG1 THR 121 HG1 THR 121 -1.264 -15.020 -0.316 1006 1HG2 THR 121 1HG2 THR 121 -4.823 -15.222 0.322 1007 2HG2 THR 121 2HG2 THR 121 -4.532 -14.649 1.962 1008 3HG2 THR 121 3HG2 THR 121 -3.799 -16.156 1.413 1009 H PHE 122 H PHE 122 -2.900 -14.112 -2.114 1010 HA PHE 122 HA PHE 122 -4.967 -12.831 -3.592 1011 1HB PHE 122 1HB PHE 122 -4.461 -14.511 -5.357 1012 2HB PHE 122 2HB PHE 122 -3.030 -13.678 -4.766 1013 HD1 PHE 122 HD1 PHE 122 -1.355 -14.849 -3.464 1014 HD2 PHE 122 HD2 PHE 122 -4.804 -16.868 -4.933 1015 HE1 PHE 122 HE1 PHE 122 -0.276 -17.013 -3.013 1016 HE2 PHE 122 HE2 PHE 122 -3.731 -19.035 -4.479 1017 HZ PHE 122 HZ PHE 122 -1.464 -19.108 -3.518 1018 H ASP 123 H ASP 123 -4.931 -15.446 -1.444 1019 HA ASP 123 HA ASP 123 -7.370 -16.686 -2.375 1020 1HB ASP 123 1HB ASP 123 -5.624 -18.013 -1.268 1021 2HB ASP 123 2HB ASP 123 -5.790 -17.040 0.186 1022 H ASN 124 H ASN 124 -6.723 -13.847 -0.935 1023 HA ASN 124 HA ASN 124 -7.960 -12.241 0.060 1024 1HB ASN 124 1HB ASN 124 -10.240 -14.190 -0.312 1025 2HB ASN 124 2HB ASN 124 -10.432 -12.544 0.285 1026 1HD2 ASN 124 1HD2 ASN 124 -9.842 -14.544 -2.459 1027 2HD2 ASN 124 2HD2 ASN 124 -9.953 -13.303 -3.655 1028 H SER 125 H SER 125 -6.833 -14.722 1.505 1029 HA SER 125 HA SER 125 -8.261 -14.587 4.012 1030 1HB SER 125 1HB SER 125 -5.682 -15.961 3.216 1031 2HB SER 125 2HB SER 125 -6.402 -16.067 4.823 1032 HG SER 125 HG SER 125 -7.211 -17.230 2.414 1033 H LEU 126 H LEU 126 -7.768 -13.333 5.714 1034 HA LEU 126 HA LEU 126 -5.982 -11.133 5.322 1035 1HB LEU 126 1HB LEU 126 -8.076 -10.896 6.567 1036 2HB LEU 126 2HB LEU 126 -7.494 -12.017 7.780 1037 HG LEU 126 HG LEU 126 -5.705 -10.421 8.383 1038 1HD1 LEU 126 1HD1 LEU 126 -5.771 -8.142 7.527 1039 2HD1 LEU 126 2HD1 LEU 126 -7.089 -8.577 6.439 1040 3HD1 LEU 126 3HD1 LEU 126 -5.493 -9.296 6.222 1041 1HD2 LEU 126 1HD2 LEU 126 -7.799 -10.405 9.614 1042 2HD2 LEU 126 2HD2 LEU 126 -8.496 -9.285 8.444 1043 3HD2 LEU 126 3HD2 LEU 126 -7.155 -8.770 9.467 1044 H LEU 127 H LEU 127 -3.874 -11.461 5.377 1045 HA LEU 127 HA LEU 127 -2.695 -13.489 7.054 1046 1HB LEU 127 1HB LEU 127 -1.379 -11.388 5.325 1047 2HB LEU 127 2HB LEU 127 -0.567 -12.750 6.074 1048 HG LEU 127 HG LEU 127 -2.642 -12.883 3.888 1049 1HD1 LEU 127 1HD1 LEU 127 -0.444 -12.156 3.130 1050 2HD1 LEU 127 2HD1 LEU 127 -0.807 -13.783 2.552 1051 3HD1 LEU 127 3HD1 LEU 127 0.297 -13.553 3.911 1052 1HD2 LEU 127 1HD2 LEU 127 -2.253 -15.290 3.903 1053 2HD2 LEU 127 2HD2 LEU 127 -2.892 -14.742 5.453 1054 3HD2 LEU 127 3HD2 LEU 127 -1.177 -15.115 5.289 1055 H PHE 128 H PHE 128 -2.496 -9.955 6.791 1056 HA PHE 128 HA PHE 128 -2.119 -9.721 9.651 1057 1HB PHE 128 1HB PHE 128 0.177 -10.134 8.744 1058 2HB PHE 128 2HB PHE 128 0.003 -8.702 7.742 1059 HD1 PHE 128 HD1 PHE 128 0.585 -6.597 8.569 1060 HD2 PHE 128 HD2 PHE 128 0.059 -9.846 11.270 1061 HE1 PHE 128 HE1 PHE 128 1.483 -5.218 10.399 1062 HE2 PHE 128 HE2 PHE 128 0.955 -8.471 13.103 1063 HZ PHE 128 HZ PHE 128 1.670 -6.154 12.667 1064 H THR 129 H THR 129 -2.457 -7.550 10.386 1065 HA THR 129 HA THR 129 -3.144 -5.616 8.306 1066 HB THR 129 HB THR 129 -5.277 -6.487 9.085 1067 HG1 THR 129 HG1 THR 129 -4.823 -4.103 8.779 1068 1HG2 THR 129 1HG2 THR 129 -4.391 -5.645 11.847 1069 2HG2 THR 129 2HG2 THR 129 -4.647 -7.301 11.292 1070 3HG2 THR 129 3HG2 THR 129 -6.011 -6.188 11.417 1071 H GLU 130 H GLU 130 -2.032 -3.831 8.532 1072 HA GLU 130 HA GLU 130 -0.888 -3.207 11.171 1073 1HB GLU 130 1HB GLU 130 0.738 -3.686 9.335 1074 2HB GLU 130 2HB GLU 130 0.084 -2.319 8.443 1075 1HG GLU 130 1HG GLU 130 2.138 -1.700 9.540 1076 2HG GLU 130 2HG GLU 130 0.784 -0.818 10.243 1077 H SER 131 H SER 131 -1.804 -1.547 12.171 1078 HA SER 131 HA SER 131 -3.858 -0.047 10.912 1079 1HB SER 131 1HB SER 131 -2.547 0.420 13.602 1080 2HB SER 131 2HB SER 131 -4.109 1.050 13.078 1081 HG SER 131 HG SER 131 -4.365 -0.823 14.358 1082 H ILE 132 H ILE 132 -3.953 2.102 10.357 1083 HA ILE 132 HA ILE 132 -1.410 3.558 10.226 1084 HB ILE 132 HB ILE 132 -2.680 5.215 8.824 1085 1HG1 ILE 132 1HG1 ILE 132 -4.803 3.058 8.843 1086 2HG1 ILE 132 2HG1 ILE 132 -4.946 4.639 9.604 1087 1HG2 ILE 132 1HG2 ILE 132 -2.608 2.387 7.785 1088 2HG2 ILE 132 2HG2 ILE 132 -1.245 3.506 7.835 1089 3HG2 ILE 132 3HG2 ILE 132 -2.636 3.851 6.805 1090 1HD1 ILE 132 1HD1 ILE 132 -4.816 5.706 7.424 1091 2HD1 ILE 132 2HD1 ILE 132 -6.138 4.539 7.486 1092 3HD1 ILE 132 3HD1 ILE 132 -4.633 4.129 6.657 1093 H GLN 133 H GLN 133 -1.009 5.132 11.632 1094 HA GLN 133 HA GLN 133 -2.213 5.138 14.030 1095 1HB GLN 133 1HB GLN 133 -1.179 7.528 14.289 1096 2HB GLN 133 2HB GLN 133 -0.177 6.095 14.166 1097 1HG GLN 133 1HG GLN 133 0.883 7.571 12.768 1098 2HG GLN 133 2HG GLN 133 -0.105 6.639 11.650 1099 1HE2 GLN 133 1HE2 GLN 133 -1.734 7.643 10.538 1100 2HE2 GLN 133 2HE2 GLN 133 -2.000 9.347 10.574 Start of MODEL 5 1 H ASP 7 H ASP 7 -3.308 14.206 -15.688 2 HA ASP 7 HA ASP 7 -6.096 14.386 -15.066 3 1HB ASP 7 1HB ASP 7 -5.278 12.966 -16.900 4 2HB ASP 7 2HB ASP 7 -4.385 11.977 -15.748 5 H GLN 8 H GLN 8 -7.171 12.832 -13.585 6 HA GLN 8 HA GLN 8 -6.350 13.222 -10.965 7 1HB GLN 8 1HB GLN 8 -8.643 12.519 -11.986 8 2HB GLN 8 2HB GLN 8 -8.059 10.881 -11.727 9 1HG GLN 8 1HG GLN 8 -7.804 11.326 -9.355 10 2HG GLN 8 2HG GLN 8 -8.325 12.994 -9.601 11 1HE2 GLN 8 1HE2 GLN 8 -10.116 12.867 -8.301 12 2HE2 GLN 8 2HE2 GLN 8 -11.512 11.928 -8.707 13 H VAL 9 H VAL 9 -5.771 10.510 -13.140 14 HA VAL 9 HA VAL 9 -4.635 8.730 -11.274 15 HB VAL 9 HB VAL 9 -4.159 9.013 -14.247 16 1HG1 VAL 9 1HG1 VAL 9 -3.274 6.722 -14.178 17 2HG1 VAL 9 2HG1 VAL 9 -3.378 6.744 -12.418 18 3HG1 VAL 9 3HG1 VAL 9 -2.275 7.839 -13.249 19 1HG2 VAL 9 1HG2 VAL 9 -5.910 7.144 -12.659 20 2HG2 VAL 9 2HG2 VAL 9 -5.677 7.090 -14.406 21 3HG2 VAL 9 3HG2 VAL 9 -6.454 8.489 -13.664 22 H VAL 10 H VAL 10 -3.272 11.354 -13.168 23 HA VAL 10 HA VAL 10 -0.548 10.807 -12.680 24 HB VAL 10 HB VAL 10 -1.844 13.478 -13.256 25 1HG1 VAL 10 1HG1 VAL 10 0.404 13.749 -12.385 26 2HG1 VAL 10 2HG1 VAL 10 0.372 14.122 -14.109 27 3HG1 VAL 10 3HG1 VAL 10 1.022 12.579 -13.551 28 1HG2 VAL 10 1HG2 VAL 10 -2.387 11.845 -14.967 29 2HG2 VAL 10 2HG2 VAL 10 -0.683 11.418 -15.131 30 3HG2 VAL 10 3HG2 VAL 10 -1.239 13.026 -15.599 31 H ILE 11 H ILE 11 -2.929 12.801 -10.979 32 HA ILE 11 HA ILE 11 -1.127 13.914 -9.106 33 HB ILE 11 HB ILE 11 -4.116 13.582 -9.090 34 1HG1 ILE 11 1HG1 ILE 11 -3.973 16.113 -8.968 35 2HG1 ILE 11 2HG1 ILE 11 -2.239 15.948 -9.209 36 1HG2 ILE 11 1HG2 ILE 11 -2.467 14.742 -6.848 37 2HG2 ILE 11 2HG2 ILE 11 -3.454 13.282 -6.779 38 3HG2 ILE 11 3HG2 ILE 11 -4.221 14.856 -6.992 39 1HD1 ILE 11 1HD1 ILE 11 -3.382 16.499 -11.276 40 2HD1 ILE 11 2HD1 ILE 11 -4.371 15.045 -11.126 41 3HD1 ILE 11 3HD1 ILE 11 -2.630 14.905 -11.369 42 H PHE 12 H PHE 12 -3.342 11.126 -8.854 43 HA PHE 12 HA PHE 12 -2.656 10.532 -6.190 44 1HB PHE 12 1HB PHE 12 -4.050 9.011 -8.355 45 2HB PHE 12 2HB PHE 12 -3.613 8.196 -6.856 46 HD1 PHE 12 HD1 PHE 12 -5.749 10.727 -8.391 47 HD2 PHE 12 HD2 PHE 12 -4.648 8.808 -4.760 48 HE1 PHE 12 HE1 PHE 12 -7.757 11.639 -7.305 49 HE2 PHE 12 HE2 PHE 12 -6.655 9.715 -3.665 50 HZ PHE 12 HZ PHE 12 -8.214 11.132 -4.938 51 H LYS 13 H LYS 13 -1.348 9.264 -9.258 52 HA LYS 13 HA LYS 13 0.318 7.376 -7.920 53 1HB LYS 13 1HB LYS 13 -0.310 7.175 -10.337 54 2HB LYS 13 2HB LYS 13 0.772 8.523 -10.681 55 1HG LYS 13 1HG LYS 13 2.658 7.249 -9.815 56 2HG LYS 13 2HG LYS 13 1.588 5.902 -9.440 57 1HD LYS 13 1HD LYS 13 1.046 5.724 -11.855 58 2HD LYS 13 2HD LYS 13 2.230 6.998 -12.175 59 1HE LYS 13 1HE LYS 13 3.978 5.593 -11.151 60 2HE LYS 13 2HE LYS 13 2.787 4.316 -10.905 61 1HZ LYS 13 1HZ LYS 13 2.465 4.286 -13.344 62 2HZ LYS 13 2HZ LYS 13 4.028 3.844 -12.869 63 3HZ LYS 13 3HZ LYS 13 3.744 5.392 -13.504 64 H GLN 14 H GLN 14 0.648 10.740 -8.817 65 HA GLN 14 HA GLN 14 3.434 10.976 -8.394 66 1HB GLN 14 1HB GLN 14 1.935 12.662 -9.526 67 2HB GLN 14 2HB GLN 14 1.351 13.115 -7.934 68 1HG GLN 14 1HG GLN 14 3.593 13.804 -7.287 69 2HG GLN 14 2HG GLN 14 4.206 13.315 -8.866 70 1HE2 GLN 14 1HE2 GLN 14 1.758 14.281 -10.202 71 2HE2 GLN 14 2HE2 GLN 14 1.904 16.004 -10.249 72 H ILE 15 H ILE 15 0.651 11.048 -6.275 73 HA ILE 15 HA ILE 15 1.889 11.879 -3.902 74 HB ILE 15 HB ILE 15 -0.397 9.931 -4.282 75 1HG1 ILE 15 1HG1 ILE 15 -0.408 12.894 -3.664 76 2HG1 ILE 15 2HG1 ILE 15 -0.801 12.175 -5.224 77 1HG2 ILE 15 1HG2 ILE 15 0.450 11.423 -1.802 78 2HG2 ILE 15 2HG2 ILE 15 0.608 9.686 -2.070 79 3HG2 ILE 15 3HG2 ILE 15 -0.993 10.421 -1.967 80 1HD1 ILE 15 1HD1 ILE 15 -2.713 11.039 -4.207 81 2HD1 ILE 15 2HD1 ILE 15 -2.808 12.789 -4.010 82 3HD1 ILE 15 3HD1 ILE 15 -2.317 11.774 -2.652 83 H PHE 16 H PHE 16 1.404 8.612 -5.232 84 HA PHE 16 HA PHE 16 2.865 7.303 -3.174 85 1HB PHE 16 1HB PHE 16 1.978 6.426 -5.918 86 2HB PHE 16 2HB PHE 16 2.899 5.373 -4.851 87 HD1 PHE 16 HD1 PHE 16 -0.330 6.918 -5.501 88 HD2 PHE 16 HD2 PHE 16 1.910 4.536 -2.774 89 HE1 PHE 16 HE1 PHE 16 -2.417 6.220 -4.401 90 HE2 PHE 16 HE2 PHE 16 -0.173 3.837 -1.669 91 HZ PHE 16 HZ PHE 16 -2.340 4.676 -2.483 92 H ASP 17 H ASP 17 3.733 8.706 -6.259 93 HA ASP 17 HA ASP 17 6.335 7.624 -6.474 94 1HB ASP 17 1HB ASP 17 4.993 8.899 -8.260 95 2HB ASP 17 2HB ASP 17 5.539 10.367 -7.457 96 H LYS 18 H LYS 18 5.108 10.639 -5.061 97 HA LYS 18 HA LYS 18 7.564 11.683 -4.219 98 1HB LYS 18 1HB LYS 18 4.745 12.079 -3.248 99 2HB LYS 18 2HB LYS 18 6.097 12.892 -2.478 100 1HG LYS 18 1HG LYS 18 5.503 13.122 -5.415 101 2HG LYS 18 2HG LYS 18 4.848 14.220 -4.200 102 1HD LYS 18 1HD LYS 18 6.739 15.346 -4.943 103 2HD LYS 18 2HD LYS 18 7.319 14.528 -3.493 104 1HE LYS 18 1HE LYS 18 8.158 12.692 -4.970 105 2HE LYS 18 2HE LYS 18 7.729 13.689 -6.360 106 1HZ LYS 18 1HZ LYS 18 9.771 14.225 -4.283 107 2HZ LYS 18 2HZ LYS 18 9.204 15.436 -5.329 108 3HZ LYS 18 3HZ LYS 18 9.992 14.073 -5.963 109 H VAL 19 H VAL 19 5.293 9.525 -2.519 110 HA VAL 19 HA VAL 19 6.733 9.697 -0.072 111 HB VAL 19 HB VAL 19 4.336 9.083 -0.154 112 1HG1 VAL 19 1HG1 VAL 19 4.354 7.583 -2.069 113 2HG1 VAL 19 2HG1 VAL 19 3.689 6.774 -0.650 114 3HG1 VAL 19 3HG1 VAL 19 5.336 6.427 -1.171 115 1HG2 VAL 19 1HG2 VAL 19 6.141 7.077 1.190 116 2HG2 VAL 19 2HG2 VAL 19 4.456 7.388 1.613 117 3HG2 VAL 19 3HG2 VAL 19 5.671 8.650 1.830 118 H ARG 20 H ARG 20 6.963 7.528 -2.845 119 HA ARG 20 HA ARG 20 8.700 5.705 -1.429 120 1HB ARG 20 1HB ARG 20 8.936 4.531 -3.561 121 2HB ARG 20 2HB ARG 20 7.247 4.853 -3.209 122 1HG ARG 20 1HG ARG 20 7.348 5.370 -5.439 123 2HG ARG 20 2HG ARG 20 7.631 6.953 -4.716 124 1HD ARG 20 1HD ARG 20 10.108 6.450 -4.923 125 2HD ARG 20 2HD ARG 20 9.650 5.069 -5.921 126 HE ARG 20 HE ARG 20 8.677 7.725 -6.687 127 1HH1 ARG 20 1HH1 ARG 20 10.802 5.016 -7.311 128 2HH1 ARG 20 2HH1 ARG 20 11.220 5.542 -8.906 129 1HH2 ARG 20 1HH2 ARG 20 9.206 8.428 -8.781 130 2HH2 ARG 20 2HH2 ARG 20 10.298 7.487 -9.755 131 H ASN 21 H ASN 21 9.066 8.634 -3.114 132 HA ASN 21 HA ASN 21 11.889 8.183 -3.718 133 1HB ASN 21 1HB ASN 21 10.541 9.296 -5.428 134 2HB ASN 21 2HB ASN 21 10.073 10.537 -4.270 135 1HD2 ASN 21 1HD2 ASN 21 11.432 12.206 -3.834 136 2HD2 ASN 21 2HD2 ASN 21 12.935 12.458 -4.672 137 H ASP 22 H ASP 22 9.844 10.394 -1.873 138 HA ASP 22 HA ASP 22 12.190 11.694 -0.771 139 1HB ASP 22 1HB ASP 22 9.245 12.318 -0.708 140 2HB ASP 22 2HB ASP 22 10.419 13.224 0.241 141 H LEU 23 H LEU 23 9.572 9.627 0.186 142 HA LEU 23 HA LEU 23 9.208 8.323 1.978 143 1HB LEU 23 1HB LEU 23 12.056 9.037 2.626 144 2HB LEU 23 2HB LEU 23 11.110 7.904 3.568 145 HG LEU 23 HG LEU 23 11.937 7.598 0.681 146 1HD1 LEU 23 1HD1 LEU 23 13.159 5.657 1.507 147 2HD1 LEU 23 2HD1 LEU 23 12.631 6.014 3.150 148 3HD1 LEU 23 3HD1 LEU 23 13.703 7.133 2.304 149 1HD2 LEU 23 1HD2 LEU 23 9.665 6.743 1.047 150 2HD2 LEU 23 2HD2 LEU 23 10.268 5.745 2.372 151 3HD2 LEU 23 3HD2 LEU 23 10.820 5.451 0.722 152 H ASN 24 H ASN 24 9.213 11.543 2.203 153 HA ASN 24 HA ASN 24 8.928 11.710 5.065 154 1HB ASN 24 1HB ASN 24 7.703 13.966 4.336 155 2HB ASN 24 2HB ASN 24 9.449 13.824 4.422 156 1HD2 ASN 24 1HD2 ASN 24 6.686 14.083 2.305 157 2HD2 ASN 24 2HD2 ASN 24 7.592 14.460 0.878 158 H TYR 25 H TYR 25 7.506 10.105 5.537 159 HA TYR 25 HA TYR 25 5.076 9.603 4.266 160 1HB TYR 25 1HB TYR 25 5.937 8.979 7.093 161 2HB TYR 25 2HB TYR 25 4.512 8.304 6.313 162 HD1 TYR 25 HD1 TYR 25 8.088 8.041 6.723 163 HD2 TYR 25 HD2 TYR 25 4.808 6.837 4.297 164 HE1 TYR 25 HE1 TYR 25 9.454 6.220 5.788 165 HE2 TYR 25 HE2 TYR 25 6.162 5.015 3.358 166 HH TYR 25 HH TYR 25 9.149 4.063 4.694 167 H GLN 26 H GLN 26 5.898 11.953 6.671 168 HA GLN 26 HA GLN 26 3.430 12.479 7.845 169 1HB GLN 26 1HB GLN 26 5.536 14.518 7.110 170 2HB GLN 26 2HB GLN 26 4.313 14.684 8.359 171 1HG GLN 26 1HG GLN 26 6.346 12.486 8.455 172 2HG GLN 26 2HG GLN 26 6.719 14.102 9.040 173 1HE2 GLN 26 1HE2 GLN 26 3.524 12.682 9.354 174 2HE2 GLN 26 2HE2 GLN 26 3.587 12.494 11.069 175 H TRP 27 H TRP 27 4.688 13.335 4.711 176 HA TRP 27 HA TRP 27 2.640 15.240 4.078 177 1HB TRP 27 1HB TRP 27 3.989 15.712 2.325 178 2HB TRP 27 2HB TRP 27 5.126 14.559 3.013 179 HD1 TRP 27 HD1 TRP 27 5.226 12.098 1.848 180 HE1 TRP 27 HE1 TRP 27 4.421 11.284 -0.458 181 HE3 TRP 27 HE3 TRP 27 2.320 16.048 0.526 182 HZ2 TRP 27 HZ2 TRP 27 2.834 12.186 -2.571 183 HZ3 TRP 27 HZ3 TRP 27 1.185 15.981 -1.639 184 HH2 TRP 27 HH2 TRP 27 1.441 14.113 -3.174 185 H PHE 28 H PHE 28 3.165 11.815 3.619 186 HA PHE 28 HA PHE 28 1.281 11.592 1.460 187 1HB PHE 28 1HB PHE 28 3.237 10.188 1.448 188 2HB PHE 28 2HB PHE 28 2.889 9.577 3.058 189 HD1 PHE 28 HD1 PHE 28 1.519 9.635 -0.396 190 HD2 PHE 28 HD2 PHE 28 1.783 7.570 3.313 191 HE1 PHE 28 HE1 PHE 28 0.379 7.697 -1.394 192 HE2 PHE 28 HE2 PHE 28 0.638 5.632 2.322 193 HZ PHE 28 HZ PHE 28 -0.063 5.691 -0.037 194 H TYR 29 H TYR 29 1.338 10.780 4.918 195 HA TYR 29 HA TYR 29 -1.201 9.487 4.890 196 1HB TYR 29 1HB TYR 29 0.443 10.655 7.138 197 2HB TYR 29 2HB TYR 29 -1.113 9.867 7.399 198 HD1 TYR 29 HD1 TYR 29 2.360 9.359 7.262 199 HD2 TYR 29 HD2 TYR 29 -1.331 7.480 6.311 200 HE1 TYR 29 HE1 TYR 29 3.476 7.169 7.272 201 HE2 TYR 29 HE2 TYR 29 -0.228 5.285 6.324 202 HH TYR 29 HH TYR 29 2.918 4.814 7.549 203 H SER 30 H SER 30 -0.157 12.765 4.986 204 HA SER 30 HA SER 30 -2.652 13.881 5.796 205 1HB SER 30 1HB SER 30 -0.383 15.123 4.214 206 2HB SER 30 2HB SER 30 -1.709 16.005 4.972 207 HG SER 30 HG SER 30 0.536 14.814 6.119 208 H GLU 31 H GLU 31 -1.136 13.066 2.701 209 HA GLU 31 HA GLU 31 -3.174 13.977 0.984 210 1HB GLU 31 1HB GLU 31 -1.205 11.693 0.759 211 2HB GLU 31 2HB GLU 31 -2.357 12.053 -0.516 212 1HG GLU 31 1HG GLU 31 -0.099 13.779 0.471 213 2HG GLU 31 2HG GLU 31 -0.299 13.038 -1.115 214 H LEU 32 H LEU 32 -2.709 10.887 2.623 215 HA LEU 32 HA LEU 32 -4.821 9.503 1.450 216 1HB LEU 32 1HB LEU 32 -3.630 9.157 4.195 217 2HB LEU 32 2HB LEU 32 -4.651 7.986 3.383 218 HG LEU 32 HG LEU 32 -1.928 8.892 2.446 219 1HD1 LEU 32 1HD1 LEU 32 -2.837 6.282 3.641 220 2HD1 LEU 32 2HD1 LEU 32 -1.820 7.489 4.427 221 3HD1 LEU 32 3HD1 LEU 32 -1.228 6.628 3.007 222 1HD2 LEU 32 1HD2 LEU 32 -2.153 7.098 0.785 223 2HD2 LEU 32 2HD2 LEU 32 -3.374 8.353 0.574 224 3HD2 LEU 32 3HD2 LEU 32 -3.809 6.821 1.326 225 H LYS 33 H LYS 33 -4.788 11.327 4.518 226 HA LYS 33 HA LYS 33 -7.534 10.755 5.050 227 1HB LYS 33 1HB LYS 33 -5.725 12.888 6.200 228 2HB LYS 33 2HB LYS 33 -7.322 12.484 6.817 229 1HG LYS 33 1HG LYS 33 -6.556 10.231 7.358 230 2HG LYS 33 2HG LYS 33 -4.958 10.617 6.713 231 1HD LYS 33 1HD LYS 33 -4.930 10.807 9.123 232 2HD LYS 33 2HD LYS 33 -4.746 12.408 8.405 233 1HE LYS 33 1HE LYS 33 -6.277 12.631 10.202 234 2HE LYS 33 2HE LYS 33 -7.220 12.714 8.716 235 1HZ LYS 33 1HZ LYS 33 -8.312 11.328 10.342 236 2HZ LYS 33 2HZ LYS 33 -6.937 10.342 10.485 237 3HZ LYS 33 3HZ LYS 33 -7.810 10.371 9.034 238 H ARG 34 H ARG 34 -5.945 13.060 3.085 239 HA ARG 34 HA ARG 34 -8.194 14.909 3.123 240 1HB ARG 34 1HB ARG 34 -6.238 16.120 3.226 241 2HB ARG 34 2HB ARG 34 -5.370 15.017 2.171 242 1HG ARG 34 1HG ARG 34 -6.150 16.020 0.260 243 2HG ARG 34 2HG ARG 34 -7.575 16.671 1.055 244 1HD ARG 34 1HD ARG 34 -5.773 18.339 0.434 245 2HD ARG 34 2HD ARG 34 -6.341 18.385 2.101 246 HE ARG 34 HE ARG 34 -4.247 17.790 2.797 247 1HH1 ARG 34 1HH1 ARG 34 -4.498 17.203 -0.639 248 2HH1 ARG 34 2HH1 ARG 34 -2.838 16.716 -0.808 249 1HH2 ARG 34 1HH2 ARG 34 -2.038 17.238 2.554 250 2HH2 ARG 34 2HH2 ARG 34 -1.446 16.748 0.986 251 H HIS 35 H HIS 35 -6.829 12.450 1.064 252 HA HIS 35 HA HIS 35 -8.754 13.220 -1.026 253 1HB HIS 35 1HB HIS 35 -5.991 12.070 -1.253 254 2HB HIS 35 2HB HIS 35 -7.166 11.823 -2.541 255 HD1 HIS 35 HD1 HIS 35 -4.469 13.957 -1.841 256 HD2 HIS 35 HD2 HIS 35 -8.373 14.614 -3.154 257 HE1 HIS 35 HE1 HIS 35 -4.442 16.197 -2.979 258 HE2 HIS 35 HE2 HIS 35 -6.832 16.634 -3.663 259 H ASN 36 H ASN 36 -7.158 10.410 0.461 260 HA ASN 36 HA ASN 36 -9.119 8.606 -0.671 261 1HB ASN 36 1HB ASN 36 -6.788 7.860 -0.380 262 2HB ASN 36 2HB ASN 36 -6.928 8.094 1.358 263 1HD2 ASN 36 1HD2 ASN 36 -6.594 6.005 1.942 264 2HD2 ASN 36 2HD2 ASN 36 -7.698 4.728 1.589 265 H VAL 37 H VAL 37 -10.964 9.642 0.251 266 HA VAL 37 HA VAL 37 -11.332 9.813 3.063 267 HB VAL 37 HB VAL 37 -13.436 9.800 0.895 268 1HG1 VAL 37 1HG1 VAL 37 -14.385 9.398 3.101 269 2HG1 VAL 37 2HG1 VAL 37 -14.814 11.007 2.523 270 3HG1 VAL 37 3HG1 VAL 37 -13.549 10.815 3.735 271 1HG2 VAL 37 1HG2 VAL 37 -11.979 12.110 2.172 272 2HG2 VAL 37 2HG2 VAL 37 -13.311 12.241 1.021 273 3HG2 VAL 37 3HG2 VAL 37 -11.774 11.538 0.516 274 H SER 38 H SER 38 -11.984 7.321 0.681 275 HA SER 38 HA SER 38 -13.505 5.801 2.660 276 1HB SER 38 1HB SER 38 -14.409 6.097 0.333 277 2HB SER 38 2HB SER 38 -13.061 5.124 -0.256 278 HG SER 38 HG SER 38 -15.341 4.227 0.504 279 H HIS 39 H HIS 39 -11.423 4.493 0.097 280 HA HIS 39 HA HIS 39 -9.300 3.652 1.734 281 1HB HIS 39 1HB HIS 39 -9.772 1.248 1.936 282 2HB HIS 39 2HB HIS 39 -10.975 2.201 2.797 283 HD1 HIS 39 HD1 HIS 39 -13.394 2.228 1.806 284 HD2 HIS 39 HD2 HIS 39 -10.747 -0.318 -0.144 285 HE1 HIS 39 HE1 HIS 39 -14.819 0.726 0.389 286 HE2 HIS 39 HE2 HIS 39 -13.218 -0.954 -0.583 287 H TYR 40 H TYR 40 -7.651 2.747 0.512 288 HA TYR 40 HA TYR 40 -8.322 2.311 -2.317 289 1HB TYR 40 1HB TYR 40 -6.144 3.073 -2.956 290 2HB TYR 40 2HB TYR 40 -6.840 4.278 -1.889 291 HD1 TYR 40 HD1 TYR 40 -4.264 1.658 -2.194 292 HD2 TYR 40 HD2 TYR 40 -5.816 4.798 0.225 293 HE1 TYR 40 HE1 TYR 40 -2.211 1.622 -0.842 294 HE2 TYR 40 HE2 TYR 40 -3.769 4.768 1.589 295 HH TYR 40 HH TYR 40 -0.949 3.102 0.636 296 H ILE 41 H ILE 41 -7.517 0.544 -3.362 297 HA ILE 41 HA ILE 41 -6.299 -1.503 -1.627 298 HB ILE 41 HB ILE 41 -7.906 -1.987 -4.147 299 1HG1 ILE 41 1HG1 ILE 41 -9.480 -3.088 -2.367 300 2HG1 ILE 41 2HG1 ILE 41 -8.683 -1.990 -1.247 301 1HG2 ILE 41 1HG2 ILE 41 -7.855 -4.334 -3.438 302 2HG2 ILE 41 2HG2 ILE 41 -6.830 -3.894 -2.072 303 3HG2 ILE 41 3HG2 ILE 41 -6.236 -3.698 -3.721 304 1HD1 ILE 41 1HD1 ILE 41 -10.778 -1.069 -2.061 305 2HD1 ILE 41 2HD1 ILE 41 -10.197 -1.191 -3.721 306 3HD1 ILE 41 3HD1 ILE 41 -9.410 -0.091 -2.591 307 H TYR 42 H TYR 42 -4.224 -1.749 -2.011 308 HA TYR 42 HA TYR 42 -3.105 -1.033 -4.613 309 1HB TYR 42 1HB TYR 42 -2.185 -0.395 -2.227 310 2HB TYR 42 2HB TYR 42 -1.483 -2.006 -2.284 311 HD1 TYR 42 HD1 TYR 42 -0.267 -2.472 -4.683 312 HD2 TYR 42 HD2 TYR 42 -0.805 1.316 -2.832 313 HE1 TYR 42 HE1 TYR 42 1.624 -1.580 -5.969 314 HE2 TYR 42 HE2 TYR 42 1.085 2.219 -4.117 315 HH TYR 42 HH TYR 42 2.398 0.643 -6.782 316 H TYR 43 H TYR 43 -2.352 -2.498 -6.029 317 HA TYR 43 HA TYR 43 -2.480 -5.333 -5.247 318 1HB TYR 43 1HB TYR 43 -2.781 -4.061 -7.980 319 2HB TYR 43 2HB TYR 43 -2.757 -5.798 -7.681 320 HD1 TYR 43 HD1 TYR 43 -4.723 -2.739 -7.460 321 HD2 TYR 43 HD2 TYR 43 -4.619 -6.879 -6.508 322 HE1 TYR 43 HE1 TYR 43 -7.144 -2.692 -7.033 323 HE2 TYR 43 HE2 TYR 43 -7.041 -6.849 -6.085 324 HH TYR 43 HH TYR 43 -9.045 -4.194 -6.950 325 H LEU 44 H LEU 44 -0.513 -5.863 -4.618 326 HA LEU 44 HA LEU 44 1.842 -4.539 -5.497 327 1HB LEU 44 1HB LEU 44 1.555 -7.110 -3.948 328 2HB LEU 44 2HB LEU 44 3.011 -6.140 -4.074 329 HG LEU 44 HG LEU 44 0.440 -5.180 -2.811 330 1HD1 LEU 44 1HD1 LEU 44 1.382 -7.016 -1.528 331 2HD1 LEU 44 2HD1 LEU 44 1.597 -5.486 -0.678 332 3HD1 LEU 44 3HD1 LEU 44 2.958 -6.224 -1.526 333 1HD2 LEU 44 1HD2 LEU 44 1.851 -3.398 -1.923 334 2HD2 LEU 44 2HD2 LEU 44 1.850 -3.396 -3.686 335 3HD2 LEU 44 3HD2 LEU 44 3.233 -4.047 -2.808 336 H ALA 45 H ALA 45 0.070 -6.963 -6.957 337 HA ALA 45 HA ALA 45 2.287 -8.464 -8.038 338 1HB ALA 45 1HB ALA 45 0.618 -9.720 -9.260 339 2HB ALA 45 2HB ALA 45 -0.628 -8.558 -8.795 340 3HB ALA 45 3HB ALA 45 0.148 -9.560 -7.566 341 H THR 46 H THR 46 0.883 -5.522 -8.778 342 HA THR 46 HA THR 46 2.247 -5.517 -11.369 343 HB THR 46 HB THR 46 0.270 -4.010 -12.171 344 HG1 THR 46 HG1 THR 46 -1.665 -5.290 -11.072 345 1HG2 THR 46 1HG2 THR 46 -0.038 -7.006 -11.933 346 2HG2 THR 46 2HG2 THR 46 0.836 -6.150 -13.202 347 3HG2 THR 46 3HG2 THR 46 -0.913 -5.974 -13.064 348 H GLU 47 H GLU 47 1.935 -4.171 -8.406 349 HA GLU 47 HA GLU 47 2.429 -2.208 -7.402 350 1HB GLU 47 1HB GLU 47 3.659 -1.587 -10.091 351 2HB GLU 47 2HB GLU 47 3.729 -0.482 -8.728 352 1HG GLU 47 1HG GLU 47 4.739 -3.296 -8.535 353 2HG GLU 47 2HG GLU 47 5.740 -1.981 -9.147 354 H ASN 48 H ASN 48 -0.009 -2.697 -9.156 355 HA ASN 48 HA ASN 48 -0.835 -0.015 -9.906 356 1HB ASN 48 1HB ASN 48 -2.048 -2.751 -10.202 357 2HB ASN 48 2HB ASN 48 -3.022 -1.306 -10.457 358 1HD2 ASN 48 1HD2 ASN 48 -3.330 -1.857 -12.613 359 2HD2 ASN 48 2HD2 ASN 48 -2.086 -1.669 -13.796 360 H VAL 49 H VAL 49 -2.808 0.947 -9.102 361 HA VAL 49 HA VAL 49 -3.583 0.024 -6.413 362 HB VAL 49 HB VAL 49 -3.382 2.959 -6.948 363 1HG1 VAL 49 1HG1 VAL 49 -3.107 1.280 -4.461 364 2HG1 VAL 49 2HG1 VAL 49 -4.527 2.201 -4.951 365 3HG1 VAL 49 3HG1 VAL 49 -3.037 3.042 -4.521 366 1HG2 VAL 49 1HG2 VAL 49 -1.107 3.032 -6.056 367 2HG2 VAL 49 2HG2 VAL 49 -1.175 2.121 -7.566 368 3HG2 VAL 49 3HG2 VAL 49 -1.058 1.270 -6.026 369 H HIS 50 H HIS 50 -5.738 0.253 -5.937 370 HA HIS 50 HA HIS 50 -7.379 1.812 -7.833 371 1HB HIS 50 1HB HIS 50 -7.973 -0.794 -6.449 372 2HB HIS 50 2HB HIS 50 -9.278 0.263 -6.971 373 HD1 HIS 50 HD1 HIS 50 -10.237 -0.870 -8.958 374 HD2 HIS 50 HD2 HIS 50 -6.075 -0.813 -9.054 375 HE1 HIS 50 HE1 HIS 50 -9.594 -1.844 -11.187 376 HE2 HIS 50 HE2 HIS 50 -7.070 -1.809 -11.228 377 H ILE 51 H ILE 51 -7.598 3.706 -6.803 378 HA ILE 51 HA ILE 51 -8.019 3.749 -3.907 379 HB ILE 51 HB ILE 51 -7.650 6.076 -5.809 380 1HG1 ILE 51 1HG1 ILE 51 -5.417 6.201 -4.435 381 2HG1 ILE 51 2HG1 ILE 51 -5.713 4.488 -4.163 382 1HG2 ILE 51 1HG2 ILE 51 -7.237 7.380 -3.751 383 2HG2 ILE 51 2HG2 ILE 51 -7.690 5.966 -2.801 384 3HG2 ILE 51 3HG2 ILE 51 -8.878 6.740 -3.847 385 1HD1 ILE 51 1HD1 ILE 51 -4.230 4.827 -6.043 386 2HD1 ILE 51 2HD1 ILE 51 -5.438 5.835 -6.837 387 3HD1 ILE 51 3HD1 ILE 51 -5.754 4.119 -6.579 388 H VAL 52 H VAL 52 -10.088 3.495 -3.299 389 HA VAL 52 HA VAL 52 -12.213 4.620 -4.942 390 HB VAL 52 HB VAL 52 -12.542 3.171 -2.313 391 1HG1 VAL 52 1HG1 VAL 52 -14.810 2.724 -3.205 392 2HG1 VAL 52 2HG1 VAL 52 -14.435 3.749 -4.594 393 3HG1 VAL 52 3HG1 VAL 52 -14.482 4.441 -2.970 394 1HG2 VAL 52 1HG2 VAL 52 -11.351 1.705 -3.843 395 2HG2 VAL 52 2HG2 VAL 52 -12.553 2.010 -5.099 396 3HG2 VAL 52 3HG2 VAL 52 -13.012 1.154 -3.626 397 H LEU 53 H LEU 53 -12.625 6.678 -4.702 398 HA LEU 53 HA LEU 53 -11.882 8.193 -2.414 399 1HB LEU 53 1HB LEU 53 -13.748 8.946 -4.665 400 2HB LEU 53 2HB LEU 53 -12.995 10.053 -3.535 401 HG LEU 53 HG LEU 53 -11.533 8.370 -5.572 402 1HD1 LEU 53 1HD1 LEU 53 -12.079 11.333 -5.486 403 2HD1 LEU 53 2HD1 LEU 53 -12.805 10.174 -6.600 404 3HD1 LEU 53 3HD1 LEU 53 -11.074 10.501 -6.674 405 1HD2 LEU 53 1HD2 LEU 53 -10.213 8.741 -3.554 406 2HD2 LEU 53 2HD2 LEU 53 -10.517 10.476 -3.668 407 3HD2 LEU 53 3HD2 LEU 53 -9.569 9.660 -4.915 408 H LYS 54 H LYS 54 -13.788 9.826 -1.675 409 HA LYS 54 HA LYS 54 -15.250 8.641 0.261 410 1HB LYS 54 1HB LYS 54 -16.891 10.641 -0.096 411 2HB LYS 54 2HB LYS 54 -15.230 10.948 0.384 412 1HG LYS 54 1HG LYS 54 -14.710 11.317 -2.054 413 2HG LYS 54 2HG LYS 54 -16.448 11.262 -2.349 414 1HD LYS 54 1HD LYS 54 -16.809 13.169 -0.935 415 2HD LYS 54 2HD LYS 54 -15.123 13.160 -0.417 416 1HE LYS 54 1HE LYS 54 -15.358 14.892 -2.030 417 2HE LYS 54 2HE LYS 54 -14.482 13.574 -2.804 418 1HZ LYS 54 1HZ LYS 54 -16.094 14.361 -4.327 419 2HZ LYS 54 2HZ LYS 54 -17.333 14.307 -3.171 420 3HZ LYS 54 3HZ LYS 54 -16.666 12.868 -3.758 421 H ASN 55 H ASN 55 -16.735 9.563 -2.845 422 HA ASN 55 HA ASN 55 -17.901 7.003 -3.240 423 1HB ASN 55 1HB ASN 55 -19.421 8.176 -1.478 424 2HB ASN 55 2HB ASN 55 -19.937 9.191 -2.822 425 1HD2 ASN 55 1HD2 ASN 55 -21.120 8.249 -4.521 426 2HD2 ASN 55 2HD2 ASN 55 -21.891 6.705 -4.351 427 H ASP 56 H ASP 56 -16.181 8.686 -4.579 428 HA ASP 56 HA ASP 56 -17.778 10.053 -6.618 429 1HB ASP 56 1HB ASP 56 -16.090 11.356 -5.267 430 2HB ASP 56 2HB ASP 56 -14.832 10.398 -6.040 431 H ASN 57 H ASN 57 -14.541 8.596 -6.567 432 HA ASN 57 HA ASN 57 -15.203 7.002 -8.919 433 1HB ASN 57 1HB ASN 57 -14.396 9.173 -9.785 434 2HB ASN 57 2HB ASN 57 -12.935 9.017 -8.821 435 1HD2 ASN 57 1HD2 ASN 57 -11.564 9.097 -10.562 436 2HD2 ASN 57 2HD2 ASN 57 -11.441 7.810 -11.708 437 H THR 58 H THR 58 -13.671 5.341 -9.354 438 HA THR 58 HA THR 58 -11.862 4.739 -7.113 439 HB THR 58 HB THR 58 -12.869 2.825 -9.231 440 HG1 THR 58 HG1 THR 58 -14.243 3.878 -7.274 441 1HG2 THR 58 1HG2 THR 58 -12.090 1.102 -7.656 442 2HG2 THR 58 2HG2 THR 58 -11.479 2.363 -6.585 443 3HG2 THR 58 3HG2 THR 58 -10.769 2.146 -8.185 444 H VAL 59 H VAL 59 -10.048 5.815 -7.691 445 HA VAL 59 HA VAL 59 -9.174 6.057 -10.404 446 HB VAL 59 HB VAL 59 -7.589 6.647 -7.902 447 1HG1 VAL 59 1HG1 VAL 59 -6.360 8.201 -9.302 448 2HG1 VAL 59 2HG1 VAL 59 -7.367 7.780 -10.686 449 3HG1 VAL 59 3HG1 VAL 59 -6.288 6.576 -9.985 450 1HG2 VAL 59 1HG2 VAL 59 -9.474 8.446 -9.420 451 2HG2 VAL 59 2HG2 VAL 59 -8.408 8.953 -8.111 452 3HG2 VAL 59 3HG2 VAL 59 -9.716 7.815 -7.792 453 H LEU 60 H LEU 60 -8.197 4.503 -11.510 454 HA LEU 60 HA LEU 60 -6.692 2.473 -10.041 455 1HB LEU 60 1HB LEU 60 -6.784 1.128 -12.087 456 2HB LEU 60 2HB LEU 60 -8.375 1.555 -11.495 457 HG LEU 60 HG LEU 60 -7.083 3.132 -13.707 458 1HD1 LEU 60 1HD1 LEU 60 -6.990 0.819 -14.415 459 2HD1 LEU 60 2HD1 LEU 60 -8.253 1.673 -15.304 460 3HD1 LEU 60 3HD1 LEU 60 -8.684 0.590 -13.979 461 1HD2 LEU 60 1HD2 LEU 60 -9.954 2.576 -12.951 462 2HD2 LEU 60 2HD2 LEU 60 -9.423 3.556 -14.319 463 3HD2 LEU 60 3HD2 LEU 60 -9.076 4.081 -12.671 464 H LEU 61 H LEU 61 -4.672 2.921 -9.769 465 HA LEU 61 HA LEU 61 -3.170 4.443 -11.761 466 1HB LEU 61 1HB LEU 61 -2.219 3.382 -9.098 467 2HB LEU 61 2HB LEU 61 -1.427 4.581 -10.099 468 HG LEU 61 HG LEU 61 -4.024 4.959 -8.607 469 1HD1 LEU 61 1HD1 LEU 61 -2.063 4.883 -7.158 470 2HD1 LEU 61 2HD1 LEU 61 -2.726 6.516 -7.245 471 3HD1 LEU 61 3HD1 LEU 61 -1.272 6.104 -8.152 472 1HD2 LEU 61 1HD2 LEU 61 -3.843 7.296 -9.311 473 2HD2 LEU 61 2HD2 LEU 61 -4.011 6.215 -10.694 474 3HD2 LEU 61 3HD2 LEU 61 -2.432 6.892 -10.290 475 H LYS 62 H LYS 62 -1.749 3.487 -13.130 476 HA LYS 62 HA LYS 62 -1.111 0.666 -12.677 477 1HB LYS 62 1HB LYS 62 -1.978 1.276 -14.910 478 2HB LYS 62 2HB LYS 62 -0.620 2.371 -15.127 479 1HG LYS 62 1HG LYS 62 0.911 0.638 -15.347 480 2HG LYS 62 2HG LYS 62 -0.157 -0.530 -14.567 481 1HD LYS 62 1HD LYS 62 -0.007 -0.912 -16.983 482 2HD LYS 62 2HD LYS 62 -1.646 -0.485 -16.492 483 1HE LYS 62 1HE LYS 62 -1.170 1.858 -17.180 484 2HE LYS 62 2HE LYS 62 0.389 1.313 -17.802 485 1HZ LYS 62 1HZ LYS 62 -2.271 0.351 -18.718 486 2HZ LYS 62 2HZ LYS 62 -0.770 -0.165 -19.320 487 3HZ LYS 62 3HZ LYS 62 -1.268 1.441 -19.552 488 H GLY 63 H GLY 63 0.692 0.214 -11.658 489 1HA GLY 63 1HA GLY 63 2.515 2.325 -10.976 490 2HA GLY 63 2HA GLY 63 2.604 0.651 -10.447 491 H LEU 64 H LEU 64 3.398 -0.922 -12.081 492 HA LEU 64 HA LEU 64 5.558 0.339 -13.640 493 1HB LEU 64 1HB LEU 64 6.062 -1.198 -11.623 494 2HB LEU 64 2HB LEU 64 5.549 -2.509 -12.662 495 HG LEU 64 HG LEU 64 8.036 -2.155 -12.511 496 1HD1 LEU 64 1HD1 LEU 64 7.045 -3.401 -14.362 497 2HD1 LEU 64 2HD1 LEU 64 8.458 -2.484 -14.880 498 3HD1 LEU 64 3HD1 LEU 64 6.839 -1.897 -15.261 499 1HD2 LEU 64 1HD2 LEU 64 7.400 0.311 -14.120 500 2HD2 LEU 64 2HD2 LEU 64 9.012 -0.335 -13.814 501 3HD2 LEU 64 3HD2 LEU 64 8.040 0.280 -12.476 502 H LYS 65 H LYS 65 4.098 -2.885 -13.662 503 HA LYS 65 HA LYS 65 2.652 -2.682 -16.039 504 1HB LYS 65 1HB LYS 65 4.945 -2.352 -17.021 505 2HB LYS 65 2HB LYS 65 5.368 -3.960 -16.444 506 1HG LYS 65 1HG LYS 65 3.557 -4.898 -17.830 507 2HG LYS 65 2HG LYS 65 3.241 -3.282 -18.463 508 1HD LYS 65 1HD LYS 65 5.858 -4.764 -18.696 509 2HD LYS 65 2HD LYS 65 4.648 -4.635 -19.973 510 1HE LYS 65 1HE LYS 65 4.936 -2.229 -20.042 511 2HE LYS 65 2HE LYS 65 6.059 -2.300 -18.684 512 1HZ LYS 65 1HZ LYS 65 7.162 -2.123 -20.874 513 2HZ LYS 65 2HZ LYS 65 6.524 -3.633 -21.300 514 3HZ LYS 65 3HZ LYS 65 7.618 -3.506 -20.010 515 H ASN 66 H ASN 66 5.011 -5.044 -14.813 516 HA ASN 66 HA ASN 66 2.761 -6.718 -13.949 517 1HB ASN 66 1HB ASN 66 5.311 -7.733 -15.225 518 2HB ASN 66 2HB ASN 66 4.037 -8.739 -14.549 519 1HD2 ASN 66 1HD2 ASN 66 2.104 -8.974 -15.664 520 2HD2 ASN 66 2HD2 ASN 66 1.922 -8.492 -17.314 521 H ILE 67 H ILE 67 6.254 -7.198 -13.739 522 HA ILE 67 HA ILE 67 7.639 -7.581 -11.991 523 HB ILE 67 HB ILE 67 7.300 -5.052 -11.991 524 1HG1 ILE 67 1HG1 ILE 67 8.584 -4.773 -9.888 525 2HG1 ILE 67 2HG1 ILE 67 8.194 -6.435 -9.456 526 1HG2 ILE 67 1HG2 ILE 67 5.715 -5.671 -9.502 527 2HG2 ILE 67 2HG2 ILE 67 5.102 -4.922 -10.978 528 3HG2 ILE 67 3HG2 ILE 67 6.284 -4.070 -9.983 529 1HD1 ILE 67 1HD1 ILE 67 9.388 -7.223 -11.439 530 2HD1 ILE 67 2HD1 ILE 67 10.429 -6.284 -10.370 531 3HD1 ILE 67 3HD1 ILE 67 9.795 -5.557 -11.847 532 H VAL 68 H VAL 68 5.293 -9.170 -11.943 533 HA VAL 68 HA VAL 68 4.159 -9.328 -9.381 534 HB VAL 68 HB VAL 68 3.002 -10.353 -11.202 535 1HG1 VAL 68 1HG1 VAL 68 4.863 -10.920 -12.640 536 2HG1 VAL 68 2HG1 VAL 68 3.850 -12.340 -12.377 537 3HG1 VAL 68 3HG1 VAL 68 5.381 -12.176 -11.516 538 1HG2 VAL 68 1HG2 VAL 68 4.013 -12.499 -9.338 539 2HG2 VAL 68 2HG2 VAL 68 2.541 -12.581 -10.307 540 3HG2 VAL 68 3HG2 VAL 68 2.680 -11.388 -9.016 541 H SER 69 H SER 69 5.494 -9.414 -7.704 542 HA SER 69 HA SER 69 7.393 -11.654 -7.544 543 1HB SER 69 1HB SER 69 7.228 -9.175 -5.806 544 2HB SER 69 2HB SER 69 8.483 -10.413 -5.741 545 HG SER 69 HG SER 69 8.864 -9.825 -8.037 546 H VAL 70 H VAL 70 4.349 -11.248 -7.051 547 HA VAL 70 HA VAL 70 3.933 -11.794 -4.290 548 HB VAL 70 HB VAL 70 2.040 -12.265 -6.601 549 1HG1 VAL 70 1HG1 VAL 70 0.286 -12.149 -4.901 550 2HG1 VAL 70 2HG1 VAL 70 1.512 -11.980 -3.643 551 3HG1 VAL 70 3HG1 VAL 70 1.406 -13.473 -4.578 552 1HG2 VAL 70 1HG2 VAL 70 2.787 -9.938 -6.496 553 2HG2 VAL 70 2HG2 VAL 70 2.328 -9.865 -4.795 554 3HG2 VAL 70 3HG2 VAL 70 1.091 -10.088 -6.032 555 H LYS 71 H LYS 71 4.748 -13.552 -3.451 556 HA LYS 71 HA LYS 71 4.850 -16.044 -4.928 557 1HB LYS 71 1HB LYS 71 6.741 -15.321 -3.494 558 2HB LYS 71 2HB LYS 71 5.688 -15.402 -2.088 559 1HG LYS 71 1HG LYS 71 5.390 -17.819 -2.503 560 2HG LYS 71 2HG LYS 71 6.543 -17.698 -3.836 561 1HD LYS 71 1HD LYS 71 7.127 -16.995 -0.961 562 2HD LYS 71 2HD LYS 71 7.568 -18.515 -1.742 563 1HE LYS 71 1HE LYS 71 8.969 -17.300 -3.330 564 2HE LYS 71 2HE LYS 71 8.500 -15.770 -2.588 565 1HZ LYS 71 1HZ LYS 71 10.672 -16.552 -1.816 566 2HZ LYS 71 2HZ LYS 71 9.954 -17.965 -1.208 567 3HZ LYS 71 3HZ LYS 71 9.551 -16.456 -0.542 568 H PHE 72 H PHE 72 3.566 -17.815 -4.532 569 HA PHE 72 HA PHE 72 1.090 -17.407 -3.204 570 1HB PHE 72 1HB PHE 72 1.429 -18.957 -5.152 571 2HB PHE 72 2HB PHE 72 2.297 -20.045 -4.075 572 HD1 PHE 72 HD1 PHE 72 -0.987 -18.321 -4.421 573 HD2 PHE 72 HD2 PHE 72 1.145 -21.706 -2.974 574 HE1 PHE 72 HE1 PHE 72 -3.113 -19.378 -3.777 575 HE2 PHE 72 HE2 PHE 72 -0.976 -22.774 -2.332 576 HZ PHE 72 HZ PHE 72 -3.108 -21.609 -2.732 577 H SER 73 H SER 73 1.680 -16.782 -1.121 578 HA SER 73 HA SER 73 1.980 -19.000 0.712 579 1HB SER 73 1HB SER 73 3.971 -16.719 0.614 580 2HB SER 73 2HB SER 73 3.813 -17.833 1.973 581 HG SER 73 HG SER 73 4.058 -19.076 -0.466 582 H LYS 74 H LYS 74 1.741 -18.172 3.007 583 HA LYS 74 HA LYS 74 0.218 -15.666 3.126 584 1HB LYS 74 1HB LYS 74 -0.614 -18.164 4.612 585 2HB LYS 74 2HB LYS 74 -1.506 -16.656 4.467 586 1HG LYS 74 1HG LYS 74 -1.667 -17.128 1.997 587 2HG LYS 74 2HG LYS 74 -1.040 -18.737 2.354 588 1HD LYS 74 1HD LYS 74 -2.939 -18.973 4.005 589 2HD LYS 74 2HD LYS 74 -3.612 -17.499 3.302 590 1HE LYS 74 1HE LYS 74 -3.458 -18.646 1.062 591 2HE LYS 74 2HE LYS 74 -3.096 -20.131 1.941 592 1HZ LYS 74 1HZ LYS 74 -5.349 -20.280 1.695 593 2HZ LYS 74 2HZ LYS 74 -5.601 -18.607 1.802 594 3HZ LYS 74 3HZ LYS 74 -5.271 -19.507 3.207 595 H ASP 75 H ASP 75 2.738 -15.547 3.748 596 HA ASP 75 HA ASP 75 3.268 -16.541 6.430 597 1HB ASP 75 1HB ASP 75 4.927 -16.633 4.477 598 2HB ASP 75 2HB ASP 75 5.152 -14.905 4.738 599 H ARG 76 H ARG 76 2.804 -15.366 8.143 600 HA ARG 76 HA ARG 76 2.300 -12.519 7.873 601 1HB ARG 76 1HB ARG 76 1.810 -14.531 10.048 602 2HB ARG 76 2HB ARG 76 1.655 -12.806 10.353 603 1HG ARG 76 1HG ARG 76 -0.073 -12.605 8.711 604 2HG ARG 76 2HG ARG 76 0.164 -14.274 8.197 605 1HD ARG 76 1HD ARG 76 -0.549 -13.632 11.032 606 2HD ARG 76 2HD ARG 76 -1.794 -13.715 9.787 607 HE ARG 76 HE ARG 76 -0.612 -16.045 9.402 608 1HH1 ARG 76 1HH1 ARG 76 -1.408 -14.495 12.447 609 2HH1 ARG 76 2HH1 ARG 76 -1.719 -15.991 13.272 610 1HH2 ARG 76 1HH2 ARG 76 -1.073 -18.002 10.471 611 2HH2 ARG 76 2HH2 ARG 76 -1.591 -17.983 12.133 612 H HIS 77 H HIS 77 4.872 -14.534 8.836 613 HA HIS 77 HA HIS 77 5.939 -12.671 10.786 614 1HB HIS 77 1HB HIS 77 6.168 -15.198 10.961 615 2HB HIS 77 2HB HIS 77 7.342 -15.094 9.654 616 HD1 HIS 77 HD1 HIS 77 9.017 -16.106 11.486 617 HD2 HIS 77 HD2 HIS 77 7.689 -12.231 12.184 618 HE1 HIS 77 HE1 HIS 77 10.577 -15.156 13.211 619 HE2 HIS 77 HE2 HIS 77 9.617 -12.897 13.774 620 H LEU 78 H LEU 78 6.527 -13.651 7.449 621 HA LEU 78 HA LEU 78 8.821 -12.039 7.053 622 1HB LEU 78 1HB LEU 78 8.076 -13.811 5.485 623 2HB LEU 78 2HB LEU 78 6.711 -12.808 5.032 624 HG LEU 78 HG LEU 78 8.224 -11.126 4.099 625 1HD1 LEU 78 1HD1 LEU 78 10.120 -11.466 5.594 626 2HD1 LEU 78 2HD1 LEU 78 10.616 -11.574 3.906 627 3HD1 LEU 78 3HD1 LEU 78 10.424 -13.041 4.865 628 1HD2 LEU 78 1HD2 LEU 78 7.423 -12.907 2.644 629 2HD2 LEU 78 2HD2 LEU 78 8.797 -13.913 3.102 630 3HD2 LEU 78 3HD2 LEU 78 9.061 -12.422 2.200 631 H ILE 79 H ILE 79 5.365 -11.396 6.880 632 HA ILE 79 HA ILE 79 5.478 -8.739 5.960 633 HB ILE 79 HB ILE 79 3.493 -9.967 7.889 634 1HG1 ILE 79 1HG1 ILE 79 3.311 -9.609 4.891 635 2HG1 ILE 79 2HG1 ILE 79 3.673 -11.131 5.701 636 1HG2 ILE 79 1HG2 ILE 79 3.318 -7.458 6.222 637 2HG2 ILE 79 2HG2 ILE 79 3.404 -7.549 7.982 638 3HG2 ILE 79 3HG2 ILE 79 1.984 -8.164 7.135 639 1HD1 ILE 79 1HD1 ILE 79 1.128 -9.554 5.994 640 2HD1 ILE 79 2HD1 ILE 79 1.487 -11.102 6.759 641 3HD1 ILE 79 3HD1 ILE 79 1.342 -10.997 5.005 642 H GLU 80 H GLU 80 5.430 -10.075 9.247 643 HA GLU 80 HA GLU 80 5.663 -7.734 10.717 644 1HB GLU 80 1HB GLU 80 5.218 -9.904 11.732 645 2HB GLU 80 2HB GLU 80 6.817 -10.473 11.276 646 1HG GLU 80 1HG GLU 80 7.729 -8.594 12.720 647 2HG GLU 80 2HG GLU 80 6.086 -8.425 13.340 648 H THR 81 H THR 81 8.227 -9.829 9.436 649 HA THR 81 HA THR 81 10.424 -8.388 10.407 650 HB THR 81 HB THR 81 10.320 -10.012 7.855 651 HG1 THR 81 HG1 THR 81 9.571 -11.285 9.552 652 1HG2 THR 81 1HG2 THR 81 12.607 -9.378 9.730 653 2HG2 THR 81 2HG2 THR 81 12.377 -8.705 8.116 654 3HG2 THR 81 3HG2 THR 81 12.697 -10.428 8.316 655 H THR 82 H THR 82 8.712 -8.164 7.300 656 HA THR 82 HA THR 82 10.364 -6.184 6.158 657 HB THR 82 HB THR 82 7.437 -6.706 5.593 658 HG1 THR 82 HG1 THR 82 8.525 -8.604 5.221 659 1HG2 THR 82 1HG2 THR 82 8.209 -4.597 4.649 660 2HG2 THR 82 2HG2 THR 82 7.965 -5.788 3.370 661 3HG2 THR 82 3HG2 THR 82 9.596 -5.410 3.923 662 H SER 83 H SER 83 7.337 -5.962 8.007 663 HA SER 83 HA SER 83 7.039 -3.177 7.946 664 1HB SER 83 1HB SER 83 5.264 -4.658 8.742 665 2HB SER 83 2HB SER 83 6.264 -5.164 10.100 666 HG SER 83 HG SER 83 4.993 -2.688 9.639 667 H ASN 84 H ASN 84 8.650 -5.269 10.314 668 HA ASN 84 HA ASN 84 9.524 -3.275 12.066 669 1HB ASN 84 1HB ASN 84 9.541 -5.683 12.598 670 2HB ASN 84 2HB ASN 84 10.837 -5.929 11.432 671 1HD2 ASN 84 1HD2 ASN 84 12.295 -6.689 12.918 672 2HD2 ASN 84 2HD2 ASN 84 13.013 -5.678 14.135 673 H LYS 85 H LYS 85 11.115 -4.714 9.242 674 HA LYS 85 HA LYS 85 13.578 -3.416 9.536 675 1HB LYS 85 1HB LYS 85 13.153 -5.337 8.027 676 2HB LYS 85 2HB LYS 85 12.246 -4.272 6.965 677 1HG LYS 85 1HG LYS 85 14.269 -2.928 6.603 678 2HG LYS 85 2HG LYS 85 15.170 -4.033 7.641 679 1HD LYS 85 1HD LYS 85 14.713 -5.869 6.103 680 2HD LYS 85 2HD LYS 85 13.775 -4.785 5.072 681 1HE LYS 85 1HE LYS 85 15.792 -3.412 4.725 682 2HE LYS 85 2HE LYS 85 16.715 -4.555 5.702 683 1HZ LYS 85 1HZ LYS 85 16.334 -6.261 4.101 684 2HZ LYS 85 2HZ LYS 85 16.918 -4.900 3.274 685 3HZ LYS 85 3HZ LYS 85 15.265 -5.279 3.213 686 H LEU 86 H LEU 86 10.592 -2.371 7.953 687 HA LEU 86 HA LEU 86 11.738 -0.023 6.803 688 1HB LEU 86 1HB LEU 86 9.747 -0.917 5.825 689 2HB LEU 86 2HB LEU 86 8.884 -0.819 7.350 690 HG LEU 86 HG LEU 86 9.078 1.674 7.226 691 1HD1 LEU 86 1HD1 LEU 86 9.620 2.676 5.054 692 2HD1 LEU 86 2HD1 LEU 86 10.102 1.091 4.452 693 3HD1 LEU 86 3HD1 LEU 86 11.002 1.847 5.770 694 1HD2 LEU 86 1HD2 LEU 86 7.668 0.279 4.959 695 2HD2 LEU 86 2HD2 LEU 86 7.361 1.937 5.476 696 3HD2 LEU 86 3HD2 LEU 86 7.027 0.598 6.572 697 H LYS 87 H LYS 87 9.685 -0.568 9.661 698 HA LYS 87 HA LYS 87 9.603 2.222 10.269 699 1HB LYS 87 1HB LYS 87 8.337 1.558 12.238 700 2HB LYS 87 2HB LYS 87 7.741 0.747 10.802 701 1HG LYS 87 1HG LYS 87 9.321 -1.175 11.591 702 2HG LYS 87 2HG LYS 87 9.168 -0.371 13.156 703 1HD LYS 87 1HD LYS 87 6.957 -1.496 11.443 704 2HD LYS 87 2HD LYS 87 7.473 -2.057 13.033 705 1HE LYS 87 1HE LYS 87 6.727 0.046 14.019 706 2HE LYS 87 2HE LYS 87 6.237 0.626 12.429 707 1HZ LYS 87 1HZ LYS 87 5.069 -1.647 13.938 708 2HZ LYS 87 2HZ LYS 87 4.663 -1.274 12.333 709 3HZ LYS 87 3HZ LYS 87 4.325 -0.169 13.571 710 H SER 88 H SER 88 11.708 -0.366 11.158 711 HA SER 88 HA SER 88 12.874 1.248 13.299 712 1HB SER 88 1HB SER 88 13.548 -1.575 12.458 713 2HB SER 88 2HB SER 88 14.137 -0.747 13.898 714 HG SER 88 HG SER 88 12.006 -2.207 13.746 715 H ARG 89 H ARG 89 13.862 -0.305 10.229 716 HA ARG 89 HA ARG 89 16.483 0.975 10.527 717 1HB ARG 89 1HB ARG 89 15.557 -1.320 8.817 718 2HB ARG 89 2HB ARG 89 17.116 -0.543 8.584 719 1HG ARG 89 1HG ARG 89 17.636 -1.073 10.976 720 2HG ARG 89 2HG ARG 89 16.150 -2.027 11.014 721 1HD ARG 89 1HD ARG 89 16.966 -3.487 9.305 722 2HD ARG 89 2HD ARG 89 18.368 -2.458 9.021 723 HE ARG 89 HE ARG 89 17.930 -4.151 11.395 724 1HH1 ARG 89 1HH1 ARG 89 20.033 -2.188 9.388 725 2HH1 ARG 89 2HH1 ARG 89 21.495 -2.795 10.108 726 1HH2 ARG 89 1HH2 ARG 89 19.839 -4.910 12.371 727 2HH2 ARG 89 2HH2 ARG 89 21.391 -4.332 11.822 728 H GLU 90 H GLU 90 13.660 1.788 9.144 729 HA GLU 90 HA GLU 90 13.137 3.592 7.874 730 1HB GLU 90 1HB GLU 90 16.117 3.865 7.461 731 2HB GLU 90 2HB GLU 90 14.916 5.048 6.962 732 1HG GLU 90 1HG GLU 90 14.335 5.537 9.204 733 2HG GLU 90 2HG GLU 90 15.257 4.163 9.813 734 H ILE 91 H ILE 91 15.817 1.870 6.315 735 HA ILE 91 HA ILE 91 16.221 1.447 4.096 736 HB ILE 91 HB ILE 91 14.706 -0.318 3.201 737 1HG1 ILE 91 1HG1 ILE 91 13.244 -0.030 5.837 738 2HG1 ILE 91 2HG1 ILE 91 12.608 0.531 4.296 739 1HG2 ILE 91 1HG2 ILE 91 16.619 -0.855 4.571 740 2HG2 ILE 91 2HG2 ILE 91 15.286 -1.950 4.935 741 3HG2 ILE 91 3HG2 ILE 91 15.666 -0.628 6.038 742 1HD1 ILE 91 1HD1 ILE 91 13.297 -2.323 4.961 743 2HD1 ILE 91 2HD1 ILE 91 12.601 -1.741 3.448 744 3HD1 ILE 91 3HD1 ILE 91 11.676 -1.629 4.944 745 H THR 92 H THR 92 13.371 0.763 2.661 746 HA THR 92 HA THR 92 12.726 3.465 1.805 747 HB THR 92 HB THR 92 13.480 1.368 -0.239 748 HG1 THR 92 HG1 THR 92 15.019 3.221 1.151 749 1HG2 THR 92 1HG2 THR 92 12.973 4.337 -0.486 750 2HG2 THR 92 2HG2 THR 92 11.877 3.059 -1.012 751 3HG2 THR 92 3HG2 THR 92 13.443 3.260 -1.800 752 H PHE 93 H PHE 93 10.634 3.656 1.045 753 HA PHE 93 HA PHE 93 8.751 1.829 1.976 754 1HB PHE 93 1HB PHE 93 8.346 4.258 1.559 755 2HB PHE 93 2HB PHE 93 8.327 3.921 -0.167 756 HD1 PHE 93 HD1 PHE 93 6.321 3.493 -1.200 757 HD2 PHE 93 HD2 PHE 93 6.655 2.877 2.993 758 HE1 PHE 93 HE1 PHE 93 3.907 3.035 -1.080 759 HE2 PHE 93 HE2 PHE 93 4.242 2.411 3.124 760 HZ PHE 93 HZ PHE 93 2.864 2.492 1.083 761 H GLN 94 H GLN 94 10.339 2.060 -1.113 762 HA GLN 94 HA GLN 94 8.562 0.545 -2.672 763 1HB GLN 94 1HB GLN 94 10.413 1.918 -3.595 764 2HB GLN 94 2HB GLN 94 11.566 0.746 -2.972 765 1HG GLN 94 1HG GLN 94 11.187 0.396 -5.335 766 2HG GLN 94 2HG GLN 94 10.588 -0.978 -4.405 767 1HE2 GLN 94 1HE2 GLN 94 9.158 -1.626 -5.992 768 2HE2 GLN 94 2HE2 GLN 94 7.714 -0.747 -6.373 769 H GLU 95 H GLU 95 11.417 -0.437 -0.791 770 HA GLU 95 HA GLU 95 11.310 -3.162 -1.502 771 1HB GLU 95 1HB GLU 95 13.246 -1.896 -0.390 772 2HB GLU 95 2HB GLU 95 12.379 -2.137 1.122 773 1HG GLU 95 1HG GLU 95 12.381 -4.614 0.534 774 2HG GLU 95 2HG GLU 95 13.575 -4.202 -0.694 775 H TYR 96 H TYR 96 9.858 -1.290 1.101 776 HA TYR 96 HA TYR 96 8.844 -3.319 2.695 777 1HB TYR 96 1HB TYR 96 8.735 -0.983 3.355 778 2HB TYR 96 2HB TYR 96 7.629 -0.628 2.035 779 HD1 TYR 96 HD1 TYR 96 5.378 -0.491 2.530 780 HD2 TYR 96 HD2 TYR 96 7.870 -2.869 5.022 781 HE1 TYR 96 HE1 TYR 96 3.472 -0.907 4.029 782 HE2 TYR 96 HE2 TYR 96 5.972 -3.294 6.527 783 HH TYR 96 HH TYR 96 3.818 -2.238 7.133 784 H ARG 97 H ARG 97 7.228 -1.718 -0.054 785 HA ARG 97 HA ARG 97 4.908 -3.329 0.020 786 1HB ARG 97 1HB ARG 97 6.087 -1.920 -2.381 787 2HB ARG 97 2HB ARG 97 4.426 -2.467 -2.207 788 1HG ARG 97 1HG ARG 97 4.290 -0.885 -0.218 789 2HG ARG 97 2HG ARG 97 5.808 -0.204 -0.810 790 1HD ARG 97 1HD ARG 97 3.136 -0.288 -2.194 791 2HD ARG 97 2HD ARG 97 4.069 1.127 -1.715 792 HE ARG 97 HE ARG 97 4.953 -0.716 -3.844 793 1HH1 ARG 97 1HH1 ARG 97 4.459 2.510 -2.594 794 2HH1 ARG 97 2HH1 ARG 97 5.046 3.293 -4.022 795 1HH2 ARG 97 1HH2 ARG 97 5.706 0.302 -5.743 796 2HH2 ARG 97 2HH2 ARG 97 5.761 2.038 -5.813 797 H ARG 98 H ARG 98 8.001 -3.673 -1.602 798 HA ARG 98 HA ARG 98 7.227 -5.691 -3.422 799 1HB ARG 98 1HB ARG 98 9.314 -4.185 -3.458 800 2HB ARG 98 2HB ARG 98 10.017 -5.357 -2.351 801 1HG ARG 98 1HG ARG 98 10.765 -6.230 -4.301 802 2HG ARG 98 2HG ARG 98 9.202 -7.045 -4.229 803 1HD ARG 98 1HD ARG 98 9.936 -4.595 -5.817 804 2HD ARG 98 2HD ARG 98 9.470 -6.178 -6.433 805 HE ARG 98 HE ARG 98 7.661 -4.226 -5.163 806 1HH1 ARG 98 1HH1 ARG 98 8.161 -7.118 -7.061 807 2HH1 ARG 98 2HH1 ARG 98 6.555 -7.129 -7.714 808 1HH2 ARG 98 1HH2 ARG 98 5.512 -4.235 -6.005 809 2HH2 ARG 98 2HH2 ARG 98 5.033 -5.528 -7.064 810 H ASN 99 H ASN 99 8.806 -5.828 -0.236 811 HA ASN 99 HA ASN 99 9.112 -8.656 -0.255 812 1HB ASN 99 1HB ASN 99 9.176 -6.669 2.019 813 2HB ASN 99 2HB ASN 99 9.546 -8.379 2.201 814 1HD2 ASN 99 1HD2 ASN 99 11.202 -6.037 2.650 815 2HD2 ASN 99 2HD2 ASN 99 12.599 -6.221 1.653 816 H LEU 100 H LEU 100 6.527 -6.524 0.725 817 HA LEU 100 HA LEU 100 5.029 -8.372 2.230 818 1HB LEU 100 1HB LEU 100 4.157 -6.034 0.538 819 2HB LEU 100 2HB LEU 100 3.051 -6.970 1.527 820 HG LEU 100 HG LEU 100 5.406 -5.385 2.559 821 1HD1 LEU 100 1HD1 LEU 100 3.707 -3.921 3.520 822 2HD1 LEU 100 2HD1 LEU 100 2.443 -4.862 2.729 823 3HD1 LEU 100 3HD1 LEU 100 3.607 -3.957 1.760 824 1HD2 LEU 100 1HD2 LEU 100 4.928 -7.366 3.910 825 2HD2 LEU 100 2HD2 LEU 100 3.240 -6.868 4.037 826 3HD2 LEU 100 3HD2 LEU 100 4.509 -5.882 4.763 827 H ALA 101 H ALA 101 5.006 -7.612 -1.236 828 HA ALA 101 HA ALA 101 3.073 -9.502 -2.019 829 1HB ALA 101 1HB ALA 101 4.030 -9.280 -4.262 830 2HB ALA 101 2HB ALA 101 5.443 -8.470 -3.584 831 3HB ALA 101 3HB ALA 101 3.857 -7.706 -3.488 832 H LYS 102 H LYS 102 6.468 -9.726 -1.356 833 HA LYS 102 HA LYS 102 6.957 -12.296 -2.454 834 1HB LYS 102 1HB LYS 102 8.588 -10.399 -1.800 835 2HB LYS 102 2HB LYS 102 8.474 -11.045 -0.174 836 1HG LYS 102 1HG LYS 102 9.351 -13.180 -0.949 837 2HG LYS 102 2HG LYS 102 9.445 -12.545 -2.595 838 1HD LYS 102 1HD LYS 102 10.901 -10.705 -1.678 839 2HD LYS 102 2HD LYS 102 10.963 -11.615 -0.170 840 1HE LYS 102 1HE LYS 102 11.978 -13.494 -1.319 841 2HE LYS 102 2HE LYS 102 11.852 -12.643 -2.860 842 1HZ LYS 102 1HZ LYS 102 13.285 -10.883 -1.867 843 2HZ LYS 102 2HZ LYS 102 14.061 -12.378 -2.063 844 3HZ LYS 102 3HZ LYS 102 13.531 -11.897 -0.529 845 H ALA 103 H ALA 103 5.439 -11.210 0.423 846 HA ALA 103 HA ALA 103 5.794 -13.727 1.844 847 1HB ALA 103 1HB ALA 103 4.514 -12.640 3.636 848 2HB ALA 103 2HB ALA 103 4.268 -11.236 2.596 849 3HB ALA 103 3HB ALA 103 5.893 -11.666 3.128 850 H GLY 104 H GLY 104 3.632 -12.298 -0.357 851 1HA GLY 104 1HA GLY 104 2.015 -13.863 -1.358 852 2HA GLY 104 2HA GLY 104 1.605 -14.352 0.279 853 H VAL 105 H VAL 105 2.118 -11.086 0.332 854 HA VAL 105 HA VAL 105 -0.683 -10.554 0.641 855 HB VAL 105 HB VAL 105 1.619 -8.593 0.577 856 1HG1 VAL 105 1HG1 VAL 105 -1.189 -8.285 1.630 857 2HG1 VAL 105 2HG1 VAL 105 -0.547 -7.544 0.165 858 3HG1 VAL 105 3HG1 VAL 105 0.099 -7.085 1.741 859 1HG2 VAL 105 1HG2 VAL 105 1.880 -10.280 2.334 860 2HG2 VAL 105 2HG2 VAL 105 0.261 -9.914 2.928 861 3HG2 VAL 105 3HG2 VAL 105 1.530 -8.690 3.016 862 H PHE 106 H PHE 106 -2.019 -10.225 -0.958 863 HA PHE 106 HA PHE 106 -1.013 -9.006 -3.444 864 1HB PHE 106 1HB PHE 106 -1.767 -11.280 -3.802 865 2HB PHE 106 2HB PHE 106 -3.290 -10.943 -2.989 866 HD1 PHE 106 HD1 PHE 106 -1.296 -9.579 -5.839 867 HD2 PHE 106 HD2 PHE 106 -5.117 -10.667 -4.320 868 HE1 PHE 106 HE1 PHE 106 -2.317 -9.002 -8.003 869 HE2 PHE 106 HE2 PHE 106 -6.148 -10.094 -6.479 870 HZ PHE 106 HZ PHE 106 -4.746 -9.261 -8.324 871 H ARG 107 H ARG 107 -3.333 -8.809 -0.873 872 HA ARG 107 HA ARG 107 -4.650 -6.563 -2.251 873 1HB ARG 107 1HB ARG 107 -5.781 -8.220 0.008 874 2HB ARG 107 2HB ARG 107 -6.612 -6.953 -0.878 875 1HG ARG 107 1HG ARG 107 -5.670 -9.561 -2.041 876 2HG ARG 107 2HG ARG 107 -7.324 -9.186 -1.564 877 1HD ARG 107 1HD ARG 107 -5.724 -7.802 -3.712 878 2HD ARG 107 2HD ARG 107 -7.034 -8.950 -3.968 879 HE ARG 107 HE ARG 107 -7.266 -6.163 -3.230 880 1HH1 ARG 107 1HH1 ARG 107 -8.891 -9.270 -3.302 881 2HH1 ARG 107 2HH1 ARG 107 -10.478 -8.570 -3.433 882 1HH2 ARG 107 1HH2 ARG 107 -9.374 -5.256 -3.411 883 2HH2 ARG 107 2HH2 ARG 107 -10.752 -6.314 -3.487 884 H TRP 108 H TRP 108 -3.421 -4.882 -1.604 885 HA TRP 108 HA TRP 108 -2.980 -4.407 1.242 886 1HB TRP 108 1HB TRP 108 -1.147 -3.912 -0.286 887 2HB TRP 108 2HB TRP 108 -2.184 -2.882 -1.253 888 HD1 TRP 108 HD1 TRP 108 -3.351 -0.921 0.871 889 HE1 TRP 108 HE1 TRP 108 -1.827 0.753 2.083 890 HE3 TRP 108 HE3 TRP 108 1.129 -3.299 0.233 891 HZ2 TRP 108 HZ2 TRP 108 0.917 1.041 2.681 892 HZ3 TRP 108 HZ3 TRP 108 3.155 -2.248 1.143 893 HH2 TRP 108 HH2 TRP 108 3.050 -0.124 2.344 894 H VAL 109 H VAL 109 -4.867 -3.813 2.214 895 HA VAL 109 HA VAL 109 -6.529 -1.812 0.819 896 HB VAL 109 HB VAL 109 -7.392 -3.729 2.993 897 1HG1 VAL 109 1HG1 VAL 109 -9.658 -3.028 2.404 898 2HG1 VAL 109 2HG1 VAL 109 -9.002 -1.875 1.241 899 3HG1 VAL 109 3HG1 VAL 109 -8.689 -1.664 2.964 900 1HG2 VAL 109 1HG2 VAL 109 -7.877 -3.829 0.020 901 2HG2 VAL 109 2HG2 VAL 109 -8.608 -4.900 1.217 902 3HG2 VAL 109 3HG2 VAL 109 -6.864 -4.931 0.952 903 H THR 110 H THR 110 -6.020 0.158 1.558 904 HA THR 110 HA THR 110 -5.645 0.507 4.455 905 HB THR 110 HB THR 110 -5.013 2.452 2.226 906 HG1 THR 110 HG1 THR 110 -3.729 0.299 2.892 907 1HG2 THR 110 1HG2 THR 110 -5.510 3.563 4.355 908 2HG2 THR 110 2HG2 THR 110 -3.797 3.694 3.956 909 3HG2 THR 110 3HG2 THR 110 -4.336 2.534 5.171 910 H ASN 111 H ASN 111 -7.542 0.832 5.410 911 HA ASN 111 HA ASN 111 -9.499 2.607 4.118 912 1HB ASN 111 1HB ASN 111 -10.238 0.305 4.824 913 2HB ASN 111 2HB ASN 111 -9.930 0.774 6.492 914 1HD2 ASN 111 1HD2 ASN 111 -12.403 0.008 5.000 915 2HD2 ASN 111 2HD2 ASN 111 -13.523 1.283 5.336 916 H ILE 112 H ILE 112 -9.529 4.627 4.767 917 HA ILE 112 HA ILE 112 -7.902 5.455 6.980 918 HB ILE 112 HB ILE 112 -9.661 7.073 5.132 919 1HG1 ILE 112 1HG1 ILE 112 -7.843 5.927 3.967 920 2HG1 ILE 112 2HG1 ILE 112 -7.536 7.660 4.029 921 1HG2 ILE 112 1HG2 ILE 112 -9.272 8.246 7.238 922 2HG2 ILE 112 2HG2 ILE 112 -8.423 9.024 5.903 923 3HG2 ILE 112 3HG2 ILE 112 -7.534 8.020 7.048 924 1HD1 ILE 112 1HD1 ILE 112 -5.516 6.368 4.438 925 2HD1 ILE 112 2HD1 ILE 112 -6.285 5.590 5.822 926 3HD1 ILE 112 3HD1 ILE 112 -5.962 7.322 5.852 927 H HIS 113 H HIS 113 -11.265 4.814 6.514 928 HA HIS 113 HA HIS 113 -12.375 6.489 8.478 929 1HB HIS 113 1HB HIS 113 -13.294 3.787 7.479 930 2HB HIS 113 2HB HIS 113 -14.231 4.781 8.586 931 HD1 HIS 113 HD1 HIS 113 -14.732 7.320 7.535 932 HD2 HIS 113 HD2 HIS 113 -13.952 4.201 4.890 933 HE1 HIS 113 HE1 HIS 113 -15.682 8.046 5.326 934 HE2 HIS 113 HE2 HIS 113 -15.365 6.075 3.793 935 H GLU 114 H GLU 114 -10.701 3.436 8.721 936 HA GLU 114 HA GLU 114 -11.083 3.503 11.641 937 1HB GLU 114 1HB GLU 114 -10.473 1.203 9.797 938 2HB GLU 114 2HB GLU 114 -10.319 1.094 11.545 939 1HG GLU 114 1HG GLU 114 -12.734 1.745 11.696 940 2HG GLU 114 2HG GLU 114 -12.813 1.563 9.943 941 H GLN 115 H GLN 115 -8.885 4.277 9.298 942 HA GLN 115 HA GLN 115 -6.628 4.582 9.201 943 1HB GLN 115 1HB GLN 115 -6.907 4.500 12.218 944 2HB GLN 115 2HB GLN 115 -5.463 5.025 11.361 945 1HG GLN 115 1HG GLN 115 -8.146 6.334 11.013 946 2HG GLN 115 2HG GLN 115 -6.969 6.849 12.217 947 1HE2 GLN 115 1HE2 GLN 115 -4.692 6.293 10.498 948 2HE2 GLN 115 2HE2 GLN 115 -4.662 7.547 9.312 949 H LYS 116 H LYS 116 -7.517 1.968 8.860 950 HA LYS 116 HA LYS 116 -5.356 0.389 10.100 951 1HB LYS 116 1HB LYS 116 -8.133 -0.496 9.311 952 2HB LYS 116 2HB LYS 116 -6.839 -1.612 9.702 953 1HG LYS 116 1HG LYS 116 -6.710 -0.593 11.960 954 2HG LYS 116 2HG LYS 116 -8.118 0.390 11.543 955 1HD LYS 116 1HD LYS 116 -9.419 -1.653 11.139 956 2HD LYS 116 2HD LYS 116 -8.014 -2.628 11.568 957 1HE LYS 116 1HE LYS 116 -9.475 -2.546 13.458 958 2HE LYS 116 2HE LYS 116 -8.049 -1.574 13.823 959 1HZ LYS 116 1HZ LYS 116 -10.622 -0.451 12.839 960 2HZ LYS 116 2HZ LYS 116 -9.271 0.412 13.413 961 3HZ LYS 116 3HZ LYS 116 -10.184 -0.534 14.479 962 H ARG 117 H ARG 117 -4.108 -0.861 8.798 963 HA ARG 117 HA ARG 117 -4.787 -0.922 5.939 964 1HB ARG 117 1HB ARG 117 -2.148 -0.968 7.364 965 2HB ARG 117 2HB ARG 117 -2.298 -1.622 5.738 966 1HG ARG 117 1HG ARG 117 -3.214 0.566 5.013 967 2HG ARG 117 2HG ARG 117 -2.859 1.194 6.623 968 1HD ARG 117 1HD ARG 117 -0.541 0.940 6.322 969 2HD ARG 117 2HD ARG 117 -0.758 -0.102 4.915 970 HE ARG 117 HE ARG 117 -1.768 2.007 3.875 971 1HH1 ARG 117 1HH1 ARG 117 0.813 2.021 6.225 972 2HH1 ARG 117 2HH1 ARG 117 1.535 3.483 5.632 973 1HH2 ARG 117 1HH2 ARG 117 -0.822 3.905 3.043 974 2HH2 ARG 117 2HH2 ARG 117 0.600 4.556 3.797 975 H TYR 118 H TYR 118 -5.761 -2.725 5.422 976 HA TYR 118 HA TYR 118 -5.231 -5.189 6.890 977 1HB TYR 118 1HB TYR 118 -7.167 -4.777 4.605 978 2HB TYR 118 2HB TYR 118 -7.174 -6.070 5.796 979 HD1 TYR 118 HD1 TYR 118 -7.932 -5.607 8.116 980 HD2 TYR 118 HD2 TYR 118 -8.176 -2.667 5.050 981 HE1 TYR 118 HE1 TYR 118 -9.537 -4.328 9.472 982 HE2 TYR 118 HE2 TYR 118 -9.775 -1.381 6.401 983 HH TYR 118 HH TYR 118 -10.349 -2.019 9.682 984 H TYR 119 H TYR 119 -3.875 -6.696 6.136 985 HA TYR 119 HA TYR 119 -3.094 -6.550 3.302 986 1HB TYR 119 1HB TYR 119 -1.583 -7.704 5.659 987 2HB TYR 119 2HB TYR 119 -1.032 -7.755 3.987 988 HD1 TYR 119 HD1 TYR 119 -0.996 -5.357 2.811 989 HD2 TYR 119 HD2 TYR 119 -0.759 -6.019 7.003 990 HE1 TYR 119 HE1 TYR 119 0.076 -3.160 3.092 991 HE2 TYR 119 HE2 TYR 119 0.308 -3.825 7.297 992 HH TYR 119 HH TYR 119 1.719 -2.250 5.812 993 H TYR 120 H TYR 120 -4.202 -7.949 2.136 994 HA TYR 120 HA TYR 120 -4.943 -10.537 3.317 995 1HB TYR 120 1HB TYR 120 -6.005 -9.091 0.884 996 2HB TYR 120 2HB TYR 120 -6.483 -10.719 1.346 997 HD1 TYR 120 HD1 TYR 120 -8.211 -11.062 2.887 998 HD2 TYR 120 HD2 TYR 120 -6.496 -7.191 2.505 999 HE1 TYR 120 HE1 TYR 120 -10.009 -10.138 4.288 1000 HE2 TYR 120 HE2 TYR 120 -8.280 -6.259 3.913 1001 HH TYR 120 HH TYR 120 -10.447 -6.708 4.680 1002 H THR 121 H THR 121 -4.442 -12.454 2.354 1003 HA THR 121 HA THR 121 -2.115 -12.606 0.733 1004 HB THR 121 HB THR 121 -2.491 -14.380 2.275 1005 HG1 THR 121 HG1 THR 121 -3.171 -16.077 0.327 1006 1HG2 THR 121 1HG2 THR 121 -4.449 -15.833 2.228 1007 2HG2 THR 121 2HG2 THR 121 -5.132 -14.878 0.913 1008 3HG2 THR 121 3HG2 THR 121 -4.906 -14.152 2.505 1009 H PHE 122 H PHE 122 -2.153 -14.079 -1.271 1010 HA PHE 122 HA PHE 122 -3.418 -12.714 -3.350 1011 1HB PHE 122 1HB PHE 122 -1.352 -14.070 -3.577 1012 2HB PHE 122 2HB PHE 122 -2.311 -15.533 -3.386 1013 HD1 PHE 122 HD1 PHE 122 -3.472 -16.479 -5.206 1014 HD2 PHE 122 HD2 PHE 122 -1.698 -12.629 -5.583 1015 HE1 PHE 122 HE1 PHE 122 -3.856 -16.541 -7.639 1016 HE2 PHE 122 HE2 PHE 122 -2.083 -12.682 -8.010 1017 HZ PHE 122 HZ PHE 122 -3.161 -14.637 -9.041 1018 H ASP 123 H ASP 123 -4.369 -15.627 -1.620 1019 HA ASP 123 HA ASP 123 -6.592 -16.148 -3.399 1020 1HB ASP 123 1HB ASP 123 -7.094 -18.017 -1.865 1021 2HB ASP 123 2HB ASP 123 -5.415 -18.036 -2.399 1022 H ASN 124 H ASN 124 -6.144 -13.834 -1.257 1023 HA ASN 124 HA ASN 124 -7.483 -12.347 -0.229 1024 1HB ASN 124 1HB ASN 124 -9.723 -13.959 -1.450 1025 2HB ASN 124 2HB ASN 124 -9.965 -12.466 -0.548 1026 1HD2 ASN 124 1HD2 ASN 124 -8.867 -13.883 -3.498 1027 2HD2 ASN 124 2HD2 ASN 124 -8.673 -12.410 -4.379 1028 H SER 125 H SER 125 -6.793 -12.836 1.755 1029 HA SER 125 HA SER 125 -8.772 -13.630 3.623 1030 1HB SER 125 1HB SER 125 -7.901 -15.881 2.887 1031 2HB SER 125 2HB SER 125 -6.311 -15.402 3.480 1032 HG SER 125 HG SER 125 -8.606 -16.123 4.877 1033 H LEU 126 H LEU 126 -8.182 -12.907 5.735 1034 HA LEU 126 HA LEU 126 -6.333 -10.718 5.570 1035 1HB LEU 126 1HB LEU 126 -8.475 -10.570 6.788 1036 2HB LEU 126 2HB LEU 126 -7.881 -11.745 7.948 1037 HG LEU 126 HG LEU 126 -6.085 -10.167 8.597 1038 1HD1 LEU 126 1HD1 LEU 126 -5.911 -8.933 6.511 1039 2HD1 LEU 126 2HD1 LEU 126 -6.225 -7.840 7.860 1040 3HD1 LEU 126 3HD1 LEU 126 -7.527 -8.271 6.752 1041 1HD2 LEU 126 1HD2 LEU 126 -7.536 -8.580 9.789 1042 2HD2 LEU 126 2HD2 LEU 126 -8.147 -10.231 9.882 1043 3HD2 LEU 126 3HD2 LEU 126 -8.893 -9.077 8.779 1044 H LEU 127 H LEU 127 -4.245 -10.837 5.918 1045 HA LEU 127 HA LEU 127 -3.203 -13.027 7.567 1046 1HB LEU 127 1HB LEU 127 -1.764 -11.176 5.661 1047 2HB LEU 127 2HB LEU 127 -1.026 -12.494 6.549 1048 HG LEU 127 HG LEU 127 -3.114 -12.762 4.385 1049 1HD1 LEU 127 1HD1 LEU 127 -0.186 -13.476 4.455 1050 2HD1 LEU 127 2HD1 LEU 127 -0.918 -12.165 3.530 1051 3HD1 LEU 127 3HD1 LEU 127 -1.302 -13.841 3.140 1052 1HD2 LEU 127 1HD2 LEU 127 -3.389 -14.474 6.102 1053 2HD2 LEU 127 2HD2 LEU 127 -1.676 -14.877 5.986 1054 3HD2 LEU 127 3HD2 LEU 127 -2.746 -15.170 4.614 1055 H PHE 128 H PHE 128 -2.655 -9.552 7.006 1056 HA PHE 128 HA PHE 128 -1.955 -9.297 9.843 1057 1HB PHE 128 1HB PHE 128 0.075 -9.494 8.263 1058 2HB PHE 128 2HB PHE 128 -0.381 -7.895 7.688 1059 HD1 PHE 128 HD1 PHE 128 0.860 -9.825 10.542 1060 HD2 PHE 128 HD2 PHE 128 0.012 -5.938 9.030 1061 HE1 PHE 128 HE1 PHE 128 2.146 -8.831 12.390 1062 HE2 PHE 128 HE2 PHE 128 1.291 -4.935 10.881 1063 HZ PHE 128 HZ PHE 128 2.363 -6.383 12.560 1064 H THR 129 H THR 129 -2.267 -7.173 10.693 1065 HA THR 129 HA THR 129 -3.580 -5.252 8.922 1066 HB THR 129 HB THR 129 -4.663 -5.995 11.649 1067 HG1 THR 129 HG1 THR 129 -5.039 -7.123 9.241 1068 1HG2 THR 129 1HG2 THR 129 -6.538 -4.534 11.037 1069 2HG2 THR 129 2HG2 THR 129 -5.735 -4.136 9.519 1070 3HG2 THR 129 3HG2 THR 129 -5.018 -3.640 11.051 1071 H GLU 130 H GLU 130 -2.065 -3.720 8.953 1072 HA GLU 130 HA GLU 130 -0.839 -2.938 11.487 1073 1HB GLU 130 1HB GLU 130 0.651 -3.237 9.548 1074 2HB GLU 130 2HB GLU 130 -0.258 -2.027 8.654 1075 1HG GLU 130 1HG GLU 130 1.663 -0.925 9.413 1076 2HG GLU 130 2HG GLU 130 0.373 -0.398 10.490 1077 H SER 131 H SER 131 -2.053 -1.557 12.639 1078 HA SER 131 HA SER 131 -3.752 0.362 11.300 1079 1HB SER 131 1HB SER 131 -4.369 -0.786 13.478 1080 2HB SER 131 2HB SER 131 -3.141 0.206 14.263 1081 HG SER 131 HG SER 131 -4.823 1.694 12.718 1082 H ILE 132 H ILE 132 -3.116 2.328 10.703 1083 HA ILE 132 HA ILE 132 -0.412 3.113 11.187 1084 HB ILE 132 HB ILE 132 -1.194 5.248 9.925 1085 1HG1 ILE 132 1HG1 ILE 132 -3.457 3.330 9.301 1086 2HG1 ILE 132 2HG1 ILE 132 -3.614 4.853 10.171 1087 1HG2 ILE 132 1HG2 ILE 132 0.276 3.554 9.001 1088 2HG2 ILE 132 2HG2 ILE 132 -0.898 4.065 7.787 1089 3HG2 ILE 132 3HG2 ILE 132 -1.107 2.526 8.624 1090 1HD1 ILE 132 1HD1 ILE 132 -2.935 6.066 8.165 1091 2HD1 ILE 132 2HD1 ILE 132 -4.352 5.057 7.864 1092 3HD1 ILE 132 3HD1 ILE 132 -2.764 4.539 7.299 1093 H GLN 133 H GLN 133 -0.603 3.141 13.452 1094 HA GLN 133 HA GLN 133 -0.709 5.787 14.490 1095 1HB GLN 133 1HB GLN 133 -3.145 5.072 14.551 1096 2HB GLN 133 2HB GLN 133 -2.665 3.797 15.663 1097 1HG GLN 133 1HG GLN 133 -3.576 5.664 16.875 1098 2HG GLN 133 2HG GLN 133 -1.862 5.477 17.242 1099 1HE2 GLN 133 1HE2 GLN 133 -2.979 6.840 14.240 1100 2HE2 GLN 133 2HE2 GLN 133 -2.467 8.462 14.560 Start of MODEL 6 1 H ASP 7 H ASP 7 -4.264 14.400 -16.422 2 HA ASP 7 HA ASP 7 -6.621 13.078 -15.757 3 1HB ASP 7 1HB ASP 7 -3.847 12.143 -16.372 4 2HB ASP 7 2HB ASP 7 -5.004 10.982 -15.731 5 H GLN 8 H GLN 8 -7.430 12.227 -13.956 6 HA GLN 8 HA GLN 8 -6.503 13.009 -11.444 7 1HB GLN 8 1HB GLN 8 -8.848 12.263 -12.147 8 2HB GLN 8 2HB GLN 8 -8.275 10.615 -11.931 9 1HG GLN 8 1HG GLN 8 -7.773 11.111 -9.583 10 2HG GLN 8 2HG GLN 8 -8.389 12.748 -9.812 11 1HE2 GLN 8 1HE2 GLN 8 -10.033 12.529 -8.317 12 2HE2 GLN 8 2HE2 GLN 8 -11.420 11.532 -8.589 13 H VAL 9 H VAL 9 -5.909 10.138 -13.318 14 HA VAL 9 HA VAL 9 -4.797 8.462 -11.383 15 HB VAL 9 HB VAL 9 -4.052 8.673 -14.307 16 1HG1 VAL 9 1HG1 VAL 9 -3.695 6.391 -12.366 17 2HG1 VAL 9 2HG1 VAL 9 -2.409 7.392 -13.043 18 3HG1 VAL 9 3HG1 VAL 9 -3.353 6.334 -14.094 19 1HG2 VAL 9 1HG2 VAL 9 -6.445 8.342 -13.986 20 2HG2 VAL 9 2HG2 VAL 9 -6.120 6.952 -12.950 21 3HG2 VAL 9 3HG2 VAL 9 -5.687 6.898 -14.658 22 H VAL 10 H VAL 10 -3.338 11.011 -13.348 23 HA VAL 10 HA VAL 10 -0.651 10.441 -12.767 24 HB VAL 10 HB VAL 10 -1.905 13.093 -13.501 25 1HG1 VAL 10 1HG1 VAL 10 0.343 13.721 -14.259 26 2HG1 VAL 10 2HG1 VAL 10 0.975 12.205 -13.621 27 3HG1 VAL 10 3HG1 VAL 10 0.300 13.408 -12.523 28 1HG2 VAL 10 1HG2 VAL 10 -1.171 12.539 -15.778 29 2HG2 VAL 10 2HG2 VAL 10 -2.337 11.368 -15.159 30 3HG2 VAL 10 3HG2 VAL 10 -0.620 10.964 -15.208 31 H ILE 11 H ILE 11 -2.953 12.656 -11.212 32 HA ILE 11 HA ILE 11 -1.121 13.842 -9.445 33 HB ILE 11 HB ILE 11 -4.119 13.549 -9.311 34 1HG1 ILE 11 1HG1 ILE 11 -3.924 16.090 -9.533 35 2HG1 ILE 11 2HG1 ILE 11 -2.223 15.827 -9.889 36 1HG2 ILE 11 1HG2 ILE 11 -4.112 15.119 -7.413 37 2HG2 ILE 11 2HG2 ILE 11 -2.354 14.981 -7.331 38 3HG2 ILE 11 3HG2 ILE 11 -3.366 13.571 -7.015 39 1HD1 ILE 11 1HD1 ILE 11 -3.515 16.132 -11.916 40 2HD1 ILE 11 2HD1 ILE 11 -4.548 14.769 -11.487 41 3HD1 ILE 11 3HD1 ILE 11 -2.843 14.503 -11.846 42 H PHE 12 H PHE 12 -3.384 11.134 -8.896 43 HA PHE 12 HA PHE 12 -2.534 10.719 -6.225 44 1HB PHE 12 1HB PHE 12 -4.088 9.035 -8.168 45 2HB PHE 12 2HB PHE 12 -3.650 8.429 -6.574 46 HD1 PHE 12 HD1 PHE 12 -5.630 10.943 -8.388 47 HD2 PHE 12 HD2 PHE 12 -4.733 9.211 -4.609 48 HE1 PHE 12 HE1 PHE 12 -7.603 12.055 -7.413 49 HE2 PHE 12 HE2 PHE 12 -6.697 10.316 -3.627 50 HZ PHE 12 HZ PHE 12 -8.134 11.739 -5.027 51 H LYS 13 H LYS 13 -1.600 9.213 -9.298 52 HA LYS 13 HA LYS 13 0.104 7.264 -8.205 53 1HB LYS 13 1HB LYS 13 -0.631 7.229 -10.556 54 2HB LYS 13 2HB LYS 13 0.328 8.669 -10.878 55 1HG LYS 13 1HG LYS 13 2.365 7.421 -10.304 56 2HG LYS 13 2HG LYS 13 1.386 5.975 -10.045 57 1HD LYS 13 1HD LYS 13 0.676 6.028 -12.379 58 2HD LYS 13 2HD LYS 13 1.617 7.499 -12.640 59 1HE LYS 13 1HE LYS 13 2.773 4.860 -11.754 60 2HE LYS 13 2HE LYS 13 2.752 5.427 -13.422 61 1HZ LYS 13 1HZ LYS 13 4.204 7.191 -12.898 62 2HZ LYS 13 2HZ LYS 13 4.859 5.831 -12.136 63 3HZ LYS 13 3HZ LYS 13 4.013 6.980 -11.224 64 H GLN 14 H GLN 14 0.612 10.639 -9.071 65 HA GLN 14 HA GLN 14 3.402 10.748 -8.843 66 1HB GLN 14 1HB GLN 14 1.714 12.530 -9.698 67 2HB GLN 14 2HB GLN 14 1.620 13.025 -8.014 68 1HG GLN 14 1HG GLN 14 3.219 14.442 -8.867 69 2HG GLN 14 2HG GLN 14 4.188 13.161 -8.142 70 1HE2 GLN 14 1HE2 GLN 14 3.433 11.336 -10.396 71 2HE2 GLN 14 2HE2 GLN 14 4.435 11.830 -11.711 72 H ILE 15 H ILE 15 0.853 10.979 -6.434 73 HA ILE 15 HA ILE 15 2.394 11.743 -4.219 74 HB ILE 15 HB ILE 15 -0.048 9.952 -4.267 75 1HG1 ILE 15 1HG1 ILE 15 0.158 12.944 -3.851 76 2HG1 ILE 15 2HG1 ILE 15 -0.370 12.170 -5.341 77 1HG2 ILE 15 1HG2 ILE 15 1.133 9.780 -2.152 78 2HG2 ILE 15 2HG2 ILE 15 -0.373 10.672 -1.940 79 3HG2 ILE 15 3HG2 ILE 15 1.161 11.539 -2.004 80 1HD1 ILE 15 1HD1 ILE 15 -1.745 12.018 -2.670 81 2HD1 ILE 15 2HD1 ILE 15 -2.270 11.191 -4.137 82 3HD1 ILE 15 3HD1 ILE 15 -2.264 12.953 -4.071 83 H PHE 16 H PHE 16 1.592 8.538 -5.518 84 HA PHE 16 HA PHE 16 3.066 7.108 -3.545 85 1HB PHE 16 1HB PHE 16 1.945 6.301 -6.225 86 2HB PHE 16 2HB PHE 16 2.823 5.181 -5.189 87 HD1 PHE 16 HD1 PHE 16 1.860 4.419 -3.084 88 HD2 PHE 16 HD2 PHE 16 -0.270 7.062 -5.650 89 HE1 PHE 16 HE1 PHE 16 -0.217 3.928 -1.860 90 HE2 PHE 16 HE2 PHE 16 -2.349 6.571 -4.434 91 HZ PHE 16 HZ PHE 16 -2.325 5.005 -2.536 92 H ASP 17 H ASP 17 3.817 8.279 -6.794 93 HA ASP 17 HA ASP 17 6.318 7.033 -7.085 94 1HB ASP 17 1HB ASP 17 5.110 9.509 -8.271 95 2HB ASP 17 2HB ASP 17 6.807 9.144 -8.553 96 H LYS 18 H LYS 18 5.404 10.072 -5.565 97 HA LYS 18 HA LYS 18 8.049 10.916 -4.989 98 1HB LYS 18 1HB LYS 18 6.309 12.549 -4.980 99 2HB LYS 18 2HB LYS 18 5.374 11.640 -3.806 100 1HG LYS 18 1HG LYS 18 6.975 12.131 -2.072 101 2HG LYS 18 2HG LYS 18 8.033 12.933 -3.237 102 1HD LYS 18 1HD LYS 18 6.473 14.690 -3.574 103 2HD LYS 18 2HD LYS 18 5.203 13.815 -2.718 104 1HE LYS 18 1HE LYS 18 6.146 15.636 -1.371 105 2HE LYS 18 2HE LYS 18 6.391 14.057 -0.630 106 1HZ LYS 18 1HZ LYS 18 8.643 14.105 -1.070 107 2HZ LYS 18 2HZ LYS 18 8.320 15.728 -0.695 108 3HZ LYS 18 3HZ LYS 18 8.495 15.253 -2.315 109 H VAL 19 H VAL 19 5.588 9.259 -3.011 110 HA VAL 19 HA VAL 19 7.172 9.340 -0.661 111 HB VAL 19 HB VAL 19 4.681 9.171 -0.684 112 1HG1 VAL 19 1HG1 VAL 19 5.200 6.268 -1.305 113 2HG1 VAL 19 2HG1 VAL 19 4.438 7.439 -2.380 114 3HG1 VAL 19 3HG1 VAL 19 3.640 6.978 -0.878 115 1HG2 VAL 19 1HG2 VAL 19 6.172 7.116 0.940 116 2HG2 VAL 19 2HG2 VAL 19 4.547 7.709 1.287 117 3HG2 VAL 19 3HG2 VAL 19 5.923 8.811 1.358 118 H ARG 20 H ARG 20 7.155 7.122 -3.331 119 HA ARG 20 HA ARG 20 8.047 4.869 -1.837 120 1HB ARG 20 1HB ARG 20 8.567 3.825 -4.007 121 2HB ARG 20 2HB ARG 20 6.936 4.474 -3.934 122 1HG ARG 20 1HG ARG 20 7.560 6.351 -5.290 123 2HG ARG 20 2HG ARG 20 9.259 5.869 -5.247 124 1HD ARG 20 1HD ARG 20 8.831 3.925 -6.537 125 2HD ARG 20 2HD ARG 20 7.089 4.104 -6.356 126 HE ARG 20 HE ARG 20 7.124 5.866 -7.930 127 1HH1 ARG 20 1HH1 ARG 20 10.287 4.415 -7.497 128 2HH1 ARG 20 2HH1 ARG 20 10.899 5.006 -9.002 129 1HH2 ARG 20 1HH2 ARG 20 7.898 6.613 -9.910 130 2HH2 ARG 20 2HH2 ARG 20 9.542 6.274 -10.383 131 H ASN 21 H ASN 21 9.669 7.638 -3.021 132 HA ASN 21 HA ASN 21 12.227 6.321 -2.364 133 1HB ASN 21 1HB ASN 21 12.110 6.970 -4.752 134 2HB ASN 21 2HB ASN 21 11.832 8.640 -4.264 135 1HD2 ASN 21 1HD2 ASN 21 13.526 9.873 -3.523 136 2HD2 ASN 21 2HD2 ASN 21 15.172 9.337 -3.566 137 H ASP 22 H ASP 22 10.396 9.333 -2.264 138 HA ASP 22 HA ASP 22 12.319 10.755 -0.725 139 1HB ASP 22 1HB ASP 22 10.763 11.918 -2.175 140 2HB ASP 22 2HB ASP 22 9.393 11.284 -1.273 141 H LEU 23 H LEU 23 9.447 8.895 0.017 142 HA LEU 23 HA LEU 23 8.744 7.851 1.892 143 1HB LEU 23 1HB LEU 23 11.539 8.484 2.818 144 2HB LEU 23 2HB LEU 23 10.415 7.491 3.726 145 HG LEU 23 HG LEU 23 11.475 6.862 0.966 146 1HD1 LEU 23 1HD1 LEU 23 12.651 5.031 2.126 147 2HD1 LEU 23 2HD1 LEU 23 12.119 5.696 3.669 148 3HD1 LEU 23 3HD1 LEU 23 13.202 6.627 2.633 149 1HD2 LEU 23 1HD2 LEU 23 9.188 6.025 1.383 150 2HD2 LEU 23 2HD2 LEU 23 9.782 5.187 2.819 151 3HD2 LEU 23 3HD2 LEU 23 10.373 4.729 1.222 152 H ASN 24 H ASN 24 8.654 10.938 1.660 153 HA ASN 24 HA ASN 24 8.475 11.708 4.428 154 1HB ASN 24 1HB ASN 24 9.049 13.395 2.741 155 2HB ASN 24 2HB ASN 24 7.484 13.166 1.968 156 1HD2 ASN 24 1HD2 ASN 24 7.114 15.419 2.296 157 2HD2 ASN 24 2HD2 ASN 24 6.619 16.011 3.841 158 H TYR 25 H TYR 25 7.078 10.229 5.325 159 HA TYR 25 HA TYR 25 4.493 9.706 4.259 160 1HB TYR 25 1HB TYR 25 5.735 9.094 6.940 161 2HB TYR 25 2HB TYR 25 4.105 8.591 6.494 162 HD1 TYR 25 HD1 TYR 25 3.905 7.204 4.299 163 HD2 TYR 25 HD2 TYR 25 7.529 7.686 6.475 164 HE1 TYR 25 HE1 TYR 25 4.801 5.175 3.240 165 HE2 TYR 25 HE2 TYR 25 8.441 5.662 5.414 166 HH TYR 25 HH TYR 25 7.030 4.210 2.718 167 H GLN 26 H GLN 26 5.759 12.235 6.167 168 HA GLN 26 HA GLN 26 3.517 13.004 7.665 169 1HB GLN 26 1HB GLN 26 5.577 14.807 6.374 170 2HB GLN 26 2HB GLN 26 4.505 15.248 7.693 171 1HG GLN 26 1HG GLN 26 6.575 13.078 7.871 172 2HG GLN 26 2HG GLN 26 6.851 14.747 8.358 173 1HE2 GLN 26 1HE2 GLN 26 7.230 14.252 10.470 174 2HE2 GLN 26 2HE2 GLN 26 5.996 13.697 11.553 175 H TRP 27 H TRP 27 4.512 13.816 4.379 176 HA TRP 27 HA TRP 27 2.138 15.352 3.844 177 1HB TRP 27 1HB TRP 27 4.276 15.901 2.763 178 2HB TRP 27 2HB TRP 27 4.296 14.323 1.987 179 HD1 TRP 27 HD1 TRP 27 2.222 17.596 1.938 180 HE1 TRP 27 HE1 TRP 27 1.188 17.850 -0.409 181 HE3 TRP 27 HE3 TRP 27 3.723 13.149 -0.094 182 HZ2 TRP 27 HZ2 TRP 27 1.040 16.361 -2.803 183 HZ3 TRP 27 HZ3 TRP 27 3.093 12.644 -2.417 184 HH2 TRP 27 HH2 TRP 27 1.778 14.219 -3.741 185 H PHE 28 H PHE 28 3.326 12.113 3.225 186 HA PHE 28 HA PHE 28 1.479 11.264 1.319 187 1HB PHE 28 1HB PHE 28 3.514 10.017 1.900 188 2HB PHE 28 2HB PHE 28 2.837 9.635 3.477 189 HD1 PHE 28 HD1 PHE 28 1.724 9.390 -0.088 190 HD2 PHE 28 HD2 PHE 28 2.109 7.495 3.704 191 HE1 PHE 28 HE1 PHE 28 0.736 7.339 -1.020 192 HE2 PHE 28 HE2 PHE 28 1.122 5.438 2.780 193 HZ PHE 28 HZ PHE 28 0.435 5.359 0.415 194 H TYR 29 H TYR 29 1.350 10.726 4.860 195 HA TYR 29 HA TYR 29 -1.267 9.604 4.713 196 1HB TYR 29 1HB TYR 29 0.425 10.533 7.027 197 2HB TYR 29 2HB TYR 29 -1.200 9.888 7.244 198 HD1 TYR 29 HD1 TYR 29 2.233 9.063 7.036 199 HD2 TYR 29 HD2 TYR 29 -1.644 7.559 6.163 200 HE1 TYR 29 HE1 TYR 29 3.132 6.774 7.008 201 HE2 TYR 29 HE2 TYR 29 -0.758 5.266 6.134 202 HH TYR 29 HH TYR 29 1.441 4.152 5.754 203 H SER 30 H SER 30 -0.032 12.822 5.112 204 HA SER 30 HA SER 30 -2.342 14.053 6.140 205 1HB SER 30 1HB SER 30 -0.147 15.173 6.062 206 2HB SER 30 2HB SER 30 -0.228 15.210 4.302 207 HG SER 30 HG SER 30 -1.072 17.110 4.715 208 H GLU 31 H GLU 31 -1.231 13.549 2.789 209 HA GLU 31 HA GLU 31 -3.557 14.718 1.639 210 1HB GLU 31 1HB GLU 31 -1.480 12.873 0.448 211 2HB GLU 31 2HB GLU 31 -2.764 13.643 -0.474 212 1HG GLU 31 1HG GLU 31 -0.486 14.960 0.964 213 2HG GLU 31 2HG GLU 31 -0.808 14.935 -0.770 214 H LEU 32 H LEU 32 -2.637 11.410 2.482 215 HA LEU 32 HA LEU 32 -4.791 10.091 1.277 216 1HB LEU 32 1HB LEU 32 -3.347 9.450 3.844 217 2HB LEU 32 2HB LEU 32 -4.523 8.389 3.097 218 HG LEU 32 HG LEU 32 -1.876 9.229 1.920 219 1HD1 LEU 32 1HD1 LEU 32 -1.290 6.874 2.190 220 2HD1 LEU 32 2HD1 LEU 32 -2.850 6.570 2.955 221 3HD1 LEU 32 3HD1 LEU 32 -1.674 7.625 3.738 222 1HD2 LEU 32 1HD2 LEU 32 -3.995 7.391 0.804 223 2HD2 LEU 32 2HD2 LEU 32 -2.387 7.640 0.121 224 3HD2 LEU 32 3HD2 LEU 32 -3.544 8.970 0.165 225 H LYS 33 H LYS 33 -4.541 11.646 4.443 226 HA LYS 33 HA LYS 33 -7.159 10.879 5.275 227 1HB LYS 33 1HB LYS 33 -5.072 11.563 6.671 228 2HB LYS 33 2HB LYS 33 -5.629 13.206 6.408 229 1HG LYS 33 1HG LYS 33 -7.522 11.187 7.510 230 2HG LYS 33 2HG LYS 33 -6.294 11.889 8.562 231 1HD LYS 33 1HD LYS 33 -8.343 13.428 6.968 232 2HD LYS 33 2HD LYS 33 -8.416 13.103 8.701 233 1HE LYS 33 1HE LYS 33 -6.245 14.313 8.941 234 2HE LYS 33 2HE LYS 33 -6.363 14.755 7.237 235 1HZ LYS 33 1HZ LYS 33 -8.554 15.787 7.803 236 2HZ LYS 33 2HZ LYS 33 -7.207 16.555 8.489 237 3HZ LYS 33 3HZ LYS 33 -8.181 15.548 9.441 238 H ARG 34 H ARG 34 -5.950 13.416 3.283 239 HA ARG 34 HA ARG 34 -8.398 14.980 3.656 240 1HB ARG 34 1HB ARG 34 -5.822 15.706 2.258 241 2HB ARG 34 2HB ARG 34 -7.228 16.758 2.383 242 1HG ARG 34 1HG ARG 34 -6.993 16.441 4.915 243 2HG ARG 34 2HG ARG 34 -5.383 15.826 4.553 244 1HD ARG 34 1HD ARG 34 -6.416 18.516 3.667 245 2HD ARG 34 2HD ARG 34 -5.465 18.254 5.127 246 HE ARG 34 HE ARG 34 -4.116 17.197 2.871 247 1HH1 ARG 34 1HH1 ARG 34 -4.954 20.222 4.411 248 2HH1 ARG 34 2HH1 ARG 34 -3.578 21.071 3.784 249 1HH2 ARG 34 1HH2 ARG 34 -2.292 18.318 2.038 250 2HH2 ARG 34 2HH2 ARG 34 -2.068 19.998 2.462 251 H HIS 35 H HIS 35 -7.332 12.568 1.642 252 HA HIS 35 HA HIS 35 -9.211 13.456 -0.445 253 1HB HIS 35 1HB HIS 35 -6.589 12.039 -0.977 254 2HB HIS 35 2HB HIS 35 -7.798 12.449 -2.187 255 HD1 HIS 35 HD1 HIS 35 -8.315 15.248 -2.126 256 HD2 HIS 35 HD2 HIS 35 -4.597 13.826 -0.922 257 HE1 HIS 35 HE1 HIS 35 -6.742 17.214 -2.293 258 HE2 HIS 35 HE2 HIS 35 -4.549 16.369 -1.351 259 H ASN 36 H ASN 36 -7.347 10.634 0.641 260 HA ASN 36 HA ASN 36 -9.387 8.809 -0.295 261 1HB ASN 36 1HB ASN 36 -7.018 8.214 -0.531 262 2HB ASN 36 2HB ASN 36 -6.807 8.318 1.212 263 1HD2 ASN 36 1HD2 ASN 36 -6.173 6.220 1.471 264 2HD2 ASN 36 2HD2 ASN 36 -7.229 4.877 1.248 265 H VAL 37 H VAL 37 -11.090 9.592 1.052 266 HA VAL 37 HA VAL 37 -10.858 9.547 3.899 267 HB VAL 37 HB VAL 37 -13.367 9.668 2.217 268 1HG1 VAL 37 1HG1 VAL 37 -12.883 10.474 5.084 269 2HG1 VAL 37 2HG1 VAL 37 -13.828 9.088 4.537 270 3HG1 VAL 37 3HG1 VAL 37 -14.378 10.725 4.184 271 1HG2 VAL 37 1HG2 VAL 37 -11.662 11.902 3.310 272 2HG2 VAL 37 2HG2 VAL 37 -13.229 12.103 2.528 273 3HG2 VAL 37 3HG2 VAL 37 -11.861 11.469 1.613 274 H SER 38 H SER 38 -11.728 7.236 1.476 275 HA SER 38 HA SER 38 -12.916 5.479 3.474 276 1HB SER 38 1HB SER 38 -12.745 5.192 0.471 277 2HB SER 38 2HB SER 38 -13.592 4.089 1.555 278 HG SER 38 HG SER 38 -14.406 6.455 0.524 279 H HIS 39 H HIS 39 -10.896 4.618 0.662 280 HA HIS 39 HA HIS 39 -8.665 3.666 2.032 281 1HB HIS 39 1HB HIS 39 -9.057 1.274 2.169 282 2HB HIS 39 2HB HIS 39 -10.275 2.117 3.114 283 HD1 HIS 39 HD1 HIS 39 -12.642 2.465 1.686 284 HD2 HIS 39 HD2 HIS 39 -10.101 -0.611 0.543 285 HE1 HIS 39 HE1 HIS 39 -14.051 0.904 0.323 286 HE2 HIS 39 HE2 HIS 39 -12.562 -1.073 -0.116 287 H TYR 40 H TYR 40 -7.210 2.472 0.647 288 HA TYR 40 HA TYR 40 -8.110 2.346 -2.152 289 1HB TYR 40 1HB TYR 40 -5.955 3.078 -2.930 290 2HB TYR 40 2HB TYR 40 -6.539 4.249 -1.758 291 HD1 TYR 40 HD1 TYR 40 -5.472 4.420 0.458 292 HD2 TYR 40 HD2 TYR 40 -3.982 1.772 -2.521 293 HE1 TYR 40 HE1 TYR 40 -3.354 4.227 1.691 294 HE2 TYR 40 HE2 TYR 40 -1.861 1.567 -1.293 295 HH TYR 40 HH TYR 40 -1.490 2.586 1.889 296 H ILE 41 H ILE 41 -7.423 0.607 -3.362 297 HA ILE 41 HA ILE 41 -6.161 -1.557 -1.811 298 HB ILE 41 HB ILE 41 -7.970 -1.868 -4.218 299 1HG1 ILE 41 1HG1 ILE 41 -9.429 -3.009 -2.347 300 2HG1 ILE 41 2HG1 ILE 41 -8.519 -1.956 -1.272 301 1HG2 ILE 41 1HG2 ILE 41 -7.967 -4.249 -3.585 302 2HG2 ILE 41 2HG2 ILE 41 -6.773 -3.892 -2.337 303 3HG2 ILE 41 3HG2 ILE 41 -6.368 -3.660 -4.037 304 1HD1 ILE 41 1HD1 ILE 41 -10.645 -0.967 -1.896 305 2HD1 ILE 41 2HD1 ILE 41 -10.202 -1.058 -3.600 306 3HD1 ILE 41 3HD1 ILE 41 -9.298 -0.010 -2.509 307 H TYR 42 H TYR 42 -4.168 -1.939 -2.348 308 HA TYR 42 HA TYR 42 -3.170 -1.240 -5.015 309 1HB TYR 42 1HB TYR 42 -2.070 -0.383 -2.894 310 2HB TYR 42 2HB TYR 42 -1.609 -2.042 -2.548 311 HD1 TYR 42 HD1 TYR 42 -0.426 -3.191 -4.763 312 HD2 TYR 42 HD2 TYR 42 -0.399 0.930 -3.713 313 HE1 TYR 42 HE1 TYR 42 1.637 -2.883 -6.057 314 HE2 TYR 42 HE2 TYR 42 1.662 1.250 -5.018 315 HH TYR 42 HH TYR 42 2.818 -1.065 -7.218 316 H TYR 43 H TYR 43 -3.226 -2.898 -6.447 317 HA TYR 43 HA TYR 43 -2.893 -5.634 -5.469 318 1HB TYR 43 1HB TYR 43 -3.561 -4.588 -8.228 319 2HB TYR 43 2HB TYR 43 -3.438 -6.292 -7.805 320 HD1 TYR 43 HD1 TYR 43 -5.080 -7.246 -6.130 321 HD2 TYR 43 HD2 TYR 43 -5.551 -3.377 -7.845 322 HE1 TYR 43 HE1 TYR 43 -7.455 -7.255 -5.490 323 HE2 TYR 43 HE2 TYR 43 -7.927 -3.379 -7.211 324 HH TYR 43 HH TYR 43 -9.256 -5.664 -5.058 325 H LEU 44 H LEU 44 -0.846 -6.223 -5.171 326 HA LEU 44 HA LEU 44 1.316 -5.106 -6.679 327 1HB LEU 44 1HB LEU 44 1.209 -7.432 -4.757 328 2HB LEU 44 2HB LEU 44 2.685 -6.883 -5.523 329 HG LEU 44 HG LEU 44 2.085 -4.584 -4.434 330 1HD1 LEU 44 1HD1 LEU 44 0.499 -6.493 -2.728 331 2HD1 LEU 44 2HD1 LEU 44 -0.121 -5.119 -3.647 332 3HD1 LEU 44 3HD1 LEU 44 0.941 -4.850 -2.263 333 1HD2 LEU 44 1HD2 LEU 44 3.318 -5.229 -2.415 334 2HD2 LEU 44 2HD2 LEU 44 4.051 -5.883 -3.878 335 3HD2 LEU 44 3HD2 LEU 44 3.093 -6.928 -2.828 336 H ALA 45 H ALA 45 2.847 -6.454 -7.943 337 HA ALA 45 HA ALA 45 3.332 -7.758 -9.745 338 1HB ALA 45 1HB ALA 45 1.150 -9.555 -8.683 339 2HB ALA 45 2HB ALA 45 2.864 -9.650 -8.275 340 3HB ALA 45 3HB ALA 45 2.332 -9.984 -9.923 341 H THR 46 H THR 46 0.920 -5.845 -9.554 342 HA THR 46 HA THR 46 0.023 -6.268 -12.289 343 HB THR 46 HB THR 46 -2.036 -5.624 -10.190 344 HG1 THR 46 HG1 THR 46 -1.070 -7.705 -9.704 345 1HG2 THR 46 1HG2 THR 46 -3.571 -6.513 -11.895 346 2HG2 THR 46 2HG2 THR 46 -2.197 -6.838 -12.952 347 3HG2 THR 46 3HG2 THR 46 -2.606 -5.176 -12.524 348 H GLU 47 H GLU 47 0.192 -4.264 -9.406 349 HA GLU 47 HA GLU 47 0.794 -2.109 -9.121 350 1HB GLU 47 1HB GLU 47 1.131 -2.092 -12.125 351 2HB GLU 47 2HB GLU 47 1.568 -0.757 -11.065 352 1HG GLU 47 1HG GLU 47 2.722 -3.529 -10.882 353 2HG GLU 47 2HG GLU 47 3.477 -2.180 -11.724 354 H ASN 48 H ASN 48 -1.963 -3.123 -9.888 355 HA ASN 48 HA ASN 48 -3.220 -0.651 -10.769 356 1HB ASN 48 1HB ASN 48 -4.270 -3.416 -10.206 357 2HB ASN 48 2HB ASN 48 -5.357 -2.047 -10.414 358 1HD2 ASN 48 1HD2 ASN 48 -5.091 -4.440 -12.024 359 2HD2 ASN 48 2HD2 ASN 48 -4.704 -3.907 -13.627 360 H VAL 49 H VAL 49 -3.575 0.870 -9.331 361 HA VAL 49 HA VAL 49 -4.140 0.081 -6.544 362 HB VAL 49 HB VAL 49 -3.208 2.807 -7.440 363 1HG1 VAL 49 1HG1 VAL 49 -3.152 1.441 -4.751 364 2HG1 VAL 49 2HG1 VAL 49 -4.281 2.700 -5.254 365 3HG1 VAL 49 3HG1 VAL 49 -2.563 3.067 -5.100 366 1HG2 VAL 49 1HG2 VAL 49 -1.512 1.190 -8.111 367 2HG2 VAL 49 2HG2 VAL 49 -1.496 0.512 -6.483 368 3HG2 VAL 49 3HG2 VAL 49 -0.943 2.164 -6.755 369 H HIS 50 H HIS 50 -6.237 0.224 -6.056 370 HA HIS 50 HA HIS 50 -7.876 2.179 -7.530 371 1HB HIS 50 1HB HIS 50 -8.591 -0.412 -6.162 372 2HB HIS 50 2HB HIS 50 -9.815 0.770 -6.610 373 HD1 HIS 50 HD1 HIS 50 -10.973 -0.206 -8.578 374 HD2 HIS 50 HD2 HIS 50 -6.830 -0.564 -8.845 375 HE1 HIS 50 HE1 HIS 50 -10.516 -1.156 -10.862 376 HE2 HIS 50 HE2 HIS 50 -8.002 -1.186 -11.073 377 H ILE 51 H ILE 51 -7.869 4.031 -6.434 378 HA ILE 51 HA ILE 51 -8.094 4.022 -3.522 379 HB ILE 51 HB ILE 51 -7.764 6.348 -5.434 380 1HG1 ILE 51 1HG1 ILE 51 -5.496 6.477 -4.189 381 2HG1 ILE 51 2HG1 ILE 51 -5.816 4.806 -3.740 382 1HG2 ILE 51 1HG2 ILE 51 -7.693 6.301 -2.421 383 2HG2 ILE 51 2HG2 ILE 51 -8.947 7.027 -3.427 384 3HG2 ILE 51 3HG2 ILE 51 -7.313 7.694 -3.434 385 1HD1 ILE 51 1HD1 ILE 51 -5.619 5.864 -6.549 386 2HD1 ILE 51 2HD1 ILE 51 -5.912 4.187 -6.088 387 3HD1 ILE 51 3HD1 ILE 51 -4.375 4.956 -5.690 388 H VAL 52 H VAL 52 -10.067 3.957 -2.655 389 HA VAL 52 HA VAL 52 -12.317 5.068 -4.154 390 HB VAL 52 HB VAL 52 -12.377 3.597 -1.512 391 1HG1 VAL 52 1HG1 VAL 52 -14.766 3.257 -2.089 392 2HG1 VAL 52 2HG1 VAL 52 -14.546 4.327 -3.476 393 3HG1 VAL 52 3HG1 VAL 52 -14.339 4.949 -1.838 394 1HG2 VAL 52 1HG2 VAL 52 -11.473 2.146 -3.239 395 2HG2 VAL 52 2HG2 VAL 52 -12.827 2.537 -4.299 396 3HG2 VAL 52 3HG2 VAL 52 -13.107 1.642 -2.806 397 H LEU 53 H LEU 53 -12.698 7.155 -3.879 398 HA LEU 53 HA LEU 53 -11.590 8.648 -1.719 399 1HB LEU 53 1HB LEU 53 -13.626 9.452 -3.797 400 2HB LEU 53 2HB LEU 53 -12.771 10.553 -2.736 401 HG LEU 53 HG LEU 53 -11.530 8.845 -4.893 402 1HD1 LEU 53 1HD1 LEU 53 -11.057 11.003 -5.955 403 2HD1 LEU 53 2HD1 LEU 53 -11.950 11.821 -4.671 404 3HD1 LEU 53 3HD1 LEU 53 -12.788 10.723 -5.770 405 1HD2 LEU 53 1HD2 LEU 53 -10.032 9.088 -2.981 406 2HD2 LEU 53 2HD2 LEU 53 -10.258 10.838 -3.017 407 3HD2 LEU 53 3HD2 LEU 53 -9.456 10.022 -4.361 408 H LYS 54 H LYS 54 -13.553 10.500 -1.145 409 HA LYS 54 HA LYS 54 -14.833 9.445 1.082 410 1HB LYS 54 1HB LYS 54 -14.374 11.838 0.678 411 2HB LYS 54 2HB LYS 54 -15.612 11.862 -0.565 412 1HG LYS 54 1HG LYS 54 -17.150 11.035 1.371 413 2HG LYS 54 2HG LYS 54 -15.886 11.720 2.391 414 1HD LYS 54 1HD LYS 54 -17.606 13.121 0.358 415 2HD LYS 54 2HD LYS 54 -17.484 13.439 2.087 416 1HE LYS 54 1HE LYS 54 -16.203 15.156 1.306 417 2HE LYS 54 2HE LYS 54 -14.957 13.921 1.449 418 1HZ LYS 54 1HZ LYS 54 -15.317 13.423 -0.947 419 2HZ LYS 54 2HZ LYS 54 -14.744 14.992 -0.663 420 3HZ LYS 54 3HZ LYS 54 -16.378 14.743 -1.033 421 H ASN 55 H ASN 55 -16.722 10.868 -1.519 422 HA ASN 55 HA ASN 55 -18.337 8.444 -1.836 423 1HB ASN 55 1HB ASN 55 -19.419 11.193 -1.155 424 2HB ASN 55 2HB ASN 55 -20.407 9.939 -1.884 425 1HD2 ASN 55 1HD2 ASN 55 -19.086 7.818 -0.312 426 2HD2 ASN 55 2HD2 ASN 55 -19.726 7.966 1.285 427 H ASP 56 H ASP 56 -16.282 10.142 -3.191 428 HA ASP 56 HA ASP 56 -17.689 11.589 -5.254 429 1HB ASP 56 1HB ASP 56 -14.707 11.223 -4.855 430 2HB ASP 56 2HB ASP 56 -15.490 12.427 -5.874 431 H ASN 57 H ASN 57 -14.813 9.522 -5.632 432 HA ASN 57 HA ASN 57 -16.192 7.707 -7.386 433 1HB ASN 57 1HB ASN 57 -15.097 8.238 -9.433 434 2HB ASN 57 2HB ASN 57 -15.742 9.756 -8.817 435 1HD2 ASN 57 1HD2 ASN 57 -12.925 7.996 -9.688 436 2HD2 ASN 57 2HD2 ASN 57 -11.784 9.272 -9.437 437 H THR 58 H THR 58 -14.528 6.200 -8.474 438 HA THR 58 HA THR 58 -12.429 5.603 -6.504 439 HB THR 58 HB THR 58 -13.424 3.812 -8.730 440 HG1 THR 58 HG1 THR 58 -14.772 4.568 -6.624 441 1HG2 THR 58 1HG2 THR 58 -11.213 3.243 -7.831 442 2HG2 THR 58 2HG2 THR 58 -12.413 2.030 -7.384 443 3HG2 THR 58 3HG2 THR 58 -11.879 3.222 -6.199 444 H VAL 59 H VAL 59 -10.357 5.926 -7.009 445 HA VAL 59 HA VAL 59 -9.699 6.679 -9.773 446 HB VAL 59 HB VAL 59 -7.931 6.970 -7.343 447 1HG1 VAL 59 1HG1 VAL 59 -7.932 8.324 -10.037 448 2HG1 VAL 59 2HG1 VAL 59 -6.786 7.107 -9.476 449 3HG1 VAL 59 3HG1 VAL 59 -6.833 8.694 -8.706 450 1HG2 VAL 59 1HG2 VAL 59 -9.956 8.183 -6.866 451 2HG2 VAL 59 2HG2 VAL 59 -9.916 8.946 -8.456 452 3HG2 VAL 59 3HG2 VAL 59 -8.674 9.328 -7.263 453 H LEU 60 H LEU 60 -8.840 5.118 -11.010 454 HA LEU 60 HA LEU 60 -7.396 2.951 -9.673 455 1HB LEU 60 1HB LEU 60 -7.714 1.638 -11.704 456 2HB LEU 60 2HB LEU 60 -9.239 2.184 -11.044 457 HG LEU 60 HG LEU 60 -7.918 3.640 -13.320 458 1HD1 LEU 60 1HD1 LEU 60 -9.278 2.312 -14.853 459 2HD1 LEU 60 2HD1 LEU 60 -9.835 1.319 -13.505 460 3HD1 LEU 60 3HD1 LEU 60 -8.134 1.295 -13.973 461 1HD2 LEU 60 1HD2 LEU 60 -9.741 4.784 -12.156 462 2HD2 LEU 60 2HD2 LEU 60 -10.789 3.392 -12.422 463 3HD2 LEU 60 3HD2 LEU 60 -10.211 4.336 -13.795 464 H LEU 61 H LEU 61 -5.313 3.192 -9.578 465 HA LEU 61 HA LEU 61 -3.896 4.681 -11.668 466 1HB LEU 61 1HB LEU 61 -2.752 3.585 -9.106 467 2HB LEU 61 2HB LEU 61 -2.055 4.804 -10.149 468 HG LEU 61 HG LEU 61 -4.474 5.138 -8.382 469 1HD1 LEU 61 1HD1 LEU 61 -3.058 6.701 -7.169 470 2HD1 LEU 61 2HD1 LEU 61 -1.713 6.329 -8.247 471 3HD1 LEU 61 3HD1 LEU 61 -2.359 5.082 -7.181 472 1HD2 LEU 61 1HD2 LEU 61 -3.135 7.107 -10.223 473 2HD2 LEU 61 2HD2 LEU 61 -4.411 7.483 -9.065 474 3HD2 LEU 61 3HD2 LEU 61 -4.744 6.414 -10.428 475 H LYS 62 H LYS 62 -2.185 3.762 -12.818 476 HA LYS 62 HA LYS 62 -1.613 0.941 -12.254 477 1HB LYS 62 1HB LYS 62 -1.167 0.550 -14.621 478 2HB LYS 62 2HB LYS 62 -2.817 1.098 -14.387 479 1HG LYS 62 1HG LYS 62 -2.336 3.234 -15.274 480 2HG LYS 62 2HG LYS 62 -0.595 2.952 -15.196 481 1HD LYS 62 1HD LYS 62 -0.869 1.130 -16.859 482 2HD LYS 62 2HD LYS 62 -2.576 1.560 -16.996 483 1HE LYS 62 1HE LYS 62 -2.004 3.759 -17.796 484 2HE LYS 62 2HE LYS 62 -0.287 3.447 -17.534 485 1HZ LYS 62 1HZ LYS 62 -2.027 1.982 -19.452 486 2HZ LYS 62 2HZ LYS 62 -0.364 1.740 -19.226 487 3HZ LYS 62 3HZ LYS 62 -0.927 3.208 -19.865 488 H GLY 63 H GLY 63 0.390 0.641 -11.578 489 1HA GLY 63 1HA GLY 63 2.344 2.694 -11.542 490 2HA GLY 63 2HA GLY 63 2.628 0.999 -11.166 491 H LEU 64 H LEU 64 2.679 -0.462 -13.118 492 HA LEU 64 HA LEU 64 3.651 0.887 -15.529 493 1HB LEU 64 1HB LEU 64 5.065 -1.346 -14.072 494 2HB LEU 64 2HB LEU 64 5.416 -0.906 -15.731 495 HG LEU 64 HG LEU 64 5.737 0.943 -13.361 496 1HD1 LEU 64 1HD1 LEU 64 8.134 0.608 -13.660 497 2HD1 LEU 64 2HD1 LEU 64 7.821 -0.563 -14.941 498 3HD1 LEU 64 3HD1 LEU 64 7.328 -0.916 -13.284 499 1HD2 LEU 64 1HD2 LEU 64 6.951 2.356 -14.945 500 2HD2 LEU 64 2HD2 LEU 64 5.279 2.114 -15.452 501 3HD2 LEU 64 3HD2 LEU 64 6.579 1.224 -16.245 502 H LYS 65 H LYS 65 3.453 -2.503 -14.449 503 HA LYS 65 HA LYS 65 1.108 -3.149 -15.855 504 1HB LYS 65 1HB LYS 65 2.528 -2.691 -17.831 505 2HB LYS 65 2HB LYS 65 3.659 -3.925 -17.284 506 1HG LYS 65 1HG LYS 65 1.761 -5.570 -17.419 507 2HG LYS 65 2HG LYS 65 0.828 -4.308 -18.224 508 1HD LYS 65 1HD LYS 65 2.588 -4.153 -19.948 509 2HD LYS 65 2HD LYS 65 3.439 -5.487 -19.164 510 1HE LYS 65 1HE LYS 65 1.405 -6.885 -19.490 511 2HE LYS 65 2HE LYS 65 0.701 -5.562 -20.421 512 1HZ LYS 65 1HZ LYS 65 3.152 -7.102 -21.081 513 2HZ LYS 65 2HZ LYS 65 2.639 -5.722 -21.927 514 3HZ LYS 65 3HZ LYS 65 1.676 -7.121 -21.919 515 H ASN 66 H ASN 66 4.312 -4.663 -15.371 516 HA ASN 66 HA ASN 66 2.906 -7.021 -14.344 517 1HB ASN 66 1HB ASN 66 4.264 -7.447 -16.316 518 2HB ASN 66 2HB ASN 66 5.676 -6.759 -15.525 519 1HD2 ASN 66 1HD2 ASN 66 3.479 -9.484 -15.616 520 2HD2 ASN 66 2HD2 ASN 66 4.504 -10.576 -14.745 521 H ILE 67 H ILE 67 6.283 -6.119 -13.812 522 HA ILE 67 HA ILE 67 7.565 -6.387 -11.950 523 HB ILE 67 HB ILE 67 5.353 -4.781 -10.636 524 1HG1 ILE 67 1HG1 ILE 67 7.097 -2.893 -11.107 525 2HG1 ILE 67 2HG1 ILE 67 7.700 -3.993 -12.340 526 1HG2 ILE 67 1HG2 ILE 67 6.857 -5.760 -9.004 527 2HG2 ILE 67 2HG2 ILE 67 7.125 -4.020 -9.106 528 3HG2 ILE 67 3HG2 ILE 67 8.253 -5.133 -9.881 529 1HD1 ILE 67 1HD1 ILE 67 6.176 -2.376 -13.290 530 2HD1 ILE 67 2HD1 ILE 67 4.912 -2.880 -12.171 531 3HD1 ILE 67 3HD1 ILE 67 5.499 -4.001 -13.400 532 H VAL 68 H VAL 68 6.800 -8.715 -12.178 533 HA VAL 68 HA VAL 68 4.999 -9.648 -10.150 534 HB VAL 68 HB VAL 68 5.051 -10.836 -12.248 535 1HG1 VAL 68 1HG1 VAL 68 7.343 -10.442 -12.923 536 2HG1 VAL 68 2HG1 VAL 68 6.972 -12.165 -12.973 537 3HG1 VAL 68 3HG1 VAL 68 7.924 -11.507 -11.643 538 1HG2 VAL 68 1HG2 VAL 68 6.150 -12.523 -10.002 539 2HG2 VAL 68 2HG2 VAL 68 5.326 -13.141 -11.433 540 3HG2 VAL 68 3HG2 VAL 68 4.457 -12.124 -10.284 541 H SER 69 H SER 69 5.997 -8.797 -8.305 542 HA SER 69 HA SER 69 8.452 -10.167 -7.452 543 1HB SER 69 1HB SER 69 8.464 -7.690 -7.335 544 2HB SER 69 2HB SER 69 7.072 -7.746 -6.254 545 HG SER 69 HG SER 69 8.628 -9.246 -5.013 546 H VAL 70 H VAL 70 5.234 -10.576 -7.346 547 HA VAL 70 HA VAL 70 4.950 -11.250 -4.547 548 HB VAL 70 HB VAL 70 2.983 -11.558 -6.827 549 1HG1 VAL 70 1HG1 VAL 70 2.549 -13.163 -5.027 550 2HG1 VAL 70 2HG1 VAL 70 1.295 -11.925 -5.096 551 3HG1 VAL 70 3HG1 VAL 70 2.543 -11.848 -3.853 552 1HG2 VAL 70 1HG2 VAL 70 3.482 -9.231 -6.359 553 2HG2 VAL 70 2HG2 VAL 70 3.179 -9.489 -4.641 554 3HG2 VAL 70 3HG2 VAL 70 1.856 -9.628 -5.799 555 H LYS 71 H LYS 71 5.209 -13.179 -3.710 556 HA LYS 71 HA LYS 71 5.458 -15.488 -5.521 557 1HB LYS 71 1HB LYS 71 7.393 -14.669 -3.913 558 2HB LYS 71 2HB LYS 71 6.447 -15.501 -2.689 559 1HG LYS 71 1HG LYS 71 8.161 -16.968 -3.519 560 2HG LYS 71 2HG LYS 71 6.582 -17.569 -4.034 561 1HD LYS 71 1HD LYS 71 6.899 -16.616 -6.237 562 2HD LYS 71 2HD LYS 71 8.430 -15.897 -5.737 563 1HE LYS 71 1HE LYS 71 8.797 -17.921 -7.042 564 2HE LYS 71 2HE LYS 71 9.364 -18.134 -5.388 565 1HZ LYS 71 1HZ LYS 71 8.052 -20.021 -6.378 566 2HZ LYS 71 2HZ LYS 71 6.684 -19.028 -6.270 567 3HZ LYS 71 3HZ LYS 71 7.523 -19.468 -4.864 568 H PHE 72 H PHE 72 4.297 -17.402 -4.956 569 HA PHE 72 HA PHE 72 1.864 -16.912 -3.557 570 1HB PHE 72 1HB PHE 72 2.920 -18.992 -5.251 571 2HB PHE 72 2HB PHE 72 2.141 -19.693 -3.835 572 HD1 PHE 72 HD1 PHE 72 -0.232 -19.384 -3.440 573 HD2 PHE 72 HD2 PHE 72 1.657 -17.774 -6.895 574 HE1 PHE 72 HE1 PHE 72 -2.437 -19.033 -4.475 575 HE2 PHE 72 HE2 PHE 72 -0.542 -17.416 -7.936 576 HZ PHE 72 HZ PHE 72 -2.593 -18.045 -6.727 577 H SER 73 H SER 73 2.572 -16.263 -1.520 578 HA SER 73 HA SER 73 3.179 -18.499 0.284 579 1HB SER 73 1HB SER 73 4.357 -15.728 0.603 580 2HB SER 73 2HB SER 73 4.758 -17.178 1.522 581 HG SER 73 HG SER 73 5.971 -16.294 -0.599 582 H LYS 74 H LYS 74 2.541 -18.010 2.541 583 HA LYS 74 HA LYS 74 0.566 -15.849 2.791 584 1HB LYS 74 1HB LYS 74 0.137 -18.724 3.652 585 2HB LYS 74 2HB LYS 74 -0.957 -17.392 3.996 586 1HG LYS 74 1HG LYS 74 -1.451 -17.120 1.661 587 2HG LYS 74 2HG LYS 74 -0.231 -18.314 1.225 588 1HD LYS 74 1HD LYS 74 -2.422 -19.318 1.108 589 2HD LYS 74 2HD LYS 74 -1.515 -20.030 2.441 590 1HE LYS 74 1HE LYS 74 -2.691 -18.601 4.023 591 2HE LYS 74 2HE LYS 74 -3.579 -17.847 2.700 592 1HZ LYS 74 1HZ LYS 74 -4.579 -19.987 2.199 593 2HZ LYS 74 2HZ LYS 74 -4.892 -19.546 3.809 594 3HZ LYS 74 3HZ LYS 74 -3.713 -20.718 3.462 595 H ASP 75 H ASP 75 2.878 -15.277 3.725 596 HA ASP 75 HA ASP 75 3.138 -16.364 6.448 597 1HB ASP 75 1HB ASP 75 5.035 -16.830 4.925 598 2HB ASP 75 2HB ASP 75 5.283 -15.099 4.730 599 H ARG 76 H ARG 76 2.049 -15.022 7.728 600 HA ARG 76 HA ARG 76 2.005 -12.197 7.547 601 1HB ARG 76 1HB ARG 76 0.258 -13.026 8.809 602 2HB ARG 76 2HB ARG 76 1.257 -14.243 9.590 603 1HG ARG 76 1HG ARG 76 2.311 -12.455 10.928 604 2HG ARG 76 2HG ARG 76 1.199 -11.299 10.198 605 1HD ARG 76 1HD ARG 76 -0.669 -12.293 11.206 606 2HD ARG 76 2HD ARG 76 0.221 -13.761 11.607 607 HE ARG 76 HE ARG 76 0.502 -11.162 12.966 608 1HH1 ARG 76 1HH1 ARG 76 0.945 -14.629 12.878 609 2HH1 ARG 76 2HH1 ARG 76 1.481 -14.738 14.522 610 1HH2 ARG 76 1HH2 ARG 76 1.204 -11.288 15.144 611 2HH2 ARG 76 2HH2 ARG 76 1.617 -12.841 15.817 612 H HIS 77 H HIS 77 4.100 -14.498 9.088 613 HA HIS 77 HA HIS 77 5.525 -12.982 10.882 614 1HB HIS 77 1HB HIS 77 6.116 -15.175 11.008 615 2HB HIS 77 2HB HIS 77 6.006 -15.414 9.275 616 HD1 HIS 77 HD1 HIS 77 8.124 -15.243 7.918 617 HD2 HIS 77 HD2 HIS 77 8.666 -14.310 11.938 618 HE1 HIS 77 HE1 HIS 77 10.620 -15.185 8.275 619 HE2 HIS 77 HE2 HIS 77 10.909 -14.831 10.756 620 H LEU 78 H LEU 78 6.345 -13.426 7.416 621 HA LEU 78 HA LEU 78 8.582 -11.709 7.492 622 1HB LEU 78 1HB LEU 78 8.155 -13.391 5.720 623 2HB LEU 78 2HB LEU 78 6.847 -12.392 5.116 624 HG LEU 78 HG LEU 78 8.451 -10.611 4.568 625 1HD1 LEU 78 1HD1 LEU 78 10.115 -11.073 6.293 626 2HD1 LEU 78 2HD1 LEU 78 10.852 -11.044 4.692 627 3HD1 LEU 78 3HD1 LEU 78 10.537 -12.584 5.491 628 1HD2 LEU 78 1HD2 LEU 78 7.883 -12.289 2.885 629 2HD2 LEU 78 2HD2 LEU 78 9.209 -13.306 3.446 630 3HD2 LEU 78 3HD2 LEU 78 9.550 -11.742 2.706 631 H ILE 79 H ILE 79 5.176 -11.128 6.843 632 HA ILE 79 HA ILE 79 5.296 -8.508 5.876 633 HB ILE 79 HB ILE 79 3.174 -9.701 7.675 634 1HG1 ILE 79 1HG1 ILE 79 3.315 -9.607 4.650 635 2HG1 ILE 79 2HG1 ILE 79 3.607 -11.040 5.632 636 1HG2 ILE 79 1HG2 ILE 79 3.026 -7.372 5.762 637 2HG2 ILE 79 2HG2 ILE 79 3.034 -7.267 7.523 638 3HG2 ILE 79 3HG2 ILE 79 1.683 -8.037 6.690 639 1HD1 ILE 79 1HD1 ILE 79 1.312 -10.971 6.429 640 2HD1 ILE 79 2HD1 ILE 79 1.373 -11.038 4.669 641 3HD1 ILE 79 3HD1 ILE 79 1.019 -9.515 5.481 642 H GLU 80 H GLU 80 4.832 -9.633 9.222 643 HA GLU 80 HA GLU 80 4.817 -7.070 10.390 644 1HB GLU 80 1HB GLU 80 3.877 -9.018 11.502 645 2HB GLU 80 2HB GLU 80 5.468 -9.759 11.599 646 1HG GLU 80 1HG GLU 80 6.219 -7.991 13.085 647 2HG GLU 80 2HG GLU 80 4.641 -7.209 12.966 648 H THR 81 H THR 81 7.420 -9.472 10.052 649 HA THR 81 HA THR 81 9.401 -8.061 11.430 650 HB THR 81 HB THR 81 9.758 -9.955 9.092 651 HG1 THR 81 HG1 THR 81 8.861 -10.346 11.607 652 1HG2 THR 81 1HG2 THR 81 11.790 -8.666 9.607 653 2HG2 THR 81 2HG2 THR 81 11.977 -10.370 10.022 654 3HG2 THR 81 3HG2 THR 81 11.681 -9.180 11.290 655 H THR 82 H THR 82 8.352 -7.857 8.062 656 HA THR 82 HA THR 82 10.427 -6.073 7.262 657 HB THR 82 HB THR 82 7.745 -6.604 5.971 658 HG1 THR 82 HG1 THR 82 8.816 -8.488 5.851 659 1HG2 THR 82 1HG2 THR 82 8.755 -5.719 3.931 660 2HG2 THR 82 2HG2 THR 82 10.249 -5.373 4.804 661 3HG2 THR 82 3HG2 THR 82 8.773 -4.500 5.202 662 H SER 83 H SER 83 7.087 -5.624 8.393 663 HA SER 83 HA SER 83 6.968 -2.832 8.045 664 1HB SER 83 1HB SER 83 5.010 -4.326 8.572 665 2HB SER 83 2HB SER 83 5.602 -4.428 10.231 666 HG SER 83 HG SER 83 4.130 -2.779 10.214 667 H ASN 84 H ASN 84 8.151 -4.839 10.684 668 HA ASN 84 HA ASN 84 8.701 -2.752 12.494 669 1HB ASN 84 1HB ASN 84 8.571 -5.107 13.183 670 2HB ASN 84 2HB ASN 84 10.026 -5.462 12.258 671 1HD2 ASN 84 1HD2 ASN 84 12.003 -4.973 13.103 672 2HD2 ASN 84 2HD2 ASN 84 12.225 -4.359 14.705 673 H LYS 85 H LYS 85 10.534 -4.100 9.817 674 HA LYS 85 HA LYS 85 13.023 -2.899 10.427 675 1HB LYS 85 1HB LYS 85 12.693 -4.718 8.731 676 2HB LYS 85 2HB LYS 85 11.938 -3.533 7.672 677 1HG LYS 85 1HG LYS 85 14.144 -2.210 7.978 678 2HG LYS 85 2HG LYS 85 14.794 -3.754 8.526 679 1HD LYS 85 1HD LYS 85 13.497 -3.217 5.856 680 2HD LYS 85 2HD LYS 85 15.222 -3.411 6.149 681 1HE LYS 85 1HE LYS 85 14.768 -5.712 6.961 682 2HE LYS 85 2HE LYS 85 13.079 -5.497 6.503 683 1HZ LYS 85 1HZ LYS 85 15.436 -5.466 4.702 684 2HZ LYS 85 2HZ LYS 85 13.868 -5.048 4.204 685 3HZ LYS 85 3HZ LYS 85 14.197 -6.623 4.750 686 H LEU 86 H LEU 86 10.309 -1.877 8.408 687 HA LEU 86 HA LEU 86 11.417 0.612 7.613 688 1HB LEU 86 1HB LEU 86 9.593 -0.464 6.394 689 2HB LEU 86 2HB LEU 86 8.546 -0.316 7.791 690 HG LEU 86 HG LEU 86 8.669 2.161 7.571 691 1HD1 LEU 86 1HD1 LEU 86 9.511 3.085 5.446 692 2HD1 LEU 86 2HD1 LEU 86 10.154 1.494 5.037 693 3HD1 LEU 86 3HD1 LEU 86 10.787 2.368 6.433 694 1HD2 LEU 86 1HD2 LEU 86 7.705 0.694 5.115 695 2HD2 LEU 86 2HD2 LEU 86 7.190 2.299 5.634 696 3HD2 LEU 86 3HD2 LEU 86 6.806 0.888 6.619 697 H LYS 87 H LYS 87 9.354 -0.422 10.249 698 HA LYS 87 HA LYS 87 8.787 2.136 11.319 699 1HB LYS 87 1HB LYS 87 7.569 -0.052 11.713 700 2HB LYS 87 2HB LYS 87 8.868 -0.488 12.807 701 1HG LYS 87 1HG LYS 87 8.312 1.362 14.261 702 2HG LYS 87 2HG LYS 87 7.071 1.908 13.125 703 1HD LYS 87 1HD LYS 87 5.951 -0.309 13.411 704 2HD LYS 87 2HD LYS 87 7.116 -0.677 14.685 705 1HE LYS 87 1HE LYS 87 6.327 1.225 15.982 706 2HE LYS 87 2HE LYS 87 5.210 1.666 14.689 707 1HZ LYS 87 1HZ LYS 87 5.119 -0.739 16.418 708 2HZ LYS 87 2HZ LYS 87 4.189 -0.589 15.006 709 3HZ LYS 87 3HZ LYS 87 3.963 0.495 16.293 710 H SER 88 H SER 88 11.550 0.128 11.438 711 HA SER 88 HA SER 88 12.599 1.346 13.858 712 1HB SER 88 1HB SER 88 12.888 -1.063 13.605 713 2HB SER 88 2HB SER 88 13.736 -0.825 12.079 714 HG SER 88 HG SER 88 14.595 -0.337 14.701 715 H ARG 89 H ARG 89 13.758 0.896 10.468 716 HA ARG 89 HA ARG 89 15.723 3.008 11.036 717 1HB ARG 89 1HB ARG 89 15.621 1.008 8.775 718 2HB ARG 89 2HB ARG 89 16.901 2.179 9.034 719 1HG ARG 89 1HG ARG 89 17.497 1.111 11.123 720 2HG ARG 89 2HG ARG 89 16.160 -0.028 10.939 721 1HD ARG 89 1HD ARG 89 17.189 -0.846 8.849 722 2HD ARG 89 2HD ARG 89 18.550 0.243 9.117 723 HE ARG 89 HE ARG 89 18.777 -1.067 11.306 724 1HH1 ARG 89 1HH1 ARG 89 17.780 -2.412 8.231 725 2HH1 ARG 89 2HH1 ARG 89 18.242 -4.038 8.648 726 1HH2 ARG 89 1HH2 ARG 89 19.449 -3.198 11.829 727 2HH2 ARG 89 2HH2 ARG 89 19.220 -4.467 10.669 728 H GLU 90 H GLU 90 14.334 2.036 7.920 729 HA GLU 90 HA GLU 90 12.714 4.141 7.303 730 1HB GLU 90 1HB GLU 90 14.363 5.550 5.867 731 2HB GLU 90 2HB GLU 90 14.245 5.855 7.589 732 1HG GLU 90 1HG GLU 90 16.509 5.906 7.256 733 2HG GLU 90 2HG GLU 90 16.261 4.239 7.764 734 H ILE 91 H ILE 91 15.456 2.345 5.991 735 HA ILE 91 HA ILE 91 15.876 1.498 3.925 736 HB ILE 91 HB ILE 91 14.241 -0.285 3.244 737 1HG1 ILE 91 1HG1 ILE 91 12.846 0.456 5.829 738 2HG1 ILE 91 2HG1 ILE 91 12.210 0.816 4.228 739 1HG2 ILE 91 1HG2 ILE 91 16.148 -0.743 4.638 740 2HG2 ILE 91 2HG2 ILE 91 14.767 -1.692 5.190 741 3HG2 ILE 91 3HG2 ILE 91 15.255 -0.248 6.075 742 1HD1 ILE 91 1HD1 ILE 91 11.164 -1.159 5.152 743 2HD1 ILE 91 2HD1 ILE 91 12.739 -1.925 5.346 744 3HD1 ILE 91 3HD1 ILE 91 12.121 -1.575 3.731 745 H THR 92 H THR 92 13.008 0.783 2.520 746 HA THR 92 HA THR 92 12.394 3.353 1.378 747 HB THR 92 HB THR 92 12.633 1.967 -0.967 748 HG1 THR 92 HG1 THR 92 14.935 1.363 0.602 749 1HG2 THR 92 1HG2 THR 92 13.265 4.286 -0.657 750 2HG2 THR 92 2HG2 THR 92 14.582 3.403 -1.427 751 3HG2 THR 92 3HG2 THR 92 14.674 3.805 0.288 752 H PHE 93 H PHE 93 10.461 3.292 0.102 753 HA PHE 93 HA PHE 93 8.490 1.545 1.079 754 1HB PHE 93 1HB PHE 93 8.049 3.821 0.171 755 2HB PHE 93 2HB PHE 93 8.417 3.218 -1.441 756 HD1 PHE 93 HD1 PHE 93 6.021 3.065 1.345 757 HD2 PHE 93 HD2 PHE 93 6.823 1.974 -2.692 758 HE1 PHE 93 HE1 PHE 93 3.662 2.441 1.046 759 HE2 PHE 93 HE2 PHE 93 4.466 1.344 -2.994 760 HZ PHE 93 HZ PHE 93 2.880 1.579 -1.122 761 H GLN 94 H GLN 94 10.492 1.479 -1.792 762 HA GLN 94 HA GLN 94 9.111 -0.601 -3.139 763 1HB GLN 94 1HB GLN 94 10.707 0.996 -4.213 764 2HB GLN 94 2HB GLN 94 12.024 0.162 -3.404 765 1HG GLN 94 1HG GLN 94 11.463 -1.892 -4.599 766 2HG GLN 94 2HG GLN 94 10.134 -1.057 -5.400 767 1HE2 GLN 94 1HE2 GLN 94 13.568 -1.408 -5.173 768 2HE2 GLN 94 2HE2 GLN 94 13.962 -0.568 -6.633 769 H GLU 95 H GLU 95 11.876 -0.548 -0.939 770 HA GLU 95 HA GLU 95 12.486 -3.296 -0.943 771 1HB GLU 95 1HB GLU 95 13.577 -1.110 0.214 772 2HB GLU 95 2HB GLU 95 12.720 -1.762 1.600 773 1HG GLU 95 1HG GLU 95 14.723 -3.289 -0.042 774 2HG GLU 95 2HG GLU 95 15.092 -2.446 1.457 775 H TYR 96 H TYR 96 10.426 -1.329 1.152 776 HA TYR 96 HA TYR 96 9.394 -3.306 2.803 777 1HB TYR 96 1HB TYR 96 9.121 -0.880 3.157 778 2HB TYR 96 2HB TYR 96 8.018 -0.808 1.790 779 HD1 TYR 96 HD1 TYR 96 8.403 -2.805 4.917 780 HD2 TYR 96 HD2 TYR 96 5.786 -0.691 2.327 781 HE1 TYR 96 HE1 TYR 96 6.535 -3.273 6.436 782 HE2 TYR 96 HE2 TYR 96 3.906 -1.147 3.843 783 HH TYR 96 HH TYR 96 3.283 -2.763 5.596 784 H ARG 97 H ARG 97 8.197 -2.120 -0.312 785 HA ARG 97 HA ARG 97 5.851 -3.688 -0.372 786 1HB ARG 97 1HB ARG 97 6.248 -1.639 -1.736 787 2HB ARG 97 2HB ARG 97 7.409 -2.538 -2.699 788 1HG ARG 97 1HG ARG 97 5.575 -4.100 -3.334 789 2HG ARG 97 2HG ARG 97 4.448 -3.030 -2.499 790 1HD ARG 97 1HD ARG 97 4.372 -2.461 -4.808 791 2HD ARG 97 2HD ARG 97 5.254 -1.174 -3.985 792 HE ARG 97 HE ARG 97 7.253 -2.757 -4.802 793 1HH1 ARG 97 1HH1 ARG 97 4.482 -1.455 -6.491 794 2HH1 ARG 97 2HH1 ARG 97 5.229 -1.528 -8.065 795 1HH2 ARG 97 1HH2 ARG 97 8.274 -2.796 -6.875 796 2HH2 ARG 97 2HH2 ARG 97 7.390 -2.262 -8.264 797 H ARG 98 H ARG 98 9.118 -4.238 -1.571 798 HA ARG 98 HA ARG 98 8.591 -6.482 -3.162 799 1HB ARG 98 1HB ARG 98 10.685 -5.289 -3.357 800 2HB ARG 98 2HB ARG 98 11.107 -5.679 -1.696 801 1HG ARG 98 1HG ARG 98 11.310 -8.015 -2.250 802 2HG ARG 98 2HG ARG 98 10.760 -7.704 -3.896 803 1HD ARG 98 1HD ARG 98 13.246 -6.520 -2.677 804 2HD ARG 98 2HD ARG 98 13.227 -7.977 -3.667 805 HE ARG 98 HE ARG 98 12.822 -5.229 -4.569 806 1HH1 ARG 98 1HH1 ARG 98 12.897 -8.654 -5.333 807 2HH1 ARG 98 2HH1 ARG 98 13.032 -8.400 -7.050 808 1HH2 ARG 98 1HH2 ARG 98 13.056 -4.891 -6.825 809 2HH2 ARG 98 2HH2 ARG 98 13.133 -6.255 -7.900 810 H ASN 99 H ASN 99 9.543 -6.269 0.256 811 HA ASN 99 HA ASN 99 9.697 -9.072 0.649 812 1HB ASN 99 1HB ASN 99 9.350 -6.802 2.604 813 2HB ASN 99 2HB ASN 99 9.505 -8.481 3.103 814 1HD2 ASN 99 1HD2 ASN 99 11.109 -5.731 1.755 815 2HD2 ASN 99 2HD2 ASN 99 12.722 -6.339 1.884 816 H LEU 100 H LEU 100 7.101 -6.721 1.031 817 HA LEU 100 HA LEU 100 5.193 -8.382 2.236 818 1HB LEU 100 1HB LEU 100 4.916 -6.063 0.330 819 2HB LEU 100 2HB LEU 100 3.529 -6.869 1.040 820 HG LEU 100 HG LEU 100 5.712 -5.560 2.666 821 1HD1 LEU 100 1HD1 LEU 100 4.558 -3.894 1.317 822 2HD1 LEU 100 2HD1 LEU 100 4.110 -3.750 3.017 823 3HD1 LEU 100 3HD1 LEU 100 3.001 -4.508 1.873 824 1HD2 LEU 100 1HD2 LEU 100 4.092 -5.735 4.471 825 2HD2 LEU 100 2HD2 LEU 100 4.453 -7.327 3.802 826 3HD2 LEU 100 3HD2 LEU 100 2.944 -6.514 3.383 827 H ALA 101 H ALA 101 5.847 -7.744 -1.179 828 HA ALA 101 HA ALA 101 3.903 -9.456 -2.251 829 1HB ALA 101 1HB ALA 101 6.557 -8.621 -3.414 830 2HB ALA 101 2HB ALA 101 5.041 -7.727 -3.538 831 3HB ALA 101 3HB ALA 101 5.203 -9.302 -4.315 832 H LYS 102 H LYS 102 7.224 -10.025 -1.228 833 HA LYS 102 HA LYS 102 7.414 -12.684 -2.209 834 1HB LYS 102 1HB LYS 102 9.322 -11.146 -1.593 835 2HB LYS 102 2HB LYS 102 8.944 -11.471 0.094 836 1HG LYS 102 1HG LYS 102 9.388 -13.848 -0.264 837 2HG LYS 102 2HG LYS 102 9.770 -13.516 -1.958 838 1HD LYS 102 1HD LYS 102 11.556 -11.953 -1.159 839 2HD LYS 102 2HD LYS 102 11.244 -12.526 0.479 840 1HE LYS 102 1HE LYS 102 12.118 -14.229 -1.850 841 2HE LYS 102 2HE LYS 102 13.151 -13.672 -0.538 842 1HZ LYS 102 1HZ LYS 102 10.793 -15.454 -0.228 843 2HZ LYS 102 2HZ LYS 102 11.829 -14.943 1.015 844 3HZ LYS 102 3HZ LYS 102 12.414 -15.951 -0.214 845 H ALA 103 H ALA 103 6.113 -11.254 0.677 846 HA ALA 103 HA ALA 103 5.938 -13.722 2.160 847 1HB ALA 103 1HB ALA 103 6.158 -11.563 3.312 848 2HB ALA 103 2HB ALA 103 4.692 -12.416 3.794 849 3HB ALA 103 3HB ALA 103 4.594 -11.068 2.664 850 H GLY 104 H GLY 104 4.241 -12.368 -0.386 851 1HA GLY 104 1HA GLY 104 2.573 -13.706 -1.476 852 2HA GLY 104 2HA GLY 104 2.011 -14.222 0.107 853 H VAL 105 H VAL 105 2.689 -10.937 0.133 854 HA VAL 105 HA VAL 105 -0.097 -10.287 0.305 855 HB VAL 105 HB VAL 105 2.318 -8.470 0.329 856 1HG1 VAL 105 1HG1 VAL 105 0.821 -6.773 1.235 857 2HG1 VAL 105 2HG1 VAL 105 -0.545 -7.876 1.074 858 3HG1 VAL 105 3HG1 VAL 105 0.286 -7.288 -0.365 859 1HG2 VAL 105 1HG2 VAL 105 2.279 -10.036 2.198 860 2HG2 VAL 105 2HG2 VAL 105 0.628 -9.547 2.584 861 3HG2 VAL 105 3HG2 VAL 105 1.952 -8.392 2.749 862 H PHE 106 H PHE 106 -1.158 -10.441 -1.535 863 HA PHE 106 HA PHE 106 -0.113 -9.160 -3.955 864 1HB PHE 106 1HB PHE 106 -0.959 -11.480 -4.136 865 2HB PHE 106 2HB PHE 106 -2.529 -10.953 -3.543 866 HD1 PHE 106 HD1 PHE 106 -4.050 -9.726 -4.970 867 HD2 PHE 106 HD2 PHE 106 -0.238 -10.984 -6.388 868 HE1 PHE 106 HE1 PHE 106 -4.767 -9.282 -7.281 869 HE2 PHE 106 HE2 PHE 106 -0.950 -10.539 -8.700 870 HZ PHE 106 HZ PHE 106 -3.214 -9.686 -9.151 871 H ARG 107 H ARG 107 -2.430 -8.800 -1.435 872 HA ARG 107 HA ARG 107 -3.758 -6.626 -2.913 873 1HB ARG 107 1HB ARG 107 -5.018 -8.859 -2.383 874 2HB ARG 107 2HB ARG 107 -5.137 -8.188 -0.764 875 1HG ARG 107 1HG ARG 107 -6.342 -6.279 -1.586 876 2HG ARG 107 2HG ARG 107 -6.122 -6.819 -3.253 877 1HD ARG 107 1HD ARG 107 -7.766 -8.095 -1.084 878 2HD ARG 107 2HD ARG 107 -8.314 -7.461 -2.638 879 HE ARG 107 HE ARG 107 -6.441 -9.698 -2.678 880 1HH1 ARG 107 1HH1 ARG 107 -9.711 -8.533 -3.122 881 2HH1 ARG 107 2HH1 ARG 107 -10.260 -9.993 -3.903 882 1HH2 ARG 107 1HH2 ARG 107 -7.155 -11.615 -3.702 883 2HH2 ARG 107 2HH2 ARG 107 -8.804 -11.751 -4.230 884 H TRP 108 H TRP 108 -2.676 -4.939 -2.089 885 HA TRP 108 HA TRP 108 -2.298 -4.653 0.790 886 1HB TRP 108 1HB TRP 108 -0.458 -4.117 -0.771 887 2HB TRP 108 2HB TRP 108 -1.468 -2.920 -1.557 888 HD1 TRP 108 HD1 TRP 108 -2.488 -1.578 1.287 889 HE1 TRP 108 HE1 TRP 108 -0.840 -0.014 2.482 890 HE3 TRP 108 HE3 TRP 108 1.855 -3.190 -0.862 891 HZ2 TRP 108 HZ2 TRP 108 1.942 0.472 2.518 892 HZ3 TRP 108 HZ3 TRP 108 3.965 -2.116 -0.199 893 HH2 TRP 108 HH2 TRP 108 4.009 -0.325 1.453 894 H VAL 109 H VAL 109 -4.191 -4.063 1.773 895 HA VAL 109 HA VAL 109 -5.756 -1.920 0.488 896 HB VAL 109 HB VAL 109 -6.782 -3.963 2.467 897 1HG1 VAL 109 1HG1 VAL 109 -8.006 -1.849 2.462 898 2HG1 VAL 109 2HG1 VAL 109 -8.985 -3.163 1.807 899 3HG1 VAL 109 3HG1 VAL 109 -8.241 -1.991 0.720 900 1HG2 VAL 109 1HG2 VAL 109 -6.136 -5.036 0.360 901 2HG2 VAL 109 2HG2 VAL 109 -7.141 -3.888 -0.528 902 3HG2 VAL 109 3HG2 VAL 109 -7.886 -5.040 0.581 903 H THR 110 H THR 110 -5.229 -0.036 1.433 904 HA THR 110 HA THR 110 -4.895 -0.014 4.355 905 HB THR 110 HB THR 110 -4.069 2.111 2.371 906 HG1 THR 110 HG1 THR 110 -2.949 -0.130 2.623 907 1HG2 THR 110 1HG2 THR 110 -3.445 1.810 5.313 908 2HG2 THR 110 2HG2 THR 110 -4.544 2.996 4.611 909 3HG2 THR 110 3HG2 THR 110 -2.821 3.066 4.246 910 H ASN 111 H ASN 111 -6.660 0.506 5.421 911 HA ASN 111 HA ASN 111 -8.657 2.221 4.146 912 1HB ASN 111 1HB ASN 111 -8.784 0.442 6.586 913 2HB ASN 111 2HB ASN 111 -10.086 1.528 6.114 914 1HD2 ASN 111 1HD2 ASN 111 -11.566 -0.064 5.757 915 2HD2 ASN 111 2HD2 ASN 111 -11.438 -1.207 4.455 916 H ILE 112 H ILE 112 -8.318 4.310 4.467 917 HA ILE 112 HA ILE 112 -7.077 5.352 6.828 918 HB ILE 112 HB ILE 112 -8.522 6.717 4.550 919 1HG1 ILE 112 1HG1 ILE 112 -6.375 5.681 3.974 920 2HG1 ILE 112 2HG1 ILE 112 -6.263 7.438 3.904 921 1HG2 ILE 112 1HG2 ILE 112 -8.775 8.099 6.528 922 2HG2 ILE 112 2HG2 ILE 112 -7.615 8.836 5.423 923 3HG2 ILE 112 3HG2 ILE 112 -7.045 7.984 6.857 924 1HD1 ILE 112 1HD1 ILE 112 -5.195 7.434 6.113 925 2HD1 ILE 112 2HD1 ILE 112 -4.283 6.505 4.921 926 3HD1 ILE 112 3HD1 ILE 112 -5.264 5.671 6.127 927 H HIS 113 H HIS 113 -10.335 4.799 5.708 928 HA HIS 113 HA HIS 113 -11.683 6.346 7.656 929 1HB HIS 113 1HB HIS 113 -12.689 5.465 5.536 930 2HB HIS 113 2HB HIS 113 -12.682 3.858 6.253 931 HD1 HIS 113 HD1 HIS 113 -14.432 3.354 8.067 932 HD2 HIS 113 HD2 HIS 113 -14.664 7.205 6.506 933 HE1 HIS 113 HE1 HIS 113 -16.647 4.271 8.839 934 HE2 HIS 113 HE2 HIS 113 -16.854 6.514 7.704 935 H GLU 114 H GLU 114 -10.146 3.255 7.749 936 HA GLU 114 HA GLU 114 -11.362 2.635 10.350 937 1HB GLU 114 1HB GLU 114 -10.081 0.941 8.235 938 2HB GLU 114 2HB GLU 114 -10.134 0.373 9.896 939 1HG GLU 114 1HG GLU 114 -11.967 -0.559 8.679 940 2HG GLU 114 2HG GLU 114 -12.581 0.581 9.868 941 H GLN 115 H GLN 115 -8.628 4.024 9.081 942 HA GLN 115 HA GLN 115 -6.456 4.318 9.688 943 1HB GLN 115 1HB GLN 115 -7.876 4.062 12.304 944 2HB GLN 115 2HB GLN 115 -6.120 4.111 12.302 945 1HG GLN 115 1HG GLN 115 -6.879 6.313 12.669 946 2HG GLN 115 2HG GLN 115 -6.265 6.251 11.021 947 1HE2 GLN 115 1HE2 GLN 115 -7.451 7.992 10.343 948 2HE2 GLN 115 2HE2 GLN 115 -9.160 7.927 10.120 949 H LYS 116 H LYS 116 -6.955 1.760 8.739 950 HA LYS 116 HA LYS 116 -4.980 0.224 10.246 951 1HB LYS 116 1HB LYS 116 -7.775 -0.710 9.617 952 2HB LYS 116 2HB LYS 116 -6.463 -1.835 9.944 953 1HG LYS 116 1HG LYS 116 -6.208 -1.066 12.151 954 2HG LYS 116 2HG LYS 116 -7.181 0.374 11.844 955 1HD LYS 116 1HD LYS 116 -9.169 -0.991 11.607 956 2HD LYS 116 2HD LYS 116 -8.209 -2.462 11.809 957 1HE LYS 116 1HE LYS 116 -9.434 -1.717 13.863 958 2HE LYS 116 2HE LYS 116 -7.695 -1.911 14.068 959 1HZ LYS 116 1HZ LYS 116 -8.627 0.131 15.098 960 2HZ LYS 116 2HZ LYS 116 -9.013 0.700 13.548 961 3HZ LYS 116 3HZ LYS 116 -7.396 0.438 13.973 962 H ARG 117 H ARG 117 -3.713 -1.091 9.077 963 HA ARG 117 HA ARG 117 -4.043 -1.002 6.162 964 1HB ARG 117 1HB ARG 117 -1.606 -1.738 7.805 965 2HB ARG 117 2HB ARG 117 -1.664 -1.597 6.054 966 1HG ARG 117 1HG ARG 117 -2.326 0.816 6.393 967 2HG ARG 117 2HG ARG 117 -1.911 0.597 8.093 968 1HD ARG 117 1HD ARG 117 -0.031 0.086 5.793 969 2HD ARG 117 2HD ARG 117 -0.090 1.588 6.710 970 HE ARG 117 HE ARG 117 0.326 -0.216 8.658 971 1HH1 ARG 117 1HH1 ARG 117 1.893 0.276 5.567 972 2HH1 ARG 117 2HH1 ARG 117 3.411 -0.372 6.091 973 1HH2 ARG 117 1HH2 ARG 117 2.330 -1.015 9.368 974 2HH2 ARG 117 2HH2 ARG 117 3.666 -1.110 8.254 975 H TYR 118 H TYR 118 -5.013 -2.712 5.329 976 HA TYR 118 HA TYR 118 -4.860 -5.292 6.708 977 1HB TYR 118 1HB TYR 118 -6.676 -4.336 4.485 978 2HB TYR 118 2HB TYR 118 -6.742 -5.930 5.223 979 HD1 TYR 118 HD1 TYR 118 -7.617 -6.225 7.476 980 HD2 TYR 118 HD2 TYR 118 -7.525 -2.385 5.649 981 HE1 TYR 118 HE1 TYR 118 -9.190 -5.389 9.170 982 HE2 TYR 118 HE2 TYR 118 -9.096 -1.536 7.339 983 HH TYR 118 HH TYR 118 -10.811 -2.426 8.879 984 H TYR 119 H TYR 119 -3.687 -6.913 5.914 985 HA TYR 119 HA TYR 119 -2.669 -6.646 3.167 986 1HB TYR 119 1HB TYR 119 -1.410 -7.903 5.604 987 2HB TYR 119 2HB TYR 119 -0.789 -8.132 3.971 988 HD1 TYR 119 HD1 TYR 119 -0.140 -6.060 2.649 989 HD2 TYR 119 HD2 TYR 119 -0.788 -6.002 6.854 990 HE1 TYR 119 HE1 TYR 119 1.125 -3.966 2.804 991 HE2 TYR 119 HE2 TYR 119 0.476 -3.894 7.025 992 HH TYR 119 HH TYR 119 1.306 -2.056 4.269 993 H TYR 120 H TYR 120 -3.730 -7.893 1.835 994 HA TYR 120 HA TYR 120 -4.617 -10.553 2.753 995 1HB TYR 120 1HB TYR 120 -5.594 -8.913 0.399 996 2HB TYR 120 2HB TYR 120 -6.200 -10.496 0.862 997 HD1 TYR 120 HD1 TYR 120 -7.793 -10.742 2.622 998 HD2 TYR 120 HD2 TYR 120 -6.084 -6.938 1.788 999 HE1 TYR 120 HE1 TYR 120 -9.516 -9.669 4.008 1000 HE2 TYR 120 HE2 TYR 120 -7.801 -5.853 3.174 1001 HH TYR 120 HH TYR 120 -9.894 -7.622 5.227 1002 H THR 121 H THR 121 -4.045 -12.355 1.596 1003 HA THR 121 HA THR 121 -1.974 -12.088 -0.408 1004 HB THR 121 HB THR 121 -1.826 -13.923 1.217 1005 HG1 THR 121 HG1 THR 121 -0.820 -14.689 -0.487 1006 1HG2 THR 121 1HG2 THR 121 -4.219 -14.301 1.571 1007 2HG2 THR 121 2HG2 THR 121 -3.385 -15.800 1.162 1008 3HG2 THR 121 3HG2 THR 121 -4.356 -14.971 -0.054 1009 H PHE 122 H PHE 122 -2.426 -13.789 -2.387 1010 HA PHE 122 HA PHE 122 -4.383 -12.542 -3.995 1011 1HB PHE 122 1HB PHE 122 -2.397 -13.675 -4.920 1012 2HB PHE 122 2HB PHE 122 -3.040 -15.227 -4.396 1013 HD1 PHE 122 HD1 PHE 122 -3.681 -12.356 -6.643 1014 HD2 PHE 122 HD2 PHE 122 -4.541 -16.420 -5.733 1015 HE1 PHE 122 HE1 PHE 122 -4.883 -12.572 -8.777 1016 HE2 PHE 122 HE2 PHE 122 -5.747 -16.645 -7.867 1017 HZ PHE 122 HZ PHE 122 -5.920 -14.718 -9.390 1018 H ASP 123 H ASP 123 -4.462 -15.255 -1.873 1019 HA ASP 123 HA ASP 123 -6.845 -16.490 -2.787 1020 1HB ASP 123 1HB ASP 123 -5.165 -17.650 -1.425 1021 2HB ASP 123 2HB ASP 123 -5.493 -16.568 -0.077 1022 H ASN 124 H ASN 124 -6.359 -13.543 -1.320 1023 HA ASN 124 HA ASN 124 -7.731 -11.950 -0.470 1024 1HB ASN 124 1HB ASN 124 -9.503 -12.783 -1.972 1025 2HB ASN 124 2HB ASN 124 -9.968 -13.978 -0.767 1026 1HD2 ASN 124 1HD2 ASN 124 -9.891 -10.576 -1.543 1027 2HD2 ASN 124 2HD2 ASN 124 -11.091 -10.079 -0.399 1028 H SER 125 H SER 125 -6.782 -14.668 0.920 1029 HA SER 125 HA SER 125 -8.053 -14.556 3.457 1030 1HB SER 125 1HB SER 125 -6.879 -16.575 2.689 1031 2HB SER 125 2HB SER 125 -5.353 -15.693 2.665 1032 HG SER 125 HG SER 125 -6.746 -15.631 5.067 1033 H LEU 126 H LEU 126 -7.839 -13.071 4.949 1034 HA LEU 126 HA LEU 126 -5.951 -10.945 4.758 1035 1HB LEU 126 1HB LEU 126 -8.209 -10.682 5.708 1036 2HB LEU 126 2HB LEU 126 -7.777 -11.751 7.028 1037 HG LEU 126 HG LEU 126 -6.134 -10.116 7.831 1038 1HD1 LEU 126 1HD1 LEU 126 -7.148 -8.365 5.595 1039 2HD1 LEU 126 2HD1 LEU 126 -5.555 -9.118 5.663 1040 3HD1 LEU 126 3HD1 LEU 126 -6.004 -7.896 6.854 1041 1HD2 LEU 126 1HD2 LEU 126 -7.732 -8.406 8.566 1042 2HD2 LEU 126 2HD2 LEU 126 -8.417 -10.026 8.676 1043 3HD2 LEU 126 3HD2 LEU 126 -8.881 -8.964 7.348 1044 H LEU 127 H LEU 127 -3.875 -11.191 5.208 1045 HA LEU 127 HA LEU 127 -3.032 -13.341 6.981 1046 1HB LEU 127 1HB LEU 127 -1.454 -11.493 5.195 1047 2HB LEU 127 2HB LEU 127 -0.755 -12.779 6.157 1048 HG LEU 127 HG LEU 127 -2.730 -13.160 3.906 1049 1HD1 LEU 127 1HD1 LEU 127 -0.813 -14.141 2.722 1050 2HD1 LEU 127 2HD1 LEU 127 0.238 -13.661 4.056 1051 3HD1 LEU 127 3HD1 LEU 127 -0.573 -12.432 3.084 1052 1HD2 LEU 127 1HD2 LEU 127 -1.221 -15.167 5.578 1053 2HD2 LEU 127 2HD2 LEU 127 -2.212 -15.542 4.168 1054 3HD2 LEU 127 3HD2 LEU 127 -2.960 -14.870 5.618 1055 H PHE 128 H PHE 128 -2.919 -9.833 6.760 1056 HA PHE 128 HA PHE 128 -2.031 -9.735 9.544 1057 1HB PHE 128 1HB PHE 128 -0.069 -9.561 7.893 1058 2HB PHE 128 2HB PHE 128 -0.733 -7.992 7.455 1059 HD1 PHE 128 HD1 PHE 128 0.138 -6.147 8.527 1060 HD2 PHE 128 HD2 PHE 128 0.169 -9.907 10.514 1061 HE1 PHE 128 HE1 PHE 128 1.346 -5.134 10.415 1062 HE2 PHE 128 HE2 PHE 128 1.379 -8.908 12.404 1063 HZ PHE 128 HZ PHE 128 1.969 -6.514 12.358 1064 H THR 129 H THR 129 -2.728 -7.954 10.667 1065 HA THR 129 HA THR 129 -4.185 -5.865 9.223 1066 HB THR 129 HB THR 129 -5.271 -7.276 11.673 1067 HG1 THR 129 HG1 THR 129 -5.482 -7.820 9.010 1068 1HG2 THR 129 1HG2 THR 129 -5.919 -4.924 11.566 1069 2HG2 THR 129 2HG2 THR 129 -7.303 -5.964 11.229 1070 3HG2 THR 129 3HG2 THR 129 -6.478 -5.139 9.907 1071 H GLU 130 H GLU 130 -2.882 -4.180 9.695 1072 HA GLU 130 HA GLU 130 -2.002 -3.868 12.491 1073 1HB GLU 130 1HB GLU 130 -0.212 -4.155 10.760 1074 2HB GLU 130 2HB GLU 130 -0.754 -2.653 10.022 1075 1HG GLU 130 1HG GLU 130 -0.368 -1.634 12.355 1076 2HG GLU 130 2HG GLU 130 0.591 -3.080 12.651 1077 H SER 131 H SER 131 -2.863 -2.227 13.594 1078 HA SER 131 HA SER 131 -4.359 -0.175 12.190 1079 1HB SER 131 1HB SER 131 -5.112 -1.287 14.379 1080 2HB SER 131 2HB SER 131 -3.868 -0.325 15.170 1081 HG SER 131 HG SER 131 -4.923 1.541 14.525 1082 H ILE 132 H ILE 132 -3.545 1.787 11.698 1083 HA ILE 132 HA ILE 132 -0.766 2.257 12.242 1084 HB ILE 132 HB ILE 132 -1.174 4.439 10.995 1085 1HG1 ILE 132 1HG1 ILE 132 -3.796 3.079 10.331 1086 2HG1 ILE 132 2HG1 ILE 132 -3.638 4.495 11.364 1087 1HG2 ILE 132 1HG2 ILE 132 -1.227 3.290 8.818 1088 2HG2 ILE 132 2HG2 ILE 132 -1.715 1.805 9.634 1089 3HG2 ILE 132 3HG2 ILE 132 -0.134 2.515 9.966 1090 1HD1 ILE 132 1HD1 ILE 132 -2.945 4.335 8.441 1091 2HD1 ILE 132 2HD1 ILE 132 -2.731 5.755 9.466 1092 3HD1 ILE 132 3HD1 ILE 132 -4.350 5.130 9.151 1093 H GLN 133 H GLN 133 -0.558 2.526 14.386 1094 HA GLN 133 HA GLN 133 -0.476 3.553 16.390 1095 1HB GLN 133 1HB GLN 133 -1.091 5.983 14.699 1096 2HB GLN 133 2HB GLN 133 -0.683 6.056 16.404 1097 1HG GLN 133 1HG GLN 133 1.337 6.500 15.435 1098 2HG GLN 133 2HG GLN 133 1.448 4.761 15.685 1099 1HE2 GLN 133 1HE2 GLN 133 -0.468 6.280 13.174 1100 2HE2 GLN 133 2HE2 GLN 133 0.484 5.717 11.848 Start of MODEL 7 1 H ASP 7 H ASP 7 -5.196 15.857 -15.483 2 HA ASP 7 HA ASP 7 -6.675 13.366 -15.481 3 1HB ASP 7 1HB ASP 7 -3.692 13.892 -15.512 4 2HB ASP 7 2HB ASP 7 -4.431 12.303 -15.648 5 H GLN 8 H GLN 8 -7.543 12.907 -13.559 6 HA GLN 8 HA GLN 8 -6.499 13.663 -11.060 7 1HB GLN 8 1HB GLN 8 -8.867 13.103 -11.481 8 2HB GLN 8 2HB GLN 8 -8.421 11.421 -11.720 9 1HG GLN 8 1HG GLN 8 -7.758 11.206 -9.432 10 2HG GLN 8 2HG GLN 8 -7.983 12.932 -9.160 11 1HE2 GLN 8 1HE2 GLN 8 -10.057 13.769 -8.996 12 2HE2 GLN 8 2HE2 GLN 8 -11.432 12.754 -8.721 13 H VAL 9 H VAL 9 -5.993 10.865 -13.055 14 HA VAL 9 HA VAL 9 -4.851 9.120 -11.182 15 HB VAL 9 HB VAL 9 -4.262 9.361 -14.136 16 1HG1 VAL 9 1HG1 VAL 9 -3.554 7.021 -14.008 17 2HG1 VAL 9 2HG1 VAL 9 -3.785 7.051 -12.260 18 3HG1 VAL 9 3HG1 VAL 9 -2.543 8.062 -13.002 19 1HG2 VAL 9 1HG2 VAL 9 -5.913 7.572 -14.389 20 2HG2 VAL 9 2HG2 VAL 9 -6.626 9.027 -13.693 21 3HG2 VAL 9 3HG2 VAL 9 -6.250 7.645 -12.661 22 H VAL 10 H VAL 10 -3.474 11.795 -13.014 23 HA VAL 10 HA VAL 10 -0.748 11.172 -12.619 24 HB VAL 10 HB VAL 10 -2.093 13.824 -13.154 25 1HG1 VAL 10 1HG1 VAL 10 0.847 13.157 -13.291 26 2HG1 VAL 10 2HG1 VAL 10 0.081 14.182 -12.078 27 3HG1 VAL 10 3HG1 VAL 10 0.102 14.684 -13.768 28 1HG2 VAL 10 1HG2 VAL 10 -1.247 13.476 -15.435 29 2HG2 VAL 10 2HG2 VAL 10 -2.361 12.204 -14.937 30 3HG2 VAL 10 3HG2 VAL 10 -0.623 11.900 -14.951 31 H ILE 11 H ILE 11 -2.973 13.263 -10.802 32 HA ILE 11 HA ILE 11 -1.059 14.251 -8.983 33 HB ILE 11 HB ILE 11 -4.058 13.995 -8.741 34 1HG1 ILE 11 1HG1 ILE 11 -3.835 16.549 -8.842 35 2HG1 ILE 11 2HG1 ILE 11 -2.175 16.275 -9.351 36 1HG2 ILE 11 1HG2 ILE 11 -3.914 15.471 -6.777 37 2HG2 ILE 11 2HG2 ILE 11 -2.156 15.328 -6.817 38 3HG2 ILE 11 3HG2 ILE 11 -3.149 13.905 -6.501 39 1HD1 ILE 11 1HD1 ILE 11 -2.983 15.041 -11.298 40 2HD1 ILE 11 2HD1 ILE 11 -3.613 16.687 -11.250 41 3HD1 ILE 11 3HD1 ILE 11 -4.646 15.333 -10.788 42 H PHE 12 H PHE 12 -3.381 11.567 -8.686 43 HA PHE 12 HA PHE 12 -2.655 10.876 -6.050 44 1HB PHE 12 1HB PHE 12 -4.108 9.405 -8.233 45 2HB PHE 12 2HB PHE 12 -3.747 8.630 -6.695 46 HD1 PHE 12 HD1 PHE 12 -5.291 11.759 -8.027 47 HD2 PHE 12 HD2 PHE 12 -5.286 8.750 -5.018 48 HE1 PHE 12 HE1 PHE 12 -7.320 12.742 -7.043 49 HE2 PHE 12 HE2 PHE 12 -7.316 9.725 -4.031 50 HZ PHE 12 HZ PHE 12 -8.334 11.725 -5.046 51 H LYS 13 H LYS 13 -1.600 9.553 -9.188 52 HA LYS 13 HA LYS 13 -0.069 7.466 -8.069 53 1HB LYS 13 1HB LYS 13 -0.848 7.726 -10.501 54 2HB LYS 13 2HB LYS 13 0.544 8.778 -10.716 55 1HG LYS 13 1HG LYS 13 0.835 5.983 -9.660 56 2HG LYS 13 2HG LYS 13 0.769 6.318 -11.388 57 1HD LYS 13 1HD LYS 13 2.731 7.677 -9.555 58 2HD LYS 13 2HD LYS 13 3.077 6.133 -10.336 59 1HE LYS 13 1HE LYS 13 2.843 7.116 -12.512 60 2HE LYS 13 2HE LYS 13 2.286 8.636 -11.814 61 1HZ LYS 13 1HZ LYS 13 4.923 7.615 -11.019 62 2HZ LYS 13 2HZ LYS 13 4.379 9.216 -11.167 63 3HZ LYS 13 3HZ LYS 13 4.755 8.316 -12.554 64 H GLN 14 H GLN 14 0.673 10.827 -8.817 65 HA GLN 14 HA GLN 14 3.468 10.628 -8.429 66 1HB GLN 14 1HB GLN 14 1.560 12.707 -8.964 67 2HB GLN 14 2HB GLN 14 2.678 13.232 -7.710 68 1HG GLN 14 1HG GLN 14 3.466 13.862 -9.922 69 2HG GLN 14 2HG GLN 14 4.565 12.722 -9.147 70 1HE2 GLN 14 1HE2 GLN 14 2.245 13.193 -11.675 71 2HE2 GLN 14 2HE2 GLN 14 2.619 11.764 -12.579 72 H ILE 15 H ILE 15 0.788 11.032 -6.217 73 HA ILE 15 HA ILE 15 2.235 11.809 -3.929 74 HB ILE 15 HB ILE 15 -0.234 10.060 -4.033 75 1HG1 ILE 15 1HG1 ILE 15 -0.044 13.062 -3.702 76 2HG1 ILE 15 2HG1 ILE 15 -0.463 12.257 -5.212 77 1HG2 ILE 15 1HG2 ILE 15 0.851 9.973 -1.869 78 2HG2 ILE 15 2HG2 ILE 15 -0.642 10.904 -1.756 79 3HG2 ILE 15 3HG2 ILE 15 0.914 11.733 -1.804 80 1HD1 ILE 15 1HD1 ILE 15 -2.451 13.050 -4.108 81 2HD1 ILE 15 2HD1 ILE 15 -2.027 12.167 -2.642 82 3HD1 ILE 15 3HD1 ILE 15 -2.438 11.287 -4.114 83 H PHE 16 H PHE 16 1.310 8.596 -5.126 84 HA PHE 16 HA PHE 16 2.776 7.170 -3.143 85 1HB PHE 16 1HB PHE 16 1.698 6.309 -5.834 86 2HB PHE 16 2HB PHE 16 2.443 5.208 -4.681 87 HD1 PHE 16 HD1 PHE 16 1.290 4.533 -2.685 88 HD2 PHE 16 HD2 PHE 16 -0.487 7.287 -5.392 89 HE1 PHE 16 HE1 PHE 16 -0.887 4.202 -1.585 90 HE2 PHE 16 HE2 PHE 16 -2.669 6.966 -4.300 91 HZ PHE 16 HZ PHE 16 -2.867 5.419 -2.394 92 H ASP 17 H ASP 17 3.490 8.411 -6.318 93 HA ASP 17 HA ASP 17 5.870 6.988 -6.835 94 1HB ASP 17 1HB ASP 17 4.412 8.431 -8.418 95 2HB ASP 17 2HB ASP 17 5.353 9.788 -7.813 96 H LYS 18 H LYS 18 5.192 9.950 -5.102 97 HA LYS 18 HA LYS 18 7.929 10.711 -4.767 98 1HB LYS 18 1HB LYS 18 5.916 12.246 -4.698 99 2HB LYS 18 2HB LYS 18 5.558 11.580 -3.113 100 1HG LYS 18 1HG LYS 18 6.795 13.237 -2.295 101 2HG LYS 18 2HG LYS 18 8.198 12.346 -2.893 102 1HD LYS 18 1HD LYS 18 6.670 14.266 -4.631 103 2HD LYS 18 2HD LYS 18 7.971 14.808 -3.573 104 1HE LYS 18 1HE LYS 18 8.337 12.606 -5.587 105 2HE LYS 18 2HE LYS 18 8.580 14.306 -5.991 106 1HZ LYS 18 1HZ LYS 18 10.204 14.395 -4.128 107 2HZ LYS 18 2HZ LYS 18 10.676 13.388 -5.404 108 3HZ LYS 18 3HZ LYS 18 10.071 12.710 -3.970 109 H VAL 19 H VAL 19 5.479 9.205 -2.652 110 HA VAL 19 HA VAL 19 7.159 9.125 -0.378 111 HB VAL 19 HB VAL 19 4.674 9.031 -0.288 112 1HG1 VAL 19 1HG1 VAL 19 3.591 6.818 -0.523 113 2HG1 VAL 19 2HG1 VAL 19 5.090 6.196 -1.212 114 3HG1 VAL 19 3HG1 VAL 19 4.200 7.471 -2.043 115 1HG2 VAL 19 1HG2 VAL 19 5.988 8.482 1.672 116 2HG2 VAL 19 2HG2 VAL 19 6.139 6.810 1.134 117 3HG2 VAL 19 3HG2 VAL 19 4.560 7.448 1.591 118 H ARG 20 H ARG 20 6.775 6.946 -3.083 119 HA ARG 20 HA ARG 20 7.922 4.680 -1.786 120 1HB ARG 20 1HB ARG 20 8.046 3.658 -3.983 121 2HB ARG 20 2HB ARG 20 6.487 4.439 -3.772 122 1HG ARG 20 1HG ARG 20 7.154 6.275 -5.163 123 2HG ARG 20 2HG ARG 20 8.802 5.651 -5.261 124 1HD ARG 20 1HD ARG 20 8.037 3.705 -6.471 125 2HD ARG 20 2HD ARG 20 6.357 4.204 -6.279 126 HE ARG 20 HE ARG 20 6.712 5.931 -7.844 127 1HH1 ARG 20 1HH1 ARG 20 9.526 3.890 -7.444 128 2HH1 ARG 20 2HH1 ARG 20 10.282 4.422 -8.914 129 1HH2 ARG 20 1HH2 ARG 20 7.678 6.626 -9.776 130 2HH2 ARG 20 2HH2 ARG 20 9.230 5.980 -10.246 131 H ASN 21 H ASN 21 9.270 7.560 -2.759 132 HA ASN 21 HA ASN 21 11.948 6.338 -2.923 133 1HB ASN 21 1HB ASN 21 10.916 8.877 -4.195 134 2HB ASN 21 2HB ASN 21 12.628 8.503 -4.064 135 1HD2 ASN 21 1HD2 ASN 21 9.674 7.862 -5.715 136 2HD2 ASN 21 2HD2 ASN 21 10.343 6.817 -6.920 137 H ASP 22 H ASP 22 10.227 9.277 -1.910 138 HA ASP 22 HA ASP 22 12.441 10.221 -0.354 139 1HB ASP 22 1HB ASP 22 9.595 11.174 -0.635 140 2HB ASP 22 2HB ASP 22 10.791 11.986 0.369 141 H LEU 23 H LEU 23 9.744 8.193 0.281 142 HA LEU 23 HA LEU 23 8.895 7.212 2.142 143 1HB LEU 23 1HB LEU 23 11.520 8.127 3.312 144 2HB LEU 23 2HB LEU 23 10.357 7.163 4.202 145 HG LEU 23 HG LEU 23 11.749 6.319 1.657 146 1HD1 LEU 23 1HD1 LEU 23 12.905 4.711 3.110 147 2HD1 LEU 23 2HD1 LEU 23 12.146 5.455 4.517 148 3HD1 LEU 23 3HD1 LEU 23 13.282 6.381 3.537 149 1HD2 LEU 23 1HD2 LEU 23 10.758 4.121 2.144 150 2HD2 LEU 23 2HD2 LEU 23 9.534 5.349 1.827 151 3HD2 LEU 23 3HD2 LEU 23 9.861 4.837 3.480 152 H ASN 24 H ASN 24 8.517 10.093 1.522 153 HA ASN 24 HA ASN 24 8.153 11.386 4.074 154 1HB ASN 24 1HB ASN 24 8.762 12.607 1.949 155 2HB ASN 24 2HB ASN 24 7.136 12.280 1.364 156 1HD2 ASN 24 1HD2 ASN 24 8.347 14.832 1.767 157 2HD2 ASN 24 2HD2 ASN 24 7.417 15.670 2.964 158 H TYR 25 H TYR 25 6.687 10.121 5.200 159 HA TYR 25 HA TYR 25 4.141 9.433 4.039 160 1HB TYR 25 1HB TYR 25 5.294 9.107 6.806 161 2HB TYR 25 2HB TYR 25 3.639 8.658 6.413 162 HD1 TYR 25 HD1 TYR 25 6.953 7.499 6.630 163 HD2 TYR 25 HD2 TYR 25 3.391 7.045 4.345 164 HE1 TYR 25 HE1 TYR 25 7.726 5.292 5.869 165 HE2 TYR 25 HE2 TYR 25 4.157 4.842 3.576 166 HH TYR 25 HH TYR 25 6.441 3.683 3.286 167 H GLN 26 H GLN 26 5.450 12.067 5.809 168 HA GLN 26 HA GLN 26 3.152 13.057 7.073 169 1HB GLN 26 1HB GLN 26 5.387 13.934 7.547 170 2HB GLN 26 2HB GLN 26 5.500 14.575 5.913 171 1HG GLN 26 1HG GLN 26 3.654 16.095 6.370 172 2HG GLN 26 2HG GLN 26 3.509 15.443 8.000 173 1HE2 GLN 26 1HE2 GLN 26 6.574 15.982 6.409 174 2HE2 GLN 26 2HE2 GLN 26 7.095 17.276 7.433 175 H TRP 27 H TRP 27 4.538 13.876 3.903 176 HA TRP 27 HA TRP 27 2.279 15.447 3.121 177 1HB TRP 27 1HB TRP 27 4.515 15.876 2.219 178 2HB TRP 27 2HB TRP 27 4.541 14.277 1.485 179 HD1 TRP 27 HD1 TRP 27 2.544 17.589 1.189 180 HE1 TRP 27 HE1 TRP 27 1.777 17.835 -1.260 181 HE3 TRP 27 HE3 TRP 27 4.246 13.131 -0.634 182 HZ2 TRP 27 HZ2 TRP 27 1.878 16.327 -3.644 183 HZ3 TRP 27 HZ3 TRP 27 3.870 12.607 -3.008 184 HH2 TRP 27 HH2 TRP 27 2.712 14.173 -4.482 185 H PHE 28 H PHE 28 3.282 12.129 2.732 186 HA PHE 28 HA PHE 28 1.545 11.297 0.715 187 1HB PHE 28 1HB PHE 28 3.420 9.950 1.529 188 2HB PHE 28 2HB PHE 28 2.617 9.744 3.079 189 HD1 PHE 28 HD1 PHE 28 1.859 7.621 3.391 190 HD2 PHE 28 HD2 PHE 28 1.596 9.335 -0.493 191 HE1 PHE 28 HE1 PHE 28 0.793 5.564 2.561 192 HE2 PHE 28 HE2 PHE 28 0.528 7.284 -1.332 193 HZ PHE 28 HZ PHE 28 0.128 5.393 0.195 194 H TYR 29 H TYR 29 1.100 10.994 4.252 195 HA TYR 29 HA TYR 29 -1.571 10.047 3.997 196 1HB TYR 29 1HB TYR 29 0.005 11.085 6.347 197 2HB TYR 29 2HB TYR 29 -1.675 10.579 6.494 198 HD1 TYR 29 HD1 TYR 29 -2.063 8.179 5.226 199 HD2 TYR 29 HD2 TYR 29 1.544 9.519 7.039 200 HE1 TYR 29 HE1 TYR 29 -1.351 5.843 5.514 201 HE2 TYR 29 HE2 TYR 29 2.268 7.187 7.331 202 HH TYR 29 HH TYR 29 1.235 4.950 7.501 203 H SER 30 H SER 30 -0.159 13.213 4.210 204 HA SER 30 HA SER 30 -2.374 14.698 5.032 205 1HB SER 30 1HB SER 30 -0.066 15.611 4.782 206 2HB SER 30 2HB SER 30 -0.256 15.544 3.031 207 HG SER 30 HG SER 30 -1.369 17.330 3.104 208 H GLU 31 H GLU 31 -1.300 13.923 1.716 209 HA GLU 31 HA GLU 31 -3.637 15.029 0.532 210 1HB GLU 31 1HB GLU 31 -1.423 13.293 -0.507 211 2HB GLU 31 2HB GLU 31 -2.820 13.680 -1.505 212 1HG GLU 31 1HG GLU 31 -0.878 15.631 -0.287 213 2HG GLU 31 2HG GLU 31 -1.028 15.205 -1.993 214 H LEU 32 H LEU 32 -2.745 11.802 1.610 215 HA LEU 32 HA LEU 32 -4.804 10.358 0.399 216 1HB LEU 32 1HB LEU 32 -3.441 9.955 3.055 217 2HB LEU 32 2HB LEU 32 -4.619 8.831 2.410 218 HG LEU 32 HG LEU 32 -1.943 9.515 1.198 219 1HD1 LEU 32 1HD1 LEU 32 -1.834 8.059 3.148 220 2HD1 LEU 32 2HD1 LEU 32 -1.431 7.179 1.674 221 3HD1 LEU 32 3HD1 LEU 32 -3.018 6.978 2.415 222 1HD2 LEU 32 1HD2 LEU 32 -3.624 9.165 -0.546 223 2HD2 LEU 32 2HD2 LEU 32 -4.078 7.631 0.197 224 3HD2 LEU 32 3HD2 LEU 32 -2.468 7.836 -0.494 225 H LYS 33 H LYS 33 -4.767 11.975 3.560 226 HA LYS 33 HA LYS 33 -7.455 11.279 4.182 227 1HB LYS 33 1HB LYS 33 -5.777 11.747 5.891 228 2HB LYS 33 2HB LYS 33 -5.636 13.394 5.320 229 1HG LYS 33 1HG LYS 33 -8.033 13.730 5.946 230 2HG LYS 33 2HG LYS 33 -7.988 12.131 6.694 231 1HD LYS 33 1HD LYS 33 -6.148 12.874 8.144 232 2HD LYS 33 2HD LYS 33 -6.224 14.476 7.407 233 1HE LYS 33 1HE LYS 33 -8.565 14.677 8.191 234 2HE LYS 33 2HE LYS 33 -8.395 13.124 9.009 235 1HZ LYS 33 1HZ LYS 33 -6.494 14.141 10.251 236 2HZ LYS 33 2HZ LYS 33 -8.012 14.806 10.606 237 3HZ LYS 33 3HZ LYS 33 -6.937 15.642 9.592 238 H ARG 34 H ARG 34 -6.148 13.618 2.086 239 HA ARG 34 HA ARG 34 -8.390 15.452 2.339 240 1HB ARG 34 1HB ARG 34 -6.012 15.445 0.481 241 2HB ARG 34 2HB ARG 34 -7.279 16.661 0.441 242 1HG ARG 34 1HG ARG 34 -6.730 17.232 2.790 243 2HG ARG 34 2HG ARG 34 -5.377 16.102 2.704 244 1HD ARG 34 1HD ARG 34 -4.553 18.315 2.284 245 2HD ARG 34 2HD ARG 34 -4.491 17.396 0.780 246 HE ARG 34 HE ARG 34 -6.848 19.060 1.230 247 1HH1 ARG 34 1HH1 ARG 34 -3.764 18.619 -0.399 248 2HH1 ARG 34 2HH1 ARG 34 -4.064 19.884 -1.555 249 1HH2 ARG 34 1HH2 ARG 34 -7.253 20.683 -0.333 250 2HH2 ARG 34 2HH2 ARG 34 -6.032 21.057 -1.515 251 H HIS 35 H HIS 35 -7.544 12.688 0.469 252 HA HIS 35 HA HIS 35 -9.731 13.299 -1.414 253 1HB HIS 35 1HB HIS 35 -7.228 11.758 -2.122 254 2HB HIS 35 2HB HIS 35 -8.519 12.241 -3.213 255 HD1 HIS 35 HD1 HIS 35 -8.773 15.057 -3.302 256 HD2 HIS 35 HD2 HIS 35 -5.108 13.398 -2.233 257 HE1 HIS 35 HE1 HIS 35 -7.061 16.869 -3.677 258 HE2 HIS 35 HE2 HIS 35 -4.881 15.898 -2.838 259 H ASN 36 H ASN 36 -7.705 10.671 -0.157 260 HA ASN 36 HA ASN 36 -9.764 8.696 -0.616 261 1HB ASN 36 1HB ASN 36 -7.455 7.996 -0.906 262 2HB ASN 36 2HB ASN 36 -7.054 8.521 0.728 263 1HD2 ASN 36 1HD2 ASN 36 -6.437 6.609 1.557 264 2HD2 ASN 36 2HD2 ASN 36 -7.488 5.259 1.765 265 H VAL 37 H VAL 37 -11.441 9.439 0.697 266 HA VAL 37 HA VAL 37 -11.033 9.739 3.540 267 HB VAL 37 HB VAL 37 -13.670 9.601 2.065 268 1HG1 VAL 37 1HG1 VAL 37 -12.916 10.891 4.687 269 2HG1 VAL 37 2HG1 VAL 37 -13.832 9.395 4.496 270 3HG1 VAL 37 3HG1 VAL 37 -14.511 10.925 3.936 271 1HG2 VAL 37 1HG2 VAL 37 -12.294 11.307 1.021 272 2HG2 VAL 37 2HG2 VAL 37 -11.937 12.013 2.597 273 3HG2 VAL 37 3HG2 VAL 37 -13.581 12.058 1.963 274 H SER 38 H SER 38 -11.358 7.106 1.498 275 HA SER 38 HA SER 38 -12.578 5.510 3.642 276 1HB SER 38 1HB SER 38 -14.012 5.713 1.608 277 2HB SER 38 2HB SER 38 -12.747 4.901 0.685 278 HG SER 38 HG SER 38 -14.405 3.892 2.731 279 H HIS 39 H HIS 39 -11.110 4.185 0.710 280 HA HIS 39 HA HIS 39 -8.761 3.294 2.102 281 1HB HIS 39 1HB HIS 39 -9.274 0.919 2.128 282 2HB HIS 39 2HB HIS 39 -10.474 1.792 3.069 283 HD1 HIS 39 HD1 HIS 39 -12.845 2.195 1.754 284 HD2 HIS 39 HD2 HIS 39 -10.303 -0.730 0.232 285 HE1 HIS 39 HE1 HIS 39 -14.287 0.728 0.301 286 HE2 HIS 39 HE2 HIS 39 -12.760 -1.130 -0.472 287 H TYR 40 H TYR 40 -7.220 2.398 0.729 288 HA TYR 40 HA TYR 40 -8.036 2.193 -2.090 289 1HB TYR 40 1HB TYR 40 -5.825 2.985 -2.765 290 2HB TYR 40 2HB TYR 40 -6.637 4.178 -1.762 291 HD1 TYR 40 HD1 TYR 40 -3.845 1.824 -1.981 292 HD2 TYR 40 HD2 TYR 40 -5.789 4.722 0.453 293 HE1 TYR 40 HE1 TYR 40 -1.852 1.947 -0.549 294 HE2 TYR 40 HE2 TYR 40 -3.802 4.847 1.898 295 HH TYR 40 HH TYR 40 -0.807 3.536 1.022 296 H ILE 41 H ILE 41 -7.299 0.508 -3.269 297 HA ILE 41 HA ILE 41 -5.972 -1.646 -1.762 298 HB ILE 41 HB ILE 41 -7.538 -1.912 -4.336 299 1HG1 ILE 41 1HG1 ILE 41 -8.497 -2.520 -1.530 300 2HG1 ILE 41 2HG1 ILE 41 -8.897 -1.040 -2.392 301 1HG2 ILE 41 1HG2 ILE 41 -7.581 -4.288 -3.778 302 2HG2 ILE 41 2HG2 ILE 41 -6.680 -3.968 -2.296 303 3HG2 ILE 41 3HG2 ILE 41 -5.918 -3.703 -3.863 304 1HD1 ILE 41 1HD1 ILE 41 -10.022 -2.351 -4.114 305 2HD1 ILE 41 2HD1 ILE 41 -10.704 -2.648 -2.515 306 3HD1 ILE 41 3HD1 ILE 41 -9.621 -3.832 -3.245 307 H TYR 42 H TYR 42 -3.871 -1.604 -2.117 308 HA TYR 42 HA TYR 42 -2.783 -0.680 -4.667 309 1HB TYR 42 1HB TYR 42 -2.022 0.056 -2.319 310 2HB TYR 42 2HB TYR 42 -1.265 -1.522 -2.199 311 HD1 TYR 42 HD1 TYR 42 0.255 -2.035 -4.448 312 HD2 TYR 42 HD2 TYR 42 -0.638 1.780 -2.801 313 HE1 TYR 42 HE1 TYR 42 2.299 -1.119 -5.464 314 HE2 TYR 42 HE2 TYR 42 1.401 2.706 -3.810 315 HH TYR 42 HH TYR 42 3.333 0.909 -6.084 316 H TYR 43 H TYR 43 -2.738 -2.283 -6.182 317 HA TYR 43 HA TYR 43 -2.028 -4.996 -5.406 318 1HB TYR 43 1HB TYR 43 -2.791 -3.786 -8.070 319 2HB TYR 43 2HB TYR 43 -2.346 -5.476 -7.864 320 HD1 TYR 43 HD1 TYR 43 -3.785 -6.972 -6.514 321 HD2 TYR 43 HD2 TYR 43 -4.957 -2.994 -7.445 322 HE1 TYR 43 HE1 TYR 43 -6.103 -7.523 -5.913 323 HE2 TYR 43 HE2 TYR 43 -7.281 -3.535 -6.858 324 HH TYR 43 HH TYR 43 -8.740 -5.402 -6.602 325 H LEU 44 H LEU 44 0.030 -5.336 -5.024 326 HA LEU 44 HA LEU 44 2.092 -3.603 -5.837 327 1HB LEU 44 1HB LEU 44 2.221 -6.380 -4.668 328 2HB LEU 44 2HB LEU 44 3.616 -5.346 -4.885 329 HG LEU 44 HG LEU 44 2.389 -3.672 -3.367 330 1HD1 LEU 44 1HD1 LEU 44 0.828 -6.169 -2.729 331 2HD1 LEU 44 2HD1 LEU 44 0.186 -4.680 -3.421 332 3HD1 LEU 44 3HD1 LEU 44 0.818 -4.684 -1.776 333 1HD2 LEU 44 1HD2 LEU 44 3.331 -6.299 -2.229 334 2HD2 LEU 44 2HD2 LEU 44 3.244 -4.761 -1.371 335 3HD2 LEU 44 3HD2 LEU 44 4.368 -4.958 -2.716 336 H ALA 45 H ALA 45 0.804 -6.454 -7.347 337 HA ALA 45 HA ALA 45 3.195 -7.118 -8.783 338 1HB ALA 45 1HB ALA 45 0.369 -8.064 -9.232 339 2HB ALA 45 2HB ALA 45 1.561 -8.827 -8.178 340 3HB ALA 45 3HB ALA 45 1.826 -8.778 -9.921 341 H THR 46 H THR 46 0.915 -4.704 -9.226 342 HA THR 46 HA THR 46 1.707 -4.403 -12.039 343 HB THR 46 HB THR 46 -1.143 -4.008 -11.097 344 HG1 THR 46 HG1 THR 46 0.173 -6.266 -12.175 345 1HG2 THR 46 1HG2 THR 46 0.047 -4.226 -13.867 346 2HG2 THR 46 2HG2 THR 46 -0.521 -2.742 -13.104 347 3HG2 THR 46 3HG2 THR 46 -1.665 -4.028 -13.492 348 H GLU 47 H GLU 47 1.692 -3.092 -9.048 349 HA GLU 47 HA GLU 47 1.515 -1.049 -8.068 350 1HB GLU 47 1HB GLU 47 2.331 -0.145 -10.840 351 2HB GLU 47 2HB GLU 47 2.317 0.889 -9.418 352 1HG GLU 47 1HG GLU 47 4.031 -1.538 -9.878 353 2HG GLU 47 2HG GLU 47 4.554 0.146 -9.821 354 H ASN 48 H ASN 48 -0.816 -2.213 -9.038 355 HA ASN 48 HA ASN 48 -2.375 -0.093 -10.301 356 1HB ASN 48 1HB ASN 48 -2.492 -2.446 -11.144 357 2HB ASN 48 2HB ASN 48 -3.191 -2.924 -9.602 358 1HD2 ASN 48 1HD2 ASN 48 -3.895 0.102 -11.203 359 2HD2 ASN 48 2HD2 ASN 48 -5.534 -0.280 -11.599 360 H VAL 49 H VAL 49 -2.859 1.385 -8.764 361 HA VAL 49 HA VAL 49 -3.787 0.444 -6.149 362 HB VAL 49 HB VAL 49 -3.279 3.314 -6.911 363 1HG1 VAL 49 1HG1 VAL 49 -3.244 1.869 -4.265 364 2HG1 VAL 49 2HG1 VAL 49 -4.518 2.937 -4.853 365 3HG1 VAL 49 3HG1 VAL 49 -2.915 3.585 -4.507 366 1HG2 VAL 49 1HG2 VAL 49 -1.016 3.061 -5.971 367 2HG2 VAL 49 2HG2 VAL 49 -1.245 2.103 -7.433 368 3HG2 VAL 49 3HG2 VAL 49 -1.275 1.323 -5.852 369 H HIS 50 H HIS 50 -5.873 0.383 -5.703 370 HA HIS 50 HA HIS 50 -7.726 1.961 -7.362 371 1HB HIS 50 1HB HIS 50 -8.170 -0.544 -5.722 372 2HB HIS 50 2HB HIS 50 -9.476 0.377 -6.457 373 HD1 HIS 50 HD1 HIS 50 -10.270 -0.815 -8.464 374 HD2 HIS 50 HD2 HIS 50 -6.140 -1.097 -8.027 375 HE1 HIS 50 HE1 HIS 50 -9.459 -2.134 -10.450 376 HE2 HIS 50 HE2 HIS 50 -6.970 -2.363 -10.122 377 H ILE 51 H ILE 51 -7.810 3.909 -6.296 378 HA ILE 51 HA ILE 51 -8.167 3.950 -3.405 379 HB ILE 51 HB ILE 51 -8.075 6.266 -5.354 380 1HG1 ILE 51 1HG1 ILE 51 -5.837 6.642 -4.068 381 2HG1 ILE 51 2HG1 ILE 51 -5.973 4.933 -3.672 382 1HG2 ILE 51 1HG2 ILE 51 -9.333 6.832 -3.364 383 2HG2 ILE 51 2HG2 ILE 51 -7.778 7.665 -3.355 384 3HG2 ILE 51 3HG2 ILE 51 -8.024 6.244 -2.340 385 1HD1 ILE 51 1HD1 ILE 51 -4.559 5.271 -5.606 386 2HD1 ILE 51 2HD1 ILE 51 -5.870 6.107 -6.438 387 3HD1 ILE 51 3HD1 ILE 51 -6.022 4.392 -6.052 388 H VAL 52 H VAL 52 -10.188 3.217 -2.923 389 HA VAL 52 HA VAL 52 -12.496 4.086 -4.396 390 HB VAL 52 HB VAL 52 -12.453 2.756 -1.680 391 1HG1 VAL 52 1HG1 VAL 52 -14.592 3.745 -2.232 392 2HG1 VAL 52 2HG1 VAL 52 -14.707 1.987 -2.343 393 3HG1 VAL 52 3HG1 VAL 52 -14.583 2.958 -3.812 394 1HG2 VAL 52 1HG2 VAL 52 -12.757 0.633 -2.891 395 2HG2 VAL 52 2HG2 VAL 52 -11.202 1.382 -3.248 396 3HG2 VAL 52 3HG2 VAL 52 -12.516 1.482 -4.416 397 H LEU 53 H LEU 53 -13.338 6.028 -4.208 398 HA LEU 53 HA LEU 53 -12.518 7.847 -2.175 399 1HB LEU 53 1HB LEU 53 -14.652 8.078 -4.295 400 2HB LEU 53 2HB LEU 53 -14.111 9.399 -3.282 401 HG LEU 53 HG LEU 53 -12.470 7.922 -5.340 402 1HD1 LEU 53 1HD1 LEU 53 -13.482 10.756 -5.238 403 2HD1 LEU 53 2HD1 LEU 53 -14.071 9.475 -6.296 404 3HD1 LEU 53 3HD1 LEU 53 -12.426 10.084 -6.478 405 1HD2 LEU 53 1HD2 LEU 53 -11.083 8.520 -3.428 406 2HD2 LEU 53 2HD2 LEU 53 -11.678 10.180 -3.501 407 3HD2 LEU 53 3HD2 LEU 53 -10.698 9.534 -4.817 408 H LYS 54 H LYS 54 -14.408 9.301 -1.292 409 HA LYS 54 HA LYS 54 -15.756 7.781 0.678 410 1HB LYS 54 1HB LYS 54 -14.979 10.071 1.053 411 2HB LYS 54 2HB LYS 54 -16.078 10.665 -0.181 412 1HG LYS 54 1HG LYS 54 -17.975 9.864 1.221 413 2HG LYS 54 2HG LYS 54 -16.805 9.473 2.485 414 1HD LYS 54 1HD LYS 54 -16.093 11.795 2.562 415 2HD LYS 54 2HD LYS 54 -17.217 12.199 1.262 416 1HE LYS 54 1HE LYS 54 -19.079 11.433 2.737 417 2HE LYS 54 2HE LYS 54 -17.903 11.234 4.036 418 1HZ LYS 54 1HZ LYS 54 -18.988 13.353 4.227 419 2HZ LYS 54 2HZ LYS 54 -18.565 13.767 2.639 420 3HZ LYS 54 3HZ LYS 54 -17.361 13.599 3.820 421 H ASN 55 H ASN 55 -16.576 8.699 -2.531 422 HA ASN 55 HA ASN 55 -19.352 7.902 -2.052 423 1HB ASN 55 1HB ASN 55 -19.139 10.390 -2.270 424 2HB ASN 55 2HB ASN 55 -18.540 10.144 -3.905 425 1HD2 ASN 55 1HD2 ASN 55 -21.049 8.172 -2.455 426 2HD2 ASN 55 2HD2 ASN 55 -22.329 8.739 -3.467 427 H ASP 56 H ASP 56 -17.838 5.979 -2.815 428 HA ASP 56 HA ASP 56 -18.252 4.193 -4.144 429 1HB ASP 56 1HB ASP 56 -20.450 5.125 -4.647 430 2HB ASP 56 2HB ASP 56 -19.751 6.109 -5.930 431 H ASN 57 H ASN 57 -17.392 7.064 -6.067 432 HA ASN 57 HA ASN 57 -16.249 5.675 -8.211 433 1HB ASN 57 1HB ASN 57 -16.819 8.067 -8.313 434 2HB ASN 57 2HB ASN 57 -15.516 8.424 -7.187 435 1HD2 ASN 57 1HD2 ASN 57 -14.444 9.754 -8.639 436 2HD2 ASN 57 2HD2 ASN 57 -13.612 9.141 -10.022 437 H THR 58 H THR 58 -14.215 4.997 -8.699 438 HA THR 58 HA THR 58 -12.318 4.942 -6.449 439 HB THR 58 HB THR 58 -12.716 2.742 -8.484 440 HG1 THR 58 HG1 THR 58 -14.238 3.342 -6.405 441 1HG2 THR 58 1HG2 THR 58 -11.129 2.852 -5.916 442 2HG2 THR 58 2HG2 THR 58 -10.467 2.816 -7.551 443 3HG2 THR 58 3HG2 THR 58 -11.347 1.421 -6.924 444 H VAL 59 H VAL 59 -10.436 5.859 -6.880 445 HA VAL 59 HA VAL 59 -9.673 6.582 -9.564 446 HB VAL 59 HB VAL 59 -7.953 6.742 -7.083 447 1HG1 VAL 59 1HG1 VAL 59 -6.769 7.035 -9.189 448 2HG1 VAL 59 2HG1 VAL 59 -6.835 8.555 -8.294 449 3HG1 VAL 59 3HG1 VAL 59 -7.907 8.292 -9.671 450 1HG2 VAL 59 1HG2 VAL 59 -8.759 9.046 -6.818 451 2HG2 VAL 59 2HG2 VAL 59 -10.055 7.866 -6.623 452 3HG2 VAL 59 3HG2 VAL 59 -9.917 8.782 -8.125 453 H LEU 60 H LEU 60 -8.709 5.225 -10.914 454 HA LEU 60 HA LEU 60 -7.351 2.875 -9.805 455 1HB LEU 60 1HB LEU 60 -9.286 2.614 -11.411 456 2HB LEU 60 2HB LEU 60 -8.276 3.331 -12.647 457 HG LEU 60 HG LEU 60 -7.396 0.845 -11.200 458 1HD1 LEU 60 1HD1 LEU 60 -8.415 -0.481 -12.977 459 2HD1 LEU 60 2HD1 LEU 60 -9.145 0.974 -13.657 460 3HD1 LEU 60 3HD1 LEU 60 -9.639 0.402 -12.064 461 1HD2 LEU 60 1HD2 LEU 60 -6.831 1.940 -13.956 462 2HD2 LEU 60 2HD2 LEU 60 -6.166 0.459 -13.273 463 3HD2 LEU 60 3HD2 LEU 60 -5.745 2.020 -12.567 464 H LEU 61 H LEU 61 -5.253 3.264 -9.532 465 HA LEU 61 HA LEU 61 -3.801 4.861 -11.527 466 1HB LEU 61 1HB LEU 61 -2.786 3.824 -8.881 467 2HB LEU 61 2HB LEU 61 -2.027 5.026 -9.907 468 HG LEU 61 HG LEU 61 -4.615 5.388 -8.399 469 1HD1 LEU 61 1HD1 LEU 61 -3.342 6.912 -7.012 470 2HD1 LEU 61 2HD1 LEU 61 -1.883 6.571 -7.938 471 3HD1 LEU 61 3HD1 LEU 61 -2.628 5.302 -6.965 472 1HD2 LEU 61 1HD2 LEU 61 -4.422 7.730 -9.090 473 2HD2 LEU 61 2HD2 LEU 61 -4.597 6.656 -10.477 474 3HD2 LEU 61 3HD2 LEU 61 -3.015 7.321 -10.072 475 H LYS 62 H LYS 62 -2.130 4.018 -12.713 476 HA LYS 62 HA LYS 62 -1.274 1.294 -12.066 477 1HB LYS 62 1HB LYS 62 -0.881 0.971 -14.559 478 2HB LYS 62 2HB LYS 62 -2.546 0.921 -14.008 479 1HG LYS 62 1HG LYS 62 -2.930 3.153 -14.842 480 2HG LYS 62 2HG LYS 62 -1.227 3.308 -15.286 481 1HD LYS 62 1HD LYS 62 -1.447 1.516 -16.898 482 2HD LYS 62 2HD LYS 62 -3.113 1.234 -16.402 483 1HE LYS 62 1HE LYS 62 -2.128 3.824 -17.582 484 2HE LYS 62 2HE LYS 62 -2.844 2.524 -18.530 485 1HZ LYS 62 1HZ LYS 62 -4.134 4.208 -16.468 486 2HZ LYS 62 2HZ LYS 62 -4.815 2.739 -16.979 487 3HZ LYS 62 3HZ LYS 62 -4.578 3.997 -18.088 488 H GLY 63 H GLY 63 0.713 1.390 -11.381 489 1HA GLY 63 1HA GLY 63 2.409 3.624 -11.646 490 2HA GLY 63 2HA GLY 63 2.884 2.032 -11.070 491 H LEU 64 H LEU 64 3.048 0.370 -12.869 492 HA LEU 64 HA LEU 64 4.250 1.598 -15.247 493 1HB LEU 64 1HB LEU 64 5.342 -0.758 -13.694 494 2HB LEU 64 2HB LEU 64 5.968 -0.192 -15.230 495 HG LEU 64 HG LEU 64 5.963 1.414 -12.673 496 1HD1 LEU 64 1HD1 LEU 64 8.213 -0.048 -14.050 497 2HD1 LEU 64 2HD1 LEU 64 7.456 -0.506 -12.524 498 3HD1 LEU 64 3HD1 LEU 64 8.366 0.999 -12.638 499 1HD2 LEU 64 1HD2 LEU 64 7.247 1.935 -15.353 500 2HD2 LEU 64 2HD2 LEU 64 7.465 2.915 -13.903 501 3HD2 LEU 64 3HD2 LEU 64 5.879 2.809 -14.667 502 H LYS 65 H LYS 65 4.291 -1.806 -14.660 503 HA LYS 65 HA LYS 65 1.888 -2.385 -16.128 504 1HB LYS 65 1HB LYS 65 4.589 -2.844 -17.407 505 2HB LYS 65 2HB LYS 65 3.149 -3.724 -17.894 506 1HG LYS 65 1HG LYS 65 3.491 -0.734 -18.022 507 2HG LYS 65 2HG LYS 65 3.654 -1.844 -19.381 508 1HD LYS 65 1HD LYS 65 1.144 -1.505 -17.741 509 2HD LYS 65 2HD LYS 65 1.449 -0.698 -19.278 510 1HE LYS 65 1HE LYS 65 1.636 -2.873 -20.380 511 2HE LYS 65 2HE LYS 65 1.340 -3.678 -18.838 512 1HZ LYS 65 1HZ LYS 65 -0.844 -2.639 -18.759 513 2HZ LYS 65 2HZ LYS 65 -0.666 -3.567 -20.168 514 3HZ LYS 65 3HZ LYS 65 -0.558 -1.872 -20.247 515 H ASN 66 H ASN 66 5.009 -4.070 -15.782 516 HA ASN 66 HA ASN 66 3.596 -6.153 -14.244 517 1HB ASN 66 1HB ASN 66 4.277 -6.908 -16.503 518 2HB ASN 66 2HB ASN 66 5.946 -6.509 -16.121 519 1HD2 ASN 66 1HD2 ASN 66 4.688 -9.072 -16.853 520 2HD2 ASN 66 2HD2 ASN 66 5.107 -10.172 -15.585 521 H ILE 67 H ILE 67 4.138 -5.959 -12.204 522 HA ILE 67 HA ILE 67 6.998 -5.849 -11.532 523 HB ILE 67 HB ILE 67 4.863 -4.473 -9.869 524 1HG1 ILE 67 1HG1 ILE 67 6.197 -2.359 -10.661 525 2HG1 ILE 67 2HG1 ILE 67 6.648 -3.376 -12.026 526 1HG2 ILE 67 1HG2 ILE 67 6.818 -5.199 -8.611 527 2HG2 ILE 67 2HG2 ILE 67 6.780 -3.439 -8.731 528 3HG2 ILE 67 3HG2 ILE 67 7.877 -4.368 -9.751 529 1HD1 ILE 67 1HD1 ILE 67 4.751 -1.996 -12.587 530 2HD1 ILE 67 2HD1 ILE 67 3.851 -2.623 -11.207 531 3HD1 ILE 67 3HD1 ILE 67 4.267 -3.691 -12.548 532 H VAL 68 H VAL 68 5.635 -8.156 -11.934 533 HA VAL 68 HA VAL 68 4.337 -9.095 -9.563 534 HB VAL 68 HB VAL 68 5.331 -10.712 -11.917 535 1HG1 VAL 68 1HG1 VAL 68 3.293 -11.376 -9.789 536 2HG1 VAL 68 2HG1 VAL 68 4.910 -12.068 -9.921 537 3HG1 VAL 68 3HG1 VAL 68 3.709 -12.386 -11.173 538 1HG2 VAL 68 1HG2 VAL 68 3.755 -8.992 -12.627 539 2HG2 VAL 68 2HG2 VAL 68 2.612 -9.516 -11.390 540 3HG2 VAL 68 3HG2 VAL 68 3.019 -10.593 -12.725 541 H SER 69 H SER 69 5.964 -8.651 -8.006 542 HA SER 69 HA SER 69 8.016 -10.745 -7.855 543 1HB SER 69 1HB SER 69 8.754 -9.364 -5.826 544 2HB SER 69 2HB SER 69 8.969 -8.615 -7.409 545 HG SER 69 HG SER 69 7.864 -7.045 -6.564 546 H VAL 70 H VAL 70 4.906 -10.162 -7.103 547 HA VAL 70 HA VAL 70 4.673 -11.125 -4.445 548 HB VAL 70 HB VAL 70 2.566 -11.157 -6.617 549 1HG1 VAL 70 1HG1 VAL 70 1.996 -12.521 -4.683 550 2HG1 VAL 70 2HG1 VAL 70 0.977 -11.083 -4.755 551 3HG1 VAL 70 3HG1 VAL 70 2.318 -11.158 -3.610 552 1HG2 VAL 70 1HG2 VAL 70 1.835 -8.994 -5.720 553 2HG2 VAL 70 2HG2 VAL 70 3.468 -8.913 -6.384 554 3HG2 VAL 70 3HG2 VAL 70 3.229 -8.978 -4.637 555 H LYS 71 H LYS 71 4.508 -13.154 -3.693 556 HA LYS 71 HA LYS 71 4.470 -15.327 -5.682 557 1HB LYS 71 1HB LYS 71 5.683 -15.438 -2.914 558 2HB LYS 71 2HB LYS 71 5.785 -16.671 -4.166 559 1HG LYS 71 1HG LYS 71 6.946 -14.868 -5.569 560 2HG LYS 71 2HG LYS 71 7.137 -14.004 -4.042 561 1HD LYS 71 1HD LYS 71 9.125 -15.295 -4.482 562 2HD LYS 71 2HD LYS 71 8.268 -16.000 -3.111 563 1HE LYS 71 1HE LYS 71 9.074 -17.724 -4.649 564 2HE LYS 71 2HE LYS 71 7.313 -17.709 -4.553 565 1HZ LYS 71 1HZ LYS 71 8.057 -17.941 -6.832 566 2HZ LYS 71 2HZ LYS 71 8.950 -16.501 -6.725 567 3HZ LYS 71 3HZ LYS 71 7.257 -16.457 -6.633 568 H PHE 72 H PHE 72 3.373 -17.277 -5.051 569 HA PHE 72 HA PHE 72 0.944 -16.681 -3.598 570 1HB PHE 72 1HB PHE 72 1.807 -19.206 -5.028 571 2HB PHE 72 2HB PHE 72 0.211 -18.927 -4.336 572 HD1 PHE 72 HD1 PHE 72 2.402 -18.329 -7.142 573 HD2 PHE 72 HD2 PHE 72 -1.266 -17.196 -5.310 574 HE1 PHE 72 HE1 PHE 72 1.665 -17.314 -9.258 575 HE2 PHE 72 HE2 PHE 72 -2.013 -16.178 -7.423 576 HZ PHE 72 HZ PHE 72 -0.547 -16.238 -9.399 577 H SER 73 H SER 73 2.071 -16.371 -1.581 578 HA SER 73 HA SER 73 2.509 -18.895 -0.151 579 1HB SER 73 1HB SER 73 4.244 -16.416 0.052 580 2HB SER 73 2HB SER 73 4.422 -17.872 1.034 581 HG SER 73 HG SER 73 4.432 -18.752 -1.395 582 H LYS 74 H LYS 74 2.424 -18.583 2.240 583 HA LYS 74 HA LYS 74 0.824 -16.256 3.053 584 1HB LYS 74 1HB LYS 74 0.262 -19.102 3.920 585 2HB LYS 74 2HB LYS 74 -0.618 -17.667 4.429 586 1HG LYS 74 1HG LYS 74 -1.334 -17.331 2.085 587 2HG LYS 74 2HG LYS 74 -0.532 -18.844 1.659 588 1HD LYS 74 1HD LYS 74 -1.973 -19.987 3.357 589 2HD LYS 74 2HD LYS 74 -2.855 -18.469 3.543 590 1HE LYS 74 1HE LYS 74 -4.069 -19.841 2.011 591 2HE LYS 74 2HE LYS 74 -3.326 -18.531 1.094 592 1HZ LYS 74 1HZ LYS 74 -1.505 -20.107 0.537 593 2HZ LYS 74 2HZ LYS 74 -3.009 -20.535 -0.109 594 3HZ LYS 74 3HZ LYS 74 -2.414 -21.350 1.256 595 H ASP 75 H ASP 75 2.563 -15.308 4.120 596 HA ASP 75 HA ASP 75 3.209 -16.639 6.647 597 1HB ASP 75 1HB ASP 75 5.129 -16.984 5.073 598 2HB ASP 75 2HB ASP 75 5.315 -15.233 4.993 599 H ARG 76 H ARG 76 3.308 -15.298 8.375 600 HA ARG 76 HA ARG 76 2.394 -12.564 7.862 601 1HB ARG 76 1HB ARG 76 2.288 -14.231 10.380 602 2HB ARG 76 2HB ARG 76 1.618 -12.616 10.202 603 1HG ARG 76 1HG ARG 76 -0.001 -13.390 8.621 604 2HG ARG 76 2HG ARG 76 0.745 -14.988 8.570 605 1HD ARG 76 1HD ARG 76 0.182 -15.343 10.909 606 2HD ARG 76 2HD ARG 76 -0.521 -13.729 10.996 607 HE ARG 76 HE ARG 76 -2.224 -14.495 9.418 608 1HH1 ARG 76 1HH1 ARG 76 -0.314 -16.949 11.038 609 2HH1 ARG 76 2HH1 ARG 76 -1.551 -18.164 10.929 610 1HH2 ARG 76 1HH2 ARG 76 -3.838 -16.091 9.259 611 2HH2 ARG 76 2HH2 ARG 76 -3.546 -17.687 9.893 612 H HIS 77 H HIS 77 5.093 -14.330 9.112 613 HA HIS 77 HA HIS 77 5.940 -12.158 10.831 614 1HB HIS 77 1HB HIS 77 7.078 -14.886 10.289 615 2HB HIS 77 2HB HIS 77 7.946 -13.681 11.234 616 HD1 HIS 77 HD1 HIS 77 6.732 -12.883 13.493 617 HD2 HIS 77 HD2 HIS 77 5.162 -16.282 11.667 618 HE1 HIS 77 HE1 HIS 77 5.321 -14.007 15.240 619 HE2 HIS 77 HE2 HIS 77 4.232 -15.943 14.054 620 H LEU 78 H LEU 78 6.678 -13.396 7.650 621 HA LEU 78 HA LEU 78 9.086 -11.962 7.262 622 1HB LEU 78 1HB LEU 78 8.292 -13.719 5.727 623 2HB LEU 78 2HB LEU 78 6.960 -12.689 5.238 624 HG LEU 78 HG LEU 78 8.493 -11.116 4.205 625 1HD1 LEU 78 1HD1 LEU 78 10.684 -12.966 5.141 626 2HD1 LEU 78 2HD1 LEU 78 10.365 -11.341 5.750 627 3HD1 LEU 78 3HD1 LEU 78 10.893 -11.570 4.083 628 1HD2 LEU 78 1HD2 LEU 78 7.722 -12.985 2.857 629 2HD2 LEU 78 2HD2 LEU 78 9.073 -13.970 3.420 630 3HD2 LEU 78 3HD2 LEU 78 9.377 -12.549 2.421 631 H ILE 79 H ILE 79 5.696 -11.087 6.957 632 HA ILE 79 HA ILE 79 6.075 -8.421 6.071 633 HB ILE 79 HB ILE 79 3.836 -9.530 7.783 634 1HG1 ILE 79 1HG1 ILE 79 3.938 -9.274 4.769 635 2HG1 ILE 79 2HG1 ILE 79 4.233 -10.776 5.642 636 1HG2 ILE 79 1HG2 ILE 79 3.911 -7.107 5.984 637 2HG2 ILE 79 2HG2 ILE 79 3.910 -7.090 7.748 638 3HG2 ILE 79 3HG2 ILE 79 2.505 -7.695 6.872 639 1HD1 ILE 79 1HD1 ILE 79 1.970 -10.691 6.548 640 2HD1 ILE 79 2HD1 ILE 79 1.968 -10.685 4.784 641 3HD1 ILE 79 3HD1 ILE 79 1.678 -9.188 5.673 642 H GLU 80 H GLU 80 5.609 -9.880 9.247 643 HA GLU 80 HA GLU 80 5.671 -7.625 10.858 644 1HB GLU 80 1HB GLU 80 4.984 -9.815 11.639 645 2HB GLU 80 2HB GLU 80 6.605 -10.444 11.407 646 1HG GLU 80 1HG GLU 80 7.404 -8.871 13.146 647 2HG GLU 80 2HG GLU 80 5.727 -8.398 13.427 648 H THR 81 H THR 81 8.395 -9.749 9.951 649 HA THR 81 HA THR 81 10.358 -8.347 11.406 650 HB THR 81 HB THR 81 11.966 -9.470 9.741 651 HG1 THR 81 HG1 THR 81 9.717 -11.049 9.072 652 1HG2 THR 81 1HG2 THR 81 10.050 -11.172 11.339 653 2HG2 THR 81 2HG2 THR 81 11.486 -10.365 11.967 654 3HG2 THR 81 3HG2 THR 81 11.649 -11.663 10.784 655 H THR 82 H THR 82 9.282 -8.055 8.041 656 HA THR 82 HA THR 82 11.243 -6.144 7.305 657 HB THR 82 HB THR 82 8.518 -6.573 6.063 658 HG1 THR 82 HG1 THR 82 9.490 -8.511 5.864 659 1HG2 THR 82 1HG2 THR 82 11.075 -5.446 4.910 660 2HG2 THR 82 2HG2 THR 82 9.640 -4.510 5.332 661 3HG2 THR 82 3HG2 THR 82 9.566 -5.700 4.032 662 H SER 83 H SER 83 7.985 -5.894 8.641 663 HA SER 83 HA SER 83 7.804 -3.067 8.492 664 1HB SER 83 1HB SER 83 5.914 -4.772 8.922 665 2HB SER 83 2HB SER 83 6.457 -4.764 10.599 666 HG SER 83 HG SER 83 5.212 -3.087 10.778 667 H ASN 84 H ASN 84 9.005 -5.329 10.925 668 HA ASN 84 HA ASN 84 9.697 -3.429 12.888 669 1HB ASN 84 1HB ASN 84 9.639 -5.866 13.321 670 2HB ASN 84 2HB ASN 84 11.040 -6.072 12.277 671 1HD2 ASN 84 1HD2 ASN 84 12.515 -6.767 13.719 672 2HD2 ASN 84 2HD2 ASN 84 13.033 -5.857 15.104 673 H LYS 85 H LYS 85 11.368 -4.660 10.053 674 HA LYS 85 HA LYS 85 13.875 -3.451 10.542 675 1HB LYS 85 1HB LYS 85 13.354 -5.325 8.922 676 2HB LYS 85 2HB LYS 85 12.678 -4.108 7.850 677 1HG LYS 85 1HG LYS 85 14.801 -3.050 7.594 678 2HG LYS 85 2HG LYS 85 15.517 -4.070 8.844 679 1HD LYS 85 1HD LYS 85 14.970 -6.051 7.404 680 2HD LYS 85 2HD LYS 85 14.512 -4.917 6.134 681 1HE LYS 85 1HE LYS 85 16.737 -4.027 6.044 682 2HE LYS 85 2HE LYS 85 17.220 -4.968 7.452 683 1HZ LYS 85 1HZ LYS 85 16.743 -6.991 6.130 684 2HZ LYS 85 2HZ LYS 85 18.027 -6.063 5.526 685 3HZ LYS 85 3HZ LYS 85 16.510 -6.009 4.764 686 H LEU 86 H LEU 86 10.939 -2.372 8.969 687 HA LEU 86 HA LEU 86 11.876 0.084 7.949 688 1HB LEU 86 1HB LEU 86 9.751 -0.902 7.271 689 2HB LEU 86 2HB LEU 86 9.134 -0.757 8.903 690 HG LEU 86 HG LEU 86 9.307 1.738 8.661 691 1HD1 LEU 86 1HD1 LEU 86 9.783 1.049 5.769 692 2HD1 LEU 86 2HD1 LEU 86 10.950 1.795 6.863 693 3HD1 LEU 86 3HD1 LEU 86 9.478 2.659 6.417 694 1HD2 LEU 86 1HD2 LEU 86 7.538 0.269 6.713 695 2HD2 LEU 86 2HD2 LEU 86 7.288 1.918 7.287 696 3HD2 LEU 86 3HD2 LEU 86 7.193 0.565 8.416 697 H LYS 87 H LYS 87 10.550 -0.882 11.058 698 HA LYS 87 HA LYS 87 10.538 1.740 12.193 699 1HB LYS 87 1HB LYS 87 9.006 0.075 13.029 700 2HB LYS 87 2HB LYS 87 10.328 -1.015 13.421 701 1HG LYS 87 1HG LYS 87 11.097 0.512 15.149 702 2HG LYS 87 2HG LYS 87 9.809 1.645 14.736 703 1HD LYS 87 1HD LYS 87 9.174 0.361 16.683 704 2HD LYS 87 2HD LYS 87 8.145 -0.074 15.319 705 1HE LYS 87 1HE LYS 87 8.762 -2.083 16.477 706 2HE LYS 87 2HE LYS 87 9.601 -2.056 14.925 707 1HZ LYS 87 1HZ LYS 87 11.607 -1.336 16.041 708 2HZ LYS 87 2HZ LYS 87 11.040 -2.757 16.765 709 3HZ LYS 87 3HZ LYS 87 10.804 -1.264 17.530 710 H SER 88 H SER 88 12.763 -0.994 12.254 711 HA SER 88 HA SER 88 14.466 0.125 14.255 712 1HB SER 88 1HB SER 88 14.985 -2.122 12.294 713 2HB SER 88 2HB SER 88 15.968 -1.749 13.711 714 HG SER 88 HG SER 88 13.354 -2.795 13.566 715 H ARG 89 H ARG 89 14.779 -0.270 10.717 716 HA ARG 89 HA ARG 89 17.092 1.533 10.836 717 1HB ARG 89 1HB ARG 89 17.014 -0.800 9.603 718 2HB ARG 89 2HB ARG 89 16.228 0.121 8.332 719 1HG ARG 89 1HG ARG 89 18.974 0.623 9.466 720 2HG ARG 89 2HG ARG 89 18.599 -0.085 7.895 721 1HD ARG 89 1HD ARG 89 17.524 2.007 7.221 722 2HD ARG 89 2HD ARG 89 17.902 2.707 8.792 723 HE ARG 89 HE ARG 89 19.785 2.141 6.620 724 1HH1 ARG 89 1HH1 ARG 89 19.230 3.272 9.888 725 2HH1 ARG 89 2HH1 ARG 89 20.680 4.228 9.951 726 1HH2 ARG 89 1HH2 ARG 89 21.690 3.407 6.683 727 2HH2 ARG 89 2HH2 ARG 89 22.095 4.284 8.128 728 H GLU 90 H GLU 90 14.669 0.970 8.333 729 HA GLU 90 HA GLU 90 13.020 2.999 8.165 730 1HB GLU 90 1HB GLU 90 14.020 4.907 7.025 731 2HB GLU 90 2HB GLU 90 14.832 4.657 8.563 732 1HG GLU 90 1HG GLU 90 16.668 3.519 7.363 733 2HG GLU 90 2HG GLU 90 15.863 3.893 5.840 734 H ILE 91 H ILE 91 15.571 1.358 6.529 735 HA ILE 91 HA ILE 91 15.918 0.649 4.400 736 HB ILE 91 HB ILE 91 14.190 -0.972 3.627 737 1HG1 ILE 91 1HG1 ILE 91 12.733 -0.134 6.151 738 2HG1 ILE 91 2HG1 ILE 91 12.186 0.199 4.511 739 1HG2 ILE 91 1HG2 ILE 91 15.982 -1.648 5.088 740 2HG2 ILE 91 2HG2 ILE 91 14.501 -2.493 5.535 741 3HG2 ILE 91 3HG2 ILE 91 15.067 -1.131 6.503 742 1HD1 ILE 91 1HD1 ILE 91 12.524 -2.532 5.729 743 2HD1 ILE 91 2HD1 ILE 91 11.952 -2.186 4.095 744 3HD1 ILE 91 3HD1 ILE 91 11.000 -1.681 5.493 745 H THR 92 H THR 92 13.179 0.205 2.816 746 HA THR 92 HA THR 92 12.715 2.921 1.926 747 HB THR 92 HB THR 92 13.621 0.790 -0.038 748 HG1 THR 92 HG1 THR 92 15.025 2.577 1.488 749 1HG2 THR 92 1HG2 THR 92 13.067 3.737 -0.427 750 2HG2 THR 92 2HG2 THR 92 12.037 2.416 -0.980 751 3HG2 THR 92 3HG2 THR 92 13.650 2.621 -1.663 752 H PHE 93 H PHE 93 10.758 3.077 0.669 753 HA PHE 93 HA PHE 93 8.668 1.476 1.563 754 1HB PHE 93 1HB PHE 93 8.492 3.798 0.610 755 2HB PHE 93 2HB PHE 93 8.698 3.101 -0.991 756 HD1 PHE 93 HD1 PHE 93 6.853 2.409 -2.195 757 HD2 PHE 93 HD2 PHE 93 6.518 2.919 2.016 758 HE1 PHE 93 HE1 PHE 93 4.419 2.058 -2.349 759 HE2 PHE 93 HE2 PHE 93 4.091 2.566 1.872 760 HZ PHE 93 HZ PHE 93 3.039 2.136 -0.312 761 H GLN 94 H GLN 94 10.695 1.204 -1.274 762 HA GLN 94 HA GLN 94 9.207 -0.787 -2.621 763 1HB GLN 94 1HB GLN 94 12.166 -0.182 -2.711 764 2HB GLN 94 2HB GLN 94 11.319 -1.230 -3.840 765 1HG GLN 94 1HG GLN 94 10.895 1.722 -3.454 766 2HG GLN 94 2HG GLN 94 11.653 0.929 -4.834 767 1HE2 GLN 94 1HE2 GLN 94 9.337 2.690 -4.725 768 2HE2 GLN 94 2HE2 GLN 94 8.026 1.800 -5.422 769 H GLU 95 H GLU 95 11.986 -0.988 -0.421 770 HA GLU 95 HA GLU 95 12.330 -3.757 -0.443 771 1HB GLU 95 1HB GLU 95 13.971 -2.193 0.486 772 2HB GLU 95 2HB GLU 95 12.867 -1.791 1.791 773 1HG GLU 95 1HG GLU 95 14.589 -3.304 2.555 774 2HG GLU 95 2HG GLU 95 13.009 -4.079 2.626 775 H TYR 96 H TYR 96 10.327 -1.716 1.637 776 HA TYR 96 HA TYR 96 9.400 -3.687 3.380 777 1HB TYR 96 1HB TYR 96 9.094 -1.250 3.712 778 2HB TYR 96 2HB TYR 96 7.920 -1.234 2.406 779 HD1 TYR 96 HD1 TYR 96 5.709 -1.206 3.029 780 HD2 TYR 96 HD2 TYR 96 8.510 -3.135 5.582 781 HE1 TYR 96 HE1 TYR 96 3.908 -1.682 4.636 782 HE2 TYR 96 HE2 TYR 96 6.716 -3.617 7.192 783 HH TYR 96 HH TYR 96 4.541 -2.839 7.818 784 H ARG 97 H ARG 97 8.022 -2.556 0.298 785 HA ARG 97 HA ARG 97 5.809 -4.345 0.353 786 1HB ARG 97 1HB ARG 97 7.089 -3.044 -2.054 787 2HB ARG 97 2HB ARG 97 5.478 -3.740 -1.978 788 1HG ARG 97 1HG ARG 97 4.902 -2.016 -0.270 789 2HG ARG 97 2HG ARG 97 6.469 -1.267 -0.584 790 1HD ARG 97 1HD ARG 97 4.197 -1.661 -2.518 791 2HD ARG 97 2HD ARG 97 4.833 -0.137 -1.905 792 HE ARG 97 HE ARG 97 6.950 -0.833 -3.131 793 1HH1 ARG 97 1HH1 ARG 97 3.766 -1.829 -4.129 794 2HH1 ARG 97 2HH1 ARG 97 4.155 -1.863 -5.828 795 1HH2 ARG 97 1HH2 ARG 97 7.492 -0.922 -5.373 796 2HH2 ARG 97 2HH2 ARG 97 6.250 -1.337 -6.517 797 H ARG 98 H ARG 98 9.060 -4.500 -0.886 798 HA ARG 98 HA ARG 98 8.859 -6.600 -2.686 799 1HB ARG 98 1HB ARG 98 10.805 -5.134 -2.466 800 2HB ARG 98 2HB ARG 98 11.174 -5.840 -0.901 801 1HG ARG 98 1HG ARG 98 11.667 -7.960 -1.925 802 2HG ARG 98 2HG ARG 98 11.174 -7.346 -3.505 803 1HD ARG 98 1HD ARG 98 12.968 -5.715 -3.462 804 2HD ARG 98 2HD ARG 98 13.432 -6.238 -1.845 805 HE ARG 98 HE ARG 98 13.869 -8.476 -2.990 806 1HH1 ARG 98 1HH1 ARG 98 14.201 -5.382 -4.607 807 2HH1 ARG 98 2HH1 ARG 98 15.481 -5.933 -5.658 808 1HH2 ARG 98 1HH2 ARG 98 15.540 -9.198 -4.387 809 2HH2 ARG 98 2HH2 ARG 98 16.234 -8.091 -5.528 810 H ASN 99 H ASN 99 9.505 -6.706 0.812 811 HA ASN 99 HA ASN 99 9.649 -9.586 0.778 812 1HB ASN 99 1HB ASN 99 9.728 -7.557 3.000 813 2HB ASN 99 2HB ASN 99 9.648 -9.287 3.325 814 1HD2 ASN 99 1HD2 ASN 99 11.730 -7.361 3.917 815 2HD2 ASN 99 2HD2 ASN 99 13.168 -7.934 3.149 816 H LEU 100 H LEU 100 7.201 -7.172 1.457 817 HA LEU 100 HA LEU 100 5.335 -8.933 2.649 818 1HB LEU 100 1HB LEU 100 5.241 -6.248 1.426 819 2HB LEU 100 2HB LEU 100 3.728 -7.132 1.442 820 HG LEU 100 HG LEU 100 3.850 -7.350 3.874 821 1HD1 LEU 100 1HD1 LEU 100 5.559 -6.194 5.163 822 2HD1 LEU 100 2HD1 LEU 100 6.363 -5.698 3.674 823 3HD1 LEU 100 3HD1 LEU 100 6.291 -7.406 4.110 824 1HD2 LEU 100 1HD2 LEU 100 3.519 -4.996 4.445 825 2HD2 LEU 100 2HD2 LEU 100 2.724 -5.413 2.927 826 3HD2 LEU 100 3HD2 LEU 100 4.247 -4.523 2.912 827 H ALA 101 H ALA 101 5.851 -7.938 -0.716 828 HA ALA 101 HA ALA 101 3.805 -9.523 -1.846 829 1HB ALA 101 1HB ALA 101 6.408 -8.641 -3.087 830 2HB ALA 101 2HB ALA 101 4.917 -7.700 -3.051 831 3HB ALA 101 3HB ALA 101 4.984 -9.214 -3.955 832 H LYS 102 H LYS 102 7.137 -10.157 -1.004 833 HA LYS 102 HA LYS 102 7.356 -12.746 -2.126 834 1HB LYS 102 1HB LYS 102 9.256 -11.280 -1.424 835 2HB LYS 102 2HB LYS 102 8.820 -11.578 0.249 836 1HG LYS 102 1HG LYS 102 9.241 -13.992 -0.126 837 2HG LYS 102 2HG LYS 102 9.809 -13.599 -1.750 838 1HD LYS 102 1HD LYS 102 10.983 -12.587 0.842 839 2HD LYS 102 2HD LYS 102 11.687 -13.817 -0.209 840 1HE LYS 102 1HE LYS 102 11.932 -12.186 -1.992 841 2HE LYS 102 2HE LYS 102 11.161 -10.952 -0.997 842 1HZ LYS 102 1HZ LYS 102 12.987 -11.086 0.556 843 2HZ LYS 102 2HZ LYS 102 13.587 -10.765 -0.995 844 3HZ LYS 102 3HZ LYS 102 13.715 -12.323 -0.343 845 H ALA 103 H ALA 103 5.955 -11.507 0.789 846 HA ALA 103 HA ALA 103 5.826 -14.067 2.125 847 1HB ALA 103 1HB ALA 103 4.653 -12.866 3.886 848 2HB ALA 103 2HB ALA 103 4.542 -11.436 2.858 849 3HB ALA 103 3HB ALA 103 6.116 -12.001 3.415 850 H GLY 104 H GLY 104 4.006 -12.408 -0.204 851 1HA GLY 104 1HA GLY 104 2.337 -13.799 -1.332 852 2HA GLY 104 2HA GLY 104 1.771 -14.281 0.258 853 H VAL 105 H VAL 105 2.514 -11.015 0.307 854 HA VAL 105 HA VAL 105 -0.272 -10.302 0.415 855 HB VAL 105 HB VAL 105 2.180 -8.537 0.552 856 1HG1 VAL 105 1HG1 VAL 105 -0.705 -7.929 1.214 857 2HG1 VAL 105 2HG1 VAL 105 0.214 -7.273 -0.141 858 3HG1 VAL 105 3HG1 VAL 105 0.665 -6.859 1.513 859 1HG2 VAL 105 1HG2 VAL 105 2.033 -10.187 2.368 860 2HG2 VAL 105 2HG2 VAL 105 0.417 -9.593 2.762 861 3HG2 VAL 105 3HG2 VAL 105 1.815 -8.535 2.949 862 H PHE 106 H PHE 106 -1.414 -10.041 -1.335 863 HA PHE 106 HA PHE 106 -0.142 -8.951 -3.754 864 1HB PHE 106 1HB PHE 106 -1.074 -11.204 -4.020 865 2HB PHE 106 2HB PHE 106 -2.638 -10.644 -3.446 866 HD1 PHE 106 HD1 PHE 106 -4.232 -9.928 -4.969 867 HD2 PHE 106 HD2 PHE 106 -0.140 -10.080 -6.134 868 HE1 PHE 106 HE1 PHE 106 -4.874 -9.412 -7.287 869 HE2 PHE 106 HE2 PHE 106 -0.776 -9.564 -8.452 870 HZ PHE 106 HZ PHE 106 -3.148 -9.228 -9.033 871 H ARG 107 H ARG 107 -2.706 -8.558 -1.432 872 HA ARG 107 HA ARG 107 -3.626 -6.173 -2.892 873 1HB ARG 107 1HB ARG 107 -5.239 -7.925 -1.028 874 2HB ARG 107 2HB ARG 107 -5.821 -6.476 -1.836 875 1HG ARG 107 1HG ARG 107 -5.380 -7.593 -4.015 876 2HG ARG 107 2HG ARG 107 -4.992 -9.065 -3.124 877 1HD ARG 107 1HD ARG 107 -7.248 -9.010 -2.123 878 2HD ARG 107 2HD ARG 107 -7.628 -7.598 -3.108 879 HE ARG 107 HE ARG 107 -6.728 -9.926 -4.569 880 1HH1 ARG 107 1HH1 ARG 107 -9.452 -8.091 -3.386 881 2HH1 ARG 107 2HH1 ARG 107 -10.589 -8.824 -4.467 882 1HH2 ARG 107 1HH2 ARG 107 -8.233 -10.928 -5.995 883 2HH2 ARG 107 2HH2 ARG 107 -9.896 -10.447 -5.946 884 H TRP 108 H TRP 108 -2.563 -4.568 -1.974 885 HA TRP 108 HA TRP 108 -2.236 -4.389 0.907 886 1HB TRP 108 1HB TRP 108 -0.427 -3.743 -0.671 887 2HB TRP 108 2HB TRP 108 -1.463 -2.485 -1.321 888 HD1 TRP 108 HD1 TRP 108 -2.404 -0.918 1.145 889 HE1 TRP 108 HE1 TRP 108 -0.742 0.332 2.656 890 HE3 TRP 108 HE3 TRP 108 1.849 -3.482 -0.047 891 HZ2 TRP 108 HZ2 TRP 108 2.013 0.250 3.251 892 HZ3 TRP 108 HZ3 TRP 108 3.961 -2.823 1.030 893 HH2 TRP 108 HH2 TRP 108 4.037 -0.994 2.641 894 H VAL 109 H VAL 109 -4.313 -4.072 1.725 895 HA VAL 109 HA VAL 109 -5.869 -1.847 0.601 896 HB VAL 109 HB VAL 109 -6.787 -3.977 2.542 897 1HG1 VAL 109 1HG1 VAL 109 -8.370 -1.972 0.934 898 2HG1 VAL 109 2HG1 VAL 109 -8.060 -1.882 2.667 899 3HG1 VAL 109 3HG1 VAL 109 -9.033 -3.200 2.013 900 1HG2 VAL 109 1HG2 VAL 109 -7.946 -4.980 0.643 901 2HG2 VAL 109 2HG2 VAL 109 -6.203 -4.946 0.375 902 3HG2 VAL 109 3HG2 VAL 109 -7.242 -3.774 -0.434 903 H THR 110 H THR 110 -5.192 -0.008 1.553 904 HA THR 110 HA THR 110 -5.019 0.031 4.488 905 HB THR 110 HB THR 110 -4.044 2.095 2.495 906 HG1 THR 110 HG1 THR 110 -2.937 -0.090 2.886 907 1HG2 THR 110 1HG2 THR 110 -4.711 3.090 4.644 908 2HG2 THR 110 2HG2 THR 110 -2.966 3.163 4.404 909 3HG2 THR 110 3HG2 THR 110 -3.657 1.956 5.490 910 H ASN 111 H ASN 111 -6.728 0.707 5.543 911 HA ASN 111 HA ASN 111 -8.665 2.439 4.159 912 1HB ASN 111 1HB ASN 111 -9.383 0.146 5.013 913 2HB ASN 111 2HB ASN 111 -9.144 0.769 6.642 914 1HD2 ASN 111 1HD2 ASN 111 -11.545 -0.195 5.217 915 2HD2 ASN 111 2HD2 ASN 111 -12.701 1.095 5.320 916 H ILE 112 H ILE 112 -8.281 4.522 4.652 917 HA ILE 112 HA ILE 112 -6.854 5.264 7.022 918 HB ILE 112 HB ILE 112 -6.947 6.468 4.665 919 1HG1 ILE 112 1HG1 ILE 112 -6.252 8.600 5.785 920 2HG1 ILE 112 2HG1 ILE 112 -6.748 7.891 7.320 921 1HG2 ILE 112 1HG2 ILE 112 -9.152 7.853 6.177 922 2HG2 ILE 112 2HG2 ILE 112 -9.271 7.048 4.612 923 3HG2 ILE 112 3HG2 ILE 112 -8.325 8.535 4.775 924 1HD1 ILE 112 1HD1 ILE 112 -4.599 6.841 5.496 925 2HD1 ILE 112 2HD1 ILE 112 -5.099 6.118 7.024 926 3HD1 ILE 112 3HD1 ILE 112 -4.355 7.716 7.009 927 H HIS 113 H HIS 113 -10.167 5.045 6.072 928 HA HIS 113 HA HIS 113 -11.365 6.598 8.119 929 1HB HIS 113 1HB HIS 113 -12.535 5.848 6.058 930 2HB HIS 113 2HB HIS 113 -12.438 4.185 6.636 931 HD1 HIS 113 HD1 HIS 113 -14.294 3.368 8.056 932 HD2 HIS 113 HD2 HIS 113 -14.280 7.520 7.731 933 HE1 HIS 113 HE1 HIS 113 -16.426 4.144 9.144 934 HE2 HIS 113 HE2 HIS 113 -16.412 6.651 8.930 935 H GLU 114 H GLU 114 -9.795 3.596 8.088 936 HA GLU 114 HA GLU 114 -11.121 2.713 10.558 937 1HB GLU 114 1HB GLU 114 -11.315 1.361 8.398 938 2HB GLU 114 2HB GLU 114 -9.611 0.989 8.601 939 1HG GLU 114 1HG GLU 114 -11.158 -0.759 9.394 940 2HG GLU 114 2HG GLU 114 -10.032 -0.181 10.621 941 H GLN 115 H GLN 115 -8.296 3.991 9.315 942 HA GLN 115 HA GLN 115 -6.148 4.208 10.016 943 1HB GLN 115 1HB GLN 115 -7.594 3.653 12.575 944 2HB GLN 115 2HB GLN 115 -5.840 3.724 12.582 945 1HG GLN 115 1HG GLN 115 -6.649 5.856 13.204 946 2HG GLN 115 2HG GLN 115 -6.000 5.997 11.574 947 1HE2 GLN 115 1HE2 GLN 115 -7.184 7.815 11.120 948 2HE2 GLN 115 2HE2 GLN 115 -8.892 7.776 10.852 949 H LYS 116 H LYS 116 -6.991 1.588 8.984 950 HA LYS 116 HA LYS 116 -4.949 -0.079 10.290 951 1HB LYS 116 1HB LYS 116 -7.729 -0.985 9.514 952 2HB LYS 116 2HB LYS 116 -6.445 -2.043 10.085 953 1HG LYS 116 1HG LYS 116 -6.443 -0.935 12.238 954 2HG LYS 116 2HG LYS 116 -7.653 0.216 11.671 955 1HD LYS 116 1HD LYS 116 -9.198 -1.707 11.290 956 2HD LYS 116 2HD LYS 116 -7.999 -2.752 12.057 957 1HE LYS 116 1HE LYS 116 -9.668 -2.121 13.684 958 2HE LYS 116 2HE LYS 116 -8.133 -1.362 14.093 959 1HZ LYS 116 1HZ LYS 116 -8.987 0.671 12.937 960 2HZ LYS 116 2HZ LYS 116 -9.815 0.263 14.353 961 3HZ LYS 116 3HZ LYS 116 -10.508 -0.077 12.847 962 H ARG 117 H ARG 117 -3.759 -1.347 8.975 963 HA ARG 117 HA ARG 117 -4.336 -1.279 6.094 964 1HB ARG 117 1HB ARG 117 -1.822 -1.941 7.629 965 2HB ARG 117 2HB ARG 117 -1.992 -2.231 5.907 966 1HG ARG 117 1HG ARG 117 -2.385 0.203 5.597 967 2HG ARG 117 2HG ARG 117 -2.039 0.426 7.316 968 1HD ARG 117 1HD ARG 117 0.170 -0.577 6.995 969 2HD ARG 117 2HD ARG 117 -0.174 -0.790 5.281 970 HE ARG 117 HE ARG 117 -0.494 1.914 5.871 971 1HH1 ARG 117 1HH1 ARG 117 2.036 -0.496 5.793 972 2HH1 ARG 117 2HH1 ARG 117 3.306 0.653 5.479 973 1HH2 ARG 117 1HH2 ARG 117 1.191 3.450 5.462 974 2HH2 ARG 117 2HH2 ARG 117 2.821 2.880 5.287 975 H TYR 118 H TYR 118 -5.273 -3.007 5.261 976 HA TYR 118 HA TYR 118 -5.030 -5.579 6.661 977 1HB TYR 118 1HB TYR 118 -7.042 -4.619 4.613 978 2HB TYR 118 2HB TYR 118 -6.987 -6.255 5.256 979 HD1 TYR 118 HD1 TYR 118 -7.430 -6.619 7.697 980 HD2 TYR 118 HD2 TYR 118 -8.105 -2.870 5.807 981 HE1 TYR 118 HE1 TYR 118 -8.884 -5.952 9.562 982 HE2 TYR 118 HE2 TYR 118 -9.560 -2.188 7.669 983 HH TYR 118 HH TYR 118 -10.958 -3.317 9.411 984 H TYR 119 H TYR 119 -3.386 -6.727 5.893 985 HA TYR 119 HA TYR 119 -2.634 -6.500 3.092 986 1HB TYR 119 1HB TYR 119 -1.356 -8.038 5.367 987 2HB TYR 119 2HB TYR 119 -0.710 -7.936 3.732 988 HD1 TYR 119 HD1 TYR 119 -0.303 -6.691 6.913 989 HD2 TYR 119 HD2 TYR 119 -0.606 -5.318 2.895 990 HE1 TYR 119 HE1 TYR 119 0.913 -4.643 7.526 991 HE2 TYR 119 HE2 TYR 119 0.611 -3.267 3.500 992 HH TYR 119 HH TYR 119 2.332 -2.932 6.372 993 H TYR 120 H TYR 120 -3.889 -7.620 1.764 994 HA TYR 120 HA TYR 120 -4.807 -10.293 2.558 995 1HB TYR 120 1HB TYR 120 -5.714 -8.386 0.402 996 2HB TYR 120 2HB TYR 120 -6.246 -10.061 0.466 997 HD1 TYR 120 HD1 TYR 120 -6.547 -6.752 1.991 998 HD2 TYR 120 HD2 TYR 120 -7.742 -10.821 2.222 999 HE1 TYR 120 HE1 TYR 120 -8.384 -6.121 3.499 1000 HE2 TYR 120 HE2 TYR 120 -9.579 -10.207 3.732 1001 HH TYR 120 HH TYR 120 -10.562 -6.979 4.219 1002 H THR 121 H THR 121 -4.319 -12.108 1.394 1003 HA THR 121 HA THR 121 -2.100 -11.974 -0.443 1004 HB THR 121 HB THR 121 -2.333 -13.845 1.175 1005 HG1 THR 121 HG1 THR 121 -1.069 -14.399 -0.519 1006 1HG2 THR 121 1HG2 THR 121 -3.950 -15.645 0.717 1007 2HG2 THR 121 2HG2 THR 121 -4.674 -14.658 -0.552 1008 3HG2 THR 121 3HG2 THR 121 -4.754 -14.128 1.127 1009 H PHE 122 H PHE 122 -2.490 -13.620 -2.457 1010 HA PHE 122 HA PHE 122 -3.991 -12.174 -4.316 1011 1HB PHE 122 1HB PHE 122 -2.157 -13.671 -4.952 1012 2HB PHE 122 2HB PHE 122 -3.099 -15.064 -4.438 1013 HD1 PHE 122 HD1 PHE 122 -4.658 -16.082 -5.883 1014 HD2 PHE 122 HD2 PHE 122 -2.948 -12.324 -6.912 1015 HE1 PHE 122 HE1 PHE 122 -5.607 -16.276 -8.145 1016 HE2 PHE 122 HE2 PHE 122 -3.901 -12.506 -9.174 1017 HZ PHE 122 HZ PHE 122 -5.231 -14.483 -9.794 1018 H ASP 123 H ASP 123 -4.851 -14.916 -2.324 1019 HA ASP 123 HA ASP 123 -7.354 -15.402 -3.674 1020 1HB ASP 123 1HB ASP 123 -5.941 -17.195 -2.601 1021 2HB ASP 123 2HB ASP 123 -6.396 -16.533 -1.037 1022 H ASN 124 H ASN 124 -6.580 -12.856 -2.034 1023 HA ASN 124 HA ASN 124 -7.685 -11.245 -0.882 1024 1HB ASN 124 1HB ASN 124 -9.446 -11.810 -2.605 1025 2HB ASN 124 2HB ASN 124 -10.198 -12.846 -1.401 1026 1HD2 ASN 124 1HD2 ASN 124 -11.520 -11.961 0.084 1027 2HD2 ASN 124 2HD2 ASN 124 -11.835 -10.266 0.230 1028 H SER 125 H SER 125 -6.738 -13.751 0.420 1029 HA SER 125 HA SER 125 -8.427 -13.825 2.794 1030 1HB SER 125 1HB SER 125 -5.886 -15.366 2.224 1031 2HB SER 125 2HB SER 125 -7.076 -15.708 3.483 1032 HG SER 125 HG SER 125 -8.105 -15.582 0.926 1033 H LEU 126 H LEU 126 -7.907 -12.823 4.660 1034 HA LEU 126 HA LEU 126 -5.904 -10.794 4.594 1035 1HB LEU 126 1HB LEU 126 -8.038 -10.502 5.760 1036 2HB LEU 126 2HB LEU 126 -7.621 -11.795 6.867 1037 HG LEU 126 HG LEU 126 -5.752 -10.436 7.732 1038 1HD1 LEU 126 1HD1 LEU 126 -5.618 -8.067 7.137 1039 2HD1 LEU 126 2HD1 LEU 126 -6.865 -8.306 5.913 1040 3HD1 LEU 126 3HD1 LEU 126 -5.301 -9.105 5.747 1041 1HD2 LEU 126 1HD2 LEU 126 -8.432 -9.056 7.774 1042 2HD2 LEU 126 2HD2 LEU 126 -7.127 -8.822 8.939 1043 3HD2 LEU 126 3HD2 LEU 126 -7.937 -10.384 8.822 1044 H LEU 127 H LEU 127 -3.817 -11.035 5.027 1045 HA LEU 127 HA LEU 127 -2.932 -13.408 6.491 1046 1HB LEU 127 1HB LEU 127 -1.477 -11.427 4.751 1047 2HB LEU 127 2HB LEU 127 -0.644 -12.646 5.696 1048 HG LEU 127 HG LEU 127 -2.660 -13.209 3.518 1049 1HD1 LEU 127 1HD1 LEU 127 -0.567 -12.312 2.640 1050 2HD1 LEU 127 2HD1 LEU 127 -0.733 -14.027 2.257 1051 3HD1 LEU 127 3HD1 LEU 127 0.341 -13.514 3.558 1052 1HD2 LEU 127 1HD2 LEU 127 -2.677 -14.912 5.257 1053 2HD2 LEU 127 2HD2 LEU 127 -0.922 -15.058 5.153 1054 3HD2 LEU 127 3HD2 LEU 127 -1.932 -15.536 3.786 1055 H PHE 128 H PHE 128 -2.464 -9.877 6.510 1056 HA PHE 128 HA PHE 128 -1.752 -10.071 9.346 1057 1HB PHE 128 1HB PHE 128 0.327 -10.049 7.871 1058 2HB PHE 128 2HB PHE 128 -0.126 -8.413 7.413 1059 HD1 PHE 128 HD1 PHE 128 0.929 -10.556 10.215 1060 HD2 PHE 128 HD2 PHE 128 0.280 -6.578 8.850 1061 HE1 PHE 128 HE1 PHE 128 2.119 -9.690 12.188 1062 HE2 PHE 128 HE2 PHE 128 1.468 -5.702 10.816 1063 HZ PHE 128 HZ PHE 128 2.393 -7.260 12.487 1064 H THR 129 H THR 129 -2.325 -8.302 10.565 1065 HA THR 129 HA THR 129 -3.590 -6.049 9.147 1066 HB THR 129 HB THR 129 -4.528 -7.180 11.795 1067 HG1 THR 129 HG1 THR 129 -5.029 -7.987 9.241 1068 1HG2 THR 129 1HG2 THR 129 -5.025 -4.800 11.467 1069 2HG2 THR 129 2HG2 THR 129 -6.499 -5.767 11.407 1070 3HG2 THR 129 3HG2 THR 129 -5.777 -5.166 9.914 1071 H GLU 130 H GLU 130 -2.632 -4.157 9.609 1072 HA GLU 130 HA GLU 130 -1.394 -3.857 12.256 1073 1HB GLU 130 1HB GLU 130 0.358 -4.274 10.543 1074 2HB GLU 130 2HB GLU 130 -0.199 -2.854 9.666 1075 1HG GLU 130 1HG GLU 130 1.806 -2.417 11.017 1076 2HG GLU 130 2HG GLU 130 0.433 -1.418 11.494 1077 H SER 131 H SER 131 -1.463 -1.804 13.146 1078 HA SER 131 HA SER 131 -3.560 -0.107 11.993 1079 1HB SER 131 1HB SER 131 -3.555 0.857 14.368 1080 2HB SER 131 2HB SER 131 -4.120 -0.804 14.188 1081 HG SER 131 HG SER 131 -1.398 -0.334 14.699 1082 H ILE 132 H ILE 132 -3.065 1.820 11.141 1083 HA ILE 132 HA ILE 132 -0.355 2.834 11.391 1084 HB ILE 132 HB ILE 132 -1.095 4.602 9.813 1085 1HG1 ILE 132 1HG1 ILE 132 -3.710 3.079 9.866 1086 2HG1 ILE 132 2HG1 ILE 132 -3.454 4.720 10.447 1087 1HG2 ILE 132 1HG2 ILE 132 -1.661 1.766 8.963 1088 2HG2 ILE 132 2HG2 ILE 132 -0.090 2.567 8.977 1089 3HG2 ILE 132 3HG2 ILE 132 -1.348 3.117 7.873 1090 1HD1 ILE 132 1HD1 ILE 132 -2.930 5.437 8.172 1091 2HD1 ILE 132 2HD1 ILE 132 -4.538 4.725 8.286 1092 3HD1 ILE 132 3HD1 ILE 132 -3.209 3.795 7.595 1093 H GLN 133 H GLN 133 -3.117 3.041 13.132 1094 HA GLN 133 HA GLN 133 -1.918 5.118 14.758 1095 1HB GLN 133 1HB GLN 133 -3.720 6.210 13.309 1096 2HB GLN 133 2HB GLN 133 -4.881 5.207 14.168 1097 1HG GLN 133 1HG GLN 133 -4.058 6.212 16.298 1098 2HG GLN 133 2HG GLN 133 -3.085 7.317 15.334 1099 1HE2 GLN 133 1HE2 GLN 133 -5.191 7.914 17.207 1100 2HE2 GLN 133 2HE2 GLN 133 -6.406 8.784 16.329 Start of MODEL 8 1 H ASP 7 H ASP 7 -5.269 15.217 -16.405 2 HA ASP 7 HA ASP 7 -6.379 12.548 -16.295 3 1HB ASP 7 1HB ASP 7 -4.305 13.191 -17.642 4 2HB ASP 7 2HB ASP 7 -3.455 13.262 -16.100 5 H GLN 8 H GLN 8 -7.300 12.230 -14.376 6 HA GLN 8 HA GLN 8 -6.323 13.288 -11.927 7 1HB GLN 8 1HB GLN 8 -8.702 12.770 -12.447 8 2HB GLN 8 2HB GLN 8 -8.308 11.059 -12.392 9 1HG GLN 8 1HG GLN 8 -7.834 11.163 -10.068 10 2HG GLN 8 2HG GLN 8 -7.919 12.925 -10.071 11 1HE2 GLN 8 1HE2 GLN 8 -10.149 10.958 -11.880 12 2HE2 GLN 8 2HE2 GLN 8 -11.540 11.291 -10.909 13 H VAL 9 H VAL 9 -5.689 10.451 -13.737 14 HA VAL 9 HA VAL 9 -4.703 8.775 -11.692 15 HB VAL 9 HB VAL 9 -3.886 8.868 -14.608 16 1HG1 VAL 9 1HG1 VAL 9 -3.576 6.681 -12.552 17 2HG1 VAL 9 2HG1 VAL 9 -2.276 7.633 -13.271 18 3HG1 VAL 9 3HG1 VAL 9 -3.219 6.527 -14.271 19 1HG2 VAL 9 1HG2 VAL 9 -5.524 7.086 -14.925 20 2HG2 VAL 9 2HG2 VAL 9 -6.294 8.551 -14.312 21 3HG2 VAL 9 3HG2 VAL 9 -5.984 7.198 -13.226 22 H VAL 10 H VAL 10 -3.228 11.360 -13.627 23 HA VAL 10 HA VAL 10 -0.553 10.910 -12.873 24 HB VAL 10 HB VAL 10 -1.934 13.499 -13.601 25 1HG1 VAL 10 1HG1 VAL 10 0.299 14.408 -14.004 26 2HG1 VAL 10 2HG1 VAL 10 1.019 12.921 -13.387 27 3HG1 VAL 10 3HG1 VAL 10 0.086 13.962 -12.309 28 1HG2 VAL 10 1HG2 VAL 10 -0.179 11.646 -15.207 29 2HG2 VAL 10 2HG2 VAL 10 -0.872 13.165 -15.776 30 3HG2 VAL 10 3HG2 VAL 10 -1.927 11.811 -15.370 31 H ILE 11 H ILE 11 -3.111 12.787 -11.309 32 HA ILE 11 HA ILE 11 -1.485 14.023 -9.370 33 HB ILE 11 HB ILE 11 -4.447 13.471 -9.441 34 1HG1 ILE 11 1HG1 ILE 11 -4.491 16.012 -9.506 35 2HG1 ILE 11 2HG1 ILE 11 -2.746 15.954 -9.729 36 1HG2 ILE 11 1HG2 ILE 11 -4.677 14.914 -7.455 37 2HG2 ILE 11 2HG2 ILE 11 -2.922 14.906 -7.273 38 3HG2 ILE 11 3HG2 ILE 11 -3.831 13.404 -7.110 39 1HD1 ILE 11 1HD1 ILE 11 -4.804 14.769 -11.576 40 2HD1 ILE 11 2HD1 ILE 11 -3.057 14.716 -11.808 41 3HD1 ILE 11 3HD1 ILE 11 -3.904 16.262 -11.834 42 H PHE 12 H PHE 12 -3.571 11.133 -9.110 43 HA PHE 12 HA PHE 12 -2.815 10.615 -6.424 44 1HB PHE 12 1HB PHE 12 -4.245 9.003 -8.512 45 2HB PHE 12 2HB PHE 12 -3.823 8.297 -6.958 46 HD1 PHE 12 HD1 PHE 12 -5.882 10.808 -8.664 47 HD2 PHE 12 HD2 PHE 12 -4.962 8.942 -4.950 48 HE1 PHE 12 HE1 PHE 12 -7.915 11.777 -7.674 49 HE2 PHE 12 HE2 PHE 12 -6.997 9.907 -3.958 50 HZ PHE 12 HZ PHE 12 -8.475 11.327 -5.321 51 H LYS 13 H LYS 13 -1.694 9.308 -9.533 52 HA LYS 13 HA LYS 13 0.021 7.343 -8.452 53 1HB LYS 13 1HB LYS 13 -0.694 7.470 -10.853 54 2HB LYS 13 2HB LYS 13 0.393 8.842 -11.058 55 1HG LYS 13 1HG LYS 13 2.000 6.902 -9.932 56 2HG LYS 13 2HG LYS 13 0.963 5.994 -11.030 57 1HD LYS 13 1HD LYS 13 2.897 6.640 -12.260 58 2HD LYS 13 2HD LYS 13 1.567 7.658 -12.816 59 1HE LYS 13 1HE LYS 13 2.347 9.494 -11.459 60 2HE LYS 13 2HE LYS 13 3.592 8.476 -10.738 61 1HZ LYS 13 1HZ LYS 13 4.598 9.821 -12.401 62 2HZ LYS 13 2HZ LYS 13 3.440 9.388 -13.565 63 3HZ LYS 13 3HZ LYS 13 4.549 8.236 -13.003 64 H GLN 14 H GLN 14 0.374 10.765 -9.069 65 HA GLN 14 HA GLN 14 3.145 11.027 -8.803 66 1HB GLN 14 1HB GLN 14 1.383 12.781 -9.501 67 2HB GLN 14 2HB GLN 14 1.188 13.074 -7.779 68 1HG GLN 14 1HG GLN 14 2.690 14.700 -8.558 69 2HG GLN 14 2HG GLN 14 3.667 13.513 -7.693 70 1HE2 GLN 14 1HE2 GLN 14 2.786 14.793 -10.794 71 2HE2 GLN 14 2HE2 GLN 14 4.113 14.115 -11.680 72 H ILE 15 H ILE 15 0.557 11.121 -6.392 73 HA ILE 15 HA ILE 15 2.069 11.742 -4.137 74 HB ILE 15 HB ILE 15 -0.363 9.948 -4.259 75 1HG1 ILE 15 1HG1 ILE 15 -0.190 12.939 -3.824 76 2HG1 ILE 15 2HG1 ILE 15 -0.701 12.168 -5.321 77 1HG2 ILE 15 1HG2 ILE 15 0.775 11.551 -1.972 78 2HG2 ILE 15 2HG2 ILE 15 0.825 9.796 -2.132 79 3HG2 ILE 15 3HG2 ILE 15 -0.722 10.619 -1.937 80 1HD1 ILE 15 1HD1 ILE 15 -2.096 11.953 -2.664 81 2HD1 ILE 15 2HD1 ILE 15 -2.609 11.183 -4.165 82 3HD1 ILE 15 3HD1 ILE 15 -2.603 12.942 -4.032 83 H PHE 16 H PHE 16 1.165 8.527 -5.393 84 HA PHE 16 HA PHE 16 2.553 7.085 -3.397 85 1HB PHE 16 1HB PHE 16 1.550 6.294 -6.125 86 2HB PHE 16 2HB PHE 16 2.340 5.157 -5.039 87 HD1 PHE 16 HD1 PHE 16 1.248 4.424 -3.000 88 HD2 PHE 16 HD2 PHE 16 -0.674 7.108 -5.683 89 HE1 PHE 16 HE1 PHE 16 -0.904 3.984 -1.893 90 HE2 PHE 16 HE2 PHE 16 -2.828 6.675 -4.578 91 HZ PHE 16 HZ PHE 16 -2.946 5.113 -2.679 92 H ASP 17 H ASP 17 3.503 8.248 -6.590 93 HA ASP 17 HA ASP 17 5.956 6.785 -6.642 94 1HB ASP 17 1HB ASP 17 4.811 7.623 -8.692 95 2HB ASP 17 2HB ASP 17 5.231 9.266 -8.210 96 H LYS 18 H LYS 18 5.026 10.039 -5.671 97 HA LYS 18 HA LYS 18 7.684 10.972 -5.302 98 1HB LYS 18 1HB LYS 18 5.664 12.424 -5.664 99 2HB LYS 18 2HB LYS 18 5.185 12.066 -4.011 100 1HG LYS 18 1HG LYS 18 7.199 13.091 -3.165 101 2HG LYS 18 2HG LYS 18 7.777 13.368 -4.808 102 1HD LYS 18 1HD LYS 18 5.787 14.802 -5.203 103 2HD LYS 18 2HD LYS 18 5.357 14.603 -3.502 104 1HE LYS 18 1HE LYS 18 7.932 15.783 -4.537 105 2HE LYS 18 2HE LYS 18 6.568 16.704 -3.911 106 1HZ LYS 18 1HZ LYS 18 8.056 14.671 -2.327 107 2HZ LYS 18 2HZ LYS 18 6.892 15.778 -1.758 108 3HZ LYS 18 3HZ LYS 18 8.399 16.330 -2.297 109 H VAL 19 H VAL 19 5.276 9.523 -3.125 110 HA VAL 19 HA VAL 19 6.845 9.887 -0.782 111 HB VAL 19 HB VAL 19 4.382 9.371 -0.767 112 1HG1 VAL 19 1HG1 VAL 19 3.693 7.023 -0.830 113 2HG1 VAL 19 2HG1 VAL 19 5.327 6.563 -1.311 114 3HG1 VAL 19 3HG1 VAL 19 4.342 7.562 -2.379 115 1HG2 VAL 19 1HG2 VAL 19 6.144 7.583 0.908 116 2HG2 VAL 19 2HG2 VAL 19 4.477 8.029 1.275 117 3HG2 VAL 19 3HG2 VAL 19 5.736 9.263 1.259 118 H ARG 20 H ARG 20 6.907 7.608 -3.380 119 HA ARG 20 HA ARG 20 8.514 5.634 -2.113 120 1HB ARG 20 1HB ARG 20 7.194 5.248 -4.179 121 2HB ARG 20 2HB ARG 20 8.274 6.323 -5.050 122 1HG ARG 20 1HG ARG 20 9.632 4.138 -3.660 123 2HG ARG 20 2HG ARG 20 8.512 3.619 -4.919 124 1HD ARG 20 1HD ARG 20 10.766 5.596 -5.248 125 2HD ARG 20 2HD ARG 20 10.762 3.926 -5.814 126 HE ARG 20 HE ARG 20 9.061 6.089 -6.874 127 1HH1 ARG 20 1HH1 ARG 20 10.616 2.978 -7.224 128 2HH1 ARG 20 2HH1 ARG 20 10.173 2.791 -8.893 129 1HH2 ARG 20 1HH2 ARG 20 8.478 5.867 -9.072 130 2HH2 ARG 20 2HH2 ARG 20 8.978 4.450 -9.951 131 H ASN 21 H ASN 21 9.132 8.773 -3.332 132 HA ASN 21 HA ASN 21 12.029 8.344 -3.423 133 1HB ASN 21 1HB ASN 21 10.426 10.846 -4.015 134 2HB ASN 21 2HB ASN 21 12.159 10.659 -4.241 135 1HD2 ASN 21 1HD2 ASN 21 11.924 7.944 -5.271 136 2HD2 ASN 21 2HD2 ASN 21 11.281 8.090 -6.872 137 H ASP 22 H ASP 22 9.706 10.573 -1.904 138 HA ASP 22 HA ASP 22 11.592 11.737 -0.143 139 1HB ASP 22 1HB ASP 22 8.583 11.698 -0.210 140 2HB ASP 22 2HB ASP 22 9.464 12.498 1.085 141 H LEU 23 H LEU 23 9.468 8.970 0.142 142 HA LEU 23 HA LEU 23 8.958 7.526 1.811 143 1HB LEU 23 1HB LEU 23 11.618 8.438 2.926 144 2HB LEU 23 2HB LEU 23 10.696 7.075 3.534 145 HG LEU 23 HG LEU 23 11.980 7.320 0.812 146 1HD1 LEU 23 1HD1 LEU 23 13.532 6.801 2.606 147 2HD1 LEU 23 2HD1 LEU 23 13.296 5.401 1.560 148 3HD1 LEU 23 3HD1 LEU 23 12.500 5.470 3.132 149 1HD2 LEU 23 1HD2 LEU 23 9.842 6.184 0.597 150 2HD2 LEU 23 2HD2 LEU 23 10.259 5.107 1.929 151 3HD2 LEU 23 3HD2 LEU 23 11.169 5.036 0.418 152 H ASN 24 H ASN 24 8.160 10.304 1.886 153 HA ASN 24 HA ASN 24 8.112 11.079 4.671 154 1HB ASN 24 1HB ASN 24 8.268 12.716 2.735 155 2HB ASN 24 2HB ASN 24 6.594 12.318 2.364 156 1HD2 ASN 24 1HD2 ASN 24 7.658 14.869 3.033 157 2HD2 ASN 24 2HD2 ASN 24 6.868 15.388 4.490 158 H TYR 25 H TYR 25 7.013 9.254 5.533 159 HA TYR 25 HA TYR 25 4.468 8.416 4.601 160 1HB TYR 25 1HB TYR 25 5.736 7.993 7.318 161 2HB TYR 25 2HB TYR 25 4.362 7.101 6.672 162 HD1 TYR 25 HD1 TYR 25 7.895 7.185 6.995 163 HD2 TYR 25 HD2 TYR 25 4.771 5.800 4.458 164 HE1 TYR 25 HE1 TYR 25 9.441 5.564 5.983 165 HE2 TYR 25 HE2 TYR 25 6.313 4.174 3.444 166 HH TYR 25 HH TYR 25 9.374 3.465 4.768 167 H GLN 26 H GLN 26 5.529 10.879 6.793 168 HA GLN 26 HA GLN 26 3.128 11.282 8.214 169 1HB GLN 26 1HB GLN 26 5.271 12.195 8.955 170 2HB GLN 26 2HB GLN 26 5.336 13.234 7.538 171 1HG GLN 26 1HG GLN 26 3.416 14.469 8.308 172 2HG GLN 26 2HG GLN 26 3.227 13.379 9.682 173 1HE2 GLN 26 1HE2 GLN 26 6.366 14.377 8.568 174 2HE2 GLN 26 2HE2 GLN 26 6.733 15.414 9.902 175 H TRP 27 H TRP 27 4.456 12.978 5.366 176 HA TRP 27 HA TRP 27 2.101 14.488 4.885 177 1HB TRP 27 1HB TRP 27 4.149 15.287 3.932 178 2HB TRP 27 2HB TRP 27 4.427 13.765 3.092 179 HD1 TRP 27 HD1 TRP 27 1.970 16.765 2.987 180 HE1 TRP 27 HE1 TRP 27 1.106 16.999 0.570 181 HE3 TRP 27 HE3 TRP 27 4.217 12.659 0.902 182 HZ2 TRP 27 HZ2 TRP 27 1.361 15.646 -1.879 183 HZ3 TRP 27 HZ3 TRP 27 3.847 12.208 -1.488 184 HH2 TRP 27 HH2 TRP 27 2.441 13.674 -2.846 185 H PHE 28 H PHE 28 3.258 11.367 3.746 186 HA PHE 28 HA PHE 28 1.567 10.885 1.635 187 1HB PHE 28 1HB PHE 28 3.415 9.405 2.320 188 2HB PHE 28 2HB PHE 28 2.479 8.888 3.716 189 HD1 PHE 28 HD1 PHE 28 1.708 6.752 3.501 190 HD2 PHE 28 HD2 PHE 28 1.766 9.261 0.063 191 HE1 PHE 28 HE1 PHE 28 0.722 4.937 2.165 192 HE2 PHE 28 HE2 PHE 28 0.776 7.451 -1.278 193 HZ PHE 28 HZ PHE 28 0.257 5.284 -0.229 194 H TYR 29 H TYR 29 0.939 9.955 5.033 195 HA TYR 29 HA TYR 29 -1.730 9.148 4.413 196 1HB TYR 29 1HB TYR 29 -0.286 9.522 7.031 197 2HB TYR 29 2HB TYR 29 -1.968 9.002 6.934 198 HD1 TYR 29 HD1 TYR 29 -2.452 6.905 5.498 199 HD2 TYR 29 HD2 TYR 29 1.425 7.934 6.916 200 HE1 TYR 29 HE1 TYR 29 -1.722 4.581 5.169 201 HE2 TYR 29 HE2 TYR 29 2.168 5.612 6.586 202 HH TYR 29 HH TYR 29 0.406 3.361 4.793 203 H SER 30 H SER 30 -0.318 12.173 5.130 204 HA SER 30 HA SER 30 -2.722 13.413 6.104 205 1HB SER 30 1HB SER 30 -0.198 14.636 4.952 206 2HB SER 30 2HB SER 30 -1.491 15.539 5.740 207 HG SER 30 HG SER 30 0.340 13.693 6.858 208 H GLU 31 H GLU 31 -0.973 13.338 3.024 209 HA GLU 31 HA GLU 31 -2.846 14.873 1.543 210 1HB GLU 31 1HB GLU 31 -0.395 14.310 0.994 211 2HB GLU 31 2HB GLU 31 -0.993 12.759 0.427 212 1HG GLU 31 1HG GLU 31 -0.655 14.314 -1.407 213 2HG GLU 31 2HG GLU 31 -2.353 13.872 -1.248 214 H LEU 32 H LEU 32 -2.394 11.379 2.034 215 HA LEU 32 HA LEU 32 -4.447 10.437 0.411 216 1HB LEU 32 1HB LEU 32 -3.406 9.401 3.041 217 2HB LEU 32 2HB LEU 32 -4.628 8.557 2.111 218 HG LEU 32 HG LEU 32 -1.799 9.133 1.232 219 1HD1 LEU 32 1HD1 LEU 32 -1.553 6.708 1.328 220 2HD1 LEU 32 2HD1 LEU 32 -3.207 6.561 1.921 221 3HD1 LEU 32 3HD1 LEU 32 -1.987 7.372 2.904 222 1HD2 LEU 32 1HD2 LEU 32 -3.296 9.254 -0.672 223 2HD2 LEU 32 2HD2 LEU 32 -4.046 7.726 -0.211 224 3HD2 LEU 32 3HD2 LEU 32 -2.361 7.759 -0.734 225 H LYS 33 H LYS 33 -4.607 11.382 3.846 226 HA LYS 33 HA LYS 33 -7.435 11.011 3.978 227 1HB LYS 33 1HB LYS 33 -5.498 12.381 5.843 228 2HB LYS 33 2HB LYS 33 -7.219 12.248 6.174 229 1HG LYS 33 1HG LYS 33 -6.972 9.762 5.989 230 2HG LYS 33 2HG LYS 33 -5.228 10.009 5.915 231 1HD LYS 33 1HD LYS 33 -6.805 11.210 8.150 232 2HD LYS 33 2HD LYS 33 -6.398 9.498 8.198 233 1HE LYS 33 1HE LYS 33 -4.760 10.809 9.424 234 2HE LYS 33 2HE LYS 33 -4.020 10.066 8.009 235 1HZ LYS 33 1HZ LYS 33 -4.983 12.874 8.088 236 2HZ LYS 33 2HZ LYS 33 -4.057 12.135 6.874 237 3HZ LYS 33 3HZ LYS 33 -3.379 12.416 8.403 238 H ARG 34 H ARG 34 -5.732 13.295 2.366 239 HA ARG 34 HA ARG 34 -7.618 15.459 2.910 240 1HB ARG 34 1HB ARG 34 -5.049 15.765 2.551 241 2HB ARG 34 2HB ARG 34 -5.436 15.600 0.842 242 1HG ARG 34 1HG ARG 34 -7.264 17.428 1.581 243 2HG ARG 34 2HG ARG 34 -5.968 17.813 2.706 244 1HD ARG 34 1HD ARG 34 -5.821 17.744 -0.302 245 2HD ARG 34 2HD ARG 34 -5.736 19.166 0.731 246 HE ARG 34 HE ARG 34 -3.632 17.180 0.283 247 1HH1 ARG 34 1HH1 ARG 34 -4.702 20.120 1.875 248 2HH1 ARG 34 2HH1 ARG 34 -3.088 20.621 2.296 249 1HH2 ARG 34 1HH2 ARG 34 -1.521 17.852 0.793 250 2HH2 ARG 34 2HH2 ARG 34 -1.278 19.350 1.663 251 H HIS 35 H HIS 35 -7.025 12.911 0.686 252 HA HIS 35 HA HIS 35 -9.082 14.008 -1.138 253 1HB HIS 35 1HB HIS 35 -6.781 12.171 -1.864 254 2HB HIS 35 2HB HIS 35 -8.038 12.715 -2.966 255 HD1 HIS 35 HD1 HIS 35 -7.316 14.602 -4.408 256 HD2 HIS 35 HD2 HIS 35 -5.329 14.571 -0.753 257 HE1 HIS 35 HE1 HIS 35 -5.671 16.503 -4.504 258 HE2 HIS 35 HE2 HIS 35 -4.336 16.318 -2.363 259 H ASN 36 H ASN 36 -7.548 10.943 -0.201 260 HA ASN 36 HA ASN 36 -10.044 9.537 -0.703 261 1HB ASN 36 1HB ASN 36 -8.031 8.508 -1.587 262 2HB ASN 36 2HB ASN 36 -7.284 8.523 0.008 263 1HD2 ASN 36 1HD2 ASN 36 -7.006 6.312 0.036 264 2HD2 ASN 36 2HD2 ASN 36 -8.324 5.214 0.219 265 H VAL 37 H VAL 37 -11.306 10.217 0.974 266 HA VAL 37 HA VAL 37 -10.425 9.804 3.706 267 HB VAL 37 HB VAL 37 -13.206 10.606 2.856 268 1HG1 VAL 37 1HG1 VAL 37 -13.199 11.808 4.999 269 2HG1 VAL 37 2HG1 VAL 37 -11.573 11.205 5.320 270 3HG1 VAL 37 3HG1 VAL 37 -12.926 10.080 5.207 271 1HG2 VAL 37 1HG2 VAL 37 -11.696 12.078 1.660 272 2HG2 VAL 37 2HG2 VAL 37 -10.805 12.412 3.145 273 3HG2 VAL 37 3HG2 VAL 37 -12.473 12.959 2.974 274 H SER 38 H SER 38 -11.347 7.717 1.432 275 HA SER 38 HA SER 38 -13.009 6.132 3.264 276 1HB SER 38 1HB SER 38 -14.151 6.724 1.149 277 2HB SER 38 2HB SER 38 -12.876 5.908 0.246 278 HG SER 38 HG SER 38 -15.069 4.854 1.288 279 H HIS 39 H HIS 39 -11.363 4.882 0.386 280 HA HIS 39 HA HIS 39 -9.214 3.663 1.805 281 1HB HIS 39 1HB HIS 39 -9.961 1.352 1.785 282 2HB HIS 39 2HB HIS 39 -11.080 2.325 2.729 283 HD1 HIS 39 HD1 HIS 39 -13.381 2.980 1.402 284 HD2 HIS 39 HD2 HIS 39 -11.107 -0.125 -0.171 285 HE1 HIS 39 HE1 HIS 39 -14.923 1.719 -0.129 286 HE2 HIS 39 HE2 HIS 39 -13.574 -0.258 -0.931 287 H TYR 40 H TYR 40 -7.931 2.232 0.452 288 HA TYR 40 HA TYR 40 -8.678 2.184 -2.374 289 1HB TYR 40 1HB TYR 40 -6.518 2.989 -3.109 290 2HB TYR 40 2HB TYR 40 -7.237 4.183 -2.036 291 HD1 TYR 40 HD1 TYR 40 -6.329 4.494 0.246 292 HD2 TYR 40 HD2 TYR 40 -4.477 1.875 -2.547 293 HE1 TYR 40 HE1 TYR 40 -4.285 4.495 1.610 294 HE2 TYR 40 HE2 TYR 40 -2.427 1.865 -1.190 295 HH TYR 40 HH TYR 40 -2.321 2.987 1.972 296 H ILE 41 H ILE 41 -7.738 0.494 -3.556 297 HA ILE 41 HA ILE 41 -6.327 -1.520 -1.923 298 HB ILE 41 HB ILE 41 -8.085 -2.067 -4.330 299 1HG1 ILE 41 1HG1 ILE 41 -9.431 -3.328 -2.471 300 2HG1 ILE 41 2HG1 ILE 41 -8.629 -2.208 -1.377 301 1HG2 ILE 41 1HG2 ILE 41 -6.261 -3.662 -4.081 302 2HG2 ILE 41 2HG2 ILE 41 -7.809 -4.423 -3.715 303 3HG2 ILE 41 3HG2 ILE 41 -6.726 -3.951 -2.404 304 1HD1 ILE 41 1HD1 ILE 41 -10.842 -1.425 -1.995 305 2HD1 ILE 41 2HD1 ILE 41 -10.394 -1.451 -3.700 306 3HD1 ILE 41 3HD1 ILE 41 -9.599 -0.328 -2.596 307 H TYR 42 H TYR 42 -4.270 -1.603 -2.446 308 HA TYR 42 HA TYR 42 -3.391 -0.916 -5.158 309 1HB TYR 42 1HB TYR 42 -2.374 0.052 -2.977 310 2HB TYR 42 2HB TYR 42 -1.614 -1.523 -2.795 311 HD1 TYR 42 HD1 TYR 42 -0.730 1.564 -3.476 312 HD2 TYR 42 HD2 TYR 42 -0.729 -2.172 -5.506 313 HE1 TYR 42 HE1 TYR 42 1.126 2.340 -4.882 314 HE2 TYR 42 HE2 TYR 42 1.133 -1.408 -6.921 315 HH TYR 42 HH TYR 42 2.946 1.380 -6.223 316 H TYR 43 H TYR 43 -3.247 -2.608 -6.537 317 HA TYR 43 HA TYR 43 -2.831 -5.282 -5.474 318 1HB TYR 43 1HB TYR 43 -3.364 -4.283 -8.276 319 2HB TYR 43 2HB TYR 43 -3.130 -5.981 -7.867 320 HD1 TYR 43 HD1 TYR 43 -4.835 -7.219 -6.677 321 HD2 TYR 43 HD2 TYR 43 -5.397 -3.103 -7.575 322 HE1 TYR 43 HE1 TYR 43 -7.222 -7.431 -6.116 323 HE2 TYR 43 HE2 TYR 43 -7.784 -3.301 -7.023 324 HH TYR 43 HH TYR 43 -9.505 -4.939 -6.837 325 H LEU 44 H LEU 44 -0.826 -5.825 -4.997 326 HA LEU 44 HA LEU 44 1.460 -4.535 -6.073 327 1HB LEU 44 1HB LEU 44 1.161 -7.071 -4.461 328 2HB LEU 44 2HB LEU 44 2.716 -6.410 -4.928 329 HG LEU 44 HG LEU 44 2.047 -4.296 -3.671 330 1HD1 LEU 44 1HD1 LEU 44 -0.052 -6.147 -2.551 331 2HD1 LEU 44 2HD1 LEU 44 -0.349 -4.716 -3.540 332 3HD1 LEU 44 3HD1 LEU 44 0.357 -4.544 -1.933 333 1HD2 LEU 44 1HD2 LEU 44 2.673 -5.241 -1.507 334 2HD2 LEU 44 2HD2 LEU 44 3.668 -5.893 -2.808 335 3HD2 LEU 44 3HD2 LEU 44 2.365 -6.866 -2.125 336 H ALA 45 H ALA 45 2.980 -5.251 -7.541 337 HA ALA 45 HA ALA 45 3.939 -6.449 -9.229 338 1HB ALA 45 1HB ALA 45 3.291 -8.729 -9.746 339 2HB ALA 45 2HB ALA 45 1.853 -8.572 -8.736 340 3HB ALA 45 3HB ALA 45 3.456 -8.524 -8.002 341 H THR 46 H THR 46 0.411 -6.406 -9.179 342 HA THR 46 HA THR 46 0.179 -6.073 -12.021 343 HB THR 46 HB THR 46 -1.901 -5.331 -9.959 344 HG1 THR 46 HG1 THR 46 -0.943 -7.846 -10.745 345 1HG2 THR 46 1HG2 THR 46 -3.466 -6.019 -11.729 346 2HG2 THR 46 2HG2 THR 46 -2.102 -6.372 -12.789 347 3HG2 THR 46 3HG2 THR 46 -2.407 -4.715 -12.268 348 H GLU 47 H GLU 47 0.509 -4.066 -9.203 349 HA GLU 47 HA GLU 47 0.893 -1.880 -8.841 350 1HB GLU 47 1HB GLU 47 1.706 -1.865 -11.749 351 2HB GLU 47 2HB GLU 47 2.082 -0.612 -10.575 352 1HG GLU 47 1HG GLU 47 3.063 -3.452 -10.574 353 2HG GLU 47 2HG GLU 47 4.004 -2.001 -10.885 354 H ASN 48 H ASN 48 -1.715 -2.806 -9.915 355 HA ASN 48 HA ASN 48 -2.750 -0.295 -11.003 356 1HB ASN 48 1HB ASN 48 -3.679 -3.136 -11.088 357 2HB ASN 48 2HB ASN 48 -4.884 -1.855 -11.184 358 1HD2 ASN 48 1HD2 ASN 48 -1.899 -3.034 -12.687 359 2HD2 ASN 48 2HD2 ASN 48 -2.261 -2.430 -14.264 360 H VAL 49 H VAL 49 -3.399 1.074 -9.505 361 HA VAL 49 HA VAL 49 -4.330 0.032 -6.920 362 HB VAL 49 HB VAL 49 -3.754 2.917 -7.526 363 1HG1 VAL 49 1HG1 VAL 49 -3.236 2.994 -5.125 364 2HG1 VAL 49 2HG1 VAL 49 -3.654 1.283 -4.997 365 3HG1 VAL 49 3HG1 VAL 49 -4.887 2.462 -5.444 366 1HG2 VAL 49 1HG2 VAL 49 -1.456 2.570 -6.728 367 2HG2 VAL 49 2HG2 VAL 49 -1.781 1.711 -8.234 368 3HG2 VAL 49 3HG2 VAL 49 -1.740 0.830 -6.707 369 H HIS 50 H HIS 50 -6.435 0.157 -6.371 370 HA HIS 50 HA HIS 50 -8.154 1.930 -7.983 371 1HB HIS 50 1HB HIS 50 -8.747 -0.684 -6.599 372 2HB HIS 50 2HB HIS 50 -10.031 0.415 -7.095 373 HD1 HIS 50 HD1 HIS 50 -11.026 -0.325 -9.228 374 HD2 HIS 50 HD2 HIS 50 -6.933 -1.063 -9.100 375 HE1 HIS 50 HE1 HIS 50 -10.455 -1.395 -11.426 376 HE2 HIS 50 HE2 HIS 50 -8.023 -2.019 -11.246 377 H ILE 51 H ILE 51 -8.471 3.764 -6.958 378 HA ILE 51 HA ILE 51 -8.700 3.771 -4.024 379 HB ILE 51 HB ILE 51 -8.250 6.132 -5.863 380 1HG1 ILE 51 1HG1 ILE 51 -5.931 6.040 -4.617 381 2HG1 ILE 51 2HG1 ILE 51 -6.321 4.332 -4.440 382 1HG2 ILE 51 1HG2 ILE 51 -8.081 5.871 -2.868 383 2HG2 ILE 51 2HG2 ILE 51 -9.318 6.735 -3.781 384 3HG2 ILE 51 3HG2 ILE 51 -7.651 7.309 -3.792 385 1HD1 ILE 51 1HD1 ILE 51 -6.513 4.128 -6.862 386 2HD1 ILE 51 2HD1 ILE 51 -4.925 4.725 -6.385 387 3HD1 ILE 51 3HD1 ILE 51 -6.125 5.838 -7.037 388 H VAL 52 H VAL 52 -10.776 3.707 -3.360 389 HA VAL 52 HA VAL 52 -12.806 5.065 -4.982 390 HB VAL 52 HB VAL 52 -13.327 3.396 -2.524 391 1HG1 VAL 52 1HG1 VAL 52 -15.148 4.837 -3.150 392 2HG1 VAL 52 2HG1 VAL 52 -15.569 3.174 -3.565 393 3HG1 VAL 52 3HG1 VAL 52 -15.056 4.296 -4.828 394 1HG2 VAL 52 1HG2 VAL 52 -12.134 2.009 -4.152 395 2HG2 VAL 52 2HG2 VAL 52 -13.309 2.454 -5.391 396 3HG2 VAL 52 3HG2 VAL 52 -13.819 1.512 -3.991 397 H LEU 53 H LEU 53 -13.234 7.096 -4.477 398 HA LEU 53 HA LEU 53 -12.292 8.249 -2.033 399 1HB LEU 53 1HB LEU 53 -14.059 9.409 -4.189 400 2HB LEU 53 2HB LEU 53 -13.342 10.321 -2.874 401 HG LEU 53 HG LEU 53 -11.870 8.945 -5.125 402 1HD1 LEU 53 1HD1 LEU 53 -12.977 11.026 -5.760 403 2HD1 LEU 53 2HD1 LEU 53 -11.222 11.209 -5.750 404 3HD1 LEU 53 3HD1 LEU 53 -12.185 11.860 -4.423 405 1HD2 LEU 53 1HD2 LEU 53 -10.596 8.764 -3.059 406 2HD2 LEU 53 2HD2 LEU 53 -10.788 10.495 -2.772 407 3HD2 LEU 53 3HD2 LEU 53 -9.845 9.929 -4.151 408 H LYS 54 H LYS 54 -13.761 9.624 -0.700 409 HA LYS 54 HA LYS 54 -15.818 8.051 0.443 410 1HB LYS 54 1HB LYS 54 -14.474 9.626 1.753 411 2HB LYS 54 2HB LYS 54 -15.122 10.972 0.828 412 1HG LYS 54 1HG LYS 54 -17.376 10.425 1.703 413 2HG LYS 54 2HG LYS 54 -16.637 9.180 2.713 414 1HD LYS 54 1HD LYS 54 -15.331 10.833 3.881 415 2HD LYS 54 2HD LYS 54 -15.892 12.103 2.793 416 1HE LYS 54 1HE LYS 54 -17.653 10.498 4.643 417 2HE LYS 54 2HE LYS 54 -17.048 12.119 4.978 418 1HZ LYS 54 1HZ LYS 54 -18.222 12.858 2.934 419 2HZ LYS 54 2HZ LYS 54 -19.256 12.292 4.145 420 3HZ LYS 54 3HZ LYS 54 -18.915 11.313 2.803 421 H ASN 55 H ASN 55 -15.754 10.156 -2.213 422 HA ASN 55 HA ASN 55 -18.658 10.534 -2.073 423 1HB ASN 55 1HB ASN 55 -16.601 12.470 -3.160 424 2HB ASN 55 2HB ASN 55 -18.346 12.681 -3.278 425 1HD2 ASN 55 1HD2 ASN 55 -19.534 13.132 -1.419 426 2HD2 ASN 55 2HD2 ASN 55 -18.775 13.713 0.029 427 H ASP 56 H ASP 56 -17.931 8.306 -3.180 428 HA ASP 56 HA ASP 56 -18.866 7.137 -4.889 429 1HB ASP 56 1HB ASP 56 -20.402 8.980 -5.319 430 2HB ASP 56 2HB ASP 56 -19.174 9.805 -6.272 431 H ASN 57 H ASN 57 -16.715 9.690 -6.104 432 HA ASN 57 HA ASN 57 -15.944 8.445 -8.449 433 1HB ASN 57 1HB ASN 57 -15.468 10.794 -7.976 434 2HB ASN 57 2HB ASN 57 -14.317 10.324 -6.730 435 1HD2 ASN 57 1HD2 ASN 57 -12.586 11.300 -7.667 436 2HD2 ASN 57 2HD2 ASN 57 -11.857 10.751 -9.131 437 H THR 58 H THR 58 -14.628 6.899 -9.028 438 HA THR 58 HA THR 58 -12.813 5.749 -7.017 439 HB THR 58 HB THR 58 -14.279 4.222 -9.184 440 HG1 THR 58 HG1 THR 58 -15.424 5.147 -7.152 441 1HG2 THR 58 1HG2 THR 58 -12.568 3.315 -6.862 442 2HG2 THR 58 2HG2 THR 58 -12.169 3.186 -8.574 443 3HG2 THR 58 3HG2 THR 58 -13.500 2.242 -7.906 444 H VAL 59 H VAL 59 -10.776 6.095 -7.603 445 HA VAL 59 HA VAL 59 -10.155 6.538 -10.441 446 HB VAL 59 HB VAL 59 -8.393 7.099 -8.050 447 1HG1 VAL 59 1HG1 VAL 59 -8.260 8.066 -10.904 448 2HG1 VAL 59 2HG1 VAL 59 -7.176 6.903 -10.141 449 3HG1 VAL 59 3HG1 VAL 59 -7.193 8.580 -9.596 450 1HG2 VAL 59 1HG2 VAL 59 -10.198 9.015 -9.517 451 2HG2 VAL 59 2HG2 VAL 59 -9.074 9.427 -8.222 452 3HG2 VAL 59 3HG2 VAL 59 -10.463 8.390 -7.890 453 H LEU 60 H LEU 60 -8.628 5.291 -11.515 454 HA LEU 60 HA LEU 60 -7.421 3.112 -9.965 455 1HB LEU 60 1HB LEU 60 -7.636 1.613 -11.866 456 2HB LEU 60 2HB LEU 60 -9.204 2.185 -11.341 457 HG LEU 60 HG LEU 60 -7.772 3.426 -13.686 458 1HD1 LEU 60 1HD1 LEU 60 -9.067 1.960 -15.137 459 2HD1 LEU 60 2HD1 LEU 60 -9.713 1.120 -13.728 460 3HD1 LEU 60 3HD1 LEU 60 -7.991 1.024 -14.098 461 1HD2 LEU 60 1HD2 LEU 60 -9.602 4.723 -12.784 462 2HD2 LEU 60 2HD2 LEU 60 -10.658 3.313 -12.824 463 3HD2 LEU 60 3HD2 LEU 60 -10.081 4.026 -14.332 464 H LEU 61 H LEU 61 -5.324 3.270 -9.900 465 HA LEU 61 HA LEU 61 -3.898 4.776 -11.961 466 1HB LEU 61 1HB LEU 61 -2.738 3.523 -9.476 467 2HB LEU 61 2HB LEU 61 -2.029 4.783 -10.471 468 HG LEU 61 HG LEU 61 -4.453 5.082 -8.698 469 1HD1 LEU 61 1HD1 LEU 61 -2.381 4.905 -7.444 470 2HD1 LEU 61 2HD1 LEU 61 -3.001 6.556 -7.389 471 3HD1 LEU 61 3HD1 LEU 61 -1.648 6.156 -8.450 472 1HD2 LEU 61 1HD2 LEU 61 -4.410 7.413 -9.287 473 2HD2 LEU 61 2HD2 LEU 61 -4.551 6.452 -10.757 474 3HD2 LEU 61 3HD2 LEU 61 -3.000 7.172 -10.314 475 H LYS 62 H LYS 62 -3.594 3.520 -13.709 476 HA LYS 62 HA LYS 62 -2.938 0.708 -13.370 477 1HB LYS 62 1HB LYS 62 -3.345 2.332 -15.891 478 2HB LYS 62 2HB LYS 62 -3.143 0.590 -15.820 479 1HG LYS 62 1HG LYS 62 -5.210 0.487 -14.418 480 2HG LYS 62 2HG LYS 62 -5.439 2.204 -14.743 481 1HD LYS 62 1HD LYS 62 -6.768 0.835 -16.268 482 2HD LYS 62 2HD LYS 62 -5.534 1.746 -17.142 483 1HE LYS 62 1HE LYS 62 -5.728 -0.582 -17.930 484 2HE LYS 62 2HE LYS 62 -4.130 -0.216 -17.283 485 1HZ LYS 62 1HZ LYS 62 -4.792 -1.284 -15.197 486 2HZ LYS 62 2HZ LYS 62 -4.877 -2.356 -16.508 487 3HZ LYS 62 3HZ LYS 62 -6.300 -1.681 -15.870 488 H GLY 63 H GLY 63 -0.877 0.486 -12.709 489 1HA GLY 63 1HA GLY 63 1.192 1.713 -14.421 490 2HA GLY 63 2HA GLY 63 1.420 1.373 -12.710 491 H LEU 64 H LEU 64 3.347 0.354 -13.942 492 HA LEU 64 HA LEU 64 2.829 -2.507 -14.046 493 1HB LEU 64 1HB LEU 64 4.212 -0.967 -16.249 494 2HB LEU 64 2HB LEU 64 4.308 -2.706 -16.073 495 HG LEU 64 HG LEU 64 1.737 -1.193 -16.530 496 1HD1 LEU 64 1HD1 LEU 64 3.200 -0.968 -18.460 497 2HD1 LEU 64 2HD1 LEU 64 1.855 -2.052 -18.818 498 3HD1 LEU 64 3HD1 LEU 64 3.457 -2.714 -18.486 499 1HD2 LEU 64 1HD2 LEU 64 1.444 -3.330 -15.391 500 2HD2 LEU 64 2HD2 LEU 64 2.383 -4.136 -16.648 501 3HD2 LEU 64 3HD2 LEU 64 0.827 -3.404 -17.043 502 H LYS 65 H LYS 65 5.429 -0.186 -14.724 503 HA LYS 65 HA LYS 65 7.435 0.252 -13.771 504 1HB LYS 65 1HB LYS 65 6.483 -1.406 -11.440 505 2HB LYS 65 2HB LYS 65 7.858 -0.318 -11.441 506 1HG LYS 65 1HG LYS 65 6.263 1.553 -11.912 507 2HG LYS 65 2HG LYS 65 4.947 0.406 -11.649 508 1HD LYS 65 1HD LYS 65 5.994 -0.086 -9.398 509 2HD LYS 65 2HD LYS 65 7.043 1.304 -9.679 510 1HE LYS 65 1HE LYS 65 5.223 2.055 -8.350 511 2HE LYS 65 2HE LYS 65 4.970 2.684 -9.977 512 1HZ LYS 65 1HZ LYS 65 2.952 1.741 -8.926 513 2HZ LYS 65 2HZ LYS 65 3.691 0.215 -8.935 514 3HZ LYS 65 3HZ LYS 65 3.355 1.005 -10.394 515 H ASN 66 H ASN 66 6.420 -3.004 -14.112 516 HA ASN 66 HA ASN 66 7.448 -4.986 -14.413 517 1HB ASN 66 1HB ASN 66 8.800 -3.889 -16.140 518 2HB ASN 66 2HB ASN 66 9.939 -3.340 -14.915 519 1HD2 ASN 66 1HD2 ASN 66 8.388 -6.484 -14.928 520 2HD2 ASN 66 2HD2 ASN 66 9.828 -7.402 -15.231 521 H ILE 67 H ILE 67 7.048 -5.512 -12.276 522 HA ILE 67 HA ILE 67 9.471 -5.659 -10.627 523 HB ILE 67 HB ILE 67 6.731 -5.017 -9.512 524 1HG1 ILE 67 1HG1 ILE 67 9.167 -3.238 -9.790 525 2HG1 ILE 67 2HG1 ILE 67 7.684 -3.097 -10.727 526 1HG2 ILE 67 1HG2 ILE 67 7.960 -4.655 -7.403 527 2HG2 ILE 67 2HG2 ILE 67 9.434 -5.228 -8.187 528 3HG2 ILE 67 3HG2 ILE 67 8.065 -6.319 -7.975 529 1HD1 ILE 67 1HD1 ILE 67 7.949 -2.700 -7.758 530 2HD1 ILE 67 2HD1 ILE 67 6.448 -2.591 -8.676 531 3HD1 ILE 67 3HD1 ILE 67 7.751 -1.439 -8.974 532 H VAL 68 H VAL 68 6.111 -6.650 -10.146 533 HA VAL 68 HA VAL 68 5.185 -8.615 -9.475 534 HB VAL 68 HB VAL 68 7.039 -9.813 -11.542 535 1HG1 VAL 68 1HG1 VAL 68 5.968 -11.490 -10.147 536 2HG1 VAL 68 2HG1 VAL 68 5.281 -11.511 -11.772 537 3HG1 VAL 68 3HG1 VAL 68 4.392 -10.759 -10.448 538 1HG2 VAL 68 1HG2 VAL 68 4.278 -8.640 -11.870 539 2HG2 VAL 68 2HG2 VAL 68 5.211 -9.458 -13.127 540 3HG2 VAL 68 3HG2 VAL 68 5.780 -7.928 -12.457 541 H SER 69 H SER 69 6.068 -8.571 -7.356 542 HA SER 69 HA SER 69 8.345 -10.373 -6.916 543 1HB SER 69 1HB SER 69 7.059 -8.543 -4.887 544 2HB SER 69 2HB SER 69 8.658 -9.289 -4.816 545 HG SER 69 HG SER 69 9.157 -8.017 -6.734 546 H VAL 70 H VAL 70 4.978 -10.169 -6.689 547 HA VAL 70 HA VAL 70 4.407 -11.499 -4.307 548 HB VAL 70 HB VAL 70 2.764 -11.481 -6.844 549 1HG1 VAL 70 1HG1 VAL 70 2.046 -13.203 -5.261 550 2HG1 VAL 70 2HG1 VAL 70 0.857 -11.906 -5.383 551 3HG1 VAL 70 3HG1 VAL 70 1.932 -11.987 -3.987 552 1HG2 VAL 70 1HG2 VAL 70 3.308 -9.229 -6.098 553 2HG2 VAL 70 2HG2 VAL 70 2.732 -9.612 -4.475 554 3HG2 VAL 70 3HG2 VAL 70 1.602 -9.576 -5.827 555 H LYS 71 H LYS 71 4.508 -13.512 -3.686 556 HA LYS 71 HA LYS 71 4.837 -15.637 -5.703 557 1HB LYS 71 1HB LYS 71 6.007 -15.479 -2.912 558 2HB LYS 71 2HB LYS 71 6.154 -16.859 -3.989 559 1HG LYS 71 1HG LYS 71 7.202 -14.109 -4.619 560 2HG LYS 71 2HG LYS 71 8.165 -15.401 -3.901 561 1HD LYS 71 1HD LYS 71 7.830 -16.790 -5.849 562 2HD LYS 71 2HD LYS 71 6.736 -15.598 -6.549 563 1HE LYS 71 1HE LYS 71 9.622 -15.038 -5.897 564 2HE LYS 71 2HE LYS 71 9.069 -15.584 -7.479 565 1HZ LYS 71 1HZ LYS 71 9.320 -13.159 -7.344 566 2HZ LYS 71 2HZ LYS 71 8.141 -13.105 -6.127 567 3HZ LYS 71 3HZ LYS 71 7.724 -13.621 -7.689 568 H PHE 72 H PHE 72 3.882 -17.704 -5.107 569 HA PHE 72 HA PHE 72 1.371 -17.321 -3.758 570 1HB PHE 72 1HB PHE 72 2.569 -19.775 -5.058 571 2HB PHE 72 2HB PHE 72 0.949 -19.704 -4.375 572 HD1 PHE 72 HD1 PHE 72 3.082 -18.742 -7.154 573 HD2 PHE 72 HD2 PHE 72 -0.789 -18.361 -5.433 574 HE1 PHE 72 HE1 PHE 72 2.224 -17.887 -9.293 575 HE2 PHE 72 HE2 PHE 72 -1.659 -17.505 -7.570 576 HZ PHE 72 HZ PHE 72 -0.151 -17.268 -9.503 577 H SER 73 H SER 73 2.242 -16.814 -1.698 578 HA SER 73 HA SER 73 2.476 -19.168 -0.016 579 1HB SER 73 1HB SER 73 4.530 -16.934 0.071 580 2HB SER 73 2HB SER 73 4.457 -18.318 1.164 581 HG SER 73 HG SER 73 4.457 -19.315 -1.255 582 H LYS 74 H LYS 74 2.525 -18.340 2.393 583 HA LYS 74 HA LYS 74 1.289 -15.742 2.740 584 1HB LYS 74 1HB LYS 74 -0.654 -16.638 3.976 585 2HB LYS 74 2HB LYS 74 -0.658 -17.119 2.286 586 1HG LYS 74 1HG LYS 74 0.220 -19.319 2.919 587 2HG LYS 74 2HG LYS 74 0.191 -18.832 4.613 588 1HD LYS 74 1HD LYS 74 -2.277 -18.422 4.335 589 2HD LYS 74 2HD LYS 74 -2.147 -19.203 2.756 590 1HE LYS 74 1HE LYS 74 -1.152 -21.185 3.936 591 2HE LYS 74 2HE LYS 74 -1.576 -20.403 5.459 592 1HZ LYS 74 1HZ LYS 74 -3.337 -21.835 5.002 593 2HZ LYS 74 2HZ LYS 74 -3.378 -21.430 3.357 594 3HZ LYS 74 3HZ LYS 74 -3.920 -20.317 4.515 595 H ASP 75 H ASP 75 2.992 -15.102 4.011 596 HA ASP 75 HA ASP 75 3.056 -16.397 6.652 597 1HB ASP 75 1HB ASP 75 5.108 -17.071 5.527 598 2HB ASP 75 2HB ASP 75 5.476 -15.388 5.146 599 H ARG 76 H ARG 76 2.861 -15.100 8.317 600 HA ARG 76 HA ARG 76 2.628 -12.235 7.804 601 1HB ARG 76 1HB ARG 76 1.650 -14.034 10.007 602 2HB ARG 76 2HB ARG 76 1.654 -12.283 10.184 603 1HG ARG 76 1HG ARG 76 0.157 -12.018 8.350 604 2HG ARG 76 2HG ARG 76 0.284 -13.727 7.932 605 1HD ARG 76 1HD ARG 76 -0.724 -12.824 10.608 606 2HD ARG 76 2HD ARG 76 -1.793 -12.956 9.213 607 HE ARG 76 HE ARG 76 -0.291 -15.342 9.637 608 1HH1 ARG 76 1HH1 ARG 76 -3.067 -13.535 10.766 609 2HH1 ARG 76 2HH1 ARG 76 -3.935 -14.947 11.284 610 1HH2 ARG 76 1HH2 ARG 76 -1.419 -17.202 10.317 611 2HH2 ARG 76 2HH2 ARG 76 -2.993 -17.039 11.045 612 H HIS 77 H HIS 77 4.833 -14.452 9.086 613 HA HIS 77 HA HIS 77 5.923 -12.853 11.190 614 1HB HIS 77 1HB HIS 77 7.213 -15.103 9.629 615 2HB HIS 77 2HB HIS 77 7.832 -14.409 11.123 616 HD1 HIS 77 HD1 HIS 77 5.328 -16.795 9.785 617 HD2 HIS 77 HD2 HIS 77 6.376 -15.131 13.457 618 HE1 HIS 77 HE1 HIS 77 4.171 -18.197 11.532 619 HE2 HIS 77 HE2 HIS 77 4.684 -17.073 13.727 620 H LEU 78 H LEU 78 6.972 -13.563 7.863 621 HA LEU 78 HA LEU 78 9.169 -11.846 7.793 622 1HB LEU 78 1HB LEU 78 8.689 -13.541 6.083 623 2HB LEU 78 2HB LEU 78 7.308 -12.607 5.542 624 HG LEU 78 HG LEU 78 8.829 -10.778 4.866 625 1HD1 LEU 78 1HD1 LEU 78 10.998 -12.726 5.635 626 2HD1 LEU 78 2HD1 LEU 78 10.648 -11.182 6.417 627 3HD1 LEU 78 3HD1 LEU 78 11.243 -11.216 4.758 628 1HD2 LEU 78 1HD2 LEU 78 9.791 -11.923 2.926 629 2HD2 LEU 78 2HD2 LEU 78 8.131 -12.432 3.231 630 3HD2 LEU 78 3HD2 LEU 78 9.472 -13.478 3.694 631 H ILE 79 H ILE 79 5.742 -11.195 7.324 632 HA ILE 79 HA ILE 79 5.938 -8.566 6.353 633 HB ILE 79 HB ILE 79 3.788 -9.750 8.122 634 1HG1 ILE 79 1HG1 ILE 79 3.909 -9.460 5.112 635 2HG1 ILE 79 2HG1 ILE 79 4.140 -10.966 5.995 636 1HG2 ILE 79 1HG2 ILE 79 3.754 -7.274 6.400 637 2HG2 ILE 79 2HG2 ILE 79 3.714 -7.326 8.164 638 3HG2 ILE 79 3HG2 ILE 79 2.357 -7.958 7.229 639 1HD1 ILE 79 1HD1 ILE 79 1.620 -9.320 5.921 640 2HD1 ILE 79 2HD1 ILE 79 1.847 -10.810 6.836 641 3HD1 ILE 79 3HD1 ILE 79 1.909 -10.840 5.074 642 H GLU 80 H GLU 80 5.669 -9.803 9.681 643 HA GLU 80 HA GLU 80 5.831 -7.288 10.958 644 1HB GLU 80 1HB GLU 80 5.002 -9.330 12.071 645 2HB GLU 80 2HB GLU 80 6.620 -10.011 12.015 646 1HG GLU 80 1HG GLU 80 7.410 -8.137 13.420 647 2HG GLU 80 2HG GLU 80 5.744 -7.573 13.546 648 H THR 81 H THR 81 8.291 -9.739 10.197 649 HA THR 81 HA THR 81 10.512 -8.515 11.328 650 HB THR 81 HB THR 81 10.474 -10.067 8.731 651 HG1 THR 81 HG1 THR 81 10.536 -10.927 11.458 652 1HG2 THR 81 1HG2 THR 81 12.753 -10.707 9.365 653 2HG2 THR 81 2HG2 THR 81 12.642 -9.691 10.803 654 3HG2 THR 81 3HG2 THR 81 12.607 -8.957 9.200 655 H THR 82 H THR 82 9.166 -8.096 8.058 656 HA THR 82 HA THR 82 11.159 -6.257 7.219 657 HB THR 82 HB THR 82 8.383 -6.568 6.054 658 HG1 THR 82 HG1 THR 82 9.285 -8.597 6.005 659 1HG2 THR 82 1HG2 THR 82 10.983 -5.748 4.756 660 2HG2 THR 82 2HG2 THR 82 9.737 -4.622 5.286 661 3HG2 THR 82 3HG2 THR 82 9.387 -5.781 4.005 662 H SER 83 H SER 83 8.018 -5.874 8.785 663 HA SER 83 HA SER 83 7.864 -3.057 8.438 664 1HB SER 83 1HB SER 83 6.572 -4.832 10.521 665 2HB SER 83 2HB SER 83 6.137 -3.151 10.205 666 HG SER 83 HG SER 83 5.803 -5.416 8.546 667 H ASN 84 H ASN 84 9.248 -5.149 10.898 668 HA ASN 84 HA ASN 84 9.958 -3.056 12.710 669 1HB ASN 84 1HB ASN 84 9.773 -5.444 13.390 670 2HB ASN 84 2HB ASN 84 11.167 -5.819 12.384 671 1HD2 ASN 84 1HD2 ASN 84 12.391 -6.566 14.072 672 2HD2 ASN 84 2HD2 ASN 84 13.037 -5.536 15.299 673 H LYS 85 H LYS 85 11.396 -4.630 9.976 674 HA LYS 85 HA LYS 85 13.980 -3.508 10.108 675 1HB LYS 85 1HB LYS 85 12.727 -5.368 8.563 676 2HB LYS 85 2HB LYS 85 12.825 -4.021 7.444 677 1HG LYS 85 1HG LYS 85 14.722 -5.499 7.174 678 2HG LYS 85 2HG LYS 85 15.253 -3.929 7.786 679 1HD LYS 85 1HD LYS 85 15.551 -4.770 9.971 680 2HD LYS 85 2HD LYS 85 14.659 -6.248 9.604 681 1HE LYS 85 1HE LYS 85 16.433 -6.971 8.109 682 2HE LYS 85 2HE LYS 85 17.315 -5.471 8.404 683 1HZ LYS 85 1HZ LYS 85 17.751 -6.080 10.600 684 2HZ LYS 85 2HZ LYS 85 18.017 -7.505 9.718 685 3HZ LYS 85 3HZ LYS 85 16.586 -7.309 10.602 686 H LEU 86 H LEU 86 10.968 -2.477 8.577 687 HA LEU 86 HA LEU 86 12.011 -0.156 7.313 688 1HB LEU 86 1HB LEU 86 9.893 -1.287 6.664 689 2HB LEU 86 2HB LEU 86 9.170 -0.740 8.164 690 HG LEU 86 HG LEU 86 9.659 1.632 7.372 691 1HD1 LEU 86 1HD1 LEU 86 10.042 0.185 4.760 692 2HD1 LEU 86 2HD1 LEU 86 11.276 1.082 5.646 693 3HD1 LEU 86 3HD1 LEU 86 9.891 1.931 4.959 694 1HD2 LEU 86 1HD2 LEU 86 7.710 -0.056 5.812 695 2HD2 LEU 86 2HD2 LEU 86 7.663 1.701 5.960 696 3HD2 LEU 86 3HD2 LEU 86 7.418 0.688 7.385 697 H LYS 87 H LYS 87 10.996 -0.864 10.531 698 HA LYS 87 HA LYS 87 10.646 1.904 11.291 699 1HB LYS 87 1HB LYS 87 9.370 0.014 12.338 700 2HB LYS 87 2HB LYS 87 10.876 -0.543 13.056 701 1HG LYS 87 1HG LYS 87 9.662 0.675 14.705 702 2HG LYS 87 2HG LYS 87 11.060 1.641 14.227 703 1HD LYS 87 1HD LYS 87 9.646 2.989 12.772 704 2HD LYS 87 2HD LYS 87 8.245 2.003 13.197 705 1HE LYS 87 1HE LYS 87 8.148 4.000 14.500 706 2HE LYS 87 2HE LYS 87 8.589 2.674 15.576 707 1HZ LYS 87 1HZ LYS 87 10.331 4.823 14.515 708 2HZ LYS 87 2HZ LYS 87 10.970 3.404 15.183 709 3HZ LYS 87 3HZ LYS 87 10.010 4.426 16.135 710 H SER 88 H SER 88 13.026 -0.664 11.793 711 HA SER 88 HA SER 88 14.700 0.977 13.442 712 1HB SER 88 1HB SER 88 14.506 -1.506 13.681 713 2HB SER 88 2HB SER 88 15.352 -1.679 12.146 714 HG SER 88 HG SER 88 16.465 -0.178 14.272 715 H ARG 89 H ARG 89 15.112 -0.439 10.175 716 HA ARG 89 HA ARG 89 17.453 1.260 9.778 717 1HB ARG 89 1HB ARG 89 16.292 -0.901 8.004 718 2HB ARG 89 2HB ARG 89 17.804 -0.052 7.724 719 1HG ARG 89 1HG ARG 89 18.685 -0.988 9.827 720 2HG ARG 89 2HG ARG 89 17.186 -1.898 10.022 721 1HD ARG 89 1HD ARG 89 18.846 -3.344 9.061 722 2HD ARG 89 2HD ARG 89 17.627 -2.992 7.837 723 HE ARG 89 HE ARG 89 19.718 -1.132 7.584 724 1HH1 ARG 89 1HH1 ARG 89 19.111 -4.551 7.055 725 2HH1 ARG 89 2HH1 ARG 89 20.361 -4.706 5.860 726 1HH2 ARG 89 1HH2 ARG 89 21.335 -1.347 6.009 727 2HH2 ARG 89 2HH2 ARG 89 21.618 -2.900 5.269 728 H GLU 90 H GLU 90 14.175 0.880 8.724 729 HA GLU 90 HA GLU 90 12.749 2.205 7.596 730 1HB GLU 90 1HB GLU 90 15.033 4.169 7.606 731 2HB GLU 90 2HB GLU 90 13.454 4.524 6.919 732 1HG GLU 90 1HG GLU 90 12.456 3.985 9.147 733 2HG GLU 90 2HG GLU 90 14.097 3.888 9.784 734 H ILE 91 H ILE 91 15.901 1.676 6.223 735 HA ILE 91 HA ILE 91 16.619 1.415 4.069 736 HB ILE 91 HB ILE 91 15.324 -0.490 2.930 737 1HG1 ILE 91 1HG1 ILE 91 14.019 -0.593 5.665 738 2HG1 ILE 91 2HG1 ILE 91 13.194 -0.134 4.182 739 1HG2 ILE 91 1HG2 ILE 91 16.548 -0.832 5.663 740 2HG2 ILE 91 2HG2 ILE 91 17.402 -0.795 4.120 741 3HG2 ILE 91 3HG2 ILE 91 16.303 -2.126 4.490 742 1HD1 ILE 91 1HD1 ILE 91 13.604 -2.365 3.270 743 2HD1 ILE 91 2HD1 ILE 91 12.698 -2.423 4.782 744 3HD1 ILE 91 3HD1 ILE 91 14.416 -2.819 4.768 745 H THR 92 H THR 92 13.735 0.440 2.597 746 HA THR 92 HA THR 92 13.000 3.061 1.607 747 HB THR 92 HB THR 92 13.822 0.910 -0.360 748 HG1 THR 92 HG1 THR 92 15.314 2.834 0.957 749 1HG2 THR 92 1HG2 THR 92 13.672 2.713 -2.002 750 2HG2 THR 92 2HG2 THR 92 13.199 3.844 -0.734 751 3HG2 THR 92 3HG2 THR 92 12.135 2.504 -1.164 752 H PHE 93 H PHE 93 10.874 3.114 0.941 753 HA PHE 93 HA PHE 93 9.115 1.162 1.881 754 1HB PHE 93 1HB PHE 93 8.495 3.513 1.555 755 2HB PHE 93 2HB PHE 93 8.622 3.312 -0.190 756 HD1 PHE 93 HD1 PHE 93 6.758 2.662 -1.428 757 HD2 PHE 93 HD2 PHE 93 6.783 2.059 2.785 758 HE1 PHE 93 HE1 PHE 93 4.391 1.987 -1.515 759 HE2 PHE 93 HE2 PHE 93 4.419 1.385 2.707 760 HZ PHE 93 HZ PHE 93 3.220 1.347 0.556 761 H GLN 94 H GLN 94 10.612 1.557 -1.244 762 HA GLN 94 HA GLN 94 8.983 -0.096 -2.794 763 1HB GLN 94 1HB GLN 94 10.619 1.323 -3.831 764 2HB GLN 94 2HB GLN 94 11.930 0.529 -2.976 765 1HG GLN 94 1HG GLN 94 11.799 -0.096 -5.345 766 2HG GLN 94 2HG GLN 94 11.630 -1.472 -4.258 767 1HE2 GLN 94 1HE2 GLN 94 10.648 -2.693 -5.848 768 2HE2 GLN 94 2HE2 GLN 94 9.013 -2.414 -6.346 769 H GLU 95 H GLU 95 11.982 -0.927 -1.042 770 HA GLU 95 HA GLU 95 11.777 -3.704 -1.559 771 1HB GLU 95 1HB GLU 95 13.385 -2.059 0.361 772 2HB GLU 95 2HB GLU 95 13.373 -3.811 0.499 773 1HG GLU 95 1HG GLU 95 15.284 -2.978 -0.781 774 2HG GLU 95 2HG GLU 95 14.247 -4.034 -1.737 775 H TYR 96 H TYR 96 10.622 -1.645 1.047 776 HA TYR 96 HA TYR 96 9.804 -3.589 2.867 777 1HB TYR 96 1HB TYR 96 9.709 -1.235 3.446 778 2HB TYR 96 2HB TYR 96 8.517 -0.937 2.185 779 HD1 TYR 96 HD1 TYR 96 6.276 -0.850 2.789 780 HD2 TYR 96 HD2 TYR 96 8.976 -3.043 5.233 781 HE1 TYR 96 HE1 TYR 96 4.461 -1.290 4.393 782 HE2 TYR 96 HE2 TYR 96 7.173 -3.496 6.839 783 HH TYR 96 HH TYR 96 5.070 -2.898 7.475 784 H ARG 97 H ARG 97 7.960 -2.122 0.210 785 HA ARG 97 HA ARG 97 5.691 -3.789 0.540 786 1HB ARG 97 1HB ARG 97 5.622 -1.602 -0.605 787 2HB ARG 97 2HB ARG 97 6.603 -2.261 -1.909 788 1HG ARG 97 1HG ARG 97 4.830 -3.845 -2.445 789 2HG ARG 97 2HG ARG 97 3.849 -3.198 -1.129 790 1HD ARG 97 1HD ARG 97 3.131 -2.261 -3.237 791 2HD ARG 97 2HD ARG 97 3.851 -1.007 -2.231 792 HE ARG 97 HE ARG 97 5.843 -1.160 -3.633 793 1HH1 ARG 97 1HH1 ARG 97 2.939 -2.676 -4.857 794 2HH1 ARG 97 2HH1 ARG 97 3.394 -2.516 -6.531 795 1HH2 ARG 97 1HH2 ARG 97 6.440 -0.928 -5.851 796 2HH2 ARG 97 2HH2 ARG 97 5.351 -1.492 -7.089 797 H ARG 98 H ARG 98 8.667 -4.093 -1.260 798 HA ARG 98 HA ARG 98 7.858 -6.164 -3.006 799 1HB ARG 98 1HB ARG 98 9.916 -4.664 -3.194 800 2HB ARG 98 2HB ARG 98 10.674 -5.729 -2.018 801 1HG ARG 98 1HG ARG 98 10.427 -7.612 -3.506 802 2HG ARG 98 2HG ARG 98 9.560 -6.609 -4.669 803 1HD ARG 98 1HD ARG 98 11.731 -6.704 -5.513 804 2HD ARG 98 2HD ARG 98 11.657 -5.147 -4.690 805 HE ARG 98 HE ARG 98 12.644 -6.752 -2.773 806 1HH1 ARG 98 1HH1 ARG 98 13.552 -6.173 -6.099 807 2HH1 ARG 98 2HH1 ARG 98 15.212 -6.634 -5.866 808 1HH2 ARG 98 1HH2 ARG 98 14.814 -7.366 -2.447 809 2HH2 ARG 98 2HH2 ARG 98 15.925 -7.348 -3.792 810 H ASN 99 H ASN 99 9.418 -6.177 0.173 811 HA ASN 99 HA ASN 99 9.773 -8.974 0.360 812 1HB ASN 99 1HB ASN 99 9.600 -6.788 2.420 813 2HB ASN 99 2HB ASN 99 9.764 -8.475 2.891 814 1HD2 ASN 99 1HD2 ASN 99 11.771 -8.027 3.837 815 2HD2 ASN 99 2HD2 ASN 99 13.197 -7.775 2.881 816 H LEU 100 H LEU 100 7.126 -6.851 1.356 817 HA LEU 100 HA LEU 100 5.560 -8.832 2.607 818 1HB LEU 100 1HB LEU 100 5.059 -6.115 1.525 819 2HB LEU 100 2HB LEU 100 3.662 -7.146 1.758 820 HG LEU 100 HG LEU 100 4.251 -7.406 4.137 821 1HD1 LEU 100 1HD1 LEU 100 5.966 -5.993 5.140 822 2HD1 LEU 100 2HD1 LEU 100 6.438 -5.421 3.541 823 3HD1 LEU 100 3HD1 LEU 100 6.666 -7.116 3.972 824 1HD2 LEU 100 1HD2 LEU 100 4.056 -4.547 3.202 825 2HD2 LEU 100 2HD2 LEU 100 3.703 -5.124 4.832 826 3HD2 LEU 100 3HD2 LEU 100 2.709 -5.653 3.475 827 H ALA 101 H ALA 101 5.707 -7.695 -0.736 828 HA ALA 101 HA ALA 101 3.603 -9.224 -1.779 829 1HB ALA 101 1HB ALA 101 4.682 -8.934 -3.951 830 2HB ALA 101 2HB ALA 101 6.162 -8.401 -3.153 831 3HB ALA 101 3HB ALA 101 4.696 -7.428 -3.034 832 H LYS 102 H LYS 102 6.983 -10.010 -1.185 833 HA LYS 102 HA LYS 102 6.901 -12.581 -2.400 834 1HB LYS 102 1HB LYS 102 8.998 -11.316 -1.989 835 2HB LYS 102 2HB LYS 102 8.770 -11.542 -0.258 836 1HG LYS 102 1HG LYS 102 8.857 -14.001 -0.641 837 2HG LYS 102 2HG LYS 102 9.277 -13.670 -2.322 838 1HD LYS 102 1HD LYS 102 11.257 -12.424 -1.560 839 2HD LYS 102 2HD LYS 102 10.843 -12.815 0.110 840 1HE LYS 102 1HE LYS 102 11.540 -14.767 -2.080 841 2HE LYS 102 2HE LYS 102 12.546 -14.333 -0.701 842 1HZ LYS 102 1HZ LYS 102 11.394 -16.461 -0.412 843 2HZ LYS 102 2HZ LYS 102 9.896 -15.671 -0.509 844 3HZ LYS 102 3HZ LYS 102 10.950 -15.336 0.778 845 H ALA 103 H ALA 103 6.070 -11.333 0.735 846 HA ALA 103 HA ALA 103 6.021 -13.871 2.072 847 1HB ALA 103 1HB ALA 103 5.046 -12.653 3.933 848 2HB ALA 103 2HB ALA 103 4.787 -11.246 2.902 849 3HB ALA 103 3HB ALA 103 6.428 -11.773 3.279 850 H GLY 104 H GLY 104 3.933 -12.294 -0.075 851 1HA GLY 104 1HA GLY 104 2.187 -13.825 -0.943 852 2HA GLY 104 2HA GLY 104 1.740 -14.099 0.732 853 H VAL 105 H VAL 105 2.518 -10.914 0.571 854 HA VAL 105 HA VAL 105 -0.241 -10.115 0.642 855 HB VAL 105 HB VAL 105 2.256 -8.405 0.659 856 1HG1 VAL 105 1HG1 VAL 105 -0.600 -7.697 1.338 857 2HG1 VAL 105 2HG1 VAL 105 0.307 -7.139 -0.069 858 3HG1 VAL 105 3HG1 VAL 105 0.798 -6.643 1.551 859 1HG2 VAL 105 1HG2 VAL 105 2.153 -9.926 2.561 860 2HG2 VAL 105 2HG2 VAL 105 0.517 -9.373 2.928 861 3HG2 VAL 105 3HG2 VAL 105 1.879 -8.262 3.075 862 H PHE 106 H PHE 106 -1.326 -10.141 -1.197 863 HA PHE 106 HA PHE 106 -0.058 -9.095 -3.631 864 1HB PHE 106 1HB PHE 106 -0.903 -11.379 -3.822 865 2HB PHE 106 2HB PHE 106 -2.494 -10.862 -3.276 866 HD1 PHE 106 HD1 PHE 106 -4.102 -10.229 -4.821 867 HD2 PHE 106 HD2 PHE 106 -0.014 -10.336 -5.989 868 HE1 PHE 106 HE1 PHE 106 -4.761 -9.814 -7.155 869 HE2 PHE 106 HE2 PHE 106 -0.665 -9.922 -8.324 870 HZ PHE 106 HZ PHE 106 -3.041 -9.660 -8.908 871 H ARG 107 H ARG 107 -2.687 -8.626 -1.393 872 HA ARG 107 HA ARG 107 -3.646 -6.393 -3.052 873 1HB ARG 107 1HB ARG 107 -5.260 -8.256 -1.301 874 2HB ARG 107 2HB ARG 107 -5.901 -6.806 -2.068 875 1HG ARG 107 1HG ARG 107 -5.671 -7.696 -4.217 876 2HG ARG 107 2HG ARG 107 -4.578 -8.968 -3.671 877 1HD ARG 107 1HD ARG 107 -6.670 -9.984 -4.109 878 2HD ARG 107 2HD ARG 107 -6.488 -9.913 -2.360 879 HE ARG 107 HE ARG 107 -7.897 -7.680 -2.887 880 1HH1 ARG 107 1HH1 ARG 107 -8.285 -10.989 -3.931 881 2HH1 ARG 107 2HH1 ARG 107 -10.022 -10.925 -3.978 882 1HH2 ARG 107 1HH2 ARG 107 -10.192 -7.554 -2.955 883 2HH2 ARG 107 2HH2 ARG 107 -11.113 -8.968 -3.401 884 H TRP 108 H TRP 108 -2.808 -4.671 -2.166 885 HA TRP 108 HA TRP 108 -2.540 -4.368 0.709 886 1HB TRP 108 1HB TRP 108 -0.760 -3.666 -0.903 887 2HB TRP 108 2HB TRP 108 -1.863 -2.461 -1.546 888 HD1 TRP 108 HD1 TRP 108 -2.785 -0.708 0.621 889 HE1 TRP 108 HE1 TRP 108 -1.239 0.511 2.273 890 HE3 TRP 108 HE3 TRP 108 1.369 -3.649 0.154 891 HZ2 TRP 108 HZ2 TRP 108 1.406 0.264 3.243 892 HZ3 TRP 108 HZ3 TRP 108 3.369 -3.082 1.470 893 HH2 TRP 108 HH2 TRP 108 3.385 -1.168 2.979 894 H VAL 109 H VAL 109 -4.585 -4.093 1.554 895 HA VAL 109 HA VAL 109 -6.246 -1.982 0.359 896 HB VAL 109 HB VAL 109 -7.083 -4.161 2.282 897 1HG1 VAL 109 1HG1 VAL 109 -8.438 -2.121 2.442 898 2HG1 VAL 109 2HG1 VAL 109 -9.358 -3.467 1.773 899 3HG1 VAL 109 3HG1 VAL 109 -8.750 -2.199 0.708 900 1HG2 VAL 109 1HG2 VAL 109 -8.230 -5.147 0.343 901 2HG2 VAL 109 2HG2 VAL 109 -6.480 -5.102 0.132 902 3HG2 VAL 109 3HG2 VAL 109 -7.496 -3.923 -0.694 903 H THR 110 H THR 110 -5.671 -0.109 1.314 904 HA THR 110 HA THR 110 -5.480 -0.052 4.246 905 HB THR 110 HB THR 110 -4.738 2.105 2.254 906 HG1 THR 110 HG1 THR 110 -3.459 -0.086 2.785 907 1HG2 THR 110 1HG2 THR 110 -3.653 3.191 4.162 908 2HG2 THR 110 2HG2 THR 110 -4.228 1.910 5.228 909 3HG2 THR 110 3HG2 THR 110 -5.381 2.998 4.452 910 H ASN 111 H ASN 111 -7.367 0.321 5.220 911 HA ASN 111 HA ASN 111 -9.339 2.002 3.863 912 1HB ASN 111 1HB ASN 111 -10.058 -0.199 4.811 913 2HB ASN 111 2HB ASN 111 -9.682 0.416 6.420 914 1HD2 ASN 111 1HD2 ASN 111 -11.918 0.022 6.913 915 2HD2 ASN 111 2HD2 ASN 111 -13.120 1.166 6.425 916 H ILE 112 H ILE 112 -8.961 4.049 4.147 917 HA ILE 112 HA ILE 112 -7.384 5.162 6.180 918 HB ILE 112 HB ILE 112 -9.338 6.466 4.279 919 1HG1 ILE 112 1HG1 ILE 112 -7.486 5.317 3.166 920 2HG1 ILE 112 2HG1 ILE 112 -7.311 7.061 3.007 921 1HG2 ILE 112 1HG2 ILE 112 -7.245 7.741 6.030 922 2HG2 ILE 112 2HG2 ILE 112 -8.992 7.921 6.175 923 3HG2 ILE 112 3HG2 ILE 112 -8.155 8.568 4.764 924 1HD1 ILE 112 1HD1 ILE 112 -5.177 6.006 3.463 925 2HD1 ILE 112 2HD1 ILE 112 -5.825 5.299 4.943 926 3HD1 ILE 112 3HD1 ILE 112 -5.651 7.048 4.806 927 H HIS 113 H HIS 113 -10.880 4.872 5.806 928 HA HIS 113 HA HIS 113 -11.544 6.721 7.837 929 1HB HIS 113 1HB HIS 113 -13.033 5.835 5.953 930 2HB HIS 113 2HB HIS 113 -13.310 4.436 6.986 931 HD1 HIS 113 HD1 HIS 113 -15.862 5.241 6.958 932 HD2 HIS 113 HD2 HIS 113 -13.187 7.742 8.938 933 HE1 HIS 113 HE1 HIS 113 -17.276 6.791 8.351 934 HE2 HIS 113 HE2 HIS 113 -15.644 8.367 9.452 935 H GLU 114 H GLU 114 -10.608 3.372 7.973 936 HA GLU 114 HA GLU 114 -11.419 3.260 10.794 937 1HB GLU 114 1HB GLU 114 -10.497 1.066 8.940 938 2HB GLU 114 2HB GLU 114 -10.871 0.839 10.643 939 1HG GLU 114 1HG GLU 114 -13.174 1.667 10.155 940 2HG GLU 114 2HG GLU 114 -12.753 1.631 8.443 941 H GLN 115 H GLN 115 -8.804 4.161 9.036 942 HA GLN 115 HA GLN 115 -6.571 4.389 9.413 943 1HB GLN 115 1HB GLN 115 -7.544 4.150 12.263 944 2HB GLN 115 2HB GLN 115 -5.891 4.572 11.840 945 1HG GLN 115 1HG GLN 115 -8.322 6.134 11.002 946 2HG GLN 115 2HG GLN 115 -7.308 6.517 12.394 947 1HE2 GLN 115 1HE2 GLN 115 -7.534 6.477 8.928 948 2HE2 GLN 115 2HE2 GLN 115 -6.131 7.444 8.626 949 H LYS 116 H LYS 116 -7.350 1.806 8.699 950 HA LYS 116 HA LYS 116 -5.317 0.232 10.104 951 1HB LYS 116 1HB LYS 116 -8.199 -0.471 9.762 952 2HB LYS 116 2HB LYS 116 -7.000 -1.756 9.714 953 1HG LYS 116 1HG LYS 116 -6.204 -1.123 11.920 954 2HG LYS 116 2HG LYS 116 -7.368 0.202 11.971 955 1HD LYS 116 1HD LYS 116 -8.262 -2.629 11.545 956 2HD LYS 116 2HD LYS 116 -7.956 -2.006 13.167 957 1HE LYS 116 1HE LYS 116 -9.889 -0.849 11.160 958 2HE LYS 116 2HE LYS 116 -10.314 -1.815 12.573 959 1HZ LYS 116 1HZ LYS 116 -9.152 -0.050 13.921 960 2HZ LYS 116 2HZ LYS 116 -10.611 0.414 13.195 961 3HZ LYS 116 3HZ LYS 116 -9.143 0.906 12.517 962 H ARG 117 H ARG 117 -4.081 -1.018 8.858 963 HA ARG 117 HA ARG 117 -4.683 -1.099 5.990 964 1HB ARG 117 1HB ARG 117 -2.125 -1.560 7.526 965 2HB ARG 117 2HB ARG 117 -2.284 -1.891 5.805 966 1HG ARG 117 1HG ARG 117 -2.781 0.439 5.377 967 2HG ARG 117 2HG ARG 117 -2.711 0.790 7.107 968 1HD ARG 117 1HD ARG 117 -0.407 -0.324 5.510 969 2HD ARG 117 2HD ARG 117 -0.645 1.392 5.832 970 HE ARG 117 HE ARG 117 -0.709 0.006 8.276 971 1HH1 ARG 117 1HH1 ARG 117 1.570 0.789 5.726 972 2HH1 ARG 117 2HH1 ARG 117 2.934 0.849 6.786 973 1HH2 ARG 117 1HH2 ARG 117 1.070 0.099 9.682 974 2HH2 ARG 117 2HH2 ARG 117 2.653 0.450 9.044 975 H TYR 118 H TYR 118 -5.483 -2.852 5.145 976 HA TYR 118 HA TYR 118 -5.290 -5.388 6.619 977 1HB TYR 118 1HB TYR 118 -7.251 -4.577 4.457 978 2HB TYR 118 2HB TYR 118 -7.279 -6.079 5.371 979 HD1 TYR 118 HD1 TYR 118 -7.877 -2.447 5.535 980 HD2 TYR 118 HD2 TYR 118 -8.190 -6.161 7.590 981 HE1 TYR 118 HE1 TYR 118 -9.349 -1.394 7.199 982 HE2 TYR 118 HE2 TYR 118 -9.666 -5.116 9.259 983 HH TYR 118 HH TYR 118 -11.076 -2.045 8.815 984 H TYR 119 H TYR 119 -3.746 -6.688 5.843 985 HA TYR 119 HA TYR 119 -2.995 -6.462 3.020 986 1HB TYR 119 1HB TYR 119 -1.639 -7.903 5.312 987 2HB TYR 119 2HB TYR 119 -1.022 -7.813 3.665 988 HD1 TYR 119 HD1 TYR 119 -1.144 -6.203 6.862 989 HD2 TYR 119 HD2 TYR 119 -0.500 -5.505 2.714 990 HE1 TYR 119 HE1 TYR 119 -0.012 -4.088 7.401 991 HE2 TYR 119 HE2 TYR 119 0.639 -3.393 3.244 992 HH TYR 119 HH TYR 119 1.666 -2.574 6.341 993 H TYR 120 H TYR 120 -4.165 -7.703 1.717 994 HA TYR 120 HA TYR 120 -5.023 -10.356 2.634 995 1HB TYR 120 1HB TYR 120 -5.906 -8.698 0.262 996 2HB TYR 120 2HB TYR 120 -6.496 -10.316 0.612 997 HD1 TYR 120 HD1 TYR 120 -6.526 -6.803 1.708 998 HD2 TYR 120 HD2 TYR 120 -8.133 -10.691 2.325 999 HE1 TYR 120 HE1 TYR 120 -8.305 -5.838 3.097 1000 HE2 TYR 120 HE2 TYR 120 -9.921 -9.737 3.723 1001 HH TYR 120 HH TYR 120 -10.514 -6.352 3.875 1002 H THR 121 H THR 121 -4.435 -12.206 1.595 1003 HA THR 121 HA THR 121 -2.197 -12.046 -0.229 1004 HB THR 121 HB THR 121 -2.142 -13.727 1.537 1005 HG1 THR 121 HG1 THR 121 -1.004 -14.687 0.036 1006 1HG2 THR 121 1HG2 THR 121 -4.537 -14.947 0.178 1007 2HG2 THR 121 2HG2 THR 121 -4.542 -14.135 1.743 1008 3HG2 THR 121 3HG2 THR 121 -3.649 -15.641 1.534 1009 H PHE 122 H PHE 122 -2.482 -14.016 -2.001 1010 HA PHE 122 HA PHE 122 -3.921 -12.691 -4.005 1011 1HB PHE 122 1HB PHE 122 -3.409 -14.734 -5.391 1012 2HB PHE 122 2HB PHE 122 -2.021 -13.958 -4.642 1013 HD1 PHE 122 HD1 PHE 122 -0.754 -15.061 -2.929 1014 HD2 PHE 122 HD2 PHE 122 -4.190 -16.916 -4.618 1015 HE1 PHE 122 HE1 PHE 122 -0.082 -17.210 -1.932 1016 HE2 PHE 122 HE2 PHE 122 -3.525 -19.064 -3.627 1017 HZ PHE 122 HZ PHE 122 -1.471 -19.215 -2.281 1018 H ASP 123 H ASP 123 -4.914 -15.320 -1.903 1019 HA ASP 123 HA ASP 123 -7.223 -15.879 -3.603 1020 1HB ASP 123 1HB ASP 123 -7.509 -17.868 -2.448 1021 2HB ASP 123 2HB ASP 123 -5.765 -17.653 -2.359 1022 H ASN 124 H ASN 124 -6.580 -13.540 -1.574 1023 HA ASN 124 HA ASN 124 -7.932 -11.907 -0.747 1024 1HB ASN 124 1HB ASN 124 -9.686 -12.718 -2.336 1025 2HB ASN 124 2HB ASN 124 -10.268 -13.802 -1.082 1026 1HD2 ASN 124 1HD2 ASN 124 -9.121 -10.522 -0.510 1027 2HD2 ASN 124 2HD2 ASN 124 -10.653 -9.884 -0.039 1028 H SER 125 H SER 125 -6.965 -14.565 0.717 1029 HA SER 125 HA SER 125 -8.481 -14.409 3.148 1030 1HB SER 125 1HB SER 125 -5.732 -15.578 2.636 1031 2HB SER 125 2HB SER 125 -6.668 -15.789 4.117 1032 HG SER 125 HG SER 125 -7.037 -16.892 1.569 1033 H LEU 126 H LEU 126 -8.208 -13.073 4.834 1034 HA LEU 126 HA LEU 126 -6.414 -10.854 4.590 1035 1HB LEU 126 1HB LEU 126 -8.638 -10.596 5.588 1036 2HB LEU 126 2HB LEU 126 -8.205 -11.711 6.870 1037 HG LEU 126 HG LEU 126 -6.515 -10.121 7.682 1038 1HD1 LEU 126 1HD1 LEU 126 -6.440 -7.852 6.793 1039 2HD1 LEU 126 2HD1 LEU 126 -7.584 -8.303 5.529 1040 3HD1 LEU 126 3HD1 LEU 126 -5.980 -9.035 5.568 1041 1HD2 LEU 126 1HD2 LEU 126 -8.759 -10.063 8.612 1042 2HD2 LEU 126 2HD2 LEU 126 -9.268 -8.942 7.351 1043 3HD2 LEU 126 3HD2 LEU 126 -8.070 -8.440 8.546 1044 H LEU 127 H LEU 127 -4.335 -10.951 5.087 1045 HA LEU 127 HA LEU 127 -3.389 -13.056 6.866 1046 1HB LEU 127 1HB LEU 127 -1.863 -11.080 5.165 1047 2HB LEU 127 2HB LEU 127 -1.133 -12.349 6.130 1048 HG LEU 127 HG LEU 127 -2.968 -12.768 3.767 1049 1HD1 LEU 127 1HD1 LEU 127 0.001 -13.211 4.081 1050 2HD1 LEU 127 2HD1 LEU 127 -0.763 -11.936 3.133 1051 3HD1 LEU 127 3HD1 LEU 127 -0.963 -13.623 2.664 1052 1HD2 LEU 127 1HD2 LEU 127 -1.486 -14.754 5.491 1053 2HD2 LEU 127 2HD2 LEU 127 -2.368 -15.136 4.012 1054 3HD2 LEU 127 3HD2 LEU 127 -3.234 -14.528 5.424 1055 H PHE 128 H PHE 128 -2.296 -9.700 6.464 1056 HA PHE 128 HA PHE 128 -2.019 -9.586 9.391 1057 1HB PHE 128 1HB PHE 128 0.078 -9.539 7.962 1058 2HB PHE 128 2HB PHE 128 -0.458 -7.973 7.368 1059 HD1 PHE 128 HD1 PHE 128 0.631 -9.824 10.365 1060 HD2 PHE 128 HD2 PHE 128 -0.162 -6.006 8.656 1061 HE1 PHE 128 HE1 PHE 128 1.718 -8.743 12.288 1062 HE2 PHE 128 HE2 PHE 128 0.922 -4.920 10.577 1063 HZ PHE 128 HZ PHE 128 1.865 -6.287 12.397 1064 H THR 129 H THR 129 -2.762 -7.823 10.490 1065 HA THR 129 HA THR 129 -3.838 -5.553 9.000 1066 HB THR 129 HB THR 129 -5.465 -7.084 11.045 1067 HG1 THR 129 HG1 THR 129 -5.252 -7.267 8.326 1068 1HG2 THR 129 1HG2 THR 129 -5.842 -4.657 11.119 1069 2HG2 THR 129 2HG2 THR 129 -7.253 -5.515 10.500 1070 3HG2 THR 129 3HG2 THR 129 -6.183 -4.660 9.388 1071 H GLU 130 H GLU 130 -3.228 -3.718 9.964 1072 HA GLU 130 HA GLU 130 -2.866 -3.738 12.870 1073 1HB GLU 130 1HB GLU 130 -0.786 -2.362 12.595 1074 2HB GLU 130 2HB GLU 130 -0.636 -4.036 12.092 1075 1HG GLU 130 1HG GLU 130 0.475 -2.871 10.430 1076 2HG GLU 130 2HG GLU 130 -1.115 -3.158 9.728 1077 H SER 131 H SER 131 -2.412 -1.343 13.579 1078 HA SER 131 HA SER 131 -4.374 0.331 12.168 1079 1HB SER 131 1HB SER 131 -3.781 0.339 15.138 1080 2HB SER 131 2HB SER 131 -5.046 1.242 14.309 1081 HG SER 131 HG SER 131 -4.869 -1.529 14.817 1082 H ILE 132 H ILE 132 -3.427 2.004 11.219 1083 HA ILE 132 HA ILE 132 -0.810 2.887 11.859 1084 HB ILE 132 HB ILE 132 -1.376 4.865 10.375 1085 1HG1 ILE 132 1HG1 ILE 132 -3.892 3.258 9.869 1086 2HG1 ILE 132 2HG1 ILE 132 -3.835 4.795 10.724 1087 1HG2 ILE 132 1HG2 ILE 132 -0.211 2.879 9.580 1088 2HG2 ILE 132 2HG2 ILE 132 -1.279 3.528 8.336 1089 3HG2 ILE 132 3HG2 ILE 132 -1.754 2.096 9.250 1090 1HD1 ILE 132 1HD1 ILE 132 -4.575 5.077 8.427 1091 2HD1 ILE 132 2HD1 ILE 132 -3.079 4.348 7.844 1092 3HD1 ILE 132 3HD1 ILE 132 -3.034 5.891 8.698 1093 H GLN 133 H GLN 133 -0.211 4.044 13.511 1094 HA GLN 133 HA GLN 133 -2.112 5.035 15.359 1095 1HB GLN 133 1HB GLN 133 0.891 5.328 15.278 1096 2HB GLN 133 2HB GLN 133 -0.123 5.805 16.637 1097 1HG GLN 133 1HG GLN 133 0.163 3.023 15.524 1098 2HG GLN 133 2HG GLN 133 0.876 3.627 17.021 1099 1HE2 GLN 133 1HE2 GLN 133 -1.074 1.456 16.444 1100 2HE2 GLN 133 2HE2 GLN 133 -2.420 1.779 17.474 Start of MODEL 9 1 H ASP 7 H ASP 7 -5.829 15.310 -15.913 2 HA ASP 7 HA ASP 7 -6.906 12.689 -15.409 3 1HB ASP 7 1HB ASP 7 -4.096 13.685 -15.916 4 2HB ASP 7 2HB ASP 7 -4.455 12.006 -15.537 5 H GLN 8 H GLN 8 -7.729 12.904 -13.331 6 HA GLN 8 HA GLN 8 -6.409 13.748 -11.043 7 1HB GLN 8 1HB GLN 8 -8.816 13.132 -11.198 8 2HB GLN 8 2HB GLN 8 -8.350 11.438 -11.262 9 1HG GLN 8 1HG GLN 8 -9.008 11.885 -9.046 10 2HG GLN 8 2HG GLN 8 -7.253 11.751 -9.039 11 1HE2 GLN 8 1HE2 GLN 8 -9.964 13.873 -8.689 12 2HE2 GLN 8 2HE2 GLN 8 -9.094 15.211 -8.042 13 H VAL 9 H VAL 9 -5.991 10.921 -12.934 14 HA VAL 9 HA VAL 9 -4.760 9.160 -11.171 15 HB VAL 9 HB VAL 9 -4.107 9.564 -14.096 16 1HG1 VAL 9 1HG1 VAL 9 -3.437 7.202 -14.044 17 2HG1 VAL 9 2HG1 VAL 9 -3.734 7.166 -12.305 18 3HG1 VAL 9 3HG1 VAL 9 -2.456 8.189 -12.959 19 1HG2 VAL 9 1HG2 VAL 9 -6.176 7.784 -12.811 20 2HG2 VAL 9 2HG2 VAL 9 -5.778 7.834 -14.528 21 3HG2 VAL 9 3HG2 VAL 9 -6.501 9.242 -13.749 22 H VAL 10 H VAL 10 -3.442 11.922 -12.963 23 HA VAL 10 HA VAL 10 -0.715 11.354 -12.470 24 HB VAL 10 HB VAL 10 -2.038 14.020 -13.008 25 1HG1 VAL 10 1HG1 VAL 10 0.865 13.227 -13.236 26 2HG1 VAL 10 2HG1 VAL 10 0.180 14.300 -12.015 27 3HG1 VAL 10 3HG1 VAL 10 0.179 14.778 -13.715 28 1HG2 VAL 10 1HG2 VAL 10 -1.322 13.656 -15.321 29 2HG2 VAL 10 2HG2 VAL 10 -2.438 12.402 -14.779 30 3HG2 VAL 10 3HG2 VAL 10 -0.708 12.063 -14.876 31 H ILE 11 H ILE 11 -3.132 13.206 -10.699 32 HA ILE 11 HA ILE 11 -1.398 14.404 -8.839 33 HB ILE 11 HB ILE 11 -4.344 13.740 -8.634 34 1HG1 ILE 11 1HG1 ILE 11 -4.481 16.296 -8.748 35 2HG1 ILE 11 2HG1 ILE 11 -2.795 16.261 -9.241 36 1HG2 ILE 11 1HG2 ILE 11 -4.428 15.212 -6.678 37 2HG2 ILE 11 2HG2 ILE 11 -2.670 15.357 -6.716 38 3HG2 ILE 11 3HG2 ILE 11 -3.419 13.795 -6.389 39 1HD1 ILE 11 1HD1 ILE 11 -5.091 14.973 -10.696 40 2HD1 ILE 11 2HD1 ILE 11 -3.400 14.928 -11.196 41 3HD1 ILE 11 3HD1 ILE 11 -4.267 16.465 -11.152 42 H PHE 12 H PHE 12 -3.481 11.533 -8.463 43 HA PHE 12 HA PHE 12 -2.488 10.917 -5.888 44 1HB PHE 12 1HB PHE 12 -4.088 9.370 -7.903 45 2HB PHE 12 2HB PHE 12 -3.545 8.625 -6.405 46 HD1 PHE 12 HD1 PHE 12 -5.688 11.252 -7.846 47 HD2 PHE 12 HD2 PHE 12 -4.563 9.132 -4.330 48 HE1 PHE 12 HE1 PHE 12 -7.649 12.165 -6.668 49 HE2 PHE 12 HE2 PHE 12 -6.519 10.041 -3.151 50 HZ PHE 12 HZ PHE 12 -8.066 11.558 -4.320 51 H LYS 13 H LYS 13 -1.637 9.705 -9.121 52 HA LYS 13 HA LYS 13 0.073 7.650 -8.261 53 1HB LYS 13 1HB LYS 13 -0.636 7.728 -10.568 54 2HB LYS 13 2HB LYS 13 0.129 9.295 -10.797 55 1HG LYS 13 1HG LYS 13 2.326 8.274 -10.452 56 2HG LYS 13 2HG LYS 13 1.557 6.703 -10.233 57 1HD LYS 13 1HD LYS 13 0.781 6.694 -12.496 58 2HD LYS 13 2HD LYS 13 1.295 8.366 -12.729 59 1HE LYS 13 1HE LYS 13 2.850 6.735 -13.742 60 2HE LYS 13 2HE LYS 13 3.611 7.739 -12.508 61 1HZ LYS 13 1HZ LYS 13 4.243 5.401 -12.316 62 2HZ LYS 13 2HZ LYS 13 2.620 4.970 -12.081 63 3HZ LYS 13 3HZ LYS 13 3.418 5.936 -10.931 64 H GLN 14 H GLN 14 0.634 11.081 -8.828 65 HA GLN 14 HA GLN 14 3.421 11.111 -8.599 66 1HB GLN 14 1HB GLN 14 1.743 12.999 -9.238 67 2HB GLN 14 2HB GLN 14 1.698 13.321 -7.509 68 1HG GLN 14 1HG GLN 14 3.277 14.785 -8.574 69 2HG GLN 14 2HG GLN 14 4.132 13.650 -7.529 70 1HE2 GLN 14 1HE2 GLN 14 3.380 14.485 -10.832 71 2HE2 GLN 14 2HE2 GLN 14 4.650 13.568 -11.570 72 H ILE 15 H ILE 15 0.875 11.281 -6.166 73 HA ILE 15 HA ILE 15 2.519 11.731 -3.920 74 HB ILE 15 HB ILE 15 -0.103 10.228 -3.922 75 1HG1 ILE 15 1HG1 ILE 15 0.311 13.216 -3.720 76 2HG1 ILE 15 2HG1 ILE 15 -0.260 12.389 -5.165 77 1HG2 ILE 15 1HG2 ILE 15 1.286 11.884 -1.821 78 2HG2 ILE 15 2HG2 ILE 15 1.082 10.132 -1.818 79 3HG2 ILE 15 3HG2 ILE 15 -0.325 11.184 -1.661 80 1HD1 ILE 15 1HD1 ILE 15 -2.095 13.387 -3.935 81 2HD1 ILE 15 2HD1 ILE 15 -1.657 12.455 -2.502 82 3HD1 ILE 15 3HD1 ILE 15 -2.230 11.629 -3.951 83 H PHE 16 H PHE 16 1.202 8.750 -5.320 84 HA PHE 16 HA PHE 16 2.289 7.014 -3.380 85 1HB PHE 16 1HB PHE 16 1.146 6.626 -6.119 86 2HB PHE 16 2HB PHE 16 1.924 5.281 -5.292 87 HD1 PHE 16 HD1 PHE 16 0.785 4.054 -3.668 88 HD2 PHE 16 HD2 PHE 16 -0.796 7.783 -4.972 89 HE1 PHE 16 HE1 PHE 16 -1.290 3.607 -2.423 90 HE2 PHE 16 HE2 PHE 16 -2.876 7.339 -3.736 91 HZ PHE 16 HZ PHE 16 -3.122 5.250 -2.456 92 H ASP 17 H ASP 17 3.447 7.887 -6.644 93 HA ASP 17 HA ASP 17 5.704 6.179 -6.541 94 1HB ASP 17 1HB ASP 17 4.817 8.399 -8.301 95 2HB ASP 17 2HB ASP 17 6.535 8.020 -8.310 96 H LYS 18 H LYS 18 5.147 9.430 -5.408 97 HA LYS 18 HA LYS 18 7.831 10.180 -4.975 98 1HB LYS 18 1HB LYS 18 5.912 11.751 -4.939 99 2HB LYS 18 2HB LYS 18 5.368 11.027 -3.434 100 1HG LYS 18 1HG LYS 18 6.509 13.134 -3.037 101 2HG LYS 18 2HG LYS 18 7.401 11.792 -2.320 102 1HD LYS 18 1HD LYS 18 9.103 11.917 -3.884 103 2HD LYS 18 2HD LYS 18 8.085 12.730 -5.073 104 1HE LYS 18 1HE LYS 18 9.741 14.265 -4.160 105 2HE LYS 18 2HE LYS 18 8.111 14.763 -3.719 106 1HZ LYS 18 1HZ LYS 18 8.465 13.754 -1.523 107 2HZ LYS 18 2HZ LYS 18 9.581 14.982 -1.846 108 3HZ LYS 18 3HZ LYS 18 10.060 13.361 -1.957 109 H VAL 19 H VAL 19 5.422 8.819 -2.713 110 HA VAL 19 HA VAL 19 7.215 8.734 -0.533 111 HB VAL 19 HB VAL 19 4.763 8.752 -0.264 112 1HG1 VAL 19 1HG1 VAL 19 4.912 5.896 -1.205 113 2HG1 VAL 19 2HG1 VAL 19 4.130 7.239 -2.041 114 3HG1 VAL 19 3HG1 VAL 19 3.495 6.668 -0.495 115 1HG2 VAL 19 1HG2 VAL 19 6.137 6.396 1.021 116 2HG2 VAL 19 2HG2 VAL 19 4.650 7.155 1.590 117 3HG2 VAL 19 3HG2 VAL 19 6.162 8.064 1.598 118 H ARG 20 H ARG 20 6.622 6.505 -3.142 119 HA ARG 20 HA ARG 20 7.518 4.112 -2.068 120 1HB ARG 20 1HB ARG 20 7.698 5.233 -4.852 121 2HB ARG 20 2HB ARG 20 8.295 3.626 -4.464 122 1HG ARG 20 1HG ARG 20 6.121 2.885 -3.845 123 2HG ARG 20 2HG ARG 20 5.472 4.522 -3.938 124 1HD ARG 20 1HD ARG 20 4.850 3.179 -5.893 125 2HD ARG 20 2HD ARG 20 5.850 4.560 -6.335 126 HE ARG 20 HE ARG 20 7.732 2.757 -6.217 127 1HH1 ARG 20 1HH1 ARG 20 4.477 2.305 -7.455 128 2HH1 ARG 20 2HH1 ARG 20 4.954 1.094 -8.615 129 1HH2 ARG 20 1HH2 ARG 20 8.335 1.169 -7.734 130 2HH2 ARG 20 2HH2 ARG 20 7.125 0.450 -8.756 131 H ASN 21 H ASN 21 9.443 6.739 -3.486 132 HA ASN 21 HA ASN 21 11.879 5.268 -2.745 133 1HB ASN 21 1HB ASN 21 11.481 7.608 -4.618 134 2HB ASN 21 2HB ASN 21 13.046 6.911 -4.226 135 1HD2 ASN 21 1HD2 ASN 21 11.666 7.155 -6.785 136 2HD2 ASN 21 2HD2 ASN 21 11.540 5.543 -7.407 137 H ASP 22 H ASP 22 10.140 8.253 -2.211 138 HA ASP 22 HA ASP 22 12.351 9.601 -0.968 139 1HB ASP 22 1HB ASP 22 10.588 10.758 -2.278 140 2HB ASP 22 2HB ASP 22 9.425 10.348 -1.025 141 H LEU 23 H LEU 23 9.697 7.639 0.134 142 HA LEU 23 HA LEU 23 8.877 7.069 2.175 143 1HB LEU 23 1HB LEU 23 11.485 8.244 3.146 144 2HB LEU 23 2HB LEU 23 10.322 7.462 4.202 145 HG LEU 23 HG LEU 23 11.789 6.143 1.913 146 1HD1 LEU 23 1HD1 LEU 23 13.241 6.591 3.815 147 2HD1 LEU 23 2HD1 LEU 23 12.906 4.865 3.667 148 3HD1 LEU 23 3HD1 LEU 23 12.076 5.821 4.895 149 1HD2 LEU 23 1HD2 LEU 23 10.790 4.077 2.745 150 2HD2 LEU 23 2HD2 LEU 23 9.558 5.221 2.214 151 3HD2 LEU 23 3HD2 LEU 23 9.872 4.998 3.935 152 H ASN 24 H ASN 24 8.136 9.406 0.918 153 HA ASN 24 HA ASN 24 8.031 11.623 2.743 154 1HB ASN 24 1HB ASN 24 7.969 11.501 0.089 155 2HB ASN 24 2HB ASN 24 6.237 11.391 0.363 156 1HD2 ASN 24 1HD2 ASN 24 6.522 13.122 2.810 157 2HD2 ASN 24 2HD2 ASN 24 6.685 14.728 2.180 158 H TYR 25 H TYR 25 7.066 9.836 4.314 159 HA TYR 25 HA TYR 25 4.417 8.966 3.955 160 1HB TYR 25 1HB TYR 25 6.109 9.208 6.436 161 2HB TYR 25 2HB TYR 25 4.494 8.507 6.440 162 HD1 TYR 25 HD1 TYR 25 4.117 6.575 4.695 163 HD2 TYR 25 HD2 TYR 25 7.926 7.813 6.121 164 HE1 TYR 25 HE1 TYR 25 5.054 4.385 4.076 165 HE2 TYR 25 HE2 TYR 25 8.873 5.632 5.503 166 HH TYR 25 HH TYR 25 8.128 3.347 5.111 167 H GLN 26 H GLN 26 5.690 11.906 5.427 168 HA GLN 26 HA GLN 26 3.416 12.576 6.941 169 1HB GLN 26 1HB GLN 26 5.561 14.307 5.718 170 2HB GLN 26 2HB GLN 26 4.302 14.937 6.770 171 1HG GLN 26 1HG GLN 26 6.380 12.885 7.494 172 2HG GLN 26 2HG GLN 26 6.336 14.567 8.017 173 1HE2 GLN 26 1HE2 GLN 26 5.080 11.392 8.484 174 2HE2 GLN 26 2HE2 GLN 26 4.144 11.739 9.892 175 H TRP 27 H TRP 27 4.362 13.653 3.684 176 HA TRP 27 HA TRP 27 1.953 15.119 3.271 177 1HB TRP 27 1HB TRP 27 4.129 15.595 2.133 178 2HB TRP 27 2HB TRP 27 3.927 14.111 1.209 179 HD1 TRP 27 HD1 TRP 27 1.887 17.377 1.782 180 HE1 TRP 27 HE1 TRP 27 0.839 18.054 -0.478 181 HE3 TRP 27 HE3 TRP 27 3.522 13.464 -1.060 182 HZ2 TRP 27 HZ2 TRP 27 0.726 17.046 -3.114 183 HZ3 TRP 27 HZ3 TRP 27 2.904 13.390 -3.434 184 HH2 TRP 27 HH2 TRP 27 1.535 15.143 -4.444 185 H PHE 28 H PHE 28 3.089 11.903 2.424 186 HA PHE 28 HA PHE 28 1.068 11.104 0.674 187 1HB PHE 28 1HB PHE 28 3.170 9.880 1.045 188 2HB PHE 28 2HB PHE 28 2.637 9.449 2.663 189 HD1 PHE 28 HD1 PHE 28 1.306 9.219 -0.828 190 HD2 PHE 28 HD2 PHE 28 1.918 7.299 2.922 191 HE1 PHE 28 HE1 PHE 28 0.321 7.154 -1.728 192 HE2 PHE 28 HE2 PHE 28 0.933 5.230 2.024 193 HZ PHE 28 HZ PHE 28 0.135 5.155 -0.306 194 H TYR 29 H TYR 29 1.297 10.605 4.203 195 HA TYR 29 HA TYR 29 -1.218 9.337 4.473 196 1HB TYR 29 1HB TYR 29 0.686 10.636 6.397 197 2HB TYR 29 2HB TYR 29 -0.903 10.121 6.945 198 HD1 TYR 29 HD1 TYR 29 -0.520 8.310 8.325 199 HD2 TYR 29 HD2 TYR 29 1.442 8.458 4.553 200 HE1 TYR 29 HE1 TYR 29 0.321 6.028 8.678 201 HE2 TYR 29 HE2 TYR 29 2.292 6.179 4.901 202 HH TYR 29 HH TYR 29 1.174 4.177 7.483 203 H SER 30 H SER 30 -0.325 12.663 4.225 204 HA SER 30 HA SER 30 -2.707 13.654 5.490 205 1HB SER 30 1HB SER 30 -0.605 15.078 3.846 206 2HB SER 30 2HB SER 30 -1.912 15.874 4.724 207 HG SER 30 HG SER 30 0.358 14.534 5.711 208 H GLU 31 H GLU 31 -1.517 13.468 2.131 209 HA GLU 31 HA GLU 31 -3.880 14.562 1.013 210 1HB GLU 31 1HB GLU 31 -1.589 12.996 -0.127 211 2HB GLU 31 2HB GLU 31 -2.986 13.404 -1.117 212 1HG GLU 31 1HG GLU 31 -1.194 15.353 0.317 213 2HG GLU 31 2HG GLU 31 -1.211 15.026 -1.416 214 H LEU 32 H LEU 32 -2.899 11.249 1.757 215 HA LEU 32 HA LEU 32 -5.087 9.962 0.545 216 1HB LEU 32 1HB LEU 32 -3.471 9.220 2.977 217 2HB LEU 32 2HB LEU 32 -4.718 8.187 2.305 218 HG LEU 32 HG LEU 32 -2.162 9.030 0.937 219 1HD1 LEU 32 1HD1 LEU 32 -3.127 6.355 1.938 220 2HD1 LEU 32 2HD1 LEU 32 -1.865 7.344 2.674 221 3HD1 LEU 32 3HD1 LEU 32 -1.621 6.653 1.069 222 1HD2 LEU 32 1HD2 LEU 32 -2.870 7.553 -0.880 223 2HD2 LEU 32 2HD2 LEU 32 -4.004 8.886 -0.662 224 3HD2 LEU 32 3HD2 LEU 32 -4.407 7.278 -0.061 225 H LYS 33 H LYS 33 -4.659 11.255 3.809 226 HA LYS 33 HA LYS 33 -7.262 10.566 4.726 227 1HB LYS 33 1HB LYS 33 -5.238 11.033 6.145 228 2HB LYS 33 2HB LYS 33 -5.418 12.731 5.746 229 1HG LYS 33 1HG LYS 33 -7.682 12.665 6.776 230 2HG LYS 33 2HG LYS 33 -7.328 11.022 7.308 231 1HD LYS 33 1HD LYS 33 -5.719 13.471 8.035 232 2HD LYS 33 2HD LYS 33 -6.923 12.709 9.069 233 1HE LYS 33 1HE LYS 33 -4.913 11.849 9.868 234 2HE LYS 33 2HE LYS 33 -5.503 10.580 8.797 235 1HZ LYS 33 1HZ LYS 33 -3.438 12.615 8.112 236 2HZ LYS 33 2HZ LYS 33 -4.009 11.410 7.068 237 3HZ LYS 33 3HZ LYS 33 -3.152 10.985 8.459 238 H ARG 34 H ARG 34 -6.171 12.934 2.590 239 HA ARG 34 HA ARG 34 -8.230 14.886 3.227 240 1HB ARG 34 1HB ARG 34 -5.913 15.559 2.576 241 2HB ARG 34 2HB ARG 34 -6.213 14.894 0.979 242 1HG ARG 34 1HG ARG 34 -6.550 17.205 0.785 243 2HG ARG 34 2HG ARG 34 -8.165 16.491 0.827 244 1HD ARG 34 1HD ARG 34 -8.683 17.735 2.594 245 2HD ARG 34 2HD ARG 34 -7.348 17.020 3.500 246 HE ARG 34 HE ARG 34 -7.231 19.491 1.910 247 1HH1 ARG 34 1HH1 ARG 34 -5.877 17.356 4.348 248 2HH1 ARG 34 2HH1 ARG 34 -4.654 18.495 4.824 249 1HH2 ARG 34 1HH2 ARG 34 -5.625 20.976 2.543 250 2HH2 ARG 34 2HH2 ARG 34 -4.503 20.548 3.810 251 H HIS 35 H HIS 35 -7.367 12.660 0.604 252 HA HIS 35 HA HIS 35 -9.803 13.479 -0.823 253 1HB HIS 35 1HB HIS 35 -7.363 12.070 -1.923 254 2HB HIS 35 2HB HIS 35 -8.748 12.625 -2.853 255 HD1 HIS 35 HD1 HIS 35 -8.925 15.170 -3.333 256 HD2 HIS 35 HD2 HIS 35 -5.514 14.036 -1.231 257 HE1 HIS 35 HE1 HIS 35 -7.371 17.154 -3.423 258 HE2 HIS 35 HE2 HIS 35 -5.258 16.393 -2.261 259 H ASN 36 H ASN 36 -7.863 10.677 0.101 260 HA ASN 36 HA ASN 36 -9.922 8.804 -0.672 261 1HB ASN 36 1HB ASN 36 -7.563 8.132 -0.842 262 2HB ASN 36 2HB ASN 36 -7.350 8.399 0.887 263 1HD2 ASN 36 1HD2 ASN 36 -6.848 6.370 1.486 264 2HD2 ASN 36 2HD2 ASN 36 -7.912 5.023 1.345 265 H VAL 37 H VAL 37 -11.594 9.769 0.615 266 HA VAL 37 HA VAL 37 -11.412 9.819 3.464 267 HB VAL 37 HB VAL 37 -13.892 9.929 1.741 268 1HG1 VAL 37 1HG1 VAL 37 -14.384 9.493 4.088 269 2HG1 VAL 37 2HG1 VAL 37 -14.887 11.122 3.635 270 3HG1 VAL 37 3HG1 VAL 37 -13.406 10.883 4.561 271 1HG2 VAL 37 1HG2 VAL 37 -12.318 11.634 1.050 272 2HG2 VAL 37 2HG2 VAL 37 -12.110 12.155 2.722 273 3HG2 VAL 37 3HG2 VAL 37 -13.664 12.376 1.916 274 H SER 38 H SER 38 -12.046 7.344 1.202 275 HA SER 38 HA SER 38 -13.360 5.728 3.265 276 1HB SER 38 1HB SER 38 -13.358 5.332 0.266 277 2HB SER 38 2HB SER 38 -14.205 4.319 1.438 278 HG SER 38 HG SER 38 -15.387 6.208 2.061 279 H HIS 39 H HIS 39 -11.585 4.578 0.392 280 HA HIS 39 HA HIS 39 -9.333 3.611 1.812 281 1HB HIS 39 1HB HIS 39 -9.830 1.233 1.917 282 2HB HIS 39 2HB HIS 39 -11.045 2.120 2.825 283 HD1 HIS 39 HD1 HIS 39 -13.480 1.990 1.992 284 HD2 HIS 39 HD2 HIS 39 -10.756 -0.017 -0.430 285 HE1 HIS 39 HE1 HIS 39 -14.860 0.585 0.435 286 HE2 HIS 39 HE2 HIS 39 -13.181 -0.819 -0.818 287 H TYR 40 H TYR 40 -7.838 2.507 0.439 288 HA TYR 40 HA TYR 40 -8.692 2.333 -2.368 289 1HB TYR 40 1HB TYR 40 -6.610 3.213 -3.152 290 2HB TYR 40 2HB TYR 40 -7.234 4.331 -1.952 291 HD1 TYR 40 HD1 TYR 40 -4.631 1.846 -2.683 292 HD2 TYR 40 HD2 TYR 40 -6.061 4.705 0.125 293 HE1 TYR 40 HE1 TYR 40 -2.475 1.758 -1.507 294 HE2 TYR 40 HE2 TYR 40 -3.913 4.620 1.312 295 HH TYR 40 HH TYR 40 -2.023 3.182 1.594 296 H ILE 41 H ILE 41 -7.831 0.687 -3.599 297 HA ILE 41 HA ILE 41 -6.503 -1.454 -2.065 298 HB ILE 41 HB ILE 41 -8.192 -1.710 -4.569 299 1HG1 ILE 41 1HG1 ILE 41 -9.596 -3.131 -2.877 300 2HG1 ILE 41 2HG1 ILE 41 -8.777 -2.165 -1.659 301 1HG2 ILE 41 1HG2 ILE 41 -7.984 -4.120 -4.239 302 2HG2 ILE 41 2HG2 ILE 41 -6.924 -3.843 -2.857 303 3HG2 ILE 41 3HG2 ILE 41 -6.408 -3.365 -4.475 304 1HD1 ILE 41 1HD1 ILE 41 -9.667 -0.132 -2.659 305 2HD1 ILE 41 2HD1 ILE 41 -10.961 -1.250 -2.222 306 3HD1 ILE 41 3HD1 ILE 41 -10.463 -1.089 -3.906 307 H TYR 42 H TYR 42 -4.435 -1.670 -2.507 308 HA TYR 42 HA TYR 42 -3.399 -0.838 -5.130 309 1HB TYR 42 1HB TYR 42 -2.468 0.144 -2.992 310 2HB TYR 42 2HB TYR 42 -1.866 -1.456 -2.592 311 HD1 TYR 42 HD1 TYR 42 -1.187 1.610 -4.233 312 HD2 TYR 42 HD2 TYR 42 -0.203 -2.528 -4.272 313 HE1 TYR 42 HE1 TYR 42 0.888 2.122 -5.439 314 HE2 TYR 42 HE2 TYR 42 1.875 -2.026 -5.487 315 HH TYR 42 HH TYR 42 2.764 -0.230 -6.957 316 H TYR 43 H TYR 43 -3.272 -2.501 -6.536 317 HA TYR 43 HA TYR 43 -2.845 -5.213 -5.598 318 1HB TYR 43 1HB TYR 43 -3.073 -4.085 -8.396 319 2HB TYR 43 2HB TYR 43 -2.937 -5.796 -8.019 320 HD1 TYR 43 HD1 TYR 43 -4.793 -6.896 -6.705 321 HD2 TYR 43 HD2 TYR 43 -5.156 -2.986 -8.347 322 HE1 TYR 43 HE1 TYR 43 -7.240 -7.049 -6.521 323 HE2 TYR 43 HE2 TYR 43 -7.603 -3.127 -8.159 324 HH TYR 43 HH TYR 43 -9.175 -5.543 -6.369 325 H LEU 44 H LEU 44 -0.847 -5.900 -5.109 326 HA LEU 44 HA LEU 44 1.495 -4.569 -6.027 327 1HB LEU 44 1HB LEU 44 1.057 -7.158 -4.562 328 2HB LEU 44 2HB LEU 44 2.650 -6.685 -5.112 329 HG LEU 44 HG LEU 44 2.215 -4.496 -3.782 330 1HD1 LEU 44 1HD1 LEU 44 0.223 -6.351 -2.483 331 2HD1 LEU 44 2HD1 LEU 44 -0.132 -4.831 -3.306 332 3HD1 LEU 44 3HD1 LEU 44 0.791 -4.827 -1.801 333 1HD2 LEU 44 1HD2 LEU 44 3.907 -6.148 -3.205 334 2HD2 LEU 44 2HD2 LEU 44 2.693 -7.116 -2.370 335 3HD2 LEU 44 3HD2 LEU 44 3.121 -5.519 -1.757 336 H ALA 45 H ALA 45 3.200 -5.514 -7.314 337 HA ALA 45 HA ALA 45 4.070 -6.468 -9.178 338 1HB ALA 45 1HB ALA 45 3.152 -8.509 -10.120 339 2HB ALA 45 2HB ALA 45 1.694 -8.324 -9.142 340 3HB ALA 45 3HB ALA 45 3.250 -8.623 -8.364 341 H THR 46 H THR 46 0.529 -6.248 -9.495 342 HA THR 46 HA THR 46 0.694 -5.414 -12.236 343 HB THR 46 HB THR 46 -1.693 -5.146 -10.402 344 HG1 THR 46 HG1 THR 46 -0.423 -7.391 -11.403 345 1HG2 THR 46 1HG2 THR 46 -2.973 -5.441 -12.472 346 2HG2 THR 46 2HG2 THR 46 -1.473 -5.574 -13.387 347 3HG2 THR 46 3HG2 THR 46 -1.891 -4.053 -12.597 348 H GLU 47 H GLU 47 0.797 -3.884 -9.159 349 HA GLU 47 HA GLU 47 0.958 -1.737 -8.455 350 1HB GLU 47 1HB GLU 47 1.933 -1.366 -11.288 351 2HB GLU 47 2HB GLU 47 2.038 -0.131 -10.041 352 1HG GLU 47 1HG GLU 47 3.409 -1.691 -8.684 353 2HG GLU 47 2HG GLU 47 3.381 -2.822 -10.036 354 H ASN 48 H ASN 48 -1.540 -2.654 -9.518 355 HA ASN 48 HA ASN 48 -2.732 -0.315 -10.787 356 1HB ASN 48 1HB ASN 48 -3.232 -2.640 -11.598 357 2HB ASN 48 2HB ASN 48 -3.994 -2.970 -10.048 358 1HD2 ASN 48 1HD2 ASN 48 -5.063 -2.972 -12.782 359 2HD2 ASN 48 2HD2 ASN 48 -6.420 -1.899 -12.749 360 H VAL 49 H VAL 49 -3.587 1.230 -9.534 361 HA VAL 49 HA VAL 49 -4.223 0.530 -6.741 362 HB VAL 49 HB VAL 49 -3.629 3.312 -7.718 363 1HG1 VAL 49 1HG1 VAL 49 -3.073 3.711 -5.380 364 2HG1 VAL 49 2HG1 VAL 49 -3.413 2.022 -5.004 365 3HG1 VAL 49 3HG1 VAL 49 -4.715 3.084 -5.542 366 1HG2 VAL 49 1HG2 VAL 49 -1.711 1.949 -8.328 367 2HG2 VAL 49 2HG2 VAL 49 -1.633 1.299 -6.692 368 3HG2 VAL 49 3HG2 VAL 49 -1.311 3.009 -6.975 369 H HIS 50 H HIS 50 -6.287 0.643 -6.160 370 HA HIS 50 HA HIS 50 -8.104 2.310 -7.776 371 1HB HIS 50 1HB HIS 50 -8.550 -0.273 -6.305 372 2HB HIS 50 2HB HIS 50 -9.899 0.787 -6.697 373 HD1 HIS 50 HD1 HIS 50 -10.725 -1.303 -8.157 374 HD2 HIS 50 HD2 HIS 50 -7.287 0.629 -9.491 375 HE1 HIS 50 HE1 HIS 50 -10.411 -2.030 -10.550 376 HE2 HIS 50 HE2 HIS 50 -8.217 -1.024 -11.253 377 H ILE 51 H ILE 51 -8.020 4.231 -6.671 378 HA ILE 51 HA ILE 51 -8.454 4.254 -3.796 379 HB ILE 51 HB ILE 51 -8.309 6.589 -5.718 380 1HG1 ILE 51 1HG1 ILE 51 -6.074 6.929 -4.431 381 2HG1 ILE 51 2HG1 ILE 51 -6.229 5.223 -4.025 382 1HG2 ILE 51 1HG2 ILE 51 -8.278 6.519 -2.705 383 2HG2 ILE 51 2HG2 ILE 51 -9.569 7.144 -3.729 384 3HG2 ILE 51 3HG2 ILE 51 -8.004 7.952 -3.697 385 1HD1 ILE 51 1HD1 ILE 51 -6.257 4.664 -6.400 386 2HD1 ILE 51 2HD1 ILE 51 -4.796 5.546 -5.951 387 3HD1 ILE 51 3HD1 ILE 51 -6.098 6.375 -6.802 388 H VAL 52 H VAL 52 -10.452 3.638 -3.270 389 HA VAL 52 HA VAL 52 -12.727 4.488 -4.850 390 HB VAL 52 HB VAL 52 -12.719 2.899 -2.277 391 1HG1 VAL 52 1HG1 VAL 52 -14.945 2.151 -3.056 392 2HG1 VAL 52 2HG1 VAL 52 -14.826 3.295 -4.395 393 3HG1 VAL 52 3HG1 VAL 52 -14.868 3.882 -2.733 394 1HG2 VAL 52 1HG2 VAL 52 -12.966 0.907 -3.699 395 2HG2 VAL 52 2HG2 VAL 52 -11.422 1.721 -3.956 396 3HG2 VAL 52 3HG2 VAL 52 -12.726 1.913 -5.128 397 H LEU 53 H LEU 53 -13.476 6.457 -4.554 398 HA LEU 53 HA LEU 53 -13.042 7.985 -2.180 399 1HB LEU 53 1HB LEU 53 -15.055 8.502 -4.360 400 2HB LEU 53 2HB LEU 53 -14.387 9.670 -3.237 401 HG LEU 53 HG LEU 53 -12.844 8.265 -5.414 402 1HD1 LEU 53 1HD1 LEU 53 -14.533 9.851 -6.215 403 2HD1 LEU 53 2HD1 LEU 53 -12.886 10.396 -6.542 404 3HD1 LEU 53 3HD1 LEU 53 -13.804 11.108 -5.215 405 1HD2 LEU 53 1HD2 LEU 53 -11.068 9.865 -4.865 406 2HD2 LEU 53 2HD2 LEU 53 -11.438 8.817 -3.495 407 3HD2 LEU 53 3HD2 LEU 53 -12.035 10.478 -3.524 408 H LYS 54 H LYS 54 -15.330 9.224 -1.534 409 HA LYS 54 HA LYS 54 -16.727 7.189 -0.092 410 1HB LYS 54 1HB LYS 54 -16.231 9.450 0.852 411 2HB LYS 54 2HB LYS 54 -17.417 10.121 -0.260 412 1HG LYS 54 1HG LYS 54 -19.132 8.648 0.766 413 2HG LYS 54 2HG LYS 54 -17.927 8.150 1.954 414 1HD LYS 54 1HD LYS 54 -17.719 10.421 2.752 415 2HD LYS 54 2HD LYS 54 -18.817 10.994 1.492 416 1HE LYS 54 1HE LYS 54 -19.495 9.115 3.751 417 2HE LYS 54 2HE LYS 54 -19.982 10.804 3.611 418 1HZ LYS 54 1HZ LYS 54 -21.792 9.424 2.940 419 2HZ LYS 54 2HZ LYS 54 -20.820 8.553 1.861 420 3HZ LYS 54 3HZ LYS 54 -21.182 10.180 1.549 421 H ASN 55 H ASN 55 -17.170 6.347 -2.451 422 HA ASN 55 HA ASN 55 -18.990 5.179 -3.226 423 1HB ASN 55 1HB ASN 55 -20.201 5.868 -1.138 424 2HB ASN 55 2HB ASN 55 -20.765 7.296 -1.995 425 1HD2 ASN 55 1HD2 ASN 55 -22.905 6.807 -1.911 426 2HD2 ASN 55 2HD2 ASN 55 -23.614 5.474 -2.758 427 H ASP 56 H ASP 56 -17.750 7.915 -4.225 428 HA ASP 56 HA ASP 56 -19.802 8.555 -6.182 429 1HB ASP 56 1HB ASP 56 -18.456 10.346 -4.976 430 2HB ASP 56 2HB ASP 56 -17.096 9.863 -5.989 431 H ASN 57 H ASN 57 -16.267 8.198 -6.530 432 HA ASN 57 HA ASN 57 -16.693 6.157 -8.559 433 1HB ASN 57 1HB ASN 57 -15.517 7.259 -10.308 434 2HB ASN 57 2HB ASN 57 -16.683 8.427 -9.711 435 1HD2 ASN 57 1HD2 ASN 57 -13.336 7.637 -10.052 436 2HD2 ASN 57 2HD2 ASN 57 -12.711 9.145 -9.485 437 H THR 58 H THR 58 -14.422 5.453 -9.415 438 HA THR 58 HA THR 58 -12.614 5.315 -7.088 439 HB THR 58 HB THR 58 -12.940 3.279 -9.307 440 HG1 THR 58 HG1 THR 58 -14.608 3.688 -7.399 441 1HG2 THR 58 1HG2 THR 58 -11.404 3.174 -6.709 442 2HG2 THR 58 2HG2 THR 58 -10.710 3.257 -8.328 443 3HG2 THR 58 3HG2 THR 58 -11.614 1.827 -7.826 444 H VAL 59 H VAL 59 -10.614 6.120 -7.358 445 HA VAL 59 HA VAL 59 -9.782 7.018 -10.001 446 HB VAL 59 HB VAL 59 -8.335 7.287 -7.355 447 1HG1 VAL 59 1HG1 VAL 59 -7.875 8.660 -10.001 448 2HG1 VAL 59 2HG1 VAL 59 -6.830 7.448 -9.259 449 3HG1 VAL 59 3HG1 VAL 59 -7.033 9.024 -8.496 450 1HG2 VAL 59 1HG2 VAL 59 -10.443 8.465 -7.257 451 2HG2 VAL 59 2HG2 VAL 59 -10.119 9.236 -8.810 452 3HG2 VAL 59 3HG2 VAL 59 -9.128 9.632 -7.408 453 H LEU 60 H LEU 60 -8.525 5.845 -11.288 454 HA LEU 60 HA LEU 60 -7.328 3.394 -10.195 455 1HB LEU 60 1HB LEU 60 -9.118 3.538 -12.132 456 2HB LEU 60 2HB LEU 60 -7.720 3.914 -13.117 457 HG LEU 60 HG LEU 60 -7.945 1.397 -11.458 458 1HD1 LEU 60 1HD1 LEU 60 -8.488 0.271 -13.577 459 2HD1 LEU 60 2HD1 LEU 60 -8.599 1.843 -14.367 460 3HD1 LEU 60 3HD1 LEU 60 -9.734 1.419 -13.087 461 1HD2 LEU 60 1HD2 LEU 60 -5.661 2.044 -12.061 462 2HD2 LEU 60 2HD2 LEU 60 -6.135 2.147 -13.756 463 3HD2 LEU 60 3HD2 LEU 60 -6.166 0.592 -12.925 464 H LEU 61 H LEU 61 -5.205 3.510 -9.848 465 HA LEU 61 HA LEU 61 -3.581 5.291 -11.547 466 1HB LEU 61 1HB LEU 61 -2.738 3.981 -8.966 467 2HB LEU 61 2HB LEU 61 -1.900 5.244 -9.842 468 HG LEU 61 HG LEU 61 -4.511 5.547 -8.370 469 1HD1 LEU 61 1HD1 LEU 61 -2.510 5.334 -6.957 470 2HD1 LEU 61 2HD1 LEU 61 -3.244 6.934 -6.860 471 3HD1 LEU 61 3HD1 LEU 61 -1.782 6.689 -7.817 472 1HD2 LEU 61 1HD2 LEU 61 -4.434 6.935 -10.390 473 2HD2 LEU 61 2HD2 LEU 61 -2.886 7.600 -9.866 474 3HD2 LEU 61 3HD2 LEU 61 -4.343 7.907 -8.922 475 H LYS 62 H LYS 62 -1.403 4.531 -12.043 476 HA LYS 62 HA LYS 62 -1.042 1.639 -12.081 477 1HB LYS 62 1HB LYS 62 -2.085 2.212 -14.244 478 2HB LYS 62 2HB LYS 62 -0.818 3.392 -14.540 479 1HG LYS 62 1HG LYS 62 0.829 1.493 -14.414 480 2HG LYS 62 2HG LYS 62 -0.559 0.401 -14.420 481 1HD LYS 62 1HD LYS 62 0.315 0.667 -16.673 482 2HD LYS 62 2HD LYS 62 -1.299 1.377 -16.553 483 1HE LYS 62 1HE LYS 62 -0.303 3.601 -16.307 484 2HE LYS 62 2HE LYS 62 1.308 2.893 -16.411 485 1HZ LYS 62 1HZ LYS 62 0.679 3.800 -18.525 486 2HZ LYS 62 2HZ LYS 62 -0.755 2.895 -18.546 487 3HZ LYS 62 3HZ LYS 62 0.743 2.110 -18.650 488 H GLY 63 H GLY 63 0.907 1.280 -11.230 489 1HA GLY 63 1HA GLY 63 3.009 3.214 -11.160 490 2HA GLY 63 2HA GLY 63 3.161 1.502 -10.781 491 H LEU 64 H LEU 64 4.256 0.247 -12.166 492 HA LEU 64 HA LEU 64 4.510 1.181 -14.954 493 1HB LEU 64 1HB LEU 64 6.648 1.164 -13.679 494 2HB LEU 64 2HB LEU 64 6.438 -0.553 -13.397 495 HG LEU 64 HG LEU 64 6.574 -0.944 -15.840 496 1HD1 LEU 64 1HD1 LEU 64 7.213 2.001 -15.951 497 2HD1 LEU 64 2HD1 LEU 64 5.782 1.217 -16.619 498 3HD1 LEU 64 3HD1 LEU 64 7.375 0.863 -17.290 499 1HD2 LEU 64 1HD2 LEU 64 8.978 -0.518 -16.041 500 2HD2 LEU 64 2HD2 LEU 64 8.558 -1.169 -14.456 501 3HD2 LEU 64 3HD2 LEU 64 8.900 0.552 -14.641 502 H LYS 65 H LYS 65 3.251 -1.077 -12.875 503 HA LYS 65 HA LYS 65 2.321 -3.119 -12.966 504 1HB LYS 65 1HB LYS 65 0.801 -3.559 -14.759 505 2HB LYS 65 2HB LYS 65 0.766 -1.841 -14.413 506 1HG LYS 65 1HG LYS 65 1.896 -1.308 -16.398 507 2HG LYS 65 2HG LYS 65 2.403 -2.979 -16.652 508 1HD LYS 65 1HD LYS 65 -0.436 -1.963 -16.755 509 2HD LYS 65 2HD LYS 65 0.568 -2.355 -18.152 510 1HE LYS 65 1HE LYS 65 0.737 -4.679 -17.344 511 2HE LYS 65 2HE LYS 65 -0.328 -4.273 -16.000 512 1HZ LYS 65 1HZ LYS 65 -1.038 -4.128 -18.882 513 2HZ LYS 65 2HZ LYS 65 -2.070 -3.738 -17.594 514 3HZ LYS 65 3HZ LYS 65 -1.533 -5.334 -17.794 515 H ASN 66 H ASN 66 5.121 -3.009 -13.597 516 HA ASN 66 HA ASN 66 5.311 -5.498 -15.162 517 1HB ASN 66 1HB ASN 66 6.138 -3.260 -16.242 518 2HB ASN 66 2HB ASN 66 7.523 -3.469 -15.181 519 1HD2 ASN 66 1HD2 ASN 66 7.584 -6.357 -15.353 520 2HD2 ASN 66 2HD2 ASN 66 8.144 -6.738 -16.951 521 H ILE 67 H ILE 67 5.970 -3.854 -12.275 522 HA ILE 67 HA ILE 67 8.311 -5.382 -11.561 523 HB ILE 67 HB ILE 67 6.591 -3.631 -9.792 524 1HG1 ILE 67 1HG1 ILE 67 9.157 -2.996 -11.271 525 2HG1 ILE 67 2HG1 ILE 67 7.558 -2.399 -11.699 526 1HG2 ILE 67 1HG2 ILE 67 9.394 -4.685 -9.406 527 2HG2 ILE 67 2HG2 ILE 67 7.954 -5.233 -8.546 528 3HG2 ILE 67 3HG2 ILE 67 8.546 -3.586 -8.319 529 1HD1 ILE 67 1HD1 ILE 67 9.015 -1.806 -9.135 530 2HD1 ILE 67 2HD1 ILE 67 7.433 -1.183 -9.603 531 3HD1 ILE 67 3HD1 ILE 67 8.869 -0.721 -10.519 532 H VAL 68 H VAL 68 7.327 -7.462 -11.958 533 HA VAL 68 HA VAL 68 5.355 -8.356 -10.018 534 HB VAL 68 HB VAL 68 6.738 -9.974 -12.166 535 1HG1 VAL 68 1HG1 VAL 68 4.834 -11.507 -11.878 536 2HG1 VAL 68 2HG1 VAL 68 4.251 -10.509 -10.545 537 3HG1 VAL 68 3HG1 VAL 68 5.794 -11.352 -10.408 538 1HG2 VAL 68 1HG2 VAL 68 5.499 -8.128 -13.162 539 2HG2 VAL 68 2HG2 VAL 68 4.065 -8.575 -12.238 540 3HG2 VAL 68 3HG2 VAL 68 4.691 -9.662 -13.478 541 H SER 69 H SER 69 6.571 -8.151 -8.117 542 HA SER 69 HA SER 69 8.780 -10.073 -7.837 543 1HB SER 69 1HB SER 69 8.093 -7.699 -6.083 544 2HB SER 69 2HB SER 69 9.499 -8.747 -5.907 545 HG SER 69 HG SER 69 9.506 -7.898 -8.404 546 H VAL 70 H VAL 70 5.626 -10.103 -7.493 547 HA VAL 70 HA VAL 70 5.262 -10.931 -4.784 548 HB VAL 70 HB VAL 70 3.451 -11.308 -7.180 549 1HG1 VAL 70 1HG1 VAL 70 2.883 -11.640 -4.235 550 2HG1 VAL 70 2HG1 VAL 70 2.924 -12.922 -5.444 551 3HG1 VAL 70 3HG1 VAL 70 1.675 -11.681 -5.521 552 1HG2 VAL 70 1HG2 VAL 70 2.223 -9.401 -6.287 553 2HG2 VAL 70 2HG2 VAL 70 3.894 -8.958 -6.636 554 3HG2 VAL 70 3HG2 VAL 70 3.389 -9.252 -4.971 555 H LYS 71 H LYS 71 5.499 -12.867 -3.919 556 HA LYS 71 HA LYS 71 6.272 -15.077 -5.711 557 1HB LYS 71 1HB LYS 71 8.026 -14.002 -4.192 558 2HB LYS 71 2HB LYS 71 7.139 -14.698 -2.846 559 1HG LYS 71 1HG LYS 71 9.060 -16.055 -3.467 560 2HG LYS 71 2HG LYS 71 7.547 -16.929 -3.707 561 1HD LYS 71 1HD LYS 71 7.656 -16.698 -6.040 562 2HD LYS 71 2HD LYS 71 8.879 -15.431 -5.942 563 1HE LYS 71 1HE LYS 71 9.694 -17.701 -6.670 564 2HE LYS 71 2HE LYS 71 10.562 -16.965 -5.326 565 1HZ LYS 71 1HZ LYS 71 9.445 -18.373 -3.795 566 2HZ LYS 71 2HZ LYS 71 10.049 -19.357 -5.035 567 3HZ LYS 71 3HZ LYS 71 8.397 -18.971 -4.986 568 H PHE 72 H PHE 72 5.488 -17.142 -5.278 569 HA PHE 72 HA PHE 72 2.951 -17.261 -3.995 570 1HB PHE 72 1HB PHE 72 3.492 -18.679 -5.922 571 2HB PHE 72 2HB PHE 72 4.736 -19.497 -4.988 572 HD1 PHE 72 HD1 PHE 72 4.220 -21.437 -3.842 573 HD2 PHE 72 HD2 PHE 72 1.074 -18.813 -4.995 574 HE1 PHE 72 HE1 PHE 72 2.566 -23.092 -3.084 575 HE2 PHE 72 HE2 PHE 72 -0.584 -20.463 -4.235 576 HZ PHE 72 HZ PHE 72 0.162 -22.605 -3.278 577 H SER 73 H SER 73 3.296 -16.604 -1.896 578 HA SER 73 HA SER 73 3.989 -18.775 -0.107 579 1HB SER 73 1HB SER 73 6.129 -17.531 -0.420 580 2HB SER 73 2HB SER 73 5.330 -16.066 0.148 581 HG SER 73 HG SER 73 5.668 -16.716 2.105 582 H LYS 74 H LYS 74 3.262 -18.301 2.118 583 HA LYS 74 HA LYS 74 1.412 -16.027 2.335 584 1HB LYS 74 1HB LYS 74 0.779 -18.839 3.271 585 2HB LYS 74 2HB LYS 74 -0.243 -17.424 3.480 586 1HG LYS 74 1HG LYS 74 -0.569 -17.264 1.090 587 2HG LYS 74 2HG LYS 74 0.535 -18.612 0.829 588 1HD LYS 74 1HD LYS 74 -1.011 -20.023 2.210 589 2HD LYS 74 2HD LYS 74 -2.153 -18.674 2.187 590 1HE LYS 74 1HE LYS 74 -2.113 -18.746 -0.288 591 2HE LYS 74 2HE LYS 74 -1.068 -20.163 -0.200 592 1HZ LYS 74 1HZ LYS 74 -3.877 -19.927 0.704 593 2HZ LYS 74 2HZ LYS 74 -2.885 -21.245 1.105 594 3HZ LYS 74 3HZ LYS 74 -3.262 -20.925 -0.518 595 H ASP 75 H ASP 75 3.516 -15.336 3.394 596 HA ASP 75 HA ASP 75 3.872 -16.601 6.024 597 1HB ASP 75 1HB ASP 75 5.853 -16.525 4.481 598 2HB ASP 75 2HB ASP 75 5.823 -14.769 4.615 599 H ARG 76 H ARG 76 2.577 -15.623 7.397 600 HA ARG 76 HA ARG 76 2.044 -12.816 7.444 601 1HB ARG 76 1HB ARG 76 0.461 -14.530 8.267 602 2HB ARG 76 2HB ARG 76 1.591 -14.946 9.544 603 1HG ARG 76 1HG ARG 76 1.335 -12.701 10.490 604 2HG ARG 76 2HG ARG 76 0.168 -12.313 9.219 605 1HD ARG 76 1HD ARG 76 -1.294 -14.089 9.987 606 2HD ARG 76 2HD ARG 76 -0.113 -14.566 11.203 607 HE ARG 76 HE ARG 76 -1.293 -11.883 11.282 608 1HH1 ARG 76 1HH1 ARG 76 -0.773 -15.029 12.707 609 2HH1 ARG 76 2HH1 ARG 76 -1.488 -14.610 14.238 610 1HH2 ARG 76 1HH2 ARG 76 -2.225 -11.305 13.312 611 2HH2 ARG 76 2HH2 ARG 76 -2.279 -12.476 14.591 612 H HIS 77 H HIS 77 4.482 -14.876 8.696 613 HA HIS 77 HA HIS 77 5.262 -13.232 10.918 614 1HB HIS 77 1HB HIS 77 5.631 -15.724 10.754 615 2HB HIS 77 2HB HIS 77 6.859 -15.402 9.537 616 HD1 HIS 77 HD1 HIS 77 6.631 -16.206 12.938 617 HD2 HIS 77 HD2 HIS 77 8.881 -13.429 10.803 618 HE1 HIS 77 HE1 HIS 77 8.601 -15.651 14.407 619 HE2 HIS 77 HE2 HIS 77 9.898 -13.897 13.133 620 H LEU 78 H LEU 78 6.384 -13.772 7.605 621 HA LEU 78 HA LEU 78 8.639 -12.102 7.710 622 1HB LEU 78 1HB LEU 78 8.234 -13.689 5.884 623 2HB LEU 78 2HB LEU 78 6.869 -12.729 5.346 624 HG LEU 78 HG LEU 78 8.348 -10.888 4.752 625 1HD1 LEU 78 1HD1 LEU 78 10.780 -11.145 4.873 626 2HD1 LEU 78 2HD1 LEU 78 10.571 -12.676 5.723 627 3HD1 LEU 78 3HD1 LEU 78 10.039 -11.171 6.473 628 1HD2 LEU 78 1HD2 LEU 78 9.571 -11.957 2.920 629 2HD2 LEU 78 2HD2 LEU 78 7.933 -12.596 3.068 630 3HD2 LEU 78 3HD2 LEU 78 9.303 -13.534 3.664 631 H ILE 79 H ILE 79 5.243 -11.411 7.016 632 HA ILE 79 HA ILE 79 5.488 -8.721 6.293 633 HB ILE 79 HB ILE 79 3.252 -9.953 7.918 634 1HG1 ILE 79 1HG1 ILE 79 3.483 -9.643 4.915 635 2HG1 ILE 79 2HG1 ILE 79 3.710 -11.156 5.785 636 1HG2 ILE 79 1HG2 ILE 79 1.884 -8.146 6.968 637 2HG2 ILE 79 2HG2 ILE 79 3.326 -7.476 6.201 638 3HG2 ILE 79 3HG2 ILE 79 3.208 -7.530 7.961 639 1HD1 ILE 79 1HD1 ILE 79 1.392 -11.037 6.566 640 2HD1 ILE 79 2HD1 ILE 79 1.504 -11.056 4.806 641 3HD1 ILE 79 3HD1 ILE 79 1.173 -9.544 5.653 642 H GLU 80 H GLU 80 5.044 -10.206 9.482 643 HA GLU 80 HA GLU 80 5.083 -7.914 11.064 644 1HB GLU 80 1HB GLU 80 4.646 -10.421 11.644 645 2HB GLU 80 2HB GLU 80 6.378 -10.492 11.918 646 1HG GLU 80 1HG GLU 80 4.624 -8.497 13.308 647 2HG GLU 80 2HG GLU 80 4.877 -10.125 13.931 648 H THR 81 H THR 81 7.762 -9.988 10.008 649 HA THR 81 HA THR 81 9.844 -8.548 11.221 650 HB THR 81 HB THR 81 10.032 -10.153 8.667 651 HG1 THR 81 HG1 THR 81 9.994 -11.948 9.880 652 1HG2 THR 81 1HG2 THR 81 12.059 -8.912 9.221 653 2HG2 THR 81 2HG2 THR 81 12.310 -10.640 9.465 654 3HG2 THR 81 3HG2 THR 81 12.042 -9.583 10.853 655 H THR 82 H THR 82 8.276 -8.201 8.071 656 HA THR 82 HA THR 82 10.086 -6.355 6.953 657 HB THR 82 HB THR 82 7.126 -6.652 6.386 658 HG1 THR 82 HG1 THR 82 8.320 -8.591 6.040 659 1HG2 THR 82 1HG2 THR 82 9.341 -5.435 4.733 660 2HG2 THR 82 2HG2 THR 82 8.020 -4.560 5.506 661 3HG2 THR 82 3HG2 THR 82 7.682 -5.687 4.193 662 H SER 83 H SER 83 7.074 -5.897 8.795 663 HA SER 83 HA SER 83 7.070 -3.101 8.828 664 1HB SER 83 1HB SER 83 6.123 -4.950 11.033 665 2HB SER 83 2HB SER 83 5.599 -3.288 10.751 666 HG SER 83 HG SER 83 4.572 -3.929 8.894 667 H ASN 84 H ASN 84 8.769 -5.448 10.832 668 HA ASN 84 HA ASN 84 9.767 -3.604 12.739 669 1HB ASN 84 1HB ASN 84 10.657 -6.366 11.914 670 2HB ASN 84 2HB ASN 84 11.459 -5.450 13.181 671 1HD2 ASN 84 1HD2 ASN 84 9.970 -7.976 13.258 672 2HD2 ASN 84 2HD2 ASN 84 8.700 -7.748 14.409 673 H LYS 85 H LYS 85 10.856 -4.627 9.585 674 HA LYS 85 HA LYS 85 13.530 -3.714 9.844 675 1HB LYS 85 1HB LYS 85 12.603 -5.358 8.141 676 2HB LYS 85 2HB LYS 85 11.971 -3.965 7.274 677 1HG LYS 85 1HG LYS 85 14.096 -4.750 6.349 678 2HG LYS 85 2HG LYS 85 14.210 -3.102 6.960 679 1HD LYS 85 1HD LYS 85 16.170 -4.470 7.566 680 2HD LYS 85 2HD LYS 85 15.292 -3.888 8.981 681 1HE LYS 85 1HE LYS 85 14.169 -6.070 9.157 682 2HE LYS 85 2HE LYS 85 15.088 -6.643 7.768 683 1HZ LYS 85 1HZ LYS 85 15.971 -7.258 10.031 684 2HZ LYS 85 2HZ LYS 85 16.403 -5.628 10.221 685 3HZ LYS 85 3HZ LYS 85 17.084 -6.549 8.966 686 H LEU 86 H LEU 86 10.572 -2.259 8.564 687 HA LEU 86 HA LEU 86 11.761 0.261 7.906 688 1HB LEU 86 1HB LEU 86 9.679 -0.505 6.873 689 2HB LEU 86 2HB LEU 86 8.890 -0.525 8.436 690 HG LEU 86 HG LEU 86 9.297 1.980 8.533 691 1HD1 LEU 86 1HD1 LEU 86 9.614 3.107 6.387 692 2HD1 LEU 86 2HD1 LEU 86 9.878 1.545 5.609 693 3HD1 LEU 86 3HD1 LEU 86 11.012 2.128 6.827 694 1HD2 LEU 86 1HD2 LEU 86 7.110 1.014 8.071 695 2HD2 LEU 86 2HD2 LEU 86 7.512 0.894 6.358 696 3HD2 LEU 86 3HD2 LEU 86 7.368 2.476 7.121 697 H LYS 87 H LYS 87 10.371 -1.186 10.714 698 HA LYS 87 HA LYS 87 9.896 1.169 12.234 699 1HB LYS 87 1HB LYS 87 8.810 -1.077 12.537 700 2HB LYS 87 2HB LYS 87 10.325 -1.667 13.194 701 1HG LYS 87 1HG LYS 87 10.135 0.026 15.001 702 2HG LYS 87 2HG LYS 87 8.543 0.455 14.369 703 1HD LYS 87 1HD LYS 87 9.408 -2.232 15.440 704 2HD LYS 87 2HD LYS 87 8.266 -1.110 16.184 705 1HE LYS 87 1HE LYS 87 6.683 -1.451 14.423 706 2HE LYS 87 2HE LYS 87 7.853 -2.367 13.475 707 1HZ LYS 87 1HZ LYS 87 6.295 -3.848 14.547 708 2HZ LYS 87 2HZ LYS 87 6.671 -3.202 16.072 709 3HZ LYS 87 3HZ LYS 87 7.841 -4.073 15.206 710 H SER 88 H SER 88 12.547 -1.174 12.065 711 HA SER 88 HA SER 88 13.932 0.053 14.281 712 1HB SER 88 1HB SER 88 14.853 -2.164 12.441 713 2HB SER 88 2HB SER 88 15.564 -1.721 13.993 714 HG SER 88 HG SER 88 13.140 -3.023 13.440 715 H ARG 89 H ARG 89 14.570 -0.354 10.777 716 HA ARG 89 HA ARG 89 16.910 1.375 11.140 717 1HB ARG 89 1HB ARG 89 17.212 -0.866 10.117 718 2HB ARG 89 2HB ARG 89 16.164 -0.375 8.796 719 1HG ARG 89 1HG ARG 89 18.613 -0.293 8.324 720 2HG ARG 89 2HG ARG 89 17.733 1.205 8.016 721 1HD ARG 89 1HD ARG 89 19.878 1.614 9.132 722 2HD ARG 89 2HD ARG 89 18.514 2.126 10.118 723 HE ARG 89 HE ARG 89 19.201 -0.488 10.855 724 1HH1 ARG 89 1HH1 ARG 89 20.528 2.751 10.949 725 2HH1 ARG 89 2HH1 ARG 89 21.434 2.483 12.412 726 1HH2 ARG 89 1HH2 ARG 89 20.400 -0.858 12.779 727 2HH2 ARG 89 2HH2 ARG 89 21.380 0.420 13.438 728 H GLU 90 H GLU 90 14.941 0.895 8.233 729 HA GLU 90 HA GLU 90 13.224 2.941 8.184 730 1HB GLU 90 1HB GLU 90 14.143 4.926 7.361 731 2HB GLU 90 2HB GLU 90 15.284 4.434 8.597 732 1HG GLU 90 1HG GLU 90 15.675 3.921 5.657 733 2HG GLU 90 2HG GLU 90 16.290 5.338 6.501 734 H ILE 91 H ILE 91 15.791 1.442 6.340 735 HA ILE 91 HA ILE 91 16.017 0.855 4.165 736 HB ILE 91 HB ILE 91 14.288 -0.741 3.355 737 1HG1 ILE 91 1HG1 ILE 91 12.926 -0.199 6.008 738 2HG1 ILE 91 2HG1 ILE 91 12.309 0.334 4.449 739 1HG2 ILE 91 1HG2 ILE 91 14.716 -2.400 5.119 740 2HG2 ILE 91 2HG2 ILE 91 15.287 -1.105 6.172 741 3HG2 ILE 91 3HG2 ILE 91 16.156 -1.480 4.682 742 1HD1 ILE 91 1HD1 ILE 91 12.694 -2.516 5.334 743 2HD1 ILE 91 2HD1 ILE 91 12.124 -2.007 3.744 744 3HD1 ILE 91 3HD1 ILE 91 11.160 -1.657 5.178 745 H THR 92 H THR 92 13.219 0.469 2.666 746 HA THR 92 HA THR 92 12.654 3.232 1.998 747 HB THR 92 HB THR 92 13.567 1.273 -0.134 748 HG1 THR 92 HG1 THR 92 14.855 3.407 1.213 749 1HG2 THR 92 1HG2 THR 92 12.848 4.204 -0.314 750 2HG2 THR 92 2HG2 THR 92 11.885 2.865 -0.937 751 3HG2 THR 92 3HG2 THR 92 13.467 3.210 -1.634 752 H PHE 93 H PHE 93 10.600 3.443 0.933 753 HA PHE 93 HA PHE 93 8.713 1.589 1.887 754 1HB PHE 93 1HB PHE 93 8.290 4.028 1.499 755 2HB PHE 93 2HB PHE 93 8.268 3.703 -0.230 756 HD1 PHE 93 HD1 PHE 93 6.110 3.969 -0.987 757 HD2 PHE 93 HD2 PHE 93 6.773 1.885 2.657 758 HE1 PHE 93 HE1 PHE 93 3.707 3.453 -0.849 759 HE2 PHE 93 HE2 PHE 93 4.379 1.361 2.803 760 HZ PHE 93 HZ PHE 93 2.840 2.149 1.049 761 H GLN 94 H GLN 94 10.255 2.009 -1.224 762 HA GLN 94 HA GLN 94 8.745 0.260 -2.777 763 1HB GLN 94 1HB GLN 94 10.494 1.646 -3.738 764 2HB GLN 94 2HB GLN 94 11.722 0.795 -2.816 765 1HG GLN 94 1HG GLN 94 11.213 -1.256 -4.063 766 2HG GLN 94 2HG GLN 94 10.022 -0.366 -5.011 767 1HE2 GLN 94 1HE2 GLN 94 13.410 -0.806 -4.333 768 2HE2 GLN 94 2HE2 GLN 94 13.992 -0.009 -5.762 769 H GLU 95 H GLU 95 11.614 -0.426 -0.780 770 HA GLU 95 HA GLU 95 11.568 -3.220 -1.203 771 1HB GLU 95 1HB GLU 95 12.926 -1.438 0.789 772 2HB GLU 95 2HB GLU 95 13.002 -3.185 0.968 773 1HG GLU 95 1HG GLU 95 14.952 -2.204 -0.192 774 2HG GLU 95 2HG GLU 95 14.102 -3.426 -1.135 775 H TYR 96 H TYR 96 9.972 -1.151 1.102 776 HA TYR 96 HA TYR 96 9.192 -3.059 2.996 777 1HB TYR 96 1HB TYR 96 8.911 -0.517 3.085 778 2HB TYR 96 2HB TYR 96 7.470 -0.743 2.106 779 HD1 TYR 96 HD1 TYR 96 5.434 -0.927 3.217 780 HD2 TYR 96 HD2 TYR 96 9.001 -2.053 5.240 781 HE1 TYR 96 HE1 TYR 96 4.139 -1.314 5.279 782 HE2 TYR 96 HE2 TYR 96 7.723 -2.444 7.296 783 HH TYR 96 HH TYR 96 4.269 -2.467 7.376 784 H ARG 97 H ARG 97 7.452 -1.886 0.113 785 HA ARG 97 HA ARG 97 5.441 -3.906 0.253 786 1HB ARG 97 1HB ARG 97 6.261 -1.910 -1.833 787 2HB ARG 97 2HB ARG 97 5.063 -3.143 -2.197 788 1HG ARG 97 1HG ARG 97 3.670 -2.322 -0.357 789 2HG ARG 97 2HG ARG 97 4.872 -1.076 -0.014 790 1HD ARG 97 1HD ARG 97 4.497 -0.027 -2.121 791 2HD ARG 97 2HD ARG 97 3.511 -1.376 -2.686 792 HE ARG 97 HE ARG 97 2.093 -0.569 -0.589 793 1HH1 ARG 97 1HH1 ARG 97 3.613 1.310 -3.116 794 2HH1 ARG 97 2HH1 ARG 97 2.414 2.559 -3.094 795 1HH2 ARG 97 1HH2 ARG 97 0.498 1.070 -0.546 796 2HH2 ARG 97 2HH2 ARG 97 0.634 2.426 -1.616 797 H ARG 98 H ARG 98 8.575 -3.663 -1.197 798 HA ARG 98 HA ARG 98 8.445 -5.697 -3.119 799 1HB ARG 98 1HB ARG 98 10.274 -3.905 -2.564 800 2HB ARG 98 2HB ARG 98 10.916 -5.146 -1.503 801 1HG ARG 98 1HG ARG 98 11.264 -6.627 -3.361 802 2HG ARG 98 2HG ARG 98 10.467 -5.494 -4.459 803 1HD ARG 98 1HD ARG 98 12.221 -3.806 -3.815 804 2HD ARG 98 2HD ARG 98 13.061 -5.105 -2.974 805 HE ARG 98 HE ARG 98 12.749 -6.112 -5.464 806 1HH1 ARG 98 1HH1 ARG 98 13.985 -3.048 -4.260 807 2HH1 ARG 98 2HH1 ARG 98 15.100 -2.839 -5.584 808 1HH2 ARG 98 1HH2 ARG 98 14.248 -5.842 -7.182 809 2HH2 ARG 98 2HH2 ARG 98 15.277 -4.444 -7.206 810 H ASN 99 H ASN 99 9.479 -5.787 0.284 811 HA ASN 99 HA ASN 99 9.914 -8.608 0.301 812 1HB ASN 99 1HB ASN 99 9.663 -6.588 2.535 813 2HB ASN 99 2HB ASN 99 10.005 -8.294 2.810 814 1HD2 ASN 99 1HD2 ASN 99 11.617 -5.910 3.351 815 2HD2 ASN 99 2HD2 ASN 99 13.121 -6.158 2.528 816 H LEU 100 H LEU 100 7.190 -6.539 1.008 817 HA LEU 100 HA LEU 100 5.517 -8.456 2.215 818 1HB LEU 100 1HB LEU 100 4.950 -5.998 0.578 819 2HB LEU 100 2HB LEU 100 3.658 -7.004 1.210 820 HG LEU 100 HG LEU 100 5.762 -5.747 2.962 821 1HD1 LEU 100 1HD1 LEU 100 4.515 -3.998 1.799 822 2HD1 LEU 100 2HD1 LEU 100 4.102 -4.053 3.512 823 3HD1 LEU 100 3HD1 LEU 100 3.000 -4.736 2.316 824 1HD2 LEU 100 1HD2 LEU 100 4.642 -7.666 3.927 825 2HD2 LEU 100 2HD2 LEU 100 3.070 -6.982 3.515 826 3HD2 LEU 100 3HD2 LEU 100 4.092 -6.187 4.714 827 H ALA 101 H ALA 101 6.078 -7.614 -1.168 828 HA ALA 101 HA ALA 101 4.238 -9.402 -2.321 829 1HB ALA 101 1HB ALA 101 6.867 -8.438 -3.447 830 2HB ALA 101 2HB ALA 101 5.329 -7.581 -3.558 831 3HB ALA 101 3HB ALA 101 5.534 -9.137 -4.365 832 H LYS 102 H LYS 102 7.545 -9.781 -1.204 833 HA LYS 102 HA LYS 102 7.931 -12.429 -2.163 834 1HB LYS 102 1HB LYS 102 9.279 -10.941 0.101 835 2HB LYS 102 2HB LYS 102 9.830 -12.474 -0.560 836 1HG LYS 102 1HG LYS 102 9.581 -9.939 -2.160 837 2HG LYS 102 2HG LYS 102 11.069 -10.492 -1.396 838 1HD LYS 102 1HD LYS 102 9.606 -12.354 -3.200 839 2HD LYS 102 2HD LYS 102 10.538 -11.040 -3.919 840 1HE LYS 102 1HE LYS 102 11.882 -13.057 -3.783 841 2HE LYS 102 2HE LYS 102 12.533 -11.814 -2.718 842 1HZ LYS 102 1HZ LYS 102 12.486 -14.054 -1.728 843 2HZ LYS 102 2HZ LYS 102 10.792 -14.046 -1.810 844 3HZ LYS 102 3HZ LYS 102 11.601 -12.920 -0.832 845 H ALA 103 H ALA 103 6.393 -11.075 0.634 846 HA ALA 103 HA ALA 103 6.331 -13.520 2.147 847 1HB ALA 103 1HB ALA 103 6.311 -11.365 3.286 848 2HB ALA 103 2HB ALA 103 4.854 -12.286 3.668 849 3HB ALA 103 3HB ALA 103 4.781 -10.955 2.510 850 H GLY 104 H GLY 104 4.468 -12.101 -0.357 851 1HA GLY 104 1HA GLY 104 2.965 -13.590 -1.569 852 2HA GLY 104 2HA GLY 104 2.454 -14.234 -0.017 853 H VAL 105 H VAL 105 2.854 -10.897 0.129 854 HA VAL 105 HA VAL 105 0.018 -10.464 0.329 855 HB VAL 105 HB VAL 105 2.270 -8.448 0.377 856 1HG1 VAL 105 1HG1 VAL 105 -0.620 -8.173 1.194 857 2HG1 VAL 105 2HG1 VAL 105 0.154 -7.400 -0.190 858 3HG1 VAL 105 3HG1 VAL 105 0.635 -6.963 1.449 859 1HG2 VAL 105 1HG2 VAL 105 0.787 -9.796 2.630 860 2HG2 VAL 105 2HG2 VAL 105 1.965 -8.498 2.818 861 3HG2 VAL 105 3HG2 VAL 105 2.472 -10.063 2.180 862 H PHE 106 H PHE 106 -1.246 -10.192 -1.349 863 HA PHE 106 HA PHE 106 -0.081 -9.157 -3.843 864 1HB PHE 106 1HB PHE 106 -1.078 -11.474 -3.839 865 2HB PHE 106 2HB PHE 106 -2.640 -10.736 -3.515 866 HD1 PHE 106 HD1 PHE 106 -3.859 -9.595 -5.248 867 HD2 PHE 106 HD2 PHE 106 0.027 -11.166 -5.993 868 HE1 PHE 106 HE1 PHE 106 -4.205 -9.303 -7.667 869 HE2 PHE 106 HE2 PHE 106 -0.315 -10.876 -8.411 870 HZ PHE 106 HZ PHE 106 -2.429 -9.943 -9.250 871 H ARG 107 H ARG 107 -2.480 -8.637 -1.398 872 HA ARG 107 HA ARG 107 -3.495 -6.333 -2.926 873 1HB ARG 107 1HB ARG 107 -4.965 -8.460 -1.638 874 2HB ARG 107 2HB ARG 107 -5.396 -6.901 -0.947 875 1HG ARG 107 1HG ARG 107 -6.911 -7.210 -2.690 876 2HG ARG 107 2HG ARG 107 -5.699 -6.111 -3.353 877 1HD ARG 107 1HD ARG 107 -5.728 -7.562 -5.078 878 2HD ARG 107 2HD ARG 107 -4.620 -8.470 -4.051 879 HE ARG 107 HE ARG 107 -7.481 -9.038 -4.455 880 1HH1 ARG 107 1HH1 ARG 107 -4.373 -9.955 -3.150 881 2HH1 ARG 107 2HH1 ARG 107 -4.828 -11.600 -2.861 882 1HH2 ARG 107 1HH2 ARG 107 -8.080 -11.212 -4.137 883 2HH2 ARG 107 2HH2 ARG 107 -6.938 -12.339 -3.472 884 H TRP 108 H TRP 108 -2.638 -4.579 -2.169 885 HA TRP 108 HA TRP 108 -2.219 -4.185 0.696 886 1HB TRP 108 1HB TRP 108 -0.401 -3.514 -0.786 887 2HB TRP 108 2HB TRP 108 -1.499 -2.548 -1.754 888 HD1 TRP 108 HD1 TRP 108 -2.563 -0.318 -0.372 889 HE1 TRP 108 HE1 TRP 108 -1.331 1.269 1.229 890 HE3 TRP 108 HE3 TRP 108 1.398 -3.311 0.830 891 HZ2 TRP 108 HZ2 TRP 108 1.020 1.256 2.790 892 HZ3 TRP 108 HZ3 TRP 108 3.099 -2.444 2.377 893 HH2 TRP 108 HH2 TRP 108 2.914 -0.207 3.337 894 H VAL 109 H VAL 109 -4.214 -3.807 1.611 895 HA VAL 109 HA VAL 109 -5.924 -1.809 0.277 896 HB VAL 109 HB VAL 109 -6.773 -3.967 2.216 897 1HG1 VAL 109 1HG1 VAL 109 -9.058 -3.317 1.597 898 2HG1 VAL 109 2HG1 VAL 109 -8.412 -2.003 0.613 899 3HG1 VAL 109 3HG1 VAL 109 -8.186 -1.990 2.362 900 1HG2 VAL 109 1HG2 VAL 109 -7.149 -3.771 -0.773 901 2HG2 VAL 109 2HG2 VAL 109 -7.851 -5.007 0.271 902 3HG2 VAL 109 3HG2 VAL 109 -6.102 -4.912 0.076 903 H THR 110 H THR 110 -5.477 0.101 1.195 904 HA THR 110 HA THR 110 -5.173 0.212 4.107 905 HB THR 110 HB THR 110 -4.661 2.393 2.074 906 HG1 THR 110 HG1 THR 110 -3.235 0.256 2.588 907 1HG2 THR 110 1HG2 THR 110 -5.211 3.252 4.308 908 2HG2 THR 110 2HG2 THR 110 -3.517 3.535 3.907 909 3HG2 THR 110 3HG2 THR 110 -3.957 2.228 5.009 910 H ASN 111 H ASN 111 -7.113 0.260 5.019 911 HA ASN 111 HA ASN 111 -9.187 2.027 3.984 912 1HB ASN 111 1HB ASN 111 -9.766 -0.262 4.829 913 2HB ASN 111 2HB ASN 111 -9.236 0.235 6.431 914 1HD2 ASN 111 1HD2 ASN 111 -11.861 -0.668 5.457 915 2HD2 ASN 111 2HD2 ASN 111 -12.973 0.592 5.899 916 H ILE 112 H ILE 112 -8.479 4.080 4.361 917 HA ILE 112 HA ILE 112 -7.125 4.781 6.800 918 HB ILE 112 HB ILE 112 -6.962 5.836 4.339 919 1HG1 ILE 112 1HG1 ILE 112 -5.960 7.870 5.400 920 2HG1 ILE 112 2HG1 ILE 112 -6.575 7.300 6.947 921 1HG2 ILE 112 1HG2 ILE 112 -8.014 8.071 4.330 922 2HG2 ILE 112 2HG2 ILE 112 -8.924 7.612 5.770 923 3HG2 ILE 112 3HG2 ILE 112 -9.179 6.748 4.254 924 1HD1 ILE 112 1HD1 ILE 112 -5.225 5.285 6.742 925 2HD1 ILE 112 2HD1 ILE 112 -4.233 6.742 6.660 926 3HD1 ILE 112 3HD1 ILE 112 -4.618 5.852 5.186 927 H HIS 113 H HIS 113 -10.351 4.609 5.736 928 HA HIS 113 HA HIS 113 -11.560 6.548 7.391 929 1HB HIS 113 1HB HIS 113 -12.642 5.309 5.473 930 2HB HIS 113 2HB HIS 113 -12.734 3.896 6.518 931 HD1 HIS 113 HD1 HIS 113 -14.413 4.024 8.534 932 HD2 HIS 113 HD2 HIS 113 -14.586 7.223 5.873 933 HE1 HIS 113 HE1 HIS 113 -16.577 5.208 9.029 934 HE2 HIS 113 HE2 HIS 113 -16.778 6.943 7.218 935 H GLU 114 H GLU 114 -10.332 3.338 7.946 936 HA GLU 114 HA GLU 114 -11.254 3.441 10.741 937 1HB GLU 114 1HB GLU 114 -10.080 1.087 9.253 938 2HB GLU 114 2HB GLU 114 -10.817 1.062 10.849 939 1HG GLU 114 1HG GLU 114 -12.181 1.558 8.219 940 2HG GLU 114 2HG GLU 114 -12.351 0.149 9.262 941 H GLN 115 H GLN 115 -8.655 4.200 8.883 942 HA GLN 115 HA GLN 115 -6.431 4.518 9.176 943 1HB GLN 115 1HB GLN 115 -7.185 4.416 12.106 944 2HB GLN 115 2HB GLN 115 -5.635 4.965 11.483 945 1HG GLN 115 1HG GLN 115 -8.291 6.233 10.849 946 2HG GLN 115 2HG GLN 115 -7.167 6.802 12.081 947 1HE2 GLN 115 1HE2 GLN 115 -8.193 8.116 9.672 948 2HE2 GLN 115 2HE2 GLN 115 -6.807 8.571 8.756 949 H LYS 116 H LYS 116 -7.021 1.992 8.503 950 HA LYS 116 HA LYS 116 -5.016 0.445 9.983 951 1HB LYS 116 1HB LYS 116 -7.754 -0.611 9.234 952 2HB LYS 116 2HB LYS 116 -6.452 -1.561 9.936 953 1HG LYS 116 1HG LYS 116 -6.580 -0.354 11.990 954 2HG LYS 116 2HG LYS 116 -7.704 0.812 11.295 955 1HD LYS 116 1HD LYS 116 -8.989 -0.680 12.628 956 2HD LYS 116 2HD LYS 116 -9.303 -1.098 10.943 957 1HE LYS 116 1HE LYS 116 -9.009 -3.131 12.145 958 2HE LYS 116 2HE LYS 116 -7.568 -2.888 11.159 959 1HZ LYS 116 1HZ LYS 116 -6.989 -3.613 13.381 960 2HZ LYS 116 2HZ LYS 116 -7.811 -2.294 14.062 961 3HZ LYS 116 3HZ LYS 116 -6.426 -2.034 13.125 962 H ARG 117 H ARG 117 -3.661 -0.653 8.687 963 HA ARG 117 HA ARG 117 -4.276 -0.738 5.815 964 1HB ARG 117 1HB ARG 117 -1.638 -1.145 7.242 965 2HB ARG 117 2HB ARG 117 -1.865 -1.192 5.501 966 1HG ARG 117 1HG ARG 117 -2.785 1.190 5.759 967 2HG ARG 117 2HG ARG 117 -2.029 1.152 7.351 968 1HD ARG 117 1HD ARG 117 -0.595 0.628 4.754 969 2HD ARG 117 2HD ARG 117 -0.606 2.172 5.595 970 HE ARG 117 HE ARG 117 0.337 -0.043 7.193 971 1HH1 ARG 117 1HH1 ARG 117 1.212 2.466 4.927 972 2HH1 ARG 117 2HH1 ARG 117 2.868 2.525 5.423 973 1HH2 ARG 117 1HH2 ARG 117 2.536 0.003 7.853 974 2HH2 ARG 117 2HH2 ARG 117 3.625 1.111 7.069 975 H TYR 118 H TYR 118 -4.993 -2.562 4.988 976 HA TYR 118 HA TYR 118 -4.640 -5.044 6.511 977 1HB TYR 118 1HB TYR 118 -6.588 -4.334 4.309 978 2HB TYR 118 2HB TYR 118 -6.507 -5.897 5.114 979 HD1 TYR 118 HD1 TYR 118 -7.327 -6.176 7.369 980 HD2 TYR 118 HD2 TYR 118 -7.482 -2.384 5.456 981 HE1 TYR 118 HE1 TYR 118 -8.880 -5.376 9.097 982 HE2 TYR 118 HE2 TYR 118 -9.033 -1.570 7.180 983 HH TYR 118 HH TYR 118 -10.651 -2.494 8.786 984 H TYR 119 H TYR 119 -3.586 -6.767 5.704 985 HA TYR 119 HA TYR 119 -2.517 -6.536 2.966 986 1HB TYR 119 1HB TYR 119 -1.244 -7.900 5.351 987 2HB TYR 119 2HB TYR 119 -0.563 -7.812 3.727 988 HD1 TYR 119 HD1 TYR 119 -1.015 -6.090 6.875 989 HD2 TYR 119 HD2 TYR 119 0.127 -5.599 2.808 990 HE1 TYR 119 HE1 TYR 119 0.039 -3.940 7.435 991 HE2 TYR 119 HE2 TYR 119 1.192 -3.456 3.359 992 HH TYR 119 HH TYR 119 1.840 -2.481 6.520 993 H TYR 120 H TYR 120 -3.350 -7.939 1.614 994 HA TYR 120 HA TYR 120 -4.368 -10.497 2.676 995 1HB TYR 120 1HB TYR 120 -5.362 -8.896 0.307 996 2HB TYR 120 2HB TYR 120 -5.982 -10.469 0.794 997 HD1 TYR 120 HD1 TYR 120 -7.205 -10.681 2.956 998 HD2 TYR 120 HD2 TYR 120 -6.092 -6.905 1.358 999 HE1 TYR 120 HE1 TYR 120 -8.832 -9.585 4.432 1000 HE2 TYR 120 HE2 TYR 120 -7.713 -5.796 2.836 1001 HH TYR 120 HH TYR 120 -9.693 -6.274 4.096 1002 H THR 121 H THR 121 -3.676 -12.342 1.775 1003 HA THR 121 HA THR 121 -1.755 -12.296 -0.378 1004 HB THR 121 HB THR 121 -1.570 -13.941 1.470 1005 HG1 THR 121 HG1 THR 121 -0.529 -14.671 -0.295 1006 1HG2 THR 121 1HG2 THR 121 -3.079 -15.876 1.531 1007 2HG2 THR 121 2HG2 THR 121 -4.064 -15.143 0.266 1008 3HG2 THR 121 3HG2 THR 121 -3.943 -14.371 1.847 1009 H PHE 122 H PHE 122 -2.339 -14.277 -2.098 1010 HA PHE 122 HA PHE 122 -4.270 -13.090 -3.759 1011 1HB PHE 122 1HB PHE 122 -4.023 -15.083 -5.203 1012 2HB PHE 122 2HB PHE 122 -2.483 -14.380 -4.729 1013 HD1 PHE 122 HD1 PHE 122 -4.656 -17.282 -4.526 1014 HD2 PHE 122 HD2 PHE 122 -1.029 -15.539 -3.139 1015 HE1 PHE 122 HE1 PHE 122 -3.899 -19.487 -3.745 1016 HE2 PHE 122 HE2 PHE 122 -0.269 -17.744 -2.354 1017 HZ PHE 122 HZ PHE 122 -1.706 -19.722 -2.659 1018 H ASP 123 H ASP 123 -4.554 -15.646 -1.387 1019 HA ASP 123 HA ASP 123 -7.106 -16.618 -2.078 1020 1HB ASP 123 1HB ASP 123 -5.543 -16.543 0.480 1021 2HB ASP 123 2HB ASP 123 -7.223 -17.065 0.498 1022 H ASN 124 H ASN 124 -6.173 -13.596 -0.866 1023 HA ASN 124 HA ASN 124 -7.294 -11.740 -0.206 1024 1HB ASN 124 1HB ASN 124 -8.980 -12.510 -1.956 1025 2HB ASN 124 2HB ASN 124 -9.894 -13.221 -0.632 1026 1HD2 ASN 124 1HD2 ASN 124 -11.110 -11.932 0.657 1027 2HD2 ASN 124 2HD2 ASN 124 -11.316 -10.233 0.405 1028 H SER 125 H SER 125 -6.751 -14.246 1.444 1029 HA SER 125 HA SER 125 -8.484 -13.866 3.720 1030 1HB SER 125 1HB SER 125 -7.565 -16.105 3.234 1031 2HB SER 125 2HB SER 125 -5.929 -15.481 3.445 1032 HG SER 125 HG SER 125 -6.383 -16.298 5.397 1033 H LEU 126 H LEU 126 -8.034 -12.704 5.511 1034 HA LEU 126 HA LEU 126 -6.152 -10.610 5.347 1035 1HB LEU 126 1HB LEU 126 -8.272 -10.486 6.611 1036 2HB LEU 126 2HB LEU 126 -7.640 -11.647 7.762 1037 HG LEU 126 HG LEU 126 -5.883 -10.041 8.407 1038 1HD1 LEU 126 1HD1 LEU 126 -6.035 -7.720 7.638 1039 2HD1 LEU 126 2HD1 LEU 126 -7.318 -8.181 6.518 1040 3HD1 LEU 126 3HD1 LEU 126 -5.690 -8.829 6.310 1041 1HD2 LEU 126 1HD2 LEU 126 -7.959 -10.110 9.668 1042 2HD2 LEU 126 2HD2 LEU 126 -8.698 -8.966 8.550 1043 3HD2 LEU 126 3HD2 LEU 126 -7.355 -8.457 9.573 1044 H LEU 127 H LEU 127 -4.040 -10.886 5.474 1045 HA LEU 127 HA LEU 127 -2.920 -12.993 7.143 1046 1HB LEU 127 1HB LEU 127 -1.593 -10.995 5.305 1047 2HB LEU 127 2HB LEU 127 -0.747 -12.246 6.194 1048 HG LEU 127 HG LEU 127 -2.825 -12.750 4.060 1049 1HD1 LEU 127 1HD1 LEU 127 -0.919 -13.478 2.701 1050 2HD1 LEU 127 2HD1 LEU 127 0.183 -12.951 3.973 1051 3HD1 LEU 127 3HD1 LEU 127 -0.811 -11.770 3.120 1052 1HD2 LEU 127 1HD2 LEU 127 -2.732 -14.541 5.704 1053 2HD2 LEU 127 2HD2 LEU 127 -0.979 -14.625 5.539 1054 3HD2 LEU 127 3HD2 LEU 127 -2.013 -15.070 4.182 1055 H PHE 128 H PHE 128 -2.602 -9.463 6.774 1056 HA PHE 128 HA PHE 128 -1.976 -9.278 9.627 1057 1HB PHE 128 1HB PHE 128 0.075 -9.366 7.887 1058 2HB PHE 128 2HB PHE 128 -0.279 -7.643 7.817 1059 HD1 PHE 128 HD1 PHE 128 0.258 -6.200 9.640 1060 HD2 PHE 128 HD2 PHE 128 0.741 -10.410 9.996 1061 HE1 PHE 128 HE1 PHE 128 1.554 -5.871 11.708 1062 HE2 PHE 128 HE2 PHE 128 2.032 -10.097 12.064 1063 HZ PHE 128 HZ PHE 128 2.440 -7.822 12.923 1064 H THR 129 H THR 129 -2.132 -7.070 10.446 1065 HA THR 129 HA THR 129 -3.418 -5.122 8.708 1066 HB THR 129 HB THR 129 -4.686 -5.984 11.318 1067 HG1 THR 129 HG1 THR 129 -4.941 -6.939 8.791 1068 1HG2 THR 129 1HG2 THR 129 -6.489 -4.474 10.690 1069 2HG2 THR 129 2HG2 THR 129 -5.640 -4.047 9.204 1070 3HG2 THR 129 3HG2 THR 129 -4.964 -3.595 10.770 1071 H GLU 130 H GLU 130 -2.156 -3.412 8.957 1072 HA GLU 130 HA GLU 130 -0.928 -2.850 11.543 1073 1HB GLU 130 1HB GLU 130 -0.582 -1.629 8.808 1074 2HB GLU 130 2HB GLU 130 0.168 -0.965 10.250 1075 1HG GLU 130 1HG GLU 130 1.367 -3.071 10.591 1076 2HG GLU 130 2HG GLU 130 0.630 -3.718 9.123 1077 H SER 131 H SER 131 -2.238 -1.852 12.925 1078 HA SER 131 HA SER 131 -4.176 0.107 12.046 1079 1HB SER 131 1HB SER 131 -3.392 -0.635 14.875 1080 2HB SER 131 2HB SER 131 -4.879 0.155 14.354 1081 HG SER 131 HG SER 131 -4.428 -2.430 14.601 1082 H ILE 132 H ILE 132 -3.521 2.124 11.590 1083 HA ILE 132 HA ILE 132 -1.009 3.057 12.743 1084 HB ILE 132 HB ILE 132 -1.163 4.896 11.060 1085 1HG1 ILE 132 1HG1 ILE 132 -3.509 3.293 10.017 1086 2HG1 ILE 132 2HG1 ILE 132 -3.613 4.885 10.761 1087 1HG2 ILE 132 1HG2 ILE 132 -1.271 2.085 9.983 1088 2HG2 ILE 132 2HG2 ILE 132 0.149 2.900 10.638 1089 3HG2 ILE 132 3HG2 ILE 132 -0.593 3.482 9.148 1090 1HD1 ILE 132 1HD1 ILE 132 -2.217 4.220 8.178 1091 2HD1 ILE 132 2HD1 ILE 132 -2.284 5.815 8.929 1092 3HD1 ILE 132 3HD1 ILE 132 -3.764 5.047 8.353 1093 H GLN 133 H GLN 133 -0.981 4.332 14.425 1094 HA GLN 133 HA GLN 133 -3.323 6.024 14.966 1095 1HB GLN 133 1HB GLN 133 -2.654 4.309 16.703 1096 2HB GLN 133 2HB GLN 133 -1.167 5.218 16.929 1097 1HG GLN 133 1HG GLN 133 -2.541 5.964 18.645 1098 2HG GLN 133 2HG GLN 133 -2.684 7.221 17.419 1099 1HE2 GLN 133 1HE2 GLN 133 -4.455 5.501 15.749 1100 2HE2 GLN 133 2HE2 GLN 133 -5.997 5.541 16.534 Start of MODEL 10 1 H ASP 7 H ASP 7 -4.349 15.958 -15.103 2 HA ASP 7 HA ASP 7 -7.098 14.974 -15.300 3 1HB ASP 7 1HB ASP 7 -5.711 13.865 -17.069 4 2HB ASP 7 2HB ASP 7 -4.708 13.191 -15.788 5 H GLN 8 H GLN 8 -7.753 13.632 -13.614 6 HA GLN 8 HA GLN 8 -6.672 14.337 -11.109 7 1HB GLN 8 1HB GLN 8 -9.050 13.856 -11.491 8 2HB GLN 8 2HB GLN 8 -8.661 12.175 -11.814 9 1HG GLN 8 1HG GLN 8 -7.990 11.822 -9.556 10 2HG GLN 8 2HG GLN 8 -8.112 13.543 -9.196 11 1HE2 GLN 8 1HE2 GLN 8 -10.442 11.944 -11.202 12 2HE2 GLN 8 2HE2 GLN 8 -11.750 11.998 -10.076 13 H VAL 9 H VAL 9 -6.213 11.538 -13.168 14 HA VAL 9 HA VAL 9 -5.134 9.765 -11.272 15 HB VAL 9 HB VAL 9 -4.587 9.999 -14.240 16 1HG1 VAL 9 1HG1 VAL 9 -3.853 7.768 -12.347 17 2HG1 VAL 9 2HG1 VAL 9 -2.732 8.831 -13.196 18 3HG1 VAL 9 3HG1 VAL 9 -3.732 7.695 -14.104 19 1HG2 VAL 9 1HG2 VAL 9 -6.392 8.179 -12.650 20 2HG2 VAL 9 2HG2 VAL 9 -6.101 8.059 -14.384 21 3HG2 VAL 9 3HG2 VAL 9 -6.895 9.487 -13.721 22 H VAL 10 H VAL 10 -3.737 12.429 -13.054 23 HA VAL 10 HA VAL 10 -1.017 11.855 -12.630 24 HB VAL 10 HB VAL 10 -2.312 14.570 -12.951 25 1HG1 VAL 10 1HG1 VAL 10 0.542 13.682 -13.365 26 2HG1 VAL 10 2HG1 VAL 10 -0.047 14.763 -12.102 27 3HG1 VAL 10 3HG1 VAL 10 -0.104 15.266 -13.791 28 1HG2 VAL 10 1HG2 VAL 10 -1.757 14.324 -15.326 29 2HG2 VAL 10 2HG2 VAL 10 -2.881 13.075 -14.785 30 3HG2 VAL 10 3HG2 VAL 10 -1.176 12.687 -15.016 31 H ILE 11 H ILE 11 -3.365 13.680 -10.701 32 HA ILE 11 HA ILE 11 -1.515 14.686 -8.819 33 HB ILE 11 HB ILE 11 -4.493 14.197 -8.569 34 1HG1 ILE 11 1HG1 ILE 11 -4.425 16.781 -8.518 35 2HG1 ILE 11 2HG1 ILE 11 -2.790 16.615 -9.147 36 1HG2 ILE 11 1HG2 ILE 11 -4.441 15.552 -6.532 37 2HG2 ILE 11 2HG2 ILE 11 -2.680 15.612 -6.614 38 3HG2 ILE 11 3HG2 ILE 11 -3.500 14.072 -6.351 39 1HD1 ILE 11 1HD1 ILE 11 -5.295 15.587 -10.452 40 2HD1 ILE 11 2HD1 ILE 11 -3.658 15.434 -11.091 41 3HD1 ILE 11 3HD1 ILE 11 -4.394 17.027 -10.919 42 H PHE 12 H PHE 12 -3.704 11.880 -8.653 43 HA PHE 12 HA PHE 12 -2.819 11.061 -6.100 44 1HB PHE 12 1HB PHE 12 -4.344 9.648 -8.276 45 2HB PHE 12 2HB PHE 12 -3.909 8.842 -6.773 46 HD1 PHE 12 HD1 PHE 12 -6.071 11.302 -8.345 47 HD2 PHE 12 HD2 PHE 12 -4.865 9.581 -4.641 48 HE1 PHE 12 HE1 PHE 12 -8.063 12.250 -7.257 49 HE2 PHE 12 HE2 PHE 12 -6.857 10.527 -3.549 50 HZ PHE 12 HZ PHE 12 -8.460 11.866 -4.858 51 H LYS 13 H LYS 13 -1.883 10.023 -9.369 52 HA LYS 13 HA LYS 13 -0.177 7.935 -8.577 53 1HB LYS 13 1HB LYS 13 -0.789 8.080 -10.885 54 2HB LYS 13 2HB LYS 13 -0.129 9.704 -11.026 55 1HG LYS 13 1HG LYS 13 2.123 8.819 -10.682 56 2HG LYS 13 2HG LYS 13 1.462 7.190 -10.550 57 1HD LYS 13 1HD LYS 13 0.761 7.206 -12.820 58 2HD LYS 13 2HD LYS 13 1.085 8.934 -12.973 59 1HE LYS 13 1HE LYS 13 2.835 7.617 -14.046 60 2HE LYS 13 2HE LYS 13 3.472 8.521 -12.672 61 1HZ LYS 13 1HZ LYS 13 3.324 6.481 -11.339 62 2HZ LYS 13 2HZ LYS 13 4.350 6.294 -12.675 63 3HZ LYS 13 3HZ LYS 13 2.791 5.627 -12.707 64 H GLN 14 H GLN 14 0.391 11.387 -9.005 65 HA GLN 14 HA GLN 14 3.181 11.371 -8.836 66 1HB GLN 14 1HB GLN 14 1.504 13.277 -9.434 67 2HB GLN 14 2HB GLN 14 1.545 13.617 -7.710 68 1HG GLN 14 1HG GLN 14 3.115 15.031 -8.856 69 2HG GLN 14 2HG GLN 14 3.990 13.876 -7.848 70 1HE2 GLN 14 1HE2 GLN 14 3.154 14.794 -11.088 71 2HE2 GLN 14 2HE2 GLN 14 4.337 13.824 -11.898 72 H ILE 15 H ILE 15 0.712 11.537 -6.324 73 HA ILE 15 HA ILE 15 2.409 12.047 -4.137 74 HB ILE 15 HB ILE 15 -0.210 10.536 -4.135 75 1HG1 ILE 15 1HG1 ILE 15 0.300 13.487 -3.706 76 2HG1 ILE 15 2HG1 ILE 15 -0.341 12.790 -5.191 77 1HG2 ILE 15 1HG2 ILE 15 1.233 11.991 -1.919 78 2HG2 ILE 15 2HG2 ILE 15 1.036 10.243 -2.066 79 3HG2 ILE 15 3HG2 ILE 15 -0.372 11.269 -1.798 80 1HD1 ILE 15 1HD1 ILE 15 -1.652 12.711 -2.485 81 2HD1 ILE 15 2HD1 ILE 15 -2.295 11.987 -3.959 82 3HD1 ILE 15 3HD1 ILE 15 -2.112 13.737 -3.842 83 H PHE 16 H PHE 16 1.012 8.973 -5.289 84 HA PHE 16 HA PHE 16 2.382 7.350 -3.426 85 1HB PHE 16 1HB PHE 16 1.028 6.737 -6.047 86 2HB PHE 16 2HB PHE 16 1.800 5.487 -5.082 87 HD1 PHE 16 HD1 PHE 16 -0.893 8.023 -5.071 88 HD2 PHE 16 HD2 PHE 16 0.729 4.558 -3.210 89 HE1 PHE 16 HE1 PHE 16 -2.951 7.776 -3.749 90 HE2 PHE 16 HE2 PHE 16 -1.329 4.303 -1.883 91 HZ PHE 16 HZ PHE 16 -3.174 5.917 -2.155 92 H ASP 17 H ASP 17 3.165 8.429 -6.673 93 HA ASP 17 HA ASP 17 5.366 6.673 -7.039 94 1HB ASP 17 1HB ASP 17 4.079 8.804 -8.525 95 2HB ASP 17 2HB ASP 17 5.835 8.882 -8.675 96 H LYS 18 H LYS 18 5.013 9.684 -5.368 97 HA LYS 18 HA LYS 18 7.877 10.148 -5.266 98 1HB LYS 18 1HB LYS 18 5.536 11.565 -4.002 99 2HB LYS 18 2HB LYS 18 7.202 11.963 -3.602 100 1HG LYS 18 1HG LYS 18 5.845 12.226 -6.273 101 2HG LYS 18 2HG LYS 18 6.444 13.519 -5.230 102 1HD LYS 18 1HD LYS 18 8.741 12.457 -5.514 103 2HD LYS 18 2HD LYS 18 8.023 11.517 -6.822 104 1HE LYS 18 1HE LYS 18 8.368 14.497 -6.630 105 2HE LYS 18 2HE LYS 18 9.015 13.397 -7.846 106 1HZ LYS 18 1HZ LYS 18 6.235 14.348 -7.516 107 2HZ LYS 18 2HZ LYS 18 6.587 12.955 -8.416 108 3HZ LYS 18 3HZ LYS 18 7.234 14.447 -8.886 109 H VAL 19 H VAL 19 5.320 9.004 -3.098 110 HA VAL 19 HA VAL 19 6.923 8.966 -0.774 111 HB VAL 19 HB VAL 19 4.414 8.892 -0.807 112 1HG1 VAL 19 1HG1 VAL 19 4.082 7.158 -2.470 113 2HG1 VAL 19 2HG1 VAL 19 3.313 6.712 -0.945 114 3HG1 VAL 19 3HG1 VAL 19 4.847 5.974 -1.410 115 1HG2 VAL 19 1HG2 VAL 19 4.226 7.458 1.185 116 2HG2 VAL 19 2HG2 VAL 19 5.631 8.522 1.248 117 3HG2 VAL 19 3HG2 VAL 19 5.834 6.818 0.852 118 H ARG 20 H ARG 20 6.730 6.842 -3.471 119 HA ARG 20 HA ARG 20 7.731 4.490 -2.284 120 1HB ARG 20 1HB ARG 20 7.889 5.517 -5.116 121 2HB ARG 20 2HB ARG 20 8.513 3.946 -4.634 122 1HG ARG 20 1HG ARG 20 6.279 3.284 -3.897 123 2HG ARG 20 2HG ARG 20 5.655 4.859 -4.389 124 1HD ARG 20 1HD ARG 20 6.352 4.392 -6.699 125 2HD ARG 20 2HD ARG 20 6.931 2.807 -6.192 126 HE ARG 20 HE ARG 20 4.571 2.303 -5.600 127 1HH1 ARG 20 1HH1 ARG 20 5.307 4.822 -7.908 128 2HH1 ARG 20 2HH1 ARG 20 3.767 4.749 -8.694 129 1HH2 ARG 20 1HH2 ARG 20 2.553 2.154 -6.633 130 2HH2 ARG 20 2HH2 ARG 20 2.186 3.201 -7.966 131 H ASN 21 H ASN 21 9.330 7.411 -3.409 132 HA ASN 21 HA ASN 21 11.923 6.144 -2.857 133 1HB ASN 21 1HB ASN 21 12.928 8.059 -4.095 134 2HB ASN 21 2HB ASN 21 11.870 7.056 -5.078 135 1HD2 ASN 21 1HD2 ASN 21 12.379 10.173 -3.653 136 2HD2 ASN 21 2HD2 ASN 21 11.059 10.977 -4.447 137 H ASP 22 H ASP 22 10.035 9.058 -2.125 138 HA ASP 22 HA ASP 22 12.172 10.153 -0.547 139 1HB ASP 22 1HB ASP 22 10.452 11.485 -1.875 140 2HB ASP 22 2HB ASP 22 9.308 11.111 -0.590 141 H LEU 23 H LEU 23 9.354 8.219 0.035 142 HA LEU 23 HA LEU 23 8.476 7.229 1.881 143 1HB LEU 23 1HB LEU 23 11.173 7.941 3.023 144 2HB LEU 23 2HB LEU 23 9.970 7.033 3.916 145 HG LEU 23 HG LEU 23 11.270 6.165 1.331 146 1HD1 LEU 23 1HD1 LEU 23 12.780 6.089 3.252 147 2HD1 LEU 23 2HD1 LEU 23 12.340 4.467 2.719 148 3HD1 LEU 23 3HD1 LEU 23 11.587 5.157 4.158 149 1HD2 LEU 23 1HD2 LEU 23 8.973 5.368 1.516 150 2HD2 LEU 23 2HD2 LEU 23 9.310 4.743 3.130 151 3HD2 LEU 23 3HD2 LEU 23 10.119 4.044 1.726 152 H ASN 24 H ASN 24 8.013 10.033 1.370 153 HA ASN 24 HA ASN 24 7.857 11.258 3.988 154 1HB ASN 24 1HB ASN 24 6.870 13.193 2.776 155 2HB ASN 24 2HB ASN 24 8.444 12.714 2.154 156 1HD2 ASN 24 1HD2 ASN 24 6.345 14.240 0.881 157 2HD2 ASN 24 2HD2 ASN 24 5.910 13.387 -0.552 158 H TYR 25 H TYR 25 6.468 9.802 5.038 159 HA TYR 25 HA TYR 25 3.866 9.219 3.988 160 1HB TYR 25 1HB TYR 25 5.032 8.800 6.746 161 2HB TYR 25 2HB TYR 25 3.464 8.194 6.219 162 HD1 TYR 25 HD1 TYR 25 3.467 6.647 4.140 163 HD2 TYR 25 HD2 TYR 25 6.932 7.488 6.458 164 HE1 TYR 25 HE1 TYR 25 4.533 4.603 3.278 165 HE2 TYR 25 HE2 TYR 25 8.010 5.450 5.604 166 HH TYR 25 HH TYR 25 6.857 3.723 2.963 167 H GLN 26 H GLN 26 5.236 11.712 5.927 168 HA GLN 26 HA GLN 26 3.000 12.663 7.306 169 1HB GLN 26 1HB GLN 26 5.448 13.399 7.459 170 2HB GLN 26 2HB GLN 26 5.126 14.406 6.062 171 1HG GLN 26 1HG GLN 26 3.626 14.628 8.663 172 2HG GLN 26 2HG GLN 26 5.059 15.572 8.273 173 1HE2 GLN 26 1HE2 GLN 26 1.689 15.219 7.869 174 2HE2 GLN 26 2HE2 GLN 26 1.431 16.610 6.874 175 H TRP 27 H TRP 27 4.297 13.814 4.190 176 HA TRP 27 HA TRP 27 2.022 15.402 3.579 177 1HB TRP 27 1HB TRP 27 4.315 15.788 2.668 178 2HB TRP 27 2HB TRP 27 4.146 14.324 1.708 179 HD1 TRP 27 HD1 TRP 27 2.527 17.830 2.024 180 HE1 TRP 27 HE1 TRP 27 1.622 18.496 -0.295 181 HE3 TRP 27 HE3 TRP 27 3.504 13.492 -0.515 182 HZ2 TRP 27 HZ2 TRP 27 1.358 17.336 -2.849 183 HZ3 TRP 27 HZ3 TRP 27 2.895 13.357 -2.893 184 HH2 TRP 27 HH2 TRP 27 1.843 15.242 -4.036 185 H PHE 28 H PHE 28 3.007 12.127 2.836 186 HA PHE 28 HA PHE 28 1.241 11.481 0.790 187 1HB PHE 28 1HB PHE 28 3.105 10.054 1.427 188 2HB PHE 28 2HB PHE 28 2.372 9.748 2.996 189 HD1 PHE 28 HD1 PHE 28 1.464 9.457 -0.617 190 HD2 PHE 28 HD2 PHE 28 1.347 7.728 3.269 191 HE1 PHE 28 HE1 PHE 28 0.360 7.464 -1.541 192 HE2 PHE 28 HE2 PHE 28 0.240 5.730 2.350 193 HZ PHE 28 HZ PHE 28 -0.252 5.596 -0.060 194 H TYR 29 H TYR 29 0.804 10.861 4.294 195 HA TYR 29 HA TYR 29 -1.868 9.935 3.907 196 1HB TYR 29 1HB TYR 29 -0.218 10.539 6.342 197 2HB TYR 29 2HB TYR 29 -1.934 10.163 6.484 198 HD1 TYR 29 HD1 TYR 29 -2.765 7.970 5.555 199 HD2 TYR 29 HD2 TYR 29 1.373 8.804 6.073 200 HE1 TYR 29 HE1 TYR 29 -2.277 5.566 5.451 201 HE2 TYR 29 HE2 TYR 29 1.873 6.396 5.973 202 HH TYR 29 HH TYR 29 -0.351 4.111 4.880 203 H SER 30 H SER 30 -0.490 13.060 4.398 204 HA SER 30 HA SER 30 -2.754 14.358 5.472 205 1HB SER 30 1HB SER 30 -0.514 15.445 3.754 206 2HB SER 30 2HB SER 30 -1.715 16.444 4.577 207 HG SER 30 HG SER 30 0.285 14.780 5.698 208 H GLU 31 H GLU 31 -1.629 14.050 2.097 209 HA GLU 31 HA GLU 31 -3.929 15.296 1.009 210 1HB GLU 31 1HB GLU 31 -1.709 13.655 -0.138 211 2HB GLU 31 2HB GLU 31 -3.119 14.024 -1.124 212 1HG GLU 31 1HG GLU 31 -1.319 16.032 0.213 213 2HG GLU 31 2HG GLU 31 -1.333 15.628 -1.503 214 H LEU 32 H LEU 32 -3.180 11.981 1.869 215 HA LEU 32 HA LEU 32 -5.331 10.740 0.564 216 1HB LEU 32 1HB LEU 32 -3.963 10.041 3.161 217 2HB LEU 32 2HB LEU 32 -5.165 9.022 2.393 218 HG LEU 32 HG LEU 32 -2.475 9.771 1.244 219 1HD1 LEU 32 1HD1 LEU 32 -3.551 7.145 2.256 220 2HD1 LEU 32 2HD1 LEU 32 -2.364 8.159 3.077 221 3HD1 LEU 32 3HD1 LEU 32 -1.965 7.408 1.531 222 1HD2 LEU 32 1HD2 LEU 32 -3.031 8.239 -0.566 223 2HD2 LEU 32 2HD2 LEU 32 -4.193 9.564 -0.494 224 3HD2 LEU 32 3HD2 LEU 32 -4.628 7.974 0.133 225 H LYS 33 H LYS 33 -5.132 11.902 3.932 226 HA LYS 33 HA LYS 33 -7.846 11.452 4.540 227 1HB LYS 33 1HB LYS 33 -6.032 11.758 6.208 228 2HB LYS 33 2HB LYS 33 -5.950 13.459 5.779 229 1HG LYS 33 1HG LYS 33 -8.225 13.785 6.584 230 2HG LYS 33 2HG LYS 33 -8.340 12.067 6.975 231 1HD LYS 33 1HD LYS 33 -6.513 12.301 8.576 232 2HD LYS 33 2HD LYS 33 -6.368 14.013 8.175 233 1HE LYS 33 1HE LYS 33 -8.813 12.698 9.355 234 2HE LYS 33 2HE LYS 33 -7.623 13.626 10.263 235 1HZ LYS 33 1HZ LYS 33 -9.479 14.615 8.168 236 2HZ LYS 33 2HZ LYS 33 -8.176 15.527 8.751 237 3HZ LYS 33 3HZ LYS 33 -9.421 15.062 9.803 238 H ARG 34 H ARG 34 -6.345 13.914 2.699 239 HA ARG 34 HA ARG 34 -8.586 15.759 3.034 240 1HB ARG 34 1HB ARG 34 -5.789 16.006 2.067 241 2HB ARG 34 2HB ARG 34 -6.979 17.093 1.364 242 1HG ARG 34 1HG ARG 34 -7.237 18.267 3.270 243 2HG ARG 34 2HG ARG 34 -7.029 16.853 4.301 244 1HD ARG 34 1HD ARG 34 -5.223 18.597 4.464 245 2HD ARG 34 2HD ARG 34 -4.674 16.957 4.132 246 HE ARG 34 HE ARG 34 -4.422 17.657 1.778 247 1HH1 ARG 34 1HH1 ARG 34 -4.580 20.163 4.232 248 2HH1 ARG 34 2HH1 ARG 34 -3.622 21.284 3.317 249 1HH2 ARG 34 1HH2 ARG 34 -3.156 19.090 0.609 250 2HH2 ARG 34 2HH2 ARG 34 -2.771 20.660 1.269 251 H HIS 35 H HIS 35 -7.829 13.202 1.043 252 HA HIS 35 HA HIS 35 -9.688 14.232 -0.996 253 1HB HIS 35 1HB HIS 35 -7.154 12.667 -1.514 254 2HB HIS 35 2HB HIS 35 -8.429 12.862 -2.708 255 HD1 HIS 35 HD1 HIS 35 -8.778 15.278 -3.683 256 HD2 HIS 35 HD2 HIS 35 -5.465 14.830 -1.206 257 HE1 HIS 35 HE1 HIS 35 -7.324 17.292 -4.118 258 HE2 HIS 35 HE2 HIS 35 -5.255 16.921 -2.711 259 H ASN 36 H ASN 36 -8.056 11.239 0.002 260 HA ASN 36 HA ASN 36 -10.449 9.715 -0.670 261 1HB ASN 36 1HB ASN 36 -8.359 8.851 -1.557 262 2HB ASN 36 2HB ASN 36 -7.645 8.840 0.051 263 1HD2 ASN 36 1HD2 ASN 36 -7.194 6.647 -0.125 264 2HD2 ASN 36 2HD2 ASN 36 -8.425 5.446 0.011 265 H VAL 37 H VAL 37 -11.814 10.119 0.996 266 HA VAL 37 HA VAL 37 -10.932 9.782 3.742 267 HB VAL 37 HB VAL 37 -13.768 10.264 2.838 268 1HG1 VAL 37 1HG1 VAL 37 -12.289 11.022 5.357 269 2HG1 VAL 37 2HG1 VAL 37 -13.479 9.729 5.191 270 3HG1 VAL 37 3HG1 VAL 37 -13.970 11.411 4.990 271 1HG2 VAL 37 1HG2 VAL 37 -11.610 12.335 3.229 272 2HG2 VAL 37 2HG2 VAL 37 -13.327 12.675 3.017 273 3HG2 VAL 37 3HG2 VAL 37 -12.412 11.924 1.713 274 H SER 38 H SER 38 -11.570 7.620 1.444 275 HA SER 38 HA SER 38 -13.168 5.875 3.185 276 1HB SER 38 1HB SER 38 -12.843 5.747 0.182 277 2HB SER 38 2HB SER 38 -13.824 4.649 1.157 278 HG SER 38 HG SER 38 -14.597 7.027 1.856 279 H HIS 39 H HIS 39 -11.167 4.869 0.429 280 HA HIS 39 HA HIS 39 -9.075 3.740 1.983 281 1HB HIS 39 1HB HIS 39 -9.647 1.376 1.836 282 2HB HIS 39 2HB HIS 39 -10.888 2.239 2.735 283 HD1 HIS 39 HD1 HIS 39 -13.265 2.119 1.848 284 HD2 HIS 39 HD2 HIS 39 -10.458 0.509 -0.771 285 HE1 HIS 39 HE1 HIS 39 -14.589 0.994 0.033 286 HE2 HIS 39 HE2 HIS 39 -12.876 -0.108 -1.454 287 H TYR 40 H TYR 40 -7.593 2.425 0.677 288 HA TYR 40 HA TYR 40 -8.200 2.392 -2.188 289 1HB TYR 40 1HB TYR 40 -6.003 3.209 -2.800 290 2HB TYR 40 2HB TYR 40 -6.787 4.389 -1.761 291 HD1 TYR 40 HD1 TYR 40 -4.066 1.953 -2.036 292 HD2 TYR 40 HD2 TYR 40 -5.928 4.850 0.465 293 HE1 TYR 40 HE1 TYR 40 -2.091 1.945 -0.573 294 HE2 TYR 40 HE2 TYR 40 -3.957 4.853 1.932 295 HH TYR 40 HH TYR 40 -1.004 3.463 1.069 296 H ILE 41 H ILE 41 -7.256 0.711 -3.336 297 HA ILE 41 HA ILE 41 -6.085 -1.398 -1.640 298 HB ILE 41 HB ILE 41 -7.535 -1.751 -4.276 299 1HG1 ILE 41 1HG1 ILE 41 -9.153 -3.025 -2.641 300 2HG1 ILE 41 2HG1 ILE 41 -8.451 -1.962 -1.427 301 1HG2 ILE 41 1HG2 ILE 41 -6.513 -3.783 -2.296 302 2HG2 ILE 41 2HG2 ILE 41 -5.843 -3.449 -3.892 303 3HG2 ILE 41 3HG2 ILE 41 -7.457 -4.141 -3.742 304 1HD1 ILE 41 1HD1 ILE 41 -9.872 -1.078 -3.929 305 2HD1 ILE 41 2HD1 ILE 41 -9.182 -0.018 -2.698 306 3HD1 ILE 41 3HD1 ILE 41 -10.536 -1.073 -2.293 307 H TYR 42 H TYR 42 -3.985 -1.574 -1.888 308 HA TYR 42 HA TYR 42 -2.712 -0.799 -4.408 309 1HB TYR 42 1HB TYR 42 -1.950 -0.005 -2.063 310 2HB TYR 42 2HB TYR 42 -1.309 -1.632 -1.870 311 HD1 TYR 42 HD1 TYR 42 0.244 -2.416 -3.911 312 HD2 TYR 42 HD2 TYR 42 -0.542 1.619 -2.831 313 HE1 TYR 42 HE1 TYR 42 2.307 -1.718 -5.054 314 HE2 TYR 42 HE2 TYR 42 1.513 2.331 -3.976 315 HH TYR 42 HH TYR 42 3.481 0.033 -5.824 316 H TYR 43 H TYR 43 -2.431 -2.398 -5.861 317 HA TYR 43 HA TYR 43 -2.227 -5.145 -4.919 318 1HB TYR 43 1HB TYR 43 -2.564 -3.939 -7.662 319 2HB TYR 43 2HB TYR 43 -2.210 -5.651 -7.432 320 HD1 TYR 43 HD1 TYR 43 -4.734 -3.042 -7.172 321 HD2 TYR 43 HD2 TYR 43 -3.846 -7.114 -6.321 322 HE1 TYR 43 HE1 TYR 43 -7.128 -3.481 -6.800 323 HE2 TYR 43 HE2 TYR 43 -6.230 -7.568 -5.952 324 HH TYR 43 HH TYR 43 -8.701 -5.244 -6.718 325 H LEU 44 H LEU 44 -0.403 -6.113 -4.575 326 HA LEU 44 HA LEU 44 2.074 -4.753 -5.252 327 1HB LEU 44 1HB LEU 44 1.470 -7.114 -3.487 328 2HB LEU 44 2HB LEU 44 3.093 -6.523 -3.794 329 HG LEU 44 HG LEU 44 0.896 -4.892 -2.523 330 1HD1 LEU 44 1HD1 LEU 44 2.146 -5.246 -0.452 331 2HD1 LEU 44 2HD1 LEU 44 3.227 -6.347 -1.309 332 3HD1 LEU 44 3HD1 LEU 44 1.523 -6.755 -1.116 333 1HD2 LEU 44 1HD2 LEU 44 2.640 -3.601 -3.709 334 2HD2 LEU 44 2HD2 LEU 44 3.866 -4.400 -2.720 335 3HD2 LEU 44 3HD2 LEU 44 2.668 -3.350 -1.963 336 H ALA 45 H ALA 45 2.753 -5.115 -7.154 337 HA ALA 45 HA ALA 45 4.060 -7.088 -8.312 338 1HB ALA 45 1HB ALA 45 2.562 -8.480 -9.655 339 2HB ALA 45 2HB ALA 45 1.159 -7.716 -8.909 340 3HB ALA 45 3HB ALA 45 2.243 -8.710 -7.936 341 H THR 46 H THR 46 0.940 -5.847 -9.471 342 HA THR 46 HA THR 46 2.212 -4.724 -11.813 343 HB THR 46 HB THR 46 -0.164 -3.957 -12.318 344 HG1 THR 46 HG1 THR 46 -1.742 -5.197 -10.998 345 1HG2 THR 46 1HG2 THR 46 -0.939 -6.231 -12.880 346 2HG2 THR 46 2HG2 THR 46 0.334 -6.902 -11.861 347 3HG2 THR 46 3HG2 THR 46 0.755 -5.982 -13.306 348 H GLU 47 H GLU 47 1.513 -3.767 -8.670 349 HA GLU 47 HA GLU 47 1.659 -1.831 -7.513 350 1HB GLU 47 1HB GLU 47 2.962 -0.754 -10.024 351 2HB GLU 47 2HB GLU 47 3.030 -0.019 -8.427 352 1HG GLU 47 1HG GLU 47 4.232 -2.643 -9.273 353 2HG GLU 47 2HG GLU 47 5.087 -1.166 -8.829 354 H ASN 48 H ASN 48 -0.637 -2.466 -9.124 355 HA ASN 48 HA ASN 48 -1.662 0.085 -10.059 356 1HB ASN 48 1HB ASN 48 -2.729 -2.722 -10.031 357 2HB ASN 48 2HB ASN 48 -3.814 -1.367 -10.311 358 1HD2 ASN 48 1HD2 ASN 48 -0.477 -1.474 -11.398 359 2HD2 ASN 48 2HD2 ASN 48 -0.844 -1.564 -13.085 360 H VAL 49 H VAL 49 -2.266 1.490 -8.593 361 HA VAL 49 HA VAL 49 -3.368 0.563 -6.044 362 HB VAL 49 HB VAL 49 -2.851 3.436 -6.771 363 1HG1 VAL 49 1HG1 VAL 49 -4.100 2.984 -4.725 364 2HG1 VAL 49 2HG1 VAL 49 -2.519 3.678 -4.365 365 3HG1 VAL 49 3HG1 VAL 49 -2.793 1.950 -4.146 366 1HG2 VAL 49 1HG2 VAL 49 -0.803 2.221 -7.300 367 2HG2 VAL 49 2HG2 VAL 49 -0.815 1.485 -5.698 368 3HG2 VAL 49 3HG2 VAL 49 -0.589 3.226 -5.867 369 H HIS 50 H HIS 50 -5.516 0.354 -5.919 370 HA HIS 50 HA HIS 50 -7.187 1.998 -7.693 371 1HB HIS 50 1HB HIS 50 -7.784 -0.532 -6.145 372 2HB HIS 50 2HB HIS 50 -9.024 0.405 -6.966 373 HD1 HIS 50 HD1 HIS 50 -9.655 -0.779 -9.038 374 HD2 HIS 50 HD2 HIS 50 -5.553 -0.991 -8.332 375 HE1 HIS 50 HE1 HIS 50 -8.688 -2.026 -10.998 376 HE2 HIS 50 HE2 HIS 50 -6.232 -2.271 -10.489 377 H ILE 51 H ILE 51 -7.437 3.933 -6.685 378 HA ILE 51 HA ILE 51 -8.042 3.998 -3.833 379 HB ILE 51 HB ILE 51 -7.701 6.295 -5.780 380 1HG1 ILE 51 1HG1 ILE 51 -5.623 6.666 -4.252 381 2HG1 ILE 51 2HG1 ILE 51 -5.832 4.970 -3.832 382 1HG2 ILE 51 1HG2 ILE 51 -7.636 7.721 -3.788 383 2HG2 ILE 51 2HG2 ILE 51 -7.992 6.317 -2.781 384 3HG2 ILE 51 3HG2 ILE 51 -9.182 6.886 -3.951 385 1HD1 ILE 51 1HD1 ILE 51 -4.185 5.286 -5.597 386 2HD1 ILE 51 2HD1 ILE 51 -5.417 6.038 -6.611 387 3HD1 ILE 51 3HD1 ILE 51 -5.565 4.341 -6.152 388 H VAL 52 H VAL 52 -10.093 3.627 -3.295 389 HA VAL 52 HA VAL 52 -12.236 4.491 -5.072 390 HB VAL 52 HB VAL 52 -12.491 3.035 -2.435 391 1HG1 VAL 52 1HG1 VAL 52 -14.398 3.426 -4.741 392 2HG1 VAL 52 2HG1 VAL 52 -14.537 4.124 -3.125 393 3HG1 VAL 52 3HG1 VAL 52 -14.695 2.382 -3.351 394 1HG2 VAL 52 1HG2 VAL 52 -12.362 1.889 -5.224 395 2HG2 VAL 52 2HG2 VAL 52 -12.738 0.983 -3.759 396 3HG2 VAL 52 3HG2 VAL 52 -11.140 1.702 -3.967 397 H LEU 53 H LEU 53 -12.531 6.631 -4.890 398 HA LEU 53 HA LEU 53 -12.165 8.094 -2.490 399 1HB LEU 53 1HB LEU 53 -13.676 8.857 -4.985 400 2HB LEU 53 2HB LEU 53 -13.195 9.959 -3.709 401 HG LEU 53 HG LEU 53 -11.325 8.429 -5.517 402 1HD1 LEU 53 1HD1 LEU 53 -12.492 10.214 -6.680 403 2HD1 LEU 53 2HD1 LEU 53 -10.794 10.629 -6.445 404 3HD1 LEU 53 3HD1 LEU 53 -12.029 11.359 -5.419 405 1HD2 LEU 53 1HD2 LEU 53 -10.747 10.465 -3.366 406 2HD2 LEU 53 2HD2 LEU 53 -9.564 9.788 -4.484 407 3HD2 LEU 53 3HD2 LEU 53 -10.362 8.743 -3.308 408 H LYS 54 H LYS 54 -13.890 9.429 -1.487 409 HA LYS 54 HA LYS 54 -15.970 7.773 -0.517 410 1HB LYS 54 1HB LYS 54 -14.890 9.553 0.806 411 2HB LYS 54 2HB LYS 54 -15.603 10.764 -0.251 412 1HG LYS 54 1HG LYS 54 -17.789 10.262 0.513 413 2HG LYS 54 2HG LYS 54 -17.230 8.820 1.364 414 1HD LYS 54 1HD LYS 54 -15.989 10.156 2.924 415 2HD LYS 54 2HD LYS 54 -16.351 11.628 2.018 416 1HE LYS 54 1HE LYS 54 -18.436 9.871 3.299 417 2HE LYS 54 2HE LYS 54 -17.744 11.299 4.066 418 1HZ LYS 54 1HZ LYS 54 -19.253 11.268 1.504 419 2HZ LYS 54 2HZ LYS 54 -18.577 12.641 2.236 420 3HZ LYS 54 3HZ LYS 54 -19.840 11.805 3.001 421 H ASN 55 H ASN 55 -15.696 9.858 -3.190 422 HA ASN 55 HA ASN 55 -18.532 10.214 -3.637 423 1HB ASN 55 1HB ASN 55 -16.820 11.895 -4.337 424 2HB ASN 55 2HB ASN 55 -16.177 10.727 -5.480 425 1HD2 ASN 55 1HD2 ASN 55 -18.839 12.857 -4.740 426 2HD2 ASN 55 2HD2 ASN 55 -19.525 12.859 -6.330 427 H ASP 56 H ASP 56 -16.703 7.592 -3.678 428 HA ASP 56 HA ASP 56 -17.027 5.479 -4.436 429 1HB ASP 56 1HB ASP 56 -19.424 5.890 -4.594 430 2HB ASP 56 2HB ASP 56 -19.212 6.655 -6.165 431 H ASN 57 H ASN 57 -16.261 8.110 -6.388 432 HA ASN 57 HA ASN 57 -15.647 6.823 -8.819 433 1HB ASN 57 1HB ASN 57 -15.876 9.290 -8.543 434 2HB ASN 57 2HB ASN 57 -14.362 9.300 -7.648 435 1HD2 ASN 57 1HD2 ASN 57 -12.424 9.004 -8.748 436 2HD2 ASN 57 2HD2 ASN 57 -12.318 9.117 -10.471 437 H THR 58 H THR 58 -14.345 5.118 -8.879 438 HA THR 58 HA THR 58 -12.066 4.937 -7.086 439 HB THR 58 HB THR 58 -12.961 2.960 -9.192 440 HG1 THR 58 HG1 THR 58 -14.378 3.618 -7.202 441 1HG2 THR 58 1HG2 THR 58 -11.200 2.643 -6.758 442 2HG2 THR 58 2HG2 THR 58 -10.652 2.659 -8.434 443 3HG2 THR 58 3HG2 THR 58 -11.685 1.350 -7.857 444 H VAL 59 H VAL 59 -10.201 5.789 -7.623 445 HA VAL 59 HA VAL 59 -9.499 6.126 -10.456 446 HB VAL 59 HB VAL 59 -8.041 7.263 -8.064 447 1HG1 VAL 59 1HG1 VAL 59 -7.153 8.860 -9.713 448 2HG1 VAL 59 2HG1 VAL 59 -8.008 7.994 -10.989 449 3HG1 VAL 59 3HG1 VAL 59 -6.719 7.193 -10.089 450 1HG2 VAL 59 1HG2 VAL 59 -9.211 9.363 -8.470 451 2HG2 VAL 59 2HG2 VAL 59 -10.340 8.074 -8.051 452 3HG2 VAL 59 3HG2 VAL 59 -10.174 8.590 -9.728 453 H LEU 60 H LEU 60 -8.377 4.462 -11.269 454 HA LEU 60 HA LEU 60 -6.651 2.931 -9.480 455 1HB LEU 60 1HB LEU 60 -6.575 1.219 -11.191 456 2HB LEU 60 2HB LEU 60 -8.230 1.628 -10.808 457 HG LEU 60 HG LEU 60 -6.829 2.762 -13.222 458 1HD1 LEU 60 1HD1 LEU 60 -8.469 0.239 -13.036 459 2HD1 LEU 60 2HD1 LEU 60 -6.740 0.333 -13.366 460 3HD1 LEU 60 3HD1 LEU 60 -7.896 0.989 -14.526 461 1HD2 LEU 60 1HD2 LEU 60 -9.747 2.350 -12.572 462 2HD2 LEU 60 2HD2 LEU 60 -9.097 3.091 -14.037 463 3HD2 LEU 60 3HD2 LEU 60 -8.884 3.885 -12.478 464 H LEU 61 H LEU 61 -4.582 3.260 -9.416 465 HA LEU 61 HA LEU 61 -3.290 4.771 -11.582 466 1HB LEU 61 1HB LEU 61 -2.166 4.168 -8.855 467 2HB LEU 61 2HB LEU 61 -1.602 5.363 -10.005 468 HG LEU 61 HG LEU 61 -4.235 5.496 -8.536 469 1HD1 LEU 61 1HD1 LEU 61 -1.659 6.991 -8.070 470 2HD1 LEU 61 2HD1 LEU 61 -2.330 5.735 -7.030 471 3HD1 LEU 61 3HD1 LEU 61 -3.184 7.263 -7.232 472 1HD2 LEU 61 1HD2 LEU 61 -4.307 7.795 -9.367 473 2HD2 LEU 61 2HD2 LEU 61 -4.283 6.634 -10.695 474 3HD2 LEU 61 3HD2 LEU 61 -2.818 7.519 -10.270 475 H LYS 62 H LYS 62 -2.573 3.283 -13.067 476 HA LYS 62 HA LYS 62 -1.199 0.908 -12.220 477 1HB LYS 62 1HB LYS 62 -0.534 0.788 -14.680 478 2HB LYS 62 2HB LYS 62 -2.249 0.688 -14.316 479 1HG LYS 62 1HG LYS 62 -2.443 3.107 -14.879 480 2HG LYS 62 2HG LYS 62 -0.755 3.068 -15.397 481 1HD LYS 62 1HD LYS 62 -1.285 1.368 -17.062 482 2HD LYS 62 2HD LYS 62 -2.964 1.342 -16.519 483 1HE LYS 62 1HE LYS 62 -3.186 3.705 -17.166 484 2HE LYS 62 2HE LYS 62 -1.523 3.684 -17.755 485 1HZ LYS 62 1HZ LYS 62 -3.758 2.022 -18.801 486 2HZ LYS 62 2HZ LYS 62 -2.159 1.975 -19.358 487 3HZ LYS 62 3HZ LYS 62 -3.085 3.379 -19.564 488 H GLY 63 H GLY 63 0.491 1.345 -10.973 489 1HA GLY 63 1HA GLY 63 2.094 3.605 -11.027 490 2HA GLY 63 2HA GLY 63 2.548 2.075 -10.299 491 H LEU 64 H LEU 64 3.362 0.401 -11.888 492 HA LEU 64 HA LEU 64 5.130 1.761 -13.807 493 1HB LEU 64 1HB LEU 64 5.564 -0.767 -12.217 494 2HB LEU 64 2HB LEU 64 6.593 -0.290 -13.548 495 HG LEU 64 HG LEU 64 7.737 0.346 -11.585 496 1HD1 LEU 64 1HD1 LEU 64 7.869 2.770 -11.735 497 2HD1 LEU 64 2HD1 LEU 64 6.356 2.805 -12.639 498 3HD1 LEU 64 3HD1 LEU 64 7.778 2.033 -13.337 499 1HD2 LEU 64 1HD2 LEU 64 5.881 0.180 -10.012 500 2HD2 LEU 64 2HD2 LEU 64 5.205 1.684 -10.638 501 3HD2 LEU 64 3HD2 LEU 64 6.758 1.697 -9.805 502 H LYS 65 H LYS 65 4.300 -1.665 -13.446 503 HA LYS 65 HA LYS 65 2.540 -1.829 -15.633 504 1HB LYS 65 1HB LYS 65 4.615 -1.294 -16.902 505 2HB LYS 65 2HB LYS 65 5.361 -2.740 -16.239 506 1HG LYS 65 1HG LYS 65 3.632 -4.108 -17.329 507 2HG LYS 65 2HG LYS 65 2.952 -2.643 -18.042 508 1HD LYS 65 1HD LYS 65 5.096 -2.215 -19.167 509 2HD LYS 65 2HD LYS 65 5.737 -3.712 -18.490 510 1HE LYS 65 1HE LYS 65 3.971 -4.964 -19.665 511 2HE LYS 65 2HE LYS 65 3.404 -3.456 -20.380 512 1HZ LYS 65 1HZ LYS 65 5.623 -3.197 -21.389 513 2HZ LYS 65 2HZ LYS 65 4.802 -4.576 -21.940 514 3HZ LYS 65 3HZ LYS 65 6.050 -4.729 -20.800 515 H ASN 66 H ASN 66 5.284 -3.897 -14.698 516 HA ASN 66 HA ASN 66 3.594 -5.696 -13.213 517 1HB ASN 66 1HB ASN 66 3.098 -6.446 -15.485 518 2HB ASN 66 2HB ASN 66 4.816 -6.578 -15.841 519 1HD2 ASN 66 1HD2 ASN 66 4.749 -8.728 -16.325 520 2HD2 ASN 66 2HD2 ASN 66 4.487 -9.960 -15.129 521 H ILE 67 H ILE 67 4.898 -5.770 -11.488 522 HA ILE 67 HA ILE 67 7.680 -6.664 -11.918 523 HB ILE 67 HB ILE 67 6.623 -5.085 -9.560 524 1HG1 ILE 67 1HG1 ILE 67 6.724 -3.685 -11.572 525 2HG1 ILE 67 2HG1 ILE 67 7.963 -3.208 -10.415 526 1HG2 ILE 67 1HG2 ILE 67 9.425 -5.950 -10.264 527 2HG2 ILE 67 2HG2 ILE 67 8.431 -6.563 -8.943 528 3HG2 ILE 67 3HG2 ILE 67 8.991 -4.890 -8.924 529 1HD1 ILE 67 1HD1 ILE 67 8.841 -3.180 -12.664 530 2HD1 ILE 67 2HD1 ILE 67 8.381 -4.868 -12.890 531 3HD1 ILE 67 3HD1 ILE 67 9.629 -4.443 -11.719 532 H VAL 68 H VAL 68 7.195 -8.861 -11.810 533 HA VAL 68 HA VAL 68 5.532 -9.834 -9.666 534 HB VAL 68 HB VAL 68 5.233 -10.897 -11.786 535 1HG1 VAL 68 1HG1 VAL 68 8.137 -11.687 -11.663 536 2HG1 VAL 68 2HG1 VAL 68 7.416 -10.520 -12.774 537 3HG1 VAL 68 3HG1 VAL 68 6.975 -12.226 -12.874 538 1HG2 VAL 68 1HG2 VAL 68 4.901 -12.299 -9.846 539 2HG2 VAL 68 2HG2 VAL 68 6.607 -12.747 -9.844 540 3HG2 VAL 68 3HG2 VAL 68 5.564 -13.255 -11.174 541 H SER 69 H SER 69 6.683 -9.325 -7.839 542 HA SER 69 HA SER 69 9.007 -11.059 -7.334 543 1HB SER 69 1HB SER 69 9.391 -9.559 -5.352 544 2HB SER 69 2HB SER 69 9.526 -8.731 -6.903 545 HG SER 69 HG SER 69 7.192 -8.765 -5.285 546 H VAL 70 H VAL 70 5.893 -11.289 -7.243 547 HA VAL 70 HA VAL 70 5.380 -11.970 -4.480 548 HB VAL 70 HB VAL 70 3.553 -12.370 -6.854 549 1HG1 VAL 70 1HG1 VAL 70 2.888 -13.566 -4.840 550 2HG1 VAL 70 2HG1 VAL 70 1.773 -12.242 -5.178 551 3HG1 VAL 70 3HG1 VAL 70 2.986 -12.074 -3.908 552 1HG2 VAL 70 1HG2 VAL 70 4.288 -10.038 -6.755 553 2HG2 VAL 70 2HG2 VAL 70 3.787 -9.952 -5.066 554 3HG2 VAL 70 3HG2 VAL 70 2.582 -10.197 -6.331 555 H LYS 71 H LYS 71 5.262 -13.972 -3.648 556 HA LYS 71 HA LYS 71 5.787 -16.211 -5.490 557 1HB LYS 71 1HB LYS 71 6.577 -16.004 -2.578 558 2HB LYS 71 2HB LYS 71 6.949 -17.333 -3.668 559 1HG LYS 71 1HG LYS 71 8.214 -15.674 -5.078 560 2HG LYS 71 2HG LYS 71 8.008 -14.527 -3.755 561 1HD LYS 71 1HD LYS 71 10.169 -15.624 -3.608 562 2HD LYS 71 2HD LYS 71 9.148 -16.081 -2.243 563 1HE LYS 71 1HE LYS 71 10.339 -18.013 -3.156 564 2HE LYS 71 2HE LYS 71 8.594 -18.183 -3.342 565 1HZ LYS 71 1HZ LYS 71 8.859 -17.392 -5.659 566 2HZ LYS 71 2HZ LYS 71 9.655 -18.853 -5.356 567 3HZ LYS 71 3HZ LYS 71 10.542 -17.412 -5.453 568 H PHE 72 H PHE 72 4.863 -18.274 -4.885 569 HA PHE 72 HA PHE 72 2.191 -18.005 -3.880 570 1HB PHE 72 1HB PHE 72 3.771 -20.412 -4.795 571 2HB PHE 72 2HB PHE 72 2.098 -20.497 -4.251 572 HD1 PHE 72 HD1 PHE 72 4.346 -19.423 -6.922 573 HD2 PHE 72 HD2 PHE 72 0.307 -19.566 -5.585 574 HE1 PHE 72 HE1 PHE 72 3.575 -18.870 -9.194 575 HE2 PHE 72 HE2 PHE 72 -0.467 -19.015 -7.853 576 HZ PHE 72 HZ PHE 72 1.167 -18.666 -9.660 577 H SER 73 H SER 73 2.642 -17.254 -1.784 578 HA SER 73 HA SER 73 2.900 -19.371 0.166 579 1HB SER 73 1HB SER 73 4.858 -17.050 0.112 580 2HB SER 73 2HB SER 73 4.711 -18.220 1.424 581 HG SER 73 HG SER 73 4.989 -19.526 -0.900 582 H LYS 74 H LYS 74 2.430 -18.514 2.385 583 HA LYS 74 HA LYS 74 1.344 -15.822 2.475 584 1HB LYS 74 1HB LYS 74 -0.746 -16.586 3.595 585 2HB LYS 74 2HB LYS 74 -0.641 -17.057 1.905 586 1HG LYS 74 1HG LYS 74 -0.158 -19.311 2.481 587 2HG LYS 74 2HG LYS 74 0.063 -18.894 4.182 588 1HD LYS 74 1HD LYS 74 -2.337 -18.155 4.203 589 2HD LYS 74 2HD LYS 74 -2.495 -18.853 2.591 590 1HE LYS 74 1HE LYS 74 -1.916 -21.039 3.431 591 2HE LYS 74 2HE LYS 74 -1.591 -20.373 5.032 592 1HZ LYS 74 1HZ LYS 74 -3.962 -19.687 5.102 593 2HZ LYS 74 2HZ LYS 74 -3.736 -21.361 5.063 594 3HZ LYS 74 3HZ LYS 74 -4.218 -20.541 3.660 595 H ASP 75 H ASP 75 3.049 -15.315 3.798 596 HA ASP 75 HA ASP 75 3.180 -16.759 6.367 597 1HB ASP 75 1HB ASP 75 5.144 -17.129 4.862 598 2HB ASP 75 2HB ASP 75 5.471 -15.401 4.931 599 H ARG 76 H ARG 76 2.574 -15.557 8.039 600 HA ARG 76 HA ARG 76 2.265 -12.707 7.786 601 1HB ARG 76 1HB ARG 76 0.732 -14.277 9.089 602 2HB ARG 76 2HB ARG 76 1.986 -14.317 10.321 603 1HG ARG 76 1HG ARG 76 1.766 -11.696 10.131 604 2HG ARG 76 2HG ARG 76 0.156 -12.117 9.543 605 1HD ARG 76 1HD ARG 76 -0.064 -11.826 11.875 606 2HD ARG 76 2HD ARG 76 -0.065 -13.570 11.607 607 HE ARG 76 HE ARG 76 2.322 -12.077 12.507 608 1HH1 ARG 76 1HH1 ARG 76 0.162 -14.824 12.732 609 2HH1 ARG 76 2HH1 ARG 76 1.143 -15.658 13.906 610 1HH2 ARG 76 1HH2 ARG 76 3.596 -13.130 14.059 611 2HH2 ARG 76 2HH2 ARG 76 3.112 -14.701 14.650 612 H HIS 77 H HIS 77 4.624 -14.885 9.076 613 HA HIS 77 HA HIS 77 5.756 -13.157 11.020 614 1HB HIS 77 1HB HIS 77 6.081 -15.577 11.103 615 2HB HIS 77 2HB HIS 77 6.957 -15.533 9.580 616 HD1 HIS 77 HD1 HIS 77 7.294 -14.333 13.167 617 HD2 HIS 77 HD2 HIS 77 9.646 -15.142 9.826 618 HE1 HIS 77 HE1 HIS 77 9.679 -14.142 13.949 619 HE2 HIS 77 HE2 HIS 77 11.084 -14.771 11.947 620 H LEU 78 H LEU 78 6.490 -13.794 7.618 621 HA LEU 78 HA LEU 78 8.764 -12.134 7.461 622 1HB LEU 78 1HB LEU 78 8.117 -13.779 5.730 623 2HB LEU 78 2HB LEU 78 6.760 -12.758 5.291 624 HG LEU 78 HG LEU 78 8.278 -11.003 4.537 625 1HD1 LEU 78 1HD1 LEU 78 10.100 -11.359 6.108 626 2HD1 LEU 78 2HD1 LEU 78 10.696 -11.397 4.450 627 3HD1 LEU 78 3HD1 LEU 78 10.480 -12.903 5.344 628 1HD2 LEU 78 1HD2 LEU 78 7.613 -12.712 2.944 629 2HD2 LEU 78 2HD2 LEU 78 8.978 -13.718 3.427 630 3HD2 LEU 78 3HD2 LEU 78 9.262 -12.173 2.625 631 H ILE 79 H ILE 79 5.321 -11.469 6.910 632 HA ILE 79 HA ILE 79 5.512 -8.752 6.264 633 HB ILE 79 HB ILE 79 3.339 -10.037 7.932 634 1HG1 ILE 79 1HG1 ILE 79 3.474 -9.739 4.925 635 2HG1 ILE 79 2HG1 ILE 79 3.779 -11.242 5.792 636 1HG2 ILE 79 1HG2 ILE 79 3.311 -7.585 6.173 637 2HG2 ILE 79 2HG2 ILE 79 3.273 -7.601 7.936 638 3HG2 ILE 79 3HG2 ILE 79 1.917 -8.260 7.022 639 1HD1 ILE 79 1HD1 ILE 79 1.530 -11.175 4.873 640 2HD1 ILE 79 2HD1 ILE 79 1.190 -9.708 5.794 641 3HD1 ILE 79 3HD1 ILE 79 1.499 -11.227 6.637 642 H GLU 80 H GLU 80 5.047 -10.321 9.394 643 HA GLU 80 HA GLU 80 5.059 -8.140 11.092 644 1HB GLU 80 1HB GLU 80 4.597 -10.566 11.626 645 2HB GLU 80 2HB GLU 80 6.332 -10.820 11.660 646 1HG GLU 80 1HG GLU 80 6.517 -9.208 13.500 647 2HG GLU 80 2HG GLU 80 4.763 -9.010 13.478 648 H THR 81 H THR 81 7.793 -10.006 9.849 649 HA THR 81 HA THR 81 9.797 -8.552 11.245 650 HB THR 81 HB THR 81 10.108 -10.171 8.704 651 HG1 THR 81 HG1 THR 81 9.144 -11.393 10.407 652 1HG2 THR 81 1HG2 THR 81 12.091 -9.449 10.870 653 2HG2 THR 81 2HG2 THR 81 12.054 -8.782 9.238 654 3HG2 THR 81 3HG2 THR 81 12.413 -10.491 9.482 655 H THR 82 H THR 82 8.303 -8.230 8.065 656 HA THR 82 HA THR 82 10.106 -6.298 7.049 657 HB THR 82 HB THR 82 7.220 -6.777 6.259 658 HG1 THR 82 HG1 THR 82 8.407 -8.668 5.980 659 1HG2 THR 82 1HG2 THR 82 9.495 -5.515 4.727 660 2HG2 THR 82 2HG2 THR 82 8.126 -4.648 5.425 661 3HG2 THR 82 3HG2 THR 82 7.865 -5.804 4.118 662 H SER 83 H SER 83 7.035 -6.054 8.817 663 HA SER 83 HA SER 83 6.726 -3.280 8.718 664 1HB SER 83 1HB SER 83 5.996 -5.142 10.992 665 2HB SER 83 2HB SER 83 5.321 -3.538 10.704 666 HG SER 83 HG SER 83 4.293 -4.280 8.914 667 H ASN 84 H ASN 84 8.476 -5.309 11.060 668 HA ASN 84 HA ASN 84 9.412 -3.102 12.602 669 1HB ASN 84 1HB ASN 84 9.273 -5.452 13.459 670 2HB ASN 84 2HB ASN 84 10.635 -5.865 12.422 671 1HD2 ASN 84 1HD2 ASN 84 12.039 -6.371 14.046 672 2HD2 ASN 84 2HD2 ASN 84 12.679 -5.205 15.151 673 H LYS 85 H LYS 85 10.557 -4.758 9.758 674 HA LYS 85 HA LYS 85 13.209 -3.807 9.737 675 1HB LYS 85 1HB LYS 85 12.294 -5.639 8.294 676 2HB LYS 85 2HB LYS 85 11.462 -4.419 7.345 677 1HG LYS 85 1HG LYS 85 13.559 -3.458 6.654 678 2HG LYS 85 2HG LYS 85 14.447 -4.565 7.704 679 1HD LYS 85 1HD LYS 85 12.730 -5.352 5.347 680 2HD LYS 85 2HD LYS 85 14.494 -5.313 5.370 681 1HE LYS 85 1HE LYS 85 14.481 -7.013 7.154 682 2HE LYS 85 2HE LYS 85 12.722 -7.065 7.076 683 1HZ LYS 85 1HZ LYS 85 14.573 -7.773 4.863 684 2HZ LYS 85 2HZ LYS 85 12.881 -7.822 4.783 685 3HZ LYS 85 3HZ LYS 85 13.710 -8.876 5.824 686 H LEU 86 H LEU 86 10.211 -2.500 8.373 687 HA LEU 86 HA LEU 86 11.359 -0.118 7.330 688 1HB LEU 86 1HB LEU 86 9.166 -0.974 6.620 689 2HB LEU 86 2HB LEU 86 8.526 -0.684 8.224 690 HG LEU 86 HG LEU 86 9.026 1.772 7.857 691 1HD1 LEU 86 1HD1 LEU 86 9.291 2.532 5.564 692 2HD1 LEU 86 2HD1 LEU 86 9.341 0.862 5.001 693 3HD1 LEU 86 3HD1 LEU 86 10.634 1.486 6.027 694 1HD2 LEU 86 1HD2 LEU 86 7.053 0.420 6.023 695 2HD2 LEU 86 2HD2 LEU 86 7.027 2.123 6.479 696 3HD2 LEU 86 3HD2 LEU 86 6.773 0.879 7.703 697 H LYS 87 H LYS 87 9.992 -1.034 10.415 698 HA LYS 87 HA LYS 87 9.894 1.475 11.659 699 1HB LYS 87 1HB LYS 87 8.745 -0.381 12.621 700 2HB LYS 87 2HB LYS 87 10.218 -1.331 12.717 701 1HG LYS 87 1HG LYS 87 9.769 -0.666 14.907 702 2HG LYS 87 2HG LYS 87 11.058 0.407 14.360 703 1HD LYS 87 1HD LYS 87 9.449 2.172 13.941 704 2HD LYS 87 2HD LYS 87 8.121 1.097 14.389 705 1HE LYS 87 1HE LYS 87 10.356 2.027 16.188 706 2HE LYS 87 2HE LYS 87 8.681 2.575 16.237 707 1HZ LYS 87 1HZ LYS 87 9.477 -0.257 16.651 708 2HZ LYS 87 2HZ LYS 87 7.961 0.446 16.952 709 3HZ LYS 87 3HZ LYS 87 9.294 0.850 17.920 710 H SER 88 H SER 88 12.431 -1.023 11.758 711 HA SER 88 HA SER 88 14.128 0.660 13.368 712 1HB SER 88 1HB SER 88 14.664 -2.052 12.139 713 2HB SER 88 2HB SER 88 15.659 -1.254 13.356 714 HG SER 88 HG SER 88 13.623 -1.226 14.640 715 H ARG 89 H ARG 89 14.401 -0.777 10.095 716 HA ARG 89 HA ARG 89 16.869 0.750 9.731 717 1HB ARG 89 1HB ARG 89 16.939 -1.649 9.261 718 2HB ARG 89 2HB ARG 89 15.667 -1.465 8.063 719 1HG ARG 89 1HG ARG 89 17.093 -0.235 6.616 720 2HG ARG 89 2HG ARG 89 18.333 -0.091 7.867 721 1HD ARG 89 1HD ARG 89 17.398 -2.678 6.633 722 2HD ARG 89 2HD ARG 89 18.869 -1.813 6.179 723 HE ARG 89 HE ARG 89 19.262 -2.117 8.786 724 1HH1 ARG 89 1HH1 ARG 89 18.156 -4.452 6.401 725 2HH1 ARG 89 2HH1 ARG 89 18.853 -5.804 7.243 726 1HH2 ARG 89 1HH2 ARG 89 20.145 -3.877 9.876 727 2HH2 ARG 89 2HH2 ARG 89 19.954 -5.484 9.239 728 H GLU 90 H GLU 90 13.597 0.693 8.682 729 HA GLU 90 HA GLU 90 12.361 2.169 7.502 730 1HB GLU 90 1HB GLU 90 14.938 3.721 7.246 731 2HB GLU 90 2HB GLU 90 13.384 4.285 6.644 732 1HG GLU 90 1HG GLU 90 12.497 4.149 8.953 733 2HG GLU 90 2HG GLU 90 14.120 3.733 9.509 734 H ILE 91 H ILE 91 15.457 1.355 6.001 735 HA ILE 91 HA ILE 91 16.065 0.935 3.845 736 HB ILE 91 HB ILE 91 14.776 -0.842 2.722 737 1HG1 ILE 91 1HG1 ILE 91 12.803 -0.501 4.999 738 2HG1 ILE 91 2HG1 ILE 91 12.494 -0.126 3.307 739 1HG2 ILE 91 1HG2 ILE 91 15.037 -2.539 4.459 740 2HG2 ILE 91 2HG2 ILE 91 15.165 -1.269 5.677 741 3HG2 ILE 91 3HG2 ILE 91 16.397 -1.417 4.422 742 1HD1 ILE 91 1HD1 ILE 91 12.766 -2.488 2.741 743 2HD1 ILE 91 2HD1 ILE 91 11.488 -2.239 3.932 744 3HD1 ILE 91 3HD1 ILE 91 13.061 -2.857 4.439 745 H THR 92 H THR 92 14.190 0.353 1.608 746 HA THR 92 HA THR 92 13.034 3.029 1.226 747 HB THR 92 HB THR 92 14.107 1.174 -0.918 748 HG1 THR 92 HG1 THR 92 15.757 2.166 0.362 749 1HG2 THR 92 1HG2 THR 92 12.275 2.567 -1.732 750 2HG2 THR 92 2HG2 THR 92 13.808 3.107 -2.415 751 3HG2 THR 92 3HG2 THR 92 13.064 4.008 -1.093 752 H PHE 93 H PHE 93 11.001 3.104 0.137 753 HA PHE 93 HA PHE 93 9.151 1.230 1.050 754 1HB PHE 93 1HB PHE 93 8.764 3.649 0.337 755 2HB PHE 93 2HB PHE 93 8.704 3.048 -1.314 756 HD1 PHE 93 HD1 PHE 93 7.277 1.752 1.881 757 HD2 PHE 93 HD2 PHE 93 6.544 3.155 -2.066 758 HE1 PHE 93 HE1 PHE 93 4.880 1.292 2.170 759 HE2 PHE 93 HE2 PHE 93 4.143 2.691 -1.786 760 HZ PHE 93 HZ PHE 93 3.310 1.760 0.333 761 H GLN 94 H GLN 94 11.092 1.229 -1.793 762 HA GLN 94 HA GLN 94 9.573 -0.464 -3.447 763 1HB GLN 94 1HB GLN 94 12.583 -0.213 -3.271 764 2HB GLN 94 2HB GLN 94 11.687 -0.921 -4.604 765 1HG GLN 94 1HG GLN 94 11.498 1.954 -3.737 766 2HG GLN 94 2HG GLN 94 12.489 1.356 -5.066 767 1HE2 GLN 94 1HE2 GLN 94 11.461 2.531 -6.622 768 2HE2 GLN 94 2HE2 GLN 94 9.840 2.211 -7.147 769 H GLU 95 H GLU 95 12.303 -1.240 -1.269 770 HA GLU 95 HA GLU 95 12.098 -4.033 -1.559 771 1HB GLU 95 1HB GLU 95 13.166 -2.546 0.844 772 2HB GLU 95 2HB GLU 95 13.512 -4.211 0.406 773 1HG GLU 95 1HG GLU 95 15.405 -3.140 -0.297 774 2HG GLU 95 2HG GLU 95 14.447 -3.167 -1.777 775 H TYR 96 H TYR 96 10.591 -1.772 0.670 776 HA TYR 96 HA TYR 96 9.545 -3.555 2.531 777 1HB TYR 96 1HB TYR 96 9.506 -1.082 2.760 778 2HB TYR 96 2HB TYR 96 8.252 -1.005 1.529 779 HD1 TYR 96 HD1 TYR 96 6.007 -1.083 2.166 780 HD2 TYR 96 HD2 TYR 96 8.980 -2.494 4.861 781 HE1 TYR 96 HE1 TYR 96 4.294 -1.349 3.911 782 HE2 TYR 96 HE2 TYR 96 7.273 -2.763 6.610 783 HH TYR 96 HH TYR 96 3.909 -2.551 5.954 784 H ARG 97 H ARG 97 8.108 -2.410 -0.519 785 HA ARG 97 HA ARG 97 5.744 -3.996 -0.167 786 1HB ARG 97 1HB ARG 97 6.766 -2.686 -2.692 787 2HB ARG 97 2HB ARG 97 5.133 -3.273 -2.408 788 1HG ARG 97 1HG ARG 97 5.014 -1.606 -0.512 789 2HG ARG 97 2HG ARG 97 6.510 -0.922 -1.153 790 1HD ARG 97 1HD ARG 97 3.790 -1.030 -2.414 791 2HD ARG 97 2HD ARG 97 4.814 0.372 -2.115 792 HE ARG 97 HE ARG 97 4.810 -1.289 -4.430 793 1HH1 ARG 97 1HH1 ARG 97 6.971 0.589 -2.405 794 2HH1 ARG 97 2HH1 ARG 97 8.070 0.936 -3.706 795 1HH2 ARG 97 1HH2 ARG 97 6.215 -0.800 -6.115 796 2HH2 ARG 97 2HH2 ARG 97 7.654 0.141 -5.810 797 H ARG 98 H ARG 98 8.882 -4.546 -1.467 798 HA ARG 98 HA ARG 98 8.089 -6.787 -3.091 799 1HB ARG 98 1HB ARG 98 10.562 -5.312 -2.579 800 2HB ARG 98 2HB ARG 98 10.809 -7.044 -2.745 801 1HG ARG 98 1HG ARG 98 11.094 -5.951 -4.880 802 2HG ARG 98 2HG ARG 98 9.677 -6.995 -4.920 803 1HD ARG 98 1HD ARG 98 9.542 -4.024 -4.417 804 2HD ARG 98 2HD ARG 98 9.418 -4.739 -6.021 805 HE ARG 98 HE ARG 98 7.538 -5.671 -3.991 806 1HH1 ARG 98 1HH1 ARG 98 8.120 -3.716 -6.832 807 2HH1 ARG 98 2HH1 ARG 98 6.434 -3.488 -7.176 808 1HH2 ARG 98 1HH2 ARG 98 5.307 -5.364 -4.445 809 2HH2 ARG 98 2HH2 ARG 98 4.837 -4.406 -5.827 810 H ASN 99 H ASN 99 9.438 -6.298 0.137 811 HA ASN 99 HA ASN 99 9.848 -9.042 0.721 812 1HB ASN 99 1HB ASN 99 9.489 -6.592 2.414 813 2HB ASN 99 2HB ASN 99 9.477 -8.179 3.165 814 1HD2 ASN 99 1HD2 ASN 99 11.431 -7.495 0.356 815 2HD2 ASN 99 2HD2 ASN 99 12.959 -7.540 1.168 816 H LEU 100 H LEU 100 7.064 -6.899 0.999 817 HA LEU 100 HA LEU 100 5.374 -8.717 2.354 818 1HB LEU 100 1HB LEU 100 4.705 -6.437 0.487 819 2HB LEU 100 2HB LEU 100 3.535 -7.293 1.475 820 HG LEU 100 HG LEU 100 5.867 -5.710 2.562 821 1HD1 LEU 100 1HD1 LEU 100 2.934 -5.026 2.455 822 2HD1 LEU 100 2HD1 LEU 100 4.203 -4.278 1.486 823 3HD1 LEU 100 3HD1 LEU 100 4.197 -4.077 3.237 824 1HD2 LEU 100 1HD2 LEU 100 5.177 -7.550 4.010 825 2HD2 LEU 100 2HD2 LEU 100 3.506 -6.990 3.934 826 3HD2 LEU 100 3HD2 LEU 100 4.735 -5.993 4.710 827 H ALA 101 H ALA 101 6.030 -8.127 -1.058 828 HA ALA 101 HA ALA 101 4.078 -9.850 -2.131 829 1HB ALA 101 1HB ALA 101 5.421 -9.786 -4.176 830 2HB ALA 101 2HB ALA 101 6.755 -9.062 -3.279 831 3HB ALA 101 3HB ALA 101 5.241 -8.179 -3.470 832 H LYS 102 H LYS 102 7.269 -10.428 -0.820 833 HA LYS 102 HA LYS 102 7.548 -13.104 -1.746 834 1HB LYS 102 1HB LYS 102 8.815 -11.639 0.570 835 2HB LYS 102 2HB LYS 102 9.253 -13.272 0.097 836 1HG LYS 102 1HG LYS 102 9.968 -12.456 -2.084 837 2HG LYS 102 2HG LYS 102 9.512 -10.815 -1.618 838 1HD LYS 102 1HD LYS 102 11.197 -10.703 0.026 839 2HD LYS 102 2HD LYS 102 11.475 -12.445 -0.032 840 1HE LYS 102 1HE LYS 102 12.073 -10.483 -2.241 841 2HE LYS 102 2HE LYS 102 13.258 -11.220 -1.164 842 1HZ LYS 102 1HZ LYS 102 11.581 -12.574 -3.203 843 2HZ LYS 102 2HZ LYS 102 12.464 -13.415 -2.024 844 3HZ LYS 102 3HZ LYS 102 13.273 -12.453 -3.163 845 H ALA 103 H ALA 103 5.997 -11.600 0.974 846 HA ALA 103 HA ALA 103 5.584 -14.055 2.425 847 1HB ALA 103 1HB ALA 103 4.341 -11.334 2.824 848 2HB ALA 103 2HB ALA 103 5.820 -11.912 3.591 849 3HB ALA 103 3HB ALA 103 4.279 -12.685 3.956 850 H GLY 104 H GLY 104 4.240 -12.717 -0.292 851 1HA GLY 104 1HA GLY 104 2.574 -13.822 -1.545 852 2HA GLY 104 2HA GLY 104 1.928 -14.489 -0.055 853 H VAL 105 H VAL 105 2.579 -11.228 0.352 854 HA VAL 105 HA VAL 105 -0.213 -10.579 0.424 855 HB VAL 105 HB VAL 105 2.144 -8.700 0.661 856 1HG1 VAL 105 1HG1 VAL 105 0.074 -7.538 0.152 857 2HG1 VAL 105 2HG1 VAL 105 0.548 -7.235 1.822 858 3HG1 VAL 105 3HG1 VAL 105 -0.746 -8.380 1.467 859 1HG2 VAL 105 1HG2 VAL 105 1.799 -8.902 3.090 860 2HG2 VAL 105 2HG2 VAL 105 2.271 -10.433 2.353 861 3HG2 VAL 105 3HG2 VAL 105 0.589 -10.151 2.799 862 H PHE 106 H PHE 106 -1.357 -10.137 -1.294 863 HA PHE 106 HA PHE 106 -0.028 -8.876 -3.597 864 1HB PHE 106 1HB PHE 106 -0.796 -11.183 -4.017 865 2HB PHE 106 2HB PHE 106 -2.432 -10.714 -3.572 866 HD1 PHE 106 HD1 PHE 106 0.276 -9.905 -5.989 867 HD2 PHE 106 HD2 PHE 106 -3.906 -9.997 -5.203 868 HE1 PHE 106 HE1 PHE 106 -0.172 -9.295 -8.328 869 HE2 PHE 106 HE2 PHE 106 -4.361 -9.391 -7.544 870 HZ PHE 106 HZ PHE 106 -2.495 -9.039 -9.108 871 H ARG 107 H ARG 107 -2.593 -8.699 -1.303 872 HA ARG 107 HA ARG 107 -3.655 -6.337 -2.697 873 1HB ARG 107 1HB ARG 107 -5.295 -8.121 -2.807 874 2HB ARG 107 2HB ARG 107 -5.172 -8.385 -1.073 875 1HG ARG 107 1HG ARG 107 -6.176 -6.251 -0.622 876 2HG ARG 107 2HG ARG 107 -6.161 -5.838 -2.338 877 1HD ARG 107 1HD ARG 107 -7.628 -8.233 -1.257 878 2HD ARG 107 2HD ARG 107 -8.372 -6.640 -1.368 879 HE ARG 107 HE ARG 107 -7.948 -6.772 -3.801 880 1HH1 ARG 107 1HH1 ARG 107 -8.021 -9.723 -1.925 881 2HH1 ARG 107 2HH1 ARG 107 -8.504 -10.720 -3.260 882 1HH2 ARG 107 1HH2 ARG 107 -8.587 -8.060 -5.564 883 2HH2 ARG 107 2HH2 ARG 107 -8.834 -9.770 -5.345 884 H TRP 108 H TRP 108 -2.741 -4.718 -1.660 885 HA TRP 108 HA TRP 108 -2.663 -4.652 1.267 886 1HB TRP 108 1HB TRP 108 -0.618 -4.071 0.061 887 2HB TRP 108 2HB TRP 108 -1.477 -2.866 -0.879 888 HD1 TRP 108 HD1 TRP 108 -2.932 -1.568 1.816 889 HE1 TRP 108 HE1 TRP 108 -1.498 0.018 3.226 890 HE3 TRP 108 HE3 TRP 108 1.712 -3.080 0.277 891 HZ2 TRP 108 HZ2 TRP 108 1.228 0.566 3.641 892 HZ3 TRP 108 HZ3 TRP 108 3.680 -1.955 1.234 893 HH2 TRP 108 HH2 TRP 108 3.439 -0.170 2.881 894 H VAL 109 H VAL 109 -4.580 -3.995 2.119 895 HA VAL 109 HA VAL 109 -5.994 -1.803 0.746 896 HB VAL 109 HB VAL 109 -7.139 -3.795 2.709 897 1HG1 VAL 109 1HG1 VAL 109 -9.311 -2.894 1.999 898 2HG1 VAL 109 2HG1 VAL 109 -8.479 -1.694 1.010 899 3HG1 VAL 109 3HG1 VAL 109 -8.305 -1.666 2.766 900 1HG2 VAL 109 1HG2 VAL 109 -8.298 -4.763 0.784 901 2HG2 VAL 109 2HG2 VAL 109 -6.546 -4.881 0.614 902 3HG2 VAL 109 3HG2 VAL 109 -7.439 -3.656 -0.288 903 H THR 110 H THR 110 -5.294 0.050 1.666 904 HA THR 110 HA THR 110 -5.133 0.220 4.577 905 HB THR 110 HB THR 110 -4.619 2.398 2.540 906 HG1 THR 110 HG1 THR 110 -2.547 1.788 2.544 907 1HG2 THR 110 1HG2 THR 110 -5.151 3.270 4.750 908 2HG2 THR 110 2HG2 THR 110 -3.439 3.506 4.399 909 3HG2 THR 110 3HG2 THR 110 -3.947 2.209 5.481 910 H ASN 111 H ASN 111 -6.935 0.599 5.648 911 HA ASN 111 HA ASN 111 -9.120 2.075 4.372 912 1HB ASN 111 1HB ASN 111 -9.541 -0.096 5.610 913 2HB ASN 111 2HB ASN 111 -9.101 0.744 7.094 914 1HD2 ASN 111 1HD2 ASN 111 -11.598 -0.513 6.403 915 2HD2 ASN 111 2HD2 ASN 111 -12.810 0.711 6.491 916 H ILE 112 H ILE 112 -8.940 4.210 4.543 917 HA ILE 112 HA ILE 112 -7.229 5.486 6.389 918 HB ILE 112 HB ILE 112 -9.420 6.665 4.676 919 1HG1 ILE 112 1HG1 ILE 112 -7.707 5.601 3.332 920 2HG1 ILE 112 2HG1 ILE 112 -7.533 7.350 3.213 921 1HG2 ILE 112 1HG2 ILE 112 -7.181 8.043 6.150 922 2HG2 ILE 112 2HG2 ILE 112 -8.902 8.160 6.514 923 3HG2 ILE 112 3HG2 ILE 112 -8.274 8.812 5.000 924 1HD1 ILE 112 1HD1 ILE 112 -5.685 7.284 4.798 925 2HD1 ILE 112 2HD1 ILE 112 -5.371 6.253 3.402 926 3HD1 ILE 112 3HD1 ILE 112 -5.860 5.536 4.937 927 H HIS 113 H HIS 113 -10.769 5.171 6.266 928 HA HIS 113 HA HIS 113 -11.141 6.904 8.502 929 1HB HIS 113 1HB HIS 113 -12.793 6.152 6.537 930 2HB HIS 113 2HB HIS 113 -13.298 4.999 7.772 931 HD1 HIS 113 HD1 HIS 113 -14.632 5.910 9.769 932 HD2 HIS 113 HD2 HIS 113 -13.256 8.876 7.187 933 HE1 HIS 113 HE1 HIS 113 -15.779 8.031 10.488 934 HE2 HIS 113 HE2 HIS 113 -14.834 9.835 8.997 935 H GLU 114 H GLU 114 -10.677 3.468 8.131 936 HA GLU 114 HA GLU 114 -11.506 2.981 10.882 937 1HB GLU 114 1HB GLU 114 -11.958 1.402 8.887 938 2HB GLU 114 2HB GLU 114 -10.273 0.932 9.060 939 1HG GLU 114 1HG GLU 114 -10.726 0.317 11.410 940 2HG GLU 114 2HG GLU 114 -12.427 0.692 11.143 941 H GLN 115 H GLN 115 -8.734 3.877 9.207 942 HA GLN 115 HA GLN 115 -6.601 4.297 9.865 943 1HB GLN 115 1HB GLN 115 -7.759 3.675 12.580 944 2HB GLN 115 2HB GLN 115 -6.116 4.249 12.337 945 1HG GLN 115 1HG GLN 115 -8.526 5.758 11.378 946 2HG GLN 115 2HG GLN 115 -7.831 5.978 12.984 947 1HE2 GLN 115 1HE2 GLN 115 -7.401 6.484 9.573 948 2HE2 GLN 115 2HE2 GLN 115 -6.046 7.551 9.704 949 H LYS 116 H LYS 116 -7.213 1.693 8.888 950 HA LYS 116 HA LYS 116 -5.205 0.107 10.342 951 1HB LYS 116 1HB LYS 116 -7.829 -0.900 9.239 952 2HB LYS 116 2HB LYS 116 -6.540 -1.933 9.832 953 1HG LYS 116 1HG LYS 116 -6.781 -0.927 12.059 954 2HG LYS 116 2HG LYS 116 -8.115 0.060 11.450 955 1HD LYS 116 1HD LYS 116 -9.279 -2.043 10.797 956 2HD LYS 116 2HD LYS 116 -7.992 -2.945 11.596 957 1HE LYS 116 1HE LYS 116 -8.576 -2.036 13.720 958 2HE LYS 116 2HE LYS 116 -9.694 -0.887 12.984 959 1HZ LYS 116 1HZ LYS 116 -11.066 -2.734 12.248 960 2HZ LYS 116 2HZ LYS 116 -10.869 -2.769 13.933 961 3HZ LYS 116 3HZ LYS 116 -9.996 -3.842 12.960 962 H ARG 117 H ARG 117 -4.010 -1.372 9.106 963 HA ARG 117 HA ARG 117 -4.291 -1.141 6.176 964 1HB ARG 117 1HB ARG 117 -1.865 -1.871 7.827 965 2HB ARG 117 2HB ARG 117 -1.936 -1.985 6.079 966 1HG ARG 117 1HG ARG 117 -2.283 0.449 5.956 967 2HG ARG 117 2HG ARG 117 -2.135 0.533 7.717 968 1HD ARG 117 1HD ARG 117 0.109 -0.499 7.532 969 2HD ARG 117 2HD ARG 117 -0.045 -0.445 5.777 970 HE ARG 117 HE ARG 117 -0.338 2.099 6.280 971 1HH1 ARG 117 1HH1 ARG 117 1.788 -0.138 7.938 972 2HH1 ARG 117 2HH1 ARG 117 3.013 1.055 8.232 973 1HH2 ARG 117 1HH2 ARG 117 1.274 3.679 6.660 974 2HH2 ARG 117 2HH2 ARG 117 2.723 3.229 7.509 975 H TYR 118 H TYR 118 -5.292 -2.851 5.352 976 HA TYR 118 HA TYR 118 -5.125 -5.428 6.736 977 1HB TYR 118 1HB TYR 118 -6.975 -4.367 4.599 978 2HB TYR 118 2HB TYR 118 -6.949 -6.061 5.073 979 HD1 TYR 118 HD1 TYR 118 -7.694 -2.631 6.256 980 HD2 TYR 118 HD2 TYR 118 -7.992 -6.795 7.073 981 HE1 TYR 118 HE1 TYR 118 -9.274 -2.155 8.081 982 HE2 TYR 118 HE2 TYR 118 -9.574 -6.332 8.896 983 HH TYR 118 HH TYR 118 -10.965 -3.192 9.375 984 H TYR 119 H TYR 119 -3.567 -6.744 6.099 985 HA TYR 119 HA TYR 119 -2.554 -6.584 3.357 986 1HB TYR 119 1HB TYR 119 -1.453 -7.955 5.822 987 2HB TYR 119 2HB TYR 119 -0.694 -8.008 4.234 988 HD1 TYR 119 HD1 TYR 119 0.548 -6.143 3.396 989 HD2 TYR 119 HD2 TYR 119 -1.522 -5.839 7.099 990 HE1 TYR 119 HE1 TYR 119 1.763 -4.062 3.895 991 HE2 TYR 119 HE2 TYR 119 -0.313 -3.762 7.611 992 HH TYR 119 HH TYR 119 1.569 -2.522 7.033 993 H TYR 120 H TYR 120 -3.721 -7.800 2.011 994 HA TYR 120 HA TYR 120 -4.614 -10.461 2.888 995 1HB TYR 120 1HB TYR 120 -5.494 -8.709 0.586 996 2HB TYR 120 2HB TYR 120 -6.030 -10.371 0.800 997 HD1 TYR 120 HD1 TYR 120 -7.467 -10.971 2.704 998 HD2 TYR 120 HD2 TYR 120 -6.416 -6.929 1.905 999 HE1 TYR 120 HE1 TYR 120 -9.318 -10.216 4.132 1000 HE2 TYR 120 HE2 TYR 120 -8.261 -6.162 3.339 1001 HH TYR 120 HH TYR 120 -10.409 -7.007 4.178 1002 H THR 121 H THR 121 -3.993 -12.292 1.863 1003 HA THR 121 HA THR 121 -1.722 -12.150 0.091 1004 HB THR 121 HB THR 121 -1.823 -13.922 1.788 1005 HG1 THR 121 HG1 THR 121 -0.622 -14.613 0.104 1006 1HG2 THR 121 1HG2 THR 121 -3.401 -15.790 1.558 1007 2HG2 THR 121 2HG2 THR 121 -4.211 -14.931 0.249 1008 3HG2 THR 121 3HG2 THR 121 -4.228 -14.267 1.881 1009 H PHE 122 H PHE 122 -1.819 -13.655 -1.914 1010 HA PHE 122 HA PHE 122 -3.707 -12.536 -3.702 1011 1HB PHE 122 1HB PHE 122 -2.740 -14.093 -5.372 1012 2HB PHE 122 2HB PHE 122 -1.514 -13.185 -4.498 1013 HD1 PHE 122 HD1 PHE 122 -2.951 -16.480 -5.113 1014 HD2 PHE 122 HD2 PHE 122 -0.044 -14.289 -2.911 1015 HE1 PHE 122 HE1 PHE 122 -1.817 -18.584 -4.527 1016 HE2 PHE 122 HE2 PHE 122 1.094 -16.387 -2.317 1017 HZ PHE 122 HZ PHE 122 0.208 -18.536 -3.125 1018 H ASP 123 H ASP 123 -4.010 -15.072 -1.530 1019 HA ASP 123 HA ASP 123 -6.047 -16.461 -3.100 1020 1HB ASP 123 1HB ASP 123 -4.280 -17.684 -1.734 1021 2HB ASP 123 2HB ASP 123 -5.139 -17.131 -0.299 1022 H ASN 124 H ASN 124 -6.097 -13.711 -1.614 1023 HA ASN 124 HA ASN 124 -7.783 -12.355 -0.924 1024 1HB ASN 124 1HB ASN 124 -9.506 -14.825 -1.182 1025 2HB ASN 124 2HB ASN 124 -10.123 -13.228 -0.778 1026 1HD2 ASN 124 1HD2 ASN 124 -10.708 -14.956 -3.047 1027 2HD2 ASN 124 2HD2 ASN 124 -10.346 -14.028 -4.464 1028 H SER 125 H SER 125 -6.395 -14.638 0.841 1029 HA SER 125 HA SER 125 -8.100 -14.477 3.180 1030 1HB SER 125 1HB SER 125 -6.971 -16.600 2.625 1031 2HB SER 125 2HB SER 125 -5.404 -15.812 2.809 1032 HG SER 125 HG SER 125 -7.010 -16.877 4.693 1033 H LEU 126 H LEU 126 -7.527 -13.488 5.122 1034 HA LEU 126 HA LEU 126 -5.794 -11.181 4.832 1035 1HB LEU 126 1HB LEU 126 -8.009 -10.935 5.861 1036 2HB LEU 126 2HB LEU 126 -7.563 -12.076 7.115 1037 HG LEU 126 HG LEU 126 -5.826 -10.495 7.901 1038 1HD1 LEU 126 1HD1 LEU 126 -7.037 -8.619 5.875 1039 2HD1 LEU 126 2HD1 LEU 126 -5.423 -9.324 5.799 1040 3HD1 LEU 126 3HD1 LEU 126 -5.831 -8.196 7.091 1041 1HD2 LEU 126 1HD2 LEU 126 -7.366 -8.895 8.912 1042 2HD2 LEU 126 2HD2 LEU 126 -8.035 -10.526 8.929 1043 3HD2 LEU 126 3HD2 LEU 126 -8.610 -9.350 7.748 1044 H LEU 127 H LEU 127 -3.758 -11.110 5.537 1045 HA LEU 127 HA LEU 127 -2.819 -13.336 7.204 1046 1HB LEU 127 1HB LEU 127 -1.328 -11.444 5.396 1047 2HB LEU 127 2HB LEU 127 -0.555 -12.651 6.407 1048 HG LEU 127 HG LEU 127 -2.469 -13.208 4.138 1049 1HD1 LEU 127 1HD1 LEU 127 -0.278 -12.449 3.379 1050 2HD1 LEU 127 2HD1 LEU 127 -0.507 -14.164 3.041 1051 3HD1 LEU 127 3HD1 LEU 127 0.501 -13.660 4.397 1052 1HD2 LEU 127 1HD2 LEU 127 -2.666 -14.842 5.957 1053 2HD2 LEU 127 2HD2 LEU 127 -0.924 -15.109 5.897 1054 3HD2 LEU 127 3HD2 LEU 127 -1.932 -15.551 4.519 1055 H PHE 128 H PHE 128 -2.581 -9.802 6.882 1056 HA PHE 128 HA PHE 128 -1.893 -9.658 9.722 1057 1HB PHE 128 1HB PHE 128 0.175 -9.656 8.155 1058 2HB PHE 128 2HB PHE 128 -0.350 -8.038 7.710 1059 HD1 PHE 128 HD1 PHE 128 0.016 -6.185 9.157 1060 HD2 PHE 128 HD2 PHE 128 0.843 -10.144 10.471 1061 HE1 PHE 128 HE1 PHE 128 1.209 -5.283 11.112 1062 HE2 PHE 128 HE2 PHE 128 2.035 -9.258 12.423 1063 HZ PHE 128 HZ PHE 128 2.222 -6.819 12.750 1064 H THR 129 H THR 129 -2.446 -7.705 10.709 1065 HA THR 129 HA THR 129 -3.567 -5.570 9.086 1066 HB THR 129 HB THR 129 -5.171 -6.843 11.319 1067 HG1 THR 129 HG1 THR 129 -4.991 -7.469 8.721 1068 1HG2 THR 129 1HG2 THR 129 -6.944 -5.287 10.605 1069 2HG2 THR 129 2HG2 THR 129 -5.828 -4.560 9.448 1070 3HG2 THR 129 3HG2 THR 129 -5.513 -4.429 11.177 1071 H GLU 130 H GLU 130 -2.664 -3.761 9.798 1072 HA GLU 130 HA GLU 130 -2.004 -3.545 12.661 1073 1HB GLU 130 1HB GLU 130 -0.222 -1.996 12.034 1074 2HB GLU 130 2HB GLU 130 -0.014 -3.540 11.220 1075 1HG GLU 130 1HG GLU 130 -0.859 -2.643 9.169 1076 2HG GLU 130 2HG GLU 130 -1.276 -1.123 9.959 1077 H SER 131 H SER 131 -1.835 -1.100 13.273 1078 HA SER 131 HA SER 131 -4.089 0.345 12.068 1079 1HB SER 131 1HB SER 131 -3.460 0.241 15.026 1080 2HB SER 131 2HB SER 131 -4.822 1.065 14.265 1081 HG SER 131 HG SER 131 -4.780 -1.496 13.486 1082 H ILE 132 H ILE 132 -3.709 2.420 11.585 1083 HA ILE 132 HA ILE 132 -0.945 3.312 11.940 1084 HB ILE 132 HB ILE 132 -1.474 4.952 10.144 1085 1HG1 ILE 132 1HG1 ILE 132 -4.095 3.441 9.987 1086 2HG1 ILE 132 2HG1 ILE 132 -3.915 5.097 10.544 1087 1HG2 ILE 132 1HG2 ILE 132 -0.431 2.821 9.629 1088 2HG2 ILE 132 2HG2 ILE 132 -1.537 3.291 8.338 1089 3HG2 ILE 132 3HG2 ILE 132 -2.013 2.056 9.503 1090 1HD1 ILE 132 1HD1 ILE 132 -4.739 4.999 8.263 1091 2HD1 ILE 132 2HD1 ILE 132 -3.304 4.099 7.774 1092 3HD1 ILE 132 3HD1 ILE 132 -3.151 5.766 8.329 1093 H GLN 133 H GLN 133 -2.918 3.603 14.101 1094 HA GLN 133 HA GLN 133 -3.701 6.315 14.336 1095 1HB GLN 133 1HB GLN 133 -4.746 4.650 15.732 1096 2HB GLN 133 2HB GLN 133 -3.197 4.199 16.435 1097 1HG GLN 133 1HG GLN 133 -3.038 6.500 17.375 1098 2HG GLN 133 2HG GLN 133 -4.678 6.791 16.800 1099 1HE2 GLN 133 1HE2 GLN 133 -5.394 7.157 18.893 1100 2HE2 GLN 133 2HE2 GLN 133 -5.622 5.863 20.019 Start of MODEL 11 1 H ASP 7 H ASP 7 -4.454 14.113 -16.538 2 HA ASP 7 HA ASP 7 -7.051 14.402 -15.389 3 1HB ASP 7 1HB ASP 7 -6.535 12.779 -17.204 4 2HB ASP 7 2HB ASP 7 -5.561 11.854 -16.064 5 H GLN 8 H GLN 8 -7.859 13.175 -13.550 6 HA GLN 8 HA GLN 8 -6.468 13.700 -11.205 7 1HB GLN 8 1HB GLN 8 -8.914 13.388 -11.379 8 2HB GLN 8 2HB GLN 8 -8.663 11.666 -11.621 9 1HG GLN 8 1HG GLN 8 -9.284 11.990 -9.364 10 2HG GLN 8 2HG GLN 8 -7.573 11.585 -9.383 11 1HE2 GLN 8 1HE2 GLN 8 -9.221 12.985 -7.397 12 2HE2 GLN 8 2HE2 GLN 8 -8.452 14.510 -7.141 13 H VAL 9 H VAL 9 -6.433 10.839 -13.224 14 HA VAL 9 HA VAL 9 -5.274 8.989 -11.489 15 HB VAL 9 HB VAL 9 -4.850 9.334 -14.466 16 1HG1 VAL 9 1HG1 VAL 9 -3.017 8.033 -13.528 17 2HG1 VAL 9 2HG1 VAL 9 -4.088 7.008 -14.486 18 3HG1 VAL 9 3HG1 VAL 9 -4.170 6.968 -12.725 19 1HG2 VAL 9 1HG2 VAL 9 -6.664 7.494 -12.909 20 2HG2 VAL 9 2HG2 VAL 9 -6.478 7.521 -14.663 21 3HG2 VAL 9 3HG2 VAL 9 -7.165 8.914 -13.826 22 H VAL 10 H VAL 10 -3.833 11.626 -13.305 23 HA VAL 10 HA VAL 10 -1.121 10.941 -12.859 24 HB VAL 10 HB VAL 10 -2.318 13.670 -13.384 25 1HG1 VAL 10 1HG1 VAL 10 -0.045 13.788 -12.476 26 2HG1 VAL 10 2HG1 VAL 10 -0.096 14.298 -14.164 27 3HG1 VAL 10 3HG1 VAL 10 0.514 12.697 -13.745 28 1HG2 VAL 10 1HG2 VAL 10 -2.901 12.086 -15.135 29 2HG2 VAL 10 2HG2 VAL 10 -1.207 11.624 -15.301 30 3HG2 VAL 10 3HG2 VAL 10 -1.722 13.256 -15.728 31 H ILE 11 H ILE 11 -3.362 13.129 -11.190 32 HA ILE 11 HA ILE 11 -1.590 14.196 -9.326 33 HB ILE 11 HB ILE 11 -4.575 13.754 -9.145 34 1HG1 ILE 11 1HG1 ILE 11 -4.462 16.335 -9.234 35 2HG1 ILE 11 2HG1 ILE 11 -2.805 16.107 -9.779 36 1HG2 ILE 11 1HG2 ILE 11 -2.825 15.239 -7.188 37 2HG2 ILE 11 2HG2 ILE 11 -3.699 13.738 -6.881 38 3HG2 ILE 11 3HG2 ILE 11 -4.590 15.229 -7.190 39 1HD1 ILE 11 1HD1 ILE 11 -3.614 14.822 -11.687 40 2HD1 ILE 11 2HD1 ILE 11 -4.304 16.445 -11.647 41 3HD1 ILE 11 3HD1 ILE 11 -5.275 15.062 -11.140 42 H PHE 12 H PHE 12 -3.768 11.388 -8.986 43 HA PHE 12 HA PHE 12 -2.934 10.763 -6.365 44 1HB PHE 12 1HB PHE 12 -4.416 9.274 -8.486 45 2HB PHE 12 2HB PHE 12 -3.824 8.397 -7.081 46 HD1 PHE 12 HD1 PHE 12 -4.491 9.231 -4.784 47 HD2 PHE 12 HD2 PHE 12 -6.403 10.496 -8.369 48 HE1 PHE 12 HE1 PHE 12 -6.448 9.949 -3.478 49 HE2 PHE 12 HE2 PHE 12 -8.362 11.219 -7.068 50 HZ PHE 12 HZ PHE 12 -8.386 10.946 -4.621 51 H LYS 13 H LYS 13 -1.771 9.657 -9.526 52 HA LYS 13 HA LYS 13 0.062 7.772 -8.566 53 1HB LYS 13 1HB LYS 13 -0.142 7.631 -10.856 54 2HB LYS 13 2HB LYS 13 -0.125 9.376 -11.075 55 1HG LYS 13 1HG LYS 13 2.190 9.498 -10.984 56 2HG LYS 13 2HG LYS 13 2.338 7.954 -10.150 57 1HD LYS 13 1HD LYS 13 1.145 7.905 -12.856 58 2HD LYS 13 2HD LYS 13 2.871 8.261 -12.752 59 1HE LYS 13 1HE LYS 13 1.605 5.911 -11.363 60 2HE LYS 13 2HE LYS 13 2.228 5.822 -13.010 61 1HZ LYS 13 1HZ LYS 13 4.409 6.305 -12.254 62 2HZ LYS 13 2HZ LYS 13 3.809 5.081 -11.248 63 3HZ LYS 13 3HZ LYS 13 3.878 6.675 -10.687 64 H GLN 14 H GLN 14 0.426 11.254 -9.141 65 HA GLN 14 HA GLN 14 3.143 11.479 -8.537 66 1HB GLN 14 1HB GLN 14 0.893 13.465 -8.158 67 2HB GLN 14 2HB GLN 14 2.599 13.871 -8.000 68 1HG GLN 14 1HG GLN 14 1.176 12.915 -10.468 69 2HG GLN 14 2HG GLN 14 1.818 14.526 -10.166 70 1HE2 GLN 14 1HE2 GLN 14 2.379 12.613 -12.299 71 2HE2 GLN 14 2HE2 GLN 14 4.089 12.355 -12.273 72 H ILE 15 H ILE 15 0.330 11.412 -6.441 73 HA ILE 15 HA ILE 15 1.561 12.134 -4.027 74 HB ILE 15 HB ILE 15 -0.760 10.244 -4.459 75 1HG1 ILE 15 1HG1 ILE 15 -0.758 13.204 -3.829 76 2HG1 ILE 15 2HG1 ILE 15 -1.058 12.521 -5.423 77 1HG2 ILE 15 1HG2 ILE 15 -1.375 10.787 -2.153 78 2HG2 ILE 15 2HG2 ILE 15 0.099 11.742 -1.986 79 3HG2 ILE 15 3HG2 ILE 15 0.202 9.999 -2.238 80 1HD1 ILE 15 1HD1 ILE 15 -3.131 13.124 -4.325 81 2HD1 ILE 15 2HD1 ILE 15 -2.734 12.073 -2.964 82 3HD1 ILE 15 3HD1 ILE 15 -3.034 11.378 -4.557 83 H PHE 16 H PHE 16 0.838 8.871 -5.277 84 HA PHE 16 HA PHE 16 2.246 7.544 -3.200 85 1HB PHE 16 1HB PHE 16 1.246 6.610 -5.888 86 2HB PHE 16 2HB PHE 16 2.056 5.540 -4.750 87 HD1 PHE 16 HD1 PHE 16 -0.961 7.536 -5.372 88 HD2 PHE 16 HD2 PHE 16 0.949 4.754 -2.781 89 HE1 PHE 16 HE1 PHE 16 -3.107 7.111 -4.251 90 HE2 PHE 16 HE2 PHE 16 -1.197 4.326 -1.653 91 HZ PHE 16 HZ PHE 16 -3.230 5.508 -2.389 92 H ASP 17 H ASP 17 3.149 8.654 -6.400 93 HA ASP 17 HA ASP 17 5.571 7.135 -6.524 94 1HB ASP 17 1HB ASP 17 4.046 8.398 -8.384 95 2HB ASP 17 2HB ASP 17 5.368 9.547 -8.206 96 H LYS 18 H LYS 18 4.692 10.056 -5.003 97 HA LYS 18 HA LYS 18 7.403 11.081 -4.889 98 1HB LYS 18 1HB LYS 18 5.228 12.472 -4.945 99 2HB LYS 18 2HB LYS 18 5.059 12.050 -3.251 100 1HG LYS 18 1HG LYS 18 7.537 13.373 -4.305 101 2HG LYS 18 2HG LYS 18 6.114 14.299 -3.831 102 1HD LYS 18 1HD LYS 18 6.243 13.244 -1.587 103 2HD LYS 18 2HD LYS 18 7.738 12.450 -2.085 104 1HE LYS 18 1HE LYS 18 7.282 15.432 -1.992 105 2HE LYS 18 2HE LYS 18 8.146 14.496 -0.776 106 1HZ LYS 18 1HZ LYS 18 9.775 15.417 -2.156 107 2HZ LYS 18 2HZ LYS 18 8.946 15.026 -3.579 108 3HZ LYS 18 3HZ LYS 18 9.664 13.796 -2.649 109 H VAL 19 H VAL 19 5.039 9.661 -2.636 110 HA VAL 19 HA VAL 19 6.767 9.868 -0.380 111 HB VAL 19 HB VAL 19 4.301 9.877 -0.196 112 1HG1 VAL 19 1HG1 VAL 19 3.077 7.751 -0.252 113 2HG1 VAL 19 2HG1 VAL 19 4.529 6.944 -0.842 114 3HG1 VAL 19 3HG1 VAL 19 3.745 8.180 -1.826 115 1HG2 VAL 19 1HG2 VAL 19 5.648 9.413 1.766 116 2HG2 VAL 19 2HG2 VAL 19 5.679 7.696 1.362 117 3HG2 VAL 19 3HG2 VAL 19 4.158 8.470 1.808 118 H ARG 20 H ARG 20 6.353 7.461 -2.840 119 HA ARG 20 HA ARG 20 7.133 5.145 -1.493 120 1HB ARG 20 1HB ARG 20 7.845 4.312 -3.742 121 2HB ARG 20 2HB ARG 20 6.213 4.967 -3.692 122 1HG ARG 20 1HG ARG 20 7.049 7.065 -4.661 123 2HG ARG 20 2HG ARG 20 8.664 6.365 -4.748 124 1HD ARG 20 1HD ARG 20 6.315 5.034 -6.055 125 2HD ARG 20 2HD ARG 20 7.195 6.330 -6.862 126 HE ARG 20 HE ARG 20 8.923 4.261 -5.907 127 1HH1 ARG 20 1HH1 ARG 20 6.779 5.191 -8.528 128 2HH1 ARG 20 2HH1 ARG 20 7.574 4.181 -9.692 129 1HH2 ARG 20 1HH2 ARG 20 9.975 2.959 -7.432 130 2HH2 ARG 20 2HH2 ARG 20 9.420 2.918 -9.080 131 H ASN 21 H ASN 21 9.043 7.846 -2.504 132 HA ASN 21 HA ASN 21 11.496 6.308 -1.966 133 1HB ASN 21 1HB ASN 21 11.396 7.239 -4.238 134 2HB ASN 21 2HB ASN 21 11.188 8.855 -3.568 135 1HD2 ASN 21 1HD2 ASN 21 12.952 9.955 -2.796 136 2HD2 ASN 21 2HD2 ASN 21 14.576 9.370 -2.944 137 H ASP 22 H ASP 22 9.909 9.421 -1.378 138 HA ASP 22 HA ASP 22 12.099 10.383 0.191 139 1HB ASP 22 1HB ASP 22 9.357 11.473 -0.395 140 2HB ASP 22 2HB ASP 22 10.484 12.289 0.689 141 H LEU 23 H LEU 23 9.212 8.633 0.865 142 HA LEU 23 HA LEU 23 8.403 7.685 2.758 143 1HB LEU 23 1HB LEU 23 11.112 8.423 3.867 144 2HB LEU 23 2HB LEU 23 9.959 7.366 4.660 145 HG LEU 23 HG LEU 23 11.271 6.813 1.994 146 1HD1 LEU 23 1HD1 LEU 23 12.850 6.711 3.865 147 2HD1 LEU 23 2HD1 LEU 23 12.532 5.112 3.190 148 3HD1 LEU 23 3HD1 LEU 23 11.774 5.595 4.706 149 1HD2 LEU 23 1HD2 LEU 23 9.081 5.803 2.128 150 2HD2 LEU 23 2HD2 LEU 23 9.444 5.153 3.728 151 3HD2 LEU 23 3HD2 LEU 23 10.314 4.558 2.315 152 H ASN 24 H ASN 24 8.382 10.742 2.325 153 HA ASN 24 HA ASN 24 8.117 11.755 5.009 154 1HB ASN 24 1HB ASN 24 7.335 13.855 3.877 155 2HB ASN 24 2HB ASN 24 8.931 13.315 3.377 156 1HD2 ASN 24 1HD2 ASN 24 6.940 15.056 2.049 157 2HD2 ASN 24 2HD2 ASN 24 6.667 14.326 0.502 158 H TYR 25 H TYR 25 6.573 10.174 5.703 159 HA TYR 25 HA TYR 25 4.087 9.733 4.511 160 1HB TYR 25 1HB TYR 25 4.925 9.447 7.397 161 2HB TYR 25 2HB TYR 25 3.412 8.831 6.737 162 HD1 TYR 25 HD1 TYR 25 6.696 7.981 7.549 163 HD2 TYR 25 HD2 TYR 25 3.740 7.309 4.570 164 HE1 TYR 25 HE1 TYR 25 7.836 5.903 6.898 165 HE2 TYR 25 HE2 TYR 25 4.868 5.225 3.908 166 HH TYR 25 HH TYR 25 7.138 4.236 4.040 167 H GLN 26 H GLN 26 5.142 12.248 6.674 168 HA GLN 26 HA GLN 26 2.707 13.212 7.603 169 1HB GLN 26 1HB GLN 26 5.178 14.803 6.882 170 2HB GLN 26 2HB GLN 26 3.843 15.402 7.853 171 1HG GLN 26 1HG GLN 26 5.411 14.823 9.440 172 2HG GLN 26 2HG GLN 26 4.370 13.401 9.399 173 1HE2 GLN 26 1HE2 GLN 26 7.483 14.705 8.611 174 2HE2 GLN 26 2HE2 GLN 26 8.264 13.187 8.298 175 H TRP 27 H TRP 27 4.224 13.601 4.472 176 HA TRP 27 HA TRP 27 2.410 15.665 3.614 177 1HB TRP 27 1HB TRP 27 3.875 15.918 1.908 178 2HB TRP 27 2HB TRP 27 4.882 14.736 2.733 179 HD1 TRP 27 HD1 TRP 27 4.801 12.176 1.750 180 HE1 TRP 27 HE1 TRP 27 4.106 11.286 -0.558 181 HE3 TRP 27 HE3 TRP 27 2.426 16.292 -0.056 182 HZ2 TRP 27 HZ2 TRP 27 2.781 12.187 -2.842 183 HZ3 TRP 27 HZ3 TRP 27 1.457 16.170 -2.299 184 HH2 TRP 27 HH2 TRP 27 1.640 14.188 -3.680 185 H PHE 28 H PHE 28 2.696 12.196 3.330 186 HA PHE 28 HA PHE 28 0.879 12.005 1.117 187 1HB PHE 28 1HB PHE 28 2.686 10.459 1.182 188 2HB PHE 28 2HB PHE 28 2.364 10.012 2.848 189 HD1 PHE 28 HD1 PHE 28 0.740 9.900 -0.507 190 HD2 PHE 28 HD2 PHE 28 1.327 8.022 3.263 191 HE1 PHE 28 HE1 PHE 28 -0.522 7.939 -1.291 192 HE2 PHE 28 HE2 PHE 28 0.062 6.061 2.489 193 HZ PHE 28 HZ PHE 28 -0.864 6.017 0.205 194 H TYR 29 H TYR 29 0.757 11.258 4.609 195 HA TYR 29 HA TYR 29 -1.867 10.162 4.518 196 1HB TYR 29 1HB TYR 29 -0.147 11.196 6.758 197 2HB TYR 29 2HB TYR 29 -1.814 10.697 7.042 198 HD1 TYR 29 HD1 TYR 29 -2.484 8.333 6.564 199 HD2 TYR 29 HD2 TYR 29 1.583 9.580 6.488 200 HE1 TYR 29 HE1 TYR 29 -1.768 5.984 6.721 201 HE2 TYR 29 HE2 TYR 29 2.310 7.236 6.645 202 HH TYR 29 HH TYR 29 0.276 4.642 6.094 203 H SER 30 H SER 30 -0.626 13.378 4.578 204 HA SER 30 HA SER 30 -3.085 14.657 5.236 205 1HB SER 30 1HB SER 30 -0.705 15.693 3.668 206 2HB SER 30 2HB SER 30 -2.026 16.680 4.295 207 HG SER 30 HG SER 30 0.128 15.537 5.619 208 H GLU 31 H GLU 31 -1.413 13.891 2.176 209 HA GLU 31 HA GLU 31 -3.351 14.749 0.374 210 1HB GLU 31 1HB GLU 31 -1.550 12.322 0.177 211 2HB GLU 31 2HB GLU 31 -2.463 12.997 -1.162 212 1HG GLU 31 1HG GLU 31 -0.125 14.195 0.295 213 2HG GLU 31 2HG GLU 31 -0.260 13.759 -1.406 214 H LEU 32 H LEU 32 -3.070 11.676 2.093 215 HA LEU 32 HA LEU 32 -5.174 10.308 0.883 216 1HB LEU 32 1HB LEU 32 -4.094 10.141 3.694 217 2HB LEU 32 2HB LEU 32 -5.272 9.016 3.037 218 HG LEU 32 HG LEU 32 -2.497 9.451 1.927 219 1HD1 LEU 32 1HD1 LEU 32 -3.615 7.183 3.566 220 2HD1 LEU 32 2HD1 LEU 32 -2.458 8.391 4.128 221 3HD1 LEU 32 3HD1 LEU 32 -1.999 7.257 2.855 222 1HD2 LEU 32 1HD2 LEU 32 -4.597 7.389 1.264 223 2HD2 LEU 32 2HD2 LEU 32 -2.975 7.485 0.576 224 3HD2 LEU 32 3HD2 LEU 32 -4.149 8.760 0.248 225 H LYS 33 H LYS 33 -5.272 12.130 3.961 226 HA LYS 33 HA LYS 33 -8.040 11.834 4.336 227 1HB LYS 33 1HB LYS 33 -6.430 12.515 6.103 228 2HB LYS 33 2HB LYS 33 -6.267 14.081 5.324 229 1HG LYS 33 1HG LYS 33 -8.643 14.523 5.724 230 2HG LYS 33 2HG LYS 33 -8.792 12.954 6.519 231 1HD LYS 33 1HD LYS 33 -7.152 13.656 8.200 232 2HD LYS 33 2HD LYS 33 -7.012 15.226 7.404 233 1HE LYS 33 1HE LYS 33 -9.402 15.630 7.839 234 2HE LYS 33 2HE LYS 33 -9.498 14.082 8.681 235 1HZ LYS 33 1HZ LYS 33 -7.885 16.450 9.477 236 2HZ LYS 33 2HZ LYS 33 -7.792 14.940 10.241 237 3HZ LYS 33 3HZ LYS 33 -9.241 15.822 10.283 238 H ARG 34 H ARG 34 -6.181 14.107 2.457 239 HA ARG 34 HA ARG 34 -8.262 15.999 2.029 240 1HB ARG 34 1HB ARG 34 -5.676 15.422 0.604 241 2HB ARG 34 2HB ARG 34 -6.780 16.675 0.062 242 1HG ARG 34 1HG ARG 34 -5.508 16.557 2.786 243 2HG ARG 34 2HG ARG 34 -4.937 17.540 1.436 244 1HD ARG 34 1HD ARG 34 -7.576 17.753 2.868 245 2HD ARG 34 2HD ARG 34 -6.250 18.915 2.898 246 HE ARG 34 HE ARG 34 -7.916 18.328 0.526 247 1HH1 ARG 34 1HH1 ARG 34 -5.937 20.524 2.415 248 2HH1 ARG 34 2HH1 ARG 34 -6.237 21.881 1.366 249 1HH2 ARG 34 1HH2 ARG 34 -8.317 20.092 -0.820 250 2HH2 ARG 34 2HH2 ARG 34 -7.603 21.639 -0.473 251 H HIS 35 H HIS 35 -7.080 13.219 0.163 252 HA HIS 35 HA HIS 35 -9.093 13.852 -1.892 253 1HB HIS 35 1HB HIS 35 -6.625 12.147 -2.248 254 2HB HIS 35 2HB HIS 35 -7.683 12.764 -3.510 255 HD1 HIS 35 HD1 HIS 35 -7.768 15.670 -3.211 256 HD2 HIS 35 HD2 HIS 35 -4.329 13.525 -2.270 257 HE1 HIS 35 HE1 HIS 35 -5.873 17.327 -3.316 258 HE2 HIS 35 HE2 HIS 35 -3.838 16.042 -2.547 259 H ASN 36 H ASN 36 -7.473 11.097 -0.337 260 HA ASN 36 HA ASN 36 -9.566 9.306 -1.278 261 1HB ASN 36 1HB ASN 36 -7.234 8.554 -1.461 262 2HB ASN 36 2HB ASN 36 -7.033 8.734 0.279 263 1HD2 ASN 36 1HD2 ASN 36 -6.485 6.568 0.496 264 2HD2 ASN 36 2HD2 ASN 36 -7.660 5.311 0.389 265 H VAL 37 H VAL 37 -11.205 10.302 0.010 266 HA VAL 37 HA VAL 37 -11.077 10.333 2.850 267 HB VAL 37 HB VAL 37 -13.567 10.393 1.138 268 1HG1 VAL 37 1HG1 VAL 37 -13.013 11.501 3.887 269 2HG1 VAL 37 2HG1 VAL 37 -13.980 10.073 3.523 270 3HG1 VAL 37 3HG1 VAL 37 -14.522 11.666 2.991 271 1HG2 VAL 37 1HG2 VAL 37 -12.003 12.074 0.337 272 2HG2 VAL 37 2HG2 VAL 37 -11.793 12.683 1.978 273 3HG2 VAL 37 3HG2 VAL 37 -13.354 12.837 1.176 274 H SER 38 H SER 38 -11.703 7.824 0.592 275 HA SER 38 HA SER 38 -13.220 6.316 2.595 276 1HB SER 38 1HB SER 38 -14.243 6.600 0.337 277 2HB SER 38 2HB SER 38 -12.904 5.673 -0.340 278 HG SER 38 HG SER 38 -15.041 4.604 0.362 279 H HIS 39 H HIS 39 -11.222 4.997 -0.042 280 HA HIS 39 HA HIS 39 -9.159 3.980 1.613 281 1HB HIS 39 1HB HIS 39 -9.796 1.627 1.717 282 2HB HIS 39 2HB HIS 39 -11.017 2.608 2.515 283 HD1 HIS 39 HD1 HIS 39 -13.282 2.986 1.117 284 HD2 HIS 39 HD2 HIS 39 -10.726 0.031 -0.309 285 HE1 HIS 39 HE1 HIS 39 -14.676 1.570 -0.417 286 HE2 HIS 39 HE2 HIS 39 -13.071 -0.099 -1.412 287 H TYR 40 H TYR 40 -7.628 2.710 0.425 288 HA TYR 40 HA TYR 40 -8.245 2.492 -2.441 289 1HB TYR 40 1HB TYR 40 -6.009 3.117 -3.048 290 2HB TYR 40 2HB TYR 40 -6.660 4.366 -1.996 291 HD1 TYR 40 HD1 TYR 40 -4.167 1.710 -2.342 292 HD2 TYR 40 HD2 TYR 40 -5.736 4.707 0.241 293 HE1 TYR 40 HE1 TYR 40 -2.169 1.521 -0.921 294 HE2 TYR 40 HE2 TYR 40 -3.742 4.524 1.668 295 HH TYR 40 HH TYR 40 -1.998 2.950 2.187 296 H ILE 41 H ILE 41 -7.482 0.723 -3.524 297 HA ILE 41 HA ILE 41 -6.466 -1.469 -1.827 298 HB ILE 41 HB ILE 41 -8.095 -1.767 -4.355 299 1HG1 ILE 41 1HG1 ILE 41 -9.081 -2.059 -1.511 300 2HG1 ILE 41 2HG1 ILE 41 -9.352 -0.624 -2.492 301 1HG2 ILE 41 1HG2 ILE 41 -7.361 -3.715 -2.172 302 2HG2 ILE 41 2HG2 ILE 41 -6.706 -3.683 -3.809 303 3HG2 ILE 41 3HG2 ILE 41 -8.407 -4.069 -3.550 304 1HD1 ILE 41 1HD1 ILE 41 -10.317 -3.398 -3.135 305 2HD1 ILE 41 2HD1 ILE 41 -10.602 -1.950 -4.102 306 3HD1 ILE 41 3HD1 ILE 41 -11.294 -2.084 -2.483 307 H TYR 42 H TYR 42 -4.381 -1.768 -2.249 308 HA TYR 42 HA TYR 42 -3.341 -1.167 -4.925 309 1HB TYR 42 1HB TYR 42 -2.367 -0.153 -2.788 310 2HB TYR 42 2HB TYR 42 -1.764 -1.760 -2.415 311 HD1 TYR 42 HD1 TYR 42 -0.666 -2.746 -4.903 312 HD2 TYR 42 HD2 TYR 42 -0.615 1.207 -3.330 313 HE1 TYR 42 HE1 TYR 42 1.381 -2.271 -6.176 314 HE2 TYR 42 HE2 TYR 42 1.429 1.690 -4.601 315 HH TYR 42 HH TYR 42 2.579 -0.292 -7.076 316 H TYR 43 H TYR 43 -3.398 -2.922 -6.226 317 HA TYR 43 HA TYR 43 -2.839 -5.576 -5.153 318 1HB TYR 43 1HB TYR 43 -3.396 -4.700 -8.002 319 2HB TYR 43 2HB TYR 43 -3.308 -6.363 -7.435 320 HD1 TYR 43 HD1 TYR 43 -5.052 -7.195 -5.826 321 HD2 TYR 43 HD2 TYR 43 -5.393 -3.454 -7.828 322 HE1 TYR 43 HE1 TYR 43 -7.463 -7.159 -5.343 323 HE2 TYR 43 HE2 TYR 43 -7.802 -3.407 -7.344 324 HH TYR 43 HH TYR 43 -9.607 -5.002 -6.840 325 H LEU 44 H LEU 44 -0.774 -6.201 -4.922 326 HA LEU 44 HA LEU 44 1.338 -4.576 -5.907 327 1HB LEU 44 1HB LEU 44 1.292 -7.183 -4.428 328 2HB LEU 44 2HB LEU 44 2.796 -6.501 -5.013 329 HG LEU 44 HG LEU 44 2.062 -4.377 -3.690 330 1HD1 LEU 44 1HD1 LEU 44 0.416 -6.496 -2.322 331 2HD1 LEU 44 2HD1 LEU 44 -0.187 -5.056 -3.145 332 3HD1 LEU 44 3HD1 LEU 44 0.768 -4.895 -1.669 333 1HD2 LEU 44 1HD2 LEU 44 2.993 -6.879 -2.292 334 2HD2 LEU 44 2HD2 LEU 44 3.167 -5.231 -1.687 335 3HD2 LEU 44 3HD2 LEU 44 4.008 -5.724 -3.155 336 H ALA 45 H ALA 45 -0.026 -7.622 -7.017 337 HA ALA 45 HA ALA 45 2.170 -8.375 -8.638 338 1HB ALA 45 1HB ALA 45 -0.707 -9.200 -8.958 339 2HB ALA 45 2HB ALA 45 0.455 -9.964 -7.876 340 3HB ALA 45 3HB ALA 45 0.706 -10.020 -9.620 341 H THR 46 H THR 46 -0.748 -6.505 -9.326 342 HA THR 46 HA THR 46 0.142 -6.174 -12.096 343 HB THR 46 HB THR 46 -2.120 -5.036 -12.344 344 HG1 THR 46 HG1 THR 46 -3.624 -5.595 -10.641 345 1HG2 THR 46 1HG2 THR 46 -2.044 -7.936 -11.494 346 2HG2 THR 46 2HG2 THR 46 -1.750 -7.313 -13.118 347 3HG2 THR 46 3HG2 THR 46 -3.353 -7.173 -12.398 348 H GLU 47 H GLU 47 0.477 -4.717 -9.170 349 HA GLU 47 HA GLU 47 1.027 -2.688 -8.372 350 1HB GLU 47 1HB GLU 47 1.886 -2.354 -11.236 351 2HB GLU 47 2HB GLU 47 2.110 -1.084 -10.041 352 1HG GLU 47 1HG GLU 47 3.402 -2.701 -8.658 353 2HG GLU 47 2HG GLU 47 3.290 -3.852 -9.991 354 H ASN 48 H ASN 48 -1.681 -3.203 -9.589 355 HA ASN 48 HA ASN 48 -2.506 -0.560 -10.447 356 1HB ASN 48 1HB ASN 48 -4.034 -3.138 -10.082 357 2HB ASN 48 2HB ASN 48 -4.807 -1.617 -10.512 358 1HD2 ASN 48 1HD2 ASN 48 -4.740 -4.062 -12.009 359 2HD2 ASN 48 2HD2 ASN 48 -3.985 -3.693 -13.529 360 H VAL 49 H VAL 49 -2.940 0.954 -9.066 361 HA VAL 49 HA VAL 49 -3.726 0.261 -6.325 362 HB VAL 49 HB VAL 49 -3.083 3.042 -7.269 363 1HG1 VAL 49 1HG1 VAL 49 -2.792 1.657 -4.608 364 2HG1 VAL 49 2HG1 VAL 49 -4.047 2.814 -5.057 365 3HG1 VAL 49 3HG1 VAL 49 -2.365 3.335 -4.943 366 1HG2 VAL 49 1HG2 VAL 49 -1.072 0.967 -6.411 367 2HG2 VAL 49 2HG2 VAL 49 -0.738 2.682 -6.660 368 3HG2 VAL 49 3HG2 VAL 49 -1.226 1.671 -8.021 369 H HIS 50 H HIS 50 -5.898 0.081 -6.139 370 HA HIS 50 HA HIS 50 -7.637 1.784 -7.762 371 1HB HIS 50 1HB HIS 50 -8.166 -0.587 -5.971 372 2HB HIS 50 2HB HIS 50 -9.465 0.389 -6.637 373 HD1 HIS 50 HD1 HIS 50 -10.342 -1.676 -7.939 374 HD2 HIS 50 HD2 HIS 50 -6.519 -0.447 -9.032 375 HE1 HIS 50 HE1 HIS 50 -9.832 -2.866 -10.091 376 HE2 HIS 50 HE2 HIS 50 -7.655 -1.886 -10.863 377 H ILE 51 H ILE 51 -7.450 3.830 -6.797 378 HA ILE 51 HA ILE 51 -8.031 4.099 -3.962 379 HB ILE 51 HB ILE 51 -7.630 6.229 -6.076 380 1HG1 ILE 51 1HG1 ILE 51 -5.568 6.664 -4.554 381 2HG1 ILE 51 2HG1 ILE 51 -5.839 5.022 -3.983 382 1HG2 ILE 51 1HG2 ILE 51 -9.117 7.022 -4.316 383 2HG2 ILE 51 2HG2 ILE 51 -7.548 7.825 -4.225 384 3HG2 ILE 51 3HG2 ILE 51 -7.946 6.532 -3.092 385 1HD1 ILE 51 1HD1 ILE 51 -5.292 5.859 -6.817 386 2HD1 ILE 51 2HD1 ILE 51 -5.613 4.209 -6.284 387 3HD1 ILE 51 3HD1 ILE 51 -4.171 5.054 -5.721 388 H VAL 52 H VAL 52 -10.093 3.642 -3.459 389 HA VAL 52 HA VAL 52 -12.244 4.473 -5.231 390 HB VAL 52 HB VAL 52 -12.535 3.114 -2.555 391 1HG1 VAL 52 1HG1 VAL 52 -14.321 3.259 -4.982 392 2HG1 VAL 52 2HG1 VAL 52 -14.565 4.087 -3.444 393 3HG1 VAL 52 3HG1 VAL 52 -14.656 2.327 -3.521 394 1HG2 VAL 52 1HG2 VAL 52 -11.042 1.753 -3.890 395 2HG2 VAL 52 2HG2 VAL 52 -12.151 1.831 -5.259 396 3HG2 VAL 52 3HG2 VAL 52 -12.623 0.981 -3.788 397 H LEU 53 H LEU 53 -12.992 6.456 -5.080 398 HA LEU 53 HA LEU 53 -12.522 8.069 -2.743 399 1HB LEU 53 1HB LEU 53 -14.102 8.687 -5.242 400 2HB LEU 53 2HB LEU 53 -13.607 9.850 -4.026 401 HG LEU 53 HG LEU 53 -11.770 8.300 -5.853 402 1HD1 LEU 53 1HD1 LEU 53 -12.501 11.223 -5.769 403 2HD1 LEU 53 2HD1 LEU 53 -12.992 10.060 -7.002 404 3HD1 LEU 53 3HD1 LEU 53 -11.292 10.494 -6.826 405 1HD2 LEU 53 1HD2 LEU 53 -9.984 9.671 -4.898 406 2HD2 LEU 53 2HD2 LEU 53 -10.753 8.675 -3.662 407 3HD2 LEU 53 3HD2 LEU 53 -11.133 10.393 -3.773 408 H LYS 54 H LYS 54 -14.389 9.422 -1.893 409 HA LYS 54 HA LYS 54 -16.464 7.611 -1.014 410 1HB LYS 54 1HB LYS 54 -15.336 9.238 0.521 411 2HB LYS 54 2HB LYS 54 -16.101 10.548 -0.368 412 1HG LYS 54 1HG LYS 54 -18.300 9.703 0.275 413 2HG LYS 54 2HG LYS 54 -17.535 8.380 1.159 414 1HD LYS 54 1HD LYS 54 -16.465 9.969 2.647 415 2HD LYS 54 2HD LYS 54 -17.146 11.317 1.732 416 1HE LYS 54 1HE LYS 54 -19.407 10.532 2.306 417 2HE LYS 54 2HE LYS 54 -18.699 9.226 3.256 418 1HZ LYS 54 1HZ LYS 54 -17.806 10.756 4.790 419 2HZ LYS 54 2HZ LYS 54 -19.407 11.249 4.530 420 3HZ LYS 54 3HZ LYS 54 -18.136 12.085 3.786 421 H ASN 55 H ASN 55 -15.993 9.523 -3.641 422 HA ASN 55 HA ASN 55 -18.836 10.109 -4.035 423 1HB ASN 55 1HB ASN 55 -16.981 11.850 -4.435 424 2HB ASN 55 2HB ASN 55 -16.575 10.910 -5.867 425 1HD2 ASN 55 1HD2 ASN 55 -18.993 12.882 -4.328 426 2HD2 ASN 55 2HD2 ASN 55 -19.898 13.245 -5.763 427 H ASP 56 H ASP 56 -17.493 7.454 -4.113 428 HA ASP 56 HA ASP 56 -18.028 5.484 -5.115 429 1HB ASP 56 1HB ASP 56 -20.175 6.446 -5.775 430 2HB ASP 56 2HB ASP 56 -19.430 7.181 -7.189 431 H ASN 57 H ASN 57 -16.645 8.031 -7.052 432 HA ASN 57 HA ASN 57 -15.745 6.469 -9.207 433 1HB ASN 57 1HB ASN 57 -15.876 8.902 -9.334 434 2HB ASN 57 2HB ASN 57 -14.630 9.053 -8.100 435 1HD2 ASN 57 1HD2 ASN 57 -12.502 8.750 -8.647 436 2HD2 ASN 57 2HD2 ASN 57 -11.964 8.608 -10.283 437 H THR 58 H THR 58 -14.170 5.054 -9.402 438 HA THR 58 HA THR 58 -12.172 4.863 -7.254 439 HB THR 58 HB THR 58 -12.931 2.819 -9.355 440 HG1 THR 58 HG1 THR 58 -14.397 3.424 -7.441 441 1HG2 THR 58 1HG2 THR 58 -10.604 2.595 -8.601 442 2HG2 THR 58 2HG2 THR 58 -11.599 1.257 -8.024 443 3HG2 THR 58 3HG2 THR 58 -11.151 2.562 -6.924 444 H VAL 59 H VAL 59 -10.325 5.864 -7.697 445 HA VAL 59 HA VAL 59 -9.429 6.183 -10.459 446 HB VAL 59 HB VAL 59 -8.073 7.165 -7.938 447 1HG1 VAL 59 1HG1 VAL 59 -6.965 8.744 -9.451 448 2HG1 VAL 59 2HG1 VAL 59 -7.780 7.995 -10.823 449 3HG1 VAL 59 3HG1 VAL 59 -6.615 7.071 -9.878 450 1HG2 VAL 59 1HG2 VAL 59 -9.098 9.343 -8.394 451 2HG2 VAL 59 2HG2 VAL 59 -10.310 8.108 -8.057 452 3HG2 VAL 59 3HG2 VAL 59 -10.020 8.629 -9.717 453 H LEU 60 H LEU 60 -8.517 4.350 -11.221 454 HA LEU 60 HA LEU 60 -6.754 2.878 -9.423 455 1HB LEU 60 1HB LEU 60 -6.993 0.953 -10.836 456 2HB LEU 60 2HB LEU 60 -8.559 1.564 -10.384 457 HG LEU 60 HG LEU 60 -8.876 0.900 -12.560 458 1HD1 LEU 60 1HD1 LEU 60 -9.668 3.175 -12.340 459 2HD1 LEU 60 2HD1 LEU 60 -9.123 2.843 -13.985 460 3HD1 LEU 60 3HD1 LEU 60 -8.107 3.784 -12.893 461 1HD2 LEU 60 1HD2 LEU 60 -6.199 2.042 -13.306 462 2HD2 LEU 60 2HD2 LEU 60 -7.321 1.234 -14.401 463 3HD2 LEU 60 3HD2 LEU 60 -6.588 0.339 -13.069 464 H LEU 61 H LEU 61 -4.679 2.964 -9.582 465 HA LEU 61 HA LEU 61 -3.490 4.268 -11.950 466 1HB LEU 61 1HB LEU 61 -2.081 3.953 -9.327 467 2HB LEU 61 2HB LEU 61 -1.820 5.149 -10.576 468 HG LEU 61 HG LEU 61 -4.226 5.094 -8.769 469 1HD1 LEU 61 1HD1 LEU 61 -2.086 5.464 -7.581 470 2HD1 LEU 61 2HD1 LEU 61 -3.176 6.844 -7.530 471 3HD1 LEU 61 3HD1 LEU 61 -1.795 6.856 -8.624 472 1HD2 LEU 61 1HD2 LEU 61 -3.180 7.195 -10.658 473 2HD2 LEU 61 2HD2 LEU 61 -4.566 7.370 -9.583 474 3HD2 LEU 61 3HD2 LEU 61 -4.618 6.205 -10.905 475 H LYS 62 H LYS 62 -1.022 3.700 -11.965 476 HA LYS 62 HA LYS 62 -0.523 0.905 -11.226 477 1HB LYS 62 1HB LYS 62 0.287 2.317 -13.774 478 2HB LYS 62 2HB LYS 62 1.092 0.862 -13.205 479 1HG LYS 62 1HG LYS 62 -1.059 -0.331 -13.291 480 2HG LYS 62 2HG LYS 62 -1.811 1.127 -13.946 481 1HD LYS 62 1HD LYS 62 -0.423 1.027 -15.902 482 2HD LYS 62 2HD LYS 62 0.518 -0.305 -15.222 483 1HE LYS 62 1HE LYS 62 -2.422 -0.402 -15.889 484 2HE LYS 62 2HE LYS 62 -1.129 -1.058 -16.894 485 1HZ LYS 62 1HZ LYS 62 -0.579 -2.626 -15.205 486 2HZ LYS 62 2HZ LYS 62 -2.254 -2.720 -15.463 487 3HZ LYS 62 3HZ LYS 62 -1.656 -1.915 -14.100 488 H GLY 63 H GLY 63 1.303 0.641 -10.049 489 1HA GLY 63 1HA GLY 63 2.607 2.786 -8.847 490 2HA GLY 63 2HA GLY 63 3.245 1.147 -8.931 491 H LEU 64 H LEU 64 4.251 0.556 -11.057 492 HA LEU 64 HA LEU 64 5.306 2.846 -12.543 493 1HB LEU 64 1HB LEU 64 6.859 1.968 -10.624 494 2HB LEU 64 2HB LEU 64 7.162 0.637 -11.720 495 HG LEU 64 HG LEU 64 8.888 2.437 -11.768 496 1HD1 LEU 64 1HD1 LEU 64 8.630 0.933 -13.666 497 2HD1 LEU 64 2HD1 LEU 64 9.087 2.552 -14.192 498 3HD1 LEU 64 3HD1 LEU 64 7.418 2.008 -14.365 499 1HD2 LEU 64 1HD2 LEU 64 6.644 4.056 -12.962 500 2HD2 LEU 64 2HD2 LEU 64 8.346 4.524 -12.954 501 3HD2 LEU 64 3HD2 LEU 64 7.470 4.358 -11.433 502 H LYS 65 H LYS 65 4.926 -0.662 -12.235 503 HA LYS 65 HA LYS 65 4.524 -0.849 -15.116 504 1HB LYS 65 1HB LYS 65 6.960 -1.121 -14.752 505 2HB LYS 65 2HB LYS 65 6.638 -2.483 -13.694 506 1HG LYS 65 1HG LYS 65 5.699 -3.732 -15.560 507 2HG LYS 65 2HG LYS 65 5.969 -2.350 -16.628 508 1HD LYS 65 1HD LYS 65 8.384 -2.492 -16.174 509 2HD LYS 65 2HD LYS 65 8.097 -3.897 -15.146 510 1HE LYS 65 1HE LYS 65 7.239 -5.136 -17.056 511 2HE LYS 65 2HE LYS 65 7.457 -3.721 -18.088 512 1HZ LYS 65 1HZ LYS 65 9.846 -3.824 -17.618 513 2HZ LYS 65 2HZ LYS 65 9.294 -5.236 -18.374 514 3HZ LYS 65 3HZ LYS 65 9.612 -5.232 -16.705 515 H ASN 66 H ASN 66 5.378 -3.541 -13.049 516 HA ASN 66 HA ASN 66 2.990 -4.307 -11.966 517 1HB ASN 66 1HB ASN 66 2.227 -6.142 -13.511 518 2HB ASN 66 2HB ASN 66 1.926 -4.517 -14.102 519 1HD2 ASN 66 1HD2 ASN 66 3.641 -7.466 -14.582 520 2HD2 ASN 66 2HD2 ASN 66 4.275 -7.094 -16.146 521 H ILE 67 H ILE 67 3.853 -5.414 -10.366 522 HA ILE 67 HA ILE 67 6.269 -6.967 -10.822 523 HB ILE 67 HB ILE 67 4.849 -6.377 -8.215 524 1HG1 ILE 67 1HG1 ILE 67 7.344 -5.132 -9.390 525 2HG1 ILE 67 2HG1 ILE 67 5.757 -4.372 -9.394 526 1HG2 ILE 67 1HG2 ILE 67 6.194 -8.397 -8.086 527 2HG2 ILE 67 2HG2 ILE 67 6.970 -7.094 -7.183 528 3HG2 ILE 67 3HG2 ILE 67 7.574 -7.544 -8.777 529 1HD1 ILE 67 1HD1 ILE 67 7.344 -5.111 -6.947 530 2HD1 ILE 67 2HD1 ILE 67 5.766 -4.323 -6.965 531 3HD1 ILE 67 3HD1 ILE 67 7.173 -3.494 -7.630 532 H VAL 68 H VAL 68 5.406 -8.716 -11.985 533 HA VAL 68 HA VAL 68 3.476 -10.432 -10.675 534 HB VAL 68 HB VAL 68 5.011 -11.131 -13.171 535 1HG1 VAL 68 1HG1 VAL 68 3.702 -12.921 -12.199 536 2HG1 VAL 68 2HG1 VAL 68 2.966 -12.391 -13.711 537 3HG1 VAL 68 3HG1 VAL 68 2.271 -11.893 -12.169 538 1HG2 VAL 68 1HG2 VAL 68 3.253 -10.079 -14.497 539 2HG2 VAL 68 2HG2 VAL 68 4.088 -8.892 -13.494 540 3HG2 VAL 68 3HG2 VAL 68 2.493 -9.478 -13.022 541 H SER 69 H SER 69 6.136 -9.837 -9.569 542 HA SER 69 HA SER 69 7.388 -12.476 -9.506 543 1HB SER 69 1HB SER 69 8.307 -9.825 -8.371 544 2HB SER 69 2HB SER 69 9.245 -11.320 -8.379 545 HG SER 69 HG SER 69 8.948 -11.234 -10.752 546 H VAL 70 H VAL 70 4.859 -11.276 -8.097 547 HA VAL 70 HA VAL 70 5.319 -11.446 -5.314 548 HB VAL 70 HB VAL 70 2.746 -11.881 -6.851 549 1HG1 VAL 70 1HG1 VAL 70 2.618 -12.786 -4.587 550 2HG1 VAL 70 2HG1 VAL 70 1.608 -11.349 -4.754 551 3HG1 VAL 70 3HG1 VAL 70 3.164 -11.244 -3.931 552 1HG2 VAL 70 1HG2 VAL 70 2.265 -9.539 -6.272 553 2HG2 VAL 70 2HG2 VAL 70 3.690 -9.696 -7.300 554 3HG2 VAL 70 3HG2 VAL 70 3.879 -9.394 -5.572 555 H LYS 71 H LYS 71 5.328 -13.139 -3.956 556 HA LYS 71 HA LYS 71 5.420 -15.793 -5.124 557 1HB LYS 71 1HB LYS 71 5.907 -14.823 -2.300 558 2HB LYS 71 2HB LYS 71 6.114 -16.484 -2.839 559 1HG LYS 71 1HG LYS 71 7.628 -14.133 -3.951 560 2HG LYS 71 2HG LYS 71 8.226 -15.209 -2.686 561 1HD LYS 71 1HD LYS 71 8.059 -17.106 -4.219 562 2HD LYS 71 2HD LYS 71 7.439 -16.037 -5.480 563 1HE LYS 71 1HE LYS 71 9.520 -14.807 -5.510 564 2HE LYS 71 2HE LYS 71 10.139 -15.763 -4.162 565 1HZ LYS 71 1HZ LYS 71 10.079 -17.725 -5.539 566 2HZ LYS 71 2HZ LYS 71 10.990 -16.520 -6.314 567 3HZ LYS 71 3HZ LYS 71 9.409 -16.852 -6.831 568 H PHE 72 H PHE 72 3.885 -17.319 -4.902 569 HA PHE 72 HA PHE 72 1.362 -16.559 -3.740 570 1HB PHE 72 1HB PHE 72 2.239 -19.156 -5.024 571 2HB PHE 72 2HB PHE 72 0.594 -18.787 -4.521 572 HD1 PHE 72 HD1 PHE 72 3.101 -18.381 -7.080 573 HD2 PHE 72 HD2 PHE 72 -0.653 -16.964 -5.661 574 HE1 PHE 72 HE1 PHE 72 2.668 -17.356 -9.271 575 HE2 PHE 72 HE2 PHE 72 -1.096 -15.939 -7.855 576 HZ PHE 72 HZ PHE 72 0.568 -16.136 -9.666 577 H SER 73 H SER 73 2.060 -16.287 -1.582 578 HA SER 73 HA SER 73 2.209 -18.797 -0.083 579 1HB SER 73 1HB SER 73 4.041 -16.423 0.380 580 2HB SER 73 2HB SER 73 4.001 -17.904 1.337 581 HG SER 73 HG SER 73 4.341 -18.231 -1.395 582 H LYS 74 H LYS 74 1.980 -18.282 2.336 583 HA LYS 74 HA LYS 74 0.287 -15.949 2.844 584 1HB LYS 74 1HB LYS 74 -0.530 -18.792 3.515 585 2HB LYS 74 2HB LYS 74 -1.393 -17.343 4.005 586 1HG LYS 74 1HG LYS 74 -1.944 -16.841 1.713 587 2HG LYS 74 2HG LYS 74 -0.969 -18.198 1.149 588 1HD LYS 74 1HD LYS 74 -2.447 -19.752 2.327 589 2HD LYS 74 2HD LYS 74 -3.417 -18.396 2.902 590 1HE LYS 74 1HE LYS 74 -3.996 -17.821 0.600 591 2HE LYS 74 2HE LYS 74 -2.993 -19.144 0.009 592 1HZ LYS 74 1HZ LYS 74 -5.369 -19.487 1.763 593 2HZ LYS 74 2HZ LYS 74 -4.446 -20.724 1.061 594 3HZ LYS 74 3HZ LYS 74 -5.372 -19.702 0.082 595 H ASP 75 H ASP 75 2.264 -15.315 3.961 596 HA ASP 75 HA ASP 75 2.512 -16.613 6.590 597 1HB ASP 75 1HB ASP 75 4.344 -17.517 5.378 598 2HB ASP 75 2HB ASP 75 4.735 -15.960 4.659 599 H ARG 76 H ARG 76 2.577 -15.246 8.266 600 HA ARG 76 HA ARG 76 2.634 -12.384 7.681 601 1HB ARG 76 1HB ARG 76 0.882 -13.484 9.187 602 2HB ARG 76 2HB ARG 76 2.164 -13.651 10.378 603 1HG ARG 76 1HG ARG 76 2.493 -11.220 10.344 604 2HG ARG 76 2HG ARG 76 1.165 -11.073 9.194 605 1HD ARG 76 1HD ARG 76 0.163 -10.594 11.233 606 2HD ARG 76 2HD ARG 76 -0.235 -12.291 10.976 607 HE ARG 76 HE ARG 76 2.079 -12.344 12.440 608 1HH1 ARG 76 1HH1 ARG 76 -1.052 -10.839 12.862 609 2HH1 ARG 76 2HH1 ARG 76 -1.021 -10.952 14.591 610 1HH2 ARG 76 1HH2 ARG 76 2.139 -12.477 14.713 611 2HH2 ARG 76 2HH2 ARG 76 0.793 -11.888 15.651 612 H HIS 77 H HIS 77 4.694 -14.851 8.793 613 HA HIS 77 HA HIS 77 6.231 -13.403 10.677 614 1HB HIS 77 1HB HIS 77 6.303 -15.834 10.609 615 2HB HIS 77 2HB HIS 77 6.974 -15.794 8.982 616 HD1 HIS 77 HD1 HIS 77 9.440 -15.863 8.814 617 HD2 HIS 77 HD2 HIS 77 8.165 -14.677 12.593 618 HE1 HIS 77 HE1 HIS 77 11.530 -15.678 10.213 619 HE2 HIS 77 HE2 HIS 77 10.747 -14.827 12.455 620 H LEU 78 H LEU 78 6.619 -13.930 7.183 621 HA LEU 78 HA LEU 78 9.074 -12.545 6.967 622 1HB LEU 78 1HB LEU 78 8.117 -14.086 5.256 623 2HB LEU 78 2HB LEU 78 6.939 -12.849 4.853 624 HG LEU 78 HG LEU 78 8.701 -11.365 4.079 625 1HD1 LEU 78 1HD1 LEU 78 11.029 -12.106 3.975 626 2HD1 LEU 78 2HD1 LEU 78 10.599 -13.586 4.833 627 3HD1 LEU 78 3HD1 LEU 78 10.457 -12.024 5.642 628 1HD2 LEU 78 1HD2 LEU 78 7.757 -12.976 2.499 629 2HD2 LEU 78 2HD2 LEU 78 9.000 -14.146 2.949 630 3HD2 LEU 78 3HD2 LEU 78 9.452 -12.642 2.145 631 H ILE 79 H ILE 79 5.713 -11.488 6.747 632 HA ILE 79 HA ILE 79 6.153 -8.783 6.095 633 HB ILE 79 HB ILE 79 3.980 -9.893 7.891 634 1HG1 ILE 79 1HG1 ILE 79 3.940 -9.488 4.893 635 2HG1 ILE 79 2HG1 ILE 79 4.128 -11.047 5.689 636 1HG2 ILE 79 1HG2 ILE 79 4.163 -7.476 8.006 637 2HG2 ILE 79 2HG2 ILE 79 2.695 -7.935 7.140 638 3HG2 ILE 79 3HG2 ILE 79 4.106 -7.366 6.248 639 1HD1 ILE 79 1HD1 ILE 79 1.843 -10.695 4.931 640 2HD1 ILE 79 2HD1 ILE 79 1.734 -9.238 5.920 641 3HD1 ILE 79 3HD1 ILE 79 1.926 -10.816 6.688 642 H GLU 80 H GLU 80 5.800 -10.408 9.217 643 HA GLU 80 HA GLU 80 6.197 -8.291 10.954 644 1HB GLU 80 1HB GLU 80 5.524 -10.660 11.505 645 2HB GLU 80 2HB GLU 80 7.217 -11.105 11.357 646 1HG GLU 80 1HG GLU 80 6.915 -10.828 13.636 647 2HG GLU 80 2HG GLU 80 7.637 -9.300 13.128 648 H THR 81 H THR 81 8.602 -10.453 9.507 649 HA THR 81 HA THR 81 10.851 -9.369 10.823 650 HB THR 81 HB THR 81 10.819 -10.796 8.155 651 HG1 THR 81 HG1 THR 81 9.721 -12.007 9.789 652 1HG2 THR 81 1HG2 THR 81 12.966 -9.768 8.722 653 2HG2 THR 81 2HG2 THR 81 13.069 -11.527 8.803 654 3HG2 THR 81 3HG2 THR 81 12.949 -10.581 10.287 655 H THR 82 H THR 82 9.323 -8.645 7.713 656 HA THR 82 HA THR 82 11.328 -6.819 6.856 657 HB THR 82 HB THR 82 8.440 -6.942 5.960 658 HG1 THR 82 HG1 THR 82 9.266 -8.949 5.560 659 1HG2 THR 82 1HG2 THR 82 9.617 -4.924 5.232 660 2HG2 THR 82 2HG2 THR 82 9.328 -6.003 3.867 661 3HG2 THR 82 3HG2 THR 82 10.931 -5.911 4.595 662 H SER 83 H SER 83 8.296 -6.503 8.634 663 HA SER 83 HA SER 83 8.280 -3.682 8.810 664 1HB SER 83 1HB SER 83 6.338 -5.182 9.323 665 2HB SER 83 2HB SER 83 7.160 -5.674 10.803 666 HG SER 83 HG SER 83 6.065 -4.040 11.580 667 H ASN 84 H ASN 84 9.663 -6.229 10.824 668 HA ASN 84 HA ASN 84 10.735 -4.667 12.882 669 1HB ASN 84 1HB ASN 84 10.664 -7.104 13.005 670 2HB ASN 84 2HB ASN 84 11.762 -7.233 11.637 671 1HD2 ASN 84 1HD2 ASN 84 11.454 -6.622 15.013 672 2HD2 ASN 84 2HD2 ASN 84 13.150 -6.622 15.381 673 H LYS 85 H LYS 85 12.111 -5.682 9.783 674 HA LYS 85 HA LYS 85 14.617 -4.447 10.065 675 1HB LYS 85 1HB LYS 85 13.929 -6.191 8.360 676 2HB LYS 85 2HB LYS 85 13.150 -4.896 7.465 677 1HG LYS 85 1HG LYS 85 15.278 -3.778 7.179 678 2HG LYS 85 2HG LYS 85 16.079 -5.010 8.157 679 1HD LYS 85 1HD LYS 85 16.498 -5.571 5.890 680 2HD LYS 85 2HD LYS 85 15.278 -6.705 6.467 681 1HE LYS 85 1HE LYS 85 13.535 -5.276 5.445 682 2HE LYS 85 2HE LYS 85 14.805 -4.245 4.789 683 1HZ LYS 85 1HZ LYS 85 14.221 -5.710 3.073 684 2HZ LYS 85 2HZ LYS 85 14.194 -7.062 4.104 685 3HZ LYS 85 3HZ LYS 85 15.668 -6.337 3.695 686 H LEU 86 H LEU 86 11.556 -3.285 8.734 687 HA LEU 86 HA LEU 86 12.468 -0.786 7.812 688 1HB LEU 86 1HB LEU 86 10.325 -1.667 7.125 689 2HB LEU 86 2HB LEU 86 9.750 -1.670 8.779 690 HG LEU 86 HG LEU 86 9.897 0.821 8.782 691 1HD1 LEU 86 1HD1 LEU 86 10.419 0.447 5.835 692 2HD1 LEU 86 2HD1 LEU 86 11.558 1.084 7.019 693 3HD1 LEU 86 3HD1 LEU 86 10.088 1.978 6.640 694 1HD2 LEU 86 1HD2 LEU 86 8.147 -0.429 6.667 695 2HD2 LEU 86 2HD2 LEU 86 7.895 1.155 7.402 696 3HD2 LEU 86 3HD2 LEU 86 7.782 -0.304 8.389 697 H LYS 87 H LYS 87 11.438 -1.895 10.982 698 HA LYS 87 HA LYS 87 11.230 0.699 12.139 699 1HB LYS 87 1HB LYS 87 10.096 -1.367 12.991 700 2HB LYS 87 2HB LYS 87 11.662 -1.936 13.554 701 1HG LYS 87 1HG LYS 87 10.444 -0.978 15.389 702 2HG LYS 87 2HG LYS 87 11.828 0.050 15.011 703 1HD LYS 87 1HD LYS 87 10.347 1.539 13.727 704 2HD LYS 87 2HD LYS 87 8.971 0.520 14.152 705 1HE LYS 87 1HE LYS 87 9.330 1.009 16.513 706 2HE LYS 87 2HE LYS 87 10.729 2.001 16.102 707 1HZ LYS 87 1HZ LYS 87 9.234 3.441 14.812 708 2HZ LYS 87 2HZ LYS 87 8.833 3.401 16.459 709 3HZ LYS 87 3HZ LYS 87 7.904 2.525 15.340 710 H SER 88 H SER 88 13.809 -1.711 11.982 711 HA SER 88 HA SER 88 15.477 -0.131 13.759 712 1HB SER 88 1HB SER 88 16.047 -2.748 12.355 713 2HB SER 88 2HB SER 88 17.049 -2.009 13.607 714 HG SER 88 HG SER 88 14.855 -2.051 14.798 715 H ARG 89 H ARG 89 15.259 -0.844 10.331 716 HA ARG 89 HA ARG 89 17.825 0.498 9.881 717 1HB ARG 89 1HB ARG 89 16.137 -1.342 8.230 718 2HB ARG 89 2HB ARG 89 17.325 -0.304 7.454 719 1HG ARG 89 1HG ARG 89 17.933 -2.286 9.640 720 2HG ARG 89 2HG ARG 89 18.181 -2.563 7.911 721 1HD ARG 89 1HD ARG 89 19.647 -0.540 7.886 722 2HD ARG 89 2HD ARG 89 19.508 -0.486 9.642 723 HE ARG 89 HE ARG 89 20.463 -2.881 9.458 724 1HH1 ARG 89 1HH1 ARG 89 21.256 -0.203 7.348 725 2HH1 ARG 89 2HH1 ARG 89 22.882 -0.751 7.055 726 1HH2 ARG 89 1HH2 ARG 89 22.590 -3.613 9.069 727 2HH2 ARG 89 2HH2 ARG 89 23.639 -2.699 8.027 728 H GLU 90 H GLU 90 14.412 0.900 9.343 729 HA GLU 90 HA GLU 90 13.143 2.346 8.162 730 1HB GLU 90 1HB GLU 90 14.277 4.015 9.640 731 2HB GLU 90 2HB GLU 90 15.490 4.246 8.387 732 1HG GLU 90 1HG GLU 90 13.784 5.052 6.855 733 2HG GLU 90 2HG GLU 90 12.541 4.782 8.076 734 H ILE 91 H ILE 91 13.392 0.833 6.454 735 HA ILE 91 HA ILE 91 15.360 1.359 4.391 736 HB ILE 91 HB ILE 91 14.404 -0.630 3.275 737 1HG1 ILE 91 1HG1 ILE 91 12.607 -0.785 5.711 738 2HG1 ILE 91 2HG1 ILE 91 12.077 -0.343 4.092 739 1HG2 ILE 91 1HG2 ILE 91 15.112 -0.996 6.184 740 2HG2 ILE 91 2HG2 ILE 91 16.232 -0.929 4.823 741 3HG2 ILE 91 3HG2 ILE 91 15.107 -2.279 4.975 742 1HD1 ILE 91 1HD1 ILE 91 11.535 -2.654 4.634 743 2HD1 ILE 91 2HD1 ILE 91 13.246 -3.000 4.890 744 3HD1 ILE 91 3HD1 ILE 91 12.663 -2.558 3.284 745 H THR 92 H THR 92 14.619 1.381 2.095 746 HA THR 92 HA THR 92 12.755 3.430 1.603 747 HB THR 92 HB THR 92 13.572 1.390 -0.455 748 HG1 THR 92 HG1 THR 92 15.186 3.639 0.106 749 1HG2 THR 92 1HG2 THR 92 13.145 4.379 -0.582 750 2HG2 THR 92 2HG2 THR 92 12.003 3.152 -1.137 751 3HG2 THR 92 3HG2 THR 92 13.563 3.337 -1.942 752 H PHE 93 H PHE 93 10.639 3.378 0.964 753 HA PHE 93 HA PHE 93 8.969 1.379 1.916 754 1HB PHE 93 1HB PHE 93 8.379 3.777 1.385 755 2HB PHE 93 2HB PHE 93 8.292 3.309 -0.307 756 HD1 PHE 93 HD1 PHE 93 6.980 2.056 2.957 757 HD2 PHE 93 HD2 PHE 93 6.185 2.979 -1.121 758 HE1 PHE 93 HE1 PHE 93 4.624 1.430 3.278 759 HE2 PHE 93 HE2 PHE 93 3.827 2.350 -0.806 760 HZ PHE 93 HZ PHE 93 3.043 1.576 1.393 761 H GLN 94 H GLN 94 10.472 1.742 -1.199 762 HA GLN 94 HA GLN 94 8.928 -0.076 -2.682 763 1HB GLN 94 1HB GLN 94 11.849 0.636 -3.015 764 2HB GLN 94 2HB GLN 94 10.829 -0.119 -4.232 765 1HG GLN 94 1HG GLN 94 9.416 1.868 -4.289 766 2HG GLN 94 2HG GLN 94 10.429 2.623 -3.062 767 1HE2 GLN 94 1HE2 GLN 94 12.897 1.535 -4.223 768 2HE2 GLN 94 2HE2 GLN 94 13.199 2.475 -5.637 769 H GLU 95 H GLU 95 11.794 -0.530 -0.667 770 HA GLU 95 HA GLU 95 12.203 -3.264 -1.380 771 1HB GLU 95 1HB GLU 95 13.729 -1.381 -0.167 772 2HB GLU 95 2HB GLU 95 13.180 -2.274 1.240 773 1HG GLU 95 1HG GLU 95 14.611 -3.461 -1.126 774 2HG GLU 95 2HG GLU 95 15.350 -3.052 0.419 775 H TYR 96 H TYR 96 10.614 -1.561 1.257 776 HA TYR 96 HA TYR 96 9.919 -3.690 2.901 777 1HB TYR 96 1HB TYR 96 9.638 -1.346 3.533 778 2HB TYR 96 2HB TYR 96 8.398 -1.141 2.307 779 HD1 TYR 96 HD1 TYR 96 9.135 -3.183 5.345 780 HD2 TYR 96 HD2 TYR 96 6.169 -1.315 2.932 781 HE1 TYR 96 HE1 TYR 96 7.422 -3.771 7.007 782 HE2 TYR 96 HE2 TYR 96 4.447 -1.896 4.591 783 HH TYR 96 HH TYR 96 5.229 -3.051 7.718 784 H ARG 97 H ARG 97 8.250 -2.378 0.066 785 HA ARG 97 HA ARG 97 6.023 -4.149 0.307 786 1HB ARG 97 1HB ARG 97 6.910 -2.506 -2.064 787 2HB ARG 97 2HB ARG 97 5.351 -3.298 -1.888 788 1HG ARG 97 1HG ARG 97 5.075 -1.899 0.228 789 2HG ARG 97 2HG ARG 97 6.434 -0.948 -0.377 790 1HD ARG 97 1HD ARG 97 4.379 0.096 -1.065 791 2HD ARG 97 2HD ARG 97 5.178 -0.586 -2.482 792 HE ARG 97 HE ARG 97 3.596 -2.450 -2.331 793 1HH1 ARG 97 1HH1 ARG 97 2.807 0.552 -0.725 794 2HH1 ARG 97 2HH1 ARG 97 1.106 0.231 -0.670 795 1HH2 ARG 97 1HH2 ARG 97 1.344 -2.878 -2.273 796 2HH2 ARG 97 2HH2 ARG 97 0.274 -1.725 -1.544 797 H ARG 98 H ARG 98 9.114 -4.314 -1.307 798 HA ARG 98 HA ARG 98 8.564 -6.365 -3.136 799 1HB ARG 98 1HB ARG 98 11.071 -5.550 -1.698 800 2HB ARG 98 2HB ARG 98 11.050 -6.990 -2.702 801 1HG ARG 98 1HG ARG 98 10.174 -5.464 -4.559 802 2HG ARG 98 2HG ARG 98 10.690 -4.131 -3.518 803 1HD ARG 98 1HD ARG 98 12.955 -5.009 -3.480 804 2HD ARG 98 2HD ARG 98 12.456 -6.398 -4.441 805 HE ARG 98 HE ARG 98 13.119 -3.784 -5.389 806 1HH1 ARG 98 1HH1 ARG 98 11.142 -6.596 -6.082 807 2HH1 ARG 98 2HH1 ARG 98 11.122 -6.325 -7.796 808 1HH2 ARG 98 1HH2 ARG 98 13.136 -3.446 -7.632 809 2HH2 ARG 98 2HH2 ARG 98 12.287 -4.539 -8.691 810 H ASN 99 H ASN 99 9.644 -6.527 0.236 811 HA ASN 99 HA ASN 99 9.705 -9.388 0.232 812 1HB ASN 99 1HB ASN 99 9.811 -7.424 2.523 813 2HB ASN 99 2HB ASN 99 10.066 -9.160 2.680 814 1HD2 ASN 99 1HD2 ASN 99 11.372 -6.163 1.585 815 2HD2 ASN 99 2HD2 ASN 99 12.962 -6.733 1.219 816 H LEU 100 H LEU 100 7.304 -6.977 0.970 817 HA LEU 100 HA LEU 100 5.440 -8.648 2.250 818 1HB LEU 100 1HB LEU 100 5.111 -6.224 0.497 819 2HB LEU 100 2HB LEU 100 3.740 -7.049 1.216 820 HG LEU 100 HG LEU 100 6.021 -5.890 2.813 821 1HD1 LEU 100 1HD1 LEU 100 4.817 -4.122 1.651 822 2HD1 LEU 100 2HD1 LEU 100 4.477 -4.094 3.382 823 3HD1 LEU 100 3HD1 LEU 100 3.288 -4.755 2.260 824 1HD2 LEU 100 1HD2 LEU 100 4.467 -6.169 4.685 825 2HD2 LEU 100 2HD2 LEU 100 4.839 -7.712 3.913 826 3HD2 LEU 100 3HD2 LEU 100 3.296 -6.914 3.596 827 H ALA 101 H ALA 101 6.011 -7.968 -1.176 828 HA ALA 101 HA ALA 101 4.005 -9.652 -2.212 829 1HB ALA 101 1HB ALA 101 6.635 -8.874 -3.470 830 2HB ALA 101 2HB ALA 101 5.139 -7.945 -3.552 831 3HB ALA 101 3HB ALA 101 5.236 -9.535 -4.314 832 H LYS 102 H LYS 102 7.240 -10.268 -1.053 833 HA LYS 102 HA LYS 102 7.472 -12.928 -2.048 834 1HB LYS 102 1HB LYS 102 8.846 -11.608 0.303 835 2HB LYS 102 2HB LYS 102 9.321 -13.133 -0.427 836 1HG LYS 102 1HG LYS 102 9.932 -12.029 -2.469 837 2HG LYS 102 2HG LYS 102 9.303 -10.492 -1.869 838 1HD LYS 102 1HD LYS 102 10.967 -10.584 -0.035 839 2HD LYS 102 2HD LYS 102 11.632 -12.050 -0.756 840 1HE LYS 102 1HE LYS 102 12.194 -10.822 -2.775 841 2HE LYS 102 2HE LYS 102 11.471 -9.360 -2.107 842 1HZ LYS 102 1HZ LYS 102 13.877 -9.351 -1.878 843 2HZ LYS 102 2HZ LYS 102 13.821 -10.792 -0.981 844 3HZ LYS 102 3HZ LYS 102 13.131 -9.377 -0.357 845 H ALA 103 H ALA 103 6.017 -11.484 0.768 846 HA ALA 103 HA ALA 103 5.725 -13.980 2.193 847 1HB ALA 103 1HB ALA 103 4.464 -12.651 3.824 848 2HB ALA 103 2HB ALA 103 4.531 -11.263 2.738 849 3HB ALA 103 3HB ALA 103 6.015 -11.907 3.438 850 H GLY 104 H GLY 104 4.135 -12.490 -0.346 851 1HA GLY 104 1HA GLY 104 2.410 -13.665 -1.503 852 2HA GLY 104 2HA GLY 104 1.834 -14.273 0.043 853 H VAL 105 H VAL 105 2.620 -11.005 0.258 854 HA VAL 105 HA VAL 105 -0.126 -10.276 0.562 855 HB VAL 105 HB VAL 105 2.317 -8.490 0.464 856 1HG1 VAL 105 1HG1 VAL 105 -0.497 -7.932 1.405 857 2HG1 VAL 105 2HG1 VAL 105 0.294 -7.236 -0.010 858 3HG1 VAL 105 3HG1 VAL 105 0.880 -6.846 1.608 859 1HG2 VAL 105 1HG2 VAL 105 0.811 -9.642 2.811 860 2HG2 VAL 105 2HG2 VAL 105 2.141 -8.489 2.908 861 3HG2 VAL 105 3HG2 VAL 105 2.426 -10.110 2.278 862 H PHE 106 H PHE 106 -1.292 -10.370 -1.222 863 HA PHE 106 HA PHE 106 -0.279 -9.246 -3.722 864 1HB PHE 106 1HB PHE 106 -1.157 -11.426 -4.006 865 2HB PHE 106 2HB PHE 106 -2.565 -11.076 -3.014 866 HD1 PHE 106 HD1 PHE 106 -0.962 -10.240 -6.255 867 HD2 PHE 106 HD2 PHE 106 -4.555 -10.385 -3.983 868 HE1 PHE 106 HE1 PHE 106 -2.259 -9.715 -8.277 869 HE2 PHE 106 HE2 PHE 106 -5.861 -9.862 -6.003 870 HZ PHE 106 HZ PHE 106 -4.709 -9.525 -8.156 871 H ARG 107 H ARG 107 -2.658 -8.715 -1.236 872 HA ARG 107 HA ARG 107 -3.720 -6.452 -2.786 873 1HB ARG 107 1HB ARG 107 -5.319 -8.323 -2.709 874 2HB ARG 107 2HB ARG 107 -5.272 -8.284 -0.955 875 1HG ARG 107 1HG ARG 107 -6.271 -6.093 -0.929 876 2HG ARG 107 2HG ARG 107 -6.207 -6.009 -2.692 877 1HD ARG 107 1HD ARG 107 -7.784 -8.003 -1.067 878 2HD ARG 107 2HD ARG 107 -8.445 -6.596 -1.898 879 HE ARG 107 HE ARG 107 -7.128 -8.035 -3.833 880 1HH1 ARG 107 1HH1 ARG 107 -9.747 -8.646 -1.591 881 2HH1 ARG 107 2HH1 ARG 107 -10.528 -9.805 -2.635 882 1HH2 ARG 107 1HH2 ARG 107 -8.166 -9.554 -5.212 883 2HH2 ARG 107 2HH2 ARG 107 -9.630 -10.320 -4.671 884 H TRP 108 H TRP 108 -2.827 -4.762 -1.872 885 HA TRP 108 HA TRP 108 -2.635 -4.518 1.031 886 1HB TRP 108 1HB TRP 108 -0.680 -3.871 -0.239 887 2HB TRP 108 2HB TRP 108 -1.639 -2.832 -1.279 888 HD1 TRP 108 HD1 TRP 108 -2.906 -0.721 0.307 889 HE1 TRP 108 HE1 TRP 108 -1.673 0.831 1.941 890 HE3 TRP 108 HE3 TRP 108 1.221 -3.598 1.186 891 HZ2 TRP 108 HZ2 TRP 108 0.735 0.840 3.408 892 HZ3 TRP 108 HZ3 TRP 108 2.946 -2.742 2.707 893 HH2 TRP 108 HH2 TRP 108 2.711 -0.568 3.797 894 H VAL 109 H VAL 109 -4.476 -3.871 1.996 895 HA VAL 109 HA VAL 109 -6.090 -1.824 0.616 896 HB VAL 109 HB VAL 109 -6.994 -3.780 2.742 897 1HG1 VAL 109 1HG1 VAL 109 -8.226 -1.684 2.842 898 2HG1 VAL 109 2HG1 VAL 109 -9.252 -2.976 2.219 899 3HG1 VAL 109 3HG1 VAL 109 -8.568 -1.784 1.115 900 1HG2 VAL 109 1HG2 VAL 109 -6.539 -4.895 0.625 901 2HG2 VAL 109 2HG2 VAL 109 -7.556 -3.731 -0.222 902 3HG2 VAL 109 3HG2 VAL 109 -8.273 -4.845 0.943 903 H THR 110 H THR 110 -6.202 0.137 1.514 904 HA THR 110 HA THR 110 -5.694 0.352 4.404 905 HB THR 110 HB THR 110 -4.796 2.354 2.324 906 HG1 THR 110 HG1 THR 110 -3.663 0.104 3.116 907 1HG2 THR 110 1HG2 THR 110 -4.379 2.272 5.317 908 2HG2 THR 110 2HG2 THR 110 -5.396 3.415 4.438 909 3HG2 THR 110 3HG2 THR 110 -3.646 3.435 4.215 910 H ASN 111 H ASN 111 -7.528 0.872 5.324 911 HA ASN 111 HA ASN 111 -9.468 2.550 3.918 912 1HB ASN 111 1HB ASN 111 -9.657 0.946 6.481 913 2HB ASN 111 2HB ASN 111 -10.965 1.931 5.836 914 1HD2 ASN 111 1HD2 ASN 111 -12.156 1.186 4.138 915 2HD2 ASN 111 2HD2 ASN 111 -11.983 -0.409 3.474 916 H ILE 112 H ILE 112 -9.301 4.671 4.209 917 HA ILE 112 HA ILE 112 -7.471 5.771 6.056 918 HB ILE 112 HB ILE 112 -9.578 7.164 4.407 919 1HG1 ILE 112 1HG1 ILE 112 -8.011 5.945 3.018 920 2HG1 ILE 112 2HG1 ILE 112 -7.657 7.666 2.908 921 1HG2 ILE 112 1HG2 ILE 112 -8.246 9.190 4.731 922 2HG2 ILE 112 2HG2 ILE 112 -7.163 8.308 5.810 923 3HG2 ILE 112 3HG2 ILE 112 -8.848 8.564 6.267 924 1HD1 ILE 112 1HD1 ILE 112 -6.159 5.678 4.600 925 2HD1 ILE 112 2HD1 ILE 112 -5.792 7.396 4.439 926 3HD1 ILE 112 3HD1 ILE 112 -5.630 6.323 3.048 927 H HIS 113 H HIS 113 -11.042 6.107 5.941 928 HA HIS 113 HA HIS 113 -10.988 7.400 8.516 929 1HB HIS 113 1HB HIS 113 -13.442 7.524 8.320 930 2HB HIS 113 2HB HIS 113 -12.625 8.168 6.904 931 HD1 HIS 113 HD1 HIS 113 -13.121 7.082 4.664 932 HD2 HIS 113 HD2 HIS 113 -14.849 5.100 7.888 933 HE1 HIS 113 HE1 HIS 113 -14.716 5.409 3.664 934 HE2 HIS 113 HE2 HIS 113 -15.579 4.086 5.630 935 H GLU 114 H GLU 114 -10.457 4.350 7.824 936 HA GLU 114 HA GLU 114 -11.816 3.353 10.240 937 1HB GLU 114 1HB GLU 114 -10.449 1.763 8.058 938 2HB GLU 114 2HB GLU 114 -11.299 1.098 9.445 939 1HG GLU 114 1HG GLU 114 -12.542 2.722 7.240 940 2HG GLU 114 2HG GLU 114 -12.622 0.970 7.404 941 H GLN 115 H GLN 115 -8.843 4.245 8.814 942 HA GLN 115 HA GLN 115 -6.731 4.471 9.577 943 1HB GLN 115 1HB GLN 115 -8.008 3.889 12.250 944 2HB GLN 115 2HB GLN 115 -6.361 4.461 12.032 945 1HG GLN 115 1HG GLN 115 -8.856 5.936 11.215 946 2HG GLN 115 2HG GLN 115 -7.884 6.263 12.648 947 1HE2 GLN 115 1HE2 GLN 115 -8.533 8.011 10.423 948 2HE2 GLN 115 2HE2 GLN 115 -7.029 8.511 9.746 949 H LYS 116 H LYS 116 -7.410 2.011 8.470 950 HA LYS 116 HA LYS 116 -5.702 0.183 10.028 951 1HB LYS 116 1HB LYS 116 -8.303 -0.530 8.663 952 2HB LYS 116 2HB LYS 116 -7.171 -1.699 9.322 953 1HG LYS 116 1HG LYS 116 -8.541 0.439 10.934 954 2HG LYS 116 2HG LYS 116 -9.101 -1.228 10.789 955 1HD LYS 116 1HD LYS 116 -7.116 -2.057 11.841 956 2HD LYS 116 2HD LYS 116 -6.375 -0.455 11.815 957 1HE LYS 116 1HE LYS 116 -8.908 -1.122 13.308 958 2HE LYS 116 2HE LYS 116 -7.299 -1.141 14.035 959 1HZ LYS 116 1HZ LYS 116 -7.059 1.192 13.543 960 2HZ LYS 116 2HZ LYS 116 -8.486 0.953 14.428 961 3HZ LYS 116 3HZ LYS 116 -8.560 1.231 12.758 962 H ARG 117 H ARG 117 -4.429 -1.218 8.876 963 HA ARG 117 HA ARG 117 -4.532 -1.015 5.934 964 1HB ARG 117 1HB ARG 117 -2.040 -1.590 7.551 965 2HB ARG 117 2HB ARG 117 -2.143 -1.333 5.817 966 1HG ARG 117 1HG ARG 117 -2.962 1.012 6.381 967 2HG ARG 117 2HG ARG 117 -2.416 0.676 8.023 968 1HD ARG 117 1HD ARG 117 -0.784 0.857 5.507 969 2HD ARG 117 2HD ARG 117 -0.615 1.780 6.997 970 HE ARG 117 HE ARG 117 0.026 -1.096 6.791 971 1HH1 ARG 117 1HH1 ARG 117 0.768 2.125 7.980 972 2HH1 ARG 117 2HH1 ARG 117 2.207 1.616 8.802 973 1HH2 ARG 117 1HH2 ARG 117 1.922 -1.745 7.840 974 2HH2 ARG 117 2HH2 ARG 117 2.848 -0.597 8.765 975 H TYR 118 H TYR 118 -5.308 -2.854 5.156 976 HA TYR 118 HA TYR 118 -4.919 -5.323 6.696 977 1HB TYR 118 1HB TYR 118 -6.896 -4.666 4.503 978 2HB TYR 118 2HB TYR 118 -6.779 -6.219 5.320 979 HD1 TYR 118 HD1 TYR 118 -7.213 -6.278 7.839 980 HD2 TYR 118 HD2 TYR 118 -8.210 -2.942 5.392 981 HE1 TYR 118 HE1 TYR 118 -8.800 -5.503 9.551 982 HE2 TYR 118 HE2 TYR 118 -9.797 -2.153 7.100 983 HH TYR 118 HH TYR 118 -11.082 -3.018 8.953 984 H TYR 119 H TYR 119 -3.592 -6.835 5.979 985 HA TYR 119 HA TYR 119 -2.550 -6.601 3.241 986 1HB TYR 119 1HB TYR 119 -1.402 -8.016 5.660 987 2HB TYR 119 2HB TYR 119 -0.659 -7.978 4.066 988 HD1 TYR 119 HD1 TYR 119 -1.782 -5.753 6.834 989 HD2 TYR 119 HD2 TYR 119 0.812 -6.256 3.499 990 HE1 TYR 119 HE1 TYR 119 -0.617 -3.676 7.436 991 HE2 TYR 119 HE2 TYR 119 1.981 -4.178 4.092 992 HH TYR 119 HH TYR 119 1.795 -2.256 5.343 993 H TYR 120 H TYR 120 -3.791 -7.813 1.939 994 HA TYR 120 HA TYR 120 -4.582 -10.490 2.858 995 1HB TYR 120 1HB TYR 120 -5.636 -8.818 0.569 996 2HB TYR 120 2HB TYR 120 -6.181 -10.446 0.952 997 HD1 TYR 120 HD1 TYR 120 -7.273 -10.820 3.234 998 HD2 TYR 120 HD2 TYR 120 -6.626 -6.954 1.581 999 HE1 TYR 120 HE1 TYR 120 -8.983 -9.897 4.738 1000 HE2 TYR 120 HE2 TYR 120 -8.337 -6.023 3.078 1001 HH TYR 120 HH TYR 120 -10.265 -6.751 4.348 1002 H THR 121 H THR 121 -4.014 -12.301 1.760 1003 HA THR 121 HA THR 121 -1.952 -12.116 -0.255 1004 HB THR 121 HB THR 121 -1.837 -13.903 1.427 1005 HG1 THR 121 HG1 THR 121 -0.854 -14.921 -0.134 1006 1HG2 THR 121 1HG2 THR 121 -4.180 -14.288 1.834 1007 2HG2 THR 121 2HG2 THR 121 -3.420 -15.798 1.324 1008 3HG2 THR 121 3HG2 THR 121 -4.405 -14.878 0.189 1009 H PHE 122 H PHE 122 -2.428 -13.920 -2.146 1010 HA PHE 122 HA PHE 122 -4.246 -12.642 -3.872 1011 1HB PHE 122 1HB PHE 122 -3.810 -14.479 -5.436 1012 2HB PHE 122 2HB PHE 122 -2.318 -13.909 -4.701 1013 HD1 PHE 122 HD1 PHE 122 -1.196 -15.279 -2.970 1014 HD2 PHE 122 HD2 PHE 122 -4.573 -16.704 -5.127 1015 HE1 PHE 122 HE1 PHE 122 -0.657 -17.580 -2.286 1016 HE2 PHE 122 HE2 PHE 122 -4.042 -19.009 -4.445 1017 HZ PHE 122 HZ PHE 122 -2.079 -19.448 -3.024 1018 H ASP 123 H ASP 123 -4.724 -15.099 -1.539 1019 HA ASP 123 HA ASP 123 -7.322 -15.871 -2.644 1020 1HB ASP 123 1HB ASP 123 -5.705 -17.605 -1.811 1021 2HB ASP 123 2HB ASP 123 -5.912 -16.946 -0.192 1022 H ASN 124 H ASN 124 -6.564 -13.262 -1.374 1023 HA ASN 124 HA ASN 124 -7.283 -11.699 0.069 1024 1HB ASN 124 1HB ASN 124 -9.664 -11.365 0.238 1025 2HB ASN 124 2HB ASN 124 -9.263 -11.895 -1.385 1026 1HD2 ASN 124 1HD2 ASN 124 -10.729 -12.818 1.650 1027 2HD2 ASN 124 2HD2 ASN 124 -11.654 -14.137 1.021 1028 H SER 125 H SER 125 -6.382 -14.267 1.249 1029 HA SER 125 HA SER 125 -7.723 -14.421 3.768 1030 1HB SER 125 1HB SER 125 -4.910 -15.344 3.173 1031 2HB SER 125 2HB SER 125 -6.019 -15.970 4.392 1032 HG SER 125 HG SER 125 -7.392 -16.565 2.511 1033 H LEU 126 H LEU 126 -7.461 -13.078 5.443 1034 HA LEU 126 HA LEU 126 -5.726 -10.827 5.231 1035 1HB LEU 126 1HB LEU 126 -7.898 -10.752 6.391 1036 2HB LEU 126 2HB LEU 126 -7.277 -11.845 7.613 1037 HG LEU 126 HG LEU 126 -5.647 -10.147 8.315 1038 1HD1 LEU 126 1HD1 LEU 126 -5.322 -9.013 6.191 1039 2HD1 LEU 126 2HD1 LEU 126 -5.810 -7.862 7.436 1040 3HD1 LEU 126 3HD1 LEU 126 -6.979 -8.415 6.236 1041 1HD2 LEU 126 1HD2 LEU 126 -8.480 -9.125 8.186 1042 2HD2 LEU 126 2HD2 LEU 126 -7.234 -8.578 9.309 1043 3HD2 LEU 126 3HD2 LEU 126 -7.833 -10.235 9.393 1044 H LEU 127 H LEU 127 -3.604 -10.975 5.458 1045 HA LEU 127 HA LEU 127 -2.454 -13.045 7.156 1046 1HB LEU 127 1HB LEU 127 -1.137 -11.045 5.315 1047 2HB LEU 127 2HB LEU 127 -0.309 -12.333 6.171 1048 HG LEU 127 HG LEU 127 -2.395 -12.702 4.019 1049 1HD1 LEU 127 1HD1 LEU 127 0.588 -13.141 4.007 1050 2HD1 LEU 127 2HD1 LEU 127 -0.289 -11.886 3.132 1051 3HD1 LEU 127 3HD1 LEU 127 -0.516 -13.582 2.704 1052 1HD2 LEU 127 1HD2 LEU 127 -1.817 -15.081 4.168 1053 2HD2 LEU 127 2HD2 LEU 127 -2.492 -14.480 5.682 1054 3HD2 LEU 127 3HD2 LEU 127 -0.753 -14.732 5.533 1055 H PHE 128 H PHE 128 -2.098 -9.520 6.734 1056 HA PHE 128 HA PHE 128 -1.272 -9.377 9.561 1057 1HB PHE 128 1HB PHE 128 0.570 -9.068 7.784 1058 2HB PHE 128 2HB PHE 128 -0.214 -7.538 7.416 1059 HD1 PHE 128 HD1 PHE 128 1.703 -9.419 9.887 1060 HD2 PHE 128 HD2 PHE 128 -0.068 -5.668 8.948 1061 HE1 PHE 128 HE1 PHE 128 2.999 -8.370 11.686 1062 HE2 PHE 128 HE2 PHE 128 1.226 -4.604 10.753 1063 HZ PHE 128 HZ PHE 128 2.767 -5.953 12.122 1064 H THR 129 H THR 129 -2.042 -7.630 10.732 1065 HA THR 129 HA THR 129 -3.816 -5.753 9.318 1066 HB THR 129 HB THR 129 -4.441 -6.961 12.018 1067 HG1 THR 129 HG1 THR 129 -4.855 -7.912 9.502 1068 1HG2 THR 129 1HG2 THR 129 -5.363 -4.715 11.639 1069 2HG2 THR 129 2HG2 THR 129 -6.635 -5.936 11.696 1070 3HG2 THR 129 3HG2 THR 129 -6.110 -5.281 10.145 1071 H GLU 130 H GLU 130 -2.797 -3.879 9.482 1072 HA GLU 130 HA GLU 130 -1.546 -3.157 12.051 1073 1HB GLU 130 1HB GLU 130 0.051 -3.313 10.189 1074 2HB GLU 130 2HB GLU 130 -0.911 -2.182 9.253 1075 1HG GLU 130 1HG GLU 130 1.004 -1.057 10.165 1076 2HG GLU 130 2HG GLU 130 -0.459 -0.439 10.928 1077 H SER 131 H SER 131 -1.813 -0.973 12.776 1078 HA SER 131 HA SER 131 -4.091 0.417 11.513 1079 1HB SER 131 1HB SER 131 -4.597 -0.657 13.768 1080 2HB SER 131 2HB SER 131 -3.469 0.501 14.473 1081 HG SER 131 HG SER 131 -5.123 1.871 12.919 1082 H ILE 132 H ILE 132 -3.704 2.449 10.909 1083 HA ILE 132 HA ILE 132 -1.074 3.570 11.431 1084 HB ILE 132 HB ILE 132 -1.875 5.377 9.833 1085 1HG1 ILE 132 1HG1 ILE 132 -4.142 3.409 9.419 1086 2HG1 ILE 132 2HG1 ILE 132 -4.296 5.005 10.147 1087 1HG2 ILE 132 1HG2 ILE 132 -0.433 3.504 9.179 1088 2HG2 ILE 132 2HG2 ILE 132 -1.510 4.003 7.874 1089 3HG2 ILE 132 3HG2 ILE 132 -1.866 2.546 8.802 1090 1HD1 ILE 132 1HD1 ILE 132 -3.637 6.032 8.042 1091 2HD1 ILE 132 2HD1 ILE 132 -5.048 4.994 7.835 1092 3HD1 ILE 132 3HD1 ILE 132 -3.457 4.438 7.313 1093 H GLN 133 H GLN 133 -2.249 3.531 13.756 1094 HA GLN 133 HA GLN 133 -2.812 4.746 15.581 1095 1HB GLN 133 1HB GLN 133 -1.339 6.519 14.745 1096 2HB GLN 133 2HB GLN 133 -2.635 7.136 13.729 1097 1HG GLN 133 1HG GLN 133 -2.357 8.500 15.714 1098 2HG GLN 133 2HG GLN 133 -3.932 7.705 15.714 1099 1HE2 GLN 133 1HE2 GLN 133 -0.804 7.864 17.199 1100 2HE2 GLN 133 2HE2 GLN 133 -1.188 6.910 18.589 Start of MODEL 12 1 H ASP 7 H ASP 7 -3.837 14.328 -15.049 2 HA ASP 7 HA ASP 7 -6.582 13.957 -15.670 3 1HB ASP 7 1HB ASP 7 -5.615 12.297 -17.253 4 2HB ASP 7 2HB ASP 7 -4.812 11.502 -15.903 5 H GLN 8 H GLN 8 -7.655 12.633 -13.971 6 HA GLN 8 HA GLN 8 -6.818 13.308 -11.401 7 1HB GLN 8 1HB GLN 8 -9.140 12.669 -12.121 8 2HB GLN 8 2HB GLN 8 -8.613 10.993 -12.145 9 1HG GLN 8 1HG GLN 8 -8.107 11.129 -9.751 10 2HG GLN 8 2HG GLN 8 -8.671 12.801 -9.739 11 1HE2 GLN 8 1HE2 GLN 8 -10.311 12.415 -8.297 12 2HE2 GLN 8 2HE2 GLN 8 -11.726 11.510 -8.698 13 H VAL 9 H VAL 9 -6.317 10.372 -13.279 14 HA VAL 9 HA VAL 9 -5.211 8.730 -11.297 15 HB VAL 9 HB VAL 9 -4.662 8.823 -14.272 16 1HG1 VAL 9 1HG1 VAL 9 -2.825 7.693 -13.123 17 2HG1 VAL 9 2HG1 VAL 9 -3.795 6.552 -14.056 18 3HG1 VAL 9 3HG1 VAL 9 -3.981 6.641 -12.305 19 1HG2 VAL 9 1HG2 VAL 9 -6.470 7.064 -12.619 20 2HG2 VAL 9 2HG2 VAL 9 -6.205 6.922 -14.356 21 3HG2 VAL 9 3HG2 VAL 9 -6.981 8.361 -13.697 22 H VAL 10 H VAL 10 -3.813 11.313 -13.191 23 HA VAL 10 HA VAL 10 -1.091 10.685 -12.695 24 HB VAL 10 HB VAL 10 -2.324 13.345 -13.444 25 1HG1 VAL 10 1HG1 VAL 10 0.524 12.369 -13.664 26 2HG1 VAL 10 2HG1 VAL 10 -0.068 13.619 -12.570 27 3HG1 VAL 10 3HG1 VAL 10 -0.089 13.891 -14.312 28 1HG2 VAL 10 1HG2 VAL 10 -2.872 11.610 -15.055 29 2HG2 VAL 10 2HG2 VAL 10 -1.171 11.154 -15.167 30 3HG2 VAL 10 3HG2 VAL 10 -1.699 12.738 -15.738 31 H ILE 11 H ILE 11 -3.457 12.750 -11.068 32 HA ILE 11 HA ILE 11 -1.679 13.999 -9.274 33 HB ILE 11 HB ILE 11 -4.644 13.489 -9.185 34 1HG1 ILE 11 1HG1 ILE 11 -4.679 16.001 -9.150 35 2HG1 ILE 11 2HG1 ILE 11 -2.931 15.981 -9.337 36 1HG2 ILE 11 1HG2 ILE 11 -3.918 13.281 -6.881 37 2HG2 ILE 11 2HG2 ILE 11 -4.794 14.794 -7.115 38 3HG2 ILE 11 3HG2 ILE 11 -3.034 14.801 -6.999 39 1HD1 ILE 11 1HD1 ILE 11 -3.179 14.862 -11.488 40 2HD1 ILE 11 2HD1 ILE 11 -4.048 16.396 -11.447 41 3HD1 ILE 11 3HD1 ILE 11 -4.932 14.877 -11.294 42 H PHE 12 H PHE 12 -3.691 11.086 -8.896 43 HA PHE 12 HA PHE 12 -2.787 10.548 -6.265 44 1HB PHE 12 1HB PHE 12 -4.206 8.860 -8.312 45 2HB PHE 12 2HB PHE 12 -3.752 8.231 -6.732 46 HD1 PHE 12 HD1 PHE 12 -5.968 10.494 -8.543 47 HD2 PHE 12 HD2 PHE 12 -4.828 9.027 -4.719 48 HE1 PHE 12 HE1 PHE 12 -8.022 11.440 -7.573 49 HE2 PHE 12 HE2 PHE 12 -6.877 9.971 -3.741 50 HZ PHE 12 HZ PHE 12 -8.475 11.179 -5.166 51 H LYS 13 H LYS 13 -1.792 9.277 -9.442 52 HA LYS 13 HA LYS 13 0.089 7.443 -8.433 53 1HB LYS 13 1HB LYS 13 -0.599 7.238 -10.717 54 2HB LYS 13 2HB LYS 13 -0.056 8.870 -11.090 55 1HG LYS 13 1HG LYS 13 2.242 8.229 -10.861 56 2HG LYS 13 2HG LYS 13 1.785 6.636 -10.261 57 1HD LYS 13 1HD LYS 13 1.008 7.631 -12.995 58 2HD LYS 13 2HD LYS 13 2.516 6.765 -12.686 59 1HE LYS 13 1HE LYS 13 1.168 4.900 -11.728 60 2HE LYS 13 2HE LYS 13 -0.289 5.754 -12.239 61 1HZ LYS 13 1HZ LYS 13 0.552 3.986 -13.783 62 2HZ LYS 13 2HZ LYS 13 1.868 4.995 -14.131 63 3HZ LYS 13 3HZ LYS 13 0.289 5.498 -14.495 64 H GLN 14 H GLN 14 0.269 10.879 -9.062 65 HA GLN 14 HA GLN 14 3.039 11.254 -8.919 66 1HB GLN 14 1HB GLN 14 1.258 12.947 -9.560 67 2HB GLN 14 2HB GLN 14 0.960 13.161 -7.842 68 1HG GLN 14 1HG GLN 14 2.382 14.914 -8.552 69 2HG GLN 14 2HG GLN 14 3.350 13.806 -7.580 70 1HE2 GLN 14 1HE2 GLN 14 2.391 13.096 -10.853 71 2HE2 GLN 14 2HE2 GLN 14 3.964 13.239 -11.564 72 H ILE 15 H ILE 15 0.571 11.144 -6.400 73 HA ILE 15 HA ILE 15 2.214 11.806 -4.212 74 HB ILE 15 HB ILE 15 -0.275 10.090 -4.217 75 1HG1 ILE 15 1HG1 ILE 15 0.014 13.065 -3.754 76 2HG1 ILE 15 2HG1 ILE 15 -0.574 12.339 -5.244 77 1HG2 ILE 15 1HG2 ILE 15 -0.489 10.719 -1.873 78 2HG2 ILE 15 2HG2 ILE 15 1.011 11.638 -1.971 79 3HG2 ILE 15 3HG2 ILE 15 1.039 9.887 -2.157 80 1HD1 ILE 15 1HD1 ILE 15 -1.879 12.106 -2.541 81 2HD1 ILE 15 2HD1 ILE 15 -2.474 11.402 -4.044 82 3HD1 ILE 15 3HD1 ILE 15 -2.400 13.156 -3.860 83 H PHE 16 H PHE 16 1.155 8.622 -5.419 84 HA PHE 16 HA PHE 16 2.577 7.152 -3.465 85 1HB PHE 16 1HB PHE 16 1.399 6.341 -6.122 86 2HB PHE 16 2HB PHE 16 2.181 5.199 -5.034 87 HD1 PHE 16 HD1 PHE 16 1.234 4.881 -2.728 88 HD2 PHE 16 HD2 PHE 16 -0.829 7.002 -5.785 89 HE1 PHE 16 HE1 PHE 16 -0.876 4.599 -1.494 90 HE2 PHE 16 HE2 PHE 16 -2.942 6.724 -4.557 91 HZ PHE 16 HZ PHE 16 -2.969 5.520 -2.413 92 H ASP 17 H ASP 17 3.471 8.393 -6.609 93 HA ASP 17 HA ASP 17 5.845 6.859 -6.903 94 1HB ASP 17 1HB ASP 17 4.773 8.048 -8.791 95 2HB ASP 17 2HB ASP 17 5.200 9.588 -8.051 96 H LYS 18 H LYS 18 5.148 10.028 -5.484 97 HA LYS 18 HA LYS 18 7.830 10.690 -4.886 98 1HB LYS 18 1HB LYS 18 5.216 11.633 -3.721 99 2HB LYS 18 2HB LYS 18 6.767 12.256 -3.178 100 1HG LYS 18 1HG LYS 18 5.721 12.401 -5.998 101 2HG LYS 18 2HG LYS 18 5.699 13.718 -4.825 102 1HD LYS 18 1HD LYS 18 8.199 12.336 -5.799 103 2HD LYS 18 2HD LYS 18 7.578 13.851 -6.453 104 1HE LYS 18 1HE LYS 18 7.828 14.904 -4.266 105 2HE LYS 18 2HE LYS 18 8.407 13.384 -3.587 106 1HZ LYS 18 1HZ LYS 18 9.747 14.926 -5.748 107 2HZ LYS 18 2HZ LYS 18 10.309 13.478 -5.064 108 3HZ LYS 18 3HZ LYS 18 10.232 14.883 -4.123 109 H VAL 19 H VAL 19 5.283 9.159 -2.901 110 HA VAL 19 HA VAL 19 6.890 9.010 -0.571 111 HB VAL 19 HB VAL 19 4.412 8.836 -0.534 112 1HG1 VAL 19 1HG1 VAL 19 3.338 6.689 -0.987 113 2HG1 VAL 19 2HG1 VAL 19 4.874 6.036 -1.552 114 3HG1 VAL 19 3HG1 VAL 19 4.095 7.346 -2.440 115 1HG2 VAL 19 1HG2 VAL 19 5.706 8.181 1.408 116 2HG2 VAL 19 2HG2 VAL 19 5.897 6.554 0.758 117 3HG2 VAL 19 3HG2 VAL 19 4.299 7.131 1.232 118 H ARG 20 H ARG 20 6.623 6.996 -3.382 119 HA ARG 20 HA ARG 20 7.783 4.634 -2.419 120 1HB ARG 20 1HB ARG 20 6.725 4.629 -4.569 121 2HB ARG 20 2HB ARG 20 7.790 5.895 -5.166 122 1HG ARG 20 1HG ARG 20 9.673 4.382 -5.120 123 2HG ARG 20 2HG ARG 20 8.675 3.115 -4.406 124 1HD ARG 20 1HD ARG 20 8.983 2.740 -6.788 125 2HD ARG 20 2HD ARG 20 7.294 3.069 -6.421 126 HE ARG 20 HE ARG 20 7.660 5.328 -7.299 127 1HH1 ARG 20 1HH1 ARG 20 10.091 2.923 -8.089 128 2HH1 ARG 20 2HH1 ARG 20 10.494 3.657 -9.608 129 1HH2 ARG 20 1HH2 ARG 20 8.196 6.286 -9.317 130 2HH2 ARG 20 2HH2 ARG 20 9.444 5.549 -10.295 131 H ASN 21 H ASN 21 9.202 7.663 -3.451 132 HA ASN 21 HA ASN 21 11.889 6.489 -3.282 133 1HB ASN 21 1HB ASN 21 10.911 9.044 -4.571 134 2HB ASN 21 2HB ASN 21 12.605 8.576 -4.470 135 1HD2 ASN 21 1HD2 ASN 21 10.855 9.016 -6.794 136 2HD2 ASN 21 2HD2 ASN 21 10.927 7.555 -7.717 137 H ASP 22 H ASP 22 9.927 9.181 -2.082 138 HA ASP 22 HA ASP 22 12.203 10.278 -0.645 139 1HB ASP 22 1HB ASP 22 10.537 11.680 -1.921 140 2HB ASP 22 2HB ASP 22 9.370 11.307 -0.657 141 H LEU 23 H LEU 23 9.366 8.395 0.044 142 HA LEU 23 HA LEU 23 8.560 7.434 1.943 143 1HB LEU 23 1HB LEU 23 11.306 8.114 3.001 144 2HB LEU 23 2HB LEU 23 10.147 7.094 3.831 145 HG LEU 23 HG LEU 23 11.340 6.483 1.126 146 1HD1 LEU 23 1HD1 LEU 23 11.972 5.344 3.845 147 2HD1 LEU 23 2HD1 LEU 23 13.020 6.394 2.890 148 3HD1 LEU 23 3HD1 LEU 23 12.625 4.776 2.308 149 1HD2 LEU 23 1HD2 LEU 23 10.344 4.286 1.451 150 2HD2 LEU 23 2HD2 LEU 23 9.105 5.540 1.471 151 3HD2 LEU 23 3HD2 LEU 23 9.650 4.811 2.982 152 H ASN 24 H ASN 24 8.133 10.239 1.466 153 HA ASN 24 HA ASN 24 8.306 11.694 3.916 154 1HB ASN 24 1HB ASN 24 8.197 12.702 1.602 155 2HB ASN 24 2HB ASN 24 6.499 12.247 1.552 156 1HD2 ASN 24 1HD2 ASN 24 7.526 14.856 1.299 157 2HD2 ASN 24 2HD2 ASN 24 6.923 15.798 2.629 158 H TYR 25 H TYR 25 7.248 10.727 5.601 159 HA TYR 25 HA TYR 25 4.681 9.513 5.354 160 1HB TYR 25 1HB TYR 25 6.495 10.214 7.608 161 2HB TYR 25 2HB TYR 25 4.802 9.914 7.983 162 HD1 TYR 25 HD1 TYR 25 7.663 8.354 6.134 163 HD2 TYR 25 HD2 TYR 25 4.127 7.764 8.426 164 HE1 TYR 25 HE1 TYR 25 8.090 5.930 6.159 165 HE2 TYR 25 HE2 TYR 25 4.541 5.343 8.454 166 HH TYR 25 HH TYR 25 7.477 3.969 7.593 167 H GLN 26 H GLN 26 5.803 12.702 6.280 168 HA GLN 26 HA GLN 26 3.476 13.685 7.476 169 1HB GLN 26 1HB GLN 26 5.565 15.193 5.895 170 2HB GLN 26 2HB GLN 26 4.368 15.933 6.945 171 1HG GLN 26 1HG GLN 26 6.535 14.035 7.819 172 2HG GLN 26 2HG GLN 26 6.571 15.788 7.993 173 1HE2 GLN 26 1HE2 GLN 26 5.378 12.816 9.234 174 2HE2 GLN 26 2HE2 GLN 26 4.574 13.468 10.622 175 H TRP 27 H TRP 27 4.610 14.139 4.135 176 HA TRP 27 HA TRP 27 2.260 15.518 3.319 177 1HB TRP 27 1HB TRP 27 4.467 15.840 2.264 178 2HB TRP 27 2HB TRP 27 4.407 14.194 1.647 179 HD1 TRP 27 HD1 TRP 27 2.302 17.448 1.324 180 HE1 TRP 27 HE1 TRP 27 1.435 17.589 -1.102 181 HE3 TRP 27 HE3 TRP 27 4.148 13.022 -0.446 182 HZ2 TRP 27 HZ2 TRP 27 1.537 16.023 -3.453 183 HZ3 TRP 27 HZ3 TRP 27 3.725 12.420 -2.794 184 HH2 TRP 27 HH2 TRP 27 2.447 13.886 -4.265 185 H PHE 28 H PHE 28 3.360 12.180 3.033 186 HA PHE 28 HA PHE 28 1.512 11.238 1.178 187 1HB PHE 28 1HB PHE 28 3.478 9.968 1.898 188 2HB PHE 28 2HB PHE 28 2.772 9.757 3.493 189 HD1 PHE 28 HD1 PHE 28 2.011 7.651 3.893 190 HD2 PHE 28 HD2 PHE 28 1.638 9.244 -0.039 191 HE1 PHE 28 HE1 PHE 28 0.958 5.556 3.147 192 HE2 PHE 28 HE2 PHE 28 0.582 7.152 -0.792 193 HZ PHE 28 HZ PHE 28 0.242 5.306 0.804 194 H TYR 29 H TYR 29 1.286 11.006 4.747 195 HA TYR 29 HA TYR 29 -1.317 9.874 4.618 196 1HB TYR 29 1HB TYR 29 0.351 10.953 6.868 197 2HB TYR 29 2HB TYR 29 -1.317 10.451 7.135 198 HD1 TYR 29 HD1 TYR 29 2.087 9.364 6.756 199 HD2 TYR 29 HD2 TYR 29 -1.962 8.069 6.576 200 HE1 TYR 29 HE1 TYR 29 2.828 7.030 6.966 201 HE2 TYR 29 HE2 TYR 29 -1.233 5.732 6.788 202 HH TYR 29 HH TYR 29 1.946 4.861 7.669 203 H SER 30 H SER 30 -0.141 13.156 4.829 204 HA SER 30 HA SER 30 -2.600 14.324 5.619 205 1HB SER 30 1HB SER 30 -0.272 15.526 4.104 206 2HB SER 30 2HB SER 30 -1.620 16.444 4.781 207 HG SER 30 HG SER 30 0.521 15.184 6.059 208 H GLU 31 H GLU 31 -1.120 13.731 2.441 209 HA GLU 31 HA GLU 31 -3.287 14.832 0.974 210 1HB GLU 31 1HB GLU 31 -1.052 12.962 0.230 211 2HB GLU 31 2HB GLU 31 -2.300 13.422 -0.922 212 1HG GLU 31 1HG GLU 31 -0.396 15.271 0.495 213 2HG GLU 31 2HG GLU 31 -0.350 14.812 -1.207 214 H LEU 32 H LEU 32 -2.575 11.609 2.206 215 HA LEU 32 HA LEU 32 -4.667 10.237 0.953 216 1HB LEU 32 1HB LEU 32 -3.453 9.826 3.684 217 2HB LEU 32 2HB LEU 32 -4.607 8.725 2.955 218 HG LEU 32 HG LEU 32 -1.856 9.371 1.892 219 1HD1 LEU 32 1HD1 LEU 32 -2.980 6.882 3.168 220 2HD1 LEU 32 2HD1 LEU 32 -1.796 7.980 3.878 221 3HD1 LEU 32 3HD1 LEU 32 -1.377 7.035 2.449 222 1HD2 LEU 32 1HD2 LEU 32 -3.961 7.471 0.857 223 2HD2 LEU 32 2HD2 LEU 32 -2.302 7.584 0.266 224 3HD2 LEU 32 3HD2 LEU 32 -3.405 8.947 0.069 225 H LYS 33 H LYS 33 -4.613 11.854 4.122 226 HA LYS 33 HA LYS 33 -7.345 11.493 4.708 227 1HB LYS 33 1HB LYS 33 -5.673 12.094 6.398 228 2HB LYS 33 2HB LYS 33 -5.432 13.653 5.622 229 1HG LYS 33 1HG LYS 33 -7.767 14.241 6.134 230 2HG LYS 33 2HG LYS 33 -7.949 12.700 6.975 231 1HD LYS 33 1HD LYS 33 -5.953 14.851 7.685 232 2HD LYS 33 2HD LYS 33 -7.486 14.573 8.510 233 1HE LYS 33 1HE LYS 33 -5.280 12.533 8.273 234 2HE LYS 33 2HE LYS 33 -5.515 13.584 9.667 235 1HZ LYS 33 1HZ LYS 33 -6.490 11.366 9.964 236 2HZ LYS 33 2HZ LYS 33 -7.532 11.646 8.658 237 3HZ LYS 33 3HZ LYS 33 -7.653 12.596 10.054 238 H ARG 34 H ARG 34 -5.690 13.718 2.669 239 HA ARG 34 HA ARG 34 -7.759 15.711 2.604 240 1HB ARG 34 1HB ARG 34 -5.398 16.297 2.334 241 2HB ARG 34 2HB ARG 34 -5.307 15.318 0.880 242 1HG ARG 34 1HG ARG 34 -6.929 16.827 -0.199 243 2HG ARG 34 2HG ARG 34 -6.917 17.832 1.254 244 1HD ARG 34 1HD ARG 34 -4.573 18.290 0.985 245 2HD ARG 34 2HD ARG 34 -4.465 17.157 -0.362 246 HE ARG 34 HE ARG 34 -6.329 19.336 -0.743 247 1HH1 ARG 34 1HH1 ARG 34 -3.075 18.137 -1.226 248 2HH1 ARG 34 2HH1 ARG 34 -2.717 19.264 -2.503 249 1HH2 ARG 34 1HH2 ARG 34 -5.846 20.847 -2.396 250 2HH2 ARG 34 2HH2 ARG 34 -4.269 20.846 -3.129 251 H HIS 35 H HIS 35 -7.189 12.756 0.919 252 HA HIS 35 HA HIS 35 -9.183 13.535 -1.108 253 1HB HIS 35 1HB HIS 35 -6.764 11.818 -1.700 254 2HB HIS 35 2HB HIS 35 -7.985 12.352 -2.847 255 HD1 HIS 35 HD1 HIS 35 -8.074 15.248 -2.775 256 HD2 HIS 35 HD2 HIS 35 -4.527 13.221 -2.006 257 HE1 HIS 35 HE1 HIS 35 -6.232 16.902 -3.219 258 HE2 HIS 35 HE2 HIS 35 -4.121 15.724 -2.483 259 H ASN 36 H ASN 36 -7.404 10.749 0.204 260 HA ASN 36 HA ASN 36 -9.586 8.974 -0.522 261 1HB ASN 36 1HB ASN 36 -7.309 8.223 -0.964 262 2HB ASN 36 2HB ASN 36 -6.887 8.424 0.733 263 1HD2 ASN 36 1HD2 ASN 36 -6.326 6.313 1.038 264 2HD2 ASN 36 2HD2 ASN 36 -7.473 5.025 1.043 265 H VAL 37 H VAL 37 -11.190 9.640 0.885 266 HA VAL 37 HA VAL 37 -10.795 9.654 3.722 267 HB VAL 37 HB VAL 37 -13.381 9.691 2.156 268 1HG1 VAL 37 1HG1 VAL 37 -14.351 10.667 4.179 269 2HG1 VAL 37 2HG1 VAL 37 -12.807 10.485 5.010 270 3HG1 VAL 37 3HG1 VAL 37 -13.702 9.057 4.492 271 1HG2 VAL 37 1HG2 VAL 37 -11.942 11.546 1.528 272 2HG2 VAL 37 2HG2 VAL 37 -11.717 11.970 3.226 273 3HG2 VAL 37 3HG2 VAL 37 -13.308 12.125 2.480 274 H SER 38 H SER 38 -11.791 7.286 1.367 275 HA SER 38 HA SER 38 -12.899 5.560 3.441 276 1HB SER 38 1HB SER 38 -12.830 5.159 0.443 277 2HB SER 38 2HB SER 38 -13.693 4.150 1.603 278 HG SER 38 HG SER 38 -14.535 6.353 0.404 279 H HIS 39 H HIS 39 -10.985 4.621 0.567 280 HA HIS 39 HA HIS 39 -8.828 3.523 2.039 281 1HB HIS 39 1HB HIS 39 -9.335 1.123 1.798 282 2HB HIS 39 2HB HIS 39 -10.495 1.928 2.846 283 HD1 HIS 39 HD1 HIS 39 -12.937 1.830 2.176 284 HD2 HIS 39 HD2 HIS 39 -10.398 0.343 -0.761 285 HE1 HIS 39 HE1 HIS 39 -14.433 0.738 0.481 286 HE2 HIS 39 HE2 HIS 39 -12.871 -0.292 -1.196 287 H TYR 40 H TYR 40 -7.206 2.725 0.707 288 HA TYR 40 HA TYR 40 -7.864 2.661 -2.161 289 1HB TYR 40 1HB TYR 40 -5.621 3.395 -2.689 290 2HB TYR 40 2HB TYR 40 -6.340 4.538 -1.566 291 HD1 TYR 40 HD1 TYR 40 -3.682 2.127 -2.115 292 HD2 TYR 40 HD2 TYR 40 -5.551 4.633 0.770 293 HE1 TYR 40 HE1 TYR 40 -1.705 1.925 -0.668 294 HE2 TYR 40 HE2 TYR 40 -3.586 4.434 2.228 295 HH TYR 40 HH TYR 40 -0.627 3.166 1.167 296 H ILE 41 H ILE 41 -7.257 0.923 -3.323 297 HA ILE 41 HA ILE 41 -6.094 -1.312 -1.794 298 HB ILE 41 HB ILE 41 -7.870 -1.490 -4.232 299 1HG1 ILE 41 1HG1 ILE 41 -8.604 -1.963 -1.333 300 2HG1 ILE 41 2HG1 ILE 41 -9.038 -0.523 -2.246 301 1HG2 ILE 41 1HG2 ILE 41 -6.931 -3.582 -2.272 302 2HG2 ILE 41 2HG2 ILE 41 -6.396 -3.398 -3.942 303 3HG2 ILE 41 3HG2 ILE 41 -8.065 -3.852 -3.596 304 1HD1 ILE 41 1HD1 ILE 41 -10.903 -2.049 -2.130 305 2HD1 ILE 41 2HD1 ILE 41 -9.925 -3.338 -2.832 306 3HD1 ILE 41 3HD1 ILE 41 -10.331 -1.916 -3.793 307 H TYR 42 H TYR 42 -4.031 -1.471 -2.275 308 HA TYR 42 HA TYR 42 -3.062 -0.840 -4.967 309 1HB TYR 42 1HB TYR 42 -2.065 0.079 -2.762 310 2HB TYR 42 2HB TYR 42 -1.383 -1.526 -2.553 311 HD1 TYR 42 HD1 TYR 42 -0.458 1.586 -3.348 312 HD2 TYR 42 HD2 TYR 42 -0.328 -2.289 -5.096 313 HE1 TYR 42 HE1 TYR 42 1.479 2.269 -4.695 314 HE2 TYR 42 HE2 TYR 42 1.612 -1.617 -6.445 315 HH TYR 42 HH TYR 42 2.789 0.215 -7.212 316 H TYR 43 H TYR 43 -3.218 -2.595 -6.292 317 HA TYR 43 HA TYR 43 -2.700 -5.257 -5.247 318 1HB TYR 43 1HB TYR 43 -3.394 -4.278 -8.026 319 2HB TYR 43 2HB TYR 43 -3.137 -5.973 -7.617 320 HD1 TYR 43 HD1 TYR 43 -4.758 -7.179 -6.248 321 HD2 TYR 43 HD2 TYR 43 -5.408 -3.119 -7.340 322 HE1 TYR 43 HE1 TYR 43 -7.115 -7.381 -5.584 323 HE2 TYR 43 HE2 TYR 43 -7.768 -3.313 -6.682 324 HH TYR 43 HH TYR 43 -9.455 -4.965 -6.331 325 H LEU 44 H LEU 44 -0.636 -5.784 -4.907 326 HA LEU 44 HA LEU 44 1.538 -4.478 -6.192 327 1HB LEU 44 1HB LEU 44 1.421 -6.967 -4.495 328 2HB LEU 44 2HB LEU 44 2.918 -6.315 -5.125 329 HG LEU 44 HG LEU 44 2.271 -4.154 -3.881 330 1HD1 LEU 44 1HD1 LEU 44 -0.046 -4.729 -3.405 331 2HD1 LEU 44 2HD1 LEU 44 0.858 -4.476 -1.914 332 3HD1 LEU 44 3HD1 LEU 44 0.482 -6.113 -2.449 333 1HD2 LEU 44 1HD2 LEU 44 3.000 -6.646 -2.347 334 2HD2 LEU 44 2HD2 LEU 44 3.263 -4.987 -1.806 335 3HD2 LEU 44 3HD2 LEU 44 4.116 -5.597 -3.226 336 H ALA 45 H ALA 45 3.186 -5.513 -7.486 337 HA ALA 45 HA ALA 45 4.043 -6.832 -9.120 338 1HB ALA 45 1HB ALA 45 3.264 -8.803 -7.902 339 2HB ALA 45 2HB ALA 45 3.115 -9.018 -9.646 340 3HB ALA 45 3HB ALA 45 1.686 -8.661 -8.676 341 H THR 46 H THR 46 0.506 -6.618 -9.363 342 HA THR 46 HA THR 46 0.675 -6.110 -12.210 343 HB THR 46 HB THR 46 -1.782 -5.791 -10.484 344 HG1 THR 46 HG1 THR 46 -0.403 -8.104 -11.292 345 1HG2 THR 46 1HG2 THR 46 -2.942 -6.459 -12.531 346 2HG2 THR 46 2HG2 THR 46 -1.397 -6.636 -13.364 347 3HG2 THR 46 3HG2 THR 46 -1.933 -5.045 -12.824 348 H GLU 47 H GLU 47 0.516 -4.377 -9.237 349 HA GLU 47 HA GLU 47 0.777 -2.214 -8.678 350 1HB GLU 47 1HB GLU 47 1.735 -1.968 -11.529 351 2HB GLU 47 2HB GLU 47 1.928 -0.731 -10.293 352 1HG GLU 47 1HG GLU 47 3.100 -3.506 -10.224 353 2HG GLU 47 2HG GLU 47 3.968 -2.013 -10.573 354 H ASN 48 H ASN 48 -1.797 -3.046 -9.534 355 HA ASN 48 HA ASN 48 -2.885 -0.596 -10.717 356 1HB ASN 48 1HB ASN 48 -4.197 -3.247 -10.076 357 2HB ASN 48 2HB ASN 48 -5.074 -1.840 -10.665 358 1HD2 ASN 48 1HD2 ASN 48 -4.868 -4.425 -11.865 359 2HD2 ASN 48 2HD2 ASN 48 -4.143 -4.199 -13.421 360 H VAL 49 H VAL 49 -3.154 0.972 -9.266 361 HA VAL 49 HA VAL 49 -3.912 0.259 -6.517 362 HB VAL 49 HB VAL 49 -3.186 3.016 -7.486 363 1HG1 VAL 49 1HG1 VAL 49 -4.224 2.931 -5.309 364 2HG1 VAL 49 2HG1 VAL 49 -2.513 3.318 -5.125 365 3HG1 VAL 49 3HG1 VAL 49 -3.091 1.689 -4.780 366 1HG2 VAL 49 1HG2 VAL 49 -0.876 2.576 -6.799 367 2HG2 VAL 49 2HG2 VAL 49 -1.366 1.533 -8.134 368 3HG2 VAL 49 3HG2 VAL 49 -1.290 0.889 -6.493 369 H HIS 50 H HIS 50 -6.041 0.210 -6.145 370 HA HIS 50 HA HIS 50 -7.779 2.043 -7.657 371 1HB HIS 50 1HB HIS 50 -8.370 -0.514 -6.161 372 2HB HIS 50 2HB HIS 50 -9.641 0.576 -6.704 373 HD1 HIS 50 HD1 HIS 50 -10.616 -0.092 -8.881 374 HD2 HIS 50 HD2 HIS 50 -6.634 -1.256 -8.549 375 HE1 HIS 50 HE1 HIS 50 -10.097 -1.344 -10.994 376 HE2 HIS 50 HE2 HIS 50 -7.722 -2.143 -10.731 377 H ILE 51 H ILE 51 -7.759 3.939 -6.585 378 HA ILE 51 HA ILE 51 -8.019 3.984 -3.681 379 HB ILE 51 HB ILE 51 -7.854 6.318 -5.603 380 1HG1 ILE 51 1HG1 ILE 51 -5.529 6.520 -4.417 381 2HG1 ILE 51 2HG1 ILE 51 -5.749 4.806 -4.086 382 1HG2 ILE 51 1HG2 ILE 51 -7.351 7.644 -3.587 383 2HG2 ILE 51 2HG2 ILE 51 -7.648 6.214 -2.599 384 3HG2 ILE 51 3HG2 ILE 51 -8.960 6.922 -3.539 385 1HD1 ILE 51 1HD1 ILE 51 -5.745 6.079 -6.810 386 2HD1 ILE 51 2HD1 ILE 51 -5.919 4.358 -6.468 387 3HD1 ILE 51 3HD1 ILE 51 -4.409 5.184 -6.085 388 H VAL 52 H VAL 52 -10.014 3.683 -2.913 389 HA VAL 52 HA VAL 52 -12.314 4.696 -4.382 390 HB VAL 52 HB VAL 52 -12.254 3.158 -1.778 391 1HG1 VAL 52 1HG1 VAL 52 -14.310 4.418 -2.107 392 2HG1 VAL 52 2HG1 VAL 52 -14.607 2.686 -2.267 393 3HG1 VAL 52 3HG1 VAL 52 -14.508 3.702 -3.707 394 1HG2 VAL 52 1HG2 VAL 52 -11.262 1.834 -3.562 395 2HG2 VAL 52 2HG2 VAL 52 -12.660 2.143 -4.590 396 3HG2 VAL 52 3HG2 VAL 52 -12.841 1.189 -3.119 397 H LEU 53 H LEU 53 -12.762 6.769 -4.097 398 HA LEU 53 HA LEU 53 -11.834 8.285 -1.881 399 1HB LEU 53 1HB LEU 53 -13.903 8.997 -3.963 400 2HB LEU 53 2HB LEU 53 -13.131 10.126 -2.864 401 HG LEU 53 HG LEU 53 -11.750 8.554 -5.041 402 1HD1 LEU 53 1HD1 LEU 53 -13.153 10.357 -5.894 403 2HD1 LEU 53 2HD1 LEU 53 -11.441 10.728 -6.099 404 3HD1 LEU 53 3HD1 LEU 53 -12.361 11.496 -4.805 405 1HD2 LEU 53 1HD2 LEU 53 -10.284 8.877 -3.126 406 2HD2 LEU 53 2HD2 LEU 53 -10.662 10.600 -3.107 407 3HD2 LEU 53 3HD2 LEU 53 -9.785 9.906 -4.469 408 H LYS 54 H LYS 54 -13.777 9.933 -1.060 409 HA LYS 54 HA LYS 54 -14.945 8.577 1.048 410 1HB LYS 54 1HB LYS 54 -14.593 11.023 0.949 411 2HB LYS 54 2HB LYS 54 -15.900 11.152 -0.220 412 1HG LYS 54 1HG LYS 54 -17.497 10.392 1.435 413 2HG LYS 54 2HG LYS 54 -16.198 10.159 2.609 414 1HD LYS 54 1HD LYS 54 -15.702 12.545 2.559 415 2HD LYS 54 2HD LYS 54 -16.954 12.791 1.341 416 1HE LYS 54 1HE LYS 54 -17.404 11.773 4.145 417 2HE LYS 54 2HE LYS 54 -17.722 13.414 3.586 418 1HZ LYS 54 1HZ LYS 54 -19.086 10.924 2.728 419 2HZ LYS 54 2HZ LYS 54 -19.286 12.414 1.944 420 3HZ LYS 54 3HZ LYS 54 -19.763 12.239 3.563 421 H ASN 55 H ASN 55 -16.810 10.005 -1.634 422 HA ASN 55 HA ASN 55 -18.292 7.528 -1.960 423 1HB ASN 55 1HB ASN 55 -19.434 8.988 -0.164 424 2HB ASN 55 2HB ASN 55 -19.835 10.079 -1.485 425 1HD2 ASN 55 1HD2 ASN 55 -20.418 6.969 -0.048 426 2HD2 ASN 55 2HD2 ASN 55 -21.831 6.583 -0.972 427 H ASP 56 H ASP 56 -16.423 9.422 -3.336 428 HA ASP 56 HA ASP 56 -17.994 10.672 -5.411 429 1HB ASP 56 1HB ASP 56 -14.986 10.455 -5.159 430 2HB ASP 56 2HB ASP 56 -15.869 11.526 -6.239 431 H ASN 57 H ASN 57 -15.007 8.870 -5.972 432 HA ASN 57 HA ASN 57 -16.335 6.807 -7.478 433 1HB ASN 57 1HB ASN 57 -15.424 7.310 -9.639 434 2HB ASN 57 2HB ASN 57 -16.232 8.763 -9.077 435 1HD2 ASN 57 1HD2 ASN 57 -13.249 7.338 -10.020 436 2HD2 ASN 57 2HD2 ASN 57 -12.282 8.768 -9.903 437 H THR 58 H THR 58 -14.661 5.316 -8.474 438 HA THR 58 HA THR 58 -12.406 5.104 -6.627 439 HB THR 58 HB THR 58 -13.281 3.077 -8.692 440 HG1 THR 58 HG1 THR 58 -15.006 3.398 -7.273 441 1HG2 THR 58 1HG2 THR 58 -11.021 2.761 -7.823 442 2HG2 THR 58 2HG2 THR 58 -12.095 1.502 -7.216 443 3HG2 THR 58 3HG2 THR 58 -11.629 2.845 -6.170 444 H VAL 59 H VAL 59 -10.435 5.691 -7.215 445 HA VAL 59 HA VAL 59 -9.900 6.244 -10.049 446 HB VAL 59 HB VAL 59 -8.204 7.004 -7.667 447 1HG1 VAL 59 1HG1 VAL 59 -7.227 8.643 -9.200 448 2HG1 VAL 59 2HG1 VAL 59 -8.258 8.042 -10.498 449 3HG1 VAL 59 3HG1 VAL 59 -7.024 6.997 -9.797 450 1HG2 VAL 59 1HG2 VAL 59 -10.310 8.651 -9.062 451 2HG2 VAL 59 2HG2 VAL 59 -9.205 9.234 -7.820 452 3HG2 VAL 59 3HG2 VAL 59 -10.409 8.009 -7.422 453 H LEU 60 H LEU 60 -8.852 4.700 -11.149 454 HA LEU 60 HA LEU 60 -7.223 2.808 -9.619 455 1HB LEU 60 1HB LEU 60 -7.454 1.258 -11.478 456 2HB LEU 60 2HB LEU 60 -9.018 1.762 -10.877 457 HG LEU 60 HG LEU 60 -7.791 3.039 -13.310 458 1HD1 LEU 60 1HD1 LEU 60 -9.581 0.617 -13.243 459 2HD1 LEU 60 2HD1 LEU 60 -7.864 0.603 -13.641 460 3HD1 LEU 60 3HD1 LEU 60 -9.002 1.457 -14.684 461 1HD2 LEU 60 1HD2 LEU 60 -9.688 4.189 -12.282 462 2HD2 LEU 60 2HD2 LEU 60 -10.641 2.707 -12.376 463 3HD2 LEU 60 3HD2 LEU 60 -10.123 3.516 -13.854 464 H LEU 61 H LEU 61 -5.171 3.250 -9.578 465 HA LEU 61 HA LEU 61 -3.819 4.506 -11.819 466 1HB LEU 61 1HB LEU 61 -2.519 3.297 -9.380 467 2HB LEU 61 2HB LEU 61 -1.863 4.516 -10.455 468 HG LEU 61 HG LEU 61 -4.107 4.898 -8.472 469 1HD1 LEU 61 1HD1 LEU 61 -1.888 4.753 -7.469 470 2HD1 LEU 61 2HD1 LEU 61 -2.537 6.390 -7.361 471 3HD1 LEU 61 3HD1 LEU 61 -1.308 6.007 -8.565 472 1HD2 LEU 61 1HD2 LEU 61 -4.054 7.246 -9.119 473 2HD2 LEU 61 2HD2 LEU 61 -4.491 6.222 -10.487 474 3HD2 LEU 61 3HD2 LEU 61 -2.860 6.884 -10.367 475 H LYS 62 H LYS 62 -4.062 3.012 -13.441 476 HA LYS 62 HA LYS 62 -3.441 0.237 -13.004 477 1HB LYS 62 1HB LYS 62 -3.866 0.135 -15.536 478 2HB LYS 62 2HB LYS 62 -5.219 0.563 -14.496 479 1HG LYS 62 1HG LYS 62 -4.720 2.970 -14.990 480 2HG LYS 62 2HG LYS 62 -3.550 2.411 -16.185 481 1HD LYS 62 1HD LYS 62 -5.300 1.282 -17.421 482 2HD LYS 62 2HD LYS 62 -6.487 1.714 -16.188 483 1HE LYS 62 1HE LYS 62 -6.018 4.108 -16.662 484 2HE LYS 62 2HE LYS 62 -4.968 3.602 -17.982 485 1HZ LYS 62 1HZ LYS 62 -6.824 2.636 -19.111 486 2HZ LYS 62 2HZ LYS 62 -7.237 4.224 -18.684 487 3HZ LYS 62 3HZ LYS 62 -7.855 2.922 -17.792 488 H GLY 63 H GLY 63 -1.339 -0.079 -12.583 489 1HA GLY 63 1HA GLY 63 0.709 -0.817 -13.454 490 2HA GLY 63 2HA GLY 63 0.451 0.195 -14.869 491 H LEU 64 H LEU 64 2.623 -0.171 -12.716 492 HA LEU 64 HA LEU 64 3.030 2.722 -12.288 493 1HB LEU 64 1HB LEU 64 2.793 1.468 -10.170 494 2HB LEU 64 2HB LEU 64 4.125 0.432 -10.642 495 HG LEU 64 HG LEU 64 5.626 2.420 -10.633 496 1HD1 LEU 64 1HD1 LEU 64 3.917 4.129 -11.030 497 2HD1 LEU 64 2HD1 LEU 64 4.871 4.479 -9.588 498 3HD1 LEU 64 3HD1 LEU 64 3.243 3.821 -9.429 499 1HD2 LEU 64 1HD2 LEU 64 5.770 2.616 -8.209 500 2HD2 LEU 64 2HD2 LEU 64 5.489 0.944 -8.688 501 3HD2 LEU 64 3HD2 LEU 64 4.163 1.913 -8.043 502 H LYS 65 H LYS 65 4.843 -0.330 -12.557 503 HA LYS 65 HA LYS 65 6.242 0.508 -14.870 504 1HB LYS 65 1HB LYS 65 7.517 1.852 -13.248 505 2HB LYS 65 2HB LYS 65 7.881 0.394 -12.332 506 1HG LYS 65 1HG LYS 65 9.002 -0.516 -14.357 507 2HG LYS 65 2HG LYS 65 8.763 1.050 -15.129 508 1HD LYS 65 1HD LYS 65 10.113 2.120 -13.407 509 2HD LYS 65 2HD LYS 65 10.322 0.566 -12.590 510 1HE LYS 65 1HE LYS 65 11.390 -0.311 -14.647 511 2HE LYS 65 2HE LYS 65 11.270 1.298 -15.357 512 1HZ LYS 65 1HZ LYS 65 12.806 0.587 -12.917 513 2HZ LYS 65 2HZ LYS 65 12.680 2.139 -13.581 514 3HZ LYS 65 3HZ LYS 65 13.457 0.911 -14.449 515 H ASN 66 H ASN 66 7.133 -1.494 -12.046 516 HA ASN 66 HA ASN 66 6.742 -3.922 -13.558 517 1HB ASN 66 1HB ASN 66 8.990 -3.037 -14.281 518 2HB ASN 66 2HB ASN 66 9.533 -3.209 -12.617 519 1HD2 ASN 66 1HD2 ASN 66 8.266 -5.010 -15.378 520 2HD2 ASN 66 2HD2 ASN 66 9.036 -6.506 -14.969 521 H ILE 67 H ILE 67 8.908 -5.019 -11.552 522 HA ILE 67 HA ILE 67 8.934 -6.010 -9.511 523 HB ILE 67 HB ILE 67 6.703 -4.092 -8.799 524 1HG1 ILE 67 1HG1 ILE 67 9.649 -4.032 -8.100 525 2HG1 ILE 67 2HG1 ILE 67 8.885 -3.025 -9.326 526 1HG2 ILE 67 1HG2 ILE 67 6.636 -6.093 -7.402 527 2HG2 ILE 67 2HG2 ILE 67 7.165 -4.692 -6.471 528 3HG2 ILE 67 3HG2 ILE 67 8.344 -5.888 -7.010 529 1HD1 ILE 67 1HD1 ILE 67 8.322 -2.976 -6.372 530 2HD1 ILE 67 2HD1 ILE 67 7.502 -1.992 -7.584 531 3HD1 ILE 67 3HD1 ILE 67 9.226 -1.774 -7.294 532 H VAL 68 H VAL 68 8.344 -8.046 -9.925 533 HA VAL 68 HA VAL 68 5.635 -8.827 -9.366 534 HB VAL 68 HB VAL 68 5.321 -8.313 -11.694 535 1HG1 VAL 68 1HG1 VAL 68 7.648 -10.134 -12.279 536 2HG1 VAL 68 2HG1 VAL 68 7.615 -8.382 -12.482 537 3HG1 VAL 68 3HG1 VAL 68 6.587 -9.405 -13.483 538 1HG2 VAL 68 1HG2 VAL 68 4.150 -10.266 -10.892 539 2HG2 VAL 68 2HG2 VAL 68 5.541 -11.287 -11.262 540 3HG2 VAL 68 3HG2 VAL 68 4.643 -10.511 -12.568 541 H SER 69 H SER 69 6.357 -10.103 -7.742 542 HA SER 69 HA SER 69 7.414 -12.665 -8.515 543 1HB SER 69 1HB SER 69 9.265 -12.530 -6.773 544 2HB SER 69 2HB SER 69 9.529 -11.611 -8.256 545 HG SER 69 HG SER 69 9.145 -9.745 -7.195 546 H VAL 70 H VAL 70 5.001 -11.551 -7.330 547 HA VAL 70 HA VAL 70 4.876 -12.128 -4.567 548 HB VAL 70 HB VAL 70 2.640 -12.185 -6.610 549 1HG1 VAL 70 1HG1 VAL 70 1.147 -11.856 -4.688 550 2HG1 VAL 70 2HG1 VAL 70 2.525 -12.014 -3.599 551 3HG1 VAL 70 3HG1 VAL 70 2.020 -13.386 -4.589 552 1HG2 VAL 70 1HG2 VAL 70 3.568 -9.974 -4.779 553 2HG2 VAL 70 2HG2 VAL 70 2.144 -9.920 -5.817 554 3HG2 VAL 70 3HG2 VAL 70 3.752 -10.024 -6.532 555 H LYS 71 H LYS 71 4.928 -14.008 -3.571 556 HA LYS 71 HA LYS 71 5.151 -16.430 -5.100 557 1HB LYS 71 1HB LYS 71 5.352 -15.796 -2.166 558 2HB LYS 71 2HB LYS 71 5.433 -17.446 -2.772 559 1HG LYS 71 1HG LYS 71 7.397 -16.916 -4.062 560 2HG LYS 71 2HG LYS 71 7.286 -15.219 -3.588 561 1HD LYS 71 1HD LYS 71 7.738 -15.755 -1.307 562 2HD LYS 71 2HD LYS 71 7.613 -17.484 -1.631 563 1HE LYS 71 1HE LYS 71 9.670 -15.684 -2.887 564 2HE LYS 71 2HE LYS 71 9.950 -16.617 -1.417 565 1HZ LYS 71 1HZ LYS 71 9.569 -18.641 -2.631 566 2HZ LYS 71 2HZ LYS 71 10.764 -17.737 -3.429 567 3HZ LYS 71 3HZ LYS 71 9.185 -17.782 -4.042 568 H PHE 72 H PHE 72 3.959 -18.381 -4.625 569 HA PHE 72 HA PHE 72 1.139 -17.870 -4.194 570 1HB PHE 72 1HB PHE 72 0.839 -20.262 -4.763 571 2HB PHE 72 2HB PHE 72 1.724 -19.384 -6.000 572 HD1 PHE 72 HD1 PHE 72 4.086 -19.816 -6.385 573 HD2 PHE 72 HD2 PHE 72 1.886 -21.985 -3.457 574 HE1 PHE 72 HE1 PHE 72 5.878 -21.494 -6.287 575 HE2 PHE 72 HE2 PHE 72 3.675 -23.672 -3.360 576 HZ PHE 72 HZ PHE 72 5.677 -23.424 -4.776 577 H SER 73 H SER 73 3.680 -18.259 -2.258 578 HA SER 73 HA SER 73 2.369 -19.829 -0.196 579 1HB SER 73 1HB SER 73 4.991 -18.308 -0.134 580 2HB SER 73 2HB SER 73 4.420 -19.440 1.089 581 HG SER 73 HG SER 73 4.316 -20.965 -0.810 582 H LYS 74 H LYS 74 2.107 -18.873 1.974 583 HA LYS 74 HA LYS 74 1.728 -15.974 1.954 584 1HB LYS 74 1HB LYS 74 -0.481 -16.364 3.179 585 2HB LYS 74 2HB LYS 74 -0.464 -16.654 1.446 586 1HG LYS 74 1HG LYS 74 0.189 -19.102 2.665 587 2HG LYS 74 2HG LYS 74 -1.169 -18.431 3.570 588 1HD LYS 74 1HD LYS 74 -1.959 -19.820 1.730 589 2HD LYS 74 2HD LYS 74 -2.409 -18.133 1.474 590 1HE LYS 74 1HE LYS 74 -0.568 -17.846 -0.079 591 2HE LYS 74 2HE LYS 74 -0.020 -19.492 0.230 592 1HZ LYS 74 1HZ LYS 74 -2.642 -18.776 -0.975 593 2HZ LYS 74 2HZ LYS 74 -2.022 -20.344 -0.764 594 3HZ LYS 74 3HZ LYS 74 -1.276 -19.278 -1.846 595 H ASP 75 H ASP 75 2.979 -15.254 3.515 596 HA ASP 75 HA ASP 75 3.064 -16.725 6.068 597 1HB ASP 75 1HB ASP 75 5.137 -17.138 4.798 598 2HB ASP 75 2HB ASP 75 5.407 -15.403 4.677 599 H ARG 76 H ARG 76 2.973 -15.504 7.900 600 HA ARG 76 HA ARG 76 2.328 -12.683 7.467 601 1HB ARG 76 1HB ARG 76 1.618 -14.645 9.627 602 2HB ARG 76 2HB ARG 76 1.391 -12.913 9.847 603 1HG ARG 76 1HG ARG 76 -0.168 -12.798 8.070 604 2HG ARG 76 2HG ARG 76 0.230 -14.428 7.524 605 1HD ARG 76 1HD ARG 76 -0.950 -13.835 10.224 606 2HD ARG 76 2HD ARG 76 -1.933 -14.178 8.799 607 HE ARG 76 HE ARG 76 -0.150 -16.058 10.187 608 1HH1 ARG 76 1HH1 ARG 76 -2.597 -15.426 7.769 609 2HH1 ARG 76 2HH1 ARG 76 -2.920 -17.106 7.459 610 1HH2 ARG 76 1HH2 ARG 76 -0.598 -18.284 9.818 611 2HH2 ARG 76 2HH2 ARG 76 -1.835 -18.718 8.670 612 H HIS 77 H HIS 77 4.670 -14.728 8.967 613 HA HIS 77 HA HIS 77 5.673 -12.843 10.844 614 1HB HIS 77 1HB HIS 77 6.863 -15.319 9.605 615 2HB HIS 77 2HB HIS 77 7.774 -14.309 10.724 616 HD1 HIS 77 HD1 HIS 77 6.342 -17.357 10.945 617 HD2 HIS 77 HD2 HIS 77 5.549 -13.837 13.028 618 HE1 HIS 77 HE1 HIS 77 5.258 -18.063 13.102 619 HE2 HIS 77 HE2 HIS 77 4.705 -15.920 14.306 620 H LEU 78 H LEU 78 6.371 -13.506 7.463 621 HA LEU 78 HA LEU 78 8.639 -11.801 7.307 622 1HB LEU 78 1HB LEU 78 8.055 -13.593 5.666 623 2HB LEU 78 2HB LEU 78 6.752 -12.574 5.086 624 HG LEU 78 HG LEU 78 8.357 -10.892 4.339 625 1HD1 LEU 78 1HD1 LEU 78 10.067 -11.255 6.050 626 2HD1 LEU 78 2HD1 LEU 78 10.753 -11.311 4.426 627 3HD1 LEU 78 3HD1 LEU 78 10.473 -12.808 5.317 628 1HD2 LEU 78 1HD2 LEU 78 9.380 -12.156 2.526 629 2HD2 LEU 78 2HD2 LEU 78 7.724 -12.698 2.810 630 3HD2 LEU 78 3HD2 LEU 78 9.081 -13.662 3.391 631 H ILE 79 H ILE 79 5.177 -11.299 6.890 632 HA ILE 79 HA ILE 79 5.259 -8.603 6.062 633 HB ILE 79 HB ILE 79 3.183 -9.916 7.825 634 1HG1 ILE 79 1HG1 ILE 79 3.229 -9.664 4.813 635 2HG1 ILE 79 2HG1 ILE 79 3.589 -11.142 5.701 636 1HG2 ILE 79 1HG2 ILE 79 3.036 -7.469 6.072 637 2HG2 ILE 79 2HG2 ILE 79 2.987 -7.509 7.833 638 3HG2 ILE 79 3HG2 ILE 79 1.665 -8.208 6.901 639 1HD1 ILE 79 1HD1 ILE 79 1.331 -11.195 4.855 640 2HD1 ILE 79 2HD1 ILE 79 0.960 -9.674 5.668 641 3HD1 ILE 79 3HD1 ILE 79 1.312 -11.119 6.616 642 H GLU 80 H GLU 80 5.029 -10.096 9.247 643 HA GLU 80 HA GLU 80 5.005 -7.858 10.880 644 1HB GLU 80 1HB GLU 80 4.571 -10.087 11.706 645 2HB GLU 80 2HB GLU 80 6.205 -10.596 11.313 646 1HG GLU 80 1HG GLU 80 6.973 -8.818 12.970 647 2HG GLU 80 2HG GLU 80 5.291 -8.764 13.498 648 H THR 81 H THR 81 7.829 -9.787 9.869 649 HA THR 81 HA THR 81 9.723 -8.183 11.186 650 HB THR 81 HB THR 81 11.351 -9.293 9.512 651 HG1 THR 81 HG1 THR 81 9.127 -11.007 9.081 652 1HG2 THR 81 1HG2 THR 81 11.076 -10.032 11.817 653 2HG2 THR 81 2HG2 THR 81 11.221 -11.423 10.742 654 3HG2 THR 81 3HG2 THR 81 9.641 -10.953 11.365 655 H THR 82 H THR 82 8.388 -8.013 7.923 656 HA THR 82 HA THR 82 10.201 -6.019 7.008 657 HB THR 82 HB THR 82 7.414 -6.619 5.978 658 HG1 THR 82 HG1 THR 82 8.577 -8.478 5.735 659 1HG2 THR 82 1HG2 THR 82 8.290 -4.472 5.190 660 2HG2 THR 82 2HG2 THR 82 8.247 -5.651 3.878 661 3HG2 THR 82 3HG2 THR 82 9.776 -5.261 4.667 662 H SER 83 H SER 83 6.987 -5.902 8.516 663 HA SER 83 HA SER 83 6.608 -3.129 8.453 664 1HB SER 83 1HB SER 83 4.773 -4.528 9.117 665 2HB SER 83 2HB SER 83 5.704 -5.226 10.440 666 HG SER 83 HG SER 83 4.174 -2.998 10.418 667 H ASN 84 H ASN 84 8.074 -5.163 10.989 668 HA ASN 84 HA ASN 84 8.816 -3.024 12.669 669 1HB ASN 84 1HB ASN 84 8.702 -5.404 13.394 670 2HB ASN 84 2HB ASN 84 10.147 -5.733 12.445 671 1HD2 ASN 84 1HD2 ASN 84 11.306 -6.383 14.263 672 2HD2 ASN 84 2HD2 ASN 84 11.871 -5.249 15.442 673 H LYS 85 H LYS 85 10.396 -4.548 9.945 674 HA LYS 85 HA LYS 85 12.950 -3.415 10.188 675 1HB LYS 85 1HB LYS 85 12.274 -5.223 8.578 676 2HB LYS 85 2HB LYS 85 11.465 -3.993 7.615 677 1HG LYS 85 1HG LYS 85 13.574 -4.419 6.615 678 2HG LYS 85 2HG LYS 85 13.662 -2.835 7.387 679 1HD LYS 85 1HD LYS 85 15.692 -4.127 7.797 680 2HD LYS 85 2HD LYS 85 14.818 -3.823 9.301 681 1HE LYS 85 1HE LYS 85 15.656 -6.125 9.171 682 2HE LYS 85 2HE LYS 85 13.896 -6.064 9.248 683 1HZ LYS 85 1HZ LYS 85 14.513 -7.657 7.617 684 2HZ LYS 85 2HZ LYS 85 15.566 -6.574 6.846 685 3HZ LYS 85 3HZ LYS 85 13.898 -6.314 6.792 686 H LEU 86 H LEU 86 10.068 -2.279 8.444 687 HA LEU 86 HA LEU 86 11.186 0.158 7.553 688 1HB LEU 86 1HB LEU 86 9.182 -0.780 6.553 689 2HB LEU 86 2HB LEU 86 8.318 -0.629 8.069 690 HG LEU 86 HG LEU 86 8.508 1.842 7.893 691 1HD1 LEU 86 1HD1 LEU 86 9.192 2.847 5.793 692 2HD1 LEU 86 2HD1 LEU 86 9.597 1.256 5.145 693 3HD1 LEU 86 3HD1 LEU 86 10.521 1.921 6.493 694 1HD2 LEU 86 1HD2 LEU 86 6.502 0.680 7.126 695 2HD2 LEU 86 2HD2 LEU 86 7.226 0.474 5.531 696 3HD2 LEU 86 3HD2 LEU 86 6.842 2.091 6.121 697 H LYS 87 H LYS 87 9.252 -0.687 10.383 698 HA LYS 87 HA LYS 87 8.945 1.851 11.488 699 1HB LYS 87 1HB LYS 87 7.686 -0.075 12.256 700 2HB LYS 87 2HB LYS 87 9.153 -0.846 12.836 701 1HG LYS 87 1HG LYS 87 9.413 0.869 14.532 702 2HG LYS 87 2HG LYS 87 7.985 1.709 13.923 703 1HD LYS 87 1HD LYS 87 6.597 -0.218 14.477 704 2HD LYS 87 2HD LYS 87 8.021 -1.095 15.039 705 1HE LYS 87 1HE LYS 87 6.989 1.480 16.220 706 2HE LYS 87 2HE LYS 87 6.698 -0.127 16.884 707 1HZ LYS 87 1HZ LYS 87 9.297 1.280 16.641 708 2HZ LYS 87 2HZ LYS 87 9.164 -0.363 17.029 709 3HZ LYS 87 3HZ LYS 87 8.505 0.808 18.066 710 H SER 88 H SER 88 11.667 -0.364 11.644 711 HA SER 88 HA SER 88 12.934 1.222 13.726 712 1HB SER 88 1HB SER 88 13.910 -1.312 12.394 713 2HB SER 88 2HB SER 88 14.577 -0.564 13.844 714 HG SER 88 HG SER 88 12.001 -1.718 13.520 715 H ARG 89 H ARG 89 13.631 0.240 10.351 716 HA ARG 89 HA ARG 89 16.084 1.833 10.501 717 1HB ARG 89 1HB ARG 89 15.213 -0.093 8.347 718 2HB ARG 89 2HB ARG 89 16.790 0.672 8.484 719 1HG ARG 89 1HG ARG 89 17.025 -0.509 10.707 720 2HG ARG 89 2HG ARG 89 15.588 -1.430 10.261 721 1HD ARG 89 1HD ARG 89 17.503 -2.724 9.650 722 2HD ARG 89 2HD ARG 89 16.758 -2.120 8.169 723 HE ARG 89 HE ARG 89 19.051 -0.719 9.368 724 1HH1 ARG 89 1HH1 ARG 89 17.633 -2.466 6.672 725 2HH1 ARG 89 2HH1 ARG 89 18.903 -2.047 5.575 726 1HH2 ARG 89 1HH2 ARG 89 20.732 -0.191 7.935 727 2HH2 ARG 89 2HH2 ARG 89 20.679 -0.764 6.292 728 H GLU 90 H GLU 90 12.928 2.096 9.236 729 HA GLU 90 HA GLU 90 11.925 3.370 7.636 730 1HB GLU 90 1HB GLU 90 14.378 5.078 8.099 731 2HB GLU 90 2HB GLU 90 13.019 5.575 7.101 732 1HG GLU 90 1HG GLU 90 12.708 4.809 9.987 733 2HG GLU 90 2HG GLU 90 13.091 6.451 9.473 734 H ILE 91 H ILE 91 12.394 1.501 6.245 735 HA ILE 91 HA ILE 91 14.630 1.767 4.410 736 HB ILE 91 HB ILE 91 13.904 -0.422 3.522 737 1HG1 ILE 91 1HG1 ILE 91 11.799 -0.303 5.700 738 2HG1 ILE 91 2HG1 ILE 91 11.476 -0.161 3.974 739 1HG2 ILE 91 1HG2 ILE 91 14.198 -0.316 6.520 740 2HG2 ILE 91 2HG2 ILE 91 15.509 -0.321 5.337 741 3HG2 ILE 91 3HG2 ILE 91 14.469 -1.735 5.509 742 1HD1 ILE 91 1HD1 ILE 91 12.651 -2.576 5.337 743 2HD1 ILE 91 2HD1 ILE 91 12.261 -2.432 3.623 744 3HD1 ILE 91 3HD1 ILE 91 10.973 -2.394 4.829 745 H THR 92 H THR 92 14.286 1.522 2.090 746 HA THR 92 HA THR 92 12.532 3.440 1.055 747 HB THR 92 HB THR 92 13.691 1.171 -0.565 748 HG1 THR 92 HG1 THR 92 15.153 3.536 -0.055 749 1HG2 THR 92 1HG2 THR 92 12.257 2.738 -1.768 750 2HG2 THR 92 2HG2 THR 92 13.934 2.933 -2.272 751 3HG2 THR 92 3HG2 THR 92 13.206 4.095 -1.164 752 H PHE 93 H PHE 93 10.581 3.290 -0.041 753 HA PHE 93 HA PHE 93 8.741 1.406 0.905 754 1HB PHE 93 1HB PHE 93 8.264 3.748 0.051 755 2HB PHE 93 2HB PHE 93 8.390 3.097 -1.578 756 HD1 PHE 93 HD1 PHE 93 6.535 2.126 -2.605 757 HD2 PHE 93 HD2 PHE 93 6.536 2.731 1.607 758 HE1 PHE 93 HE1 PHE 93 4.155 1.498 -2.516 759 HE2 PHE 93 HE2 PHE 93 4.161 2.105 1.705 760 HZ PHE 93 HZ PHE 93 2.967 1.488 -0.359 761 H GLN 94 H GLN 94 10.763 1.414 -1.923 762 HA GLN 94 HA GLN 94 9.411 -0.634 -3.350 763 1HB GLN 94 1HB GLN 94 12.300 0.255 -3.466 764 2HB GLN 94 2HB GLN 94 11.540 -0.835 -4.617 765 1HG GLN 94 1HG GLN 94 9.976 0.931 -5.253 766 2HG GLN 94 2HG GLN 94 10.751 2.024 -4.111 767 1HE2 GLN 94 1HE2 GLN 94 13.437 1.016 -4.715 768 2HE2 GLN 94 2HE2 GLN 94 13.846 1.680 -6.264 769 H GLU 95 H GLU 95 12.001 -0.619 -0.954 770 HA GLU 95 HA GLU 95 12.568 -3.408 -1.106 771 1HB GLU 95 1HB GLU 95 13.058 -1.526 1.211 772 2HB GLU 95 2HB GLU 95 13.875 -3.053 0.904 773 1HG GLU 95 1HG GLU 95 14.048 -0.581 -0.803 774 2HG GLU 95 2HG GLU 95 15.276 -1.151 0.326 775 H TYR 96 H TYR 96 10.452 -1.392 0.817 776 HA TYR 96 HA TYR 96 9.626 -3.258 2.725 777 1HB TYR 96 1HB TYR 96 9.175 -0.804 2.803 778 2HB TYR 96 2HB TYR 96 7.988 -1.013 1.522 779 HD1 TYR 96 HD1 TYR 96 5.762 -1.439 2.071 780 HD2 TYR 96 HD2 TYR 96 8.784 -2.166 4.975 781 HE1 TYR 96 HE1 TYR 96 4.029 -1.884 3.759 782 HE2 TYR 96 HE2 TYR 96 7.058 -2.612 6.666 783 HH TYR 96 HH TYR 96 3.732 -2.972 5.862 784 H ARG 97 H ARG 97 8.128 -2.381 -0.394 785 HA ARG 97 HA ARG 97 6.107 -4.379 -0.160 786 1HB ARG 97 1HB ARG 97 7.028 -2.748 -2.520 787 2HB ARG 97 2HB ARG 97 5.691 -3.887 -2.594 788 1HG ARG 97 1HG ARG 97 4.739 -2.524 -0.612 789 2HG ARG 97 2HG ARG 97 5.885 -1.287 -1.139 790 1HD ARG 97 1HD ARG 97 3.751 -2.561 -2.851 791 2HD ARG 97 2HD ARG 97 3.682 -0.948 -2.145 792 HE ARG 97 HE ARG 97 5.742 -0.516 -3.545 793 1HH1 ARG 97 1HH1 ARG 97 3.347 -2.886 -4.473 794 2HH1 ARG 97 2HH1 ARG 97 3.560 -2.637 -6.185 795 1HH2 ARG 97 1HH2 ARG 97 6.035 -0.197 -5.810 796 2HH2 ARG 97 2HH2 ARG 97 5.058 -1.097 -6.933 797 H ARG 98 H ARG 98 9.339 -4.363 -1.440 798 HA ARG 98 HA ARG 98 9.212 -6.562 -3.157 799 1HB ARG 98 1HB ARG 98 11.209 -5.084 -2.874 800 2HB ARG 98 2HB ARG 98 11.519 -5.868 -1.330 801 1HG ARG 98 1HG ARG 98 11.524 -8.055 -2.703 802 2HG ARG 98 2HG ARG 98 11.747 -6.992 -4.092 803 1HD ARG 98 1HD ARG 98 13.529 -7.233 -1.675 804 2HD ARG 98 2HD ARG 98 13.891 -7.760 -3.316 805 HE ARG 98 HE ARG 98 13.643 -4.952 -2.469 806 1HH1 ARG 98 1HH1 ARG 98 14.872 -7.390 -4.665 807 2HH1 ARG 98 2HH1 ARG 98 15.981 -6.292 -5.445 808 1HH2 ARG 98 1HH2 ARG 98 15.094 -3.525 -3.478 809 2HH2 ARG 98 2HH2 ARG 98 16.116 -4.114 -4.765 810 H ASN 99 H ASN 99 10.136 -6.493 0.279 811 HA ASN 99 HA ASN 99 10.241 -9.310 0.563 812 1HB ASN 99 1HB ASN 99 10.035 -7.071 2.578 813 2HB ASN 99 2HB ASN 99 10.107 -8.762 3.056 814 1HD2 ASN 99 1HD2 ASN 99 11.865 -6.068 1.767 815 2HD2 ASN 99 2HD2 ASN 99 13.434 -6.793 1.868 816 H LEU 100 H LEU 100 7.723 -6.926 0.964 817 HA LEU 100 HA LEU 100 5.854 -8.534 2.324 818 1HB LEU 100 1HB LEU 100 5.858 -5.994 1.961 819 2HB LEU 100 2HB LEU 100 5.152 -6.335 0.393 820 HG LEU 100 HG LEU 100 3.244 -7.441 1.519 821 1HD1 LEU 100 1HD1 LEU 100 2.956 -7.178 3.922 822 2HD1 LEU 100 2HD1 LEU 100 4.539 -6.412 4.042 823 3HD1 LEU 100 3HD1 LEU 100 4.415 -8.105 3.569 824 1HD2 LEU 100 1HD2 LEU 100 3.117 -5.096 0.866 825 2HD2 LEU 100 2HD2 LEU 100 3.808 -4.617 2.416 826 3HD2 LEU 100 3HD2 LEU 100 2.219 -5.384 2.357 827 H ALA 101 H ALA 101 6.502 -7.996 -1.106 828 HA ALA 101 HA ALA 101 4.354 -9.552 -2.105 829 1HB ALA 101 1HB ALA 101 5.541 -7.931 -3.496 830 2HB ALA 101 2HB ALA 101 5.581 -9.536 -4.223 831 3HB ALA 101 3HB ALA 101 7.005 -8.909 -3.396 832 H LYS 102 H LYS 102 7.609 -10.322 -1.030 833 HA LYS 102 HA LYS 102 7.658 -13.008 -1.972 834 1HB LYS 102 1HB LYS 102 9.093 -11.959 0.467 835 2HB LYS 102 2HB LYS 102 9.536 -13.342 -0.514 836 1HG LYS 102 1HG LYS 102 9.645 -10.456 -1.357 837 2HG LYS 102 2HG LYS 102 11.016 -11.470 -0.920 838 1HD LYS 102 1HD LYS 102 10.490 -12.948 -2.830 839 2HD LYS 102 2HD LYS 102 9.181 -11.854 -3.284 840 1HE LYS 102 1HE LYS 102 10.837 -10.025 -3.495 841 2HE LYS 102 2HE LYS 102 12.118 -11.183 -3.145 842 1HZ LYS 102 1HZ LYS 102 11.967 -10.890 -5.496 843 2HZ LYS 102 2HZ LYS 102 10.301 -11.188 -5.488 844 3HZ LYS 102 3HZ LYS 102 11.387 -12.441 -5.130 845 H ALA 103 H ALA 103 6.170 -11.424 0.703 846 HA ALA 103 HA ALA 103 5.800 -13.790 2.301 847 1HB ALA 103 1HB ALA 103 4.483 -11.087 2.533 848 2HB ALA 103 2HB ALA 103 5.977 -11.573 3.333 849 3HB ALA 103 3HB ALA 103 4.456 -12.367 3.746 850 H GLY 104 H GLY 104 4.239 -12.402 -0.384 851 1HA GLY 104 1HA GLY 104 2.622 -13.704 -1.590 852 2HA GLY 104 2HA GLY 104 2.023 -14.311 -0.052 853 H VAL 105 H VAL 105 2.632 -11.034 0.183 854 HA VAL 105 HA VAL 105 -0.174 -10.445 0.295 855 HB VAL 105 HB VAL 105 2.187 -8.571 0.540 856 1HG1 VAL 105 1HG1 VAL 105 0.147 -7.388 -0.058 857 2HG1 VAL 105 2HG1 VAL 105 0.597 -7.048 1.613 858 3HG1 VAL 105 3HG1 VAL 105 -0.712 -8.174 1.265 859 1HG2 VAL 105 1HG2 VAL 105 2.210 -10.291 2.263 860 2HG2 VAL 105 2HG2 VAL 105 0.528 -9.939 2.659 861 3HG2 VAL 105 3HG2 VAL 105 1.773 -8.728 2.957 862 H PHE 106 H PHE 106 -1.274 -10.245 -1.501 863 HA PHE 106 HA PHE 106 -0.022 -8.992 -3.844 864 1HB PHE 106 1HB PHE 106 -0.916 -11.304 -4.089 865 2HB PHE 106 2HB PHE 106 -2.519 -10.698 -3.687 866 HD1 PHE 106 HD1 PHE 106 0.187 -10.578 -6.188 867 HD2 PHE 106 HD2 PHE 106 -3.875 -9.657 -5.315 868 HE1 PHE 106 HE1 PHE 106 -0.212 -10.101 -8.568 869 HE2 PHE 106 HE2 PHE 106 -4.279 -9.177 -7.692 870 HZ PHE 106 HZ PHE 106 -2.449 -9.397 -9.323 871 H ARG 107 H ARG 107 -2.602 -8.690 -1.537 872 HA ARG 107 HA ARG 107 -3.667 -6.406 -3.063 873 1HB ARG 107 1HB ARG 107 -5.127 -8.502 -2.820 874 2HB ARG 107 2HB ARG 107 -5.275 -8.056 -1.125 875 1HG ARG 107 1HG ARG 107 -6.294 -5.944 -1.745 876 2HG ARG 107 2HG ARG 107 -6.090 -6.333 -3.458 877 1HD ARG 107 1HD ARG 107 -7.494 -8.378 -3.050 878 2HD ARG 107 2HD ARG 107 -7.832 -7.742 -1.442 879 HE ARG 107 HE ARG 107 -8.465 -6.071 -3.768 880 1HH1 ARG 107 1HH1 ARG 107 -9.560 -8.072 -1.121 881 2HH1 ARG 107 2HH1 ARG 107 -11.211 -7.541 -1.215 882 1HH2 ARG 107 1HH2 ARG 107 -10.637 -5.357 -3.908 883 2HH2 ARG 107 2HH2 ARG 107 -11.827 -5.984 -2.805 884 H TRP 108 H TRP 108 -2.836 -4.667 -2.126 885 HA TRP 108 HA TRP 108 -2.580 -4.474 0.777 886 1HB TRP 108 1HB TRP 108 -0.717 -3.760 -0.688 887 2HB TRP 108 2HB TRP 108 -1.770 -2.584 -1.456 888 HD1 TRP 108 HD1 TRP 108 -2.983 -1.058 0.961 889 HE1 TRP 108 HE1 TRP 108 -1.507 0.365 2.509 890 HE3 TRP 108 HE3 TRP 108 1.534 -3.241 -0.009 891 HZ2 TRP 108 HZ2 TRP 108 1.214 0.547 3.217 892 HZ3 TRP 108 HZ3 TRP 108 3.526 -2.373 1.140 893 HH2 TRP 108 HH2 TRP 108 3.367 -0.517 2.719 894 H VAL 109 H VAL 109 -4.510 -3.987 1.741 895 HA VAL 109 HA VAL 109 -6.133 -1.849 0.512 896 HB VAL 109 HB VAL 109 -7.046 -3.994 2.441 897 1HG1 VAL 109 1HG1 VAL 109 -8.301 -1.918 2.687 898 2HG1 VAL 109 2HG1 VAL 109 -9.302 -3.174 1.957 899 3HG1 VAL 109 3HG1 VAL 109 -8.620 -1.896 0.953 900 1HG2 VAL 109 1HG2 VAL 109 -6.555 -4.952 0.269 901 2HG2 VAL 109 2HG2 VAL 109 -7.510 -3.701 -0.526 902 3HG2 VAL 109 3HG2 VAL 109 -8.302 -4.885 0.512 903 H THR 110 H THR 110 -5.841 0.061 1.520 904 HA THR 110 HA THR 110 -5.519 -0.021 4.448 905 HB THR 110 HB THR 110 -4.399 2.033 2.533 906 HG1 THR 110 HG1 THR 110 -3.454 -0.268 3.112 907 1HG2 THR 110 1HG2 THR 110 -5.087 3.062 4.650 908 2HG2 THR 110 2HG2 THR 110 -3.329 3.016 4.506 909 3HG2 THR 110 3HG2 THR 110 -4.159 1.854 5.541 910 H ASN 111 H ASN 111 -7.346 0.493 5.366 911 HA ASN 111 HA ASN 111 -9.153 2.443 4.188 912 1HB ASN 111 1HB ASN 111 -9.305 0.582 6.543 913 2HB ASN 111 2HB ASN 111 -10.442 1.913 6.387 914 1HD2 ASN 111 1HD2 ASN 111 -12.109 1.758 4.987 915 2HD2 ASN 111 2HD2 ASN 111 -12.419 0.357 4.012 916 H ILE 112 H ILE 112 -8.464 4.477 4.421 917 HA ILE 112 HA ILE 112 -6.833 5.395 6.542 918 HB ILE 112 HB ILE 112 -8.546 6.978 4.617 919 1HG1 ILE 112 1HG1 ILE 112 -6.877 5.622 3.475 920 2HG1 ILE 112 2HG1 ILE 112 -6.417 7.320 3.399 921 1HG2 ILE 112 1HG2 ILE 112 -7.078 8.877 5.172 922 2HG2 ILE 112 2HG2 ILE 112 -6.318 7.900 6.427 923 3HG2 ILE 112 3HG2 ILE 112 -8.024 8.328 6.555 924 1HD1 ILE 112 1HD1 ILE 112 -5.276 5.245 5.253 925 2HD1 ILE 112 2HD1 ILE 112 -4.835 6.953 5.234 926 3HD1 ILE 112 3HD1 ILE 112 -4.490 5.938 3.834 927 H HIS 113 H HIS 113 -10.298 5.465 5.950 928 HA HIS 113 HA HIS 113 -11.042 7.102 8.110 929 1HB HIS 113 1HB HIS 113 -12.528 6.514 6.211 930 2HB HIS 113 2HB HIS 113 -12.626 4.867 6.816 931 HD1 HIS 113 HD1 HIS 113 -14.259 4.395 8.708 932 HD2 HIS 113 HD2 HIS 113 -13.927 8.444 7.783 933 HE1 HIS 113 HE1 HIS 113 -16.141 5.537 9.928 934 HE2 HIS 113 HE2 HIS 113 -15.907 7.983 9.384 935 H GLU 114 H GLU 114 -10.181 3.722 7.938 936 HA GLU 114 HA GLU 114 -11.188 3.245 10.638 937 1HB GLU 114 1HB GLU 114 -9.832 1.270 8.801 938 2HB GLU 114 2HB GLU 114 -10.757 0.911 10.250 939 1HG GLU 114 1HG GLU 114 -11.792 1.932 7.622 940 2HG GLU 114 2HG GLU 114 -12.083 0.359 8.358 941 H GLN 115 H GLN 115 -8.333 4.141 9.067 942 HA GLN 115 HA GLN 115 -6.164 4.386 9.699 943 1HB GLN 115 1HB GLN 115 -7.380 3.969 12.432 944 2HB GLN 115 2HB GLN 115 -5.679 4.336 12.187 945 1HG GLN 115 1HG GLN 115 -7.947 6.085 11.264 946 2HG GLN 115 2HG GLN 115 -7.067 6.299 12.776 947 1HE2 GLN 115 1HE2 GLN 115 -6.971 6.623 9.328 948 2HE2 GLN 115 2HE2 GLN 115 -5.489 7.519 9.252 949 H LYS 116 H LYS 116 -6.970 1.881 8.751 950 HA LYS 116 HA LYS 116 -5.115 0.100 10.162 951 1HB LYS 116 1HB LYS 116 -7.949 -0.608 9.373 952 2HB LYS 116 2HB LYS 116 -6.747 -1.770 9.911 953 1HG LYS 116 1HG LYS 116 -6.677 -0.823 12.087 954 2HG LYS 116 2HG LYS 116 -7.630 0.570 11.578 955 1HD LYS 116 1HD LYS 116 -8.979 -1.013 12.858 956 2HD LYS 116 2HD LYS 116 -9.561 -0.876 11.198 957 1HE LYS 116 1HE LYS 116 -8.411 -2.943 10.614 958 2HE LYS 116 2HE LYS 116 -7.786 -3.072 12.258 959 1HZ LYS 116 1HZ LYS 116 -9.754 -4.468 11.851 960 2HZ LYS 116 2HZ LYS 116 -10.672 -3.076 11.549 961 3HZ LYS 116 3HZ LYS 116 -10.006 -3.334 13.088 962 H ARG 117 H ARG 117 -3.868 -1.121 8.854 963 HA ARG 117 HA ARG 117 -4.471 -1.110 5.971 964 1HB ARG 117 1HB ARG 117 -1.861 -1.705 7.393 965 2HB ARG 117 2HB ARG 117 -2.100 -1.741 5.652 966 1HG ARG 117 1HG ARG 117 -2.776 0.689 5.832 967 2HG ARG 117 2HG ARG 117 -2.157 0.633 7.482 968 1HD ARG 117 1HD ARG 117 -0.579 -0.018 4.996 969 2HD ARG 117 2HD ARG 117 -0.506 1.507 5.872 970 HE ARG 117 HE ARG 117 0.265 -1.046 7.139 971 1HH1 ARG 117 1HH1 ARG 117 0.960 2.288 6.306 972 2HH1 ARG 117 2HH1 ARG 117 2.483 2.311 7.141 973 1HH2 ARG 117 1HH2 ARG 117 2.265 -1.020 8.238 974 2HH2 ARG 117 2HH2 ARG 117 3.229 0.432 8.221 975 H TYR 118 H TYR 118 -5.091 -2.929 5.032 976 HA TYR 118 HA TYR 118 -4.910 -5.435 6.567 977 1HB TYR 118 1HB TYR 118 -6.777 -4.789 4.277 978 2HB TYR 118 2HB TYR 118 -6.842 -6.196 5.330 979 HD1 TYR 118 HD1 TYR 118 -7.625 -2.652 4.991 980 HD2 TYR 118 HD2 TYR 118 -7.702 -5.999 7.612 981 HE1 TYR 118 HE1 TYR 118 -9.185 -1.455 6.461 982 HE2 TYR 118 HE2 TYR 118 -9.265 -4.808 9.091 983 HH TYR 118 HH TYR 118 -10.894 -1.987 8.133 984 H TYR 119 H TYR 119 -3.632 -6.990 5.805 985 HA TYR 119 HA TYR 119 -2.569 -6.698 3.082 986 1HB TYR 119 1HB TYR 119 -1.468 -8.241 5.442 987 2HB TYR 119 2HB TYR 119 -0.708 -8.125 3.855 988 HD1 TYR 119 HD1 TYR 119 -1.433 -6.361 6.980 989 HD2 TYR 119 HD2 TYR 119 0.352 -6.057 3.134 990 HE1 TYR 119 HE1 TYR 119 -0.291 -4.299 7.679 991 HE2 TYR 119 HE2 TYR 119 1.501 -3.995 3.824 992 HH TYR 119 HH TYR 119 1.535 -2.922 7.131 993 H TYR 120 H TYR 120 -3.648 -7.872 1.654 994 HA TYR 120 HA TYR 120 -4.745 -10.470 2.482 995 1HB TYR 120 1HB TYR 120 -5.393 -8.693 0.126 996 2HB TYR 120 2HB TYR 120 -6.054 -10.308 0.340 997 HD1 TYR 120 HD1 TYR 120 -5.984 -6.894 1.773 998 HD2 TYR 120 HD2 TYR 120 -7.905 -10.690 1.756 999 HE1 TYR 120 HE1 TYR 120 -7.844 -5.953 3.073 1000 HE2 TYR 120 HE2 TYR 120 -9.767 -9.759 3.064 1001 HH TYR 120 HH TYR 120 -10.325 -7.944 4.459 1002 H THR 121 H THR 121 -4.137 -12.331 1.549 1003 HA THR 121 HA THR 121 -1.846 -12.371 -0.204 1004 HB THR 121 HB THR 121 -1.985 -14.080 1.500 1005 HG1 THR 121 HG1 THR 121 -2.486 -15.933 -0.356 1006 1HG2 THR 121 1HG2 THR 121 -3.764 -15.764 1.533 1007 2HG2 THR 121 2HG2 THR 121 -4.588 -14.915 0.227 1008 3HG2 THR 121 3HG2 THR 121 -4.397 -14.139 1.798 1009 H PHE 122 H PHE 122 -2.045 -14.006 -2.142 1010 HA PHE 122 HA PHE 122 -3.804 -12.875 -4.042 1011 1HB PHE 122 1HB PHE 122 -1.636 -13.926 -4.612 1012 2HB PHE 122 2HB PHE 122 -2.297 -15.499 -4.184 1013 HD1 PHE 122 HD1 PHE 122 -3.288 -16.802 -5.809 1014 HD2 PHE 122 HD2 PHE 122 -2.888 -12.618 -6.464 1015 HE1 PHE 122 HE1 PHE 122 -4.106 -17.088 -8.111 1016 HE2 PHE 122 HE2 PHE 122 -3.710 -12.895 -8.766 1017 HZ PHE 122 HZ PHE 122 -4.319 -15.132 -9.592 1018 H ASP 123 H ASP 123 -4.213 -15.338 -1.727 1019 HA ASP 123 HA ASP 123 -6.369 -16.770 -2.923 1020 1HB ASP 123 1HB ASP 123 -5.797 -16.414 0.026 1021 2HB ASP 123 2HB ASP 123 -6.729 -17.705 -0.721 1022 H ASN 124 H ASN 124 -6.140 -13.629 -1.846 1023 HA ASN 124 HA ASN 124 -7.591 -11.974 -1.330 1024 1HB ASN 124 1HB ASN 124 -9.511 -14.007 -2.398 1025 2HB ASN 124 2HB ASN 124 -10.134 -12.575 -1.587 1026 1HD2 ASN 124 1HD2 ASN 124 -8.448 -13.791 -4.371 1027 2HD2 ASN 124 2HD2 ASN 124 -8.540 -12.337 -5.305 1028 H SER 125 H SER 125 -6.683 -14.033 0.554 1029 HA SER 125 HA SER 125 -8.764 -13.822 2.609 1030 1HB SER 125 1HB SER 125 -7.845 -16.093 2.112 1031 2HB SER 125 2HB SER 125 -6.252 -15.522 2.602 1032 HG SER 125 HG SER 125 -8.539 -16.021 4.155 1033 H LEU 126 H LEU 126 -8.383 -12.713 4.489 1034 HA LEU 126 HA LEU 126 -6.325 -10.730 4.448 1035 1HB LEU 126 1HB LEU 126 -8.528 -10.276 5.396 1036 2HB LEU 126 2HB LEU 126 -8.282 -11.514 6.610 1037 HG LEU 126 HG LEU 126 -6.461 -10.194 7.595 1038 1HD1 LEU 126 1HD1 LEU 126 -6.078 -7.896 6.865 1039 2HD1 LEU 126 2HD1 LEU 126 -7.218 -8.124 5.537 1040 3HD1 LEU 126 3HD1 LEU 126 -5.713 -9.044 5.575 1041 1HD2 LEU 126 1HD2 LEU 126 -9.023 -8.649 7.232 1042 2HD2 LEU 126 2HD2 LEU 126 -7.847 -8.425 8.528 1043 3HD2 LEU 126 3HD2 LEU 126 -8.749 -9.936 8.408 1044 H LEU 127 H LEU 127 -4.286 -11.137 4.920 1045 HA LEU 127 HA LEU 127 -3.580 -13.382 6.614 1046 1HB LEU 127 1HB LEU 127 -1.875 -11.383 5.125 1047 2HB LEU 127 2HB LEU 127 -1.236 -12.715 6.067 1048 HG LEU 127 HG LEU 127 -2.943 -12.958 3.587 1049 1HD1 LEU 127 1HD1 LEU 127 -0.686 -12.202 3.106 1050 2HD1 LEU 127 2HD1 LEU 127 -0.891 -13.878 2.595 1051 3HD1 LEU 127 3HD1 LEU 127 -0.018 -13.509 4.084 1052 1HD2 LEU 127 1HD2 LEU 127 -2.496 -15.353 3.757 1053 2HD2 LEU 127 2HD2 LEU 127 -3.367 -14.775 5.177 1054 3HD2 LEU 127 3HD2 LEU 127 -1.636 -15.096 5.275 1055 H PHE 128 H PHE 128 -2.688 -9.932 6.551 1056 HA PHE 128 HA PHE 128 -2.379 -10.077 9.477 1057 1HB PHE 128 1HB PHE 128 -0.212 -10.060 8.117 1058 2HB PHE 128 2HB PHE 128 -0.630 -8.416 7.657 1059 HD1 PHE 128 HD1 PHE 128 0.232 -10.608 10.487 1060 HD2 PHE 128 HD2 PHE 128 -0.291 -6.604 9.143 1061 HE1 PHE 128 HE1 PHE 128 1.314 -9.784 12.537 1062 HE2 PHE 128 HE2 PHE 128 0.785 -5.771 11.194 1063 HZ PHE 128 HZ PHE 128 1.591 -7.364 12.892 1064 H THR 129 H THR 129 -3.194 -8.387 10.631 1065 HA THR 129 HA THR 129 -4.357 -6.164 9.081 1066 HB THR 129 HB THR 129 -5.343 -7.212 11.741 1067 HG1 THR 129 HG1 THR 129 -5.807 -8.034 9.138 1068 1HG2 THR 129 1HG2 THR 129 -5.895 -4.869 11.303 1069 2HG2 THR 129 2HG2 THR 129 -7.339 -5.877 11.213 1070 3HG2 THR 129 3HG2 THR 129 -6.565 -5.312 9.733 1071 H GLU 130 H GLU 130 -3.016 -4.485 9.293 1072 HA GLU 130 HA GLU 130 -1.768 -4.041 11.924 1073 1HB GLU 130 1HB GLU 130 -0.111 -4.535 10.245 1074 2HB GLU 130 2HB GLU 130 -0.792 -3.332 9.157 1075 1HG GLU 130 1HG GLU 130 -0.193 -1.579 10.789 1076 2HG GLU 130 2HG GLU 130 0.577 -2.815 11.783 1077 H SER 131 H SER 131 -2.820 -2.486 12.985 1078 HA SER 131 HA SER 131 -4.180 -0.344 11.661 1079 1HB SER 131 1HB SER 131 -3.378 -0.550 14.574 1080 2HB SER 131 2HB SER 131 -4.643 0.476 13.894 1081 HG SER 131 HG SER 131 -4.837 -2.035 14.754 1082 H ILE 132 H ILE 132 -3.493 1.748 11.304 1083 HA ILE 132 HA ILE 132 -0.615 2.165 11.517 1084 HB ILE 132 HB ILE 132 -1.014 4.238 10.196 1085 1HG1 ILE 132 1HG1 ILE 132 -3.852 3.193 10.032 1086 2HG1 ILE 132 2HG1 ILE 132 -3.353 4.633 10.909 1087 1HG2 ILE 132 1HG2 ILE 132 -0.389 2.166 9.116 1088 2HG2 ILE 132 2HG2 ILE 132 -1.505 3.075 8.097 1089 3HG2 ILE 132 3HG2 ILE 132 -2.081 1.680 9.012 1090 1HD1 ILE 132 1HD1 ILE 132 -2.668 5.674 8.818 1091 2HD1 ILE 132 2HD1 ILE 132 -4.363 5.191 8.773 1092 3HD1 ILE 132 3HD1 ILE 132 -3.150 4.225 7.935 1093 H GLN 133 H GLN 133 -3.034 2.529 13.579 1094 HA GLN 133 HA GLN 133 -2.387 5.115 14.663 1095 1HB GLN 133 1HB GLN 133 -4.554 3.529 14.925 1096 2HB GLN 133 2HB GLN 133 -3.676 3.042 16.363 1097 1HG GLN 133 1HG GLN 133 -4.679 5.788 15.663 1098 2HG GLN 133 2HG GLN 133 -5.206 4.746 16.980 1099 1HE2 GLN 133 1HE2 GLN 133 -2.832 6.985 15.867 1100 2HE2 GLN 133 2HE2 GLN 133 -1.997 7.171 17.372 Start of MODEL 13 1 H ASP 7 H ASP 7 -5.269 14.964 -15.601 2 HA ASP 7 HA ASP 7 -7.753 13.586 -15.011 3 1HB ASP 7 1HB ASP 7 -6.313 12.859 -16.923 4 2HB ASP 7 2HB ASP 7 -5.068 12.398 -15.764 5 H GLN 8 H GLN 8 -8.173 12.508 -13.165 6 HA GLN 8 HA GLN 8 -6.791 13.404 -10.884 7 1HB GLN 8 1HB GLN 8 -9.248 12.835 -11.083 8 2HB GLN 8 2HB GLN 8 -8.783 11.144 -10.964 9 1HG GLN 8 1HG GLN 8 -7.970 11.431 -8.758 10 2HG GLN 8 2HG GLN 8 -8.076 13.187 -8.875 11 1HE2 GLN 8 1HE2 GLN 8 -10.541 11.052 -10.104 12 2HE2 GLN 8 2HE2 GLN 8 -11.757 11.465 -8.949 13 H VAL 9 H VAL 9 -6.392 10.550 -12.815 14 HA VAL 9 HA VAL 9 -5.173 8.879 -10.891 15 HB VAL 9 HB VAL 9 -4.788 8.988 -13.890 16 1HG1 VAL 9 1HG1 VAL 9 -3.959 6.842 -11.937 17 2HG1 VAL 9 2HG1 VAL 9 -2.881 7.887 -12.864 18 3HG1 VAL 9 3HG1 VAL 9 -3.896 6.707 -13.695 19 1HG2 VAL 9 1HG2 VAL 9 -6.306 7.060 -13.905 20 2HG2 VAL 9 2HG2 VAL 9 -7.072 8.491 -13.220 21 3HG2 VAL 9 3HG2 VAL 9 -6.499 7.205 -12.159 22 H VAL 10 H VAL 10 -3.951 11.452 -12.946 23 HA VAL 10 HA VAL 10 -1.197 11.022 -12.577 24 HB VAL 10 HB VAL 10 -2.637 13.639 -13.057 25 1HG1 VAL 10 1HG1 VAL 10 0.261 12.918 -13.494 26 2HG1 VAL 10 2HG1 VAL 10 -0.364 13.984 -12.234 27 3HG1 VAL 10 3HG1 VAL 10 -0.505 14.447 -13.929 28 1HG2 VAL 10 1HG2 VAL 10 -2.059 13.267 -15.415 29 2HG2 VAL 10 2HG2 VAL 10 -3.127 12.010 -14.787 30 3HG2 VAL 10 3HG2 VAL 10 -1.406 11.684 -14.992 31 H ILE 11 H ILE 11 -3.555 12.868 -10.703 32 HA ILE 11 HA ILE 11 -1.733 14.154 -8.988 33 HB ILE 11 HB ILE 11 -4.649 13.461 -8.624 34 1HG1 ILE 11 1HG1 ILE 11 -4.833 15.998 -8.720 35 2HG1 ILE 11 2HG1 ILE 11 -3.148 16.015 -9.229 36 1HG2 ILE 11 1HG2 ILE 11 -2.884 15.028 -6.748 37 2HG2 ILE 11 2HG2 ILE 11 -3.677 13.486 -6.415 38 3HG2 ILE 11 3HG2 ILE 11 -4.643 14.943 -6.654 39 1HD1 ILE 11 1HD1 ILE 11 -3.730 14.708 -11.199 40 2HD1 ILE 11 2HD1 ILE 11 -4.654 16.208 -11.119 41 3HD1 ILE 11 3HD1 ILE 11 -5.416 14.678 -10.685 42 H PHE 12 H PHE 12 -3.690 11.219 -8.447 43 HA PHE 12 HA PHE 12 -2.557 10.686 -5.912 44 1HB PHE 12 1HB PHE 12 -4.110 8.973 -7.840 45 2HB PHE 12 2HB PHE 12 -3.533 8.359 -6.294 46 HD1 PHE 12 HD1 PHE 12 -4.316 9.444 -4.189 47 HD2 PHE 12 HD2 PHE 12 -6.055 10.295 -7.979 48 HE1 PHE 12 HE1 PHE 12 -6.302 10.361 -3.068 49 HE2 PHE 12 HE2 PHE 12 -8.041 11.220 -6.863 50 HZ PHE 12 HZ PHE 12 -8.166 11.255 -4.407 51 H LYS 13 H LYS 13 -1.767 9.525 -9.163 52 HA LYS 13 HA LYS 13 0.119 7.584 -8.386 53 1HB LYS 13 1HB LYS 13 -0.884 7.904 -10.694 54 2HB LYS 13 2HB LYS 13 0.261 9.223 -10.920 55 1HG LYS 13 1HG LYS 13 2.096 7.568 -10.445 56 2HG LYS 13 2HG LYS 13 0.866 6.303 -10.519 57 1HD LYS 13 1HD LYS 13 1.735 6.345 -12.682 58 2HD LYS 13 2HD LYS 13 0.268 7.318 -12.811 59 1HE LYS 13 1HE LYS 13 1.882 8.570 -13.946 60 2HE LYS 13 2HE LYS 13 1.790 9.329 -12.357 61 1HZ LYS 13 1HZ LYS 13 3.735 7.861 -11.747 62 2HZ LYS 13 2HZ LYS 13 4.066 9.108 -12.840 63 3HZ LYS 13 3HZ LYS 13 3.890 7.518 -13.399 64 H GLN 14 H GLN 14 0.355 11.034 -8.901 65 HA GLN 14 HA GLN 14 3.157 11.291 -8.858 66 1HB GLN 14 1HB GLN 14 1.596 13.035 -9.643 67 2HB GLN 14 2HB GLN 14 1.034 13.263 -7.996 68 1HG GLN 14 1HG GLN 14 3.237 14.043 -7.330 69 2HG GLN 14 2HG GLN 14 3.835 13.773 -8.969 70 1HE2 GLN 14 1HE2 GLN 14 1.341 14.678 -10.189 71 2HE2 GLN 14 2HE2 GLN 14 1.326 16.403 -10.042 72 H ILE 15 H ILE 15 0.733 11.247 -6.299 73 HA ILE 15 HA ILE 15 2.372 11.992 -4.143 74 HB ILE 15 HB ILE 15 0.030 10.074 -4.088 75 1HG1 ILE 15 1HG1 ILE 15 0.064 13.075 -3.688 76 2HG1 ILE 15 2HG1 ILE 15 -0.495 12.264 -5.147 77 1HG2 ILE 15 1HG2 ILE 15 -0.200 10.774 -1.749 78 2HG2 ILE 15 2HG2 ILE 15 1.248 11.768 -1.907 79 3HG2 ILE 15 3HG2 ILE 15 1.364 10.014 -2.047 80 1HD1 ILE 15 1HD1 ILE 15 -2.273 11.193 -3.881 81 2HD1 ILE 15 2HD1 ILE 15 -2.348 12.948 -3.731 82 3HD1 ILE 15 3HD1 ILE 15 -1.703 11.975 -2.408 83 H PHE 16 H PHE 16 1.494 8.760 -5.346 84 HA PHE 16 HA PHE 16 3.231 7.378 -3.576 85 1HB PHE 16 1HB PHE 16 1.837 6.531 -6.114 86 2HB PHE 16 2HB PHE 16 2.827 5.437 -5.153 87 HD1 PHE 16 HD1 PHE 16 2.085 4.639 -3.007 88 HD2 PHE 16 HD2 PHE 16 -0.313 7.319 -5.284 89 HE1 PHE 16 HE1 PHE 16 0.156 4.128 -1.569 90 HE2 PHE 16 HE2 PHE 16 -2.246 6.813 -3.848 91 HZ PHE 16 HZ PHE 16 -2.012 5.215 -1.986 92 H ASP 17 H ASP 17 3.563 8.711 -6.770 93 HA ASP 17 HA ASP 17 5.829 7.410 -7.713 94 1HB ASP 17 1HB ASP 17 4.428 8.901 -9.076 95 2HB ASP 17 2HB ASP 17 4.988 10.286 -8.150 96 H LYS 18 H LYS 18 5.568 10.202 -5.561 97 HA LYS 18 HA LYS 18 8.464 10.473 -5.534 98 1HB LYS 18 1HB LYS 18 6.342 12.115 -4.149 99 2HB LYS 18 2HB LYS 18 8.063 12.476 -4.151 100 1HG LYS 18 1HG LYS 18 6.189 12.484 -6.503 101 2HG LYS 18 2HG LYS 18 7.030 13.860 -5.786 102 1HD LYS 18 1HD LYS 18 9.167 12.967 -6.491 103 2HD LYS 18 2HD LYS 18 8.388 11.512 -7.109 104 1HE LYS 18 1HE LYS 18 7.111 12.963 -8.690 105 2HE LYS 18 2HE LYS 18 8.091 14.324 -8.148 106 1HZ LYS 18 1HZ LYS 18 10.076 13.011 -8.840 107 2HZ LYS 18 2HZ LYS 18 9.066 13.475 -10.118 108 3HZ LYS 18 3HZ LYS 18 9.025 11.882 -9.544 109 H VAL 19 H VAL 19 5.870 9.506 -3.331 110 HA VAL 19 HA VAL 19 7.437 9.532 -0.995 111 HB VAL 19 HB VAL 19 4.920 9.450 -1.068 112 1HG1 VAL 19 1HG1 VAL 19 5.351 6.488 -1.399 113 2HG1 VAL 19 2HG1 VAL 19 4.739 7.569 -2.649 114 3HG1 VAL 19 3HG1 VAL 19 3.808 7.316 -1.172 115 1HG2 VAL 19 1HG2 VAL 19 6.123 9.209 1.020 116 2HG2 VAL 19 2HG2 VAL 19 6.348 7.485 0.721 117 3HG2 VAL 19 3HG2 VAL 19 4.731 8.125 1.003 118 H ARG 20 H ARG 20 7.112 7.110 -3.523 119 HA ARG 20 HA ARG 20 8.233 4.985 -1.999 120 1HB ARG 20 1HB ARG 20 8.637 3.894 -4.237 121 2HB ARG 20 2HB ARG 20 6.974 4.322 -3.887 122 1HG ARG 20 1HG ARG 20 7.360 4.841 -6.153 123 2HG ARG 20 2HG ARG 20 7.299 6.374 -5.288 124 1HD ARG 20 1HD ARG 20 9.084 6.365 -6.944 125 2HD ARG 20 2HD ARG 20 9.740 6.488 -5.313 126 HE ARG 20 HE ARG 20 10.350 4.131 -5.489 127 1HH1 ARG 20 1HH1 ARG 20 9.584 5.821 -8.460 128 2HH1 ARG 20 2HH1 ARG 20 10.515 4.752 -9.454 129 1HH2 ARG 20 1HH2 ARG 20 11.587 2.733 -6.795 130 2HH2 ARG 20 2HH2 ARG 20 11.647 2.981 -8.518 131 H ASN 21 H ASN 21 9.598 7.767 -3.215 132 HA ASN 21 HA ASN 21 12.274 6.537 -3.345 133 1HB ASN 21 1HB ASN 21 11.525 7.578 -5.465 134 2HB ASN 21 2HB ASN 21 11.313 9.109 -4.621 135 1HD2 ASN 21 1HD2 ASN 21 13.077 10.342 -4.112 136 2HD2 ASN 21 2HD2 ASN 21 14.675 9.985 -4.693 137 H ASP 22 H ASP 22 10.587 9.542 -2.470 138 HA ASP 22 HA ASP 22 12.894 10.409 -0.951 139 1HB ASP 22 1HB ASP 22 10.317 11.733 -1.757 140 2HB ASP 22 2HB ASP 22 11.429 12.486 -0.612 141 H LEU 23 H LEU 23 9.950 8.828 -0.350 142 HA LEU 23 HA LEU 23 8.961 8.040 1.531 143 1HB LEU 23 1HB LEU 23 11.633 8.755 2.730 144 2HB LEU 23 2HB LEU 23 10.387 7.866 3.583 145 HG LEU 23 HG LEU 23 11.786 6.951 1.068 146 1HD1 LEU 23 1HD1 LEU 23 12.791 5.260 2.517 147 2HD1 LEU 23 2HD1 LEU 23 12.019 6.001 3.917 148 3HD1 LEU 23 3HD1 LEU 23 13.245 6.890 3.016 149 1HD2 LEU 23 1HD2 LEU 23 9.496 6.147 1.160 150 2HD2 LEU 23 2HD2 LEU 23 9.747 5.572 2.808 151 3HD2 LEU 23 3HD2 LEU 23 10.624 4.830 1.474 152 H ASN 24 H ASN 24 8.552 10.818 0.848 153 HA ASN 24 HA ASN 24 8.436 12.260 3.333 154 1HB ASN 24 1HB ASN 24 7.148 13.957 1.972 155 2HB ASN 24 2HB ASN 24 8.779 13.619 1.416 156 1HD2 ASN 24 1HD2 ASN 24 5.404 13.406 0.696 157 2HD2 ASN 24 2HD2 ASN 24 5.576 12.889 -0.942 158 H TYR 25 H TYR 25 7.215 10.996 4.694 159 HA TYR 25 HA TYR 25 4.607 10.066 3.907 160 1HB TYR 25 1HB TYR 25 6.114 9.923 6.514 161 2HB TYR 25 2HB TYR 25 4.492 9.274 6.304 162 HD1 TYR 25 HD1 TYR 25 4.162 7.517 4.452 163 HD2 TYR 25 HD2 TYR 25 7.982 8.620 5.972 164 HE1 TYR 25 HE1 TYR 25 5.107 5.416 3.586 165 HE2 TYR 25 HE2 TYR 25 8.936 6.525 5.109 166 HH TYR 25 HH TYR 25 8.217 4.306 4.465 167 H GLN 26 H GLN 26 5.886 12.836 5.531 168 HA GLN 26 HA GLN 26 3.665 13.634 7.035 169 1HB GLN 26 1HB GLN 26 5.805 14.739 7.284 170 2HB GLN 26 2HB GLN 26 5.765 15.286 5.616 171 1HG GLN 26 1HG GLN 26 5.257 17.111 7.096 172 2HG GLN 26 2HG GLN 26 3.837 16.706 6.138 173 1HE2 GLN 26 1HE2 GLN 26 4.908 14.824 8.886 174 2HE2 GLN 26 2HE2 GLN 26 3.588 15.233 9.924 175 H TRP 27 H TRP 27 4.550 14.527 3.698 176 HA TRP 27 HA TRP 27 2.048 15.819 3.196 177 1HB TRP 27 1HB TRP 27 4.149 16.386 2.009 178 2HB TRP 27 2HB TRP 27 4.121 14.805 1.238 179 HD1 TRP 27 HD1 TRP 27 1.787 17.908 1.451 180 HE1 TRP 27 HE1 TRP 27 0.676 18.212 -0.848 181 HE3 TRP 27 HE3 TRP 27 3.757 13.841 -0.947 182 HZ2 TRP 27 HZ2 TRP 27 0.645 16.904 -3.355 183 HZ3 TRP 27 HZ3 TRP 27 3.137 13.443 -3.295 184 HH2 TRP 27 HH2 TRP 27 1.613 14.944 -4.471 185 H PHE 28 H PHE 28 3.301 12.598 2.818 186 HA PHE 28 HA PHE 28 1.466 11.543 0.992 187 1HB PHE 28 1HB PHE 28 3.549 10.414 1.641 188 2HB PHE 28 2HB PHE 28 2.910 10.151 3.258 189 HD1 PHE 28 HD1 PHE 28 2.148 8.049 3.713 190 HD2 PHE 28 HD2 PHE 28 1.872 9.517 -0.273 191 HE1 PHE 28 HE1 PHE 28 1.227 5.887 2.986 192 HE2 PHE 28 HE2 PHE 28 0.945 7.360 -1.006 193 HZ PHE 28 HZ PHE 28 0.625 5.540 0.621 194 H TYR 29 H TYR 29 1.408 11.292 4.566 195 HA TYR 29 HA TYR 29 -1.119 10.018 4.617 196 1HB TYR 29 1HB TYR 29 0.525 11.389 6.727 197 2HB TYR 29 2HB TYR 29 -1.069 10.737 7.084 198 HD1 TYR 29 HD1 TYR 29 -1.468 8.260 6.696 199 HD2 TYR 29 HD2 TYR 29 2.420 9.988 6.694 200 HE1 TYR 29 HE1 TYR 29 -0.486 6.038 7.084 201 HE2 TYR 29 HE2 TYR 29 3.410 7.771 7.077 202 HH TYR 29 HH TYR 29 2.740 5.594 8.015 203 H SER 30 H SER 30 -0.166 13.382 4.666 204 HA SER 30 HA SER 30 -2.597 14.459 5.586 205 1HB SER 30 1HB SER 30 -0.505 15.683 3.774 206 2HB SER 30 2HB SER 30 -1.800 16.574 4.573 207 HG SER 30 HG SER 30 0.515 15.425 5.645 208 H GLU 31 H GLU 31 -1.402 13.865 2.274 209 HA GLU 31 HA GLU 31 -3.784 14.778 1.018 210 1HB GLU 31 1HB GLU 31 -1.521 13.026 0.063 211 2HB GLU 31 2HB GLU 31 -2.887 13.449 -0.961 212 1HG GLU 31 1HG GLU 31 -0.966 15.387 0.311 213 2HG GLU 31 2HG GLU 31 -0.987 14.902 -1.384 214 H LEU 32 H LEU 32 -2.742 11.660 2.263 215 HA LEU 32 HA LEU 32 -4.774 10.076 1.158 216 1HB LEU 32 1HB LEU 32 -3.372 9.831 3.816 217 2HB LEU 32 2HB LEU 32 -4.439 8.608 3.155 218 HG LEU 32 HG LEU 32 -1.813 9.510 1.975 219 1HD1 LEU 32 1HD1 LEU 32 -1.091 7.231 2.509 220 2HD1 LEU 32 2HD1 LEU 32 -2.648 6.928 3.283 221 3HD1 LEU 32 3HD1 LEU 32 -1.550 8.134 3.953 222 1HD2 LEU 32 1HD2 LEU 32 -3.763 7.422 1.010 223 2HD2 LEU 32 2HD2 LEU 32 -2.151 7.700 0.355 224 3HD2 LEU 32 3HD2 LEU 32 -3.387 8.947 0.211 225 H LYS 33 H LYS 33 -4.673 11.847 4.232 226 HA LYS 33 HA LYS 33 -7.343 11.134 4.954 227 1HB LYS 33 1HB LYS 33 -5.440 13.231 5.999 228 2HB LYS 33 2HB LYS 33 -7.029 12.942 6.692 229 1HG LYS 33 1HG LYS 33 -6.427 10.752 7.382 230 2HG LYS 33 2HG LYS 33 -4.933 10.798 6.446 231 1HD LYS 33 1HD LYS 33 -4.548 11.132 8.859 232 2HD LYS 33 2HD LYS 33 -4.038 12.519 7.897 233 1HE LYS 33 1HE LYS 33 -5.182 13.296 9.868 234 2HE LYS 33 2HE LYS 33 -6.169 13.639 8.449 235 1HZ LYS 33 1HZ LYS 33 -7.550 11.737 8.965 236 2HZ LYS 33 2HZ LYS 33 -7.472 12.769 10.307 237 3HZ LYS 33 3HZ LYS 33 -6.567 11.337 10.290 238 H ARG 34 H ARG 34 -6.121 13.359 2.745 239 HA ARG 34 HA ARG 34 -8.406 15.166 3.037 240 1HB ARG 34 1HB ARG 34 -6.235 16.234 2.944 241 2HB ARG 34 2HB ARG 34 -5.853 15.413 1.442 242 1HG ARG 34 1HG ARG 34 -7.098 16.829 0.186 243 2HG ARG 34 2HG ARG 34 -8.268 17.113 1.470 244 1HD ARG 34 1HD ARG 34 -6.893 19.104 0.939 245 2HD ARG 34 2HD ARG 34 -6.753 18.580 2.614 246 HE ARG 34 HE ARG 34 -4.712 17.556 0.826 247 1HH1 ARG 34 1HH1 ARG 34 -5.623 20.167 2.981 248 2HH1 ARG 34 2HH1 ARG 34 -3.979 20.583 3.364 249 1HH2 ARG 34 1HH2 ARG 34 -2.582 18.102 1.308 250 2HH2 ARG 34 2HH2 ARG 34 -2.247 19.407 2.415 251 H HIS 35 H HIS 35 -7.358 12.532 1.136 252 HA HIS 35 HA HIS 35 -9.423 13.179 -0.868 253 1HB HIS 35 1HB HIS 35 -6.775 11.827 -1.436 254 2HB HIS 35 2HB HIS 35 -8.053 12.117 -2.609 255 HD1 HIS 35 HD1 HIS 35 -8.693 14.901 -2.657 256 HD2 HIS 35 HD2 HIS 35 -4.850 13.705 -1.609 257 HE1 HIS 35 HE1 HIS 35 -7.229 16.916 -3.024 258 HE2 HIS 35 HE2 HIS 35 -4.900 16.162 -2.407 259 H ASN 36 H ASN 36 -7.537 10.589 0.641 260 HA ASN 36 HA ASN 36 -9.387 8.569 -0.306 261 1HB ASN 36 1HB ASN 36 -6.988 8.314 1.527 262 2HB ASN 36 2HB ASN 36 -7.911 6.972 0.865 263 1HD2 ASN 36 1HD2 ASN 36 -6.133 6.105 -0.156 264 2HD2 ASN 36 2HD2 ASN 36 -5.421 6.821 -1.556 265 H VAL 37 H VAL 37 -11.251 9.403 0.761 266 HA VAL 37 HA VAL 37 -11.338 9.770 3.579 267 HB VAL 37 HB VAL 37 -13.631 9.415 1.639 268 1HG1 VAL 37 1HG1 VAL 37 -14.970 10.580 3.322 269 2HG1 VAL 37 2HG1 VAL 37 -13.576 10.628 4.402 270 3HG1 VAL 37 3HG1 VAL 37 -14.302 9.081 3.968 271 1HG2 VAL 37 1HG2 VAL 37 -12.228 11.261 0.965 272 2HG2 VAL 37 2HG2 VAL 37 -12.221 11.899 2.608 273 3HG2 VAL 37 3HG2 VAL 37 -13.717 11.890 1.674 274 H SER 38 H SER 38 -12.038 7.071 1.432 275 HA SER 38 HA SER 38 -12.874 5.532 3.787 276 1HB SER 38 1HB SER 38 -13.685 3.830 2.146 277 2HB SER 38 2HB SER 38 -14.486 5.394 2.018 278 HG SER 38 HG SER 38 -13.128 5.865 0.242 279 H HIS 39 H HIS 39 -11.243 4.380 0.821 280 HA HIS 39 HA HIS 39 -8.910 3.516 2.255 281 1HB HIS 39 1HB HIS 39 -9.328 1.091 2.081 282 2HB HIS 39 2HB HIS 39 -10.503 1.874 3.130 283 HD1 HIS 39 HD1 HIS 39 -12.958 2.014 2.261 284 HD2 HIS 39 HD2 HIS 39 -10.384 -0.091 -0.222 285 HE1 HIS 39 HE1 HIS 39 -14.438 0.813 0.627 286 HE2 HIS 39 HE2 HIS 39 -12.856 -0.384 -0.934 287 H TYR 40 H TYR 40 -7.366 2.427 0.894 288 HA TYR 40 HA TYR 40 -8.115 2.333 -1.947 289 1HB TYR 40 1HB TYR 40 -5.987 3.212 -2.634 290 2HB TYR 40 2HB TYR 40 -6.684 4.331 -1.473 291 HD1 TYR 40 HD1 TYR 40 -3.963 2.010 -2.158 292 HD2 TYR 40 HD2 TYR 40 -5.695 4.569 0.766 293 HE1 TYR 40 HE1 TYR 40 -1.878 1.932 -0.864 294 HE2 TYR 40 HE2 TYR 40 -3.611 4.494 2.069 295 HH TYR 40 HH TYR 40 -1.655 2.926 2.316 296 H ILE 41 H ILE 41 -7.335 0.630 -3.117 297 HA ILE 41 HA ILE 41 -6.093 -1.503 -1.511 298 HB ILE 41 HB ILE 41 -7.668 -1.836 -4.071 299 1HG1 ILE 41 1HG1 ILE 41 -9.288 -3.002 -2.366 300 2HG1 ILE 41 2HG1 ILE 41 -8.511 -1.946 -1.194 301 1HG2 ILE 41 1HG2 ILE 41 -7.674 -4.216 -3.453 302 2HG2 ILE 41 2HG2 ILE 41 -6.641 -3.845 -2.073 303 3HG2 ILE 41 3HG2 ILE 41 -6.045 -3.591 -3.714 304 1HD1 ILE 41 1HD1 ILE 41 -10.577 -0.985 -2.031 305 2HD1 ILE 41 2HD1 ILE 41 -9.958 -1.057 -3.681 306 3HD1 ILE 41 3HD1 ILE 41 -9.191 0.001 -2.495 307 H TYR 42 H TYR 42 -3.996 -1.596 -1.856 308 HA TYR 42 HA TYR 42 -2.864 -0.840 -4.431 309 1HB TYR 42 1HB TYR 42 -1.953 -0.174 -2.095 310 2HB TYR 42 2HB TYR 42 -1.332 -1.818 -2.024 311 HD1 TYR 42 HD1 TYR 42 -0.058 -2.468 -4.381 312 HD2 TYR 42 HD2 TYR 42 -0.434 1.416 -2.687 313 HE1 TYR 42 HE1 TYR 42 1.936 -1.739 -5.622 314 HE2 TYR 42 HE2 TYR 42 1.557 2.151 -3.924 315 HH TYR 42 HH TYR 42 2.834 0.480 -6.490 316 H TYR 43 H TYR 43 -2.870 -2.411 -5.944 317 HA TYR 43 HA TYR 43 -2.444 -5.177 -5.141 318 1HB TYR 43 1HB TYR 43 -3.086 -3.900 -7.802 319 2HB TYR 43 2HB TYR 43 -2.711 -5.613 -7.632 320 HD1 TYR 43 HD1 TYR 43 -5.218 -3.028 -7.129 321 HD2 TYR 43 HD2 TYR 43 -4.228 -7.091 -6.369 322 HE1 TYR 43 HE1 TYR 43 -7.562 -3.487 -6.552 323 HE2 TYR 43 HE2 TYR 43 -6.571 -7.563 -5.793 324 HH TYR 43 HH TYR 43 -9.101 -5.247 -6.352 325 H LEU 44 H LEU 44 -0.483 -5.881 -4.872 326 HA LEU 44 HA LEU 44 1.802 -4.430 -5.729 327 1HB LEU 44 1HB LEU 44 1.498 -7.153 -4.477 328 2HB LEU 44 2HB LEU 44 3.051 -6.412 -4.816 329 HG LEU 44 HG LEU 44 0.963 -5.181 -3.017 330 1HD1 LEU 44 1HD1 LEU 44 1.737 -7.265 -2.055 331 2HD1 LEU 44 2HD1 LEU 44 2.398 -5.891 -1.168 332 3HD1 LEU 44 3HD1 LEU 44 3.414 -6.779 -2.305 333 1HD2 LEU 44 1HD2 LEU 44 2.520 -3.591 -4.038 334 2HD2 LEU 44 2HD2 LEU 44 3.881 -4.542 -3.440 335 3HD2 LEU 44 3HD2 LEU 44 2.794 -3.743 -2.303 336 H ALA 45 H ALA 45 3.570 -5.352 -6.975 337 HA ALA 45 HA ALA 45 4.452 -6.062 -8.921 338 1HB ALA 45 1HB ALA 45 3.852 -8.309 -8.357 339 2HB ALA 45 2HB ALA 45 3.516 -8.046 -10.067 340 3HB ALA 45 3HB ALA 45 2.193 -8.056 -8.899 341 H THR 46 H THR 46 0.922 -6.322 -9.496 342 HA THR 46 HA THR 46 1.008 -5.211 -12.073 343 HB THR 46 HB THR 46 -1.370 -4.921 -10.245 344 HG1 THR 46 HG1 THR 46 -0.274 -7.278 -11.412 345 1HG2 THR 46 1HG2 THR 46 -1.094 -5.546 -13.189 346 2HG2 THR 46 2HG2 THR 46 -1.558 -3.991 -12.500 347 3HG2 THR 46 3HG2 THR 46 -2.615 -5.389 -12.310 348 H GLU 47 H GLU 47 0.936 -3.792 -8.915 349 HA GLU 47 HA GLU 47 1.192 -1.697 -8.129 350 1HB GLU 47 1HB GLU 47 2.201 -1.199 -10.931 351 2HB GLU 47 2HB GLU 47 2.328 -0.038 -9.613 352 1HG GLU 47 1HG GLU 47 3.665 -1.652 -8.341 353 2HG GLU 47 2HG GLU 47 3.560 -2.785 -9.686 354 H ASN 48 H ASN 48 -1.313 -2.543 -9.439 355 HA ASN 48 HA ASN 48 -2.442 -0.013 -10.328 356 1HB ASN 48 1HB ASN 48 -3.493 -2.827 -10.177 357 2HB ASN 48 2HB ASN 48 -4.610 -1.477 -10.325 358 1HD2 ASN 48 1HD2 ASN 48 -1.427 -1.524 -11.798 359 2HD2 ASN 48 2HD2 ASN 48 -1.987 -1.629 -13.428 360 H VAL 49 H VAL 49 -2.586 1.342 -8.648 361 HA VAL 49 HA VAL 49 -3.513 0.386 -6.057 362 HB VAL 49 HB VAL 49 -2.879 3.249 -6.735 363 1HG1 VAL 49 1HG1 VAL 49 -2.660 1.667 -4.179 364 2HG1 VAL 49 2HG1 VAL 49 -3.939 2.812 -4.585 365 3HG1 VAL 49 3HG1 VAL 49 -2.284 3.379 -4.373 366 1HG2 VAL 49 1HG2 VAL 49 -0.888 1.135 -5.926 367 2HG2 VAL 49 2HG2 VAL 49 -0.562 2.859 -6.103 368 3HG2 VAL 49 3HG2 VAL 49 -0.998 1.896 -7.513 369 H HIS 50 H HIS 50 -5.645 0.240 -5.754 370 HA HIS 50 HA HIS 50 -7.436 1.922 -7.338 371 1HB HIS 50 1HB HIS 50 -7.937 -0.477 -5.566 372 2HB HIS 50 2HB HIS 50 -9.227 0.446 -6.324 373 HD1 HIS 50 HD1 HIS 50 -10.099 -1.228 -7.969 374 HD2 HIS 50 HD2 HIS 50 -5.962 -0.815 -8.165 375 HE1 HIS 50 HE1 HIS 50 -9.374 -2.565 -9.973 376 HE2 HIS 50 HE2 HIS 50 -6.858 -2.496 -9.921 377 H ILE 51 H ILE 51 -7.342 3.931 -6.368 378 HA ILE 51 HA ILE 51 -7.758 4.177 -3.506 379 HB ILE 51 HB ILE 51 -7.448 6.268 -5.667 380 1HG1 ILE 51 1HG1 ILE 51 -5.405 6.809 -4.164 381 2HG1 ILE 51 2HG1 ILE 51 -5.658 5.198 -3.501 382 1HG2 ILE 51 1HG2 ILE 51 -7.386 7.934 -3.864 383 2HG2 ILE 51 2HG2 ILE 51 -7.841 6.680 -2.708 384 3HG2 ILE 51 3HG2 ILE 51 -8.958 7.142 -3.996 385 1HD1 ILE 51 1HD1 ILE 51 -3.966 5.217 -5.250 386 2HD1 ILE 51 2HD1 ILE 51 -5.155 5.838 -6.393 387 3HD1 ILE 51 3HD1 ILE 51 -5.356 4.229 -5.700 388 H VAL 52 H VAL 52 -9.776 3.671 -2.875 389 HA VAL 52 HA VAL 52 -12.054 4.739 -4.329 390 HB VAL 52 HB VAL 52 -12.108 3.315 -1.660 391 1HG1 VAL 52 1HG1 VAL 52 -14.431 2.797 -2.322 392 2HG1 VAL 52 2HG1 VAL 52 -14.216 3.778 -3.774 393 3HG1 VAL 52 3HG1 VAL 52 -14.137 4.529 -2.179 394 1HG2 VAL 52 1HG2 VAL 52 -12.353 2.103 -4.412 395 2HG2 VAL 52 2HG2 VAL 52 -12.594 1.259 -2.883 396 3HG2 VAL 52 3HG2 VAL 52 -11.000 1.887 -3.303 397 H LEU 53 H LEU 53 -12.593 6.772 -4.027 398 HA LEU 53 HA LEU 53 -11.460 8.403 -2.026 399 1HB LEU 53 1HB LEU 53 -13.850 8.900 -3.800 400 2HB LEU 53 2HB LEU 53 -13.027 10.125 -2.859 401 HG LEU 53 HG LEU 53 -11.844 8.551 -5.141 402 1HD1 LEU 53 1HD1 LEU 53 -12.587 11.460 -4.924 403 2HD1 LEU 53 2HD1 LEU 53 -13.489 10.236 -5.815 404 3HD1 LEU 53 3HD1 LEU 53 -11.854 10.671 -6.321 405 1HD2 LEU 53 1HD2 LEU 53 -10.198 9.064 -3.396 406 2HD2 LEU 53 2HD2 LEU 53 -10.637 10.770 -3.497 407 3HD2 LEU 53 3HD2 LEU 53 -9.892 9.967 -4.881 408 H LYS 54 H LYS 54 -14.910 8.390 -2.494 409 HA LYS 54 HA LYS 54 -15.284 7.992 0.386 410 1HB LYS 54 1HB LYS 54 -15.832 10.262 -0.281 411 2HB LYS 54 2HB LYS 54 -16.855 9.672 -1.580 412 1HG LYS 54 1HG LYS 54 -18.469 8.850 -0.027 413 2HG LYS 54 2HG LYS 54 -17.399 9.187 1.336 414 1HD LYS 54 1HD LYS 54 -17.625 11.514 1.073 415 2HD LYS 54 2HD LYS 54 -18.306 11.348 -0.545 416 1HE LYS 54 1HE LYS 54 -19.663 10.370 1.958 417 2HE LYS 54 2HE LYS 54 -19.957 11.951 1.236 418 1HZ LYS 54 1HZ LYS 54 -21.593 10.253 0.572 419 2HZ LYS 54 2HZ LYS 54 -20.356 9.362 -0.166 420 3HZ LYS 54 3HZ LYS 54 -20.752 10.901 -0.752 421 H ASN 55 H ASN 55 -17.302 7.888 -2.548 422 HA ASN 55 HA ASN 55 -17.549 5.054 -2.545 423 1HB ASN 55 1HB ASN 55 -19.907 4.845 -1.941 424 2HB ASN 55 2HB ASN 55 -19.012 5.545 -0.598 425 1HD2 ASN 55 1HD2 ASN 55 -21.458 6.039 -2.976 426 2HD2 ASN 55 2HD2 ASN 55 -21.989 7.592 -2.415 427 H ASP 56 H ASP 56 -17.075 7.458 -4.249 428 HA ASP 56 HA ASP 56 -19.369 7.280 -6.076 429 1HB ASP 56 1HB ASP 56 -17.457 9.593 -5.716 430 2HB ASP 56 2HB ASP 56 -18.879 9.566 -6.756 431 H ASN 57 H ASN 57 -15.871 7.283 -5.844 432 HA ASN 57 HA ASN 57 -15.710 6.056 -8.448 433 1HB ASN 57 1HB ASN 57 -15.674 8.472 -8.989 434 2HB ASN 57 2HB ASN 57 -14.288 8.681 -7.926 435 1HD2 ASN 57 1HD2 ASN 57 -13.083 9.496 -9.665 436 2HD2 ASN 57 2HD2 ASN 57 -12.436 8.446 -10.885 437 H THR 58 H THR 58 -13.792 4.979 -8.821 438 HA THR 58 HA THR 58 -11.945 4.818 -6.535 439 HB THR 58 HB THR 58 -12.695 2.579 -8.432 440 HG1 THR 58 HG1 THR 58 -14.033 3.530 -6.374 441 1HG2 THR 58 1HG2 THR 58 -11.458 1.153 -6.872 442 2HG2 THR 58 2HG2 THR 58 -11.039 2.565 -5.904 443 3HG2 THR 58 3HG2 THR 58 -10.414 2.405 -7.543 444 H VAL 59 H VAL 59 -10.173 5.896 -7.150 445 HA VAL 59 HA VAL 59 -9.402 6.054 -9.937 446 HB VAL 59 HB VAL 59 -7.959 7.160 -7.518 447 1HG1 VAL 59 1HG1 VAL 59 -6.914 8.678 -9.114 448 2HG1 VAL 59 2HG1 VAL 59 -7.785 7.899 -10.435 449 3HG1 VAL 59 3HG1 VAL 59 -6.577 6.996 -9.521 450 1HG2 VAL 59 1HG2 VAL 59 -10.257 8.014 -7.655 451 2HG2 VAL 59 2HG2 VAL 59 -9.960 8.531 -9.316 452 3HG2 VAL 59 3HG2 VAL 59 -9.069 9.274 -7.985 453 H LEU 60 H LEU 60 -8.517 4.215 -10.701 454 HA LEU 60 HA LEU 60 -6.608 2.767 -9.044 455 1HB LEU 60 1HB LEU 60 -6.711 0.998 -10.708 456 2HB LEU 60 2HB LEU 60 -8.307 1.420 -10.128 457 HG LEU 60 HG LEU 60 -7.215 2.446 -12.744 458 1HD1 LEU 60 1HD1 LEU 60 -8.870 -0.023 -12.231 459 2HD1 LEU 60 2HD1 LEU 60 -7.194 0.009 -12.787 460 3HD1 LEU 60 3HD1 LEU 60 -8.477 0.646 -13.817 461 1HD2 LEU 60 1HD2 LEU 60 -10.032 2.152 -11.694 462 2HD2 LEU 60 2HD2 LEU 60 -9.574 2.781 -13.277 463 3HD2 LEU 60 3HD2 LEU 60 -9.132 3.665 -11.816 464 H LEU 61 H LEU 61 -4.557 3.152 -9.172 465 HA LEU 61 HA LEU 61 -3.487 4.747 -11.360 466 1HB LEU 61 1HB LEU 61 -1.999 3.733 -8.950 467 2HB LEU 61 2HB LEU 61 -1.579 5.082 -9.986 468 HG LEU 61 HG LEU 61 -3.920 4.996 -8.085 469 1HD1 LEU 61 1HD1 LEU 61 -1.796 5.130 -6.924 470 2HD1 LEU 61 2HD1 LEU 61 -2.641 6.675 -6.837 471 3HD1 LEU 61 3HD1 LEU 61 -1.294 6.468 -7.957 472 1HD2 LEU 61 1HD2 LEU 61 -4.366 6.353 -10.075 473 2HD2 LEU 61 2HD2 LEU 61 -2.873 7.250 -9.791 474 3HD2 LEU 61 3HD2 LEU 61 -4.194 7.348 -8.627 475 H LYS 62 H LYS 62 -1.144 4.152 -11.951 476 HA LYS 62 HA LYS 62 -0.671 1.277 -12.061 477 1HB LYS 62 1HB LYS 62 -1.783 1.697 -14.161 478 2HB LYS 62 2HB LYS 62 -0.762 3.094 -14.477 479 1HG LYS 62 1HG LYS 62 1.194 1.593 -14.608 480 2HG LYS 62 2HG LYS 62 0.116 0.215 -14.385 481 1HD LYS 62 1HD LYS 62 -1.037 0.724 -16.438 482 2HD LYS 62 2HD LYS 62 -0.111 2.212 -16.633 483 1HE LYS 62 1HE LYS 62 1.011 -0.590 -16.658 484 2HE LYS 62 2HE LYS 62 0.741 0.425 -18.075 485 1HZ LYS 62 1HZ LYS 62 2.305 2.055 -17.060 486 2HZ LYS 62 2HZ LYS 62 3.022 0.582 -17.486 487 3HZ LYS 62 3HZ LYS 62 2.665 0.906 -15.866 488 H GLY 63 H GLY 63 1.337 0.910 -11.407 489 1HA GLY 63 1HA GLY 63 3.305 3.036 -11.365 490 2HA GLY 63 2HA GLY 63 3.522 1.394 -10.769 491 H LEU 64 H LEU 64 4.965 0.236 -11.860 492 HA LEU 64 HA LEU 64 5.777 1.077 -14.513 493 1HB LEU 64 1HB LEU 64 6.745 -1.233 -12.824 494 2HB LEU 64 2HB LEU 64 7.484 -0.674 -14.312 495 HG LEU 64 HG LEU 64 7.308 0.905 -11.743 496 1HD1 LEU 64 1HD1 LEU 64 9.720 0.571 -11.624 497 2HD1 LEU 64 2HD1 LEU 64 9.657 -0.440 -13.069 498 3HD1 LEU 64 3HD1 LEU 64 8.859 -0.968 -11.588 499 1HD2 LEU 64 1HD2 LEU 64 7.257 2.353 -13.700 500 2HD2 LEU 64 2HD2 LEU 64 8.678 1.540 -14.354 501 3HD2 LEU 64 3HD2 LEU 64 8.807 2.483 -12.868 502 H LYS 65 H LYS 65 4.989 -2.144 -13.164 503 HA LYS 65 HA LYS 65 2.892 -2.757 -14.895 504 1HB LYS 65 1HB LYS 65 4.739 -2.507 -16.610 505 2HB LYS 65 2HB LYS 65 5.475 -3.940 -15.908 506 1HG LYS 65 1HG LYS 65 3.446 -5.220 -16.438 507 2HG LYS 65 2HG LYS 65 2.753 -3.778 -17.184 508 1HD LYS 65 1HD LYS 65 5.252 -5.227 -18.053 509 2HD LYS 65 2HD LYS 65 3.698 -5.225 -18.889 510 1HE LYS 65 1HE LYS 65 3.895 -2.897 -19.391 511 2HE LYS 65 2HE LYS 65 5.313 -2.736 -18.356 512 1HZ LYS 65 1HZ LYS 65 5.155 -4.334 -20.858 513 2HZ LYS 65 2HZ LYS 65 6.517 -4.211 -19.852 514 3HZ LYS 65 3HZ LYS 65 5.944 -2.846 -20.672 515 H ASN 66 H ASN 66 5.854 -4.230 -13.580 516 HA ASN 66 HA ASN 66 4.205 -6.083 -12.050 517 1HB ASN 66 1HB ASN 66 4.814 -7.154 -14.281 518 2HB ASN 66 2HB ASN 66 6.485 -7.118 -13.739 519 1HD2 ASN 66 1HD2 ASN 66 5.779 -7.720 -10.941 520 2HD2 ASN 66 2HD2 ASN 66 5.356 -9.393 -10.927 521 H ILE 67 H ILE 67 7.536 -5.357 -12.956 522 HA ILE 67 HA ILE 67 9.443 -5.009 -11.868 523 HB ILE 67 HB ILE 67 8.182 -3.030 -11.036 524 1HG1 ILE 67 1HG1 ILE 67 9.845 -2.489 -9.267 525 2HG1 ILE 67 2HG1 ILE 67 10.342 -4.178 -9.261 526 1HG2 ILE 67 1HG2 ILE 67 6.588 -4.083 -9.539 527 2HG2 ILE 67 2HG2 ILE 67 7.575 -2.915 -8.661 528 3HG2 ILE 67 3HG2 ILE 67 7.901 -4.642 -8.503 529 1HD1 ILE 67 1HD1 ILE 67 11.023 -3.974 -11.601 530 2HD1 ILE 67 2HD1 ILE 67 11.870 -2.830 -10.561 531 3HD1 ILE 67 3HD1 ILE 67 10.546 -2.276 -11.585 532 H VAL 68 H VAL 68 7.237 -6.430 -9.454 533 HA VAL 68 HA VAL 68 9.481 -8.132 -8.610 534 HB VAL 68 HB VAL 68 9.102 -6.390 -6.934 535 1HG1 VAL 68 1HG1 VAL 68 6.309 -7.489 -6.740 536 2HG1 VAL 68 2HG1 VAL 68 6.768 -5.900 -7.345 537 3HG1 VAL 68 3HG1 VAL 68 7.018 -6.304 -5.646 538 1HG2 VAL 68 1HG2 VAL 68 9.888 -8.527 -6.136 539 2HG2 VAL 68 2HG2 VAL 68 8.235 -9.135 -6.046 540 3HG2 VAL 68 3HG2 VAL 68 8.756 -7.844 -4.965 541 H SER 69 H SER 69 9.052 -10.258 -8.309 542 HA SER 69 HA SER 69 6.533 -11.211 -9.360 543 1HB SER 69 1HB SER 69 8.917 -12.770 -8.330 544 2HB SER 69 2HB SER 69 7.571 -13.419 -9.268 545 HG SER 69 HG SER 69 8.479 -11.399 -10.660 546 H VAL 70 H VAL 70 4.860 -11.117 -7.984 547 HA VAL 70 HA VAL 70 5.038 -11.552 -5.186 548 HB VAL 70 HB VAL 70 2.629 -11.716 -7.012 549 1HG1 VAL 70 1HG1 VAL 70 2.238 -12.893 -4.905 550 2HG1 VAL 70 2HG1 VAL 70 1.290 -11.410 -4.989 551 3HG1 VAL 70 3HG1 VAL 70 2.755 -11.466 -4.007 552 1HG2 VAL 70 1HG2 VAL 70 3.586 -9.453 -5.260 553 2HG2 VAL 70 2HG2 VAL 70 2.166 -9.444 -6.308 554 3HG2 VAL 70 3HG2 VAL 70 3.782 -9.531 -7.010 555 H LYS 71 H LYS 71 5.469 -13.407 -4.248 556 HA LYS 71 HA LYS 71 5.319 -15.876 -5.762 557 1HB LYS 71 1HB LYS 71 7.306 -15.173 -4.349 558 2HB LYS 71 2HB LYS 71 6.305 -15.474 -2.937 559 1HG LYS 71 1HG LYS 71 6.106 -17.809 -3.528 560 2HG LYS 71 2HG LYS 71 7.018 -17.534 -5.014 561 1HD LYS 71 1HD LYS 71 8.055 -17.152 -2.205 562 2HD LYS 71 2HD LYS 71 8.427 -18.508 -3.269 563 1HE LYS 71 1HE LYS 71 9.080 -15.619 -3.855 564 2HE LYS 71 2HE LYS 71 10.218 -16.801 -3.210 565 1HZ LYS 71 1HZ LYS 71 8.832 -17.003 -5.836 566 2HZ LYS 71 2HZ LYS 71 9.961 -18.109 -5.221 567 3HZ LYS 71 3HZ LYS 71 10.446 -16.532 -5.612 568 H PHE 72 H PHE 72 3.916 -17.516 -5.408 569 HA PHE 72 HA PHE 72 1.538 -16.910 -3.997 570 1HB PHE 72 1HB PHE 72 0.760 -19.139 -4.623 571 2HB PHE 72 2HB PHE 72 1.489 -18.322 -5.994 572 HD1 PHE 72 HD1 PHE 72 3.966 -18.937 -6.501 573 HD2 PHE 72 HD2 PHE 72 1.356 -21.296 -4.109 574 HE1 PHE 72 HE1 PHE 72 5.376 -20.906 -6.909 575 HE2 PHE 72 HE2 PHE 72 2.768 -23.270 -4.507 576 HZ PHE 72 HZ PHE 72 4.782 -23.077 -5.911 577 H SER 73 H SER 73 2.043 -16.488 -1.918 578 HA SER 73 HA SER 73 2.297 -18.856 -0.237 579 1HB SER 73 1HB SER 73 4.034 -16.403 0.148 580 2HB SER 73 2HB SER 73 4.016 -17.841 1.169 581 HG SER 73 HG SER 73 4.522 -18.086 -1.583 582 H LYS 74 H LYS 74 2.071 -18.078 2.155 583 HA LYS 74 HA LYS 74 0.525 -15.658 2.481 584 1HB LYS 74 1HB LYS 74 -1.270 -16.965 3.773 585 2HB LYS 74 2HB LYS 74 -1.343 -16.996 2.017 586 1HG LYS 74 1HG LYS 74 -0.511 -19.205 1.925 587 2HG LYS 74 2HG LYS 74 -0.050 -19.175 3.629 588 1HD LYS 74 1HD LYS 74 -2.362 -19.111 4.302 589 2HD LYS 74 2HD LYS 74 -2.883 -18.956 2.623 590 1HE LYS 74 1HE LYS 74 -3.118 -21.252 3.580 591 2HE LYS 74 2HE LYS 74 -2.155 -21.160 2.108 592 1HZ LYS 74 1HZ LYS 74 -0.940 -21.166 4.813 593 2HZ LYS 74 2HZ LYS 74 -0.172 -21.420 3.320 594 3HZ LYS 74 3HZ LYS 74 -1.237 -22.582 3.935 595 H ASP 75 H ASP 75 2.616 -15.331 3.533 596 HA ASP 75 HA ASP 75 2.688 -16.519 6.232 597 1HB ASP 75 1HB ASP 75 4.658 -17.116 4.882 598 2HB ASP 75 2HB ASP 75 4.988 -15.409 4.604 599 H ARG 76 H ARG 76 2.232 -15.157 7.841 600 HA ARG 76 HA ARG 76 2.071 -12.318 7.185 601 1HB ARG 76 1HB ARG 76 0.655 -12.047 9.061 602 2HB ARG 76 2HB ARG 76 0.154 -13.543 8.288 603 1HG ARG 76 1HG ARG 76 1.266 -14.848 9.963 604 2HG ARG 76 2HG ARG 76 1.963 -13.396 10.688 605 1HD ARG 76 1HD ARG 76 -0.417 -12.607 11.054 606 2HD ARG 76 2HD ARG 76 -0.925 -14.241 10.623 607 HE ARG 76 HE ARG 76 1.003 -14.521 12.589 608 1HH1 ARG 76 1HH1 ARG 76 -2.203 -13.102 12.319 609 2HH1 ARG 76 2HH1 ARG 76 -2.532 -13.249 14.024 610 1HH2 ARG 76 1HH2 ARG 76 0.553 -14.699 14.807 611 2HH2 ARG 76 2HH2 ARG 76 -0.974 -14.164 15.427 612 H HIS 77 H HIS 77 4.191 -14.451 8.702 613 HA HIS 77 HA HIS 77 5.180 -12.722 10.747 614 1HB HIS 77 1HB HIS 77 5.509 -15.127 10.923 615 2HB HIS 77 2HB HIS 77 6.438 -15.140 9.427 616 HD1 HIS 77 HD1 HIS 77 6.776 -13.021 12.597 617 HD2 HIS 77 HD2 HIS 77 9.009 -15.513 10.121 618 HE1 HIS 77 HE1 HIS 77 9.103 -13.012 13.542 619 HE2 HIS 77 HE2 HIS 77 10.380 -14.676 12.147 620 H LEU 78 H LEU 78 6.175 -13.458 7.425 621 HA LEU 78 HA LEU 78 8.421 -11.751 7.389 622 1HB LEU 78 1HB LEU 78 7.939 -13.467 5.665 623 2HB LEU 78 2HB LEU 78 6.596 -12.493 5.095 624 HG LEU 78 HG LEU 78 8.143 -10.716 4.426 625 1HD1 LEU 78 1HD1 LEU 78 9.857 -11.090 6.130 626 2HD1 LEU 78 2HD1 LEU 78 10.549 -11.051 4.509 627 3HD1 LEU 78 3HD1 LEU 78 10.320 -12.594 5.332 628 1HD2 LEU 78 1HD2 LEU 78 9.232 -11.882 2.579 629 2HD2 LEU 78 2HD2 LEU 78 7.580 -12.454 2.810 630 3HD2 LEU 78 3HD2 LEU 78 8.936 -13.430 3.375 631 H ILE 79 H ILE 79 5.017 -11.218 6.578 632 HA ILE 79 HA ILE 79 5.127 -8.518 5.881 633 HB ILE 79 HB ILE 79 2.934 -9.881 7.459 634 1HG1 ILE 79 1HG1 ILE 79 3.199 -9.570 4.461 635 2HG1 ILE 79 2HG1 ILE 79 3.522 -11.060 5.344 636 1HG2 ILE 79 1HG2 ILE 79 2.883 -7.418 5.719 637 2HG2 ILE 79 2HG2 ILE 79 2.749 -7.459 7.476 638 3HG2 ILE 79 3HG2 ILE 79 1.478 -8.167 6.479 639 1HD1 ILE 79 1HD1 ILE 79 0.876 -9.636 5.249 640 2HD1 ILE 79 2HD1 ILE 79 1.213 -11.163 6.062 641 3HD1 ILE 79 3HD1 ILE 79 1.313 -11.056 4.304 642 H GLU 80 H GLU 80 4.581 -10.036 9.022 643 HA GLU 80 HA GLU 80 4.416 -7.841 10.676 644 1HB GLU 80 1HB GLU 80 3.982 -10.119 11.390 645 2HB GLU 80 2HB GLU 80 5.668 -10.548 11.157 646 1HG GLU 80 1HG GLU 80 6.273 -8.979 12.964 647 2HG GLU 80 2HG GLU 80 4.552 -8.682 13.231 648 H THR 81 H THR 81 7.361 -9.638 9.764 649 HA THR 81 HA THR 81 9.186 -7.991 11.129 650 HB THR 81 HB THR 81 9.648 -9.635 8.627 651 HG1 THR 81 HG1 THR 81 9.059 -10.364 11.124 652 1HG2 THR 81 1HG2 THR 81 11.438 -7.999 9.026 653 2HG2 THR 81 2HG2 THR 81 11.998 -9.648 9.299 654 3HG2 THR 81 3HG2 THR 81 11.622 -8.603 10.671 655 H THR 82 H THR 82 7.817 -7.797 7.885 656 HA THR 82 HA THR 82 9.478 -5.695 6.959 657 HB THR 82 HB THR 82 6.696 -6.417 6.013 658 HG1 THR 82 HG1 THR 82 8.022 -8.237 5.884 659 1HG2 THR 82 1HG2 THR 82 8.985 -5.020 4.628 660 2HG2 THR 82 2HG2 THR 82 7.473 -4.275 5.148 661 3HG2 THR 82 3HG2 THR 82 7.467 -5.489 3.868 662 H SER 83 H SER 83 6.207 -5.754 8.360 663 HA SER 83 HA SER 83 5.656 -3.023 8.291 664 1HB SER 83 1HB SER 83 4.821 -5.098 10.332 665 2HB SER 83 2HB SER 83 4.087 -3.505 10.153 666 HG SER 83 HG SER 83 3.096 -4.124 8.391 667 H ASN 84 H ASN 84 7.344 -4.949 10.736 668 HA ASN 84 HA ASN 84 7.763 -2.779 12.516 669 1HB ASN 84 1HB ASN 84 9.075 -5.485 12.253 670 2HB ASN 84 2HB ASN 84 9.529 -4.329 13.496 671 1HD2 ASN 84 1HD2 ASN 84 8.369 -6.977 13.768 672 2HD2 ASN 84 2HD2 ASN 84 6.898 -6.772 14.658 673 H LYS 85 H LYS 85 9.659 -4.217 9.905 674 HA LYS 85 HA LYS 85 12.053 -2.845 10.436 675 1HB LYS 85 1HB LYS 85 11.935 -4.835 8.988 676 2HB LYS 85 2HB LYS 85 11.057 -3.904 7.781 677 1HG LYS 85 1HG LYS 85 12.944 -2.541 7.339 678 2HG LYS 85 2HG LYS 85 13.809 -3.173 8.738 679 1HD LYS 85 1HD LYS 85 14.654 -4.122 6.643 680 2HD LYS 85 2HD LYS 85 13.955 -5.358 7.683 681 1HE LYS 85 1HE LYS 85 12.002 -5.508 6.346 682 2HE LYS 85 2HE LYS 85 12.420 -4.045 5.455 683 1HZ LYS 85 1HZ LYS 85 12.850 -6.239 4.302 684 2HZ LYS 85 2HZ LYS 85 14.133 -6.460 5.391 685 3HZ LYS 85 3HZ LYS 85 14.141 -5.138 4.330 686 H LEU 86 H LEU 86 9.296 -1.975 8.348 687 HA LEU 86 HA LEU 86 10.533 0.432 7.429 688 1HB LEU 86 1HB LEU 86 8.692 -0.586 6.189 689 2HB LEU 86 2HB LEU 86 7.610 -0.319 7.543 690 HG LEU 86 HG LEU 86 7.980 2.148 7.255 691 1HD1 LEU 86 1HD1 LEU 86 8.887 2.939 5.137 692 2HD1 LEU 86 2HD1 LEU 86 9.302 1.284 4.688 693 3HD1 LEU 86 3HD1 LEU 86 10.099 2.053 6.062 694 1HD2 LEU 86 1HD2 LEU 86 5.985 1.047 6.398 695 2HD2 LEU 86 2HD2 LEU 86 6.826 0.680 4.893 696 3HD2 LEU 86 3HD2 LEU 86 6.497 2.355 5.330 697 H LYS 87 H LYS 87 8.374 -0.375 10.078 698 HA LYS 87 HA LYS 87 7.732 2.309 10.742 699 1HB LYS 87 1HB LYS 87 6.360 0.267 11.254 700 2HB LYS 87 2HB LYS 87 7.525 -0.131 12.505 701 1HG LYS 87 1HG LYS 87 6.984 1.878 13.714 702 2HG LYS 87 2HG LYS 87 5.914 2.406 12.415 703 1HD LYS 87 1HD LYS 87 5.528 -0.097 14.060 704 2HD LYS 87 2HD LYS 87 4.704 1.433 14.348 705 1HE LYS 87 1HE LYS 87 3.124 0.298 13.116 706 2HE LYS 87 2HE LYS 87 3.971 1.184 11.851 707 1HZ LYS 87 1HZ LYS 87 5.259 -0.819 11.378 708 2HZ LYS 87 2HZ LYS 87 3.597 -1.110 11.206 709 3HZ LYS 87 3HZ LYS 87 4.422 -1.663 12.589 710 H SER 88 H SER 88 10.142 0.020 11.941 711 HA SER 88 HA SER 88 10.963 1.915 13.997 712 1HB SER 88 1HB SER 88 11.914 -0.906 13.454 713 2HB SER 88 2HB SER 88 12.326 0.073 14.865 714 HG SER 88 HG SER 88 10.500 -1.509 15.028 715 H ARG 89 H ARG 89 12.212 0.512 11.002 716 HA ARG 89 HA ARG 89 14.850 1.681 11.531 717 1HB ARG 89 1HB ARG 89 14.443 -0.731 10.682 718 2HB ARG 89 2HB ARG 89 14.133 0.024 9.132 719 1HG ARG 89 1HG ARG 89 16.384 1.058 9.234 720 2HG ARG 89 2HG ARG 89 16.690 0.140 10.711 721 1HD ARG 89 1HD ARG 89 16.127 -1.936 9.382 722 2HD ARG 89 2HD ARG 89 16.179 -0.920 7.943 723 HE ARG 89 HE ARG 89 18.488 -1.315 9.748 724 1HH1 ARG 89 1HH1 ARG 89 17.149 -0.793 6.553 725 2HH1 ARG 89 2HH1 ARG 89 18.643 -1.107 5.737 726 1HH2 ARG 89 1HH2 ARG 89 20.457 -1.743 8.666 727 2HH2 ARG 89 2HH2 ARG 89 20.522 -1.617 6.927 728 H GLU 90 H GLU 90 12.043 2.111 9.569 729 HA GLU 90 HA GLU 90 11.477 3.478 7.861 730 1HB GLU 90 1HB GLU 90 13.879 5.080 8.768 731 2HB GLU 90 2HB GLU 90 12.664 5.640 7.625 732 1HG GLU 90 1HG GLU 90 10.959 5.539 9.333 733 2HG GLU 90 2HG GLU 90 12.115 4.868 10.483 734 H ILE 91 H ILE 91 12.205 1.501 6.683 735 HA ILE 91 HA ILE 91 14.594 1.787 5.072 736 HB ILE 91 HB ILE 91 13.854 -0.286 3.966 737 1HG1 ILE 91 1HG1 ILE 91 11.528 -0.221 5.899 738 2HG1 ILE 91 2HG1 ILE 91 11.401 0.190 4.193 739 1HG2 ILE 91 1HG2 ILE 91 13.786 -0.372 6.979 740 2HG2 ILE 91 2HG2 ILE 91 15.224 -0.433 5.958 741 3HG2 ILE 91 3HG2 ILE 91 14.062 -1.761 5.926 742 1HD1 ILE 91 1HD1 ILE 91 12.184 -2.482 5.331 743 2HD1 ILE 91 2HD1 ILE 91 12.116 -2.083 3.614 744 3HD1 ILE 91 3HD1 ILE 91 10.641 -2.065 4.585 745 H THR 92 H THR 92 14.102 1.153 2.597 746 HA THR 92 HA THR 92 12.704 3.412 1.517 747 HB THR 92 HB THR 92 13.589 1.069 -0.143 748 HG1 THR 92 HG1 THR 92 15.372 1.385 1.130 749 1HG2 THR 92 1HG2 THR 92 12.481 2.946 -1.256 750 2HG2 THR 92 2HG2 THR 92 14.173 2.840 -1.738 751 3HG2 THR 92 3HG2 THR 92 13.663 4.058 -0.568 752 H PHE 93 H PHE 93 10.772 3.435 0.389 753 HA PHE 93 HA PHE 93 8.789 1.622 1.193 754 1HB PHE 93 1HB PHE 93 8.389 3.985 0.479 755 2HB PHE 93 2HB PHE 93 8.692 3.488 -1.181 756 HD1 PHE 93 HD1 PHE 93 6.435 3.004 1.705 757 HD2 PHE 93 HD2 PHE 93 7.002 2.501 -2.484 758 HE1 PHE 93 HE1 PHE 93 4.061 2.405 1.458 759 HE2 PHE 93 HE2 PHE 93 4.630 1.903 -2.738 760 HZ PHE 93 HZ PHE 93 3.155 1.855 -0.766 761 H GLN 94 H GLN 94 10.889 1.733 -1.593 762 HA GLN 94 HA GLN 94 9.536 -0.143 -3.204 763 1HB GLN 94 1HB GLN 94 11.329 1.346 -4.040 764 2HB GLN 94 2HB GLN 94 12.506 0.429 -3.106 765 1HG GLN 94 1HG GLN 94 12.024 -1.559 -4.404 766 2HG GLN 94 2HG GLN 94 10.780 -0.694 -5.301 767 1HE2 GLN 94 1HE2 GLN 94 13.861 0.720 -4.403 768 2HE2 GLN 94 2HE2 GLN 94 14.481 0.831 -6.016 769 H GLU 95 H GLU 95 11.954 -0.498 -0.659 770 HA GLU 95 HA GLU 95 12.341 -3.291 -0.962 771 1HB GLU 95 1HB GLU 95 12.655 -1.601 1.529 772 2HB GLU 95 2HB GLU 95 13.340 -3.199 1.267 773 1HG GLU 95 1HG GLU 95 14.762 -2.350 -0.479 774 2HG GLU 95 2HG GLU 95 14.019 -0.757 -0.350 775 H TYR 96 H TYR 96 10.052 -1.300 0.725 776 HA TYR 96 HA TYR 96 9.002 -3.214 2.504 777 1HB TYR 96 1HB TYR 96 8.761 -0.687 2.584 778 2HB TYR 96 2HB TYR 96 7.534 -0.848 1.336 779 HD1 TYR 96 HD1 TYR 96 8.375 -2.086 4.749 780 HD2 TYR 96 HD2 TYR 96 5.318 -1.115 1.960 781 HE1 TYR 96 HE1 TYR 96 6.683 -2.417 6.498 782 HE2 TYR 96 HE2 TYR 96 3.615 -1.446 3.706 783 HH TYR 96 HH TYR 96 3.401 -2.699 5.864 784 H ARG 97 H ARG 97 7.868 -2.057 -0.661 785 HA ARG 97 HA ARG 97 5.661 -3.809 -0.814 786 1HB ARG 97 1HB ARG 97 5.793 -3.288 -3.309 787 2HB ARG 97 2HB ARG 97 5.564 -1.930 -2.215 788 1HG ARG 97 1HG ARG 97 7.537 -1.009 -2.720 789 2HG ARG 97 2HG ARG 97 8.358 -2.565 -2.842 790 1HD ARG 97 1HD ARG 97 8.374 -1.582 -5.011 791 2HD ARG 97 2HD ARG 97 7.214 -2.906 -5.039 792 HE ARG 97 HE ARG 97 5.758 -0.635 -4.462 793 1HH1 ARG 97 1HH1 ARG 97 7.857 -1.677 -7.075 794 2HH1 ARG 97 2HH1 ARG 97 6.944 -0.846 -8.301 795 1HH2 ARG 97 1HH2 ARG 97 4.601 0.508 -6.100 796 2HH2 ARG 97 2HH2 ARG 97 5.141 0.391 -7.760 797 H ARG 98 H ARG 98 9.041 -4.206 -1.717 798 HA ARG 98 HA ARG 98 8.679 -6.529 -3.309 799 1HB ARG 98 1HB ARG 98 11.090 -5.529 -1.790 800 2HB ARG 98 2HB ARG 98 11.118 -6.939 -2.839 801 1HG ARG 98 1HG ARG 98 10.392 -5.477 -4.713 802 2HG ARG 98 2HG ARG 98 10.576 -4.091 -3.635 803 1HD ARG 98 1HD ARG 98 12.946 -4.761 -3.284 804 2HD ARG 98 2HD ARG 98 12.726 -6.021 -4.497 805 HE ARG 98 HE ARG 98 12.862 -3.143 -4.952 806 1HH1 ARG 98 1HH1 ARG 98 12.473 -6.369 -6.259 807 2HH1 ARG 98 2HH1 ARG 98 12.698 -5.865 -7.911 808 1HH2 ARG 98 1HH2 ARG 98 13.187 -2.484 -7.131 809 2HH2 ARG 98 2HH2 ARG 98 13.122 -3.671 -8.395 810 H ASN 99 H ASN 99 9.408 -6.053 0.120 811 HA ASN 99 HA ASN 99 9.774 -8.765 0.786 812 1HB ASN 99 1HB ASN 99 9.008 -6.342 2.400 813 2HB ASN 99 2HB ASN 99 9.063 -7.936 3.136 814 1HD2 ASN 99 1HD2 ASN 99 11.274 -7.012 0.601 815 2HD2 ASN 99 2HD2 ASN 99 12.685 -6.927 1.604 816 H LEU 100 H LEU 100 6.904 -6.715 0.770 817 HA LEU 100 HA LEU 100 5.131 -8.590 1.906 818 1HB LEU 100 1HB LEU 100 4.571 -6.290 0.032 819 2HB LEU 100 2HB LEU 100 3.361 -7.146 0.969 820 HG LEU 100 HG LEU 100 5.648 -5.587 2.179 821 1HD1 LEU 100 1HD1 LEU 100 2.756 -4.814 1.837 822 2HD1 LEU 100 2HD1 LEU 100 4.126 -4.104 0.983 823 3HD1 LEU 100 3HD1 LEU 100 3.974 -3.904 2.729 824 1HD2 LEU 100 1HD2 LEU 100 4.371 -5.802 4.236 825 2HD2 LEU 100 2HD2 LEU 100 4.776 -7.390 3.583 826 3HD2 LEU 100 3HD2 LEU 100 3.146 -6.744 3.389 827 H ALA 101 H ALA 101 6.077 -7.912 -1.420 828 HA ALA 101 HA ALA 101 4.131 -9.445 -2.727 829 1HB ALA 101 1HB ALA 101 5.531 -7.822 -3.884 830 2HB ALA 101 2HB ALA 101 5.641 -9.408 -4.649 831 3HB ALA 101 3HB ALA 101 6.946 -8.837 -3.611 832 H LYS 102 H LYS 102 7.323 -10.340 -1.474 833 HA LYS 102 HA LYS 102 7.101 -13.025 -2.490 834 1HB LYS 102 1HB LYS 102 9.104 -11.656 -0.716 835 2HB LYS 102 2HB LYS 102 9.173 -13.383 -1.032 836 1HG LYS 102 1HG LYS 102 9.355 -12.926 -3.439 837 2HG LYS 102 2HG LYS 102 9.327 -11.193 -3.099 838 1HD LYS 102 1HD LYS 102 11.383 -11.350 -1.864 839 2HD LYS 102 2HD LYS 102 11.376 -13.109 -1.995 840 1HE LYS 102 1HE LYS 102 12.944 -12.120 -3.578 841 2HE LYS 102 2HE LYS 102 11.627 -12.931 -4.420 842 1HZ LYS 102 1HZ LYS 102 10.620 -10.853 -4.910 843 2HZ LYS 102 2HZ LYS 102 12.254 -10.721 -5.342 844 3HZ LYS 102 3HZ LYS 102 11.692 -10.010 -3.905 845 H ALA 103 H ALA 103 5.900 -11.421 0.232 846 HA ALA 103 HA ALA 103 5.826 -13.747 1.949 847 1HB ALA 103 1HB ALA 103 4.520 -12.346 3.462 848 2HB ALA 103 2HB ALA 103 4.411 -11.094 2.222 849 3HB ALA 103 3HB ALA 103 5.976 -11.507 2.923 850 H GLY 104 H GLY 104 4.046 -12.556 -0.655 851 1HA GLY 104 1HA GLY 104 2.393 -13.970 -1.677 852 2HA GLY 104 2HA GLY 104 1.891 -14.475 -0.070 853 H VAL 105 H VAL 105 2.481 -11.170 -0.148 854 HA VAL 105 HA VAL 105 -0.331 -10.590 0.094 855 HB VAL 105 HB VAL 105 1.990 -8.651 0.019 856 1HG1 VAL 105 1HG1 VAL 105 -0.168 -7.602 -0.444 857 2HG1 VAL 105 2HG1 VAL 105 0.450 -7.108 1.131 858 3HG1 VAL 105 3HG1 VAL 105 -0.835 -8.310 1.026 859 1HG2 VAL 105 1HG2 VAL 105 0.605 -9.892 2.392 860 2HG2 VAL 105 2HG2 VAL 105 1.865 -8.660 2.455 861 3HG2 VAL 105 3HG2 VAL 105 2.236 -10.267 1.834 862 H PHE 106 H PHE 106 -1.618 -10.176 -1.539 863 HA PHE 106 HA PHE 106 -0.449 -9.070 -4.008 864 1HB PHE 106 1HB PHE 106 -1.260 -11.427 -4.198 865 2HB PHE 106 2HB PHE 106 -2.874 -10.866 -3.783 866 HD1 PHE 106 HD1 PHE 106 -0.168 -10.486 -6.293 867 HD2 PHE 106 HD2 PHE 106 -4.318 -10.084 -5.438 868 HE1 PHE 106 HE1 PHE 106 -0.612 -10.049 -8.673 869 HE2 PHE 106 HE2 PHE 106 -4.769 -9.644 -7.817 870 HZ PHE 106 HZ PHE 106 -2.915 -9.626 -9.436 871 H ARG 107 H ARG 107 -2.896 -8.876 -1.586 872 HA ARG 107 HA ARG 107 -3.998 -6.498 -2.911 873 1HB ARG 107 1HB ARG 107 -5.653 -8.237 -3.052 874 2HB ARG 107 2HB ARG 107 -5.465 -8.624 -1.349 875 1HG ARG 107 1HG ARG 107 -6.643 -6.766 -0.659 876 2HG ARG 107 2HG ARG 107 -6.354 -5.894 -2.165 877 1HD ARG 107 1HD ARG 107 -8.706 -6.799 -1.766 878 2HD ARG 107 2HD ARG 107 -7.963 -7.142 -3.327 879 HE ARG 107 HE ARG 107 -7.528 -9.391 -2.531 880 1HH1 ARG 107 1HH1 ARG 107 -9.795 -7.502 -0.644 881 2HH1 ARG 107 2HH1 ARG 107 -10.615 -8.890 0.004 882 1HH2 ARG 107 1HH2 ARG 107 -8.594 -11.211 -1.713 883 2HH2 ARG 107 2HH2 ARG 107 -9.924 -11.011 -0.601 884 H TRP 108 H TRP 108 -2.998 -4.949 -1.881 885 HA TRP 108 HA TRP 108 -2.696 -4.980 1.032 886 1HB TRP 108 1HB TRP 108 -0.693 -4.593 -0.245 887 2HB TRP 108 2HB TRP 108 -1.480 -3.377 -1.226 888 HD1 TRP 108 HD1 TRP 108 -2.514 -2.079 1.887 889 HE1 TRP 108 HE1 TRP 108 -0.806 -0.420 2.873 890 HE3 TRP 108 HE3 TRP 108 1.571 -3.420 -0.849 891 HZ2 TRP 108 HZ2 TRP 108 1.934 0.225 2.529 892 HZ3 TRP 108 HZ3 TRP 108 3.696 -2.248 -0.468 893 HH2 TRP 108 HH2 TRP 108 3.879 -0.463 1.178 894 H VAL 109 H VAL 109 -4.586 -4.276 1.935 895 HA VAL 109 HA VAL 109 -5.952 -1.993 0.670 896 HB VAL 109 HB VAL 109 -7.068 -3.942 2.695 897 1HG1 VAL 109 1HG1 VAL 109 -9.231 -2.983 2.102 898 2HG1 VAL 109 2HG1 VAL 109 -8.438 -1.858 0.998 899 3HG1 VAL 109 3HG1 VAL 109 -8.143 -1.744 2.733 900 1HG2 VAL 109 1HG2 VAL 109 -7.472 -3.823 -0.291 901 2HG2 VAL 109 2HG2 VAL 109 -8.312 -4.905 0.820 902 3HG2 VAL 109 3HG2 VAL 109 -6.572 -5.059 0.585 903 H THR 110 H THR 110 -5.187 -0.146 1.573 904 HA THR 110 HA THR 110 -4.931 -0.059 4.493 905 HB THR 110 HB THR 110 -4.179 2.085 2.499 906 HG1 THR 110 HG1 THR 110 -2.972 0.009 2.427 907 1HG2 THR 110 1HG2 THR 110 -4.561 2.982 4.715 908 2HG2 THR 110 2HG2 THR 110 -2.825 2.944 4.399 909 3HG2 THR 110 3HG2 THR 110 -3.563 1.720 5.435 910 H ASN 111 H ASN 111 -6.736 0.381 5.518 911 HA ASN 111 HA ASN 111 -8.789 2.003 4.209 912 1HB ASN 111 1HB ASN 111 -9.367 -0.258 5.135 913 2HB ASN 111 2HB ASN 111 -9.018 0.368 6.741 914 1HD2 ASN 111 1HD2 ASN 111 -11.175 -0.088 7.356 915 2HD2 ASN 111 2HD2 ASN 111 -12.477 0.939 6.858 916 H ILE 112 H ILE 112 -8.208 4.076 4.514 917 HA ILE 112 HA ILE 112 -6.989 5.122 6.837 918 HB ILE 112 HB ILE 112 -8.587 6.615 4.743 919 1HG1 ILE 112 1HG1 ILE 112 -6.774 5.319 3.727 920 2HG1 ILE 112 2HG1 ILE 112 -6.416 7.040 3.658 921 1HG2 ILE 112 1HG2 ILE 112 -6.491 7.606 6.675 922 2HG2 ILE 112 2HG2 ILE 112 -8.223 7.933 6.765 923 3HG2 ILE 112 3HG2 ILE 112 -7.273 8.568 5.420 924 1HD1 ILE 112 1HD1 ILE 112 -4.907 6.800 5.561 925 2HD1 ILE 112 2HD1 ILE 112 -4.443 5.744 4.227 926 3HD1 ILE 112 3HD1 ILE 112 -5.273 5.075 5.631 927 H HIS 113 H HIS 113 -10.284 4.617 5.885 928 HA HIS 113 HA HIS 113 -11.607 6.247 7.741 929 1HB HIS 113 1HB HIS 113 -12.713 5.184 5.820 930 2HB HIS 113 2HB HIS 113 -12.481 3.604 6.555 931 HD1 HIS 113 HD1 HIS 113 -14.702 2.811 7.269 932 HD2 HIS 113 HD2 HIS 113 -14.158 6.850 8.122 933 HE1 HIS 113 HE1 HIS 113 -16.781 3.538 8.483 934 HE2 HIS 113 HE2 HIS 113 -16.377 5.944 9.112 935 H GLU 114 H GLU 114 -9.884 3.281 8.180 936 HA GLU 114 HA GLU 114 -10.881 3.135 10.953 937 1HB GLU 114 1HB GLU 114 -9.892 0.983 9.108 938 2HB GLU 114 2HB GLU 114 -9.901 0.761 10.849 939 1HG GLU 114 1HG GLU 114 -12.354 1.257 10.802 940 2HG GLU 114 2HG GLU 114 -12.253 1.194 9.038 941 H GLN 115 H GLN 115 -8.268 4.051 9.117 942 HA GLN 115 HA GLN 115 -6.043 4.361 9.465 943 1HB GLN 115 1HB GLN 115 -6.918 4.121 12.352 944 2HB GLN 115 2HB GLN 115 -5.295 4.583 11.860 945 1HG GLN 115 1HG GLN 115 -7.764 6.085 11.038 946 2HG GLN 115 2HG GLN 115 -6.820 6.471 12.475 947 1HE2 GLN 115 1HE2 GLN 115 -7.364 8.030 10.027 948 2HE2 GLN 115 2HE2 GLN 115 -5.804 8.442 9.396 949 H LYS 116 H LYS 116 -7.018 1.751 8.909 950 HA LYS 116 HA LYS 116 -5.018 0.082 10.293 951 1HB LYS 116 1HB LYS 116 -7.714 -0.783 9.224 952 2HB LYS 116 2HB LYS 116 -6.500 -1.863 9.888 953 1HG LYS 116 1HG LYS 116 -6.692 -0.626 12.048 954 2HG LYS 116 2HG LYS 116 -8.050 0.259 11.347 955 1HD LYS 116 1HD LYS 116 -9.203 -1.885 10.943 956 2HD LYS 116 2HD LYS 116 -7.862 -2.734 11.710 957 1HE LYS 116 1HE LYS 116 -9.595 -2.529 13.327 958 2HE LYS 116 2HE LYS 116 -8.318 -1.400 13.780 959 1HZ LYS 116 1HZ LYS 116 -10.778 -0.654 12.286 960 2HZ LYS 116 2HZ LYS 116 -9.586 0.404 12.877 961 3HZ LYS 116 3HZ LYS 116 -10.566 -0.454 13.957 962 H ARG 117 H ARG 117 -3.935 -1.467 9.044 963 HA ARG 117 HA ARG 117 -4.185 -1.110 6.127 964 1HB ARG 117 1HB ARG 117 -2.115 -0.112 7.136 965 2HB ARG 117 2HB ARG 117 -1.648 -1.725 7.659 966 1HG ARG 117 1HG ARG 117 -1.593 -2.455 5.322 967 2HG ARG 117 2HG ARG 117 -2.028 -0.820 4.814 968 1HD ARG 117 1HD ARG 117 0.438 -1.580 6.369 969 2HD ARG 117 2HD ARG 117 0.385 -1.236 4.642 970 HE ARG 117 HE ARG 117 -0.579 1.029 5.596 971 1HH1 ARG 117 1HH1 ARG 117 2.090 -0.900 6.788 972 2HH1 ARG 117 2HH1 ARG 117 2.987 0.462 7.366 973 1HH2 ARG 117 1HH2 ARG 117 0.613 2.846 6.364 974 2HH2 ARG 117 2HH2 ARG 117 2.149 2.596 7.119 975 H TYR 118 H TYR 118 -5.104 -2.867 5.336 976 HA TYR 118 HA TYR 118 -4.798 -5.434 6.697 977 1HB TYR 118 1HB TYR 118 -6.663 -4.549 4.486 978 2HB TYR 118 2HB TYR 118 -6.662 -6.150 5.216 979 HD1 TYR 118 HD1 TYR 118 -7.735 -6.548 7.300 980 HD2 TYR 118 HD2 TYR 118 -7.355 -2.567 5.842 981 HE1 TYR 118 HE1 TYR 118 -9.313 -5.773 9.018 982 HE2 TYR 118 HE2 TYR 118 -8.933 -1.781 7.559 983 HH TYR 118 HH TYR 118 -10.741 -2.684 8.973 984 H TYR 119 H TYR 119 -3.690 -7.104 5.875 985 HA TYR 119 HA TYR 119 -2.638 -6.837 3.136 986 1HB TYR 119 1HB TYR 119 -1.531 -8.397 5.479 987 2HB TYR 119 2HB TYR 119 -0.851 -8.398 3.854 988 HD1 TYR 119 HD1 TYR 119 -1.262 -6.496 6.944 989 HD2 TYR 119 HD2 TYR 119 0.332 -6.447 3.000 990 HE1 TYR 119 HE1 TYR 119 0.111 -4.541 7.529 991 HE2 TYR 119 HE2 TYR 119 1.709 -4.496 3.574 992 HH TYR 119 HH TYR 119 1.973 -3.326 6.857 993 H TYR 120 H TYR 120 -3.707 -8.026 1.729 994 HA TYR 120 HA TYR 120 -4.766 -10.641 2.585 995 1HB TYR 120 1HB TYR 120 -5.729 -8.709 0.480 996 2HB TYR 120 2HB TYR 120 -6.272 -10.378 0.548 997 HD1 TYR 120 HD1 TYR 120 -7.864 -11.099 2.179 998 HD2 TYR 120 HD2 TYR 120 -6.353 -7.124 2.265 999 HE1 TYR 120 HE1 TYR 120 -9.639 -10.465 3.755 1000 HE2 TYR 120 HE2 TYR 120 -8.124 -6.480 3.843 1001 HH TYR 120 HH TYR 120 -10.165 -8.824 5.368 1002 H THR 121 H THR 121 -4.203 -12.442 1.480 1003 HA THR 121 HA THR 121 -2.276 -12.244 -0.675 1004 HB THR 121 HB THR 121 -2.047 -14.063 0.967 1005 HG1 THR 121 HG1 THR 121 -1.170 -14.901 -0.776 1006 1HG2 THR 121 1HG2 THR 121 -3.641 -15.914 1.027 1007 2HG2 THR 121 2HG2 THR 121 -4.672 -15.073 -0.130 1008 3HG2 THR 121 3HG2 THR 121 -4.418 -14.397 1.479 1009 H PHE 122 H PHE 122 -2.755 -13.605 -2.710 1010 HA PHE 122 HA PHE 122 -5.032 -12.483 -3.972 1011 1HB PHE 122 1HB PHE 122 -4.367 -13.817 -5.935 1012 2HB PHE 122 2HB PHE 122 -2.998 -12.966 -5.233 1013 HD1 PHE 122 HD1 PHE 122 -1.290 -14.207 -3.959 1014 HD2 PHE 122 HD2 PHE 122 -4.448 -16.193 -6.004 1015 HE1 PHE 122 HE1 PHE 122 -0.043 -16.325 -3.821 1016 HE2 PHE 122 HE2 PHE 122 -3.211 -18.313 -5.867 1017 HZ PHE 122 HZ PHE 122 -1.007 -18.380 -4.775 1018 H ASP 123 H ASP 123 -4.536 -15.345 -2.189 1019 HA ASP 123 HA ASP 123 -6.711 -16.870 -3.283 1020 1HB ASP 123 1HB ASP 123 -4.779 -17.970 -2.262 1021 2HB ASP 123 2HB ASP 123 -5.111 -17.180 -0.727 1022 H ASN 124 H ASN 124 -6.711 -14.107 -1.622 1023 HA ASN 124 HA ASN 124 -8.169 -12.922 -0.379 1024 1HB ASN 124 1HB ASN 124 -9.865 -13.727 -1.982 1025 2HB ASN 124 2HB ASN 124 -10.139 -15.143 -0.969 1026 1HD2 ASN 124 1HD2 ASN 124 -12.311 -14.587 -0.662 1027 2HD2 ASN 124 2HD2 ASN 124 -12.778 -13.286 0.385 1028 H SER 125 H SER 125 -6.765 -13.384 1.356 1029 HA SER 125 HA SER 125 -8.209 -14.520 3.587 1030 1HB SER 125 1HB SER 125 -5.422 -15.490 2.879 1031 2HB SER 125 2HB SER 125 -6.315 -15.910 4.340 1032 HG SER 125 HG SER 125 -7.819 -16.426 2.173 1033 H LEU 126 H LEU 126 -7.885 -13.294 5.367 1034 HA LEU 126 HA LEU 126 -6.207 -10.980 5.154 1035 1HB LEU 126 1HB LEU 126 -8.370 -10.985 6.365 1036 2HB LEU 126 2HB LEU 126 -7.674 -12.066 7.559 1037 HG LEU 126 HG LEU 126 -6.057 -10.332 8.201 1038 1HD1 LEU 126 1HD1 LEU 126 -5.863 -9.189 6.066 1039 2HD1 LEU 126 2HD1 LEU 126 -6.302 -8.053 7.341 1040 3HD1 LEU 126 3HD1 LEU 126 -7.526 -8.617 6.202 1041 1HD2 LEU 126 1HD2 LEU 126 -8.190 -10.477 9.381 1042 2HD2 LEU 126 2HD2 LEU 126 -8.918 -9.373 8.215 1043 3HD2 LEU 126 3HD2 LEU 126 -7.632 -8.809 9.282 1044 H LEU 127 H LEU 127 -4.089 -11.271 5.195 1045 HA LEU 127 HA LEU 127 -2.884 -13.406 6.707 1046 1HB LEU 127 1HB LEU 127 -1.587 -11.168 5.144 1047 2HB LEU 127 2HB LEU 127 -0.776 -12.597 5.757 1048 HG LEU 127 HG LEU 127 -2.901 -12.547 3.611 1049 1HD1 LEU 127 1HD1 LEU 127 -0.753 -11.672 2.865 1050 2HD1 LEU 127 2HD1 LEU 127 -1.081 -13.244 2.136 1051 3HD1 LEU 127 3HD1 LEU 127 0.059 -13.113 3.477 1052 1HD2 LEU 127 1HD2 LEU 127 -2.442 -14.928 3.363 1053 2HD2 LEU 127 2HD2 LEU 127 -3.039 -14.567 4.983 1054 3HD2 LEU 127 3HD2 LEU 127 -1.320 -14.864 4.723 1055 H PHE 128 H PHE 128 -2.709 -9.855 6.745 1056 HA PHE 128 HA PHE 128 -2.218 -9.904 9.602 1057 1HB PHE 128 1HB PHE 128 0.031 -10.146 8.441 1058 2HB PHE 128 2HB PHE 128 -0.227 -8.539 7.778 1059 HD1 PHE 128 HD1 PHE 128 0.033 -10.400 10.972 1060 HD2 PHE 128 HD2 PHE 128 0.403 -6.648 8.995 1061 HE1 PHE 128 HE1 PHE 128 1.020 -9.431 13.005 1062 HE2 PHE 128 HE2 PHE 128 1.393 -5.670 11.028 1063 HZ PHE 128 HZ PHE 128 1.699 -7.063 13.033 1064 H THR 129 H THR 129 -2.406 -7.773 10.559 1065 HA THR 129 HA THR 129 -3.261 -5.598 8.839 1066 HB THR 129 HB THR 129 -5.049 -6.622 11.057 1067 HG1 THR 129 HG1 THR 129 -4.877 -7.287 8.455 1068 1HG2 THR 129 1HG2 THR 129 -6.613 -4.895 10.282 1069 2HG2 THR 129 2HG2 THR 129 -5.418 -4.339 9.111 1070 3HG2 THR 129 3HG2 THR 129 -5.097 -4.183 10.836 1071 H GLU 130 H GLU 130 -1.912 -4.048 9.503 1072 HA GLU 130 HA GLU 130 -1.483 -3.720 12.394 1073 1HB GLU 130 1HB GLU 130 0.477 -2.415 11.852 1074 2HB GLU 130 2HB GLU 130 0.556 -3.939 10.986 1075 1HG GLU 130 1HG GLU 130 -0.246 -2.792 8.958 1076 2HG GLU 130 2HG GLU 130 -0.223 -1.267 9.844 1077 H SER 131 H SER 131 -1.552 -1.483 13.224 1078 HA SER 131 HA SER 131 -3.421 0.149 11.650 1079 1HB SER 131 1HB SER 131 -4.398 -0.942 13.724 1080 2HB SER 131 2HB SER 131 -3.310 0.071 14.671 1081 HG SER 131 HG SER 131 -4.846 1.378 12.757 1082 H ILE 132 H ILE 132 -2.840 2.177 11.259 1083 HA ILE 132 HA ILE 132 -0.305 3.136 12.273 1084 HB ILE 132 HB ILE 132 -0.906 5.182 10.831 1085 1HG1 ILE 132 1HG1 ILE 132 -2.972 3.215 9.809 1086 2HG1 ILE 132 2HG1 ILE 132 -3.328 4.712 10.662 1087 1HG2 ILE 132 1HG2 ILE 132 -0.211 4.009 8.788 1088 2HG2 ILE 132 2HG2 ILE 132 -0.554 2.467 9.570 1089 3HG2 ILE 132 3HG2 ILE 132 0.729 3.502 10.192 1090 1HD1 ILE 132 1HD1 ILE 132 -2.323 5.981 8.822 1091 2HD1 ILE 132 2HD1 ILE 132 -3.661 4.967 8.279 1092 3HD1 ILE 132 3HD1 ILE 132 -1.997 4.470 7.973 1093 H GLN 133 H GLN 133 -3.360 3.081 13.394 1094 HA GLN 133 HA GLN 133 -3.066 5.535 14.971 1095 1HB GLN 133 1HB GLN 133 -5.292 4.658 13.813 1096 2HB GLN 133 2HB GLN 133 -5.380 3.642 15.242 1097 1HG GLN 133 1HG GLN 133 -5.116 6.630 15.370 1098 2HG GLN 133 2HG GLN 133 -6.667 5.802 15.311 1099 1HE2 GLN 133 1HE2 GLN 133 -5.526 7.518 17.361 1100 2HE2 GLN 133 2HE2 GLN 133 -5.503 6.583 18.824 Start of MODEL 14 1 H ASP 7 H ASP 7 -3.653 14.793 -15.490 2 HA ASP 7 HA ASP 7 -6.254 13.486 -15.401 3 1HB ASP 7 1HB ASP 7 -4.809 12.371 -17.204 4 2HB ASP 7 2HB ASP 7 -3.766 11.841 -15.889 5 H GLN 8 H GLN 8 -6.727 12.974 -13.356 6 HA GLN 8 HA GLN 8 -4.927 13.617 -11.265 7 1HB GLN 8 1HB GLN 8 -6.670 12.949 -9.758 8 2HB GLN 8 2HB GLN 8 -7.397 13.818 -11.104 9 1HG GLN 8 1HG GLN 8 -7.904 11.624 -12.141 10 2HG GLN 8 2HG GLN 8 -7.350 10.855 -10.662 11 1HE2 GLN 8 1HE2 GLN 8 -9.087 13.890 -10.703 12 2HE2 GLN 8 2HE2 GLN 8 -10.537 13.280 -9.983 13 H VAL 9 H VAL 9 -5.367 10.755 -13.090 14 HA VAL 9 HA VAL 9 -4.491 8.831 -11.233 15 HB VAL 9 HB VAL 9 -4.134 8.973 -14.233 16 1HG1 VAL 9 1HG1 VAL 9 -2.330 7.611 -13.315 17 2HG1 VAL 9 2HG1 VAL 9 -3.509 6.599 -14.148 18 3HG1 VAL 9 3HG1 VAL 9 -3.497 6.669 -12.386 19 1HG2 VAL 9 1HG2 VAL 9 -5.964 7.343 -12.472 20 2HG2 VAL 9 2HG2 VAL 9 -5.870 7.237 -14.229 21 3HG2 VAL 9 3HG2 VAL 9 -6.430 8.724 -13.463 22 H VAL 10 H VAL 10 -2.738 11.102 -13.287 23 HA VAL 10 HA VAL 10 -0.122 10.244 -12.605 24 HB VAL 10 HB VAL 10 -1.018 13.028 -13.396 25 1HG1 VAL 10 1HG1 VAL 10 1.228 12.974 -12.444 26 2HG1 VAL 10 2HG1 VAL 10 1.282 13.319 -14.174 27 3HG1 VAL 10 3HG1 VAL 10 1.689 11.708 -13.582 28 1HG2 VAL 10 1HG2 VAL 10 -1.737 11.390 -15.049 29 2HG2 VAL 10 2HG2 VAL 10 -0.100 10.738 -15.136 30 3HG2 VAL 10 3HG2 VAL 10 -0.425 12.382 -15.684 31 H ILE 11 H ILE 11 -2.470 12.331 -11.114 32 HA ILE 11 HA ILE 11 -0.782 13.553 -9.199 33 HB ILE 11 HB ILE 11 -3.765 13.227 -9.461 34 1HG1 ILE 11 1HG1 ILE 11 -3.656 15.729 -9.398 35 2HG1 ILE 11 2HG1 ILE 11 -1.904 15.620 -9.281 36 1HG2 ILE 11 1HG2 ILE 11 -3.364 12.925 -7.083 37 2HG2 ILE 11 2HG2 ILE 11 -4.088 14.505 -7.379 38 3HG2 ILE 11 3HG2 ILE 11 -2.362 14.374 -7.040 39 1HD1 ILE 11 1HD1 ILE 11 -1.837 14.530 -11.469 40 2HD1 ILE 11 2HD1 ILE 11 -2.590 16.123 -11.541 41 3HD1 ILE 11 3HD1 ILE 11 -3.590 14.672 -11.584 42 H PHE 12 H PHE 12 -3.121 10.865 -8.874 43 HA PHE 12 HA PHE 12 -2.409 10.320 -6.193 44 1HB PHE 12 1HB PHE 12 -3.897 8.710 -8.258 45 2HB PHE 12 2HB PHE 12 -3.631 8.127 -6.619 46 HD1 PHE 12 HD1 PHE 12 -4.644 9.325 -4.710 47 HD2 PHE 12 HD2 PHE 12 -5.551 10.336 -8.743 48 HE1 PHE 12 HE1 PHE 12 -6.655 10.521 -3.955 49 HE2 PHE 12 HE2 PHE 12 -7.559 11.544 -7.993 50 HZ PHE 12 HZ PHE 12 -8.114 11.636 -5.596 51 H LYS 13 H LYS 13 -1.424 8.801 -9.258 52 HA LYS 13 HA LYS 13 0.016 6.690 -8.076 53 1HB LYS 13 1HB LYS 13 -0.664 6.685 -10.446 54 2HB LYS 13 2HB LYS 13 0.471 7.988 -10.774 55 1HG LYS 13 1HG LYS 13 2.326 6.511 -10.106 56 2HG LYS 13 2HG LYS 13 1.167 5.207 -9.845 57 1HD LYS 13 1HD LYS 13 2.245 4.982 -12.014 58 2HD LYS 13 2HD LYS 13 0.523 5.309 -12.208 59 1HE LYS 13 1HE LYS 13 0.990 7.639 -12.679 60 2HE LYS 13 2HE LYS 13 2.709 7.378 -12.394 61 1HZ LYS 13 1HZ LYS 13 2.837 5.980 -14.303 62 2HZ LYS 13 2HZ LYS 13 2.065 7.410 -14.772 63 3HZ LYS 13 3HZ LYS 13 1.154 6.002 -14.516 64 H GLN 14 H GLN 14 0.896 9.984 -8.920 65 HA GLN 14 HA GLN 14 3.681 9.772 -8.619 66 1HB GLN 14 1HB GLN 14 2.475 11.702 -9.637 67 2HB GLN 14 2HB GLN 14 1.953 12.178 -8.030 68 1HG GLN 14 1HG GLN 14 4.301 12.454 -7.370 69 2HG GLN 14 2HG GLN 14 4.791 12.045 -9.013 70 1HE2 GLN 14 1HE2 GLN 14 2.469 13.457 -10.156 71 2HE2 GLN 14 2HE2 GLN 14 2.838 15.145 -10.034 72 H ILE 15 H ILE 15 1.098 10.436 -6.302 73 HA ILE 15 HA ILE 15 2.635 11.049 -4.064 74 HB ILE 15 HB ILE 15 0.050 9.481 -4.107 75 1HG1 ILE 15 1HG1 ILE 15 0.501 12.463 -3.836 76 2HG1 ILE 15 2HG1 ILE 15 -0.087 11.661 -5.290 77 1HG2 ILE 15 1HG2 ILE 15 1.367 11.073 -1.912 78 2HG2 ILE 15 2HG2 ILE 15 1.189 9.321 -1.973 79 3HG2 ILE 15 3HG2 ILE 15 -0.238 10.347 -1.822 80 1HD1 ILE 15 1HD1 ILE 15 -1.481 11.712 -2.623 81 2HD1 ILE 15 2HD1 ILE 15 -2.072 10.928 -4.088 82 3HD1 ILE 15 3HD1 ILE 15 -1.901 12.682 -4.034 83 H PHE 16 H PHE 16 1.374 7.865 -5.060 84 HA PHE 16 HA PHE 16 2.681 6.431 -2.995 85 1HB PHE 16 1HB PHE 16 1.501 5.527 -5.625 86 2HB PHE 16 2HB PHE 16 2.152 4.416 -4.427 87 HD1 PHE 16 HD1 PHE 16 -0.554 6.793 -5.163 88 HD2 PHE 16 HD2 PHE 16 0.962 3.919 -2.414 89 HE1 PHE 16 HE1 PHE 16 -2.726 6.757 -4.007 90 HE2 PHE 16 HE2 PHE 16 -1.209 3.876 -1.257 91 HZ PHE 16 HZ PHE 16 -3.056 5.299 -2.054 92 H ASP 17 H ASP 17 3.565 7.218 -6.299 93 HA ASP 17 HA ASP 17 5.752 5.438 -6.501 94 1HB ASP 17 1HB ASP 17 4.636 6.480 -8.460 95 2HB ASP 17 2HB ASP 17 5.320 8.034 -7.993 96 H LYS 18 H LYS 18 5.537 8.867 -5.596 97 HA LYS 18 HA LYS 18 8.378 9.107 -5.346 98 1HB LYS 18 1HB LYS 18 6.124 10.925 -4.515 99 2HB LYS 18 2HB LYS 18 7.822 11.321 -4.277 100 1HG LYS 18 1HG LYS 18 8.062 10.928 -6.800 101 2HG LYS 18 2HG LYS 18 6.301 11.039 -6.841 102 1HD LYS 18 1HD LYS 18 7.321 13.207 -7.309 103 2HD LYS 18 2HD LYS 18 6.427 13.252 -5.786 104 1HE LYS 18 1HE LYS 18 8.531 12.914 -4.564 105 2HE LYS 18 2HE LYS 18 9.409 12.908 -6.091 106 1HZ LYS 18 1HZ LYS 18 8.767 15.177 -6.467 107 2HZ LYS 18 2HZ LYS 18 9.495 15.050 -4.941 108 3HZ LYS 18 3HZ LYS 18 7.813 15.188 -5.068 109 H VAL 19 H VAL 19 5.712 8.541 -3.093 110 HA VAL 19 HA VAL 19 7.199 8.986 -0.742 111 HB VAL 19 HB VAL 19 4.687 8.821 -0.854 112 1HG1 VAL 19 1HG1 VAL 19 3.664 6.616 -0.575 113 2HG1 VAL 19 2HG1 VAL 19 5.238 5.860 -0.832 114 3HG1 VAL 19 3HG1 VAL 19 4.475 6.777 -2.132 115 1HG2 VAL 19 1HG2 VAL 19 5.876 8.909 1.266 116 2HG2 VAL 19 2HG2 VAL 19 6.075 7.157 1.244 117 3HG2 VAL 19 3HG2 VAL 19 4.464 7.860 1.386 118 H ARG 20 H ARG 20 7.093 6.295 -2.941 119 HA ARG 20 HA ARG 20 8.207 4.281 -1.375 120 1HB ARG 20 1HB ARG 20 8.356 4.941 -4.275 121 2HB ARG 20 2HB ARG 20 9.465 3.734 -3.639 122 1HG ARG 20 1HG ARG 20 7.424 2.582 -2.674 123 2HG ARG 20 2HG ARG 20 6.469 3.668 -3.686 124 1HD ARG 20 1HD ARG 20 8.644 1.876 -4.753 125 2HD ARG 20 2HD ARG 20 6.948 1.409 -4.680 126 HE ARG 20 HE ARG 20 7.804 3.800 -6.181 127 1HH1 ARG 20 1HH1 ARG 20 6.342 0.641 -6.066 128 2HH1 ARG 20 2HH1 ARG 20 5.564 0.781 -7.615 129 1HH2 ARG 20 1HH2 ARG 20 6.802 4.001 -8.251 130 2HH2 ARG 20 2HH2 ARG 20 5.843 2.673 -8.851 131 H ASN 21 H ASN 21 9.734 7.097 -2.807 132 HA ASN 21 HA ASN 21 12.357 6.124 -1.896 133 1HB ASN 21 1HB ASN 21 11.603 8.132 -4.023 134 2HB ASN 21 2HB ASN 21 13.255 7.898 -3.465 135 1HD2 ASN 21 1HD2 ASN 21 14.384 6.114 -4.090 136 2HD2 ASN 21 2HD2 ASN 21 13.806 4.984 -5.263 137 H ASP 22 H ASP 22 10.232 8.964 -1.860 138 HA ASP 22 HA ASP 22 12.032 10.637 -0.448 139 1HB ASP 22 1HB ASP 22 9.051 10.773 -0.868 140 2HB ASP 22 2HB ASP 22 9.918 11.972 0.083 141 H LEU 23 H LEU 23 9.656 8.297 0.570 142 HA LEU 23 HA LEU 23 9.039 7.472 2.593 143 1HB LEU 23 1HB LEU 23 11.739 8.601 3.302 144 2HB LEU 23 2HB LEU 23 10.742 7.765 4.479 145 HG LEU 23 HG LEU 23 11.714 6.547 1.892 146 1HD1 LEU 23 1HD1 LEU 23 13.240 5.261 3.287 147 2HD1 LEU 23 2HD1 LEU 23 12.701 6.147 4.713 148 3HD1 LEU 23 3HD1 LEU 23 13.565 6.990 3.428 149 1HD2 LEU 23 1HD2 LEU 23 9.625 5.598 2.690 150 2HD2 LEU 23 2HD2 LEU 23 10.326 5.361 4.291 151 3HD2 LEU 23 3HD2 LEU 23 10.947 4.454 2.912 152 H ASN 24 H ASN 24 8.242 10.165 1.799 153 HA ASN 24 HA ASN 24 8.110 11.605 4.320 154 1HB ASN 24 1HB ASN 24 7.042 13.407 2.993 155 2HB ASN 24 2HB ASN 24 8.619 12.946 2.368 156 1HD2 ASN 24 1HD2 ASN 24 6.444 14.304 1.043 157 2HD2 ASN 24 2HD2 ASN 24 5.995 13.332 -0.316 158 H TYR 25 H TYR 25 6.833 10.033 5.397 159 HA TYR 25 HA TYR 25 4.300 9.184 4.488 160 1HB TYR 25 1HB TYR 25 5.480 9.284 7.267 161 2HB TYR 25 2HB TYR 25 3.934 8.534 6.888 162 HD1 TYR 25 HD1 TYR 25 3.837 6.487 5.558 163 HD2 TYR 25 HD2 TYR 25 7.567 8.206 6.663 164 HE1 TYR 25 HE1 TYR 25 4.968 4.381 4.992 165 HE2 TYR 25 HE2 TYR 25 8.711 6.103 6.096 166 HH TYR 25 HH TYR 25 8.263 3.785 5.820 167 H GLN 26 H GLN 26 5.362 11.964 6.296 168 HA GLN 26 HA GLN 26 2.973 12.887 7.357 169 1HB GLN 26 1HB GLN 26 5.103 13.930 7.887 170 2HB GLN 26 2HB GLN 26 5.302 14.451 6.221 171 1HG GLN 26 1HG GLN 26 4.633 16.290 7.653 172 2HG GLN 26 2HG GLN 26 3.400 15.944 6.442 173 1HE2 GLN 26 1HE2 GLN 26 1.779 16.911 7.622 174 2HE2 GLN 26 2HE2 GLN 26 1.119 16.202 9.059 175 H TRP 27 H TRP 27 4.405 13.745 4.209 176 HA TRP 27 HA TRP 27 2.145 15.204 3.308 177 1HB TRP 27 1HB TRP 27 4.426 15.549 2.428 178 2HB TRP 27 2HB TRP 27 4.392 13.939 1.719 179 HD1 TRP 27 HD1 TRP 27 2.619 17.357 1.346 180 HE1 TRP 27 HE1 TRP 27 1.822 17.586 -1.094 181 HE3 TRP 27 HE3 TRP 27 3.885 12.704 -0.354 182 HZ2 TRP 27 HZ2 TRP 27 1.748 15.998 -3.424 183 HZ3 TRP 27 HZ3 TRP 27 3.420 12.141 -2.699 184 HH2 TRP 27 HH2 TRP 27 2.371 13.754 -4.205 185 H PHE 28 H PHE 28 3.222 11.884 2.930 186 HA PHE 28 HA PHE 28 1.489 10.979 0.968 187 1HB PHE 28 1HB PHE 28 3.357 9.660 1.819 188 2HB PHE 28 2HB PHE 28 2.567 9.513 3.383 189 HD1 PHE 28 HD1 PHE 28 1.556 7.515 3.831 190 HD2 PHE 28 HD2 PHE 28 1.778 8.838 -0.209 191 HE1 PHE 28 HE1 PHE 28 0.487 5.428 3.089 192 HE2 PHE 28 HE2 PHE 28 0.706 6.753 -0.954 193 HZ PHE 28 HZ PHE 28 0.062 5.044 0.698 194 H TYR 29 H TYR 29 1.001 10.814 4.510 195 HA TYR 29 HA TYR 29 -1.649 9.800 4.250 196 1HB TYR 29 1HB TYR 29 -0.142 10.943 6.601 197 2HB TYR 29 2HB TYR 29 -1.794 10.345 6.725 198 HD1 TYR 29 HD1 TYR 29 1.551 9.472 7.163 199 HD2 TYR 29 HD2 TYR 29 -2.106 7.903 5.658 200 HE1 TYR 29 HE1 TYR 29 2.401 7.187 7.489 201 HE2 TYR 29 HE2 TYR 29 -1.262 5.616 5.976 202 HH TYR 29 HH TYR 29 1.511 4.921 7.803 203 H SER 30 H SER 30 -0.315 13.021 4.460 204 HA SER 30 HA SER 30 -2.663 14.407 5.149 205 1HB SER 30 1HB SER 30 -0.309 15.305 3.467 206 2HB SER 30 2HB SER 30 -1.568 16.379 4.078 207 HG SER 30 HG SER 30 0.325 14.868 5.558 208 H GLU 31 H GLU 31 -1.266 13.693 1.942 209 HA GLU 31 HA GLU 31 -3.460 14.800 0.526 210 1HB GLU 31 1HB GLU 31 -1.212 12.980 -0.286 211 2HB GLU 31 2HB GLU 31 -2.492 13.424 -1.409 212 1HG GLU 31 1HG GLU 31 -0.579 15.283 -0.021 213 2HG GLU 31 2HG GLU 31 -0.621 14.880 -1.738 214 H LEU 32 H LEU 32 -2.781 11.598 1.784 215 HA LEU 32 HA LEU 32 -4.794 10.195 0.446 216 1HB LEU 32 1HB LEU 32 -3.685 9.829 3.222 217 2HB LEU 32 2HB LEU 32 -4.864 8.740 2.510 218 HG LEU 32 HG LEU 32 -2.069 9.258 1.487 219 1HD1 LEU 32 1HD1 LEU 32 -1.683 6.930 2.111 220 2HD1 LEU 32 2HD1 LEU 32 -3.324 6.825 2.751 221 3HD1 LEU 32 3HD1 LEU 32 -2.149 7.898 3.509 222 1HD2 LEU 32 1HD2 LEU 32 -4.233 7.436 0.434 223 2HD2 LEU 32 2HD2 LEU 32 -2.563 7.474 -0.130 224 3HD2 LEU 32 3HD2 LEU 32 -3.605 8.880 -0.360 225 H LYS 33 H LYS 33 -4.968 11.724 3.672 226 HA LYS 33 HA LYS 33 -7.698 11.275 4.056 227 1HB LYS 33 1HB LYS 33 -6.161 11.921 5.867 228 2HB LYS 33 2HB LYS 33 -6.009 13.526 5.167 229 1HG LYS 33 1HG LYS 33 -8.732 12.565 5.835 230 2HG LYS 33 2HG LYS 33 -7.663 13.009 7.165 231 1HD LYS 33 1HD LYS 33 -7.533 15.228 6.484 232 2HD LYS 33 2HD LYS 33 -8.019 14.851 4.831 233 1HE LYS 33 1HE LYS 33 -9.838 14.582 7.217 234 2HE LYS 33 2HE LYS 33 -9.758 16.024 6.206 235 1HZ LYS 33 1HZ LYS 33 -10.436 13.307 5.213 236 2HZ LYS 33 2HZ LYS 33 -10.465 14.743 4.314 237 3HZ LYS 33 3HZ LYS 33 -11.573 14.510 5.577 238 H ARG 34 H ARG 34 -6.046 13.888 2.361 239 HA ARG 34 HA ARG 34 -8.274 15.624 2.177 240 1HB ARG 34 1HB ARG 34 -5.818 15.381 0.447 241 2HB ARG 34 2HB ARG 34 -7.028 16.635 0.237 242 1HG ARG 34 1HG ARG 34 -6.588 17.394 2.546 243 2HG ARG 34 2HG ARG 34 -5.297 16.193 2.655 244 1HD ARG 34 1HD ARG 34 -4.352 18.347 2.092 245 2HD ARG 34 2HD ARG 34 -4.193 17.254 0.718 246 HE ARG 34 HE ARG 34 -6.531 18.976 0.692 247 1HH1 ARG 34 1HH1 ARG 34 -3.267 18.406 -0.449 248 2HH1 ARG 34 2HH1 ARG 34 -3.355 19.632 -1.681 249 1HH2 ARG 34 1HH2 ARG 34 -6.666 20.547 -0.951 250 2HH2 ARG 34 2HH2 ARG 34 -5.292 20.842 -1.979 251 H HIS 35 H HIS 35 -7.144 12.991 0.123 252 HA HIS 35 HA HIS 35 -9.255 13.632 -1.827 253 1HB HIS 35 1HB HIS 35 -6.816 11.867 -2.182 254 2HB HIS 35 2HB HIS 35 -7.987 12.265 -3.428 255 HD1 HIS 35 HD1 HIS 35 -7.313 14.131 -4.915 256 HD2 HIS 35 HD2 HIS 35 -5.418 14.329 -1.227 257 HE1 HIS 35 HE1 HIS 35 -5.660 16.021 -5.102 258 HE2 HIS 35 HE2 HIS 35 -4.366 15.957 -2.929 259 H ASN 36 H ASN 36 -7.623 10.826 -0.413 260 HA ASN 36 HA ASN 36 -9.978 9.169 -0.932 261 1HB ASN 36 1HB ASN 36 -7.842 8.295 -1.731 262 2HB ASN 36 2HB ASN 36 -7.153 8.445 -0.121 263 1HD2 ASN 36 1HD2 ASN 36 -6.652 6.294 -0.002 264 2HD2 ASN 36 2HD2 ASN 36 -7.845 5.066 0.204 265 H VAL 37 H VAL 37 -11.245 10.039 0.756 266 HA VAL 37 HA VAL 37 -10.367 9.889 3.487 267 HB VAL 37 HB VAL 37 -13.202 10.246 2.495 268 1HG1 VAL 37 1HG1 VAL 37 -11.857 11.091 5.061 269 2HG1 VAL 37 2HG1 VAL 37 -13.013 9.771 4.876 270 3HG1 VAL 37 3HG1 VAL 37 -13.526 11.437 4.610 271 1HG2 VAL 37 1HG2 VAL 37 -11.758 11.878 1.406 272 2HG2 VAL 37 2HG2 VAL 37 -11.109 12.365 2.971 273 3HG2 VAL 37 3HG2 VAL 37 -12.807 12.658 2.590 274 H SER 38 H SER 38 -11.694 7.676 1.258 275 HA SER 38 HA SER 38 -12.990 6.074 3.315 276 1HB SER 38 1HB SER 38 -12.852 5.557 0.339 277 2HB SER 38 2HB SER 38 -13.923 4.780 1.506 278 HG SER 38 HG SER 38 -15.053 6.643 1.736 279 H HIS 39 H HIS 39 -11.140 4.881 0.504 280 HA HIS 39 HA HIS 39 -8.999 3.772 1.934 281 1HB HIS 39 1HB HIS 39 -9.671 1.380 1.964 282 2HB HIS 39 2HB HIS 39 -10.611 2.381 3.063 283 HD1 HIS 39 HD1 HIS 39 -13.055 2.106 2.949 284 HD2 HIS 39 HD2 HIS 39 -11.182 0.781 -0.518 285 HE1 HIS 39 HE1 HIS 39 -14.870 1.069 1.550 286 HE2 HIS 39 HE2 HIS 39 -13.658 0.044 -0.408 287 H TYR 40 H TYR 40 -7.630 2.413 0.638 288 HA TYR 40 HA TYR 40 -8.418 2.300 -2.200 289 1HB TYR 40 1HB TYR 40 -6.169 2.849 -2.891 290 2HB TYR 40 2HB TYR 40 -6.766 4.108 -1.821 291 HD1 TYR 40 HD1 TYR 40 -4.284 1.474 -2.278 292 HD2 TYR 40 HD2 TYR 40 -5.824 4.365 0.437 293 HE1 TYR 40 HE1 TYR 40 -2.246 1.265 -0.913 294 HE2 TYR 40 HE2 TYR 40 -3.797 4.161 1.808 295 HH TYR 40 HH TYR 40 -0.997 2.575 0.726 296 H ILE 41 H ILE 41 -8.000 0.453 -3.276 297 HA ILE 41 HA ILE 41 -6.772 -1.742 -1.747 298 HB ILE 41 HB ILE 41 -8.566 -1.915 -4.183 299 1HG1 ILE 41 1HG1 ILE 41 -10.060 -3.111 -2.399 300 2HG1 ILE 41 2HG1 ILE 41 -9.094 -2.212 -1.236 301 1HG2 ILE 41 1HG2 ILE 41 -6.980 -3.745 -4.101 302 2HG2 ILE 41 2HG2 ILE 41 -8.595 -4.334 -3.714 303 3HG2 ILE 41 3HG2 ILE 41 -7.414 -4.084 -2.428 304 1HD1 ILE 41 1HD1 ILE 41 -9.792 -0.119 -2.277 305 2HD1 ILE 41 2HD1 ILE 41 -11.177 -1.070 -1.740 306 3HD1 ILE 41 3HD1 ILE 41 -10.749 -1.020 -3.451 307 H TYR 42 H TYR 42 -4.680 -1.753 -2.178 308 HA TYR 42 HA TYR 42 -3.711 -1.075 -4.849 309 1HB TYR 42 1HB TYR 42 -2.661 0.163 -3.133 310 2HB TYR 42 2HB TYR 42 -2.458 -1.250 -2.119 311 HD1 TYR 42 HD1 TYR 42 -1.513 -1.094 -5.718 312 HD2 TYR 42 HD2 TYR 42 -0.178 -1.007 -1.681 313 HE1 TYR 42 HE1 TYR 42 0.816 -1.311 -6.483 314 HE2 TYR 42 HE2 TYR 42 2.142 -1.223 -2.433 315 HH TYR 42 HH TYR 42 3.031 -1.007 -5.802 316 H TYR 43 H TYR 43 -3.706 -2.780 -6.172 317 HA TYR 43 HA TYR 43 -2.834 -5.388 -5.229 318 1HB TYR 43 1HB TYR 43 -3.710 -4.418 -7.960 319 2HB TYR 43 2HB TYR 43 -3.211 -6.070 -7.617 320 HD1 TYR 43 HD1 TYR 43 -4.507 -7.272 -5.704 321 HD2 TYR 43 HD2 TYR 43 -5.959 -3.851 -7.776 322 HE1 TYR 43 HE1 TYR 43 -6.803 -7.850 -5.038 323 HE2 TYR 43 HE2 TYR 43 -8.257 -4.412 -7.108 324 HH TYR 43 HH TYR 43 -9.533 -6.454 -6.432 325 H LEU 44 H LEU 44 -0.795 -6.073 -5.340 326 HA LEU 44 HA LEU 44 1.215 -4.247 -6.263 327 1HB LEU 44 1HB LEU 44 1.338 -6.954 -4.958 328 2HB LEU 44 2HB LEU 44 2.778 -6.147 -5.544 329 HG LEU 44 HG LEU 44 2.070 -4.189 -4.030 330 1HD1 LEU 44 1HD1 LEU 44 0.430 -6.388 -2.785 331 2HD1 LEU 44 2HD1 LEU 44 -0.193 -4.920 -3.541 332 3HD1 LEU 44 3HD1 LEU 44 0.766 -4.814 -2.063 333 1HD2 LEU 44 1HD2 LEU 44 3.160 -5.216 -2.096 334 2HD2 LEU 44 2HD2 LEU 44 4.000 -5.582 -3.603 335 3HD2 LEU 44 3HD2 LEU 44 2.977 -6.802 -2.844 336 H ALA 45 H ALA 45 3.219 -5.653 -7.275 337 HA ALA 45 HA ALA 45 4.126 -6.571 -9.134 338 1HB ALA 45 1HB ALA 45 2.954 -8.242 -10.426 339 2HB ALA 45 2HB ALA 45 1.426 -7.803 -9.662 340 3HB ALA 45 3HB ALA 45 2.713 -8.528 -8.702 341 H THR 46 H THR 46 0.781 -5.825 -10.164 342 HA THR 46 HA THR 46 1.856 -4.381 -12.463 343 HB THR 46 HB THR 46 -0.577 -4.140 -13.078 344 HG1 THR 46 HG1 THR 46 -2.053 -4.768 -11.696 345 1HG2 THR 46 1HG2 THR 46 -0.888 -6.549 -13.630 346 2HG2 THR 46 2HG2 THR 46 0.505 -6.922 -12.611 347 3HG2 THR 46 3HG2 THR 46 0.709 -5.930 -14.056 348 H GLU 47 H GLU 47 0.710 -3.836 -9.339 349 HA GLU 47 HA GLU 47 0.364 -2.025 -8.051 350 1HB GLU 47 1HB GLU 47 1.579 -0.463 -10.335 351 2HB GLU 47 2HB GLU 47 1.330 0.130 -8.698 352 1HG GLU 47 1HG GLU 47 2.770 -2.097 -8.202 353 2HG GLU 47 2HG GLU 47 3.409 -1.634 -9.780 354 H ASN 48 H ASN 48 -1.789 -2.948 -9.219 355 HA ASN 48 HA ASN 48 -3.261 -0.743 -10.417 356 1HB ASN 48 1HB ASN 48 -4.017 -3.598 -9.793 357 2HB ASN 48 2HB ASN 48 -5.194 -2.409 -10.341 358 1HD2 ASN 48 1HD2 ASN 48 -4.388 -4.855 -11.639 359 2HD2 ASN 48 2HD2 ASN 48 -3.758 -4.396 -13.191 360 H VAL 49 H VAL 49 -3.531 0.786 -8.906 361 HA VAL 49 HA VAL 49 -4.427 0.032 -6.224 362 HB VAL 49 HB VAL 49 -3.773 2.814 -7.198 363 1HG1 VAL 49 1HG1 VAL 49 -3.825 1.598 -4.439 364 2HG1 VAL 49 2HG1 VAL 49 -5.026 2.698 -5.117 365 3HG1 VAL 49 3HG1 VAL 49 -3.380 3.259 -4.824 366 1HG2 VAL 49 1HG2 VAL 49 -1.899 0.795 -5.971 367 2HG2 VAL 49 2HG2 VAL 49 -1.529 2.497 -6.240 368 3HG2 VAL 49 3HG2 VAL 49 -1.827 1.434 -7.615 369 H HIS 50 H HIS 50 -6.564 -0.261 -6.098 370 HA HIS 50 HA HIS 50 -8.377 1.447 -7.621 371 1HB HIS 50 1HB HIS 50 -8.782 -1.013 -5.924 372 2HB HIS 50 2HB HIS 50 -10.140 -0.034 -6.461 373 HD1 HIS 50 HD1 HIS 50 -11.239 -1.265 -8.287 374 HD2 HIS 50 HD2 HIS 50 -7.091 -1.460 -8.577 375 HE1 HIS 50 HE1 HIS 50 -10.760 -2.539 -10.404 376 HE2 HIS 50 HE2 HIS 50 -8.253 -2.784 -10.474 377 H ILE 51 H ILE 51 -8.324 3.441 -6.662 378 HA ILE 51 HA ILE 51 -8.595 3.637 -3.766 379 HB ILE 51 HB ILE 51 -8.287 5.819 -5.829 380 1HG1 ILE 51 1HG1 ILE 51 -6.203 4.600 -4.007 381 2HG1 ILE 51 2HG1 ILE 51 -6.379 4.212 -5.718 382 1HG2 ILE 51 1HG2 ILE 51 -7.619 7.197 -3.896 383 2HG2 ILE 51 2HG2 ILE 51 -8.033 5.858 -2.825 384 3HG2 ILE 51 3HG2 ILE 51 -9.287 6.638 -3.788 385 1HD1 ILE 51 1HD1 ILE 51 -4.598 5.811 -5.345 386 2HD1 ILE 51 2HD1 ILE 51 -5.736 6.916 -4.578 387 3HD1 ILE 51 3HD1 ILE 51 -5.903 6.526 -6.291 388 H VAL 52 H VAL 52 -10.639 3.391 -3.067 389 HA VAL 52 HA VAL 52 -12.863 4.447 -4.603 390 HB VAL 52 HB VAL 52 -12.912 3.100 -1.897 391 1HG1 VAL 52 1HG1 VAL 52 -15.281 2.724 -2.378 392 2HG1 VAL 52 2HG1 VAL 52 -15.114 3.609 -3.893 393 3HG1 VAL 52 3HG1 VAL 52 -14.894 4.444 -2.353 394 1HG2 VAL 52 1HG2 VAL 52 -13.332 1.914 -4.639 395 2HG2 VAL 52 2HG2 VAL 52 -13.592 1.075 -3.108 396 3HG2 VAL 52 3HG2 VAL 52 -11.970 1.599 -3.563 397 H LEU 53 H LEU 53 -13.256 6.541 -4.467 398 HA LEU 53 HA LEU 53 -12.335 8.133 -2.266 399 1HB LEU 53 1HB LEU 53 -14.166 8.912 -4.537 400 2HB LEU 53 2HB LEU 53 -13.322 10.009 -3.463 401 HG LEU 53 HG LEU 53 -12.057 8.176 -5.498 402 1HD1 LEU 53 1HD1 LEU 53 -13.176 10.098 -6.487 403 2HD1 LEU 53 2HD1 LEU 53 -11.423 10.256 -6.612 404 3HD1 LEU 53 3HD1 LEU 53 -12.306 11.178 -5.396 405 1HD2 LEU 53 1HD2 LEU 53 -10.643 8.405 -3.520 406 2HD2 LEU 53 2HD2 LEU 53 -10.778 10.161 -3.617 407 3HD2 LEU 53 3HD2 LEU 53 -9.953 9.269 -4.894 408 H LYS 54 H LYS 54 -13.876 9.759 -1.270 409 HA LYS 54 HA LYS 54 -15.949 8.395 0.114 410 1HB LYS 54 1HB LYS 54 -16.325 10.468 1.265 411 2HB LYS 54 2HB LYS 54 -14.589 10.290 1.044 412 1HG LYS 54 1HG LYS 54 -14.680 11.830 -0.859 413 2HG LYS 54 2HG LYS 54 -16.418 12.014 -0.617 414 1HD LYS 54 1HD LYS 54 -15.887 12.812 1.718 415 2HD LYS 54 2HD LYS 54 -14.193 12.857 1.228 416 1HE LYS 54 1HE LYS 54 -16.459 14.407 -0.025 417 2HE LYS 54 2HE LYS 54 -15.199 15.058 1.024 418 1HZ LYS 54 1HZ LYS 54 -14.738 15.490 -1.315 419 2HZ LYS 54 2HZ LYS 54 -14.759 13.833 -1.641 420 3HZ LYS 54 3HZ LYS 54 -13.554 14.472 -0.644 421 H ASN 55 H ASN 55 -15.830 9.672 -2.923 422 HA ASN 55 HA ASN 55 -18.668 10.427 -2.998 423 1HB ASN 55 1HB ASN 55 -16.890 12.039 -3.839 424 2HB ASN 55 2HB ASN 55 -16.580 10.891 -5.136 425 1HD2 ASN 55 1HD2 ASN 55 -19.697 11.741 -3.719 426 2HD2 ASN 55 2HD2 ASN 55 -20.364 12.413 -5.164 427 H ASP 56 H ASP 56 -17.298 7.706 -3.018 428 HA ASP 56 HA ASP 56 -17.926 5.655 -3.766 429 1HB ASP 56 1HB ASP 56 -20.184 6.407 -4.126 430 2HB ASP 56 2HB ASP 56 -19.733 7.208 -5.625 431 H ASN 57 H ASN 57 -17.053 8.062 -6.161 432 HA ASN 57 HA ASN 57 -16.364 6.406 -8.292 433 1HB ASN 57 1HB ASN 57 -16.524 8.854 -8.475 434 2HB ASN 57 2HB ASN 57 -15.086 9.027 -7.476 435 1HD2 ASN 57 1HD2 ASN 57 -13.936 10.096 -9.048 436 2HD2 ASN 57 2HD2 ASN 57 -13.343 9.323 -10.474 437 H THR 58 H THR 58 -14.658 5.147 -8.762 438 HA THR 58 HA THR 58 -12.541 4.992 -6.738 439 HB THR 58 HB THR 58 -13.312 2.907 -8.785 440 HG1 THR 58 HG1 THR 58 -14.614 3.539 -6.640 441 1HG2 THR 58 1HG2 THR 58 -10.954 2.813 -8.104 442 2HG2 THR 58 2HG2 THR 58 -11.854 1.430 -7.483 443 3HG2 THR 58 3HG2 THR 58 -11.446 2.770 -6.410 444 H VAL 59 H VAL 59 -10.681 5.866 -7.253 445 HA VAL 59 HA VAL 59 -9.942 6.284 -10.046 446 HB VAL 59 HB VAL 59 -8.381 7.047 -7.572 447 1HG1 VAL 59 1HG1 VAL 59 -7.261 8.633 -9.045 448 2HG1 VAL 59 2HG1 VAL 59 -8.244 8.082 -10.402 449 3HG1 VAL 59 3HG1 VAL 59 -7.086 6.985 -9.649 450 1HG2 VAL 59 1HG2 VAL 59 -9.327 9.290 -7.814 451 2HG2 VAL 59 2HG2 VAL 59 -10.578 8.091 -7.480 452 3HG2 VAL 59 3HG2 VAL 59 -10.364 8.710 -9.119 453 H LEU 60 H LEU 60 -9.200 4.416 -10.934 454 HA LEU 60 HA LEU 60 -7.477 2.720 -9.313 455 1HB LEU 60 1HB LEU 60 -7.680 1.081 -11.157 456 2HB LEU 60 2HB LEU 60 -9.206 1.516 -10.422 457 HG LEU 60 HG LEU 60 -9.252 3.227 -12.479 458 1HD1 LEU 60 1HD1 LEU 60 -7.104 2.557 -13.377 459 2HD1 LEU 60 2HD1 LEU 60 -8.401 2.113 -14.487 460 3HD1 LEU 60 3HD1 LEU 60 -7.645 0.880 -13.474 461 1HD2 LEU 60 1HD2 LEU 60 -10.988 1.622 -11.935 462 2HD2 LEU 60 2HD2 LEU 60 -10.006 0.309 -12.586 463 3HD2 LEU 60 3HD2 LEU 60 -10.622 1.564 -13.660 464 H LEU 61 H LEU 61 -5.386 2.684 -9.477 465 HA LEU 61 HA LEU 61 -4.106 4.195 -11.653 466 1HB LEU 61 1HB LEU 61 -2.873 3.295 -9.048 467 2HB LEU 61 2HB LEU 61 -2.213 4.445 -10.192 468 HG LEU 61 HG LEU 61 -4.680 4.899 -8.515 469 1HD1 LEU 61 1HD1 LEU 61 -1.884 5.979 -8.225 470 2HD1 LEU 61 2HD1 LEU 61 -2.652 4.794 -7.168 471 3HD1 LEU 61 3HD1 LEU 61 -3.281 6.439 -7.248 472 1HD2 LEU 61 1HD2 LEU 61 -3.123 6.760 -10.306 473 2HD2 LEU 61 2HD2 LEU 61 -4.479 7.215 -9.273 474 3HD2 LEU 61 3HD2 LEU 61 -4.732 6.115 -10.630 475 H LYS 62 H LYS 62 -2.525 3.232 -12.904 476 HA LYS 62 HA LYS 62 -1.683 0.537 -12.100 477 1HB LYS 62 1HB LYS 62 -1.237 0.096 -14.537 478 2HB LYS 62 2HB LYS 62 -2.932 0.228 -14.102 479 1HG LYS 62 1HG LYS 62 -3.018 2.478 -15.002 480 2HG LYS 62 2HG LYS 62 -1.291 2.412 -15.370 481 1HD LYS 62 1HD LYS 62 -2.613 1.976 -17.371 482 2HD LYS 62 2HD LYS 62 -1.693 0.545 -16.905 483 1HE LYS 62 1HE LYS 62 -3.701 -0.372 -15.826 484 2HE LYS 62 2HE LYS 62 -4.617 1.040 -16.349 485 1HZ LYS 62 1HZ LYS 62 -4.181 0.433 -18.647 486 2HZ LYS 62 2HZ LYS 62 -4.954 -0.840 -17.830 487 3HZ LYS 62 3HZ LYS 62 -3.291 -0.924 -18.142 488 H GLY 63 H GLY 63 0.219 0.785 -11.190 489 1HA GLY 63 1HA GLY 63 1.961 2.953 -11.606 490 2HA GLY 63 2HA GLY 63 2.384 1.442 -10.812 491 H LEU 64 H LEU 64 2.327 -0.424 -12.603 492 HA LEU 64 HA LEU 64 3.513 -1.478 -14.190 493 1HB LEU 64 1HB LEU 64 3.329 -0.619 -16.465 494 2HB LEU 64 2HB LEU 64 1.811 -0.562 -15.600 495 HG LEU 64 HG LEU 64 2.426 1.943 -15.196 496 1HD1 LEU 64 1HD1 LEU 64 4.075 1.374 -17.653 497 2HD1 LEU 64 2HD1 LEU 64 4.719 1.788 -16.064 498 3HD1 LEU 64 3HD1 LEU 64 3.743 2.958 -16.953 499 1HD2 LEU 64 1HD2 LEU 64 1.571 0.885 -17.883 500 2HD2 LEU 64 2HD2 LEU 64 1.334 2.538 -17.313 501 3HD2 LEU 64 3HD2 LEU 64 0.527 1.201 -16.495 502 H LYS 65 H LYS 65 4.957 0.915 -12.670 503 HA LYS 65 HA LYS 65 7.350 0.832 -14.383 504 1HB LYS 65 1HB LYS 65 8.076 2.893 -13.275 505 2HB LYS 65 2HB LYS 65 6.506 3.099 -14.035 506 1HG LYS 65 1HG LYS 65 5.482 2.693 -11.771 507 2HG LYS 65 2HG LYS 65 7.114 2.794 -11.106 508 1HD LYS 65 1HD LYS 65 5.736 4.950 -12.707 509 2HD LYS 65 2HD LYS 65 5.921 4.939 -10.955 510 1HE LYS 65 1HE LYS 65 8.212 4.911 -12.917 511 2HE LYS 65 2HE LYS 65 7.574 6.367 -12.153 512 1HZ LYS 65 1HZ LYS 65 8.810 4.053 -10.760 513 2HZ LYS 65 2HZ LYS 65 8.124 5.397 -9.986 514 3HZ LYS 65 3HZ LYS 65 9.497 5.590 -10.967 515 H ASN 66 H ASN 66 6.117 -0.813 -12.017 516 HA ASN 66 HA ASN 66 8.693 -1.648 -11.032 517 1HB ASN 66 1HB ASN 66 8.042 0.142 -9.423 518 2HB ASN 66 2HB ASN 66 6.564 -0.746 -9.071 519 1HD2 ASN 66 1HD2 ASN 66 6.657 -2.577 -7.817 520 2HD2 ASN 66 2HD2 ASN 66 8.062 -3.019 -6.907 521 H ILE 67 H ILE 67 7.992 -3.419 -12.342 522 HA ILE 67 HA ILE 67 5.647 -4.897 -11.485 523 HB ILE 67 HB ILE 67 7.641 -5.655 -13.628 524 1HG1 ILE 67 1HG1 ILE 67 6.610 -3.483 -14.151 525 2HG1 ILE 67 2HG1 ILE 67 6.032 -4.734 -15.243 526 1HG2 ILE 67 1HG2 ILE 67 5.854 -7.102 -14.451 527 2HG2 ILE 67 2HG2 ILE 67 4.816 -6.590 -13.120 528 3HG2 ILE 67 3HG2 ILE 67 6.283 -7.510 -12.789 529 1HD1 ILE 67 1HD1 ILE 67 4.243 -3.240 -14.555 530 2HD1 ILE 67 2HD1 ILE 67 4.539 -3.655 -12.867 531 3HD1 ILE 67 3HD1 ILE 67 3.954 -4.886 -13.986 532 H VAL 68 H VAL 68 6.072 -5.765 -9.523 533 HA VAL 68 HA VAL 68 8.504 -7.367 -9.219 534 HB VAL 68 HB VAL 68 8.133 -5.720 -7.460 535 1HG1 VAL 68 1HG1 VAL 68 5.555 -7.179 -6.906 536 2HG1 VAL 68 2HG1 VAL 68 5.714 -5.548 -7.560 537 3HG1 VAL 68 3HG1 VAL 68 6.245 -5.895 -5.912 538 1HG2 VAL 68 1HG2 VAL 68 7.713 -8.540 -6.477 539 2HG2 VAL 68 2HG2 VAL 68 8.307 -7.189 -5.513 540 3HG2 VAL 68 3HG2 VAL 68 9.263 -7.791 -6.866 541 H SER 69 H SER 69 8.462 -9.525 -8.973 542 HA SER 69 HA SER 69 6.128 -10.955 -9.720 543 1HB SER 69 1HB SER 69 8.631 -12.104 -8.472 544 2HB SER 69 2HB SER 69 7.488 -12.917 -9.541 545 HG SER 69 HG SER 69 8.135 -11.270 -11.138 546 H VAL 70 H VAL 70 4.446 -10.895 -8.338 547 HA VAL 70 HA VAL 70 4.880 -11.359 -5.487 548 HB VAL 70 HB VAL 70 2.276 -10.805 -6.915 549 1HG1 VAL 70 1HG1 VAL 70 1.477 -10.142 -4.702 550 2HG1 VAL 70 2HG1 VAL 70 3.045 -10.558 -4.010 551 3HG1 VAL 70 3HG1 VAL 70 2.029 -11.818 -4.711 552 1HG2 VAL 70 1HG2 VAL 70 4.112 -8.841 -5.553 553 2HG2 VAL 70 2HG2 VAL 70 2.531 -8.480 -6.241 554 3HG2 VAL 70 3HG2 VAL 70 3.859 -8.976 -7.293 555 H LYS 71 H LYS 71 4.303 -13.222 -4.464 556 HA LYS 71 HA LYS 71 3.409 -15.410 -6.194 557 1HB LYS 71 1HB LYS 71 4.764 -15.421 -3.500 558 2HB LYS 71 2HB LYS 71 4.160 -16.870 -4.288 559 1HG LYS 71 1HG LYS 71 5.666 -16.394 -6.202 560 2HG LYS 71 2HG LYS 71 6.333 -15.041 -5.283 561 1HD LYS 71 1HD LYS 71 7.010 -16.580 -3.510 562 2HD LYS 71 2HD LYS 71 6.338 -17.931 -4.423 563 1HE LYS 71 1HE LYS 71 7.930 -17.499 -6.226 564 2HE LYS 71 2HE LYS 71 8.596 -16.144 -5.319 565 1HZ LYS 71 1HZ LYS 71 8.651 -19.004 -4.510 566 2HZ LYS 71 2HZ LYS 71 9.212 -17.721 -3.557 567 3HZ LYS 71 3HZ LYS 71 9.976 -18.077 -5.031 568 H PHE 72 H PHE 72 2.311 -17.171 -4.564 569 HA PHE 72 HA PHE 72 -0.094 -15.797 -3.560 570 1HB PHE 72 1HB PHE 72 0.117 -18.691 -4.415 571 2HB PHE 72 2HB PHE 72 -1.348 -17.747 -4.165 572 HD1 PHE 72 HD1 PHE 72 -1.689 -15.721 -5.735 573 HD2 PHE 72 HD2 PHE 72 1.005 -18.917 -6.532 574 HE1 PHE 72 HE1 PHE 72 -1.706 -15.134 -8.121 575 HE2 PHE 72 HE2 PHE 72 0.995 -18.332 -8.923 576 HZ PHE 72 HZ PHE 72 -0.364 -16.433 -9.721 577 H SER 73 H SER 73 2.501 -16.434 -2.239 578 HA SER 73 HA SER 73 2.053 -18.616 -0.448 579 1HB SER 73 1HB SER 73 4.130 -16.420 -0.284 580 2HB SER 73 2HB SER 73 4.197 -18.005 0.488 581 HG SER 73 HG SER 73 3.821 -18.371 -2.127 582 H LYS 74 H LYS 74 2.222 -18.307 1.929 583 HA LYS 74 HA LYS 74 0.909 -15.830 2.828 584 1HB LYS 74 1HB LYS 74 0.460 -18.647 3.842 585 2HB LYS 74 2HB LYS 74 -0.150 -17.206 4.638 586 1HG LYS 74 1HG LYS 74 -1.971 -18.015 3.441 587 2HG LYS 74 2HG LYS 74 -1.345 -16.716 2.426 588 1HD LYS 74 1HD LYS 74 -0.227 -18.323 1.003 589 2HD LYS 74 2HD LYS 74 -0.725 -19.646 2.060 590 1HE LYS 74 1HE LYS 74 -2.579 -17.848 0.497 591 2HE LYS 74 2HE LYS 74 -2.127 -19.493 0.052 592 1HZ LYS 74 1HZ LYS 74 -3.694 -18.638 2.426 593 2HZ LYS 74 2HZ LYS 74 -3.093 -20.211 2.220 594 3HZ LYS 74 3HZ LYS 74 -4.223 -19.588 1.123 595 H ASP 75 H ASP 75 3.074 -15.030 3.203 596 HA ASP 75 HA ASP 75 4.422 -16.301 5.478 597 1HB ASP 75 1HB ASP 75 5.400 -14.532 3.262 598 2HB ASP 75 2HB ASP 75 6.306 -14.676 4.759 599 H ARG 76 H ARG 76 3.009 -15.426 7.037 600 HA ARG 76 HA ARG 76 2.614 -12.623 7.335 601 1HB ARG 76 1HB ARG 76 1.055 -14.180 8.362 602 2HB ARG 76 2HB ARG 76 2.340 -14.866 9.346 603 1HG ARG 76 1HG ARG 76 2.609 -12.672 10.453 604 2HG ARG 76 2HG ARG 76 1.228 -12.078 9.528 605 1HD ARG 76 1HD ARG 76 1.126 -14.465 11.358 606 2HD ARG 76 2HD ARG 76 0.699 -12.831 11.859 607 HE ARG 76 HE ARG 76 -0.840 -13.284 9.652 608 1HH1 ARG 76 1HH1 ARG 76 -0.359 -14.889 12.722 609 2HH1 ARG 76 2HH1 ARG 76 -1.976 -15.529 12.793 610 1HH2 ARG 76 1HH2 ARG 76 -2.966 -14.130 9.728 611 2HH2 ARG 76 2HH2 ARG 76 -3.458 -15.109 11.080 612 H HIS 77 H HIS 77 4.947 -14.946 8.583 613 HA HIS 77 HA HIS 77 6.153 -13.281 10.508 614 1HB HIS 77 1HB HIS 77 7.128 -15.679 8.981 615 2HB HIS 77 2HB HIS 77 8.204 -14.800 10.059 616 HD1 HIS 77 HD1 HIS 77 5.938 -17.580 10.049 617 HD2 HIS 77 HD2 HIS 77 7.004 -14.647 12.806 618 HE1 HIS 77 HE1 HIS 77 5.282 -18.485 12.300 619 HE2 HIS 77 HE2 HIS 77 6.104 -16.782 13.958 620 H LEU 78 H LEU 78 6.559 -13.511 7.044 621 HA LEU 78 HA LEU 78 8.949 -11.941 6.965 622 1HB LEU 78 1HB LEU 78 8.276 -13.506 5.157 623 2HB LEU 78 2HB LEU 78 6.937 -12.444 4.770 624 HG LEU 78 HG LEU 78 8.507 -10.666 4.149 625 1HD1 LEU 78 1HD1 LEU 78 10.335 -11.231 5.656 626 2HD1 LEU 78 2HD1 LEU 78 10.903 -11.138 3.988 627 3HD1 LEU 78 3HD1 LEU 78 10.644 -12.711 4.747 628 1HD2 LEU 78 1HD2 LEU 78 7.738 -12.232 2.447 629 2HD2 LEU 78 2HD2 LEU 78 9.092 -13.301 2.809 630 3HD2 LEU 78 3HD2 LEU 78 9.390 -11.703 2.124 631 H ILE 79 H ILE 79 5.493 -11.299 6.698 632 HA ILE 79 HA ILE 79 5.632 -8.542 6.156 633 HB ILE 79 HB ILE 79 3.554 -9.983 7.822 634 1HG1 ILE 79 1HG1 ILE 79 3.528 -9.371 4.858 635 2HG1 ILE 79 2HG1 ILE 79 3.893 -10.950 5.545 636 1HG2 ILE 79 1HG2 ILE 79 3.391 -7.367 6.327 637 2HG2 ILE 79 2HG2 ILE 79 3.486 -7.551 8.078 638 3HG2 ILE 79 3HG2 ILE 79 2.071 -8.141 7.206 639 1HD1 ILE 79 1HD1 ILE 79 1.643 -11.003 6.542 640 2HD1 ILE 79 2HD1 ILE 79 1.617 -10.893 4.781 641 3HD1 ILE 79 3HD1 ILE 79 1.288 -9.463 5.758 642 H GLU 80 H GLU 80 5.432 -10.320 9.215 643 HA GLU 80 HA GLU 80 5.480 -8.178 10.982 644 1HB GLU 80 1HB GLU 80 6.649 -10.941 11.353 645 2HB GLU 80 2HB GLU 80 6.257 -9.816 12.641 646 1HG GLU 80 1HG GLU 80 3.893 -9.912 11.994 647 2HG GLU 80 2HG GLU 80 4.304 -11.075 10.735 648 H THR 81 H THR 81 8.202 -10.078 9.686 649 HA THR 81 HA THR 81 10.180 -8.651 11.112 650 HB THR 81 HB THR 81 11.737 -9.613 9.305 651 HG1 THR 81 HG1 THR 81 9.562 -11.306 8.714 652 1HG2 THR 81 1HG2 THR 81 10.018 -11.473 10.954 653 2HG2 THR 81 2HG2 THR 81 11.451 -10.611 11.520 654 3HG2 THR 81 3HG2 THR 81 11.602 -11.857 10.282 655 H THR 82 H THR 82 8.797 -8.224 7.872 656 HA THR 82 HA THR 82 10.556 -6.185 7.028 657 HB THR 82 HB THR 82 7.678 -6.650 6.197 658 HG1 THR 82 HG1 THR 82 8.887 -8.460 5.704 659 1HG2 THR 82 1HG2 THR 82 8.276 -5.443 4.151 660 2HG2 THR 82 2HG2 THR 82 9.889 -5.132 4.796 661 3HG2 THR 82 3HG2 THR 82 8.475 -4.413 5.569 662 H SER 83 H SER 83 7.477 -6.069 8.787 663 HA SER 83 HA SER 83 7.190 -3.281 8.893 664 1HB SER 83 1HB SER 83 5.409 -4.866 9.540 665 2HB SER 83 2HB SER 83 6.350 -5.349 10.952 666 HG SER 83 HG SER 83 4.820 -3.082 10.501 667 H ASN 84 H ASN 84 8.714 -5.518 11.211 668 HA ASN 84 HA ASN 84 9.675 -3.564 12.985 669 1HB ASN 84 1HB ASN 84 10.508 -6.392 12.388 670 2HB ASN 84 2HB ASN 84 11.398 -5.412 13.543 671 1HD2 ASN 84 1HD2 ASN 84 8.385 -7.026 12.867 672 2HD2 ASN 84 2HD2 ASN 84 7.769 -6.970 14.485 673 H LYS 85 H LYS 85 11.059 -5.019 10.110 674 HA LYS 85 HA LYS 85 13.643 -3.936 10.248 675 1HB LYS 85 1HB LYS 85 13.118 -5.761 8.773 676 2HB LYS 85 2HB LYS 85 11.909 -4.810 7.931 677 1HG LYS 85 1HG LYS 85 13.687 -3.379 7.028 678 2HG LYS 85 2HG LYS 85 14.891 -4.382 7.850 679 1HD LYS 85 1HD LYS 85 14.282 -6.296 6.559 680 2HD LYS 85 2HD LYS 85 12.873 -5.473 5.893 681 1HE LYS 85 1HE LYS 85 14.382 -3.887 4.755 682 2HE LYS 85 2HE LYS 85 15.763 -4.787 5.380 683 1HZ LYS 85 1HZ LYS 85 13.662 -6.004 3.672 684 2HZ LYS 85 2HZ LYS 85 15.153 -6.681 4.117 685 3HZ LYS 85 3HZ LYS 85 15.106 -5.354 3.060 686 H LEU 86 H LEU 86 10.639 -2.629 8.936 687 HA LEU 86 HA LEU 86 11.799 -0.328 7.738 688 1HB LEU 86 1HB LEU 86 9.578 -1.152 7.119 689 2HB LEU 86 2HB LEU 86 8.989 -0.825 8.738 690 HG LEU 86 HG LEU 86 9.394 1.599 8.349 691 1HD1 LEU 86 1HD1 LEU 86 11.116 1.431 6.643 692 2HD1 LEU 86 2HD1 LEU 86 9.747 2.372 6.050 693 3HD1 LEU 86 3HD1 LEU 86 9.962 0.701 5.527 694 1HD2 LEU 86 1HD2 LEU 86 7.465 1.927 6.908 695 2HD2 LEU 86 2HD2 LEU 86 7.185 0.596 8.031 696 3HD2 LEU 86 3HD2 LEU 86 7.583 0.260 6.345 697 H LYS 87 H LYS 87 10.453 -1.013 10.926 698 HA LYS 87 HA LYS 87 10.605 1.697 11.837 699 1HB LYS 87 1HB LYS 87 8.997 0.040 12.741 700 2HB LYS 87 2HB LYS 87 10.337 -0.868 13.424 701 1HG LYS 87 1HG LYS 87 9.315 0.412 15.158 702 2HG LYS 87 2HG LYS 87 10.898 1.113 14.812 703 1HD LYS 87 1HD LYS 87 9.840 2.850 13.461 704 2HD LYS 87 2HD LYS 87 8.257 2.140 13.778 705 1HE LYS 87 1HE LYS 87 10.126 3.254 15.864 706 2HE LYS 87 2HE LYS 87 8.714 4.085 15.212 707 1HZ LYS 87 1HZ LYS 87 8.704 1.558 16.783 708 2HZ LYS 87 2HZ LYS 87 7.332 2.263 16.082 709 3HZ LYS 87 3HZ LYS 87 8.171 3.077 17.309 710 H SER 88 H SER 88 12.748 -1.049 11.853 711 HA SER 88 HA SER 88 14.451 -0.018 13.920 712 1HB SER 88 1HB SER 88 15.924 -1.979 13.185 713 2HB SER 88 2HB SER 88 14.324 -2.375 13.806 714 HG SER 88 HG SER 88 13.676 -2.952 11.855 715 H ARG 89 H ARG 89 15.209 -0.843 10.517 716 HA ARG 89 HA ARG 89 17.490 0.973 10.708 717 1HB ARG 89 1HB ARG 89 16.777 -1.173 8.715 718 2HB ARG 89 2HB ARG 89 18.119 -0.064 8.470 719 1HG ARG 89 1HG ARG 89 19.140 -1.913 9.395 720 2HG ARG 89 2HG ARG 89 18.908 -0.859 10.790 721 1HD ARG 89 1HD ARG 89 16.635 -2.179 10.972 722 2HD ARG 89 2HD ARG 89 17.532 -3.397 10.066 723 HE ARG 89 HE ARG 89 18.317 -2.340 12.714 724 1HH1 ARG 89 1HH1 ARG 89 18.419 -4.838 10.266 725 2HH1 ARG 89 2HH1 ARG 89 19.104 -6.037 11.326 726 1HH2 ARG 89 1HH2 ARG 89 19.197 -3.913 14.128 727 2HH2 ARG 89 2HH2 ARG 89 19.554 -5.503 13.524 728 H GLU 90 H GLU 90 14.368 1.271 9.796 729 HA GLU 90 HA GLU 90 13.177 2.626 8.419 730 1HB GLU 90 1HB GLU 90 15.662 4.329 8.673 731 2HB GLU 90 2HB GLU 90 14.108 4.890 8.068 732 1HG GLU 90 1HG GLU 90 13.081 4.445 10.221 733 2HG GLU 90 2HG GLU 90 14.610 3.813 10.835 734 H ILE 91 H ILE 91 13.599 0.834 6.860 735 HA ILE 91 HA ILE 91 15.475 1.251 4.742 736 HB ILE 91 HB ILE 91 14.365 -0.655 3.649 737 1HG1 ILE 91 1HG1 ILE 91 12.516 -0.664 6.049 738 2HG1 ILE 91 2HG1 ILE 91 12.058 -0.092 4.448 739 1HG2 ILE 91 1HG2 ILE 91 14.920 -1.074 6.583 740 2HG2 ILE 91 2HG2 ILE 91 16.118 -1.057 5.290 741 3HG2 ILE 91 3HG2 ILE 91 14.902 -2.336 5.350 742 1HD1 ILE 91 1HD1 ILE 91 12.916 -2.893 5.135 743 2HD1 ILE 91 2HD1 ILE 91 12.423 -2.319 3.540 744 3HD1 ILE 91 3HD1 ILE 91 11.261 -2.351 4.867 745 H THR 92 H THR 92 14.511 1.025 2.411 746 HA THR 92 HA THR 92 13.046 3.439 1.930 747 HB THR 92 HB THR 92 13.402 1.394 -0.220 748 HG1 THR 92 HG1 THR 92 15.387 1.238 0.852 749 1HG2 THR 92 1HG2 THR 92 12.457 3.612 -0.712 750 2HG2 THR 92 2HG2 THR 92 14.000 3.370 -1.531 751 3HG2 THR 92 3HG2 THR 92 13.919 4.369 -0.080 752 H PHE 93 H PHE 93 10.921 3.657 1.181 753 HA PHE 93 HA PHE 93 9.093 1.754 2.198 754 1HB PHE 93 1HB PHE 93 8.621 4.173 2.085 755 2HB PHE 93 2HB PHE 93 8.559 4.074 0.332 756 HD1 PHE 93 HD1 PHE 93 6.477 3.988 -0.616 757 HD2 PHE 93 HD2 PHE 93 7.019 2.384 3.287 758 HE1 PHE 93 HE1 PHE 93 4.070 3.495 -0.486 759 HE2 PHE 93 HE2 PHE 93 4.615 1.885 3.423 760 HZ PHE 93 HZ PHE 93 3.136 2.441 1.533 761 H GLN 94 H GLN 94 10.547 2.219 -0.911 762 HA GLN 94 HA GLN 94 8.781 0.621 -2.436 763 1HB GLN 94 1HB GLN 94 10.541 0.503 -4.084 764 2HB GLN 94 2HB GLN 94 10.515 2.126 -3.413 765 1HG GLN 94 1HG GLN 94 12.418 1.561 -1.984 766 2HG GLN 94 2HG GLN 94 12.443 -0.062 -2.669 767 1HE2 GLN 94 1HE2 GLN 94 13.090 -0.342 -4.815 768 2HE2 GLN 94 2HE2 GLN 94 14.016 0.861 -5.642 769 H GLU 95 H GLU 95 11.346 -0.103 -0.202 770 HA GLU 95 HA GLU 95 11.692 -2.830 -1.022 771 1HB GLU 95 1HB GLU 95 12.512 -1.472 1.554 772 2HB GLU 95 2HB GLU 95 13.070 -3.040 0.991 773 1HG GLU 95 1HG GLU 95 14.098 -1.939 -0.957 774 2HG GLU 95 2HG GLU 95 13.600 -0.378 -0.303 775 H TYR 96 H TYR 96 10.020 -1.149 1.601 776 HA TYR 96 HA TYR 96 9.029 -3.339 2.996 777 1HB TYR 96 1HB TYR 96 8.825 -1.016 3.789 778 2HB TYR 96 2HB TYR 96 7.667 -0.674 2.511 779 HD1 TYR 96 HD1 TYR 96 5.373 -1.392 2.700 780 HD2 TYR 96 HD2 TYR 96 8.199 -2.422 5.703 781 HE1 TYR 96 HE1 TYR 96 3.541 -2.079 4.179 782 HE2 TYR 96 HE2 TYR 96 6.370 -3.120 7.197 783 HH TYR 96 HH TYR 96 3.905 -2.612 7.470 784 H ARG 97 H ARG 97 7.719 -1.692 0.156 785 HA ARG 97 HA ARG 97 5.389 -3.309 -0.026 786 1HB ARG 97 1HB ARG 97 6.775 -1.455 -1.954 787 2HB ARG 97 2HB ARG 97 5.333 -2.352 -2.406 788 1HG ARG 97 1HG ARG 97 3.978 -1.171 -0.970 789 2HG ARG 97 2HG ARG 97 5.316 -0.714 0.081 790 1HD ARG 97 1HD ARG 97 4.619 1.244 -1.070 791 2HD ARG 97 2HD ARG 97 6.158 0.750 -1.763 792 HE ARG 97 HE ARG 97 4.358 -0.378 -3.446 793 1HH1 ARG 97 1HH1 ARG 97 4.659 2.849 -2.134 794 2HH1 ARG 97 2HH1 ARG 97 4.078 3.640 -3.562 795 1HH2 ARG 97 1HH2 ARG 97 3.588 0.668 -5.370 796 2HH2 ARG 97 2HH2 ARG 97 3.451 2.398 -5.388 797 H ARG 98 H ARG 98 8.626 -3.537 -1.425 798 HA ARG 98 HA ARG 98 7.952 -5.632 -3.238 799 1HB ARG 98 1HB ARG 98 9.915 -4.099 -3.511 800 2HB ARG 98 2HB ARG 98 10.699 -4.944 -2.179 801 1HG ARG 98 1HG ARG 98 10.658 -7.012 -3.442 802 2HG ARG 98 2HG ARG 98 9.803 -6.213 -4.758 803 1HD ARG 98 1HD ARG 98 11.756 -4.675 -4.993 804 2HD ARG 98 2HD ARG 98 12.610 -5.663 -3.805 805 HE ARG 98 HE ARG 98 11.589 -7.255 -5.922 806 1HH1 ARG 98 1HH1 ARG 98 14.210 -5.056 -5.138 807 2HH1 ARG 98 2HH1 ARG 98 15.283 -5.728 -6.333 808 1HH2 ARG 98 1HH2 ARG 98 13.009 -8.120 -7.482 809 2HH2 ARG 98 2HH2 ARG 98 14.599 -7.464 -7.658 810 H ASN 99 H ASN 99 9.185 -5.527 0.055 811 HA ASN 99 HA ASN 99 9.817 -8.294 0.237 812 1HB ASN 99 1HB ASN 99 9.304 -6.168 2.315 813 2HB ASN 99 2HB ASN 99 9.601 -7.842 2.766 814 1HD2 ASN 99 1HD2 ASN 99 11.154 -6.456 -0.012 815 2HD2 ASN 99 2HD2 ASN 99 12.737 -6.358 0.668 816 H LEU 100 H LEU 100 6.914 -6.405 0.832 817 HA LEU 100 HA LEU 100 5.326 -8.458 1.933 818 1HB LEU 100 1HB LEU 100 4.676 -5.936 0.436 819 2HB LEU 100 2HB LEU 100 3.415 -7.042 0.945 820 HG LEU 100 HG LEU 100 5.374 -5.731 2.825 821 1HD1 LEU 100 1HD1 LEU 100 2.507 -5.041 2.206 822 2HD1 LEU 100 2HD1 LEU 100 3.922 -4.069 1.801 823 3HD1 LEU 100 3HD1 LEU 100 3.485 -4.328 3.490 824 1HD2 LEU 100 1HD2 LEU 100 3.810 -6.518 4.541 825 2HD2 LEU 100 2HD2 LEU 100 4.504 -7.856 3.625 826 3HD2 LEU 100 3HD2 LEU 100 2.858 -7.320 3.290 827 H ALA 101 H ALA 101 5.993 -7.500 -1.391 828 HA ALA 101 HA ALA 101 4.156 -9.131 -2.720 829 1HB ALA 101 1HB ALA 101 5.684 -8.994 -4.638 830 2HB ALA 101 2HB ALA 101 6.933 -8.334 -3.584 831 3HB ALA 101 3HB ALA 101 5.448 -7.424 -3.871 832 H LYS 102 H LYS 102 7.425 -9.815 -1.569 833 HA LYS 102 HA LYS 102 7.527 -12.489 -2.511 834 1HB LYS 102 1HB LYS 102 9.583 -11.397 -2.041 835 2HB LYS 102 2HB LYS 102 9.077 -10.984 -0.411 836 1HG LYS 102 1HG LYS 102 9.302 -13.228 0.319 837 2HG LYS 102 2HG LYS 102 9.490 -13.814 -1.335 838 1HD LYS 102 1HD LYS 102 11.632 -12.784 -1.537 839 2HD LYS 102 2HD LYS 102 11.412 -11.896 -0.026 840 1HE LYS 102 1HE LYS 102 12.917 -13.933 0.074 841 2HE LYS 102 2HE LYS 102 11.633 -13.846 1.277 842 1HZ LYS 102 1HZ LYS 102 10.387 -15.455 0.158 843 2HZ LYS 102 2HZ LYS 102 11.973 -16.053 0.126 844 3HZ LYS 102 3HZ LYS 102 11.307 -15.339 -1.262 845 H ALA 103 H ALA 103 6.161 -11.009 0.306 846 HA ALA 103 HA ALA 103 5.943 -13.430 1.835 847 1HB ALA 103 1HB ALA 103 4.624 -12.094 3.386 848 2HB ALA 103 2HB ALA 103 4.555 -10.783 2.207 849 3HB ALA 103 3HB ALA 103 6.099 -11.246 2.922 850 H GLY 104 H GLY 104 4.311 -12.255 -0.831 851 1HA GLY 104 1HA GLY 104 2.645 -13.518 -1.935 852 2HA GLY 104 2HA GLY 104 2.156 -14.186 -0.385 853 H VAL 105 H VAL 105 2.639 -10.886 -0.119 854 HA VAL 105 HA VAL 105 -0.210 -10.426 0.082 855 HB VAL 105 HB VAL 105 2.080 -8.489 0.486 856 1HG1 VAL 105 1HG1 VAL 105 -0.004 -7.336 -0.013 857 2HG1 VAL 105 2HG1 VAL 105 0.427 -7.123 1.684 858 3HG1 VAL 105 3HG1 VAL 105 -0.838 -8.265 1.232 859 1HG2 VAL 105 1HG2 VAL 105 2.209 -10.306 2.070 860 2HG2 VAL 105 2HG2 VAL 105 0.500 -10.125 2.467 861 3HG2 VAL 105 3HG2 VAL 105 1.644 -8.852 2.891 862 H PHE 106 H PHE 106 -1.192 -10.290 -1.819 863 HA PHE 106 HA PHE 106 -0.019 -8.610 -3.921 864 1HB PHE 106 1HB PHE 106 -0.682 -10.972 -4.458 865 2HB PHE 106 2HB PHE 106 -2.351 -10.531 -4.120 866 HD1 PHE 106 HD1 PHE 106 -3.639 -9.262 -5.688 867 HD2 PHE 106 HD2 PHE 106 0.470 -10.077 -6.425 868 HE1 PHE 106 HE1 PHE 106 -3.921 -8.549 -8.029 869 HE2 PHE 106 HE2 PHE 106 0.199 -9.364 -8.762 870 HZ PHE 106 HZ PHE 106 -1.997 -8.599 -9.567 871 H ARG 107 H ARG 107 -2.447 -8.674 -1.539 872 HA ARG 107 HA ARG 107 -3.923 -6.502 -2.879 873 1HB ARG 107 1HB ARG 107 -5.197 -8.612 -2.687 874 2HB ARG 107 2HB ARG 107 -4.987 -8.565 -0.945 875 1HG ARG 107 1HG ARG 107 -6.318 -6.561 -0.795 876 2HG ARG 107 2HG ARG 107 -6.453 -6.487 -2.554 877 1HD ARG 107 1HD ARG 107 -7.643 -8.615 -2.566 878 2HD ARG 107 2HD ARG 107 -7.474 -8.731 -0.816 879 HE ARG 107 HE ARG 107 -8.893 -6.701 -0.695 880 1HH1 ARG 107 1HH1 ARG 107 -8.997 -8.719 -3.551 881 2HH1 ARG 107 2HH1 ARG 107 -10.618 -8.266 -3.974 882 1HH2 ARG 107 1HH2 ARG 107 -11.037 -6.126 -1.229 883 2HH2 ARG 107 2HH2 ARG 107 -11.773 -6.787 -2.656 884 H TRP 108 H TRP 108 -3.032 -4.745 -1.995 885 HA TRP 108 HA TRP 108 -2.662 -4.557 0.906 886 1HB TRP 108 1HB TRP 108 -0.826 -3.845 -0.587 887 2HB TRP 108 2HB TRP 108 -1.896 -2.699 -1.371 888 HD1 TRP 108 HD1 TRP 108 -3.086 -1.149 1.072 889 HE1 TRP 108 HE1 TRP 108 -1.580 0.344 2.525 890 HE3 TRP 108 HE3 TRP 108 1.443 -3.242 -0.046 891 HZ2 TRP 108 HZ2 TRP 108 1.169 0.601 3.118 892 HZ3 TRP 108 HZ3 TRP 108 3.462 -2.304 0.999 893 HH2 TRP 108 HH2 TRP 108 3.327 -0.422 2.547 894 H VAL 109 H VAL 109 -4.585 -4.095 1.887 895 HA VAL 109 HA VAL 109 -6.273 -2.029 0.627 896 HB VAL 109 HB VAL 109 -7.136 -4.225 2.521 897 1HG1 VAL 109 1HG1 VAL 109 -8.481 -2.198 2.768 898 2HG1 VAL 109 2HG1 VAL 109 -9.416 -3.487 2.009 899 3HG1 VAL 109 3HG1 VAL 109 -8.772 -2.171 1.029 900 1HG2 VAL 109 1HG2 VAL 109 -6.564 -5.107 0.331 901 2HG2 VAL 109 2HG2 VAL 109 -7.590 -3.900 -0.443 902 3HG2 VAL 109 3HG2 VAL 109 -8.311 -5.147 0.574 903 H THR 110 H THR 110 -5.641 -0.175 1.581 904 HA THR 110 HA THR 110 -5.510 -0.130 4.512 905 HB THR 110 HB THR 110 -4.563 1.937 2.523 906 HG1 THR 110 HG1 THR 110 -3.449 -0.277 3.166 907 1HG2 THR 110 1HG2 THR 110 -5.304 2.949 4.644 908 2HG2 THR 110 2HG2 THR 110 -3.558 3.070 4.433 909 3HG2 THR 110 3HG2 THR 110 -4.235 1.863 5.526 910 H ASN 111 H ASN 111 -7.391 0.268 5.400 911 HA ASN 111 HA ASN 111 -9.286 2.062 4.140 912 1HB ASN 111 1HB ASN 111 -9.421 0.523 6.743 913 2HB ASN 111 2HB ASN 111 -10.708 1.563 6.151 914 1HD2 ASN 111 1HD2 ASN 111 -10.923 -1.202 6.740 915 2HD2 ASN 111 2HD2 ASN 111 -11.321 -2.029 5.272 916 H ILE 112 H ILE 112 -8.920 4.165 4.315 917 HA ILE 112 HA ILE 112 -7.141 5.301 6.194 918 HB ILE 112 HB ILE 112 -9.221 6.675 4.479 919 1HG1 ILE 112 1HG1 ILE 112 -7.654 5.418 3.104 920 2HG1 ILE 112 2HG1 ILE 112 -7.312 7.140 2.956 921 1HG2 ILE 112 1HG2 ILE 112 -8.513 8.113 6.282 922 2HG2 ILE 112 2HG2 ILE 112 -7.824 8.683 4.762 923 3HG2 ILE 112 3HG2 ILE 112 -6.819 7.798 5.910 924 1HD1 ILE 112 1HD1 ILE 112 -5.280 5.805 3.113 925 2HD1 ILE 112 2HD1 ILE 112 -5.795 5.202 4.688 926 3HD1 ILE 112 3HD1 ILE 112 -5.438 6.916 4.473 927 H HIS 113 H HIS 113 -10.651 5.132 5.994 928 HA HIS 113 HA HIS 113 -11.237 6.719 8.242 929 1HB HIS 113 1HB HIS 113 -12.919 6.107 6.558 930 2HB HIS 113 2HB HIS 113 -12.814 4.421 7.056 931 HD1 HIS 113 HD1 HIS 113 -14.168 3.705 9.078 932 HD2 HIS 113 HD2 HIS 113 -14.190 7.824 8.460 933 HE1 HIS 113 HE1 HIS 113 -15.923 4.622 10.633 934 HE2 HIS 113 HE2 HIS 113 -15.765 7.126 10.391 935 H GLU 114 H GLU 114 -10.146 3.453 7.929 936 HA GLU 114 HA GLU 114 -10.840 2.788 10.679 937 1HB GLU 114 1HB GLU 114 -9.855 1.228 8.320 938 2HB GLU 114 2HB GLU 114 -9.649 0.574 9.937 939 1HG GLU 114 1HG GLU 114 -11.668 -0.240 8.766 940 2HG GLU 114 2HG GLU 114 -12.005 0.543 10.308 941 H GLN 115 H GLN 115 -8.178 3.935 8.863 942 HA GLN 115 HA GLN 115 -5.979 4.295 9.299 943 1HB GLN 115 1HB GLN 115 -6.905 3.971 12.164 944 2HB GLN 115 2HB GLN 115 -5.314 4.552 11.694 945 1HG GLN 115 1HG GLN 115 -7.871 5.883 10.851 946 2HG GLN 115 2HG GLN 115 -6.982 6.320 12.310 947 1HE2 GLN 115 1HE2 GLN 115 -7.600 7.805 9.819 948 2HE2 GLN 115 2HE2 GLN 115 -6.072 8.368 9.238 949 H LYS 116 H LYS 116 -6.804 1.705 8.616 950 HA LYS 116 HA LYS 116 -4.792 0.069 10.005 951 1HB LYS 116 1HB LYS 116 -7.614 -0.737 9.296 952 2HB LYS 116 2HB LYS 116 -6.360 -1.888 9.734 953 1HG LYS 116 1HG LYS 116 -6.160 -0.857 11.929 954 2HG LYS 116 2HG LYS 116 -7.384 0.336 11.486 955 1HD LYS 116 1HD LYS 116 -9.066 -1.338 11.321 956 2HD LYS 116 2HD LYS 116 -7.878 -2.633 11.463 957 1HE LYS 116 1HE LYS 116 -7.364 -1.873 13.748 958 2HE LYS 116 2HE LYS 116 -8.606 -0.629 13.597 959 1HZ LYS 116 1HZ LYS 116 -9.306 -3.453 13.135 960 2HZ LYS 116 2HZ LYS 116 -10.291 -2.175 13.667 961 3HZ LYS 116 3HZ LYS 116 -9.163 -2.873 14.722 962 H ARG 117 H ARG 117 -3.482 -1.035 8.713 963 HA ARG 117 HA ARG 117 -4.040 -1.029 5.836 964 1HB ARG 117 1HB ARG 117 -1.495 -1.311 7.431 965 2HB ARG 117 2HB ARG 117 -1.565 -1.634 5.705 966 1HG ARG 117 1HG ARG 117 -1.617 0.534 5.169 967 2HG ARG 117 2HG ARG 117 -2.722 0.933 6.485 968 1HD ARG 117 1HD ARG 117 -0.574 2.050 6.756 969 2HD ARG 117 2HD ARG 117 -0.872 0.910 8.064 970 HE ARG 117 HE ARG 117 0.671 -0.621 6.907 971 1HH1 ARG 117 1HH1 ARG 117 0.801 2.794 6.111 972 2HH1 ARG 117 2HH1 ARG 117 2.467 2.743 5.649 973 1HH2 ARG 117 1HH2 ARG 117 2.854 -0.671 6.339 974 2HH2 ARG 117 2HH2 ARG 117 3.642 0.776 5.774 975 H TYR 118 H TYR 118 -5.186 -2.788 5.341 976 HA TYR 118 HA TYR 118 -4.669 -5.334 6.647 977 1HB TYR 118 1HB TYR 118 -6.683 -4.559 4.527 978 2HB TYR 118 2HB TYR 118 -6.596 -6.129 5.310 979 HD1 TYR 118 HD1 TYR 118 -7.417 -6.442 7.555 980 HD2 TYR 118 HD2 TYR 118 -7.491 -2.594 5.746 981 HE1 TYR 118 HE1 TYR 118 -8.946 -5.654 9.313 982 HE2 TYR 118 HE2 TYR 118 -9.014 -1.790 7.501 983 HH TYR 118 HH TYR 118 -10.698 -2.806 9.084 984 H TYR 119 H TYR 119 -3.493 -6.933 5.795 985 HA TYR 119 HA TYR 119 -2.636 -6.642 2.995 986 1HB TYR 119 1HB TYR 119 -1.209 -8.055 5.259 987 2HB TYR 119 2HB TYR 119 -0.613 -7.881 3.611 988 HD1 TYR 119 HD1 TYR 119 -0.539 -5.348 2.770 989 HD2 TYR 119 HD2 TYR 119 -0.410 -6.573 6.842 990 HE1 TYR 119 HE1 TYR 119 0.513 -3.209 3.375 991 HE2 TYR 119 HE2 TYR 119 0.639 -4.436 7.456 992 HH TYR 119 HH TYR 119 2.000 -2.667 6.352 993 H TYR 120 H TYR 120 -3.625 -7.979 1.680 994 HA TYR 120 HA TYR 120 -4.449 -10.628 2.685 995 1HB TYR 120 1HB TYR 120 -5.569 -9.034 0.363 996 2HB TYR 120 2HB TYR 120 -6.106 -10.633 0.848 997 HD1 TYR 120 HD1 TYR 120 -7.611 -10.928 2.679 998 HD2 TYR 120 HD2 TYR 120 -6.079 -7.067 1.776 999 HE1 TYR 120 HE1 TYR 120 -9.296 -9.919 4.157 1000 HE2 TYR 120 HE2 TYR 120 -7.756 -6.049 3.257 1001 HH TYR 120 HH TYR 120 -9.991 -6.617 4.167 1002 H THR 121 H THR 121 -3.823 -12.442 1.578 1003 HA THR 121 HA THR 121 -1.831 -12.217 -0.487 1004 HB THR 121 HB THR 121 -1.690 -14.052 1.125 1005 HG1 THR 121 HG1 THR 121 -0.762 -14.953 -0.547 1006 1HG2 THR 121 1HG2 THR 121 -4.047 -14.390 1.593 1007 2HG2 THR 121 2HG2 THR 121 -3.313 -15.906 1.073 1008 3HG2 THR 121 3HG2 THR 121 -4.313 -14.980 -0.048 1009 H PHE 122 H PHE 122 -2.217 -13.625 -2.557 1010 HA PHE 122 HA PHE 122 -4.340 -12.410 -3.987 1011 1HB PHE 122 1HB PHE 122 -2.191 -13.179 -5.012 1012 2HB PHE 122 2HB PHE 122 -2.744 -14.839 -4.823 1013 HD1 PHE 122 HD1 PHE 122 -3.436 -11.634 -6.511 1014 HD2 PHE 122 HD2 PHE 122 -4.247 -15.809 -6.375 1015 HE1 PHE 122 HE1 PHE 122 -4.587 -11.476 -8.681 1016 HE2 PHE 122 HE2 PHE 122 -5.401 -15.660 -8.540 1017 HZ PHE 122 HZ PHE 122 -5.572 -13.492 -9.698 1018 H ASP 123 H ASP 123 -4.027 -15.393 -2.268 1019 HA ASP 123 HA ASP 123 -6.275 -16.788 -3.204 1020 1HB ASP 123 1HB ASP 123 -4.634 -17.881 -1.817 1021 2HB ASP 123 2HB ASP 123 -4.920 -16.752 -0.498 1022 H ASN 124 H ASN 124 -5.989 -13.941 -1.432 1023 HA ASN 124 HA ASN 124 -7.426 -12.440 -0.599 1024 1HB ASN 124 1HB ASN 124 -8.867 -13.188 -2.577 1025 2HB ASN 124 2HB ASN 124 -9.757 -14.164 -1.413 1026 1HD2 ASN 124 1HD2 ASN 124 -11.066 -13.165 0.091 1027 2HD2 ASN 124 2HD2 ASN 124 -11.467 -11.483 0.008 1028 H SER 125 H SER 125 -6.503 -13.118 1.358 1029 HA SER 125 HA SER 125 -8.517 -13.813 3.286 1030 1HB SER 125 1HB SER 125 -7.588 -16.039 2.590 1031 2HB SER 125 2HB SER 125 -5.998 -15.496 3.125 1032 HG SER 125 HG SER 125 -8.169 -15.332 4.903 1033 H LEU 126 H LEU 126 -7.993 -13.017 5.326 1034 HA LEU 126 HA LEU 126 -6.168 -10.824 5.284 1035 1HB LEU 126 1HB LEU 126 -8.322 -10.798 6.494 1036 2HB LEU 126 2HB LEU 126 -7.699 -12.007 7.600 1037 HG LEU 126 HG LEU 126 -5.992 -10.419 8.380 1038 1HD1 LEU 126 1HD1 LEU 126 -5.737 -9.106 6.351 1039 2HD1 LEU 126 2HD1 LEU 126 -6.122 -8.068 7.723 1040 3HD1 LEU 126 3HD1 LEU 126 -7.370 -8.467 6.542 1041 1HD2 LEU 126 1HD2 LEU 126 -8.815 -9.363 8.479 1042 2HD2 LEU 126 2HD2 LEU 126 -7.508 -8.909 9.574 1043 3HD2 LEU 126 3HD2 LEU 126 -8.110 -10.567 9.558 1044 H LEU 127 H LEU 127 -4.054 -11.292 5.241 1045 HA LEU 127 HA LEU 127 -2.972 -13.402 6.907 1046 1HB LEU 127 1HB LEU 127 -1.770 -11.527 4.892 1047 2HB LEU 127 2HB LEU 127 -0.767 -12.524 5.926 1048 HG LEU 127 HG LEU 127 -2.808 -13.535 3.946 1049 1HD1 LEU 127 1HD1 LEU 127 0.207 -13.618 3.917 1050 2HD1 LEU 127 2HD1 LEU 127 -0.812 -12.612 2.887 1051 3HD1 LEU 127 3HD1 LEU 127 -0.858 -14.368 2.730 1052 1HD2 LEU 127 1HD2 LEU 127 -2.663 -14.985 5.890 1053 2HD2 LEU 127 2HD2 LEU 127 -0.905 -15.013 5.763 1054 3HD2 LEU 127 3HD2 LEU 127 -1.893 -15.750 4.500 1055 H PHE 128 H PHE 128 -2.916 -9.872 6.743 1056 HA PHE 128 HA PHE 128 -2.108 -9.762 9.517 1057 1HB PHE 128 1HB PHE 128 -0.022 -9.927 7.940 1058 2HB PHE 128 2HB PHE 128 -0.382 -8.240 7.595 1059 HD1 PHE 128 HD1 PHE 128 0.498 -10.619 10.251 1060 HD2 PHE 128 HD2 PHE 128 0.172 -6.532 9.135 1061 HE1 PHE 128 HE1 PHE 128 1.729 -9.982 12.277 1062 HE2 PHE 128 HE2 PHE 128 1.400 -5.874 11.165 1063 HZ PHE 128 HZ PHE 128 2.181 -7.602 12.741 1064 H THR 129 H THR 129 -2.578 -7.794 10.485 1065 HA THR 129 HA THR 129 -3.696 -5.694 8.755 1066 HB THR 129 HB THR 129 -4.737 -6.465 11.492 1067 HG1 THR 129 HG1 THR 129 -5.257 -7.472 9.034 1068 1HG2 THR 129 1HG2 THR 129 -5.007 -4.088 10.963 1069 2HG2 THR 129 2HG2 THR 129 -6.564 -4.919 10.969 1070 3HG2 THR 129 3HG2 THR 129 -5.787 -4.511 9.439 1071 H GLU 130 H GLU 130 -2.024 -4.273 8.803 1072 HA GLU 130 HA GLU 130 -0.707 -3.706 11.335 1073 1HB GLU 130 1HB GLU 130 0.650 -3.963 9.277 1074 2HB GLU 130 2HB GLU 130 -0.167 -2.567 8.587 1075 1HG GLU 130 1HG GLU 130 0.776 -1.118 10.245 1076 2HG GLU 130 2HG GLU 130 1.459 -2.490 11.117 1077 H SER 131 H SER 131 -2.243 -2.649 12.510 1078 HA SER 131 HA SER 131 -3.637 -0.367 11.476 1079 1HB SER 131 1HB SER 131 -4.134 -0.197 14.081 1080 2HB SER 131 2HB SER 131 -4.925 -1.407 13.070 1081 HG SER 131 HG SER 131 -2.563 -1.813 14.618 1082 H ILE 132 H ILE 132 -2.850 1.608 11.340 1083 HA ILE 132 HA ILE 132 -0.308 2.217 12.597 1084 HB ILE 132 HB ILE 132 -0.585 4.409 11.289 1085 1HG1 ILE 132 1HG1 ILE 132 -2.706 2.760 9.893 1086 2HG1 ILE 132 2HG1 ILE 132 -3.041 4.148 10.921 1087 1HG2 ILE 132 1HG2 ILE 132 0.171 3.346 9.216 1088 2HG2 ILE 132 2HG2 ILE 132 -0.392 1.786 9.815 1089 3HG2 ILE 132 3HG2 ILE 132 0.928 2.620 10.634 1090 1HD1 ILE 132 1HD1 ILE 132 -1.851 5.597 9.378 1091 2HD1 ILE 132 2HD1 ILE 132 -3.134 4.712 8.551 1092 3HD1 ILE 132 3HD1 ILE 132 -1.455 4.209 8.364 1093 H GLN 133 H GLN 133 -1.650 2.018 14.697 1094 HA GLN 133 HA GLN 133 -3.241 4.294 15.406 1095 1HB GLN 133 1HB GLN 133 -3.625 2.084 16.434 1096 2HB GLN 133 2HB GLN 133 -2.034 2.157 17.178 1097 1HG GLN 133 1HG GLN 133 -3.820 2.716 18.753 1098 2HG GLN 133 2HG GLN 133 -2.708 4.063 18.509 1099 1HE2 GLN 133 1HE2 GLN 133 -5.930 2.882 18.045 1100 2HE2 GLN 133 2HE2 GLN 133 -6.627 4.387 17.527 Start of MODEL 15 1 H ASP 7 H ASP 7 -4.529 15.552 -15.910 2 HA ASP 7 HA ASP 7 -6.971 14.380 -15.222 3 1HB ASP 7 1HB ASP 7 -4.250 13.192 -15.714 4 2HB ASP 7 2HB ASP 7 -5.636 12.189 -15.315 5 H GLN 8 H GLN 8 -7.783 13.632 -13.373 6 HA GLN 8 HA GLN 8 -6.686 14.080 -10.869 7 1HB GLN 8 1HB GLN 8 -9.062 13.629 -11.244 8 2HB GLN 8 2HB GLN 8 -8.692 11.975 -11.698 9 1HG GLN 8 1HG GLN 8 -7.959 11.471 -9.460 10 2HG GLN 8 2HG GLN 8 -8.161 13.155 -8.980 11 1HE2 GLN 8 1HE2 GLN 8 -10.606 13.530 -10.451 12 2HE2 GLN 8 2HE2 GLN 8 -11.842 12.668 -9.597 13 H VAL 9 H VAL 9 -6.377 11.334 -13.003 14 HA VAL 9 HA VAL 9 -5.216 9.461 -11.300 15 HB VAL 9 HB VAL 9 -4.638 9.910 -14.237 16 1HG1 VAL 9 1HG1 VAL 9 -2.984 8.469 -13.169 17 2HG1 VAL 9 2HG1 VAL 9 -3.997 7.563 -14.291 18 3HG1 VAL 9 3HG1 VAL 9 -4.274 7.436 -12.554 19 1HG2 VAL 9 1HG2 VAL 9 -7.009 9.636 -13.860 20 2HG2 VAL 9 2HG2 VAL 9 -6.718 8.196 -12.885 21 3HG2 VAL 9 3HG2 VAL 9 -6.355 8.182 -14.610 22 H VAL 10 H VAL 10 -3.767 12.141 -13.091 23 HA VAL 10 HA VAL 10 -1.071 11.410 -12.732 24 HB VAL 10 HB VAL 10 -2.260 14.157 -13.163 25 1HG1 VAL 10 1HG1 VAL 10 -0.033 14.780 -13.989 26 2HG1 VAL 10 2HG1 VAL 10 0.581 13.200 -13.505 27 3HG1 VAL 10 3HG1 VAL 10 0.002 14.331 -12.284 28 1HG2 VAL 10 1HG2 VAL 10 -1.077 12.203 -15.131 29 2HG2 VAL 10 2HG2 VAL 10 -1.730 13.801 -15.502 30 3HG2 VAL 10 3HG2 VAL 10 -2.796 12.525 -14.918 31 H ILE 11 H ILE 11 -3.149 13.623 -10.885 32 HA ILE 11 HA ILE 11 -1.233 14.525 -9.079 33 HB ILE 11 HB ILE 11 -4.216 14.203 -8.752 34 1HG1 ILE 11 1HG1 ILE 11 -4.048 16.752 -8.733 35 2HG1 ILE 11 2HG1 ILE 11 -2.384 16.545 -9.264 36 1HG2 ILE 11 1HG2 ILE 11 -4.053 15.553 -6.718 37 2HG2 ILE 11 2HG2 ILE 11 -2.294 15.484 -6.819 38 3HG2 ILE 11 3HG2 ILE 11 -3.219 14.009 -6.546 39 1HD1 ILE 11 1HD1 ILE 11 -3.835 17.022 -11.134 40 2HD1 ILE 11 2HD1 ILE 11 -4.838 15.625 -10.738 41 3HD1 ILE 11 3HD1 ILE 11 -3.170 15.396 -11.266 42 H PHE 12 H PHE 12 -3.538 11.831 -8.685 43 HA PHE 12 HA PHE 12 -2.557 11.054 -6.155 44 1HB PHE 12 1HB PHE 12 -4.241 9.652 -8.221 45 2HB PHE 12 2HB PHE 12 -3.757 8.849 -6.730 46 HD1 PHE 12 HD1 PHE 12 -4.846 9.282 -4.703 47 HD2 PHE 12 HD2 PHE 12 -5.635 11.727 -8.090 48 HE1 PHE 12 HE1 PHE 12 -6.738 10.309 -3.513 49 HE2 PHE 12 HE2 PHE 12 -7.531 12.759 -6.910 50 HZ PHE 12 HZ PHE 12 -8.082 12.049 -4.618 51 H LYS 13 H LYS 13 -1.826 9.923 -9.430 52 HA LYS 13 HA LYS 13 -0.229 7.740 -8.667 53 1HB LYS 13 1HB LYS 13 -1.131 7.910 -10.900 54 2HB LYS 13 2HB LYS 13 -0.225 9.386 -11.196 55 1HG LYS 13 1HG LYS 13 1.839 8.209 -11.208 56 2HG LYS 13 2HG LYS 13 1.063 6.734 -10.624 57 1HD LYS 13 1HD LYS 13 -0.062 6.400 -12.671 58 2HD LYS 13 2HD LYS 13 0.307 8.036 -13.228 59 1HE LYS 13 1HE LYS 13 2.408 5.950 -12.677 60 2HE LYS 13 2HE LYS 13 1.681 6.199 -14.264 61 1HZ LYS 13 1HZ LYS 13 2.507 8.427 -14.311 62 2HZ LYS 13 2HZ LYS 13 3.801 7.386 -13.969 63 3HZ LYS 13 3HZ LYS 13 3.104 8.310 -12.727 64 H GLN 14 H GLN 14 0.575 11.126 -9.296 65 HA GLN 14 HA GLN 14 3.380 10.809 -9.119 66 1HB GLN 14 1HB GLN 14 1.554 13.172 -8.785 67 2HB GLN 14 2HB GLN 14 3.288 13.317 -8.533 68 1HG GLN 14 1HG GLN 14 3.698 12.568 -10.807 69 2HG GLN 14 2HG GLN 14 1.966 12.368 -11.064 70 1HE2 GLN 14 1HE2 GLN 14 1.297 14.765 -9.550 71 2HE2 GLN 14 2HE2 GLN 14 1.707 16.102 -10.569 72 H ILE 15 H ILE 15 0.885 11.278 -6.697 73 HA ILE 15 HA ILE 15 2.563 11.862 -4.513 74 HB ILE 15 HB ILE 15 -0.088 10.403 -4.506 75 1HG1 ILE 15 1HG1 ILE 15 0.545 13.329 -4.043 76 2HG1 ILE 15 2HG1 ILE 15 -0.174 12.664 -5.505 77 1HG2 ILE 15 1HG2 ILE 15 1.426 11.725 -2.254 78 2HG2 ILE 15 2HG2 ILE 15 1.103 10.000 -2.440 79 3HG2 ILE 15 3HG2 ILE 15 -0.226 11.121 -2.149 80 1HD1 ILE 15 1HD1 ILE 15 -2.126 11.957 -4.225 81 2HD1 ILE 15 2HD1 ILE 15 -1.847 13.693 -4.077 82 3HD1 ILE 15 3HD1 ILE 15 -1.400 12.613 -2.757 83 H PHE 16 H PHE 16 1.151 8.747 -5.535 84 HA PHE 16 HA PHE 16 2.560 7.203 -3.633 85 1HB PHE 16 1HB PHE 16 1.199 6.470 -6.221 86 2HB PHE 16 2HB PHE 16 1.961 5.273 -5.184 87 HD1 PHE 16 HD1 PHE 16 0.930 4.554 -3.162 88 HD2 PHE 16 HD2 PHE 16 -0.779 7.704 -5.454 89 HE1 PHE 16 HE1 PHE 16 -1.138 4.389 -1.840 90 HE2 PHE 16 HE2 PHE 16 -2.849 7.548 -4.134 91 HZ PHE 16 HZ PHE 16 -3.031 5.891 -2.325 92 H ASP 17 H ASP 17 3.286 8.142 -6.942 93 HA ASP 17 HA ASP 17 5.426 6.388 -7.424 94 1HB ASP 17 1HB ASP 17 4.354 7.566 -9.235 95 2HB ASP 17 2HB ASP 17 4.815 9.122 -8.558 96 H LYS 18 H LYS 18 5.369 9.623 -5.986 97 HA LYS 18 HA LYS 18 8.268 9.577 -5.780 98 1HB LYS 18 1HB LYS 18 6.224 11.710 -5.218 99 2HB LYS 18 2HB LYS 18 7.922 11.894 -4.794 100 1HG LYS 18 1HG LYS 18 8.523 11.515 -7.153 101 2HG LYS 18 2HG LYS 18 6.806 11.446 -7.551 102 1HD LYS 18 1HD LYS 18 6.495 13.722 -6.891 103 2HD LYS 18 2HD LYS 18 8.128 13.808 -6.226 104 1HE LYS 18 1HE LYS 18 9.053 13.471 -8.470 105 2HE LYS 18 2HE LYS 18 7.420 13.395 -9.128 106 1HZ LYS 18 1HZ LYS 18 7.052 15.655 -8.617 107 2HZ LYS 18 2HZ LYS 18 8.588 15.588 -9.341 108 3HZ LYS 18 3HZ LYS 18 8.451 15.757 -7.662 109 H VAL 19 H VAL 19 5.472 9.211 -3.679 110 HA VAL 19 HA VAL 19 6.857 9.683 -1.251 111 HB VAL 19 HB VAL 19 4.343 9.647 -1.513 112 1HG1 VAL 19 1HG1 VAL 19 4.097 7.552 -2.707 113 2HG1 VAL 19 2HG1 VAL 19 3.195 7.502 -1.193 114 3HG1 VAL 19 3HG1 VAL 19 4.741 6.664 -1.327 115 1HG2 VAL 19 1HG2 VAL 19 3.949 8.809 0.753 116 2HG2 VAL 19 2HG2 VAL 19 5.416 9.781 0.664 117 3HG2 VAL 19 3HG2 VAL 19 5.527 8.023 0.737 118 H ARG 20 H ARG 20 6.617 6.902 -3.331 119 HA ARG 20 HA ARG 20 7.502 4.995 -1.401 120 1HB ARG 20 1HB ARG 20 7.805 3.485 -3.305 121 2HB ARG 20 2HB ARG 20 6.247 4.291 -3.370 122 1HG ARG 20 1HG ARG 20 7.144 5.856 -5.036 123 2HG ARG 20 2HG ARG 20 8.683 4.994 -4.989 124 1HD ARG 20 1HD ARG 20 7.582 2.959 -5.754 125 2HD ARG 20 2HD ARG 20 6.027 3.787 -5.760 126 HE ARG 20 HE ARG 20 7.897 5.157 -7.404 127 1HH1 ARG 20 1HH1 ARG 20 5.856 2.311 -7.324 128 2HH1 ARG 20 2HH1 ARG 20 5.701 2.200 -9.050 129 1HH2 ARG 20 1HH2 ARG 20 7.692 5.034 -9.664 130 2HH2 ARG 20 2HH2 ARG 20 6.732 3.776 -10.379 131 H ASN 21 H ASN 21 9.082 7.502 -2.906 132 HA ASN 21 HA ASN 21 11.700 6.195 -2.558 133 1HB ASN 21 1HB ASN 21 11.295 6.943 -4.867 134 2HB ASN 21 2HB ASN 21 10.977 8.572 -4.280 135 1HD2 ASN 21 1HD2 ASN 21 12.669 9.883 -3.693 136 2HD2 ASN 21 2HD2 ASN 21 14.322 9.477 -3.988 137 H ASP 22 H ASP 22 9.906 9.232 -2.144 138 HA ASP 22 HA ASP 22 12.054 10.472 -0.700 139 1HB ASP 22 1HB ASP 22 10.475 11.735 -2.143 140 2HB ASP 22 2HB ASP 22 9.190 11.397 -0.985 141 H LEU 23 H LEU 23 9.227 8.660 0.124 142 HA LEU 23 HA LEU 23 8.529 7.716 2.057 143 1HB LEU 23 1HB LEU 23 11.204 8.675 3.061 144 2HB LEU 23 2HB LEU 23 10.114 7.670 3.997 145 HG LEU 23 HG LEU 23 11.384 6.894 1.370 146 1HD1 LEU 23 1HD1 LEU 23 13.003 6.965 3.185 147 2HD1 LEU 23 2HD1 LEU 23 12.659 5.298 2.717 148 3HD1 LEU 23 3HD1 LEU 23 11.946 5.968 4.183 149 1HD2 LEU 23 1HD2 LEU 23 9.195 5.879 1.645 150 2HD2 LEU 23 2HD2 LEU 23 9.636 5.329 3.262 151 3HD2 LEU 23 3HD2 LEU 23 10.464 4.672 1.852 152 H ASN 24 H ASN 24 8.048 10.612 1.451 153 HA ASN 24 HA ASN 24 7.778 11.820 4.057 154 1HB ASN 24 1HB ASN 24 8.202 13.156 1.977 155 2HB ASN 24 2HB ASN 24 6.580 12.748 1.436 156 1HD2 ASN 24 1HD2 ASN 24 7.849 15.329 2.072 157 2HD2 ASN 24 2HD2 ASN 24 6.825 16.071 3.253 158 H TYR 25 H TYR 25 6.517 10.253 5.121 159 HA TYR 25 HA TYR 25 3.970 9.439 4.127 160 1HB TYR 25 1HB TYR 25 5.230 9.176 6.858 161 2HB TYR 25 2HB TYR 25 3.673 8.478 6.430 162 HD1 TYR 25 HD1 TYR 25 7.200 7.995 6.456 163 HD2 TYR 25 HD2 TYR 25 3.632 6.816 4.469 164 HE1 TYR 25 HE1 TYR 25 8.344 5.992 5.609 165 HE2 TYR 25 HE2 TYR 25 4.762 4.804 3.618 166 HH TYR 25 HH TYR 25 7.073 4.048 3.153 167 H GLN 26 H GLN 26 5.079 12.108 6.020 168 HA GLN 26 HA GLN 26 2.733 12.724 7.425 169 1HB GLN 26 1HB GLN 26 4.927 14.533 6.407 170 2HB GLN 26 2HB GLN 26 3.644 15.063 7.485 171 1HG GLN 26 1HG GLN 26 4.397 13.393 9.140 172 2HG GLN 26 2HG GLN 26 5.735 12.980 8.069 173 1HE2 GLN 26 1HE2 GLN 26 4.385 15.400 10.173 174 2HE2 GLN 26 2HE2 GLN 26 5.816 16.364 10.316 175 H TRP 27 H TRP 27 3.935 14.084 4.361 176 HA TRP 27 HA TRP 27 1.544 15.506 3.803 177 1HB TRP 27 1HB TRP 27 3.671 16.171 2.812 178 2HB TRP 27 2HB TRP 27 3.791 14.631 1.969 179 HD1 TRP 27 HD1 TRP 27 1.307 17.625 2.051 180 HE1 TRP 27 HE1 TRP 27 0.441 18.003 -0.346 181 HE3 TRP 27 HE3 TRP 27 3.742 13.785 -0.284 182 HZ2 TRP 27 HZ2 TRP 27 0.773 16.822 -2.894 183 HZ3 TRP 27 HZ3 TRP 27 3.420 13.482 -2.703 184 HH2 TRP 27 HH2 TRP 27 1.964 14.971 -3.979 185 H PHE 28 H PHE 28 2.752 12.330 2.934 186 HA PHE 28 HA PHE 28 0.970 11.590 0.952 187 1HB PHE 28 1HB PHE 28 2.931 10.269 1.562 188 2HB PHE 28 2HB PHE 28 2.212 9.885 3.121 189 HD1 PHE 28 HD1 PHE 28 1.198 9.693 -0.473 190 HD2 PHE 28 HD2 PHE 28 1.424 7.748 3.306 191 HE1 PHE 28 HE1 PHE 28 0.207 7.669 -1.461 192 HE2 PHE 28 HE2 PHE 28 0.427 5.724 2.327 193 HZ PHE 28 HZ PHE 28 -0.182 5.683 -0.061 194 H TYR 29 H TYR 29 0.655 10.930 4.458 195 HA TYR 29 HA TYR 29 -1.967 9.840 4.096 196 1HB TYR 29 1HB TYR 29 -0.283 10.411 6.521 197 2HB TYR 29 2HB TYR 29 -1.960 9.887 6.673 198 HD1 TYR 29 HD1 TYR 29 -2.613 7.714 5.461 199 HD2 TYR 29 HD2 TYR 29 1.417 8.814 6.258 200 HE1 TYR 29 HE1 TYR 29 -1.924 5.371 5.174 201 HE2 TYR 29 HE2 TYR 29 2.120 6.473 5.971 202 HH TYR 29 HH TYR 29 0.248 4.164 4.514 203 H SER 30 H SER 30 -0.768 13.019 4.667 204 HA SER 30 HA SER 30 -3.155 14.080 5.806 205 1HB SER 30 1HB SER 30 -0.879 15.451 4.352 206 2HB SER 30 2HB SER 30 -2.195 16.303 5.162 207 HG SER 30 HG SER 30 -0.154 14.700 6.277 208 H GLU 31 H GLU 31 -1.873 13.893 2.490 209 HA GLU 31 HA GLU 31 -4.132 15.117 1.280 210 1HB GLU 31 1HB GLU 31 -1.988 13.283 0.228 211 2HB GLU 31 2HB GLU 31 -3.320 13.813 -0.786 212 1HG GLU 31 1HG GLU 31 -1.303 15.583 0.573 213 2HG GLU 31 2HG GLU 31 -1.374 15.195 -1.147 214 H LEU 32 H LEU 32 -3.313 11.798 2.118 215 HA LEU 32 HA LEU 32 -5.415 10.508 0.824 216 1HB LEU 32 1HB LEU 32 -3.967 9.811 3.369 217 2HB LEU 32 2HB LEU 32 -5.162 8.759 2.634 218 HG LEU 32 HG LEU 32 -2.537 9.613 1.414 219 1HD1 LEU 32 1HD1 LEU 32 -1.982 7.240 1.586 220 2HD1 LEU 32 2HD1 LEU 32 -3.528 6.938 2.380 221 3HD1 LEU 32 3HD1 LEU 32 -2.315 7.947 3.169 222 1HD2 LEU 32 1HD2 LEU 32 -4.242 9.445 -0.314 223 2HD2 LEU 32 2HD2 LEU 32 -4.713 7.855 0.284 224 3HD2 LEU 32 3HD2 LEU 32 -3.116 8.092 -0.423 225 H LYS 33 H LYS 33 -5.331 11.905 4.106 226 HA LYS 33 HA LYS 33 -8.003 11.070 4.683 227 1HB LYS 33 1HB LYS 33 -6.334 11.445 6.459 228 2HB LYS 33 2HB LYS 33 -6.307 13.159 6.068 229 1HG LYS 33 1HG LYS 33 -8.546 13.449 6.811 230 2HG LYS 33 2HG LYS 33 -8.787 11.711 6.955 231 1HD LYS 33 1HD LYS 33 -6.800 13.282 8.590 232 2HD LYS 33 2HD LYS 33 -8.431 12.887 9.129 233 1HE LYS 33 1HE LYS 33 -7.878 10.477 8.800 234 2HE LYS 33 2HE LYS 33 -6.217 10.956 8.454 235 1HZ LYS 33 1HZ LYS 33 -7.665 11.488 10.997 236 2HZ LYS 33 2HZ LYS 33 -6.053 11.901 10.667 237 3HZ LYS 33 3HZ LYS 33 -6.510 10.269 10.763 238 H ARG 34 H ARG 34 -6.736 13.630 2.835 239 HA ARG 34 HA ARG 34 -9.191 15.198 3.155 240 1HB ARG 34 1HB ARG 34 -6.620 15.893 1.727 241 2HB ARG 34 2HB ARG 34 -8.034 16.940 1.822 242 1HG ARG 34 1HG ARG 34 -7.761 16.674 4.378 243 2HG ARG 34 2HG ARG 34 -6.128 16.135 3.978 244 1HD ARG 34 1HD ARG 34 -7.366 18.761 3.162 245 2HD ARG 34 2HD ARG 34 -6.223 18.537 4.483 246 HE ARG 34 HE ARG 34 -5.053 17.539 2.144 247 1HH1 ARG 34 1HH1 ARG 34 -6.095 20.596 3.502 248 2HH1 ARG 34 2HH1 ARG 34 -4.930 21.537 2.616 249 1HH2 ARG 34 1HH2 ARG 34 -3.511 18.766 0.970 250 2HH2 ARG 34 2HH2 ARG 34 -3.473 20.502 1.165 251 H HIS 35 H HIS 35 -8.122 12.713 1.271 252 HA HIS 35 HA HIS 35 -9.940 13.514 -0.908 253 1HB HIS 35 1HB HIS 35 -7.345 12.001 -1.276 254 2HB HIS 35 2HB HIS 35 -8.516 12.345 -2.540 255 HD1 HIS 35 HD1 HIS 35 -9.009 15.308 -2.183 256 HD2 HIS 35 HD2 HIS 35 -5.246 13.571 -1.842 257 HE1 HIS 35 HE1 HIS 35 -7.361 17.158 -2.627 258 HE2 HIS 35 HE2 HIS 35 -5.098 16.133 -2.152 259 H ASN 36 H ASN 36 -8.151 10.738 0.380 260 HA ASN 36 HA ASN 36 -10.205 8.913 -0.538 261 1HB ASN 36 1HB ASN 36 -7.851 8.301 -0.841 262 2HB ASN 36 2HB ASN 36 -7.584 8.411 0.894 263 1HD2 ASN 36 1HD2 ASN 36 -6.945 6.300 1.093 264 2HD2 ASN 36 2HD2 ASN 36 -8.035 4.973 0.937 265 H VAL 37 H VAL 37 -11.922 9.429 0.752 266 HA VAL 37 HA VAL 37 -11.766 9.537 3.609 267 HB VAL 37 HB VAL 37 -14.199 9.272 1.824 268 1HG1 VAL 37 1HG1 VAL 37 -15.430 10.260 3.699 269 2HG1 VAL 37 2HG1 VAL 37 -13.962 10.237 4.675 270 3HG1 VAL 37 3HG1 VAL 37 -14.691 8.722 4.143 271 1HG2 VAL 37 1HG2 VAL 37 -14.383 11.714 2.021 272 2HG2 VAL 37 2HG2 VAL 37 -12.893 11.226 1.212 273 3HG2 VAL 37 3HG2 VAL 37 -12.853 11.753 2.895 274 H SER 38 H SER 38 -12.174 7.061 1.260 275 HA SER 38 HA SER 38 -13.317 5.232 3.238 276 1HB SER 38 1HB SER 38 -14.496 5.410 1.084 277 2HB SER 38 2HB SER 38 -13.031 4.917 0.238 278 HG SER 38 HG SER 38 -14.770 3.407 1.845 279 H HIS 39 H HIS 39 -11.289 4.340 0.479 280 HA HIS 39 HA HIS 39 -8.979 3.627 1.912 281 1HB HIS 39 1HB HIS 39 -9.228 1.242 2.167 282 2HB HIS 39 2HB HIS 39 -10.574 2.024 2.987 283 HD1 HIS 39 HD1 HIS 39 -12.833 2.169 1.289 284 HD2 HIS 39 HD2 HIS 39 -10.019 -0.826 0.648 285 HE1 HIS 39 HE1 HIS 39 -14.007 0.416 -0.069 286 HE2 HIS 39 HE2 HIS 39 -12.354 -1.481 -0.259 287 H TYR 40 H TYR 40 -7.468 2.364 0.600 288 HA TYR 40 HA TYR 40 -8.275 2.221 -2.225 289 1HB TYR 40 1HB TYR 40 -6.096 3.015 -2.935 290 2HB TYR 40 2HB TYR 40 -6.829 4.195 -1.857 291 HD1 TYR 40 HD1 TYR 40 -4.084 1.842 -2.325 292 HD2 TYR 40 HD2 TYR 40 -5.917 4.553 0.394 293 HE1 TYR 40 HE1 TYR 40 -2.041 1.833 -0.952 294 HE2 TYR 40 HE2 TYR 40 -3.881 4.554 1.769 295 HH TYR 40 HH TYR 40 -1.949 3.010 2.182 296 H ILE 41 H ILE 41 -7.428 0.548 -3.437 297 HA ILE 41 HA ILE 41 -6.155 -1.598 -1.865 298 HB ILE 41 HB ILE 41 -7.833 -1.891 -4.369 299 1HG1 ILE 41 1HG1 ILE 41 -9.309 -3.199 -2.646 300 2HG1 ILE 41 2HG1 ILE 41 -8.478 -2.209 -1.454 301 1HG2 ILE 41 1HG2 ILE 41 -6.621 -3.969 -2.551 302 2HG2 ILE 41 2HG2 ILE 41 -6.119 -3.597 -4.201 303 3HG2 ILE 41 3HG2 ILE 41 -7.710 -4.297 -3.900 304 1HD1 ILE 41 1HD1 ILE 41 -10.608 -1.233 -2.060 305 2HD1 ILE 41 2HD1 ILE 41 -10.129 -1.197 -3.757 306 3HD1 ILE 41 3HD1 ILE 41 -9.283 -0.191 -2.580 307 H TYR 42 H TYR 42 -4.064 -1.654 -2.268 308 HA TYR 42 HA TYR 42 -3.035 -0.908 -4.911 309 1HB TYR 42 1HB TYR 42 -2.165 0.126 -2.757 310 2HB TYR 42 2HB TYR 42 -1.492 -1.446 -2.363 311 HD1 TYR 42 HD1 TYR 42 -1.082 -1.347 -5.767 312 HD2 TYR 42 HD2 TYR 42 0.374 0.574 -2.262 313 HE1 TYR 42 HE1 TYR 42 0.980 -0.734 -6.961 314 HE2 TYR 42 HE2 TYR 42 2.433 1.194 -3.445 315 HH TYR 42 HH TYR 42 2.765 0.952 -6.815 316 H TYR 43 H TYR 43 -2.976 -2.630 -6.265 317 HA TYR 43 HA TYR 43 -2.473 -5.297 -5.285 318 1HB TYR 43 1HB TYR 43 -2.792 -4.202 -8.084 319 2HB TYR 43 2HB TYR 43 -2.551 -5.909 -7.722 320 HD1 TYR 43 HD1 TYR 43 -4.281 -7.132 -6.395 321 HD2 TYR 43 HD2 TYR 43 -4.934 -3.189 -7.852 322 HE1 TYR 43 HE1 TYR 43 -6.697 -7.411 -6.047 323 HE2 TYR 43 HE2 TYR 43 -7.355 -3.459 -7.512 324 HH TYR 43 HH TYR 43 -9.014 -5.278 -7.315 325 H LEU 44 H LEU 44 -0.529 -6.077 -4.873 326 HA LEU 44 HA LEU 44 1.777 -4.492 -5.419 327 1HB LEU 44 1HB LEU 44 1.436 -7.176 -4.103 328 2HB LEU 44 2HB LEU 44 3.007 -6.438 -4.335 329 HG LEU 44 HG LEU 44 2.038 -4.428 -3.043 330 1HD1 LEU 44 1HD1 LEU 44 0.080 -6.566 -2.218 331 2HD1 LEU 44 2HD1 LEU 44 -0.295 -5.079 -3.093 332 3HD1 LEU 44 3HD1 LEU 44 0.290 -5.001 -1.430 333 1HD2 LEU 44 1HD2 LEU 44 2.618 -5.471 -0.899 334 2HD2 LEU 44 2HD2 LEU 44 3.773 -5.871 -2.169 335 3HD2 LEU 44 3HD2 LEU 44 2.571 -7.059 -1.669 336 H ALA 45 H ALA 45 0.705 -7.683 -6.595 337 HA ALA 45 HA ALA 45 3.076 -8.002 -8.224 338 1HB ALA 45 1HB ALA 45 2.102 -10.123 -8.897 339 2HB ALA 45 2HB ALA 45 0.573 -9.683 -8.140 340 3HB ALA 45 3HB ALA 45 2.005 -9.935 -7.145 341 H THR 46 H THR 46 1.722 -5.696 -8.891 342 HA THR 46 HA THR 46 1.315 -5.967 -11.697 343 HB THR 46 HB THR 46 -1.129 -5.149 -10.095 344 HG1 THR 46 HG1 THR 46 -0.293 -7.605 -10.917 345 1HG2 THR 46 1HG2 THR 46 -0.940 -3.985 -12.226 346 2HG2 THR 46 2HG2 THR 46 -2.263 -5.150 -12.276 347 3HG2 THR 46 3HG2 THR 46 -0.730 -5.524 -13.063 348 H GLU 47 H GLU 47 1.000 -4.140 -8.754 349 HA GLU 47 HA GLU 47 1.342 -2.026 -8.138 350 1HB GLU 47 1HB GLU 47 3.523 -2.306 -9.368 351 2HB GLU 47 2HB GLU 47 2.756 -1.560 -10.765 352 1HG GLU 47 1HG GLU 47 2.480 0.498 -9.649 353 2HG GLU 47 2HG GLU 47 2.864 -0.214 -8.084 354 H ASN 48 H ASN 48 -0.992 -2.194 -8.524 355 HA ASN 48 HA ASN 48 -1.814 0.082 -10.170 356 1HB ASN 48 1HB ASN 48 -2.375 -2.091 -11.342 357 2HB ASN 48 2HB ASN 48 -3.416 -2.483 -9.979 358 1HD2 ASN 48 1HD2 ASN 48 -4.057 -2.097 -12.792 359 2HD2 ASN 48 2HD2 ASN 48 -5.248 -0.847 -12.847 360 H VAL 49 H VAL 49 -2.557 1.510 -8.781 361 HA VAL 49 HA VAL 49 -3.589 0.607 -6.195 362 HB VAL 49 HB VAL 49 -3.102 3.474 -6.983 363 1HG1 VAL 49 1HG1 VAL 49 -4.364 3.130 -4.952 364 2HG1 VAL 49 2HG1 VAL 49 -2.760 3.753 -4.565 365 3HG1 VAL 49 3HG1 VAL 49 -3.122 2.042 -4.332 366 1HG2 VAL 49 1HG2 VAL 49 -1.076 1.555 -5.837 367 2HG2 VAL 49 2HG2 VAL 49 -0.854 3.295 -6.032 368 3HG2 VAL 49 3HG2 VAL 49 -1.041 2.265 -7.451 369 H HIS 50 H HIS 50 -5.706 0.439 -5.927 370 HA HIS 50 HA HIS 50 -7.503 2.027 -7.623 371 1HB HIS 50 1HB HIS 50 -7.877 -0.502 -6.041 372 2HB HIS 50 2HB HIS 50 -9.260 0.453 -6.556 373 HD1 HIS 50 HD1 HIS 50 -10.054 -1.524 -8.030 374 HD2 HIS 50 HD2 HIS 50 -6.356 0.051 -9.116 375 HE1 HIS 50 HE1 HIS 50 -9.589 -2.408 -10.343 376 HE2 HIS 50 HE2 HIS 50 -7.399 -1.371 -11.026 377 H ILE 51 H ILE 51 -7.655 3.995 -6.636 378 HA ILE 51 HA ILE 51 -8.123 4.107 -3.751 379 HB ILE 51 HB ILE 51 -7.870 6.411 -5.698 380 1HG1 ILE 51 1HG1 ILE 51 -5.627 6.656 -4.342 381 2HG1 ILE 51 2HG1 ILE 51 -5.835 4.928 -4.078 382 1HG2 ILE 51 1HG2 ILE 51 -7.817 6.354 -2.684 383 2HG2 ILE 51 2HG2 ILE 51 -9.113 6.993 -3.698 384 3HG2 ILE 51 3HG2 ILE 51 -7.532 7.775 -3.691 385 1HD1 ILE 51 1HD1 ILE 51 -4.388 5.373 -5.974 386 2HD1 ILE 51 2HD1 ILE 51 -5.674 6.294 -6.754 387 3HD1 ILE 51 3HD1 ILE 51 -5.869 4.562 -6.482 388 H VAL 52 H VAL 52 -10.170 3.742 -3.169 389 HA VAL 52 HA VAL 52 -12.344 4.894 -4.756 390 HB VAL 52 HB VAL 52 -12.569 3.203 -2.255 391 1HG1 VAL 52 1HG1 VAL 52 -14.592 3.944 -4.370 392 2HG1 VAL 52 2HG1 VAL 52 -14.539 4.554 -2.717 393 3HG1 VAL 52 3HG1 VAL 52 -14.880 2.850 -3.016 394 1HG2 VAL 52 1HG2 VAL 52 -12.729 2.339 -5.142 395 2HG2 VAL 52 2HG2 VAL 52 -13.084 1.323 -3.744 396 3HG2 VAL 52 3HG2 VAL 52 -11.446 1.927 -4.004 397 H LEU 53 H LEU 53 -12.418 7.035 -4.358 398 HA LEU 53 HA LEU 53 -11.529 8.364 -2.098 399 1HB LEU 53 1HB LEU 53 -13.766 9.211 -3.935 400 2HB LEU 53 2HB LEU 53 -12.895 10.266 -2.840 401 HG LEU 53 HG LEU 53 -11.719 8.838 -5.222 402 1HD1 LEU 53 1HD1 LEU 53 -13.205 10.690 -5.810 403 2HD1 LEU 53 2HD1 LEU 53 -11.520 11.064 -6.177 404 3HD1 LEU 53 3HD1 LEU 53 -12.287 11.758 -4.747 405 1HD2 LEU 53 1HD2 LEU 53 -10.457 10.791 -3.305 406 2HD2 LEU 53 2HD2 LEU 53 -9.707 10.140 -4.761 407 3HD2 LEU 53 3HD2 LEU 53 -10.095 9.069 -3.413 408 H LYS 54 H LYS 54 -14.847 7.448 -2.865 409 HA LYS 54 HA LYS 54 -15.609 6.760 -0.271 410 1HB LYS 54 1HB LYS 54 -15.349 9.244 0.071 411 2HB LYS 54 2HB LYS 54 -16.610 9.489 -1.129 412 1HG LYS 54 1HG LYS 54 -18.190 8.279 0.293 413 2HG LYS 54 2HG LYS 54 -16.923 8.062 1.504 414 1HD LYS 54 1HD LYS 54 -18.315 9.939 2.118 415 2HD LYS 54 2HD LYS 54 -16.709 10.517 1.668 416 1HE LYS 54 1HE LYS 54 -17.664 10.910 -0.651 417 2HE LYS 54 2HE LYS 54 -19.250 10.642 0.067 418 1HZ LYS 54 1HZ LYS 54 -17.311 12.782 0.730 419 2HZ LYS 54 2HZ LYS 54 -18.695 12.465 1.657 420 3HZ LYS 54 3HZ LYS 54 -18.851 12.961 0.042 421 H ASN 55 H ASN 55 -17.304 8.772 -2.641 422 HA ASN 55 HA ASN 55 -18.298 6.432 -4.037 423 1HB ASN 55 1HB ASN 55 -19.970 6.844 -2.212 424 2HB ASN 55 2HB ASN 55 -20.240 8.451 -2.877 425 1HD2 ASN 55 1HD2 ASN 55 -20.554 5.016 -3.517 426 2HD2 ASN 55 2HD2 ASN 55 -21.777 5.162 -4.729 427 H ASP 56 H ASP 56 -16.638 8.965 -4.271 428 HA ASP 56 HA ASP 56 -18.015 10.572 -6.228 429 1HB ASP 56 1HB ASP 56 -16.210 11.337 -4.528 430 2HB ASP 56 2HB ASP 56 -15.053 10.659 -5.668 431 H ASN 57 H ASN 57 -14.978 8.726 -6.305 432 HA ASN 57 HA ASN 57 -15.772 7.166 -8.537 433 1HB ASN 57 1HB ASN 57 -14.122 7.969 -10.166 434 2HB ASN 57 2HB ASN 57 -15.268 9.241 -9.764 435 1HD2 ASN 57 1HD2 ASN 57 -11.978 8.181 -9.567 436 2HD2 ASN 57 2HD2 ASN 57 -11.319 9.667 -8.971 437 H THR 58 H THR 58 -13.984 5.739 -9.272 438 HA THR 58 HA THR 58 -12.057 5.236 -7.100 439 HB THR 58 HB THR 58 -12.855 3.350 -9.327 440 HG1 THR 58 HG1 THR 58 -14.620 3.899 -7.877 441 1HG2 THR 58 1HG2 THR 58 -10.690 2.885 -8.264 442 2HG2 THR 58 2HG2 THR 58 -11.877 1.636 -7.888 443 3HG2 THR 58 3HG2 THR 58 -11.476 2.862 -6.685 444 H VAL 59 H VAL 59 -10.008 5.793 -7.500 445 HA VAL 59 HA VAL 59 -9.196 6.336 -10.264 446 HB VAL 59 HB VAL 59 -7.510 6.846 -7.825 447 1HG1 VAL 59 1HG1 VAL 59 -7.665 8.206 -10.512 448 2HG1 VAL 59 2HG1 VAL 59 -6.432 7.052 -10.004 449 3HG1 VAL 59 3HG1 VAL 59 -6.556 8.622 -9.207 450 1HG2 VAL 59 1HG2 VAL 59 -9.637 8.671 -8.931 451 2HG2 VAL 59 2HG2 VAL 59 -8.436 9.120 -7.720 452 3HG2 VAL 59 3HG2 VAL 59 -9.645 7.889 -7.351 453 H LEU 60 H LEU 60 -8.138 4.782 -11.346 454 HA LEU 60 HA LEU 60 -6.618 2.805 -9.799 455 1HB LEU 60 1HB LEU 60 -6.696 1.386 -11.829 456 2HB LEU 60 2HB LEU 60 -8.269 1.723 -11.142 457 HG LEU 60 HG LEU 60 -7.269 3.366 -13.443 458 1HD1 LEU 60 1HD1 LEU 60 -8.358 1.762 -14.964 459 2HD1 LEU 60 2HD1 LEU 60 -8.591 0.657 -13.610 460 3HD1 LEU 60 3HD1 LEU 60 -6.962 1.062 -14.144 461 1HD2 LEU 60 1HD2 LEU 60 -9.309 4.046 -12.239 462 2HD2 LEU 60 2HD2 LEU 60 -10.022 2.469 -12.587 463 3HD2 LEU 60 3HD2 LEU 60 -9.644 3.578 -13.906 464 H LEU 61 H LEU 61 -4.528 3.040 -9.732 465 HA LEU 61 HA LEU 61 -3.207 4.664 -11.803 466 1HB LEU 61 1HB LEU 61 -2.116 3.956 -9.088 467 2HB LEU 61 2HB LEU 61 -1.539 5.194 -10.184 468 HG LEU 61 HG LEU 61 -4.193 5.272 -8.749 469 1HD1 LEU 61 1HD1 LEU 61 -2.349 5.468 -7.187 470 2HD1 LEU 61 2HD1 LEU 61 -3.150 7.026 -7.388 471 3HD1 LEU 61 3HD1 LEU 61 -1.609 6.718 -8.187 472 1HD2 LEU 61 1HD2 LEU 61 -2.757 7.351 -10.393 473 2HD2 LEU 61 2HD2 LEU 61 -4.258 7.595 -9.502 474 3HD2 LEU 61 3HD2 LEU 61 -4.215 6.479 -10.865 475 H LYS 62 H LYS 62 -2.390 3.303 -13.332 476 HA LYS 62 HA LYS 62 -1.129 0.816 -12.550 477 1HB LYS 62 1HB LYS 62 -2.344 1.043 -14.724 478 2HB LYS 62 2HB LYS 62 -1.101 2.167 -15.261 479 1HG LYS 62 1HG LYS 62 0.563 0.287 -14.774 480 2HG LYS 62 2HG LYS 62 -0.848 -0.768 -14.694 481 1HD LYS 62 1HD LYS 62 -0.009 -0.908 -16.911 482 2HD LYS 62 2HD LYS 62 -1.476 0.072 -16.983 483 1HE LYS 62 1HE LYS 62 0.219 1.106 -18.347 484 2HE LYS 62 2HE LYS 62 -0.062 2.109 -16.924 485 1HZ LYS 62 1HZ LYS 62 2.224 0.270 -17.405 486 2HZ LYS 62 2HZ LYS 62 1.923 1.021 -15.916 487 3HZ LYS 62 3HZ LYS 62 2.271 1.962 -17.279 488 H GLY 63 H GLY 63 0.826 0.812 -11.695 489 1HA GLY 63 1HA GLY 63 2.620 3.044 -12.038 490 2HA GLY 63 2HA GLY 63 2.919 1.596 -11.090 491 H LEU 64 H LEU 64 4.608 0.516 -11.773 492 HA LEU 64 HA LEU 64 5.910 1.021 -14.200 493 1HB LEU 64 1HB LEU 64 6.202 -1.313 -12.319 494 2HB LEU 64 2HB LEU 64 7.300 -0.959 -13.640 495 HG LEU 64 HG LEU 64 6.805 0.783 -11.225 496 1HD1 LEU 64 1HD1 LEU 64 8.120 -1.210 -10.736 497 2HD1 LEU 64 2HD1 LEU 64 9.111 0.245 -10.655 498 3HD1 LEU 64 3HD1 LEU 64 9.219 -0.816 -12.058 499 1HD2 LEU 64 1HD2 LEU 64 8.686 1.183 -13.547 500 2HD2 LEU 64 2HD2 LEU 64 8.606 2.185 -12.098 501 3HD2 LEU 64 3HD2 LEU 64 7.237 2.131 -13.210 502 H LYS 65 H LYS 65 4.802 -2.286 -13.373 503 HA LYS 65 HA LYS 65 3.340 -2.643 -15.766 504 1HB LYS 65 1HB LYS 65 5.577 -2.303 -16.762 505 2HB LYS 65 2HB LYS 65 6.179 -3.677 -15.848 506 1HG LYS 65 1HG LYS 65 4.625 -5.143 -17.051 507 2HG LYS 65 2HG LYS 65 4.061 -3.755 -17.987 508 1HD LYS 65 1HD LYS 65 6.356 -3.421 -18.819 509 2HD LYS 65 2HD LYS 65 6.867 -4.860 -17.934 510 1HE LYS 65 1HE LYS 65 6.462 -5.362 -20.284 511 2HE LYS 65 2HE LYS 65 5.331 -6.223 -19.242 512 1HZ LYS 65 1HZ LYS 65 4.316 -5.208 -21.242 513 2HZ LYS 65 2HZ LYS 65 4.687 -3.674 -20.616 514 3HZ LYS 65 3HZ LYS 65 3.616 -4.699 -19.785 515 H ASN 66 H ASN 66 5.674 -4.503 -13.769 516 HA ASN 66 HA ASN 66 3.647 -6.632 -13.633 517 1HB ASN 66 1HB ASN 66 5.316 -7.139 -15.386 518 2HB ASN 66 2HB ASN 66 6.596 -7.044 -14.182 519 1HD2 ASN 66 1HD2 ASN 66 3.853 -8.851 -15.326 520 2HD2 ASN 66 2HD2 ASN 66 4.236 -10.326 -14.498 521 H ILE 67 H ILE 67 6.931 -6.889 -12.442 522 HA ILE 67 HA ILE 67 7.828 -7.134 -10.377 523 HB ILE 67 HB ILE 67 5.535 -5.505 -9.279 524 1HG1 ILE 67 1HG1 ILE 67 8.084 -4.506 -10.581 525 2HG1 ILE 67 2HG1 ILE 67 6.469 -4.382 -11.275 526 1HG2 ILE 67 1HG2 ILE 67 7.250 -4.727 -7.684 527 2HG2 ILE 67 2HG2 ILE 67 8.422 -5.809 -8.440 528 3HG2 ILE 67 3HG2 ILE 67 7.017 -6.475 -7.610 529 1HD1 ILE 67 1HD1 ILE 67 7.396 -3.072 -8.733 530 2HD1 ILE 67 2HD1 ILE 67 5.786 -2.937 -9.439 531 3HD1 ILE 67 3HD1 ILE 67 7.181 -2.283 -10.294 532 H VAL 68 H VAL 68 6.035 -9.149 -11.319 533 HA VAL 68 HA VAL 68 4.489 -10.062 -9.080 534 HB VAL 68 HB VAL 68 5.425 -11.591 -11.520 535 1HG1 VAL 68 1HG1 VAL 68 3.359 -12.341 -9.447 536 2HG1 VAL 68 2HG1 VAL 68 4.936 -13.102 -9.665 537 3HG1 VAL 68 3HG1 VAL 68 3.710 -13.235 -10.926 538 1HG2 VAL 68 1HG2 VAL 68 3.933 -9.721 -12.052 539 2HG2 VAL 68 2HG2 VAL 68 2.750 -10.340 -10.897 540 3HG2 VAL 68 3HG2 VAL 68 3.148 -11.274 -12.339 541 H SER 69 H SER 69 5.772 -10.158 -7.314 542 HA SER 69 HA SER 69 7.803 -12.290 -7.300 543 1HB SER 69 1HB SER 69 8.851 -10.022 -7.248 544 2HB SER 69 2HB SER 69 7.951 -9.670 -5.776 545 HG SER 69 HG SER 69 9.044 -11.541 -4.858 546 H VAL 70 H VAL 70 4.912 -12.032 -6.620 547 HA VAL 70 HA VAL 70 4.751 -12.202 -3.743 548 HB VAL 70 HB VAL 70 2.654 -12.586 -5.891 549 1HG1 VAL 70 1HG1 VAL 70 1.012 -12.371 -4.073 550 2HG1 VAL 70 2HG1 VAL 70 2.329 -12.412 -2.901 551 3HG1 VAL 70 3HG1 VAL 70 2.009 -13.818 -3.916 552 1HG2 VAL 70 1HG2 VAL 70 3.496 -10.316 -5.789 553 2HG2 VAL 70 2HG2 VAL 70 3.213 -10.268 -4.049 554 3HG2 VAL 70 3HG2 VAL 70 1.850 -10.385 -5.162 555 H LYS 71 H LYS 71 4.826 -14.037 -2.573 556 HA LYS 71 HA LYS 71 5.170 -16.576 -3.881 557 1HB LYS 71 1HB LYS 71 4.829 -15.912 -0.947 558 2HB LYS 71 2HB LYS 71 5.149 -17.522 -1.566 559 1HG LYS 71 1HG LYS 71 7.217 -16.276 -2.670 560 2HG LYS 71 2HG LYS 71 6.957 -15.191 -1.300 561 1HD LYS 71 1HD LYS 71 7.408 -18.178 -1.166 562 2HD LYS 71 2HD LYS 71 8.560 -16.928 -0.706 563 1HE LYS 71 1HE LYS 71 5.871 -17.069 0.606 564 2HE LYS 71 2HE LYS 71 7.163 -18.148 1.123 565 1HZ LYS 71 1HZ LYS 71 7.139 -16.201 2.496 566 2HZ LYS 71 2HZ LYS 71 7.221 -15.179 1.144 567 3HZ LYS 71 3HZ LYS 71 8.541 -16.171 1.542 568 H PHE 72 H PHE 72 3.722 -18.250 -4.028 569 HA PHE 72 HA PHE 72 0.931 -17.629 -3.794 570 1HB PHE 72 1HB PHE 72 0.651 -20.045 -4.530 571 2HB PHE 72 2HB PHE 72 1.529 -19.007 -5.643 572 HD1 PHE 72 HD1 PHE 72 1.686 -21.922 -3.499 573 HD2 PHE 72 HD2 PHE 72 3.981 -19.239 -5.875 574 HE1 PHE 72 HE1 PHE 72 3.541 -23.538 -3.523 575 HE2 PHE 72 HE2 PHE 72 5.840 -20.851 -5.905 576 HZ PHE 72 HZ PHE 72 5.621 -23.001 -4.730 577 H SER 73 H SER 73 1.746 -17.211 -1.366 578 HA SER 73 HA SER 73 0.824 -19.479 0.223 579 1HB SER 73 1HB SER 73 3.349 -19.581 -0.014 580 2HB SER 73 2HB SER 73 3.421 -18.046 0.854 581 HG SER 73 HG SER 73 3.294 -20.472 1.869 582 H LYS 74 H LYS 74 1.308 -18.533 2.697 583 HA LYS 74 HA LYS 74 0.274 -15.793 2.818 584 1HB LYS 74 1HB LYS 74 -0.897 -18.222 4.187 585 2HB LYS 74 2HB LYS 74 -1.208 -16.584 4.747 586 1HG LYS 74 1HG LYS 74 -2.246 -16.018 2.642 587 2HG LYS 74 2HG LYS 74 -1.834 -17.599 1.982 588 1HD LYS 74 1HD LYS 74 -3.438 -17.476 4.486 589 2HD LYS 74 2HD LYS 74 -4.230 -17.100 2.954 590 1HE LYS 74 1HE LYS 74 -2.611 -19.598 3.402 591 2HE LYS 74 2HE LYS 74 -4.348 -19.512 3.701 592 1HZ LYS 74 1HZ LYS 74 -4.765 -19.085 1.431 593 2HZ LYS 74 2HZ LYS 74 -3.660 -20.378 1.463 594 3HZ LYS 74 3HZ LYS 74 -3.124 -18.813 1.087 595 H ASP 75 H ASP 75 2.386 -15.193 3.373 596 HA ASP 75 HA ASP 75 3.641 -16.509 5.673 597 1HB ASP 75 1HB ASP 75 4.743 -16.028 3.355 598 2HB ASP 75 2HB ASP 75 4.925 -14.392 3.972 599 H ARG 76 H ARG 76 2.406 -15.533 7.343 600 HA ARG 76 HA ARG 76 2.132 -12.710 7.596 601 1HB ARG 76 1HB ARG 76 1.819 -14.956 9.584 602 2HB ARG 76 2HB ARG 76 1.547 -13.271 10.000 603 1HG ARG 76 1HG ARG 76 -0.219 -13.150 8.302 604 2HG ARG 76 2HG ARG 76 0.048 -14.854 7.920 605 1HD ARG 76 1HD ARG 76 -1.873 -14.447 9.457 606 2HD ARG 76 2HD ARG 76 -0.640 -15.519 10.117 607 HE ARG 76 HE ARG 76 0.184 -13.349 11.244 608 1HH1 ARG 76 1HH1 ARG 76 -3.191 -14.093 10.601 609 2HH1 ARG 76 2HH1 ARG 76 -3.759 -13.248 12.009 610 1HH2 ARG 76 1HH2 ARG 76 -0.575 -12.229 13.057 611 2HH2 ARG 76 2HH2 ARG 76 -2.283 -12.175 13.399 612 H HIS 77 H HIS 77 4.508 -15.038 8.584 613 HA HIS 77 HA HIS 77 5.812 -13.579 10.592 614 1HB HIS 77 1HB HIS 77 6.185 -15.960 10.304 615 2HB HIS 77 2HB HIS 77 6.872 -15.696 8.706 616 HD1 HIS 77 HD1 HIS 77 9.320 -15.667 8.640 617 HD2 HIS 77 HD2 HIS 77 7.860 -14.595 12.383 618 HE1 HIS 77 HE1 HIS 77 11.347 -15.362 10.099 619 HE2 HIS 77 HE2 HIS 77 10.442 -14.527 12.303 620 H LEU 78 H LEU 78 6.255 -13.634 7.083 621 HA LEU 78 HA LEU 78 8.583 -11.997 7.124 622 1HB LEU 78 1HB LEU 78 7.950 -13.510 5.250 623 2HB LEU 78 2HB LEU 78 6.645 -12.411 4.850 624 HG LEU 78 HG LEU 78 8.231 -10.656 4.297 625 1HD1 LEU 78 1HD1 LEU 78 10.650 -11.120 4.288 626 2HD1 LEU 78 2HD1 LEU 78 10.342 -12.661 5.091 627 3HD1 LEU 78 3HD1 LEU 78 9.969 -11.146 5.915 628 1HD2 LEU 78 1HD2 LEU 78 9.285 -11.702 2.351 629 2HD2 LEU 78 2HD2 LEU 78 7.618 -12.243 2.553 630 3HD2 LEU 78 3HD2 LEU 78 8.951 -13.295 3.031 631 H ILE 79 H ILE 79 5.133 -11.349 6.940 632 HA ILE 79 HA ILE 79 5.250 -8.616 6.290 633 HB ILE 79 HB ILE 79 3.236 -10.024 8.053 634 1HG1 ILE 79 1HG1 ILE 79 3.160 -9.449 5.082 635 2HG1 ILE 79 2HG1 ILE 79 3.475 -11.026 5.799 636 1HG2 ILE 79 1HG2 ILE 79 3.039 -7.404 6.567 637 2HG2 ILE 79 2HG2 ILE 79 3.150 -7.605 8.317 638 3HG2 ILE 79 3HG2 ILE 79 1.730 -8.188 7.450 639 1HD1 ILE 79 1HD1 ILE 79 0.932 -9.443 6.086 640 2HD1 ILE 79 2HD1 ILE 79 1.246 -11.041 6.768 641 3HD1 ILE 79 3HD1 ILE 79 1.179 -10.824 5.018 642 H GLU 80 H GLU 80 5.126 -10.240 9.443 643 HA GLU 80 HA GLU 80 5.247 -8.043 11.120 644 1HB GLU 80 1HB GLU 80 6.409 -10.810 11.451 645 2HB GLU 80 2HB GLU 80 6.308 -9.633 12.749 646 1HG GLU 80 1HG GLU 80 3.930 -9.669 12.693 647 2HG GLU 80 2HG GLU 80 3.927 -10.640 11.221 648 H THR 81 H THR 81 7.925 -9.916 9.736 649 HA THR 81 HA THR 81 9.937 -8.435 11.088 650 HB THR 81 HB THR 81 11.449 -9.589 9.335 651 HG1 THR 81 HG1 THR 81 9.238 -11.313 8.989 652 1HG2 THR 81 1HG2 THR 81 9.756 -11.223 11.228 653 2HG2 THR 81 2HG2 THR 81 11.222 -10.339 11.648 654 3HG2 THR 81 3HG2 THR 81 11.307 -11.716 10.549 655 H THR 82 H THR 82 8.445 -8.153 7.909 656 HA THR 82 HA THR 82 10.297 -6.296 6.846 657 HB THR 82 HB THR 82 7.368 -6.628 6.153 658 HG1 THR 82 HG1 THR 82 8.422 -8.555 5.768 659 1HG2 THR 82 1HG2 THR 82 8.002 -5.642 3.994 660 2HG2 THR 82 2HG2 THR 82 9.640 -5.380 4.595 661 3HG2 THR 82 3HG2 THR 82 8.284 -4.519 5.323 662 H SER 83 H SER 83 7.163 -5.825 8.491 663 HA SER 83 HA SER 83 7.253 -3.008 8.501 664 1HB SER 83 1HB SER 83 5.857 -4.941 10.365 665 2HB SER 83 2HB SER 83 5.590 -3.197 10.367 666 HG SER 83 HG SER 83 4.116 -3.691 8.942 667 H ASN 84 H ASN 84 8.623 -5.426 10.609 668 HA ASN 84 HA ASN 84 9.353 -3.679 12.726 669 1HB ASN 84 1HB ASN 84 9.190 -6.310 12.601 670 2HB ASN 84 2HB ASN 84 10.880 -6.184 12.123 671 1HD2 ASN 84 1HD2 ASN 84 9.599 -7.317 14.511 672 2HD2 ASN 84 2HD2 ASN 84 10.346 -6.532 15.857 673 H LYS 85 H LYS 85 10.956 -4.811 9.789 674 HA LYS 85 HA LYS 85 13.496 -3.679 10.359 675 1HB LYS 85 1HB LYS 85 13.147 -5.463 8.678 676 2HB LYS 85 2HB LYS 85 12.276 -4.319 7.665 677 1HG LYS 85 1HG LYS 85 14.302 -2.952 7.480 678 2HG LYS 85 2HG LYS 85 15.169 -4.119 8.476 679 1HD LYS 85 1HD LYS 85 14.753 -5.852 6.786 680 2HD LYS 85 2HD LYS 85 13.911 -4.662 5.788 681 1HE LYS 85 1HE LYS 85 15.957 -3.339 5.635 682 2HE LYS 85 2HE LYS 85 16.798 -4.504 6.654 683 1HZ LYS 85 1HZ LYS 85 17.304 -4.868 4.343 684 2HZ LYS 85 2HZ LYS 85 15.660 -5.031 3.960 685 3HZ LYS 85 3HZ LYS 85 16.423 -6.186 4.948 686 H LEU 86 H LEU 86 10.650 -2.488 8.637 687 HA LEU 86 HA LEU 86 11.682 -0.062 7.694 688 1HB LEU 86 1HB LEU 86 9.510 -0.923 7.015 689 2HB LEU 86 2HB LEU 86 8.902 -0.761 8.649 690 HG LEU 86 HG LEU 86 9.210 1.720 8.438 691 1HD1 LEU 86 1HD1 LEU 86 10.853 1.736 6.646 692 2HD1 LEU 86 2HD1 LEU 86 9.419 2.656 6.190 693 3HD1 LEU 86 3HD1 LEU 86 9.670 1.037 5.540 694 1HD2 LEU 86 1HD2 LEU 86 7.361 0.359 6.487 695 2HD2 LEU 86 2HD2 LEU 86 7.226 2.036 7.017 696 3HD2 LEU 86 3HD2 LEU 86 7.026 0.725 8.180 697 H LYS 87 H LYS 87 10.246 -0.937 10.779 698 HA LYS 87 HA LYS 87 10.397 1.656 11.939 699 1HB LYS 87 1HB LYS 87 8.787 0.100 12.783 700 2HB LYS 87 2HB LYS 87 10.024 -1.111 13.087 701 1HG LYS 87 1HG LYS 87 10.959 0.296 14.854 702 2HG LYS 87 2HG LYS 87 9.704 1.503 14.549 703 1HD LYS 87 1HD LYS 87 7.992 0.025 15.251 704 2HD LYS 87 2HD LYS 87 9.089 -1.356 15.253 705 1HE LYS 87 1HE LYS 87 10.341 -0.354 17.104 706 2HE LYS 87 2HE LYS 87 9.240 1.023 17.102 707 1HZ LYS 87 1HZ LYS 87 8.414 -1.790 17.595 708 2HZ LYS 87 2HZ LYS 87 7.437 -0.405 17.720 709 3HZ LYS 87 3HZ LYS 87 8.710 -0.645 18.812 710 H SER 88 H SER 88 12.615 -0.989 11.590 711 HA SER 88 HA SER 88 14.328 -0.426 13.758 712 1HB SER 88 1HB SER 88 14.223 -2.540 12.276 713 2HB SER 88 2HB SER 88 15.254 -1.641 11.162 714 HG SER 88 HG SER 88 16.898 -1.925 12.448 715 H ARG 89 H ARG 89 15.108 0.079 10.296 716 HA ARG 89 HA ARG 89 16.743 2.356 11.162 717 1HB ARG 89 1HB ARG 89 17.903 0.614 9.854 718 2HB ARG 89 2HB ARG 89 16.788 0.895 8.518 719 1HG ARG 89 1HG ARG 89 17.598 3.360 8.749 720 2HG ARG 89 2HG ARG 89 18.979 2.615 9.552 721 1HD ARG 89 1HD ARG 89 19.501 1.326 7.617 722 2HD ARG 89 2HD ARG 89 17.993 1.795 6.831 723 HE ARG 89 HE ARG 89 19.263 4.165 7.297 724 1HH1 ARG 89 1HH1 ARG 89 20.164 1.191 5.666 725 2HH1 ARG 89 2HH1 ARG 89 21.190 1.991 4.516 726 1HH2 ARG 89 1HH2 ARG 89 20.604 5.215 5.762 727 2HH2 ARG 89 2HH2 ARG 89 21.441 4.260 4.571 728 H GLU 90 H GLU 90 15.092 1.632 8.111 729 HA GLU 90 HA GLU 90 13.306 3.764 7.987 730 1HB GLU 90 1HB GLU 90 16.112 4.462 7.305 731 2HB GLU 90 2HB GLU 90 14.890 4.986 6.157 732 1HG GLU 90 1HG GLU 90 13.714 6.142 7.993 733 2HG GLU 90 2HG GLU 90 15.020 5.675 9.084 734 H ILE 91 H ILE 91 15.769 2.021 6.174 735 HA ILE 91 HA ILE 91 15.883 1.171 4.081 736 HB ILE 91 HB ILE 91 14.265 -0.555 3.552 737 1HG1 ILE 91 1HG1 ILE 91 12.640 0.373 5.929 738 2HG1 ILE 91 2HG1 ILE 91 12.211 0.725 4.259 739 1HG2 ILE 91 1HG2 ILE 91 14.479 -1.890 5.600 740 2HG2 ILE 91 2HG2 ILE 91 14.935 -0.433 6.484 741 3HG2 ILE 91 3HG2 ILE 91 15.971 -1.042 5.192 742 1HD1 ILE 91 1HD1 ILE 91 12.426 -2.010 5.504 743 2HD1 ILE 91 2HD1 ILE 91 12.031 -1.680 3.815 744 3HD1 ILE 91 3HD1 ILE 91 10.937 -1.154 5.095 745 H THR 92 H THR 92 13.546 0.528 2.366 746 HA THR 92 HA THR 92 12.713 3.227 1.577 747 HB THR 92 HB THR 92 13.622 1.095 -0.375 748 HG1 THR 92 HG1 THR 92 15.043 2.875 1.102 749 1HG2 THR 92 1HG2 THR 92 11.970 2.654 -1.291 750 2HG2 THR 92 2HG2 THR 92 13.557 2.942 -2.005 751 3HG2 THR 92 3HG2 THR 92 12.945 4.018 -0.751 752 H PHE 93 H PHE 93 10.639 3.338 0.683 753 HA PHE 93 HA PHE 93 8.767 1.497 1.625 754 1HB PHE 93 1HB PHE 93 8.277 3.864 1.087 755 2HB PHE 93 2HB PHE 93 8.436 3.495 -0.625 756 HD1 PHE 93 HD1 PHE 93 6.372 3.012 2.375 757 HD2 PHE 93 HD2 PHE 93 6.675 2.414 -1.828 758 HE1 PHE 93 HE1 PHE 93 3.978 2.463 2.285 759 HE2 PHE 93 HE2 PHE 93 4.278 1.860 -1.924 760 HZ PHE 93 HZ PHE 93 2.927 1.887 0.133 761 H GLN 94 H GLN 94 10.451 1.697 -1.424 762 HA GLN 94 HA GLN 94 8.860 -0.085 -2.903 763 1HB GLN 94 1HB GLN 94 10.563 1.420 -3.891 764 2HB GLN 94 2HB GLN 94 11.826 0.428 -3.175 765 1HG GLN 94 1HG GLN 94 11.226 -1.438 -4.544 766 2HG GLN 94 2HG GLN 94 9.798 -0.598 -5.143 767 1HE2 GLN 94 1HE2 GLN 94 12.050 -1.725 -6.605 768 2HE2 GLN 94 2HE2 GLN 94 12.717 -0.424 -7.539 769 H GLU 95 H GLU 95 11.595 -0.615 -0.718 770 HA GLU 95 HA GLU 95 11.725 -3.434 -1.230 771 1HB GLU 95 1HB GLU 95 13.660 -2.072 -0.379 772 2HB GLU 95 2HB GLU 95 12.819 -1.943 1.161 773 1HG GLU 95 1HG GLU 95 12.849 -4.389 1.362 774 2HG GLU 95 2HG GLU 95 13.740 -4.486 -0.155 775 H TYR 96 H TYR 96 10.269 -1.351 1.195 776 HA TYR 96 HA TYR 96 9.321 -3.248 2.990 777 1HB TYR 96 1HB TYR 96 9.233 -0.844 3.415 778 2HB TYR 96 2HB TYR 96 8.059 -0.639 2.121 779 HD1 TYR 96 HD1 TYR 96 8.445 -2.718 5.205 780 HD2 TYR 96 HD2 TYR 96 5.876 -0.347 2.783 781 HE1 TYR 96 HE1 TYR 96 6.628 -3.049 6.822 782 HE2 TYR 96 HE2 TYR 96 4.050 -0.671 4.398 783 HH TYR 96 HH TYR 96 4.574 -2.237 7.484 784 H ARG 97 H ARG 97 7.750 -1.925 0.091 785 HA ARG 97 HA ARG 97 5.482 -3.645 0.281 786 1HB ARG 97 1HB ARG 97 5.433 -1.455 -0.863 787 2HB ARG 97 2HB ARG 97 6.516 -2.085 -2.093 788 1HG ARG 97 1HG ARG 97 4.127 -3.715 -1.729 789 2HG ARG 97 2HG ARG 97 3.777 -2.055 -2.213 790 1HD ARG 97 1HD ARG 97 5.634 -3.972 -3.625 791 2HD ARG 97 2HD ARG 97 4.023 -3.500 -4.164 792 HE ARG 97 HE ARG 97 5.911 -1.337 -3.777 793 1HH1 ARG 97 1HH1 ARG 97 4.433 -3.562 -6.052 794 2HH1 ARG 97 2HH1 ARG 97 4.822 -2.589 -7.435 795 1HH2 ARG 97 1HH2 ARG 97 6.423 -0.075 -5.620 796 2HH2 ARG 97 2HH2 ARG 97 5.925 -0.615 -7.201 797 H ARG 98 H ARG 98 8.630 -3.895 -1.193 798 HA ARG 98 HA ARG 98 8.108 -6.002 -2.992 799 1HB ARG 98 1HB ARG 98 10.162 -4.676 -3.093 800 2HB ARG 98 2HB ARG 98 10.662 -5.301 -1.529 801 1HG ARG 98 1HG ARG 98 11.878 -6.476 -3.201 802 2HG ARG 98 2HG ARG 98 10.680 -7.588 -2.532 803 1HD ARG 98 1HD ARG 98 9.183 -6.896 -4.466 804 2HD ARG 98 2HD ARG 98 10.613 -6.141 -5.167 805 HE ARG 98 HE ARG 98 10.210 -9.019 -4.721 806 1HH1 ARG 98 1HH1 ARG 98 12.170 -6.425 -6.030 807 2HH1 ARG 98 2HH1 ARG 98 13.005 -7.457 -7.160 808 1HH2 ARG 98 1HH2 ARG 98 11.289 -10.367 -6.193 809 2HH2 ARG 98 2HH2 ARG 98 12.492 -9.703 -7.255 810 H ASN 99 H ASN 99 9.182 -5.992 0.388 811 HA ASN 99 HA ASN 99 9.404 -8.844 0.508 812 1HB ASN 99 1HB ASN 99 9.347 -6.763 2.700 813 2HB ASN 99 2HB ASN 99 9.660 -8.476 2.966 814 1HD2 ASN 99 1HD2 ASN 99 11.392 -6.223 3.501 815 2HD2 ASN 99 2HD2 ASN 99 12.830 -6.484 2.578 816 H LEU 100 H LEU 100 6.884 -6.519 1.217 817 HA LEU 100 HA LEU 100 5.106 -8.267 2.524 818 1HB LEU 100 1HB LEU 100 4.706 -5.789 0.875 819 2HB LEU 100 2HB LEU 100 3.341 -6.683 1.518 820 HG LEU 100 HG LEU 100 5.558 -5.556 3.231 821 1HD1 LEU 100 1HD1 LEU 100 2.814 -4.443 2.663 822 2HD1 LEU 100 2HD1 LEU 100 4.343 -3.750 2.127 823 3HD1 LEU 100 3HD1 LEU 100 3.959 -3.814 3.847 824 1HD2 LEU 100 1HD2 LEU 100 2.831 -6.662 3.887 825 2HD2 LEU 100 2HD2 LEU 100 3.961 -5.959 5.045 826 3HD2 LEU 100 3HD2 LEU 100 4.376 -7.453 4.203 827 H ALA 101 H ALA 101 5.574 -7.512 -0.906 828 HA ALA 101 HA ALA 101 3.590 -9.194 -1.948 829 1HB ALA 101 1HB ALA 101 4.853 -9.124 -4.029 830 2HB ALA 101 2HB ALA 101 6.264 -8.504 -3.172 831 3HB ALA 101 3HB ALA 101 4.802 -7.526 -3.286 832 H LYS 102 H LYS 102 6.940 -9.816 -1.062 833 HA LYS 102 HA LYS 102 6.996 -12.500 -1.967 834 1HB LYS 102 1HB LYS 102 9.011 -11.125 -1.650 835 2HB LYS 102 2HB LYS 102 8.733 -11.114 0.083 836 1HG LYS 102 1HG LYS 102 9.241 -13.404 0.281 837 2HG LYS 102 2HG LYS 102 9.142 -13.654 -1.462 838 1HD LYS 102 1HD LYS 102 11.466 -13.592 -0.633 839 2HD LYS 102 2HD LYS 102 11.125 -12.331 -1.817 840 1HE LYS 102 1HE LYS 102 10.820 -10.722 0.024 841 2HE LYS 102 2HE LYS 102 11.221 -11.991 1.180 842 1HZ LYS 102 1HZ LYS 102 13.034 -11.037 -0.973 843 2HZ LYS 102 2HZ LYS 102 13.409 -12.163 0.241 844 3HZ LYS 102 3HZ LYS 102 13.117 -10.541 0.648 845 H ALA 103 H ALA 103 5.516 -11.062 0.716 846 HA ALA 103 HA ALA 103 5.517 -13.499 2.312 847 1HB ALA 103 1HB ALA 103 4.241 -12.209 3.927 848 2HB ALA 103 2HB ALA 103 4.098 -10.879 2.780 849 3HB ALA 103 3HB ALA 103 5.679 -11.313 3.431 850 H GLY 104 H GLY 104 3.817 -12.254 -0.282 851 1HA GLY 104 1HA GLY 104 2.141 -13.635 -1.325 852 2HA GLY 104 2HA GLY 104 1.592 -14.101 0.279 853 H VAL 105 H VAL 105 2.243 -10.883 0.435 854 HA VAL 105 HA VAL 105 -0.519 -10.170 0.491 855 HB VAL 105 HB VAL 105 1.898 -8.347 0.532 856 1HG1 VAL 105 1HG1 VAL 105 -0.166 -7.181 -0.074 857 2HG1 VAL 105 2HG1 VAL 105 0.385 -6.707 1.532 858 3HG1 VAL 105 3HG1 VAL 105 -0.961 -7.835 1.360 859 1HG2 VAL 105 1HG2 VAL 105 1.930 -9.958 2.369 860 2HG2 VAL 105 2HG2 VAL 105 0.290 -9.486 2.817 861 3HG2 VAL 105 3HG2 VAL 105 1.610 -8.325 2.956 862 H PHE 106 H PHE 106 -1.645 -10.052 -1.298 863 HA PHE 106 HA PHE 106 -0.398 -8.973 -3.730 864 1HB PHE 106 1HB PHE 106 -1.321 -11.237 -3.934 865 2HB PHE 106 2HB PHE 106 -2.885 -10.665 -3.369 866 HD1 PHE 106 HD1 PHE 106 -4.487 -10.062 -4.904 867 HD2 PHE 106 HD2 PHE 106 -0.399 -10.095 -6.080 868 HE1 PHE 106 HE1 PHE 106 -5.158 -9.600 -7.221 869 HE2 PHE 106 HE2 PHE 106 -1.062 -9.633 -8.404 870 HZ PHE 106 HZ PHE 106 -3.446 -9.384 -8.978 871 H ARG 107 H ARG 107 -2.802 -8.446 -1.334 872 HA ARG 107 HA ARG 107 -3.842 -6.141 -2.840 873 1HB ARG 107 1HB ARG 107 -5.299 -8.086 -1.057 874 2HB ARG 107 2HB ARG 107 -5.969 -6.519 -1.485 875 1HG ARG 107 1HG ARG 107 -6.091 -7.090 -3.779 876 2HG ARG 107 2HG ARG 107 -5.105 -8.534 -3.540 877 1HD ARG 107 1HD ARG 107 -7.571 -8.945 -3.811 878 2HD ARG 107 2HD ARG 107 -6.841 -9.637 -2.363 879 HE ARG 107 HE ARG 107 -7.784 -7.650 -1.174 880 1HH1 ARG 107 1HH1 ARG 107 -9.204 -8.723 -4.183 881 2HH1 ARG 107 2HH1 ARG 107 -10.798 -8.173 -3.779 882 1HH2 ARG 107 1HH2 ARG 107 -9.904 -6.961 -0.617 883 2HH2 ARG 107 2HH2 ARG 107 -11.209 -7.218 -1.733 884 H TRP 108 H TRP 108 -2.611 -4.587 -1.951 885 HA TRP 108 HA TRP 108 -2.353 -4.270 0.916 886 1HB TRP 108 1HB TRP 108 -0.511 -3.653 -0.592 887 2HB TRP 108 2HB TRP 108 -1.549 -2.510 -1.426 888 HD1 TRP 108 HD1 TRP 108 -2.685 -0.841 0.982 889 HE1 TRP 108 HE1 TRP 108 -1.118 0.670 2.351 890 HE3 TRP 108 HE3 TRP 108 1.766 -3.083 -0.130 891 HZ2 TRP 108 HZ2 TRP 108 1.649 0.884 2.882 892 HZ3 TRP 108 HZ3 TRP 108 3.826 -2.157 0.836 893 HH2 TRP 108 HH2 TRP 108 3.770 -0.215 2.309 894 H VAL 109 H VAL 109 -4.272 -3.761 1.885 895 HA VAL 109 HA VAL 109 -5.935 -1.707 0.581 896 HB VAL 109 HB VAL 109 -6.861 -3.827 2.532 897 1HG1 VAL 109 1HG1 VAL 109 -8.391 -1.886 0.806 898 2HG1 VAL 109 2HG1 VAL 109 -8.230 -1.819 2.563 899 3HG1 VAL 109 3HG1 VAL 109 -9.103 -3.153 1.806 900 1HG2 VAL 109 1HG2 VAL 109 -7.133 -3.713 -0.470 901 2HG2 VAL 109 2HG2 VAL 109 -7.905 -4.897 0.584 902 3HG2 VAL 109 3HG2 VAL 109 -6.147 -4.853 0.444 903 H THR 110 H THR 110 -5.320 0.171 1.535 904 HA THR 110 HA THR 110 -5.128 0.229 4.462 905 HB THR 110 HB THR 110 -4.437 2.427 2.506 906 HG1 THR 110 HG1 THR 110 -3.155 0.251 2.767 907 1HG2 THR 110 1HG2 THR 110 -3.807 2.111 5.446 908 2HG2 THR 110 2HG2 THR 110 -4.984 3.232 4.761 909 3HG2 THR 110 3HG2 THR 110 -3.269 3.434 4.408 910 H ASN 111 H ASN 111 -6.972 0.573 5.462 911 HA ASN 111 HA ASN 111 -9.089 2.124 4.208 912 1HB ASN 111 1HB ASN 111 -8.957 0.478 6.743 913 2HB ASN 111 2HB ASN 111 -10.352 1.470 6.332 914 1HD2 ASN 111 1HD2 ASN 111 -11.619 -0.441 6.322 915 2HD2 ASN 111 2HD2 ASN 111 -11.580 -1.519 4.963 916 H ILE 112 H ILE 112 -8.539 4.249 4.292 917 HA ILE 112 HA ILE 112 -7.321 5.508 6.526 918 HB ILE 112 HB ILE 112 -8.962 6.754 4.303 919 1HG1 ILE 112 1HG1 ILE 112 -7.044 5.519 3.429 920 2HG1 ILE 112 2HG1 ILE 112 -6.777 7.251 3.268 921 1HG2 ILE 112 1HG2 ILE 112 -6.982 8.040 6.187 922 2HG2 ILE 112 2HG2 ILE 112 -8.734 8.231 6.247 923 3HG2 ILE 112 3HG2 ILE 112 -7.828 8.837 4.861 924 1HD1 ILE 112 1HD1 ILE 112 -5.595 5.460 5.379 925 2HD1 ILE 112 2HD1 ILE 112 -5.341 7.200 5.252 926 3HD1 ILE 112 3HD1 ILE 112 -4.754 6.130 3.980 927 H HIS 113 H HIS 113 -10.571 4.812 5.561 928 HA HIS 113 HA HIS 113 -12.003 6.432 7.353 929 1HB HIS 113 1HB HIS 113 -12.983 5.236 5.420 930 2HB HIS 113 2HB HIS 113 -12.730 3.706 6.249 931 HD1 HIS 113 HD1 HIS 113 -14.805 2.841 7.238 932 HD2 HIS 113 HD2 HIS 113 -14.715 7.005 7.220 933 HE1 HIS 113 HE1 HIS 113 -16.991 3.579 8.244 934 HE2 HIS 113 HE2 HIS 113 -16.985 6.094 8.067 935 H GLU 114 H GLU 114 -10.009 3.723 7.958 936 HA GLU 114 HA GLU 114 -11.160 3.452 10.657 937 1HB GLU 114 1HB GLU 114 -10.029 1.296 8.875 938 2HB GLU 114 2HB GLU 114 -10.390 1.069 10.581 939 1HG GLU 114 1HG GLU 114 -12.726 1.528 10.183 940 2HG GLU 114 2HG GLU 114 -12.393 1.842 8.480 941 H GLN 115 H GLN 115 -8.540 4.425 8.915 942 HA GLN 115 HA GLN 115 -6.360 4.876 9.336 943 1HB GLN 115 1HB GLN 115 -7.714 5.763 11.468 944 2HB GLN 115 2HB GLN 115 -6.712 4.563 12.272 945 1HG GLN 115 1HG GLN 115 -5.627 6.693 12.396 946 2HG GLN 115 2HG GLN 115 -4.707 5.648 11.314 947 1HE2 GLN 115 1HE2 GLN 115 -4.679 6.096 9.116 948 2HE2 GLN 115 2HE2 GLN 115 -5.198 7.610 8.472 949 H LYS 116 H LYS 116 -6.997 2.174 8.829 950 HA LYS 116 HA LYS 116 -4.801 0.836 10.255 951 1HB LYS 116 1HB LYS 116 -7.554 -0.295 9.729 952 2HB LYS 116 2HB LYS 116 -6.169 -1.292 10.149 953 1HG LYS 116 1HG LYS 116 -5.991 -0.236 12.301 954 2HG LYS 116 2HG LYS 116 -7.252 0.926 11.879 955 1HD LYS 116 1HD LYS 116 -7.637 -2.065 12.054 956 2HD LYS 116 2HD LYS 116 -8.087 -0.910 13.313 957 1HE LYS 116 1HE LYS 116 -9.662 0.156 11.841 958 2HE LYS 116 2HE LYS 116 -9.135 -0.843 10.489 959 1HZ LYS 116 1HZ LYS 116 -10.522 -1.811 12.938 960 2HZ LYS 116 2HZ LYS 116 -9.974 -2.795 11.669 961 3HZ LYS 116 3HZ LYS 116 -11.197 -1.655 11.388 962 H ARG 117 H ARG 117 -3.714 -0.791 9.036 963 HA ARG 117 HA ARG 117 -4.288 -0.663 6.146 964 1HB ARG 117 1HB ARG 117 -2.084 0.286 6.978 965 2HB ARG 117 2HB ARG 117 -1.639 -1.357 7.416 966 1HG ARG 117 1HG ARG 117 -1.962 -2.020 5.043 967 2HG ARG 117 2HG ARG 117 -2.235 -0.321 4.655 968 1HD ARG 117 1HD ARG 117 0.267 -1.480 5.874 969 2HD ARG 117 2HD ARG 117 0.072 -0.981 4.197 970 HE ARG 117 HE ARG 117 -0.394 1.314 5.275 971 1HH1 ARG 117 1HH1 ARG 117 1.781 -1.110 6.535 972 2HH1 ARG 117 2HH1 ARG 117 2.885 0.040 7.218 973 1HH2 ARG 117 1HH2 ARG 117 1.073 2.871 6.174 974 2HH2 ARG 117 2HH2 ARG 117 2.480 2.305 7.016 975 H TYR 118 H TYR 118 -5.084 -2.457 5.312 976 HA TYR 118 HA TYR 118 -4.788 -4.972 6.782 977 1HB TYR 118 1HB TYR 118 -6.655 -4.182 4.538 978 2HB TYR 118 2HB TYR 118 -6.614 -5.775 5.284 979 HD1 TYR 118 HD1 TYR 118 -7.669 -6.178 7.386 980 HD2 TYR 118 HD2 TYR 118 -7.435 -2.216 5.843 981 HE1 TYR 118 HE1 TYR 118 -9.279 -5.425 9.086 982 HE2 TYR 118 HE2 TYR 118 -9.043 -1.455 7.541 983 HH TYR 118 HH TYR 118 -10.834 -2.419 8.941 984 H TYR 119 H TYR 119 -3.715 -6.686 5.982 985 HA TYR 119 HA TYR 119 -2.562 -6.418 3.285 986 1HB TYR 119 1HB TYR 119 -1.537 -8.059 5.617 987 2HB TYR 119 2HB TYR 119 -0.756 -7.888 4.050 988 HD1 TYR 119 HD1 TYR 119 0.028 -5.557 3.364 989 HD2 TYR 119 HD2 TYR 119 -1.088 -6.547 7.345 990 HE1 TYR 119 HE1 TYR 119 1.243 -3.588 4.182 991 HE2 TYR 119 HE2 TYR 119 0.132 -4.582 8.182 992 HH TYR 119 HH TYR 119 1.971 -3.100 7.471 993 H TYR 120 H TYR 120 -3.792 -7.532 1.904 994 HA TYR 120 HA TYR 120 -4.817 -10.167 2.742 995 1HB TYR 120 1HB TYR 120 -5.788 -8.231 0.639 996 2HB TYR 120 2HB TYR 120 -6.333 -9.899 0.719 997 HD1 TYR 120 HD1 TYR 120 -7.773 -10.654 2.533 998 HD2 TYR 120 HD2 TYR 120 -6.536 -6.593 2.258 999 HE1 TYR 120 HE1 TYR 120 -9.546 -10.015 4.112 1000 HE2 TYR 120 HE2 TYR 120 -8.304 -5.945 3.836 1001 HH TYR 120 HH TYR 120 -10.107 -8.243 5.644 1002 H THR 121 H THR 121 -4.365 -11.950 1.558 1003 HA THR 121 HA THR 121 -2.403 -11.728 -0.575 1004 HB THR 121 HB THR 121 -2.069 -13.489 1.088 1005 HG1 THR 121 HG1 THR 121 -1.254 -14.239 -0.758 1006 1HG2 THR 121 1HG2 THR 121 -3.618 -15.366 1.306 1007 2HG2 THR 121 2HG2 THR 121 -4.713 -14.606 0.149 1008 3HG2 THR 121 3HG2 THR 121 -4.415 -13.845 1.712 1009 H PHE 122 H PHE 122 -2.923 -13.349 -2.514 1010 HA PHE 122 HA PHE 122 -5.280 -12.360 -3.783 1011 1HB PHE 122 1HB PHE 122 -4.678 -13.987 -5.601 1012 2HB PHE 122 2HB PHE 122 -3.393 -12.861 -5.177 1013 HD1 PHE 122 HD1 PHE 122 -4.517 -16.344 -5.022 1014 HD2 PHE 122 HD2 PHE 122 -1.362 -13.623 -4.153 1015 HE1 PHE 122 HE1 PHE 122 -2.988 -18.235 -4.664 1016 HE2 PHE 122 HE2 PHE 122 0.172 -15.512 -3.793 1017 HZ PHE 122 HZ PHE 122 -0.643 -17.821 -4.050 1018 H ASP 123 H ASP 123 -4.620 -14.942 -1.696 1019 HA ASP 123 HA ASP 123 -6.861 -16.602 -2.395 1020 1HB ASP 123 1HB ASP 123 -4.827 -17.476 -1.293 1021 2HB ASP 123 2HB ASP 123 -5.170 -16.490 0.120 1022 H ASN 124 H ASN 124 -6.553 -13.622 -1.019 1023 HA ASN 124 HA ASN 124 -7.938 -12.166 -0.016 1024 1HB ASN 124 1HB ASN 124 -9.923 -14.242 -0.878 1025 2HB ASN 124 2HB ASN 124 -10.436 -12.851 0.071 1026 1HD2 ASN 124 1HD2 ASN 124 -11.102 -13.581 -2.666 1027 2HD2 ASN 124 2HD2 ASN 124 -10.614 -12.244 -3.653 1028 H SER 125 H SER 125 -6.785 -14.623 1.458 1029 HA SER 125 HA SER 125 -8.393 -14.539 3.868 1030 1HB SER 125 1HB SER 125 -7.202 -16.628 3.153 1031 2HB SER 125 2HB SER 125 -5.668 -15.799 3.412 1032 HG SER 125 HG SER 125 -6.086 -16.918 5.267 1033 H LEU 126 H LEU 126 -8.128 -13.013 5.394 1034 HA LEU 126 HA LEU 126 -6.324 -10.887 5.117 1035 1HB LEU 126 1HB LEU 126 -8.388 -10.704 6.411 1036 2HB LEU 126 2HB LEU 126 -7.763 -11.836 7.595 1037 HG LEU 126 HG LEU 126 -5.978 -10.212 8.166 1038 1HD1 LEU 126 1HD1 LEU 126 -7.482 -8.379 6.308 1039 2HD1 LEU 126 2HD1 LEU 126 -5.867 -9.033 6.037 1040 3HD1 LEU 126 3HD1 LEU 126 -6.153 -7.912 7.369 1041 1HD2 LEU 126 1HD2 LEU 126 -8.032 -10.290 9.475 1042 2HD2 LEU 126 2HD2 LEU 126 -8.790 -9.142 8.370 1043 3HD2 LEU 126 3HD2 LEU 126 -7.421 -8.640 9.359 1044 H LEU 127 H LEU 127 -4.219 -10.917 5.310 1045 HA LEU 127 HA LEU 127 -2.891 -13.077 6.698 1046 1HB LEU 127 1HB LEU 127 -1.715 -10.686 5.277 1047 2HB LEU 127 2HB LEU 127 -0.836 -12.105 5.811 1048 HG LEU 127 HG LEU 127 -2.914 -11.996 3.632 1049 1HD1 LEU 127 1HD1 LEU 127 -1.058 -12.594 2.180 1050 2HD1 LEU 127 2HD1 LEU 127 0.041 -12.585 3.558 1051 3HD1 LEU 127 3HD1 LEU 127 -0.720 -11.085 3.027 1052 1HD2 LEU 127 1HD2 LEU 127 -3.075 -14.069 4.914 1053 2HD2 LEU 127 2HD2 LEU 127 -1.348 -14.342 4.685 1054 3HD2 LEU 127 3HD2 LEU 127 -2.435 -14.354 3.296 1055 H PHE 128 H PHE 128 -2.864 -9.533 6.855 1056 HA PHE 128 HA PHE 128 -2.360 -9.654 9.708 1057 1HB PHE 128 1HB PHE 128 -0.144 -9.777 8.315 1058 2HB PHE 128 2HB PHE 128 -0.437 -8.071 8.017 1059 HD1 PHE 128 HD1 PHE 128 -0.141 -6.440 9.750 1060 HD2 PHE 128 HD2 PHE 128 0.373 -10.591 10.547 1061 HE1 PHE 128 HE1 PHE 128 0.969 -5.889 11.874 1062 HE2 PHE 128 HE2 PHE 128 1.480 -10.047 12.676 1063 HZ PHE 128 HZ PHE 128 1.778 -7.696 13.344 1064 H THR 129 H THR 129 -2.709 -7.614 10.733 1065 HA THR 129 HA THR 129 -3.672 -5.450 9.003 1066 HB THR 129 HB THR 129 -5.046 -6.316 11.559 1067 HG1 THR 129 HG1 THR 129 -5.289 -7.193 9.026 1068 1HG2 THR 129 1HG2 THR 129 -6.764 -4.670 10.885 1069 2HG2 THR 129 2HG2 THR 129 -5.746 -4.184 9.528 1070 3HG2 THR 129 3HG2 THR 129 -5.200 -3.909 11.181 1071 H GLU 130 H GLU 130 -2.226 -3.900 9.307 1072 HA GLU 130 HA GLU 130 -1.109 -3.538 12.001 1073 1HB GLU 130 1HB GLU 130 0.535 -4.108 10.265 1074 2HB GLU 130 2HB GLU 130 0.017 -2.727 9.314 1075 1HG GLU 130 1HG GLU 130 0.954 -1.195 10.814 1076 2HG GLU 130 2HG GLU 130 1.119 -2.407 12.084 1077 H SER 131 H SER 131 -2.014 -1.944 13.074 1078 HA SER 131 HA SER 131 -3.485 0.163 11.870 1079 1HB SER 131 1HB SER 131 -2.375 -0.005 14.684 1080 2HB SER 131 2HB SER 131 -3.689 1.036 14.134 1081 HG SER 131 HG SER 131 -5.010 -0.575 14.356 1082 H ILE 132 H ILE 132 -2.745 2.006 11.026 1083 HA ILE 132 HA ILE 132 0.072 2.427 10.924 1084 HB ILE 132 HB ILE 132 -0.619 4.562 9.662 1085 1HG1 ILE 132 1HG1 ILE 132 -3.275 3.106 9.759 1086 2HG1 ILE 132 2HG1 ILE 132 -2.940 4.688 10.451 1087 1HG2 ILE 132 1HG2 ILE 132 -1.077 3.236 7.632 1088 2HG2 ILE 132 2HG2 ILE 132 -1.325 1.813 8.644 1089 3HG2 ILE 132 3HG2 ILE 132 0.258 2.587 8.586 1090 1HD1 ILE 132 1HD1 ILE 132 -2.895 3.982 7.527 1091 2HD1 ILE 132 2HD1 ILE 132 -2.528 5.569 8.203 1092 3HD1 ILE 132 3HD1 ILE 132 -4.148 4.894 8.368 1093 H GLN 133 H GLN 133 0.763 2.806 12.939 1094 HA GLN 133 HA GLN 133 1.727 4.181 14.455 1095 1HB GLN 133 1HB GLN 133 1.502 5.960 12.659 1096 2HB GLN 133 2HB GLN 133 0.023 6.457 13.466 1097 1HG GLN 133 1HG GLN 133 1.852 7.870 14.149 1098 2HG GLN 133 2HG GLN 133 1.307 6.898 15.516 1099 1HE2 GLN 133 1HE2 GLN 133 3.231 5.603 12.916 1100 2HE2 GLN 133 2HE2 GLN 133 4.672 5.348 13.836 Start of MODEL 16 1 H ASP 7 H ASP 7 -5.362 14.987 -15.600 2 HA ASP 7 HA ASP 7 -7.326 13.186 -14.363 3 1HB ASP 7 1HB ASP 7 -4.455 12.624 -15.131 4 2HB ASP 7 2HB ASP 7 -5.612 11.450 -14.517 5 H GLN 8 H GLN 8 -7.555 13.494 -12.211 6 HA GLN 8 HA GLN 8 -5.455 14.391 -10.514 7 1HB GLN 8 1HB GLN 8 -6.879 13.882 -8.674 8 2HB GLN 8 2HB GLN 8 -7.922 14.465 -9.964 9 1HG GLN 8 1HG GLN 8 -8.321 12.063 -10.553 10 2HG GLN 8 2HG GLN 8 -7.520 11.647 -9.045 11 1HE2 GLN 8 1HE2 GLN 8 -10.312 13.124 -10.490 12 2HE2 GLN 8 2HE2 GLN 8 -11.292 13.147 -9.058 13 H VAL 9 H VAL 9 -6.061 11.501 -12.097 14 HA VAL 9 HA VAL 9 -4.942 9.520 -10.515 15 HB VAL 9 HB VAL 9 -4.579 9.907 -13.497 16 1HG1 VAL 9 1HG1 VAL 9 -4.300 7.458 -13.567 17 2HG1 VAL 9 2HG1 VAL 9 -4.335 7.422 -11.804 18 3HG1 VAL 9 3HG1 VAL 9 -3.028 8.256 -12.644 19 1HG2 VAL 9 1HG2 VAL 9 -6.737 8.455 -11.968 20 2HG2 VAL 9 2HG2 VAL 9 -6.538 8.425 -13.720 21 3HG2 VAL 9 3HG2 VAL 9 -6.928 9.938 -12.903 22 H VAL 10 H VAL 10 -3.385 11.920 -12.597 23 HA VAL 10 HA VAL 10 -0.719 11.078 -12.174 24 HB VAL 10 HB VAL 10 -1.700 13.871 -12.801 25 1HG1 VAL 10 1HG1 VAL 10 0.507 14.170 -13.827 26 2HG1 VAL 10 2HG1 VAL 10 0.970 12.555 -13.291 27 3HG1 VAL 10 3HG1 VAL 10 0.629 13.814 -12.105 28 1HG2 VAL 10 1HG2 VAL 10 -0.991 11.623 -14.685 29 2HG2 VAL 10 2HG2 VAL 10 -1.379 13.279 -15.155 30 3HG2 VAL 10 3HG2 VAL 10 -2.607 12.269 -14.393 31 H ILE 11 H ILE 11 -2.840 13.345 -10.522 32 HA ILE 11 HA ILE 11 -1.001 14.451 -8.717 33 HB ILE 11 HB ILE 11 -3.997 14.117 -8.657 34 1HG1 ILE 11 1HG1 ILE 11 -3.863 16.643 -8.644 35 2HG1 ILE 11 2HG1 ILE 11 -2.125 16.493 -8.853 36 1HG2 ILE 11 1HG2 ILE 11 -4.089 15.446 -6.598 37 2HG2 ILE 11 2HG2 ILE 11 -2.331 15.375 -6.473 38 3HG2 ILE 11 3HG2 ILE 11 -3.286 13.897 -6.339 39 1HD1 ILE 11 1HD1 ILE 11 -2.537 15.280 -10.972 40 2HD1 ILE 11 2HD1 ILE 11 -3.135 16.939 -10.968 41 3HD1 ILE 11 3HD1 ILE 11 -4.259 15.597 -10.769 42 H PHE 12 H PHE 12 -3.277 11.745 -8.264 43 HA PHE 12 HA PHE 12 -2.447 11.105 -5.655 44 1HB PHE 12 1HB PHE 12 -3.870 9.543 -7.793 45 2HB PHE 12 2HB PHE 12 -3.459 8.809 -6.249 46 HD1 PHE 12 HD1 PHE 12 -5.016 11.988 -7.455 47 HD2 PHE 12 HD2 PHE 12 -5.136 8.735 -4.718 48 HE1 PHE 12 HE1 PHE 12 -7.090 12.884 -6.490 49 HE2 PHE 12 HE2 PHE 12 -7.214 9.625 -3.749 50 HZ PHE 12 HZ PHE 12 -8.193 11.702 -4.635 51 H LYS 13 H LYS 13 -1.367 9.900 -8.814 52 HA LYS 13 HA LYS 13 0.259 7.847 -7.729 53 1HB LYS 13 1HB LYS 13 -0.583 8.098 -10.155 54 2HB LYS 13 2HB LYS 13 0.818 9.147 -10.382 55 1HG LYS 13 1HG LYS 13 2.186 7.207 -9.425 56 2HG LYS 13 2HG LYS 13 0.748 6.224 -9.712 57 1HD LYS 13 1HD LYS 13 0.804 6.947 -12.090 58 2HD LYS 13 2HD LYS 13 2.327 7.780 -11.757 59 1HE LYS 13 1HE LYS 13 1.757 4.827 -11.640 60 2HE LYS 13 2HE LYS 13 2.886 5.672 -12.699 61 1HZ LYS 13 1HZ LYS 13 3.139 5.100 -9.814 62 2HZ LYS 13 2HZ LYS 13 4.036 6.344 -10.525 63 3HZ LYS 13 3HZ LYS 13 4.223 4.744 -11.066 64 H GLN 14 H GLN 14 0.876 11.221 -8.625 65 HA GLN 14 HA GLN 14 3.642 11.292 -8.309 66 1HB GLN 14 1HB GLN 14 1.487 13.331 -7.959 67 2HB GLN 14 2HB GLN 14 3.113 13.720 -7.425 68 1HG GLN 14 1HG GLN 14 3.947 13.252 -9.690 69 2HG GLN 14 2HG GLN 14 2.293 12.926 -10.210 70 1HE2 GLN 14 1HE2 GLN 14 2.437 14.599 -11.733 71 2HE2 GLN 14 2HE2 GLN 14 2.327 16.258 -11.265 72 H ILE 15 H ILE 15 1.083 11.381 -5.910 73 HA ILE 15 HA ILE 15 2.630 11.950 -3.637 74 HB ILE 15 HB ILE 15 0.207 10.142 -3.748 75 1HG1 ILE 15 1HG1 ILE 15 0.293 13.138 -3.333 76 2HG1 ILE 15 2HG1 ILE 15 -0.144 12.361 -4.850 77 1HG2 ILE 15 1HG2 ILE 15 1.352 11.809 -1.509 78 2HG2 ILE 15 2HG2 ILE 15 1.406 10.050 -1.630 79 3HG2 ILE 15 3HG2 ILE 15 -0.142 10.874 -1.433 80 1HD1 ILE 15 1HD1 ILE 15 -2.102 13.076 -3.583 81 2HD1 ILE 15 2HD1 ILE 15 -1.610 12.038 -2.243 82 3HD1 ILE 15 3HD1 ILE 15 -2.061 11.326 -3.791 83 H PHE 16 H PHE 16 1.707 8.823 -5.067 84 HA PHE 16 HA PHE 16 3.162 7.264 -3.183 85 1HB PHE 16 1HB PHE 16 2.004 6.617 -5.893 86 2HB PHE 16 2HB PHE 16 2.847 5.423 -4.912 87 HD1 PHE 16 HD1 PHE 16 -0.172 7.479 -5.214 88 HD2 PHE 16 HD2 PHE 16 1.858 4.527 -2.915 89 HE1 PHE 16 HE1 PHE 16 -2.256 6.994 -4.001 90 HE2 PHE 16 HE2 PHE 16 -0.225 4.036 -1.700 91 HZ PHE 16 HZ PHE 16 -2.285 5.272 -2.241 92 H ASP 17 H ASP 17 3.917 8.477 -6.425 93 HA ASP 17 HA ASP 17 6.401 7.155 -6.680 94 1HB ASP 17 1HB ASP 17 5.123 9.490 -8.033 95 2HB ASP 17 2HB ASP 17 6.852 9.241 -8.252 96 H LYS 18 H LYS 18 5.452 10.065 -5.035 97 HA LYS 18 HA LYS 18 8.073 11.133 -4.671 98 1HB LYS 18 1HB LYS 18 5.953 12.443 -4.491 99 2HB LYS 18 2HB LYS 18 5.590 11.584 -3.004 100 1HG LYS 18 1HG LYS 18 6.463 13.673 -2.375 101 2HG LYS 18 2HG LYS 18 7.743 12.497 -2.077 102 1HD LYS 18 1HD LYS 18 8.893 13.155 -4.079 103 2HD LYS 18 2HD LYS 18 7.545 14.184 -4.570 104 1HE LYS 18 1HE LYS 18 9.254 15.590 -3.668 105 2HE LYS 18 2HE LYS 18 7.922 15.539 -2.515 106 1HZ LYS 18 1HZ LYS 18 9.177 13.878 -1.242 107 2HZ LYS 18 2HZ LYS 18 10.010 15.341 -1.376 108 3HZ LYS 18 3HZ LYS 18 10.468 14.021 -2.335 109 H VAL 19 H VAL 19 5.889 9.196 -2.647 110 HA VAL 19 HA VAL 19 7.653 9.263 -0.402 111 HB VAL 19 HB VAL 19 5.183 9.092 -0.203 112 1HG1 VAL 19 1HG1 VAL 19 4.766 7.492 -1.990 113 2HG1 VAL 19 2HG1 VAL 19 4.092 6.932 -0.460 114 3HG1 VAL 19 3HG1 VAL 19 5.593 6.235 -1.070 115 1HG2 VAL 19 1HG2 VAL 19 5.190 7.520 1.674 116 2HG2 VAL 19 2HG2 VAL 19 6.611 8.563 1.688 117 3HG2 VAL 19 3HG2 VAL 19 6.751 6.893 1.140 118 H ARG 20 H ARG 20 7.366 7.137 -3.142 119 HA ARG 20 HA ARG 20 8.407 4.824 -1.872 120 1HB ARG 20 1HB ARG 20 8.805 3.936 -4.126 121 2HB ARG 20 2HB ARG 20 7.187 4.593 -3.951 122 1HG ARG 20 1HG ARG 20 7.775 6.545 -5.202 123 2HG ARG 20 2HG ARG 20 9.476 6.071 -5.228 124 1HD ARG 20 1HD ARG 20 8.961 4.142 -6.583 125 2HD ARG 20 2HD ARG 20 7.234 4.475 -6.462 126 HE ARG 20 HE ARG 20 7.504 6.315 -7.918 127 1HH1 ARG 20 1HH1 ARG 20 10.463 4.500 -7.468 128 2HH1 ARG 20 2HH1 ARG 20 11.217 5.132 -8.890 129 1HH2 ARG 20 1HH2 ARG 20 8.467 7.148 -9.776 130 2HH2 ARG 20 2HH2 ARG 20 10.086 6.677 -10.215 131 H ASN 21 H ASN 21 9.940 7.648 -3.174 132 HA ASN 21 HA ASN 21 12.540 6.332 -2.767 133 1HB ASN 21 1HB ASN 21 11.703 8.476 -4.689 134 2HB ASN 21 2HB ASN 21 13.386 8.336 -4.197 135 1HD2 ASN 21 1HD2 ASN 21 13.214 5.417 -3.936 136 2HD2 ASN 21 2HD2 ASN 21 13.214 4.802 -5.549 137 H ASP 22 H ASP 22 10.744 9.346 -2.193 138 HA ASP 22 HA ASP 22 12.941 10.442 -0.664 139 1HB ASP 22 1HB ASP 22 11.480 11.883 -2.048 140 2HB ASP 22 2HB ASP 22 10.128 11.503 -0.986 141 H LEU 23 H LEU 23 10.010 8.717 -0.055 142 HA LEU 23 HA LEU 23 9.139 7.748 1.793 143 1HB LEU 23 1HB LEU 23 11.870 8.375 2.902 144 2HB LEU 23 2HB LEU 23 10.662 7.455 3.777 145 HG LEU 23 HG LEU 23 11.860 6.649 1.125 146 1HD1 LEU 23 1HD1 LEU 23 12.355 5.617 3.912 147 2HD1 LEU 23 2HD1 LEU 23 13.493 6.537 2.927 148 3HD1 LEU 23 3HD1 LEU 23 12.999 4.916 2.428 149 1HD2 LEU 23 1HD2 LEU 23 10.017 5.181 3.008 150 2HD2 LEU 23 2HD2 LEU 23 10.734 4.520 1.538 151 3HD2 LEU 23 3HD2 LEU 23 9.575 5.845 1.434 152 H ASN 24 H ASN 24 8.806 10.628 1.336 153 HA ASN 24 HA ASN 24 8.720 11.803 3.964 154 1HB ASN 24 1HB ASN 24 7.617 13.724 2.842 155 2HB ASN 24 2HB ASN 24 9.157 13.292 2.117 156 1HD2 ASN 24 1HD2 ASN 24 6.795 14.739 1.089 157 2HD2 ASN 24 2HD2 ASN 24 6.341 13.910 -0.364 158 H TYR 25 H TYR 25 7.448 10.101 4.916 159 HA TYR 25 HA TYR 25 4.784 9.562 4.175 160 1HB TYR 25 1HB TYR 25 6.206 9.275 6.825 161 2HB TYR 25 2HB TYR 25 4.568 8.698 6.535 162 HD1 TYR 25 HD1 TYR 25 4.273 7.063 4.534 163 HD2 TYR 25 HD2 TYR 25 8.007 7.864 6.408 164 HE1 TYR 25 HE1 TYR 25 5.160 4.950 3.652 165 HE2 TYR 25 HE2 TYR 25 8.905 5.749 5.531 166 HH TYR 25 HH TYR 25 7.434 3.994 3.097 167 H GLN 26 H GLN 26 6.214 12.199 5.839 168 HA GLN 26 HA GLN 26 4.129 13.221 7.357 169 1HB GLN 26 1HB GLN 26 6.159 14.746 5.708 170 2HB GLN 26 2HB GLN 26 5.184 15.427 7.002 171 1HG GLN 26 1HG GLN 26 6.277 14.058 8.631 172 2HG GLN 26 2HG GLN 26 7.139 13.174 7.373 173 1HE2 GLN 26 1HE2 GLN 26 7.640 15.600 5.819 174 2HE2 GLN 26 2HE2 GLN 26 8.905 16.444 6.645 175 H TRP 27 H TRP 27 4.865 13.789 3.925 176 HA TRP 27 HA TRP 27 2.423 15.292 3.556 177 1HB TRP 27 1HB TRP 27 4.454 15.975 2.374 178 2HB TRP 27 2HB TRP 27 4.543 14.408 1.580 179 HD1 TRP 27 HD1 TRP 27 1.927 17.290 1.792 180 HE1 TRP 27 HE1 TRP 27 0.904 17.582 -0.552 181 HE3 TRP 27 HE3 TRP 27 4.426 13.559 -0.658 182 HZ2 TRP 27 HZ2 TRP 27 1.133 16.395 -3.101 183 HZ3 TRP 27 HZ3 TRP 27 3.965 13.210 -3.051 184 HH2 TRP 27 HH2 TRP 27 2.353 14.601 -4.242 185 H PHE 28 H PHE 28 3.712 12.128 2.828 186 HA PHE 28 HA PHE 28 1.865 11.156 1.024 187 1HB PHE 28 1HB PHE 28 3.899 9.957 1.663 188 2HB PHE 28 2HB PHE 28 3.246 9.676 3.272 189 HD1 PHE 28 HD1 PHE 28 2.565 7.527 3.644 190 HD2 PHE 28 HD2 PHE 28 2.070 9.185 -0.246 191 HE1 PHE 28 HE1 PHE 28 1.584 5.407 2.869 192 HE2 PHE 28 HE2 PHE 28 1.088 7.068 -1.029 193 HZ PHE 28 HZ PHE 28 0.844 5.176 0.530 194 H TYR 29 H TYR 29 1.714 10.837 4.589 195 HA TYR 29 HA TYR 29 -0.837 9.580 4.530 196 1HB TYR 29 1HB TYR 29 0.833 10.761 6.730 197 2HB TYR 29 2HB TYR 29 -0.801 10.184 7.044 198 HD1 TYR 29 HD1 TYR 29 -1.342 7.773 6.561 199 HD2 TYR 29 HD2 TYR 29 2.645 9.252 6.593 200 HE1 TYR 29 HE1 TYR 29 -0.503 5.479 6.832 201 HE2 TYR 29 HE2 TYR 29 3.499 6.962 6.859 202 HH TYR 29 HH TYR 29 2.706 4.787 7.689 203 H SER 30 H SER 30 0.178 12.907 4.641 204 HA SER 30 HA SER 30 -2.218 14.014 5.641 205 1HB SER 30 1HB SER 30 -0.144 15.240 3.810 206 2HB SER 30 2HB SER 30 -1.415 16.134 4.644 207 HG SER 30 HG SER 30 0.867 14.866 5.691 208 H GLU 31 H GLU 31 -1.084 13.398 2.336 209 HA GLU 31 HA GLU 31 -3.447 14.466 1.155 210 1HB GLU 31 1HB GLU 31 -1.210 12.796 0.021 211 2HB GLU 31 2HB GLU 31 -2.552 13.402 -0.942 212 1HG GLU 31 1HG GLU 31 -0.519 15.032 0.554 213 2HG GLU 31 2HG GLU 31 -0.689 14.876 -1.196 214 H LEU 32 H LEU 32 -2.481 11.295 2.242 215 HA LEU 32 HA LEU 32 -4.608 9.852 1.045 216 1HB LEU 32 1HB LEU 32 -3.209 9.331 3.674 217 2HB LEU 32 2HB LEU 32 -4.228 8.188 2.824 218 HG LEU 32 HG LEU 32 -1.558 9.242 1.891 219 1HD1 LEU 32 1HD1 LEU 32 -2.421 6.504 2.802 220 2HD1 LEU 32 2HD1 LEU 32 -1.402 7.625 3.704 221 3HD1 LEU 32 3HD1 LEU 32 -0.825 6.934 2.187 222 1HD2 LEU 32 1HD2 LEU 32 -1.795 7.658 0.041 223 2HD2 LEU 32 2HD2 LEU 32 -3.049 8.897 -0.001 224 3HD2 LEU 32 3HD2 LEU 32 -3.431 7.275 0.580 225 H LYS 33 H LYS 33 -4.253 11.687 4.004 226 HA LYS 33 HA LYS 33 -6.806 10.980 5.076 227 1HB LYS 33 1HB LYS 33 -4.764 11.603 6.392 228 2HB LYS 33 2HB LYS 33 -4.982 13.258 5.854 229 1HG LYS 33 1HG LYS 33 -6.993 13.487 7.087 230 2HG LYS 33 2HG LYS 33 -7.065 11.752 7.410 231 1HD LYS 33 1HD LYS 33 -5.064 11.882 8.764 232 2HD LYS 33 2HD LYS 33 -4.879 13.590 8.377 233 1HE LYS 33 1HE LYS 33 -7.225 12.411 9.855 234 2HE LYS 33 2HE LYS 33 -5.836 13.172 10.628 235 1HZ LYS 33 1HZ LYS 33 -7.399 14.858 10.514 236 2HZ LYS 33 2HZ LYS 33 -7.940 14.412 8.975 237 3HZ LYS 33 3HZ LYS 33 -6.430 15.165 9.155 238 H ARG 34 H ARG 34 -5.765 13.266 2.754 239 HA ARG 34 HA ARG 34 -8.152 14.916 3.120 240 1HB ARG 34 1HB ARG 34 -5.763 15.245 1.311 241 2HB ARG 34 2HB ARG 34 -7.183 16.275 1.219 242 1HG ARG 34 1HG ARG 34 -6.707 16.642 3.766 243 2HG ARG 34 2HG ARG 34 -5.081 16.123 3.318 244 1HD ARG 34 1HD ARG 34 -6.633 18.422 2.124 245 2HD ARG 34 2HD ARG 34 -5.248 18.542 3.207 246 HE ARG 34 HE ARG 34 -4.094 17.243 1.240 247 1HH1 ARG 34 1HH1 ARG 34 -6.467 19.832 0.979 248 2HH1 ARG 34 2HH1 ARG 34 -5.826 20.427 -0.526 249 1HH2 ARG 34 1HH2 ARG 34 -3.275 18.015 -0.739 250 2HH2 ARG 34 2HH2 ARG 34 -3.990 19.430 -1.476 251 H HIS 35 H HIS 35 -6.871 12.472 0.961 252 HA HIS 35 HA HIS 35 -9.116 13.003 -0.884 253 1HB HIS 35 1HB HIS 35 -6.434 11.748 -1.487 254 2HB HIS 35 2HB HIS 35 -7.741 11.945 -2.648 255 HD1 HIS 35 HD1 HIS 35 -4.884 13.701 -1.144 256 HD2 HIS 35 HD2 HIS 35 -8.265 14.691 -3.346 257 HE1 HIS 35 HE1 HIS 35 -4.457 16.018 -2.029 258 HE2 HIS 35 HE2 HIS 35 -6.575 16.650 -3.251 259 H ASN 36 H ASN 36 -7.187 10.413 0.569 260 HA ASN 36 HA ASN 36 -8.877 8.360 -0.582 261 1HB ASN 36 1HB ASN 36 -6.526 8.145 1.316 262 2HB ASN 36 2HB ASN 36 -7.340 6.786 0.552 263 1HD2 ASN 36 1HD2 ASN 36 -5.518 6.088 -0.477 264 2HD2 ASN 36 2HD2 ASN 36 -4.810 6.926 -1.805 265 H VAL 37 H VAL 37 -10.450 9.888 0.927 266 HA VAL 37 HA VAL 37 -10.542 9.498 3.679 267 HB VAL 37 HB VAL 37 -12.943 9.975 1.914 268 1HG1 VAL 37 1HG1 VAL 37 -13.495 9.506 4.235 269 2HG1 VAL 37 2HG1 VAL 37 -13.806 11.200 3.854 270 3HG1 VAL 37 3HG1 VAL 37 -12.367 10.753 4.770 271 1HG2 VAL 37 1HG2 VAL 37 -10.957 11.971 2.995 272 2HG2 VAL 37 2HG2 VAL 37 -12.469 12.370 2.180 273 3HG2 VAL 37 3HG2 VAL 37 -11.188 11.537 1.299 274 H SER 38 H SER 38 -11.595 7.384 1.130 275 HA SER 38 HA SER 38 -13.033 5.721 3.051 276 1HB SER 38 1HB SER 38 -14.068 6.239 0.822 277 2HB SER 38 2HB SER 38 -12.788 5.289 0.069 278 HG SER 38 HG SER 38 -15.065 4.429 1.097 279 H HIS 39 H HIS 39 -11.098 4.612 0.277 280 HA HIS 39 HA HIS 39 -8.985 3.521 1.807 281 1HB HIS 39 1HB HIS 39 -9.619 1.091 1.524 282 2HB HIS 39 2HB HIS 39 -10.544 1.969 2.732 283 HD1 HIS 39 HD1 HIS 39 -13.031 1.822 2.539 284 HD2 HIS 39 HD2 HIS 39 -11.113 0.695 -0.974 285 HE1 HIS 39 HE1 HIS 39 -14.837 0.942 1.036 286 HE2 HIS 39 HE2 HIS 39 -13.632 0.088 -1.001 287 H TYR 40 H TYR 40 -7.413 2.458 0.508 288 HA TYR 40 HA TYR 40 -8.102 2.332 -2.350 289 1HB TYR 40 1HB TYR 40 -5.947 3.129 -2.996 290 2HB TYR 40 2HB TYR 40 -6.600 4.266 -1.831 291 HD1 TYR 40 HD1 TYR 40 -4.033 1.734 -2.458 292 HD2 TYR 40 HD2 TYR 40 -5.548 4.557 0.340 293 HE1 TYR 40 HE1 TYR 40 -1.937 1.585 -1.186 294 HE2 TYR 40 HE2 TYR 40 -3.457 4.410 1.627 295 HH TYR 40 HH TYR 40 -0.649 2.986 0.404 296 H ILE 41 H ILE 41 -7.471 0.592 -3.472 297 HA ILE 41 HA ILE 41 -6.289 -1.603 -1.906 298 HB ILE 41 HB ILE 41 -8.033 -1.725 -4.377 299 1HG1 ILE 41 1HG1 ILE 41 -9.495 -3.064 -2.697 300 2HG1 ILE 41 2HG1 ILE 41 -8.544 -2.249 -1.460 301 1HG2 ILE 41 1HG2 ILE 41 -6.817 -3.955 -2.763 302 2HG2 ILE 41 2HG2 ILE 41 -6.393 -3.500 -4.414 303 3HG2 ILE 41 3HG2 ILE 41 -7.993 -4.155 -4.061 304 1HD1 ILE 41 1HD1 ILE 41 -10.232 -0.915 -3.565 305 2HD1 ILE 41 2HD1 ILE 41 -9.272 -0.089 -2.338 306 3HD1 ILE 41 3HD1 ILE 41 -10.635 -1.098 -1.858 307 H TYR 42 H TYR 42 -4.260 -2.028 -2.334 308 HA TYR 42 HA TYR 42 -3.100 -1.217 -4.909 309 1HB TYR 42 1HB TYR 42 -2.229 -0.491 -2.556 310 2HB TYR 42 2HB TYR 42 -1.551 -2.109 -2.488 311 HD1 TYR 42 HD1 TYR 42 -0.391 -2.616 -5.051 312 HD2 TYR 42 HD2 TYR 42 -0.613 1.064 -2.927 313 HE1 TYR 42 HE1 TYR 42 1.599 -1.808 -6.250 314 HE2 TYR 42 HE2 TYR 42 1.369 1.884 -4.126 315 HH TYR 42 HH TYR 42 2.640 0.350 -6.862 316 H TYR 43 H TYR 43 -2.986 -2.850 -6.374 317 HA TYR 43 HA TYR 43 -2.582 -5.591 -5.411 318 1HB TYR 43 1HB TYR 43 -3.253 -4.498 -8.150 319 2HB TYR 43 2HB TYR 43 -2.918 -6.198 -7.842 320 HD1 TYR 43 HD1 TYR 43 -4.418 -7.429 -6.193 321 HD2 TYR 43 HD2 TYR 43 -5.411 -3.626 -7.826 322 HE1 TYR 43 HE1 TYR 43 -6.772 -7.794 -5.593 323 HE2 TYR 43 HE2 TYR 43 -7.772 -3.984 -7.232 324 HH TYR 43 HH TYR 43 -9.295 -5.853 -6.784 325 H LEU 44 H LEU 44 -0.531 -6.103 -5.034 326 HA LEU 44 HA LEU 44 1.603 -4.485 -5.930 327 1HB LEU 44 1HB LEU 44 1.548 -7.124 -4.494 328 2HB LEU 44 2HB LEU 44 3.046 -6.316 -4.904 329 HG LEU 44 HG LEU 44 2.115 -4.315 -3.584 330 1HD1 LEU 44 1HD1 LEU 44 0.326 -6.492 -2.516 331 2HD1 LEU 44 2HD1 LEU 44 -0.193 -5.071 -3.425 332 3HD1 LEU 44 3HD1 LEU 44 0.520 -4.881 -1.824 333 1HD2 LEU 44 1HD2 LEU 44 2.924 -5.249 -1.474 334 2HD2 LEU 44 2HD2 LEU 44 3.966 -5.710 -2.821 335 3HD2 LEU 44 3HD2 LEU 44 2.823 -6.874 -2.152 336 H ALA 45 H ALA 45 0.217 -7.364 -7.283 337 HA ALA 45 HA ALA 45 2.583 -8.131 -8.740 338 1HB ALA 45 1HB ALA 45 0.945 -9.793 -7.949 339 2HB ALA 45 2HB ALA 45 1.213 -9.883 -9.691 340 3HB ALA 45 3HB ALA 45 -0.247 -9.122 -9.061 341 H THR 46 H THR 46 0.121 -5.870 -9.233 342 HA THR 46 HA THR 46 0.800 -5.702 -12.094 343 HB THR 46 HB THR 46 -1.837 -4.939 -10.833 344 HG1 THR 46 HG1 THR 46 -0.886 -7.325 -11.946 345 1HG2 THR 46 1HG2 THR 46 -1.035 -5.229 -13.730 346 2HG2 THR 46 2HG2 THR 46 -1.325 -3.706 -12.890 347 3HG2 THR 46 3HG2 THR 46 -2.649 -4.843 -13.144 348 H GLU 47 H GLU 47 0.623 -4.179 -9.074 349 HA GLU 47 HA GLU 47 1.091 -2.150 -8.250 350 1HB GLU 47 1HB GLU 47 3.101 -2.437 -9.784 351 2HB GLU 47 2HB GLU 47 2.256 -1.397 -10.923 352 1HG GLU 47 1HG GLU 47 2.256 0.419 -9.382 353 2HG GLU 47 2HG GLU 47 2.883 -0.603 -8.093 354 H ASN 48 H ASN 48 -1.441 -2.670 -9.703 355 HA ASN 48 HA ASN 48 -2.122 0.079 -10.395 356 1HB ASN 48 1HB ASN 48 -4.222 -0.673 -11.215 357 2HB ASN 48 2HB ASN 48 -3.039 -1.833 -11.794 358 1HD2 ASN 48 1HD2 ASN 48 -3.206 -3.927 -11.194 359 2HD2 ASN 48 2HD2 ASN 48 -4.486 -4.562 -10.224 360 H VAL 49 H VAL 49 -3.156 1.405 -9.069 361 HA VAL 49 HA VAL 49 -3.851 0.343 -6.410 362 HB VAL 49 HB VAL 49 -3.212 3.225 -6.999 363 1HG1 VAL 49 1HG1 VAL 49 -3.097 1.583 -4.475 364 2HG1 VAL 49 2HG1 VAL 49 -4.346 2.753 -4.904 365 3HG1 VAL 49 3HG1 VAL 49 -2.694 3.296 -4.613 366 1HG2 VAL 49 1HG2 VAL 49 -0.915 2.829 -6.272 367 2HG2 VAL 49 2HG2 VAL 49 -1.284 1.914 -7.733 368 3HG2 VAL 49 3HG2 VAL 49 -1.239 1.096 -6.171 369 H HIS 50 H HIS 50 -5.969 0.207 -6.118 370 HA HIS 50 HA HIS 50 -7.764 1.939 -7.642 371 1HB HIS 50 1HB HIS 50 -8.199 -0.529 -5.968 372 2HB HIS 50 2HB HIS 50 -9.542 0.461 -6.527 373 HD1 HIS 50 HD1 HIS 50 -9.901 -2.141 -7.589 374 HD2 HIS 50 HD2 HIS 50 -7.184 0.450 -9.391 375 HE1 HIS 50 HE1 HIS 50 -9.637 -2.962 -9.955 376 HE2 HIS 50 HE2 HIS 50 -8.100 -1.305 -11.066 377 H ILE 51 H ILE 51 -7.682 3.942 -6.635 378 HA ILE 51 HA ILE 51 -8.099 4.082 -3.762 379 HB ILE 51 HB ILE 51 -7.813 6.299 -5.800 380 1HG1 ILE 51 1HG1 ILE 51 -5.713 6.738 -4.393 381 2HG1 ILE 51 2HG1 ILE 51 -5.946 5.118 -3.753 382 1HG2 ILE 51 1HG2 ILE 51 -8.070 6.493 -2.802 383 2HG2 ILE 51 2HG2 ILE 51 -9.264 7.019 -3.989 384 3HG2 ILE 51 3HG2 ILE 51 -7.702 7.831 -3.889 385 1HD1 ILE 51 1HD1 ILE 51 -5.531 5.832 -6.642 386 2HD1 ILE 51 2HD1 ILE 51 -5.758 4.204 -6.000 387 3HD1 ILE 51 3HD1 ILE 51 -4.331 5.139 -5.553 388 H VAL 52 H VAL 52 -10.111 3.558 -3.182 389 HA VAL 52 HA VAL 52 -12.395 4.557 -4.652 390 HB VAL 52 HB VAL 52 -12.312 3.129 -1.982 391 1HG1 VAL 52 1HG1 VAL 52 -14.678 2.710 -2.338 392 2HG1 VAL 52 2HG1 VAL 52 -14.626 3.588 -3.866 393 3HG1 VAL 52 3HG1 VAL 52 -14.358 4.445 -2.348 394 1HG2 VAL 52 1HG2 VAL 52 -12.829 2.034 -4.746 395 2HG2 VAL 52 2HG2 VAL 52 -12.960 1.130 -3.237 396 3HG2 VAL 52 3HG2 VAL 52 -11.394 1.744 -3.765 397 H LEU 53 H LEU 53 -13.077 6.554 -4.405 398 HA LEU 53 HA LEU 53 -12.008 8.267 -2.399 399 1HB LEU 53 1HB LEU 53 -14.274 8.726 -4.342 400 2HB LEU 53 2HB LEU 53 -13.529 9.969 -3.357 401 HG LEU 53 HG LEU 53 -12.182 8.396 -5.556 402 1HD1 LEU 53 1HD1 LEU 53 -12.050 10.572 -6.676 403 2HD1 LEU 53 2HD1 LEU 53 -12.981 11.297 -5.364 404 3HD1 LEU 53 3HD1 LEU 53 -13.719 10.074 -6.399 405 1HD2 LEU 53 1HD2 LEU 53 -10.264 9.873 -5.166 406 2HD2 LEU 53 2HD2 LEU 53 -10.615 8.873 -3.756 407 3HD2 LEU 53 3HD2 LEU 53 -11.090 10.571 -3.773 408 H LYS 54 H LYS 54 -13.792 9.842 -1.377 409 HA LYS 54 HA LYS 54 -14.576 8.707 0.946 410 1HB LYS 54 1HB LYS 54 -14.560 11.135 0.430 411 2HB LYS 54 2HB LYS 54 -16.063 10.929 -0.456 412 1HG LYS 54 1HG LYS 54 -17.151 10.175 1.622 413 2HG LYS 54 2HG LYS 54 -15.645 10.485 2.491 414 1HD LYS 54 1HD LYS 54 -15.760 12.844 1.785 415 2HD LYS 54 2HD LYS 54 -17.298 12.514 0.989 416 1HE LYS 54 1HE LYS 54 -17.713 13.510 3.144 417 2HE LYS 54 2HE LYS 54 -18.236 11.826 3.165 418 1HZ LYS 54 1HZ LYS 54 -16.266 11.211 4.347 419 2HZ LYS 54 2HZ LYS 54 -16.997 12.505 5.169 420 3HZ LYS 54 3HZ LYS 54 -15.625 12.777 4.209 421 H ASN 55 H ASN 55 -16.843 9.329 -1.730 422 HA ASN 55 HA ASN 55 -18.134 6.778 -1.302 423 1HB ASN 55 1HB ASN 55 -19.228 8.330 0.360 424 2HB ASN 55 2HB ASN 55 -19.754 9.325 -0.990 425 1HD2 ASN 55 1HD2 ASN 55 -21.533 8.751 -2.119 426 2HD2 ASN 55 2HD2 ASN 55 -22.504 7.362 -1.770 427 H ASP 56 H ASP 56 -16.626 8.318 -3.294 428 HA ASP 56 HA ASP 56 -18.604 9.110 -5.275 429 1HB ASP 56 1HB ASP 56 -15.595 9.404 -5.303 430 2HB ASP 56 2HB ASP 56 -16.706 10.092 -6.485 431 H ASN 57 H ASN 57 -15.442 7.763 -5.987 432 HA ASN 57 HA ASN 57 -16.540 5.371 -7.164 433 1HB ASN 57 1HB ASN 57 -15.855 5.860 -9.452 434 2HB ASN 57 2HB ASN 57 -16.995 7.084 -8.908 435 1HD2 ASN 57 1HD2 ASN 57 -16.246 9.175 -8.482 436 2HD2 ASN 57 2HD2 ASN 57 -14.728 9.740 -9.096 437 H THR 58 H THR 58 -14.429 4.702 -8.819 438 HA THR 58 HA THR 58 -12.265 4.511 -6.834 439 HB THR 58 HB THR 58 -12.872 2.551 -9.054 440 HG1 THR 58 HG1 THR 58 -14.565 2.556 -7.529 441 1HG2 THR 58 1HG2 THR 58 -11.130 2.315 -6.596 442 2HG2 THR 58 2HG2 THR 58 -10.548 2.541 -8.245 443 3HG2 THR 58 3HG2 THR 58 -11.399 1.060 -7.804 444 H VAL 59 H VAL 59 -10.591 5.736 -7.329 445 HA VAL 59 HA VAL 59 -9.917 6.302 -10.118 446 HB VAL 59 HB VAL 59 -8.608 7.326 -7.584 447 1HG1 VAL 59 1HG1 VAL 59 -8.360 8.233 -10.450 448 2HG1 VAL 59 2HG1 VAL 59 -7.116 7.430 -9.492 449 3HG1 VAL 59 3HG1 VAL 59 -7.654 9.055 -9.057 450 1HG2 VAL 59 1HG2 VAL 59 -9.845 9.400 -7.987 451 2HG2 VAL 59 2HG2 VAL 59 -10.937 8.040 -7.722 452 3HG2 VAL 59 3HG2 VAL 59 -10.662 8.646 -9.355 453 H LEU 60 H LEU 60 -8.781 4.731 -11.082 454 HA LEU 60 HA LEU 60 -6.990 3.083 -9.494 455 1HB LEU 60 1HB LEU 60 -6.763 1.772 -11.649 456 2HB LEU 60 2HB LEU 60 -8.336 1.764 -10.877 457 HG LEU 60 HG LEU 60 -7.950 3.830 -12.964 458 1HD1 LEU 60 1HD1 LEU 60 -6.788 1.938 -13.981 459 2HD1 LEU 60 2HD1 LEU 60 -8.333 2.235 -14.780 460 3HD1 LEU 60 3HD1 LEU 60 -8.171 0.897 -13.640 461 1HD2 LEU 60 1HD2 LEU 60 -10.131 1.839 -12.334 462 2HD2 LEU 60 2HD2 LEU 60 -10.234 3.140 -13.522 463 3HD2 LEU 60 3HD2 LEU 60 -10.078 3.522 -11.806 464 H LEU 61 H LEU 61 -4.990 3.721 -9.226 465 HA LEU 61 HA LEU 61 -3.599 5.274 -11.256 466 1HB LEU 61 1HB LEU 61 -2.464 4.119 -8.711 467 2HB LEU 61 2HB LEU 61 -1.777 5.396 -9.692 468 HG LEU 61 HG LEU 61 -4.259 5.588 -7.994 469 1HD1 LEU 61 1HD1 LEU 61 -1.559 6.897 -7.732 470 2HD1 LEU 61 2HD1 LEU 61 -2.142 5.551 -6.756 471 3HD1 LEU 61 3HD1 LEU 61 -2.940 7.121 -6.658 472 1HD2 LEU 61 1HD2 LEU 61 -2.933 7.653 -9.739 473 2HD2 LEU 61 2HD2 LEU 61 -4.245 7.964 -8.602 474 3HD2 LEU 61 3HD2 LEU 61 -4.516 6.924 -10.001 475 H LYS 62 H LYS 62 -2.694 4.209 -12.932 476 HA LYS 62 HA LYS 62 -1.857 1.449 -12.574 477 1HB LYS 62 1HB LYS 62 -1.248 1.569 -15.001 478 2HB LYS 62 2HB LYS 62 -2.938 1.911 -14.674 479 1HG LYS 62 1HG LYS 62 -2.800 3.990 -15.486 480 2HG LYS 62 2HG LYS 62 -1.235 4.285 -14.725 481 1HD LYS 62 1HD LYS 62 -1.670 2.665 -17.235 482 2HD LYS 62 2HD LYS 62 -1.118 4.341 -17.192 483 1HE LYS 62 1HE LYS 62 0.828 3.604 -15.831 484 2HE LYS 62 2HE LYS 62 0.295 1.939 -16.044 485 1HZ LYS 62 1HZ LYS 62 0.572 2.174 -18.425 486 2HZ LYS 62 2HZ LYS 62 2.024 2.546 -17.626 487 3HZ LYS 62 3HZ LYS 62 1.049 3.792 -18.239 488 H GLY 63 H GLY 63 0.024 1.111 -11.608 489 1HA GLY 63 1HA GLY 63 2.176 2.992 -11.662 490 2HA GLY 63 2HA GLY 63 2.242 1.349 -11.036 491 H LEU 64 H LEU 64 3.032 -0.275 -12.297 492 HA LEU 64 HA LEU 64 4.110 0.548 -14.887 493 1HB LEU 64 1HB LEU 64 4.749 -1.869 -13.191 494 2HB LEU 64 2HB LEU 64 5.494 -1.496 -14.735 495 HG LEU 64 HG LEU 64 5.703 0.182 -12.231 496 1HD1 LEU 64 1HD1 LEU 64 8.037 -0.501 -12.209 497 2HD1 LEU 64 2HD1 LEU 64 7.763 -1.520 -13.624 498 3HD1 LEU 64 3HD1 LEU 64 6.972 -1.903 -12.094 499 1HD2 LEU 64 1HD2 LEU 64 7.004 0.526 -14.931 500 2HD2 LEU 64 2HD2 LEU 64 7.335 1.493 -13.496 501 3HD2 LEU 64 3HD2 LEU 64 5.741 1.551 -14.251 502 H LYS 65 H LYS 65 3.374 -2.793 -14.040 503 HA LYS 65 HA LYS 65 0.806 -3.062 -14.991 504 1HB LYS 65 1HB LYS 65 1.732 -2.226 -17.157 505 2HB LYS 65 2HB LYS 65 2.764 -3.646 -17.219 506 1HG LYS 65 1HG LYS 65 0.880 -5.103 -17.419 507 2HG LYS 65 2HG LYS 65 -0.241 -3.777 -17.100 508 1HD LYS 65 1HD LYS 65 0.445 -2.684 -19.169 509 2HD LYS 65 2HD LYS 65 1.603 -3.978 -19.481 510 1HE LYS 65 1HE LYS 65 -0.213 -5.588 -19.646 511 2HE LYS 65 2HE LYS 65 -1.387 -4.327 -19.270 512 1HZ LYS 65 1HZ LYS 65 -0.772 -3.187 -21.306 513 2HZ LYS 65 2HZ LYS 65 -1.272 -4.770 -21.649 514 3HZ LYS 65 3HZ LYS 65 0.377 -4.380 -21.664 515 H ASN 66 H ASN 66 3.858 -4.796 -15.723 516 HA ASN 66 HA ASN 66 2.575 -7.201 -14.596 517 1HB ASN 66 1HB ASN 66 2.664 -7.334 -17.028 518 2HB ASN 66 2HB ASN 66 4.389 -6.991 -17.007 519 1HD2 ASN 66 1HD2 ASN 66 2.673 -9.149 -14.799 520 2HD2 ASN 66 2HD2 ASN 66 3.452 -10.596 -15.337 521 H ILE 67 H ILE 67 3.595 -6.931 -12.575 522 HA ILE 67 HA ILE 67 6.390 -7.837 -12.607 523 HB ILE 67 HB ILE 67 5.302 -5.713 -10.741 524 1HG1 ILE 67 1HG1 ILE 67 7.412 -4.505 -11.667 525 2HG1 ILE 67 2HG1 ILE 67 7.303 -5.665 -12.985 526 1HG2 ILE 67 1HG2 ILE 67 7.536 -5.710 -9.720 527 2HG2 ILE 67 2HG2 ILE 67 7.984 -7.089 -10.725 528 3HG2 ILE 67 3HG2 ILE 67 6.715 -7.255 -9.513 529 1HD1 ILE 67 1HD1 ILE 67 6.245 -3.561 -13.561 530 2HD1 ILE 67 2HD1 ILE 67 5.168 -3.710 -12.172 531 3HD1 ILE 67 3HD1 ILE 67 5.058 -4.865 -13.500 532 H VAL 68 H VAL 68 5.784 -9.934 -12.180 533 HA VAL 68 HA VAL 68 4.085 -10.410 -9.855 534 HB VAL 68 HB VAL 68 5.129 -12.454 -11.822 535 1HG1 VAL 68 1HG1 VAL 68 2.910 -12.618 -9.784 536 2HG1 VAL 68 2HG1 VAL 68 4.499 -13.369 -9.646 537 3HG1 VAL 68 3HG1 VAL 68 3.385 -13.893 -10.907 538 1HG2 VAL 68 1HG2 VAL 68 3.721 -10.849 -12.981 539 2HG2 VAL 68 2HG2 VAL 68 2.462 -11.039 -11.762 540 3HG2 VAL 68 3HG2 VAL 68 2.880 -12.390 -12.815 541 H SER 69 H SER 69 5.702 -9.714 -8.365 542 HA SER 69 HA SER 69 7.731 -11.781 -7.837 543 1HB SER 69 1HB SER 69 7.510 -8.996 -6.655 544 2HB SER 69 2HB SER 69 8.832 -10.136 -6.402 545 HG SER 69 HG SER 69 8.369 -9.735 -9.039 546 H VAL 70 H VAL 70 4.676 -11.238 -7.250 547 HA VAL 70 HA VAL 70 4.642 -11.590 -4.364 548 HB VAL 70 HB VAL 70 2.304 -11.422 -6.276 549 1HG1 VAL 70 1HG1 VAL 70 2.458 -11.105 -3.284 550 2HG1 VAL 70 2HG1 VAL 70 1.758 -12.470 -4.154 551 3HG1 VAL 70 3HG1 VAL 70 1.013 -10.875 -4.270 552 1HG2 VAL 70 1HG2 VAL 70 2.092 -9.083 -5.534 553 2HG2 VAL 70 2HG2 VAL 70 3.591 -9.375 -6.414 554 3HG2 VAL 70 3HG2 VAL 70 3.613 -9.240 -4.655 555 H LYS 71 H LYS 71 4.681 -13.554 -3.518 556 HA LYS 71 HA LYS 71 4.229 -15.902 -5.117 557 1HB LYS 71 1HB LYS 71 4.802 -15.490 -2.184 558 2HB LYS 71 2HB LYS 71 4.515 -17.080 -2.881 559 1HG LYS 71 1HG LYS 71 6.434 -16.759 -4.376 560 2HG LYS 71 2HG LYS 71 6.725 -15.180 -3.644 561 1HD LYS 71 1HD LYS 71 8.197 -16.923 -2.714 562 2HD LYS 71 2HD LYS 71 7.138 -16.225 -1.490 563 1HE LYS 71 1HE LYS 71 7.304 -18.661 -1.274 564 2HE LYS 71 2HE LYS 71 5.659 -18.145 -1.640 565 1HZ LYS 71 1HZ LYS 71 5.968 -18.797 -3.924 566 2HZ LYS 71 2HZ LYS 71 6.360 -20.104 -2.917 567 3HZ LYS 71 3HZ LYS 71 7.593 -19.193 -3.640 568 H PHE 72 H PHE 72 2.623 -17.503 -4.712 569 HA PHE 72 HA PHE 72 0.084 -16.385 -3.848 570 1HB PHE 72 1HB PHE 72 -0.796 -18.658 -4.634 571 2HB PHE 72 2HB PHE 72 -0.133 -17.587 -5.859 572 HD1 PHE 72 HD1 PHE 72 0.633 -20.568 -3.791 573 HD2 PHE 72 HD2 PHE 72 1.646 -18.258 -7.221 574 HE1 PHE 72 HE1 PHE 72 2.142 -22.355 -4.546 575 HE2 PHE 72 HE2 PHE 72 3.161 -20.043 -7.979 576 HZ PHE 72 HZ PHE 72 3.411 -22.094 -6.642 577 H SER 73 H SER 73 2.504 -17.415 -2.208 578 HA SER 73 HA SER 73 1.178 -19.259 -0.394 579 1HB SER 73 1HB SER 73 3.926 -18.013 -0.112 580 2HB SER 73 2HB SER 73 3.321 -19.477 0.667 581 HG SER 73 HG SER 73 3.221 -20.446 -1.409 582 H LYS 74 H LYS 74 1.958 -18.518 2.070 583 HA LYS 74 HA LYS 74 1.477 -15.689 2.450 584 1HB LYS 74 1HB LYS 74 -0.391 -16.050 4.011 585 2HB LYS 74 2HB LYS 74 -0.789 -16.566 2.378 586 1HG LYS 74 1HG LYS 74 -0.511 -18.870 2.975 587 2HG LYS 74 2HG LYS 74 0.091 -18.426 4.574 588 1HD LYS 74 1HD LYS 74 -2.094 -17.377 5.062 589 2HD LYS 74 2HD LYS 74 -2.682 -17.932 3.492 590 1HE LYS 74 1HE LYS 74 -1.660 -19.721 5.696 591 2HE LYS 74 2HE LYS 74 -3.362 -19.398 5.364 592 1HZ LYS 74 1HZ LYS 74 -3.079 -20.367 3.166 593 2HZ LYS 74 2HZ LYS 74 -2.657 -21.480 4.374 594 3HZ LYS 74 3HZ LYS 74 -1.444 -20.689 3.490 595 H ASP 75 H ASP 75 2.773 -14.967 3.991 596 HA ASP 75 HA ASP 75 3.217 -16.638 6.353 597 1HB ASP 75 1HB ASP 75 5.256 -16.956 5.133 598 2HB ASP 75 2HB ASP 75 5.384 -15.234 4.786 599 H ARG 76 H ARG 76 3.388 -15.530 8.257 600 HA ARG 76 HA ARG 76 2.516 -12.731 8.113 601 1HB ARG 76 1HB ARG 76 1.181 -14.521 9.344 602 2HB ARG 76 2HB ARG 76 2.482 -14.549 10.523 603 1HG ARG 76 1HG ARG 76 2.072 -12.237 11.089 604 2HG ARG 76 2HG ARG 76 0.846 -12.119 9.823 605 1HD ARG 76 1HD ARG 76 -0.412 -13.938 10.994 606 2HD ARG 76 2HD ARG 76 0.752 -13.816 12.313 607 HE ARG 76 HE ARG 76 -0.026 -11.373 12.381 608 1HH1 ARG 76 1HH1 ARG 76 -2.056 -14.100 11.568 609 2HH1 ARG 76 2HH1 ARG 76 -3.529 -13.315 12.032 610 1HH2 ARG 76 1HH2 ARG 76 -1.941 -10.335 13.025 611 2HH2 ARG 76 2HH2 ARG 76 -3.470 -11.160 12.885 612 H HIS 77 H HIS 77 5.231 -14.634 8.726 613 HA HIS 77 HA HIS 77 6.389 -13.072 10.846 614 1HB HIS 77 1HB HIS 77 7.588 -15.151 9.008 615 2HB HIS 77 2HB HIS 77 8.457 -14.388 10.334 616 HD1 HIS 77 HD1 HIS 77 7.376 -14.832 12.784 617 HD2 HIS 77 HD2 HIS 77 6.176 -17.361 9.705 618 HE1 HIS 77 HE1 HIS 77 6.369 -16.847 13.910 619 HE2 HIS 77 HE2 HIS 77 5.606 -18.346 12.028 620 H LEU 78 H LEU 78 7.046 -13.446 7.365 621 HA LEU 78 HA LEU 78 9.132 -11.579 7.246 622 1HB LEU 78 1HB LEU 78 8.547 -13.248 5.489 623 2HB LEU 78 2HB LEU 78 7.176 -12.251 5.049 624 HG LEU 78 HG LEU 78 8.671 -10.442 4.363 625 1HD1 LEU 78 1HD1 LEU 78 11.094 -10.787 4.301 626 2HD1 LEU 78 2HD1 LEU 78 10.894 -12.326 5.139 627 3HD1 LEU 78 3HD1 LEU 78 10.477 -10.817 5.953 628 1HD2 LEU 78 1HD2 LEU 78 9.456 -13.107 3.190 629 2HD2 LEU 78 2HD2 LEU 78 9.691 -11.533 2.431 630 3HD2 LEU 78 3HD2 LEU 78 8.059 -12.139 2.719 631 H ILE 79 H ILE 79 5.632 -11.144 6.904 632 HA ILE 79 HA ILE 79 5.647 -8.429 6.170 633 HB ILE 79 HB ILE 79 3.575 -9.817 7.881 634 1HG1 ILE 79 1HG1 ILE 79 3.686 -9.518 4.871 635 2HG1 ILE 79 2HG1 ILE 79 4.029 -11.007 5.746 636 1HG2 ILE 79 1HG2 ILE 79 2.052 -8.116 6.954 637 2HG2 ILE 79 2HG2 ILE 79 3.425 -7.350 6.153 638 3HG2 ILE 79 3HG2 ILE 79 3.351 -7.408 7.914 639 1HD1 ILE 79 1HD1 ILE 79 1.743 -11.052 6.578 640 2HD1 ILE 79 2HD1 ILE 79 1.786 -11.010 4.815 641 3HD1 ILE 79 3HD1 ILE 79 1.395 -9.549 5.721 642 H GLU 80 H GLU 80 5.456 -9.950 9.370 643 HA GLU 80 HA GLU 80 5.410 -7.632 10.928 644 1HB GLU 80 1HB GLU 80 4.900 -9.861 11.801 645 2HB GLU 80 2HB GLU 80 6.561 -10.365 11.544 646 1HG GLU 80 1HG GLU 80 5.982 -8.049 13.334 647 2HG GLU 80 2HG GLU 80 5.725 -9.692 13.914 648 H THR 81 H THR 81 8.158 -9.614 9.880 649 HA THR 81 HA THR 81 10.164 -8.132 11.170 650 HB THR 81 HB THR 81 10.469 -9.730 8.618 651 HG1 THR 81 HG1 THR 81 9.434 -10.939 10.322 652 1HG2 THR 81 1HG2 THR 81 12.428 -9.117 10.835 653 2HG2 THR 81 2HG2 THR 81 12.424 -8.369 9.240 654 3HG2 THR 81 3HG2 THR 81 12.750 -10.093 9.401 655 H THR 82 H THR 82 8.903 -7.932 7.848 656 HA THR 82 HA THR 82 10.726 -5.999 6.931 657 HB THR 82 HB THR 82 7.911 -6.482 5.923 658 HG1 THR 82 HG1 THR 82 8.964 -8.407 5.739 659 1HG2 THR 82 1HG2 THR 82 9.097 -4.399 5.134 660 2HG2 THR 82 2HG2 THR 82 8.636 -5.521 3.857 661 3HG2 THR 82 3HG2 THR 82 10.310 -5.449 4.414 662 H SER 83 H SER 83 7.557 -5.673 8.481 663 HA SER 83 HA SER 83 7.333 -2.875 8.090 664 1HB SER 83 1HB SER 83 6.052 -4.624 10.203 665 2HB SER 83 2HB SER 83 5.539 -2.993 9.762 666 HG SER 83 HG SER 83 5.280 -5.400 8.345 667 H ASN 84 H ASN 84 8.549 -4.834 10.789 668 HA ASN 84 HA ASN 84 9.099 -2.670 12.518 669 1HB ASN 84 1HB ASN 84 8.985 -4.980 13.325 670 2HB ASN 84 2HB ASN 84 10.407 -5.396 12.374 671 1HD2 ASN 84 1HD2 ASN 84 11.507 -6.064 14.211 672 2HD2 ASN 84 2HD2 ASN 84 12.157 -4.933 15.352 673 H LYS 85 H LYS 85 11.149 -4.453 10.237 674 HA LYS 85 HA LYS 85 13.496 -2.957 10.677 675 1HB LYS 85 1HB LYS 85 13.408 -5.167 9.526 676 2HB LYS 85 2HB LYS 85 12.643 -4.386 8.150 677 1HG LYS 85 1HG LYS 85 14.981 -4.711 7.697 678 2HG LYS 85 2HG LYS 85 14.648 -2.985 7.853 679 1HD LYS 85 1HD LYS 85 16.691 -3.466 9.013 680 2HD LYS 85 2HD LYS 85 15.445 -3.117 10.212 681 1HE LYS 85 1HE LYS 85 16.771 -5.027 10.914 682 2HE LYS 85 2HE LYS 85 15.118 -5.526 10.560 683 1HZ LYS 85 1HZ LYS 85 17.413 -5.820 8.694 684 2HZ LYS 85 2HZ LYS 85 15.837 -6.386 8.439 685 3HZ LYS 85 3HZ LYS 85 16.791 -7.062 9.667 686 H LEU 86 H LEU 86 10.692 -2.457 8.648 687 HA LEU 86 HA LEU 86 11.629 -0.492 6.927 688 1HB LEU 86 1HB LEU 86 9.449 -1.486 6.622 689 2HB LEU 86 2HB LEU 86 8.888 -0.815 8.143 690 HG LEU 86 HG LEU 86 9.241 1.478 7.149 691 1HD1 LEU 86 1HD1 LEU 86 9.543 -0.120 4.613 692 2HD1 LEU 86 2HD1 LEU 86 10.775 0.886 5.374 693 3HD1 LEU 86 3HD1 LEU 86 9.323 1.628 4.701 694 1HD2 LEU 86 1HD2 LEU 86 7.253 -0.326 5.774 695 2HD2 LEU 86 2HD2 LEU 86 7.163 1.432 5.879 696 3HD2 LEU 86 3HD2 LEU 86 7.030 0.454 7.340 697 H LYS 87 H LYS 87 10.103 -0.056 10.145 698 HA LYS 87 HA LYS 87 10.572 2.793 9.948 699 1HB LYS 87 1HB LYS 87 8.570 1.765 11.106 700 2HB LYS 87 2HB LYS 87 9.660 1.319 12.413 701 1HG LYS 87 1HG LYS 87 8.514 3.383 12.954 702 2HG LYS 87 2HG LYS 87 10.239 3.689 12.729 703 1HD LYS 87 1HD LYS 87 9.761 4.425 10.408 704 2HD LYS 87 2HD LYS 87 8.040 4.218 10.728 705 1HE LYS 87 1HE LYS 87 8.463 6.515 11.020 706 2HE LYS 87 2HE LYS 87 8.350 5.850 12.648 707 1HZ LYS 87 1HZ LYS 87 10.783 5.789 12.732 708 2HZ LYS 87 2HZ LYS 87 10.204 7.359 12.477 709 3HZ LYS 87 3HZ LYS 87 10.862 6.483 11.182 710 H SER 88 H SER 88 12.289 0.083 11.129 711 HA SER 88 HA SER 88 13.844 1.450 13.089 712 1HB SER 88 1HB SER 88 14.387 -1.143 11.625 713 2HB SER 88 2HB SER 88 15.292 -0.558 13.023 714 HG SER 88 HG SER 88 12.541 -1.286 12.909 715 H ARG 89 H ARG 89 14.679 0.271 9.812 716 HA ARG 89 HA ARG 89 17.058 1.967 9.857 717 1HB ARG 89 1HB ARG 89 17.148 -0.408 9.044 718 2HB ARG 89 2HB ARG 89 16.136 0.070 7.691 719 1HG ARG 89 1HG ARG 89 17.850 1.607 6.922 720 2HG ARG 89 2HG ARG 89 18.861 1.193 8.310 721 1HD ARG 89 1HD ARG 89 19.021 -1.103 7.534 722 2HD ARG 89 2HD ARG 89 17.952 -0.740 6.179 723 HE ARG 89 HE ARG 89 19.975 1.032 5.855 724 1HH1 ARG 89 1HH1 ARG 89 19.895 -2.442 6.308 725 2HH1 ARG 89 2HH1 ARG 89 21.327 -2.731 5.380 726 1HH2 ARG 89 1HH2 ARG 89 21.842 0.660 4.599 727 2HH2 ARG 89 2HH2 ARG 89 22.446 -0.966 4.414 728 H GLU 90 H GLU 90 13.874 2.000 8.743 729 HA GLU 90 HA GLU 90 12.653 3.216 7.316 730 1HB GLU 90 1HB GLU 90 14.823 5.287 7.687 731 2HB GLU 90 2HB GLU 90 13.202 5.583 7.065 732 1HG GLU 90 1HG GLU 90 12.424 4.552 9.312 733 2HG GLU 90 2HG GLU 90 14.066 4.903 9.844 734 H ILE 91 H ILE 91 13.582 1.414 5.957 735 HA ILE 91 HA ILE 91 15.290 2.178 3.775 736 HB ILE 91 HB ILE 91 14.612 -0.033 2.816 737 1HG1 ILE 91 1HG1 ILE 91 13.047 -0.248 5.397 738 2HG1 ILE 91 2HG1 ILE 91 12.358 -0.154 3.780 739 1HG2 ILE 91 1HG2 ILE 91 15.788 -1.378 4.498 740 2HG2 ILE 91 2HG2 ILE 91 15.596 -0.071 5.665 741 3HG2 ILE 91 3HG2 ILE 91 16.585 0.172 4.225 742 1HD1 ILE 91 1HD1 ILE 91 13.345 -2.301 3.222 743 2HD1 ILE 91 2HD1 ILE 91 12.326 -2.427 4.656 744 3HD1 ILE 91 3HD1 ILE 91 14.082 -2.389 4.821 745 H THR 92 H THR 92 14.433 1.760 1.479 746 HA THR 92 HA THR 92 12.448 3.701 0.994 747 HB THR 92 HB THR 92 12.532 2.768 -1.387 748 HG1 THR 92 HG1 THR 92 14.816 1.387 -0.384 749 1HG2 THR 92 1HG2 THR 92 14.757 3.753 -1.785 750 2HG2 THR 92 2HG2 THR 92 15.051 3.747 -0.045 751 3HG2 THR 92 3HG2 THR 92 13.760 4.744 -0.720 752 H PHE 93 H PHE 93 10.454 3.463 -0.109 753 HA PHE 93 HA PHE 93 8.706 1.607 1.078 754 1HB PHE 93 1HB PHE 93 8.223 3.933 0.076 755 2HB PHE 93 2HB PHE 93 8.148 3.110 -1.476 756 HD1 PHE 93 HD1 PHE 93 6.596 3.341 1.860 757 HD2 PHE 93 HD2 PHE 93 6.226 1.912 -2.132 758 HE1 PHE 93 HE1 PHE 93 4.223 2.829 2.267 759 HE2 PHE 93 HE2 PHE 93 3.858 1.392 -1.731 760 HZ PHE 93 HZ PHE 93 2.850 1.850 0.470 761 H GLN 94 H GLN 94 10.649 1.510 -1.754 762 HA GLN 94 HA GLN 94 9.264 -0.495 -3.196 763 1HB GLN 94 1HB GLN 94 12.137 0.429 -3.271 764 2HB GLN 94 2HB GLN 94 11.461 -0.745 -4.395 765 1HG GLN 94 1HG GLN 94 9.897 0.879 -5.229 766 2HG GLN 94 2HG GLN 94 10.417 2.051 -4.022 767 1HE2 GLN 94 1HE2 GLN 94 10.389 2.136 -6.961 768 2HE2 GLN 94 2HE2 GLN 94 12.019 2.506 -7.436 769 H GLU 95 H GLU 95 11.974 -0.589 -0.908 770 HA GLU 95 HA GLU 95 12.397 -3.372 -0.968 771 1HB GLU 95 1HB GLU 95 12.849 -1.365 1.245 772 2HB GLU 95 2HB GLU 95 13.425 -3.024 1.291 773 1HG GLU 95 1HG GLU 95 14.178 -1.075 -0.865 774 2HG GLU 95 2HG GLU 95 15.106 -1.291 0.615 775 H TYR 96 H TYR 96 10.307 -1.339 1.022 776 HA TYR 96 HA TYR 96 9.283 -3.334 2.703 777 1HB TYR 96 1HB TYR 96 8.980 -0.884 3.056 778 2HB TYR 96 2HB TYR 96 7.848 -0.858 1.709 779 HD1 TYR 96 HD1 TYR 96 8.335 -2.895 4.800 780 HD2 TYR 96 HD2 TYR 96 5.627 -0.748 2.338 781 HE1 TYR 96 HE1 TYR 96 6.514 -3.440 6.359 782 HE2 TYR 96 HE2 TYR 96 3.789 -1.284 3.886 783 HH TYR 96 HH TYR 96 4.371 -2.837 6.971 784 H ARG 97 H ARG 97 8.120 -2.115 -0.422 785 HA ARG 97 HA ARG 97 5.843 -3.743 -0.619 786 1HB ARG 97 1HB ARG 97 7.579 -2.409 -2.681 787 2HB ARG 97 2HB ARG 97 6.232 -3.427 -3.158 788 1HG ARG 97 1HG ARG 97 4.696 -1.960 -1.963 789 2HG ARG 97 2HG ARG 97 6.054 -0.942 -1.471 790 1HD ARG 97 1HD ARG 97 4.815 -0.074 -3.448 791 2HD ARG 97 2HD ARG 97 6.525 -0.367 -3.756 792 HE ARG 97 HE ARG 97 4.862 -2.596 -4.455 793 1HH1 ARG 97 1HH1 ARG 97 6.122 0.465 -5.610 794 2HH1 ARG 97 2HH1 ARG 97 5.962 0.042 -7.285 795 1HH2 ARG 97 1HH2 ARG 97 4.678 -3.143 -6.688 796 2HH2 ARG 97 2HH2 ARG 97 5.142 -1.971 -7.891 797 H ARG 98 H ARG 98 9.146 -4.242 -1.801 798 HA ARG 98 HA ARG 98 8.586 -6.531 -3.320 799 1HB ARG 98 1HB ARG 98 10.589 -5.177 -3.658 800 2HB ARG 98 2HB ARG 98 11.198 -5.656 -2.078 801 1HG ARG 98 1HG ARG 98 11.619 -7.841 -2.772 802 2HG ARG 98 2HG ARG 98 10.580 -7.686 -4.190 803 1HD ARG 98 1HD ARG 98 12.940 -7.657 -4.808 804 2HD ARG 98 2HD ARG 98 12.151 -6.131 -5.195 805 HE ARG 98 HE ARG 98 13.197 -5.459 -2.897 806 1HH1 ARG 98 1HH1 ARG 98 14.626 -7.444 -5.403 807 2HH1 ARG 98 2HH1 ARG 98 16.261 -7.002 -4.998 808 1HH2 ARG 98 1HH2 ARG 98 15.327 -4.842 -2.388 809 2HH2 ARG 98 2HH2 ARG 98 16.655 -5.538 -3.279 810 H ASN 99 H ASN 99 9.644 -6.183 0.037 811 HA ASN 99 HA ASN 99 9.965 -8.979 0.467 812 1HB ASN 99 1HB ASN 99 9.664 -6.654 2.362 813 2HB ASN 99 2HB ASN 99 9.813 -8.314 2.929 814 1HD2 ASN 99 1HD2 ASN 99 11.607 -6.042 3.309 815 2HD2 ASN 99 2HD2 ASN 99 13.138 -6.537 2.683 816 H LEU 100 H LEU 100 7.266 -6.746 0.843 817 HA LEU 100 HA LEU 100 5.484 -8.525 2.117 818 1HB LEU 100 1HB LEU 100 5.032 -6.168 0.299 819 2HB LEU 100 2HB LEU 100 3.708 -7.073 1.005 820 HG LEU 100 HG LEU 100 5.845 -5.730 2.654 821 1HD1 LEU 100 1HD1 LEU 100 4.647 -4.054 1.354 822 2HD1 LEU 100 2HD1 LEU 100 4.198 -3.973 3.057 823 3HD1 LEU 100 3HD1 LEU 100 3.107 -4.724 1.891 824 1HD2 LEU 100 1HD2 LEU 100 3.105 -6.780 3.340 825 2HD2 LEU 100 2HD2 LEU 100 4.224 -5.994 4.455 826 3HD2 LEU 100 3HD2 LEU 100 4.634 -7.558 3.745 827 H ALA 101 H ALA 101 6.182 -7.885 -1.276 828 HA ALA 101 HA ALA 101 4.258 -9.560 -2.427 829 1HB ALA 101 1HB ALA 101 7.011 -8.908 -3.480 830 2HB ALA 101 2HB ALA 101 5.578 -7.896 -3.666 831 3HB ALA 101 3HB ALA 101 5.638 -9.488 -4.422 832 H LYS 102 H LYS 102 7.513 -10.225 -1.248 833 HA LYS 102 HA LYS 102 7.617 -12.918 -2.144 834 1HB LYS 102 1HB LYS 102 9.157 -11.495 0.031 835 2HB LYS 102 2HB LYS 102 9.535 -13.101 -0.574 836 1HG LYS 102 1HG LYS 102 10.017 -12.207 -2.767 837 2HG LYS 102 2HG LYS 102 9.527 -10.595 -2.243 838 1HD LYS 102 1HD LYS 102 11.937 -10.743 -2.219 839 2HD LYS 102 2HD LYS 102 11.341 -10.630 -0.562 840 1HE LYS 102 1HE LYS 102 13.083 -12.284 -0.658 841 2HE LYS 102 2HE LYS 102 11.542 -13.087 -0.367 842 1HZ LYS 102 1HZ LYS 102 12.919 -14.234 -2.021 843 2HZ LYS 102 2HZ LYS 102 12.859 -12.865 -3.021 844 3HZ LYS 102 3HZ LYS 102 11.438 -13.720 -2.671 845 H ALA 103 H ALA 103 6.243 -11.359 0.634 846 HA ALA 103 HA ALA 103 6.003 -13.780 2.188 847 1HB ALA 103 1HB ALA 103 4.674 -11.103 2.620 848 2HB ALA 103 2HB ALA 103 6.247 -11.573 3.265 849 3HB ALA 103 3HB ALA 103 4.791 -12.421 3.788 850 H GLY 104 H GLY 104 4.231 -12.204 -0.277 851 1HA GLY 104 1HA GLY 104 2.609 -13.541 -1.470 852 2HA GLY 104 2HA GLY 104 2.095 -14.201 0.075 853 H VAL 105 H VAL 105 2.686 -10.832 0.097 854 HA VAL 105 HA VAL 105 -0.106 -10.277 0.497 855 HB VAL 105 HB VAL 105 2.204 -8.341 0.231 856 1HG1 VAL 105 1HG1 VAL 105 0.057 -7.283 -0.243 857 2HG1 VAL 105 2HG1 VAL 105 0.706 -6.726 1.300 858 3HG1 VAL 105 3HG1 VAL 105 -0.598 -7.915 1.268 859 1HG2 VAL 105 1HG2 VAL 105 0.865 -9.478 2.683 860 2HG2 VAL 105 2HG2 VAL 105 2.100 -8.220 2.680 861 3HG2 VAL 105 3HG2 VAL 105 2.496 -9.843 2.123 862 H PHE 106 H PHE 106 -1.330 -10.517 -1.256 863 HA PHE 106 HA PHE 106 -0.405 -9.520 -3.840 864 1HB PHE 106 1HB PHE 106 -1.327 -11.774 -3.793 865 2HB PHE 106 2HB PHE 106 -2.817 -11.182 -3.069 866 HD1 PHE 106 HD1 PHE 106 -0.736 -11.003 -6.131 867 HD2 PHE 106 HD2 PHE 106 -4.589 -10.456 -4.409 868 HE1 PHE 106 HE1 PHE 106 -1.693 -10.707 -8.380 869 HE2 PHE 106 HE2 PHE 106 -5.552 -10.158 -6.654 870 HZ PHE 106 HZ PHE 106 -4.105 -10.283 -8.640 871 H ARG 107 H ARG 107 -2.760 -8.861 -1.347 872 HA ARG 107 HA ARG 107 -3.659 -6.548 -2.917 873 1HB ARG 107 1HB ARG 107 -5.394 -8.322 -2.951 874 2HB ARG 107 2HB ARG 107 -5.461 -8.255 -1.194 875 1HG ARG 107 1HG ARG 107 -6.410 -6.128 -1.187 876 2HG ARG 107 2HG ARG 107 -5.940 -5.811 -2.857 877 1HD ARG 107 1HD ARG 107 -8.300 -6.214 -2.789 878 2HD ARG 107 2HD ARG 107 -7.522 -7.584 -3.575 879 HE ARG 107 HE ARG 107 -8.582 -7.575 -0.821 880 1HH1 ARG 107 1HH1 ARG 107 -7.619 -9.253 -3.737 881 2HH1 ARG 107 2HH1 ARG 107 -8.230 -10.796 -3.225 882 1HH2 ARG 107 1HH2 ARG 107 -9.413 -9.596 -0.127 883 2HH2 ARG 107 2HH2 ARG 107 -9.227 -10.993 -1.151 884 H TRP 108 H TRP 108 -2.854 -4.891 -1.962 885 HA TRP 108 HA TRP 108 -2.657 -4.719 0.954 886 1HB TRP 108 1HB TRP 108 -0.680 -4.234 -0.464 887 2HB TRP 108 2HB TRP 108 -1.575 -2.954 -1.259 888 HD1 TRP 108 HD1 TRP 108 -2.702 -1.897 1.769 889 HE1 TRP 108 HE1 TRP 108 -1.062 -0.393 3.064 890 HE3 TRP 108 HE3 TRP 108 1.630 -3.162 -0.627 891 HZ2 TRP 108 HZ2 TRP 108 1.700 0.183 3.064 892 HZ3 TRP 108 HZ3 TRP 108 3.723 -2.087 0.076 893 HH2 TRP 108 HH2 TRP 108 3.757 -0.450 1.883 894 H VAL 109 H VAL 109 -4.566 -4.035 1.812 895 HA VAL 109 HA VAL 109 -6.008 -1.902 0.376 896 HB VAL 109 HB VAL 109 -7.166 -3.871 2.352 897 1HG1 VAL 109 1HG1 VAL 109 -8.503 -1.881 0.521 898 2HG1 VAL 109 2HG1 VAL 109 -8.356 -1.740 2.272 899 3HG1 VAL 109 3HG1 VAL 109 -9.326 -3.036 1.569 900 1HG2 VAL 109 1HG2 VAL 109 -8.237 -4.913 0.411 901 2HG2 VAL 109 2HG2 VAL 109 -6.478 -5.012 0.321 902 3HG2 VAL 109 3HG2 VAL 109 -7.347 -3.828 -0.656 903 H THR 110 H THR 110 -5.053 -0.120 1.314 904 HA THR 110 HA THR 110 -5.083 0.105 4.215 905 HB THR 110 HB THR 110 -4.253 2.129 2.123 906 HG1 THR 110 HG1 THR 110 -2.940 0.160 2.441 907 1HG2 THR 110 1HG2 THR 110 -3.963 2.180 5.130 908 2HG2 THR 110 2HG2 THR 110 -4.976 3.248 4.157 909 3HG2 THR 110 3HG2 THR 110 -3.219 3.328 4.018 910 H ASN 111 H ASN 111 -6.947 0.487 5.131 911 HA ASN 111 HA ASN 111 -9.000 1.996 3.680 912 1HB ASN 111 1HB ASN 111 -9.460 -0.332 4.598 913 2HB ASN 111 2HB ASN 111 -9.332 0.365 6.208 914 1HD2 ASN 111 1HD2 ASN 111 -11.575 -0.927 4.819 915 2HD2 ASN 111 2HD2 ASN 111 -12.875 0.213 4.858 916 H ILE 112 H ILE 112 -8.414 4.088 4.058 917 HA ILE 112 HA ILE 112 -7.481 5.113 6.521 918 HB ILE 112 HB ILE 112 -8.809 6.589 4.236 919 1HG1 ILE 112 1HG1 ILE 112 -6.822 5.352 3.506 920 2HG1 ILE 112 2HG1 ILE 112 -6.519 7.086 3.484 921 1HG2 ILE 112 1HG2 ILE 112 -8.786 7.898 6.303 922 2HG2 ILE 112 2HG2 ILE 112 -7.697 8.580 5.095 923 3HG2 ILE 112 3HG2 ILE 112 -7.046 7.648 6.442 924 1HD1 ILE 112 1HD1 ILE 112 -5.609 5.165 5.617 925 2HD1 ILE 112 2HD1 ILE 112 -5.297 6.902 5.586 926 3HD1 ILE 112 3HD1 ILE 112 -4.607 5.860 4.342 927 H HIS 113 H HIS 113 -10.660 4.760 5.098 928 HA HIS 113 HA HIS 113 -12.146 6.330 6.891 929 1HB HIS 113 1HB HIS 113 -12.983 5.427 4.726 930 2HB HIS 113 2HB HIS 113 -13.015 3.820 5.440 931 HD1 HIS 113 HD1 HIS 113 -15.085 3.163 6.683 932 HD2 HIS 113 HD2 HIS 113 -14.900 7.252 5.923 933 HE1 HIS 113 HE1 HIS 113 -17.339 4.080 7.329 934 HE2 HIS 113 HE2 HIS 113 -17.241 6.538 6.771 935 H GLU 114 H GLU 114 -10.710 3.204 7.219 936 HA GLU 114 HA GLU 114 -12.243 2.705 9.683 937 1HB GLU 114 1HB GLU 114 -12.135 1.080 7.610 938 2HB GLU 114 2HB GLU 114 -10.605 0.606 8.330 939 1HG GLU 114 1HG GLU 114 -11.651 -0.168 10.288 940 2HG GLU 114 2HG GLU 114 -13.183 0.600 9.863 941 H GLN 115 H GLN 115 -9.338 3.832 8.612 942 HA GLN 115 HA GLN 115 -7.359 4.325 9.593 943 1HB GLN 115 1HB GLN 115 -8.771 3.456 12.123 944 2HB GLN 115 2HB GLN 115 -7.238 4.314 12.061 945 1HG GLN 115 1HG GLN 115 -9.861 5.362 11.019 946 2HG GLN 115 2HG GLN 115 -9.130 5.786 12.565 947 1HE2 GLN 115 1HE2 GLN 115 -9.829 7.431 10.219 948 2HE2 GLN 115 2HE2 GLN 115 -8.361 8.238 9.776 949 H LYS 116 H LYS 116 -7.649 1.753 8.421 950 HA LYS 116 HA LYS 116 -5.603 0.300 9.957 951 1HB LYS 116 1HB LYS 116 -7.976 -1.009 8.626 952 2HB LYS 116 2HB LYS 116 -6.650 -1.844 9.419 953 1HG LYS 116 1HG LYS 116 -7.344 -0.758 11.554 954 2HG LYS 116 2HG LYS 116 -8.763 -0.136 10.701 955 1HD LYS 116 1HD LYS 116 -9.118 -2.589 9.990 956 2HD LYS 116 2HD LYS 116 -8.022 -2.970 11.315 957 1HE LYS 116 1HE LYS 116 -9.503 -1.916 12.900 958 2HE LYS 116 2HE LYS 116 -10.563 -1.377 11.596 959 1HZ LYS 116 1HZ LYS 116 -11.576 -3.292 12.422 960 2HZ LYS 116 2HZ LYS 116 -10.111 -4.130 12.583 961 3HZ LYS 116 3HZ LYS 116 -10.757 -3.842 11.042 962 H ARG 117 H ARG 117 -4.281 -1.102 8.669 963 HA ARG 117 HA ARG 117 -4.570 -0.751 5.751 964 1HB ARG 117 1HB ARG 117 -1.950 -1.190 7.199 965 2HB ARG 117 2HB ARG 117 -2.179 -0.800 5.500 966 1HG ARG 117 1HG ARG 117 -3.157 1.389 6.239 967 2HG ARG 117 2HG ARG 117 -2.627 0.988 7.872 968 1HD ARG 117 1HD ARG 117 -0.891 2.295 7.043 969 2HD ARG 117 2HD ARG 117 -0.309 0.647 6.810 970 HE ARG 117 HE ARG 117 -1.666 1.552 4.489 971 1HH1 ARG 117 1HH1 ARG 117 1.337 1.888 6.241 972 2HH1 ARG 117 2HH1 ARG 117 2.254 2.404 4.864 973 1HH2 ARG 117 1HH2 ARG 117 -0.492 2.259 2.652 974 2HH2 ARG 117 2HH2 ARG 117 1.199 2.616 2.813 975 H TYR 118 H TYR 118 -5.469 -2.600 5.107 976 HA TYR 118 HA TYR 118 -4.956 -5.086 6.509 977 1HB TYR 118 1HB TYR 118 -6.850 -4.294 4.302 978 2HB TYR 118 2HB TYR 118 -6.665 -5.962 4.827 979 HD1 TYR 118 HD1 TYR 118 -7.871 -2.616 5.815 980 HD2 TYR 118 HD2 TYR 118 -7.615 -6.725 6.876 981 HE1 TYR 118 HE1 TYR 118 -9.565 -2.268 7.564 982 HE2 TYR 118 HE2 TYR 118 -9.303 -6.389 8.627 983 HH TYR 118 HH TYR 118 -11.153 -3.487 8.882 984 H TYR 119 H TYR 119 -3.819 -6.785 5.755 985 HA TYR 119 HA TYR 119 -2.754 -6.612 3.014 986 1HB TYR 119 1HB TYR 119 -1.454 -7.784 5.482 987 2HB TYR 119 2HB TYR 119 -0.802 -7.926 3.853 988 HD1 TYR 119 HD1 TYR 119 -0.126 -5.815 2.639 989 HD2 TYR 119 HD2 TYR 119 -1.040 -5.864 6.788 990 HE1 TYR 119 HE1 TYR 119 1.064 -3.685 2.917 991 HE2 TYR 119 HE2 TYR 119 0.143 -3.728 7.081 992 HH TYR 119 HH TYR 119 2.117 -2.515 5.739 993 H TYR 120 H TYR 120 -3.814 -7.973 1.783 994 HA TYR 120 HA TYR 120 -4.609 -10.641 2.817 995 1HB TYR 120 1HB TYR 120 -5.753 -8.949 0.581 996 2HB TYR 120 2HB TYR 120 -6.236 -10.608 0.915 997 HD1 TYR 120 HD1 TYR 120 -6.563 -7.129 1.910 998 HD2 TYR 120 HD2 TYR 120 -7.463 -11.140 2.994 999 HE1 TYR 120 HE1 TYR 120 -8.256 -6.315 3.498 1000 HE2 TYR 120 HE2 TYR 120 -9.156 -10.339 4.584 1001 HH TYR 120 HH TYR 120 -9.706 -8.344 5.838 1002 H THR 121 H THR 121 -4.027 -12.428 1.694 1003 HA THR 121 HA THR 121 -2.109 -12.151 -0.478 1004 HB THR 121 HB THR 121 -1.640 -13.813 1.289 1005 HG1 THR 121 HG1 THR 121 -0.664 -14.668 -0.388 1006 1HG2 THR 121 1HG2 THR 121 -2.990 -15.886 1.394 1007 2HG2 THR 121 2HG2 THR 121 -4.169 -15.140 0.315 1008 3HG2 THR 121 3HG2 THR 121 -3.881 -14.458 1.912 1009 H PHE 122 H PHE 122 -2.608 -14.149 -2.182 1010 HA PHE 122 HA PHE 122 -4.677 -13.200 -3.800 1011 1HB PHE 122 1HB PHE 122 -2.724 -14.585 -4.544 1012 2HB PHE 122 2HB PHE 122 -3.516 -15.993 -3.846 1013 HD1 PHE 122 HD1 PHE 122 -5.108 -17.196 -5.065 1014 HD2 PHE 122 HD2 PHE 122 -3.908 -13.340 -6.403 1015 HE1 PHE 122 HE1 PHE 122 -6.326 -17.552 -7.172 1016 HE2 PHE 122 HE2 PHE 122 -5.126 -13.689 -8.512 1017 HZ PHE 122 HZ PHE 122 -6.335 -15.798 -8.898 1018 H ASP 123 H ASP 123 -4.682 -15.670 -1.310 1019 HA ASP 123 HA ASP 123 -7.483 -16.331 -1.868 1020 1HB ASP 123 1HB ASP 123 -5.724 -18.123 -1.426 1021 2HB ASP 123 2HB ASP 123 -5.702 -17.561 0.245 1022 H ASN 124 H ASN 124 -6.342 -13.828 -0.674 1023 HA ASN 124 HA ASN 124 -7.046 -12.189 0.700 1024 1HB ASN 124 1HB ASN 124 -9.048 -14.130 1.885 1025 2HB ASN 124 2HB ASN 124 -9.077 -12.377 1.993 1026 1HD2 ASN 124 1HD2 ASN 124 -11.122 -14.165 1.037 1027 2HD2 ASN 124 2HD2 ASN 124 -11.447 -13.711 -0.601 1028 H SER 125 H SER 125 -7.689 -14.949 2.673 1029 HA SER 125 HA SER 125 -6.977 -15.745 4.649 1030 1HB SER 125 1HB SER 125 -4.911 -16.069 3.298 1031 2HB SER 125 2HB SER 125 -4.309 -14.536 3.933 1032 HG SER 125 HG SER 125 -4.761 -15.567 6.075 1033 H LEU 126 H LEU 126 -6.010 -12.382 4.169 1034 HA LEU 126 HA LEU 126 -5.701 -10.635 5.567 1035 1HB LEU 126 1HB LEU 126 -7.997 -11.053 6.297 1036 2HB LEU 126 2HB LEU 126 -7.430 -12.233 7.464 1037 HG LEU 126 HG LEU 126 -6.269 -10.471 8.708 1038 1HD1 LEU 126 1HD1 LEU 126 -6.640 -8.109 8.110 1039 2HD1 LEU 126 2HD1 LEU 126 -7.410 -8.632 6.610 1040 3HD1 LEU 126 3HD1 LEU 126 -5.704 -8.981 6.897 1041 1HD2 LEU 126 1HD2 LEU 126 -8.245 -9.280 9.532 1042 2HD2 LEU 126 2HD2 LEU 126 -8.570 -10.998 9.298 1043 3HD2 LEU 126 3HD2 LEU 126 -9.156 -9.823 8.122 1044 H LEU 127 H LEU 127 -3.517 -11.104 5.605 1045 HA LEU 127 HA LEU 127 -2.465 -12.879 7.643 1046 1HB LEU 127 1HB LEU 127 -1.108 -11.226 5.514 1047 2HB LEU 127 2HB LEU 127 -0.269 -12.298 6.617 1048 HG LEU 127 HG LEU 127 -2.339 -13.173 4.602 1049 1HD1 LEU 127 1HD1 LEU 127 0.670 -13.381 4.576 1050 2HD1 LEU 127 2HD1 LEU 127 -0.328 -12.409 3.493 1051 3HD1 LEU 127 3HD1 LEU 127 -0.414 -14.170 3.431 1052 1HD2 LEU 127 1HD2 LEU 127 -2.238 -14.583 6.607 1053 2HD2 LEU 127 2HD2 LEU 127 -0.500 -14.779 6.377 1054 3HD2 LEU 127 3HD2 LEU 127 -1.627 -15.425 5.184 1055 H PHE 128 H PHE 128 -2.698 -9.454 6.985 1056 HA PHE 128 HA PHE 128 -1.844 -8.874 9.687 1057 1HB PHE 128 1HB PHE 128 0.077 -8.856 7.701 1058 2HB PHE 128 2HB PHE 128 -0.411 -7.171 7.784 1059 HD1 PHE 128 HD1 PHE 128 0.733 -9.997 9.899 1060 HD2 PHE 128 HD2 PHE 128 0.471 -5.778 9.418 1061 HE1 PHE 128 HE1 PHE 128 2.195 -9.687 11.849 1062 HE2 PHE 128 HE2 PHE 128 1.932 -5.461 11.372 1063 HZ PHE 128 HZ PHE 128 2.796 -7.416 12.589 1064 H THR 129 H THR 129 -2.373 -6.720 10.324 1065 HA THR 129 HA THR 129 -3.571 -4.892 8.500 1066 HB THR 129 HB THR 129 -5.500 -6.302 8.626 1067 HG1 THR 129 HG1 THR 129 -6.939 -4.829 9.943 1068 1HG2 THR 129 1HG2 THR 129 -5.288 -6.147 11.632 1069 2HG2 THR 129 2HG2 THR 129 -4.953 -7.566 10.640 1070 3HG2 THR 129 3HG2 THR 129 -6.592 -6.918 10.725 1071 H GLU 130 H GLU 130 -2.340 -3.298 9.251 1072 HA GLU 130 HA GLU 130 -2.066 -2.881 12.115 1073 1HB GLU 130 1HB GLU 130 -0.789 -1.562 9.727 1074 2HB GLU 130 2HB GLU 130 -0.554 -0.986 11.372 1075 1HG GLU 130 1HG GLU 130 0.169 -3.703 10.314 1076 2HG GLU 130 2HG GLU 130 1.284 -2.386 10.683 1077 H SER 131 H SER 131 -3.244 -1.490 13.231 1078 HA SER 131 HA SER 131 -4.962 0.369 11.792 1079 1HB SER 131 1HB SER 131 -5.850 -1.033 13.694 1080 2HB SER 131 2HB SER 131 -4.823 -0.100 14.781 1081 HG SER 131 HG SER 131 -6.330 1.482 13.135 1082 H ILE 132 H ILE 132 -4.330 2.366 11.422 1083 HA ILE 132 HA ILE 132 -1.896 3.357 12.593 1084 HB ILE 132 HB ILE 132 -2.379 5.386 11.139 1085 1HG1 ILE 132 1HG1 ILE 132 -4.530 3.555 10.040 1086 2HG1 ILE 132 2HG1 ILE 132 -4.829 5.026 10.956 1087 1HG2 ILE 132 1HG2 ILE 132 -2.158 2.670 9.837 1088 2HG2 ILE 132 2HG2 ILE 132 -0.829 3.628 10.488 1089 3HG2 ILE 132 3HG2 ILE 132 -1.726 4.207 9.083 1090 1HD1 ILE 132 1HD1 ILE 132 -3.449 4.881 8.286 1091 2HD1 ILE 132 2HD1 ILE 132 -3.812 6.349 9.194 1092 3HD1 ILE 132 3HD1 ILE 132 -5.126 5.357 8.560 1093 H GLN 133 H GLN 133 -2.107 3.910 14.667 1094 HA GLN 133 HA GLN 133 -4.477 5.296 15.596 1095 1HB GLN 133 1HB GLN 133 -3.492 3.470 16.931 1096 2HB GLN 133 2HB GLN 133 -2.014 4.404 17.109 1097 1HG GLN 133 1HG GLN 133 -3.392 4.530 19.105 1098 2HG GLN 133 2HG GLN 133 -3.219 6.113 18.346 1099 1HE2 GLN 133 1HE2 GLN 133 -5.381 3.483 19.040 1100 2HE2 GLN 133 2HE2 GLN 133 -6.842 4.328 18.668 Start of MODEL 17 1 H ASP 7 H ASP 7 -5.462 17.046 -15.444 2 HA ASP 7 HA ASP 7 -7.609 15.364 -14.735 3 1HB ASP 7 1HB ASP 7 -6.222 14.672 -16.526 4 2HB ASP 7 2HB ASP 7 -4.767 14.784 -15.540 5 H GLN 8 H GLN 8 -8.151 14.455 -12.942 6 HA GLN 8 HA GLN 8 -6.855 14.939 -10.488 7 1HB GLN 8 1HB GLN 8 -9.277 14.607 -10.718 8 2HB GLN 8 2HB GLN 8 -9.012 12.943 -11.199 9 1HG GLN 8 1HG GLN 8 -8.133 12.418 -9.009 10 2HG GLN 8 2HG GLN 8 -8.294 14.104 -8.515 11 1HE2 GLN 8 1HE2 GLN 8 -10.660 12.568 -10.538 12 2HE2 GLN 8 2HE2 GLN 8 -11.919 12.495 -9.355 13 H VAL 9 H VAL 9 -6.690 12.327 -12.795 14 HA VAL 9 HA VAL 9 -5.604 10.329 -11.114 15 HB VAL 9 HB VAL 9 -5.191 10.719 -14.088 16 1HG1 VAL 9 1HG1 VAL 9 -3.537 9.206 -13.131 17 2HG1 VAL 9 2HG1 VAL 9 -4.686 8.323 -14.135 18 3HG1 VAL 9 3HG1 VAL 9 -4.822 8.263 -12.377 19 1HG2 VAL 9 1HG2 VAL 9 -7.245 9.084 -12.599 20 2HG2 VAL 9 2HG2 VAL 9 -7.012 9.094 -14.347 21 3HG2 VAL 9 3HG2 VAL 9 -7.552 10.555 -13.520 22 H VAL 10 H VAL 10 -4.197 13.004 -12.897 23 HA VAL 10 HA VAL 10 -1.488 12.333 -12.723 24 HB VAL 10 HB VAL 10 -2.727 15.092 -12.639 25 1HG1 VAL 10 1HG1 VAL 10 0.089 14.255 -13.326 26 2HG1 VAL 10 2HG1 VAL 10 -0.410 15.127 -11.877 27 3HG1 VAL 10 3HG1 VAL 10 -0.563 15.887 -13.461 28 1HG2 VAL 10 1HG2 VAL 10 -3.406 13.868 -14.612 29 2HG2 VAL 10 2HG2 VAL 10 -1.729 13.446 -14.957 30 3HG2 VAL 10 3HG2 VAL 10 -2.252 15.126 -15.053 31 H ILE 11 H ILE 11 -3.499 14.225 -10.491 32 HA ILE 11 HA ILE 11 -1.490 14.891 -8.671 33 HB ILE 11 HB ILE 11 -4.467 14.601 -8.275 34 1HG1 ILE 11 1HG1 ILE 11 -4.236 17.138 -8.010 35 2HG1 ILE 11 2HG1 ILE 11 -2.607 16.948 -8.645 36 1HG2 ILE 11 1HG2 ILE 11 -3.447 14.178 -6.129 37 2HG2 ILE 11 2HG2 ILE 11 -4.188 15.778 -6.126 38 3HG2 ILE 11 3HG2 ILE 11 -2.438 15.617 -6.290 39 1HD1 ILE 11 1HD1 ILE 11 -4.148 17.635 -10.377 40 2HD1 ILE 11 2HD1 ILE 11 -5.159 16.224 -10.063 41 3HD1 ILE 11 3HD1 ILE 11 -3.530 16.016 -10.706 42 H PHE 12 H PHE 12 -3.837 12.204 -8.518 43 HA PHE 12 HA PHE 12 -2.856 11.133 -6.110 44 1HB PHE 12 1HB PHE 12 -4.465 9.948 -8.357 45 2HB PHE 12 2HB PHE 12 -3.944 8.967 -6.989 46 HD1 PHE 12 HD1 PHE 12 -6.272 11.468 -8.158 47 HD2 PHE 12 HD2 PHE 12 -4.700 9.546 -4.700 48 HE1 PHE 12 HE1 PHE 12 -8.197 12.256 -6.848 49 HE2 PHE 12 HE2 PHE 12 -6.627 10.330 -3.385 50 HZ PHE 12 HZ PHE 12 -8.378 11.686 -4.460 51 H LYS 13 H LYS 13 -2.006 10.458 -9.471 52 HA LYS 13 HA LYS 13 -0.254 8.316 -8.924 53 1HB LYS 13 1HB LYS 13 -1.057 8.634 -11.158 54 2HB LYS 13 2HB LYS 13 -0.370 10.252 -11.238 55 1HG LYS 13 1HG LYS 13 1.882 9.277 -11.123 56 2HG LYS 13 2HG LYS 13 1.162 7.667 -11.092 57 1HD LYS 13 1HD LYS 13 1.895 8.236 -13.344 58 2HD LYS 13 2HD LYS 13 0.139 8.088 -13.277 59 1HE LYS 13 1HE LYS 13 -0.083 10.508 -13.156 60 2HE LYS 13 2HE LYS 13 1.673 10.681 -13.173 61 1HZ LYS 13 1HZ LYS 13 1.716 9.687 -15.370 62 2HZ LYS 13 2HZ LYS 13 0.721 11.062 -15.357 63 3HZ LYS 13 3HZ LYS 13 0.026 9.516 -15.353 64 H GLN 14 H GLN 14 0.273 11.813 -9.152 65 HA GLN 14 HA GLN 14 3.064 11.803 -8.842 66 1HB GLN 14 1HB GLN 14 1.022 13.858 -7.975 67 2HB GLN 14 2HB GLN 14 2.761 14.121 -7.936 68 1HG GLN 14 1HG GLN 14 2.858 13.799 -10.357 69 2HG GLN 14 2HG GLN 14 1.113 13.551 -10.389 70 1HE2 GLN 14 1HE2 GLN 14 2.684 15.550 -11.747 71 2HE2 GLN 14 2HE2 GLN 14 2.096 17.088 -11.207 72 H ILE 15 H ILE 15 0.465 11.676 -6.477 73 HA ILE 15 HA ILE 15 1.955 12.032 -4.136 74 HB ILE 15 HB ILE 15 -0.491 10.300 -4.545 75 1HG1 ILE 15 1HG1 ILE 15 -0.280 13.151 -3.551 76 2HG1 ILE 15 2HG1 ILE 15 -0.758 12.695 -5.185 77 1HG2 ILE 15 1HG2 ILE 15 0.643 11.450 -1.997 78 2HG2 ILE 15 2HG2 ILE 15 0.714 9.754 -2.479 79 3HG2 ILE 15 3HG2 ILE 15 -0.844 10.514 -2.146 80 1HD1 ILE 15 1HD1 ILE 15 -2.691 13.229 -3.825 81 2HD1 ILE 15 2HD1 ILE 15 -2.224 11.999 -2.649 82 3HD1 ILE 15 3HD1 ILE 15 -2.705 11.525 -4.280 83 H PHE 16 H PHE 16 0.934 8.977 -5.658 84 HA PHE 16 HA PHE 16 2.418 7.374 -3.840 85 1HB PHE 16 1HB PHE 16 1.071 6.731 -6.461 86 2HB PHE 16 2HB PHE 16 1.850 5.517 -5.452 87 HD1 PHE 16 HD1 PHE 16 0.919 4.934 -3.269 88 HD2 PHE 16 HD2 PHE 16 -1.038 7.692 -5.848 89 HE1 PHE 16 HE1 PHE 16 -1.144 4.700 -1.951 90 HE2 PHE 16 HE2 PHE 16 -3.107 7.462 -4.537 91 HZ PHE 16 HZ PHE 16 -3.160 5.962 -2.585 92 H ASP 17 H ASP 17 3.098 8.690 -7.021 93 HA ASP 17 HA ASP 17 5.392 7.106 -7.549 94 1HB ASP 17 1HB ASP 17 4.164 8.414 -9.281 95 2HB ASP 17 2HB ASP 17 4.779 9.896 -8.555 96 H LYS 18 H LYS 18 4.943 10.298 -6.067 97 HA LYS 18 HA LYS 18 7.740 10.739 -5.740 98 1HB LYS 18 1HB LYS 18 6.262 12.634 -5.937 99 2HB LYS 18 2HB LYS 18 5.358 12.132 -4.515 100 1HG LYS 18 1HG LYS 18 7.014 12.805 -3.061 101 2HG LYS 18 2HG LYS 18 8.281 12.693 -4.284 102 1HD LYS 18 1HD LYS 18 7.794 15.019 -3.744 103 2HD LYS 18 2HD LYS 18 7.369 14.655 -5.415 104 1HE LYS 18 1HE LYS 18 5.009 14.420 -4.744 105 2HE LYS 18 2HE LYS 18 5.453 14.833 -3.086 106 1HZ LYS 18 1HZ LYS 18 6.195 16.993 -3.839 107 2HZ LYS 18 2HZ LYS 18 4.587 16.751 -4.318 108 3HZ LYS 18 3HZ LYS 18 5.840 16.597 -5.448 109 H VAL 19 H VAL 19 5.180 9.520 -3.588 110 HA VAL 19 HA VAL 19 6.791 9.581 -1.252 111 HB VAL 19 HB VAL 19 4.307 9.405 -1.198 112 1HG1 VAL 19 1HG1 VAL 19 3.247 7.222 -1.447 113 2HG1 VAL 19 2HG1 VAL 19 4.790 6.528 -1.952 114 3HG1 VAL 19 3HG1 VAL 19 4.001 7.747 -2.955 115 1HG2 VAL 19 1HG2 VAL 19 5.643 8.926 0.784 116 2HG2 VAL 19 2HG2 VAL 19 5.775 7.236 0.295 117 3HG2 VAL 19 3HG2 VAL 19 4.204 7.910 0.728 118 H ARG 20 H ARG 20 6.524 7.333 -3.885 119 HA ARG 20 HA ARG 20 7.801 5.145 -2.542 120 1HB ARG 20 1HB ARG 20 6.255 4.850 -4.456 121 2HB ARG 20 2HB ARG 20 7.417 5.653 -5.502 122 1HG ARG 20 1HG ARG 20 8.960 3.869 -5.300 123 2HG ARG 20 2HG ARG 20 8.040 3.135 -3.985 124 1HD ARG 20 1HD ARG 20 7.688 1.936 -6.077 125 2HD ARG 20 2HD ARG 20 6.196 2.686 -5.516 126 HE ARG 20 HE ARG 20 7.644 4.312 -7.386 127 1HH1 ARG 20 1HH1 ARG 20 5.322 1.707 -7.057 128 2HH1 ARG 20 2HH1 ARG 20 4.658 1.934 -8.637 129 1HH2 ARG 20 1HH2 ARG 20 6.759 4.631 -9.451 130 2HH2 ARG 20 2HH2 ARG 20 5.461 3.619 -9.999 131 H ASN 21 H ASN 21 8.901 8.066 -3.753 132 HA ASN 21 HA ASN 21 11.635 7.024 -4.108 133 1HB ASN 21 1HB ASN 21 10.232 9.391 -5.327 134 2HB ASN 21 2HB ASN 21 11.989 9.303 -5.275 135 1HD2 ASN 21 1HD2 ASN 21 9.085 7.985 -6.665 136 2HD2 ASN 21 2HD2 ASN 21 9.870 7.068 -7.906 137 H ASP 22 H ASP 22 9.842 9.844 -2.911 138 HA ASP 22 HA ASP 22 12.111 10.911 -1.515 139 1HB ASP 22 1HB ASP 22 10.246 12.279 -2.499 140 2HB ASP 22 2HB ASP 22 9.196 11.671 -1.225 141 H LEU 23 H LEU 23 9.574 8.718 -0.780 142 HA LEU 23 HA LEU 23 9.023 7.488 1.039 143 1HB LEU 23 1HB LEU 23 11.735 8.369 2.030 144 2HB LEU 23 2HB LEU 23 10.763 7.106 2.755 145 HG LEU 23 HG LEU 23 12.011 7.052 0.005 146 1HD1 LEU 23 1HD1 LEU 23 12.535 5.426 2.490 147 2HD1 LEU 23 2HD1 LEU 23 13.594 6.664 1.813 148 3HD1 LEU 23 3HD1 LEU 23 13.293 5.175 0.917 149 1HD2 LEU 23 1HD2 LEU 23 10.278 4.997 1.370 150 2HD2 LEU 23 2HD2 LEU 23 11.123 4.781 -0.162 151 3HD2 LEU 23 3HD2 LEU 23 9.826 5.968 -0.028 152 H ASN 24 H ASN 24 8.206 10.211 0.891 153 HA ASN 24 HA ASN 24 8.269 11.222 3.614 154 1HB ASN 24 1HB ASN 24 8.380 12.745 1.606 155 2HB ASN 24 2HB ASN 24 6.722 12.286 1.235 156 1HD2 ASN 24 1HD2 ASN 24 7.808 14.889 1.820 157 2HD2 ASN 24 2HD2 ASN 24 6.966 15.482 3.208 158 H TYR 25 H TYR 25 7.096 9.909 4.905 159 HA TYR 25 HA TYR 25 4.479 8.969 4.030 160 1HB TYR 25 1HB TYR 25 6.047 8.425 6.561 161 2HB TYR 25 2HB TYR 25 4.482 7.706 6.177 162 HD1 TYR 25 HD1 TYR 25 4.306 6.225 4.138 163 HD2 TYR 25 HD2 TYR 25 8.042 7.491 5.723 164 HE1 TYR 25 HE1 TYR 25 5.431 4.407 2.925 165 HE2 TYR 25 HE2 TYR 25 9.179 5.677 4.512 166 HH TYR 25 HH TYR 25 7.696 3.903 2.056 167 H GLN 26 H GLN 26 5.913 11.371 6.033 168 HA GLN 26 HA GLN 26 3.813 11.992 7.767 169 1HB GLN 26 1HB GLN 26 6.053 12.949 7.997 170 2HB GLN 26 2HB GLN 26 5.845 13.839 6.497 171 1HG GLN 26 1HG GLN 26 4.047 15.135 7.498 172 2HG GLN 26 2HG GLN 26 4.218 14.227 8.999 173 1HE2 GLN 26 1HE2 GLN 26 6.946 15.198 7.047 174 2HE2 GLN 26 2HE2 GLN 26 7.565 16.372 8.160 175 H TRP 27 H TRP 27 4.562 13.354 4.565 176 HA TRP 27 HA TRP 27 2.097 14.805 4.429 177 1HB TRP 27 1HB TRP 27 3.945 15.673 3.169 178 2HB TRP 27 2HB TRP 27 4.182 14.135 2.345 179 HD1 TRP 27 HD1 TRP 27 1.512 16.944 2.542 180 HE1 TRP 27 HE1 TRP 27 0.326 17.077 0.255 181 HE3 TRP 27 HE3 TRP 27 3.814 13.025 0.200 182 HZ2 TRP 27 HZ2 TRP 27 0.374 15.710 -2.210 183 HZ3 TRP 27 HZ3 TRP 27 3.186 12.505 -2.120 184 HH2 TRP 27 HH2 TRP 27 1.497 13.819 -3.297 185 H PHE 28 H PHE 28 3.261 11.692 3.316 186 HA PHE 28 HA PHE 28 1.417 11.019 1.398 187 1HB PHE 28 1HB PHE 28 3.385 9.666 1.947 188 2HB PHE 28 2HB PHE 28 2.642 9.194 3.470 189 HD1 PHE 28 HD1 PHE 28 1.878 7.048 3.500 190 HD2 PHE 28 HD2 PHE 28 1.607 9.271 -0.121 191 HE1 PHE 28 HE1 PHE 28 0.854 5.110 2.390 192 HE2 PHE 28 HE2 PHE 28 0.579 7.332 -1.239 193 HZ PHE 28 HZ PHE 28 0.199 5.248 0.021 194 H TYR 29 H TYR 29 1.142 10.084 4.840 195 HA TYR 29 HA TYR 29 -1.460 9.019 4.479 196 1HB TYR 29 1HB TYR 29 0.109 9.731 6.950 197 2HB TYR 29 2HB TYR 29 -1.508 9.038 7.020 198 HD1 TYR 29 HD1 TYR 29 1.983 8.339 6.740 199 HD2 TYR 29 HD2 TYR 29 -1.877 6.787 5.859 200 HE1 TYR 29 HE1 TYR 29 2.942 6.080 6.545 201 HE2 TYR 29 HE2 TYR 29 -0.934 4.527 5.667 202 HH TYR 29 HH TYR 29 2.161 3.718 6.739 203 H SER 30 H SER 30 -0.295 12.190 5.321 204 HA SER 30 HA SER 30 -2.784 13.145 6.346 205 1HB SER 30 1HB SER 30 -0.421 14.712 5.281 206 2HB SER 30 2HB SER 30 -1.725 15.344 6.291 207 HG SER 30 HG SER 30 0.475 13.814 6.976 208 H GLU 31 H GLU 31 -1.178 13.191 3.199 209 HA GLU 31 HA GLU 31 -3.125 14.767 1.861 210 1HB GLU 31 1HB GLU 31 -0.812 14.317 1.015 211 2HB GLU 31 2HB GLU 31 -1.292 12.655 0.701 212 1HG GLU 31 1HG GLU 31 -1.323 13.968 -1.327 213 2HG GLU 31 2HG GLU 31 -2.945 13.427 -0.912 214 H LEU 32 H LEU 32 -2.673 11.287 2.307 215 HA LEU 32 HA LEU 32 -4.865 10.374 0.843 216 1HB LEU 32 1HB LEU 32 -3.680 9.258 3.386 217 2HB LEU 32 2HB LEU 32 -4.828 8.411 2.370 218 HG LEU 32 HG LEU 32 -2.044 9.251 1.555 219 1HD1 LEU 32 1HD1 LEU 32 -1.538 6.882 1.605 220 2HD1 LEU 32 2HD1 LEU 32 -3.185 6.520 2.119 221 3HD1 LEU 32 3HD1 LEU 32 -2.105 7.415 3.188 222 1HD2 LEU 32 1HD2 LEU 32 -3.616 9.277 -0.322 223 2HD2 LEU 32 2HD2 LEU 32 -4.112 7.631 0.072 224 3HD2 LEU 32 3HD2 LEU 32 -2.462 7.949 -0.463 225 H LYS 33 H LYS 33 -4.651 11.502 4.192 226 HA LYS 33 HA LYS 33 -7.303 10.967 4.939 227 1HB LYS 33 1HB LYS 33 -5.652 11.455 6.614 228 2HB LYS 33 2HB LYS 33 -5.320 13.027 5.907 229 1HG LYS 33 1HG LYS 33 -7.483 13.838 6.578 230 2HG LYS 33 2HG LYS 33 -7.934 12.240 7.172 231 1HD LYS 33 1HD LYS 33 -6.310 12.346 8.911 232 2HD LYS 33 2HD LYS 33 -5.582 13.798 8.225 233 1HE LYS 33 1HE LYS 33 -8.400 13.632 9.282 234 2HE LYS 33 2HE LYS 33 -7.023 14.236 10.203 235 1HZ LYS 33 1HZ LYS 33 -8.098 15.392 7.684 236 2HZ LYS 33 2HZ LYS 33 -6.708 15.939 8.480 237 3HZ LYS 33 3HZ LYS 33 -8.223 16.066 9.238 238 H ARG 34 H ARG 34 -5.941 13.536 3.026 239 HA ARG 34 HA ARG 34 -8.223 15.262 3.355 240 1HB ARG 34 1HB ARG 34 -5.917 15.439 1.409 241 2HB ARG 34 2HB ARG 34 -7.134 16.687 1.656 242 1HG ARG 34 1HG ARG 34 -6.373 16.643 4.111 243 2HG ARG 34 2HG ARG 34 -4.958 15.782 3.504 244 1HD ARG 34 1HD ARG 34 -5.900 18.502 2.591 245 2HD ARG 34 2HD ARG 34 -4.563 18.197 3.694 246 HE ARG 34 HE ARG 34 -4.180 16.832 1.216 247 1HH1 ARG 34 1HH1 ARG 34 -3.985 19.988 2.736 248 2HH1 ARG 34 2HH1 ARG 34 -2.797 20.596 1.617 249 1HH2 ARG 34 1HH2 ARG 34 -2.614 17.634 -0.261 250 2HH2 ARG 34 2HH2 ARG 34 -2.049 19.275 -0.099 251 H HIS 35 H HIS 35 -7.384 12.651 1.251 252 HA HIS 35 HA HIS 35 -9.644 13.398 -0.512 253 1HB HIS 35 1HB HIS 35 -7.209 11.807 -1.343 254 2HB HIS 35 2HB HIS 35 -8.529 12.326 -2.380 255 HD1 HIS 35 HD1 HIS 35 -8.795 15.125 -2.343 256 HD2 HIS 35 HD2 HIS 35 -5.089 13.445 -1.489 257 HE1 HIS 35 HE1 HIS 35 -7.115 16.962 -2.701 258 HE2 HIS 35 HE2 HIS 35 -4.941 15.991 -1.869 259 H ASN 36 H ASN 36 -7.731 10.621 0.568 260 HA ASN 36 HA ASN 36 -9.775 8.743 -0.186 261 1HB ASN 36 1HB ASN 36 -7.215 8.323 1.377 262 2HB ASN 36 2HB ASN 36 -8.248 7.048 0.746 263 1HD2 ASN 36 1HD2 ASN 36 -6.602 6.183 -0.472 264 2HD2 ASN 36 2HD2 ASN 36 -6.005 6.942 -1.899 265 H VAL 37 H VAL 37 -11.453 9.650 1.140 266 HA VAL 37 HA VAL 37 -11.347 9.717 3.952 267 HB VAL 37 HB VAL 37 -13.791 9.357 2.210 268 1HG1 VAL 37 1HG1 VAL 37 -14.996 10.408 4.060 269 2HG1 VAL 37 2HG1 VAL 37 -13.507 10.463 5.000 270 3HG1 VAL 37 3HG1 VAL 37 -14.219 8.909 4.569 271 1HG2 VAL 37 1HG2 VAL 37 -13.985 11.814 2.334 272 2HG2 VAL 37 2HG2 VAL 37 -12.530 11.291 1.484 273 3HG2 VAL 37 3HG2 VAL 37 -12.417 11.873 3.142 274 H SER 38 H SER 38 -11.991 7.147 1.670 275 HA SER 38 HA SER 38 -12.622 5.360 3.910 276 1HB SER 38 1HB SER 38 -14.293 5.481 2.071 277 2HB SER 38 2HB SER 38 -13.072 4.855 0.964 278 HG SER 38 HG SER 38 -14.125 3.547 3.267 279 H HIS 39 H HIS 39 -11.225 4.476 0.724 280 HA HIS 39 HA HIS 39 -8.754 3.629 1.918 281 1HB HIS 39 1HB HIS 39 -9.099 1.211 1.703 282 2HB HIS 39 2HB HIS 39 -10.250 1.907 2.835 283 HD1 HIS 39 HD1 HIS 39 -12.763 1.964 2.082 284 HD2 HIS 39 HD2 HIS 39 -10.197 0.062 -0.579 285 HE1 HIS 39 HE1 HIS 39 -14.248 0.686 0.512 286 HE2 HIS 39 HE2 HIS 39 -12.687 -0.275 -1.220 287 H TYR 40 H TYR 40 -7.264 2.732 0.431 288 HA TYR 40 HA TYR 40 -8.169 2.613 -2.368 289 1HB TYR 40 1HB TYR 40 -6.100 3.549 -3.149 290 2HB TYR 40 2HB TYR 40 -6.739 4.638 -1.927 291 HD1 TYR 40 HD1 TYR 40 -5.612 4.876 0.236 292 HD2 TYR 40 HD2 TYR 40 -4.068 2.296 -2.778 293 HE1 TYR 40 HE1 TYR 40 -3.469 4.768 1.431 294 HE2 TYR 40 HE2 TYR 40 -1.919 2.178 -1.588 295 HH TYR 40 HH TYR 40 -1.548 3.282 1.615 296 H ILE 41 H ILE 41 -7.333 0.948 -3.603 297 HA ILE 41 HA ILE 41 -5.981 -1.156 -2.051 298 HB ILE 41 HB ILE 41 -7.596 -1.509 -4.586 299 1HG1 ILE 41 1HG1 ILE 41 -9.117 -2.783 -2.857 300 2HG1 ILE 41 2HG1 ILE 41 -8.355 -1.711 -1.690 301 1HG2 ILE 41 1HG2 ILE 41 -7.478 -3.896 -4.038 302 2HG2 ILE 41 2HG2 ILE 41 -6.452 -3.523 -2.654 303 3HG2 ILE 41 3HG2 ILE 41 -5.878 -3.200 -4.291 304 1HD1 ILE 41 1HD1 ILE 41 -9.891 -0.829 -4.124 305 2HD1 ILE 41 2HD1 ILE 41 -9.167 0.222 -2.907 306 3HD1 ILE 41 3HD1 ILE 41 -10.500 -0.846 -2.469 307 H TYR 42 H TYR 42 -3.894 -1.102 -2.412 308 HA TYR 42 HA TYR 42 -2.845 -0.488 -5.072 309 1HB TYR 42 1HB TYR 42 -1.891 0.573 -3.002 310 2HB TYR 42 2HB TYR 42 -1.383 -1.024 -2.469 311 HD1 TYR 42 HD1 TYR 42 0.213 -2.309 -4.125 312 HD2 TYR 42 HD2 TYR 42 -0.433 1.892 -4.183 313 HE1 TYR 42 HE1 TYR 42 2.359 -2.005 -5.284 314 HE2 TYR 42 HE2 TYR 42 1.705 2.210 -5.347 315 HH TYR 42 HH TYR 42 3.447 -0.388 -6.738 316 H TYR 43 H TYR 43 -2.743 -2.199 -6.422 317 HA TYR 43 HA TYR 43 -2.501 -4.881 -5.344 318 1HB TYR 43 1HB TYR 43 -2.770 -3.866 -8.177 319 2HB TYR 43 2HB TYR 43 -2.661 -5.569 -7.751 320 HD1 TYR 43 HD1 TYR 43 -4.484 -6.549 -6.267 321 HD2 TYR 43 HD2 TYR 43 -4.828 -2.737 -8.134 322 HE1 TYR 43 HE1 TYR 43 -6.922 -6.629 -5.975 323 HE2 TYR 43 HE2 TYR 43 -7.271 -2.814 -7.850 324 HH TYR 43 HH TYR 43 -8.811 -5.120 -5.865 325 H LEU 44 H LEU 44 -0.574 -5.680 -4.854 326 HA LEU 44 HA LEU 44 1.862 -4.655 -5.919 327 1HB LEU 44 1HB LEU 44 1.241 -7.158 -4.353 328 2HB LEU 44 2HB LEU 44 2.855 -6.775 -4.911 329 HG LEU 44 HG LEU 44 2.470 -4.527 -3.615 330 1HD1 LEU 44 1HD1 LEU 44 0.570 -6.381 -2.189 331 2HD1 LEU 44 2HD1 LEU 44 0.109 -4.949 -3.112 332 3HD1 LEU 44 3HD1 LEU 44 1.074 -4.782 -1.643 333 1HD2 LEU 44 1HD2 LEU 44 2.966 -7.130 -2.177 334 2HD2 LEU 44 2HD2 LEU 44 3.463 -5.527 -1.636 335 3HD2 LEU 44 3HD2 LEU 44 4.168 -6.223 -3.097 336 H ALA 45 H ALA 45 3.421 -5.945 -7.136 337 HA ALA 45 HA ALA 45 4.131 -7.269 -8.838 338 1HB ALA 45 1HB ALA 45 1.465 -8.655 -8.611 339 2HB ALA 45 2HB ALA 45 2.960 -9.131 -7.801 340 3HB ALA 45 3HB ALA 45 2.845 -9.214 -9.560 341 H THR 46 H THR 46 1.143 -5.552 -9.040 342 HA THR 46 HA THR 46 1.457 -5.400 -11.962 343 HB THR 46 HB THR 46 -0.976 -4.721 -11.974 344 HG1 THR 46 HG1 THR 46 -1.247 -5.978 -9.485 345 1HG2 THR 46 1HG2 THR 46 -1.804 -7.026 -11.733 346 2HG2 THR 46 2HG2 THR 46 -0.293 -7.477 -10.939 347 3HG2 THR 46 3HG2 THR 46 -0.284 -6.966 -12.629 348 H GLU 47 H GLU 47 1.283 -3.602 -9.007 349 HA GLU 47 HA GLU 47 1.677 -1.421 -8.509 350 1HB GLU 47 1HB GLU 47 2.452 -1.201 -11.428 351 2HB GLU 47 2HB GLU 47 2.726 0.042 -10.215 352 1HG GLU 47 1HG GLU 47 3.884 -2.732 -10.099 353 2HG GLU 47 2HG GLU 47 4.722 -1.321 -10.745 354 H ASN 48 H ASN 48 -0.915 -2.439 -9.602 355 HA ASN 48 HA ASN 48 -2.033 -0.003 -10.777 356 1HB ASN 48 1HB ASN 48 -3.117 -2.796 -10.453 357 2HB ASN 48 2HB ASN 48 -4.161 -1.447 -10.882 358 1HD2 ASN 48 1HD2 ASN 48 -0.839 -1.804 -11.955 359 2HD2 ASN 48 2HD2 ASN 48 -1.216 -2.062 -13.620 360 H VAL 49 H VAL 49 -2.724 1.498 -9.454 361 HA VAL 49 HA VAL 49 -3.566 0.725 -6.742 362 HB VAL 49 HB VAL 49 -3.032 3.547 -7.629 363 1HG1 VAL 49 1HG1 VAL 49 -2.832 2.147 -4.965 364 2HG1 VAL 49 2HG1 VAL 49 -4.098 3.268 -5.473 365 3HG1 VAL 49 3HG1 VAL 49 -2.444 3.843 -5.255 366 1HG2 VAL 49 1HG2 VAL 49 -0.958 1.571 -6.680 367 2HG2 VAL 49 2HG2 VAL 49 -0.703 3.302 -6.895 368 3HG2 VAL 49 3HG2 VAL 49 -1.063 2.283 -8.289 369 H HIS 50 H HIS 50 -5.682 0.720 -6.310 370 HA HIS 50 HA HIS 50 -7.455 2.378 -7.982 371 1HB HIS 50 1HB HIS 50 -7.946 -0.201 -6.495 372 2HB HIS 50 2HB HIS 50 -9.271 0.816 -7.052 373 HD1 HIS 50 HD1 HIS 50 -10.220 -0.161 -9.110 374 HD2 HIS 50 HD2 HIS 50 -6.082 -0.570 -8.982 375 HE1 HIS 50 HE1 HIS 50 -9.581 -1.287 -11.262 376 HE2 HIS 50 HE2 HIS 50 -7.127 -1.781 -11.022 377 H ILE 51 H ILE 51 -7.685 4.264 -6.977 378 HA ILE 51 HA ILE 51 -7.909 4.376 -4.070 379 HB ILE 51 HB ILE 51 -7.753 6.599 -6.116 380 1HG1 ILE 51 1HG1 ILE 51 -5.552 6.992 -4.762 381 2HG1 ILE 51 2HG1 ILE 51 -5.740 5.304 -4.304 382 1HG2 ILE 51 1HG2 ILE 51 -7.504 8.115 -4.216 383 2HG2 ILE 51 2HG2 ILE 51 -7.783 6.773 -3.106 384 3HG2 ILE 51 3HG2 ILE 51 -9.066 7.296 -4.198 385 1HD1 ILE 51 1HD1 ILE 51 -5.525 6.358 -7.114 386 2HD1 ILE 51 2HD1 ILE 51 -5.701 4.663 -6.656 387 3HD1 ILE 51 3HD1 ILE 51 -4.248 5.557 -6.200 388 H VAL 52 H VAL 52 -9.901 3.947 -3.327 389 HA VAL 52 HA VAL 52 -12.189 5.197 -4.674 390 HB VAL 52 HB VAL 52 -12.280 3.298 -2.324 391 1HG1 VAL 52 1HG1 VAL 52 -14.614 2.971 -3.047 392 2HG1 VAL 52 2HG1 VAL 52 -14.382 4.195 -4.297 393 3HG1 VAL 52 3HG1 VAL 52 -14.279 4.642 -2.592 394 1HG2 VAL 52 1HG2 VAL 52 -11.220 2.171 -4.203 395 2HG2 VAL 52 2HG2 VAL 52 -12.548 2.654 -5.258 396 3HG2 VAL 52 3HG2 VAL 52 -12.839 1.533 -3.927 397 H LEU 53 H LEU 53 -12.597 7.196 -4.015 398 HA LEU 53 HA LEU 53 -11.361 8.445 -1.866 399 1HB LEU 53 1HB LEU 53 -13.898 9.171 -3.313 400 2HB LEU 53 2HB LEU 53 -13.094 10.229 -2.170 401 HG LEU 53 HG LEU 53 -12.072 9.290 -4.845 402 1HD1 LEU 53 1HD1 LEU 53 -11.978 11.688 -5.315 403 2HD1 LEU 53 2HD1 LEU 53 -12.652 12.022 -3.720 404 3HD1 LEU 53 3HD1 LEU 53 -13.613 11.159 -4.921 405 1HD2 LEU 53 1HD2 LEU 53 -10.597 10.817 -2.704 406 2HD2 LEU 53 2HD2 LEU 53 -10.036 10.583 -4.358 407 3HD2 LEU 53 3HD2 LEU 53 -10.219 9.194 -3.286 408 H LYS 54 H LYS 54 -14.887 8.211 -1.951 409 HA LYS 54 HA LYS 54 -14.784 7.148 0.797 410 1HB LYS 54 1HB LYS 54 -15.688 9.422 0.735 411 2HB LYS 54 2HB LYS 54 -16.868 8.936 -0.475 412 1HG LYS 54 1HG LYS 54 -17.862 7.389 1.174 413 2HG LYS 54 2HG LYS 54 -16.730 8.007 2.380 414 1HD LYS 54 1HD LYS 54 -17.647 10.226 2.170 415 2HD LYS 54 2HD LYS 54 -18.697 9.704 0.851 416 1HE LYS 54 1HE LYS 54 -19.788 8.127 2.428 417 2HE LYS 54 2HE LYS 54 -18.813 8.817 3.725 418 1HZ LYS 54 1HZ LYS 54 -20.650 10.404 2.021 419 2HZ LYS 54 2HZ LYS 54 -19.853 10.920 3.425 420 3HZ LYS 54 3HZ LYS 54 -21.086 9.759 3.528 421 H ASN 55 H ASN 55 -16.094 7.004 -2.364 422 HA ASN 55 HA ASN 55 -16.792 4.498 -2.818 423 1HB ASN 55 1HB ASN 55 -18.161 4.528 -0.683 424 2HB ASN 55 2HB ASN 55 -19.220 5.707 -1.450 425 1HD2 ASN 55 1HD2 ASN 55 -20.999 4.357 -1.338 426 2HD2 ASN 55 2HD2 ASN 55 -21.172 2.964 -2.355 427 H ASP 56 H ASP 56 -17.475 7.790 -2.905 428 HA ASP 56 HA ASP 56 -19.371 7.901 -5.007 429 1HB ASP 56 1HB ASP 56 -18.719 10.330 -5.039 430 2HB ASP 56 2HB ASP 56 -19.233 9.731 -3.468 431 H ASN 57 H ASN 57 -15.853 8.432 -4.874 432 HA ASN 57 HA ASN 57 -15.813 8.094 -7.801 433 1HB ASN 57 1HB ASN 57 -15.378 10.436 -7.149 434 2HB ASN 57 2HB ASN 57 -14.039 9.898 -6.140 435 1HD2 ASN 57 1HD2 ASN 57 -12.482 11.030 -7.221 436 2HD2 ASN 57 2HD2 ASN 57 -11.975 10.641 -8.827 437 H THR 58 H THR 58 -14.026 7.046 -8.703 438 HA THR 58 HA THR 58 -12.111 5.811 -6.867 439 HB THR 58 HB THR 58 -13.616 4.266 -8.991 440 HG1 THR 58 HG1 THR 58 -14.135 4.769 -6.349 441 1HG2 THR 58 1HG2 THR 58 -12.481 2.302 -8.027 442 2HG2 THR 58 2HG2 THR 58 -11.572 3.365 -6.952 443 3HG2 THR 58 3HG2 THR 58 -11.331 3.460 -8.696 444 H VAL 59 H VAL 59 -10.189 6.425 -7.554 445 HA VAL 59 HA VAL 59 -9.752 6.901 -10.429 446 HB VAL 59 HB VAL 59 -8.011 7.831 -8.134 447 1HG1 VAL 59 1HG1 VAL 59 -7.201 9.462 -9.822 448 2HG1 VAL 59 2HG1 VAL 59 -8.163 8.622 -11.037 449 3HG1 VAL 59 3HG1 VAL 59 -6.837 7.784 -10.228 450 1HG2 VAL 59 1HG2 VAL 59 -10.158 9.378 -9.579 451 2HG2 VAL 59 2HG2 VAL 59 -9.059 10.019 -8.356 452 3HG2 VAL 59 3HG2 VAL 59 -10.252 8.793 -7.917 453 H LEU 60 H LEU 60 -8.447 5.509 -11.507 454 HA LEU 60 HA LEU 60 -6.895 3.623 -9.876 455 1HB LEU 60 1HB LEU 60 -7.087 1.999 -11.671 456 2HB LEU 60 2HB LEU 60 -8.665 2.506 -11.108 457 HG LEU 60 HG LEU 60 -7.441 3.713 -13.579 458 1HD1 LEU 60 1HD1 LEU 60 -8.643 2.051 -14.901 459 2HD1 LEU 60 2HD1 LEU 60 -9.141 1.221 -13.426 460 3HD1 LEU 60 3HD1 LEU 60 -7.437 1.280 -13.873 461 1HD2 LEU 60 1HD2 LEU 60 -9.380 4.839 -12.596 462 2HD2 LEU 60 2HD2 LEU 60 -10.290 3.329 -12.661 463 3HD2 LEU 60 3HD2 LEU 60 -9.779 4.115 -14.155 464 H LEU 61 H LEU 61 -4.810 3.785 -9.957 465 HA LEU 61 HA LEU 61 -3.534 5.158 -12.222 466 1HB LEU 61 1HB LEU 61 -2.133 4.353 -9.690 467 2HB LEU 61 2HB LEU 61 -1.730 5.652 -10.802 468 HG LEU 61 HG LEU 61 -4.141 5.678 -8.983 469 1HD1 LEU 61 1HD1 LEU 61 -1.451 6.994 -8.672 470 2HD1 LEU 61 2HD1 LEU 61 -2.116 5.714 -7.658 471 3HD1 LEU 61 3HD1 LEU 61 -2.861 7.314 -7.668 472 1HD2 LEU 61 1HD2 LEU 61 -2.847 7.836 -10.648 473 2HD2 LEU 61 2HD2 LEU 61 -4.214 8.054 -9.554 474 3HD2 LEU 61 3HD2 LEU 61 -4.386 7.046 -10.991 475 H LYS 62 H LYS 62 -3.027 3.702 -13.772 476 HA LYS 62 HA LYS 62 -2.296 0.991 -13.001 477 1HB LYS 62 1HB LYS 62 -3.922 1.526 -14.883 478 2HB LYS 62 2HB LYS 62 -2.531 2.081 -15.805 479 1HG LYS 62 1HG LYS 62 -1.535 -0.124 -15.681 480 2HG LYS 62 2HG LYS 62 -2.877 -0.692 -14.684 481 1HD LYS 62 1HD LYS 62 -4.408 -0.091 -16.584 482 2HD LYS 62 2HD LYS 62 -2.967 0.197 -17.564 483 1HE LYS 62 1HE LYS 62 -3.767 -2.029 -17.995 484 2HE LYS 62 2HE LYS 62 -2.248 -2.127 -17.104 485 1HZ LYS 62 1HZ LYS 62 -3.505 -2.523 -15.072 486 2HZ LYS 62 2HZ LYS 62 -3.891 -3.682 -16.248 487 3HZ LYS 62 3HZ LYS 62 -4.966 -2.412 -15.926 488 H GLY 63 H GLY 63 -0.255 0.636 -12.501 489 1HA GLY 63 1HA GLY 63 1.826 2.382 -13.516 490 2HA GLY 63 2HA GLY 63 2.004 1.167 -12.263 491 H LEU 64 H LEU 64 3.551 -0.166 -12.875 492 HA LEU 64 HA LEU 64 4.408 -0.402 -15.560 493 1HB LEU 64 1HB LEU 64 5.161 -2.057 -13.155 494 2HB LEU 64 2HB LEU 64 6.033 -2.010 -14.675 495 HG LEU 64 HG LEU 64 5.692 0.327 -12.794 496 1HD1 LEU 64 1HD1 LEU 64 8.061 0.036 -12.318 497 2HD1 LEU 64 2HD1 LEU 64 8.103 -1.393 -13.350 498 3HD1 LEU 64 3HD1 LEU 64 7.145 -1.404 -11.870 499 1HD2 LEU 64 1HD2 LEU 64 7.371 1.413 -14.223 500 2HD2 LEU 64 2HD2 LEU 64 5.887 1.050 -15.105 501 3HD2 LEU 64 3HD2 LEU 64 7.312 0.034 -15.321 502 H LYS 65 H LYS 65 2.215 -2.241 -13.654 503 HA LYS 65 HA LYS 65 0.807 -3.942 -14.132 504 1HB LYS 65 1HB LYS 65 0.654 -2.988 -16.432 505 2HB LYS 65 2HB LYS 65 1.992 -4.026 -16.910 506 1HG LYS 65 1HG LYS 65 0.581 -5.976 -16.140 507 2HG LYS 65 2HG LYS 65 -0.763 -4.841 -16.031 508 1HD LYS 65 1HD LYS 65 -0.379 -4.275 -18.432 509 2HD LYS 65 2HD LYS 65 0.819 -5.568 -18.493 510 1HE LYS 65 1HE LYS 65 -2.119 -5.852 -17.872 511 2HE LYS 65 2HE LYS 65 -1.297 -6.373 -19.341 512 1HZ LYS 65 1HZ LYS 65 -0.801 -7.454 -16.611 513 2HZ LYS 65 2HZ LYS 65 -0.044 -7.975 -18.036 514 3HZ LYS 65 3HZ LYS 65 -1.705 -8.217 -17.825 515 H ASN 66 H ASN 66 4.163 -4.332 -15.103 516 HA ASN 66 HA ASN 66 3.999 -7.121 -14.184 517 1HB ASN 66 1HB ASN 66 4.271 -7.038 -16.639 518 2HB ASN 66 2HB ASN 66 5.731 -6.078 -16.439 519 1HD2 ASN 66 1HD2 ASN 66 4.290 -9.211 -16.101 520 2HD2 ASN 66 2HD2 ASN 66 5.763 -10.097 -15.909 521 H ILE 67 H ILE 67 4.695 -6.623 -12.141 522 HA ILE 67 HA ILE 67 7.593 -6.216 -11.976 523 HB ILE 67 HB ILE 67 6.263 -4.073 -11.420 524 1HG1 ILE 67 1HG1 ILE 67 7.742 -3.564 -9.463 525 2HG1 ILE 67 2HG1 ILE 67 8.219 -5.260 -9.451 526 1HG2 ILE 67 1HG2 ILE 67 4.504 -5.137 -10.102 527 2HG2 ILE 67 2HG2 ILE 67 5.351 -3.895 -9.181 528 3HG2 ILE 67 3HG2 ILE 67 5.695 -5.599 -8.889 529 1HD1 ILE 67 1HD1 ILE 67 9.150 -5.046 -11.667 530 2HD1 ILE 67 2HD1 ILE 67 9.846 -3.828 -10.598 531 3HD1 ILE 67 3HD1 ILE 67 8.598 -3.375 -11.762 532 H VAL 68 H VAL 68 5.587 -8.400 -11.894 533 HA VAL 68 HA VAL 68 4.913 -9.263 -9.360 534 HB VAL 68 HB VAL 68 3.847 -10.220 -11.275 535 1HG1 VAL 68 1HG1 VAL 68 5.666 -10.121 -12.870 536 2HG1 VAL 68 2HG1 VAL 68 4.992 -11.752 -12.809 537 3HG1 VAL 68 3HG1 VAL 68 6.523 -11.398 -12.005 538 1HG2 VAL 68 1HG2 VAL 68 3.918 -11.628 -9.303 539 2HG2 VAL 68 2HG2 VAL 68 5.448 -12.324 -9.832 540 3HG2 VAL 68 3HG2 VAL 68 3.981 -12.613 -10.764 541 H SER 69 H SER 69 6.197 -9.585 -7.739 542 HA SER 69 HA SER 69 8.425 -11.473 -8.045 543 1HB SER 69 1HB SER 69 8.454 -9.026 -6.253 544 2HB SER 69 2HB SER 69 9.768 -10.182 -6.484 545 HG SER 69 HG SER 69 8.663 -8.550 -8.539 546 H VAL 70 H VAL 70 5.509 -11.319 -7.092 547 HA VAL 70 HA VAL 70 5.733 -11.885 -4.251 548 HB VAL 70 HB VAL 70 3.205 -11.938 -5.893 549 1HG1 VAL 70 1HG1 VAL 70 3.074 -12.896 -3.654 550 2HG1 VAL 70 2HG1 VAL 70 2.133 -11.410 -3.764 551 3HG1 VAL 70 3HG1 VAL 70 3.707 -11.399 -2.969 552 1HG2 VAL 70 1HG2 VAL 70 4.460 -9.541 -4.558 553 2HG2 VAL 70 2HG2 VAL 70 2.852 -9.591 -5.279 554 3HG2 VAL 70 3HG2 VAL 70 4.280 -9.790 -6.294 555 H LYS 71 H LYS 71 5.485 -13.844 -3.351 556 HA LYS 71 HA LYS 71 5.026 -16.115 -5.179 557 1HB LYS 71 1HB LYS 71 7.341 -15.817 -4.093 558 2HB LYS 71 2HB LYS 71 6.558 -16.249 -2.583 559 1HG LYS 71 1HG LYS 71 7.619 -18.187 -3.507 560 2HG LYS 71 2HG LYS 71 5.868 -18.392 -3.590 561 1HD LYS 71 1HD LYS 71 5.874 -17.808 -5.938 562 2HD LYS 71 2HD LYS 71 7.601 -17.457 -5.879 563 1HE LYS 71 1HE LYS 71 7.244 -19.631 -6.870 564 2HE LYS 71 2HE LYS 71 8.029 -19.816 -5.302 565 1HZ LYS 71 1HZ LYS 71 6.267 -21.428 -5.576 566 2HZ LYS 71 2HZ LYS 71 5.138 -20.200 -5.864 567 3HZ LYS 71 3HZ LYS 71 5.862 -20.344 -4.339 568 H PHE 72 H PHE 72 3.785 -17.910 -4.310 569 HA PHE 72 HA PHE 72 1.684 -17.098 -2.577 570 1HB PHE 72 1HB PHE 72 1.201 -18.745 -4.269 571 2HB PHE 72 2HB PHE 72 2.438 -19.827 -3.638 572 HD1 PHE 72 HD1 PHE 72 1.734 -21.594 -2.369 573 HD2 PHE 72 HD2 PHE 72 -0.622 -18.052 -2.438 574 HE1 PHE 72 HE1 PHE 72 0.063 -22.685 -0.936 575 HE2 PHE 72 HE2 PHE 72 -2.301 -19.138 -1.001 576 HZ PHE 72 HZ PHE 72 -1.958 -21.457 -0.248 577 H SER 73 H SER 73 2.688 -16.416 -0.705 578 HA SER 73 HA SER 73 3.494 -18.619 1.071 579 1HB SER 73 1HB SER 73 4.453 -15.745 1.234 580 2HB SER 73 2HB SER 73 4.964 -17.081 2.258 581 HG SER 73 HG SER 73 6.347 -16.428 0.390 582 H LYS 74 H LYS 74 2.816 -18.383 3.272 583 HA LYS 74 HA LYS 74 0.900 -16.226 3.808 584 1HB LYS 74 1HB LYS 74 0.558 -19.128 4.594 585 2HB LYS 74 2HB LYS 74 -0.469 -17.813 5.135 586 1HG LYS 74 1HG LYS 74 -1.235 -17.436 2.870 587 2HG LYS 74 2HG LYS 74 -0.144 -18.690 2.274 588 1HD LYS 74 1HD LYS 74 -2.407 -19.116 4.231 589 2HD LYS 74 2HD LYS 74 -2.447 -19.520 2.512 590 1HE LYS 74 1HE LYS 74 -0.691 -21.133 2.794 591 2HE LYS 74 2HE LYS 74 -0.455 -20.647 4.470 592 1HZ LYS 74 1HZ LYS 74 -2.577 -21.525 5.051 593 2HZ LYS 74 2HZ LYS 74 -1.738 -22.722 4.187 594 3HZ LYS 74 3HZ LYS 74 -2.965 -21.833 3.429 595 H ASP 75 H ASP 75 2.533 -15.122 4.931 596 HA ASP 75 HA ASP 75 3.167 -16.327 7.526 597 1HB ASP 75 1HB ASP 75 5.098 -16.523 5.852 598 2HB ASP 75 2HB ASP 75 5.240 -14.772 5.985 599 H ARG 76 H ARG 76 2.340 -15.069 9.003 600 HA ARG 76 HA ARG 76 1.713 -12.299 8.458 601 1HB ARG 76 1HB ARG 76 0.156 -13.763 9.684 602 2HB ARG 76 2HB ARG 76 1.349 -13.971 10.954 603 1HG ARG 76 1HG ARG 76 1.184 -11.661 11.562 604 2HG ARG 76 2HG ARG 76 0.119 -11.343 10.191 605 1HD ARG 76 1HD ARG 76 -1.603 -12.714 11.124 606 2HD ARG 76 2HD ARG 76 -0.530 -13.282 12.402 607 HE ARG 76 HE ARG 76 -0.539 -10.936 13.223 608 1HH1 ARG 76 1HH1 ARG 76 -3.172 -12.079 11.221 609 2HH1 ARG 76 2HH1 ARG 76 -4.336 -10.969 11.886 610 1HH2 ARG 76 1HH2 ARG 76 -2.057 -9.485 14.114 611 2HH2 ARG 76 2HH2 ARG 76 -3.705 -9.498 13.542 612 H HIS 77 H HIS 77 4.140 -14.138 10.071 613 HA HIS 77 HA HIS 77 5.064 -12.147 11.861 614 1HB HIS 77 1HB HIS 77 5.556 -14.523 12.197 615 2HB HIS 77 2HB HIS 77 6.518 -14.542 10.724 616 HD1 HIS 77 HD1 HIS 77 8.945 -14.062 10.988 617 HD2 HIS 77 HD2 HIS 77 6.711 -12.754 14.245 618 HE1 HIS 77 HE1 HIS 77 10.626 -13.236 12.680 619 HE2 HIS 77 HE2 HIS 77 9.235 -12.327 14.583 620 H LEU 78 H LEU 78 6.113 -13.163 8.625 621 HA LEU 78 HA LEU 78 8.342 -11.486 8.416 622 1HB LEU 78 1HB LEU 78 7.828 -13.335 6.859 623 2HB LEU 78 2HB LEU 78 6.501 -12.395 6.203 624 HG LEU 78 HG LEU 78 8.084 -10.711 5.380 625 1HD1 LEU 78 1HD1 LEU 78 9.807 -10.976 7.092 626 2HD1 LEU 78 2HD1 LEU 78 10.486 -11.126 5.471 627 3HD1 LEU 78 3HD1 LEU 78 10.208 -12.568 6.448 628 1HD2 LEU 78 1HD2 LEU 78 7.469 -12.541 3.911 629 2HD2 LEU 78 2HD2 LEU 78 8.766 -13.535 4.575 630 3HD2 LEU 78 3HD2 LEU 78 9.153 -12.086 3.648 631 H ILE 79 H ILE 79 4.946 -10.905 7.617 632 HA ILE 79 HA ILE 79 5.232 -8.337 6.539 633 HB ILE 79 HB ILE 79 2.892 -9.355 8.163 634 1HG1 ILE 79 1HG1 ILE 79 3.377 -9.501 5.178 635 2HG1 ILE 79 2HG1 ILE 79 3.518 -10.863 6.284 636 1HG2 ILE 79 1HG2 ILE 79 3.080 -7.189 6.072 637 2HG2 ILE 79 2HG2 ILE 79 2.868 -6.943 7.806 638 3HG2 ILE 79 3HG2 ILE 79 1.599 -7.728 6.864 639 1HD1 ILE 79 1HD1 ILE 79 1.153 -10.692 6.812 640 2HD1 ILE 79 2HD1 ILE 79 1.407 -10.894 5.078 641 3HD1 ILE 79 3HD1 ILE 79 1.004 -9.306 5.732 642 H GLU 80 H GLU 80 4.548 -9.354 9.881 643 HA GLU 80 HA GLU 80 4.581 -6.892 11.154 644 1HB GLU 80 1HB GLU 80 4.010 -8.943 12.329 645 2HB GLU 80 2HB GLU 80 5.644 -9.556 12.117 646 1HG GLU 80 1HG GLU 80 6.385 -7.497 13.452 647 2HG GLU 80 2HG GLU 80 4.688 -7.345 13.903 648 H THR 81 H THR 81 7.283 -9.047 10.409 649 HA THR 81 HA THR 81 9.290 -7.480 11.624 650 HB THR 81 HB THR 81 9.656 -9.424 9.340 651 HG1 THR 81 HG1 THR 81 8.481 -10.044 11.477 652 1HG2 THR 81 1HG2 THR 81 11.641 -8.090 9.889 653 2HG2 THR 81 2HG2 THR 81 11.865 -9.782 10.336 654 3HG2 THR 81 3HG2 THR 81 11.505 -8.582 11.578 655 H THR 82 H THR 82 7.818 -7.410 8.448 656 HA THR 82 HA THR 82 9.794 -5.738 7.241 657 HB THR 82 HB THR 82 6.917 -6.153 6.393 658 HG1 THR 82 HG1 THR 82 8.004 -8.141 6.463 659 1HG2 THR 82 1HG2 THR 82 9.351 -5.221 4.860 660 2HG2 THR 82 2HG2 THR 82 7.956 -4.235 5.302 661 3HG2 THR 82 3HG2 THR 82 7.772 -5.562 4.154 662 H SER 83 H SER 83 6.576 -5.142 8.665 663 HA SER 83 HA SER 83 6.507 -2.372 8.301 664 1HB SER 83 1HB SER 83 5.350 -3.918 10.638 665 2HB SER 83 2HB SER 83 4.813 -2.347 10.043 666 HG SER 83 HG SER 83 3.486 -3.513 8.889 667 H ASN 84 H ASN 84 7.832 -4.306 10.959 668 HA ASN 84 HA ASN 84 8.763 -2.154 12.529 669 1HB ASN 84 1HB ASN 84 9.692 -5.024 12.309 670 2HB ASN 84 2HB ASN 84 10.324 -3.890 13.491 671 1HD2 ASN 84 1HD2 ASN 84 8.892 -6.390 13.890 672 2HD2 ASN 84 2HD2 ASN 84 7.502 -5.999 14.836 673 H LYS 85 H LYS 85 10.237 -4.072 9.968 674 HA LYS 85 HA LYS 85 12.858 -3.125 10.144 675 1HB LYS 85 1HB LYS 85 11.905 -5.084 8.805 676 2HB LYS 85 2HB LYS 85 11.499 -3.904 7.571 677 1HG LYS 85 1HG LYS 85 13.850 -3.309 7.353 678 2HG LYS 85 2HG LYS 85 14.265 -4.469 8.619 679 1HD LYS 85 1HD LYS 85 13.024 -5.101 5.939 680 2HD LYS 85 2HD LYS 85 14.685 -5.435 6.432 681 1HE LYS 85 1HE LYS 85 13.817 -6.920 8.211 682 2HE LYS 85 2HE LYS 85 12.180 -6.631 7.616 683 1HZ LYS 85 1HZ LYS 85 13.068 -8.700 6.751 684 2HZ LYS 85 2HZ LYS 85 14.394 -7.884 6.086 685 3HZ LYS 85 3HZ LYS 85 12.832 -7.593 5.484 686 H LEU 86 H LEU 86 10.067 -1.850 8.393 687 HA LEU 86 HA LEU 86 11.437 0.225 7.034 688 1HB LEU 86 1HB LEU 86 9.232 -0.499 6.338 689 2HB LEU 86 2HB LEU 86 8.553 -0.033 7.885 690 HG LEU 86 HG LEU 86 9.145 2.346 7.344 691 1HD1 LEU 86 1HD1 LEU 86 9.592 2.908 5.004 692 2HD1 LEU 86 2HD1 LEU 86 9.713 1.191 4.621 693 3HD1 LEU 86 3HD1 LEU 86 10.886 1.937 5.708 694 1HD2 LEU 86 1HD2 LEU 86 7.279 2.666 5.783 695 2HD2 LEU 86 2HD2 LEU 86 6.880 1.519 7.062 696 3HD2 LEU 86 3HD2 LEU 86 7.274 0.932 5.447 697 H LYS 87 H LYS 87 9.577 0.166 10.045 698 HA LYS 87 HA LYS 87 9.819 2.930 10.570 699 1HB LYS 87 1HB LYS 87 8.031 1.496 11.465 700 2HB LYS 87 2HB LYS 87 9.209 0.647 12.452 701 1HG LYS 87 1HG LYS 87 9.613 2.614 13.763 702 2HG LYS 87 2HG LYS 87 8.598 3.584 12.693 703 1HD LYS 87 1HD LYS 87 6.636 2.353 13.345 704 2HD LYS 87 2HD LYS 87 7.610 1.218 14.281 705 1HE LYS 87 1HE LYS 87 7.401 4.168 14.859 706 2HE LYS 87 2HE LYS 87 6.442 2.926 15.664 707 1HZ LYS 87 1HZ LYS 87 8.492 1.917 16.458 708 2HZ LYS 87 2HZ LYS 87 8.369 3.525 16.975 709 3HZ LYS 87 3HZ LYS 87 9.405 3.127 15.703 710 H SER 88 H SER 88 11.784 0.157 11.451 711 HA SER 88 HA SER 88 13.383 1.782 13.267 712 1HB SER 88 1HB SER 88 13.634 -1.151 12.580 713 2HB SER 88 2HB SER 88 14.451 -0.312 13.900 714 HG SER 88 HG SER 88 11.928 0.226 14.237 715 H ARG 89 H ARG 89 14.018 -0.327 10.438 716 HA ARG 89 HA ARG 89 16.785 0.531 10.404 717 1HB ARG 89 1HB ARG 89 16.056 -1.838 10.026 718 2HB ARG 89 2HB ARG 89 15.363 -1.328 8.501 719 1HG ARG 89 1HG ARG 89 17.458 -0.881 7.561 720 2HG ARG 89 2HG ARG 89 18.260 -0.884 9.133 721 1HD ARG 89 1HD ARG 89 16.941 -3.311 7.929 722 2HD ARG 89 2HD ARG 89 18.651 -2.928 7.719 723 HE ARG 89 HE ARG 89 18.731 -2.994 10.248 724 1HH1 ARG 89 1HH1 ARG 89 16.456 -4.915 8.403 725 2HH1 ARG 89 2HH1 ARG 89 16.306 -6.139 9.626 726 1HH2 ARG 89 1HH2 ARG 89 18.572 -4.611 11.826 727 2HH2 ARG 89 2HH2 ARG 89 17.514 -5.969 11.567 728 H GLU 90 H GLU 90 13.901 1.481 8.879 729 HA GLU 90 HA GLU 90 13.382 2.867 7.166 730 1HB GLU 90 1HB GLU 90 14.991 4.400 8.257 731 2HB GLU 90 2HB GLU 90 16.288 3.707 7.296 732 1HG GLU 90 1HG GLU 90 14.912 4.412 5.260 733 2HG GLU 90 2HG GLU 90 13.988 5.397 6.392 734 H ILE 91 H ILE 91 13.456 0.482 6.245 735 HA ILE 91 HA ILE 91 15.231 0.230 3.992 736 HB ILE 91 HB ILE 91 13.766 -1.639 3.294 737 1HG1 ILE 91 1HG1 ILE 91 12.222 -1.004 5.820 738 2HG1 ILE 91 2HG1 ILE 91 11.639 -0.726 4.184 739 1HG2 ILE 91 1HG2 ILE 91 14.320 -3.119 5.162 740 2HG2 ILE 91 2HG2 ILE 91 14.626 -1.713 6.182 741 3HG2 ILE 91 3HG2 ILE 91 15.651 -2.026 4.782 742 1HD1 ILE 91 1HD1 ILE 91 12.310 -3.408 5.372 743 2HD1 ILE 91 2HD1 ILE 91 11.690 -3.118 3.746 744 3HD1 ILE 91 3HD1 ILE 91 10.689 -2.746 5.152 745 H THR 92 H THR 92 14.731 0.565 1.810 746 HA THR 92 HA THR 92 13.078 2.768 1.242 747 HB THR 92 HB THR 92 13.976 0.783 -0.841 748 HG1 THR 92 HG1 THR 92 15.950 2.183 -0.815 749 1HG2 THR 92 1HG2 THR 92 13.709 3.790 -0.824 750 2HG2 THR 92 2HG2 THR 92 12.602 2.657 -1.597 751 3HG2 THR 92 3HG2 THR 92 14.256 2.817 -2.188 752 H PHE 93 H PHE 93 11.124 2.904 0.070 753 HA PHE 93 HA PHE 93 9.101 1.168 0.835 754 1HB PHE 93 1HB PHE 93 8.851 3.545 0.041 755 2HB PHE 93 2HB PHE 93 9.035 2.950 -1.604 756 HD1 PHE 93 HD1 PHE 93 7.160 2.330 -2.803 757 HD2 PHE 93 HD2 PHE 93 6.955 2.460 1.444 758 HE1 PHE 93 HE1 PHE 93 4.739 1.900 -2.909 759 HE2 PHE 93 HE2 PHE 93 4.536 2.025 1.347 760 HZ PHE 93 HZ PHE 93 3.425 1.747 -0.833 761 H GLN 94 H GLN 94 11.068 1.164 -2.075 762 HA GLN 94 HA GLN 94 9.733 -0.787 -3.559 763 1HB GLN 94 1HB GLN 94 11.564 0.553 -4.456 764 2HB GLN 94 2HB GLN 94 12.693 -0.202 -3.344 765 1HG GLN 94 1HG GLN 94 12.391 -2.338 -4.456 766 2HG GLN 94 2HG GLN 94 11.211 -1.612 -5.551 767 1HE2 GLN 94 1HE2 GLN 94 12.458 -2.129 -7.364 768 2HE2 GLN 94 2HE2 GLN 94 13.898 -1.246 -7.753 769 H GLU 95 H GLU 95 12.342 -1.149 -1.186 770 HA GLU 95 HA GLU 95 12.477 -3.970 -1.271 771 1HB GLU 95 1HB GLU 95 13.233 -2.153 1.024 772 2HB GLU 95 2HB GLU 95 13.837 -3.776 0.719 773 1HG GLU 95 1HG GLU 95 14.275 -1.450 -1.135 774 2HG GLU 95 2HG GLU 95 15.409 -1.941 0.123 775 H TYR 96 H TYR 96 10.622 -1.693 0.622 776 HA TYR 96 HA TYR 96 9.631 -3.382 2.611 777 1HB TYR 96 1HB TYR 96 9.429 -0.871 2.489 778 2HB TYR 96 2HB TYR 96 8.144 -1.093 1.309 779 HD1 TYR 96 HD1 TYR 96 5.929 -1.514 2.009 780 HD2 TYR 96 HD2 TYR 96 9.111 -1.784 4.812 781 HE1 TYR 96 HE1 TYR 96 4.296 -1.647 3.843 782 HE2 TYR 96 HE2 TYR 96 7.489 -1.928 6.651 783 HH TYR 96 HH TYR 96 4.237 -2.543 6.210 784 H ARG 97 H ARG 97 8.248 -2.562 -0.563 785 HA ARG 97 HA ARG 97 6.037 -4.342 -0.344 786 1HB ARG 97 1HB ARG 97 7.343 -3.153 -2.799 787 2HB ARG 97 2HB ARG 97 5.791 -3.976 -2.776 788 1HG ARG 97 1HG ARG 97 4.825 -2.247 -1.432 789 2HG ARG 97 2HG ARG 97 6.396 -1.472 -1.217 790 1HD ARG 97 1HD ARG 97 4.955 -1.823 -3.843 791 2HD ARG 97 2HD ARG 97 5.032 -0.330 -2.906 792 HE ARG 97 HE ARG 97 7.604 -0.773 -3.227 793 1HH1 ARG 97 1HH1 ARG 97 5.028 -1.147 -5.549 794 2HH1 ARG 97 2HH1 ARG 97 6.022 -0.806 -6.933 795 1HH2 ARG 97 1HH2 ARG 97 8.945 -0.316 -5.042 796 2HH2 ARG 97 2HH2 ARG 97 8.264 -0.330 -6.633 797 H ARG 98 H ARG 98 9.328 -4.642 -1.402 798 HA ARG 98 HA ARG 98 9.122 -7.033 -2.882 799 1HB ARG 98 1HB ARG 98 11.094 -5.233 -2.396 800 2HB ARG 98 2HB ARG 98 11.608 -6.551 -1.356 801 1HG ARG 98 1HG ARG 98 10.998 -6.878 -4.281 802 2HG ARG 98 2HG ARG 98 12.606 -6.534 -3.645 803 1HD ARG 98 1HD ARG 98 12.482 -8.602 -2.303 804 2HD ARG 98 2HD ARG 98 10.912 -8.952 -3.029 805 HE ARG 98 HE ARG 98 12.816 -8.533 -5.068 806 1HH1 ARG 98 1HH1 ARG 98 12.029 -10.861 -2.575 807 2HH1 ARG 98 2HH1 ARG 98 12.647 -12.215 -3.459 808 1HH2 ARG 98 1HH2 ARG 98 13.626 -10.320 -6.246 809 2HH2 ARG 98 2HH2 ARG 98 13.569 -11.914 -5.534 810 H ASN 99 H ASN 99 9.737 -6.378 0.542 811 HA ASN 99 HA ASN 99 10.102 -9.111 1.271 812 1HB ASN 99 1HB ASN 99 9.526 -6.618 2.854 813 2HB ASN 99 2HB ASN 99 9.555 -8.196 3.625 814 1HD2 ASN 99 1HD2 ASN 99 11.656 -7.366 0.958 815 2HD2 ASN 99 2HD2 ASN 99 13.124 -7.343 1.874 816 H LEU 100 H LEU 100 7.333 -6.935 1.195 817 HA LEU 100 HA LEU 100 5.474 -8.697 2.389 818 1HB LEU 100 1HB LEU 100 5.065 -6.456 0.409 819 2HB LEU 100 2HB LEU 100 3.765 -7.283 1.246 820 HG LEU 100 HG LEU 100 5.954 -5.716 2.610 821 1HD1 LEU 100 1HD1 LEU 100 4.513 -4.262 1.297 822 2HD1 LEU 100 2HD1 LEU 100 4.226 -4.045 3.023 823 3HD1 LEU 100 3HD1 LEU 100 3.087 -4.978 2.051 824 1HD2 LEU 100 1HD2 LEU 100 4.525 -5.924 4.586 825 2HD2 LEU 100 2HD2 LEU 100 5.033 -7.505 3.989 826 3HD2 LEU 100 3HD2 LEU 100 3.398 -6.923 3.666 827 H ALA 101 H ALA 101 6.525 -8.208 -0.933 828 HA ALA 101 HA ALA 101 4.737 -9.933 -2.223 829 1HB ALA 101 1HB ALA 101 6.412 -10.038 -4.008 830 2HB ALA 101 2HB ALA 101 7.605 -9.311 -2.932 831 3HB ALA 101 3HB ALA 101 6.186 -8.387 -3.429 832 H LYS 102 H LYS 102 7.754 -10.541 -0.525 833 HA LYS 102 HA LYS 102 7.967 -13.291 -1.216 834 1HB LYS 102 1HB LYS 102 9.800 -11.767 -0.322 835 2HB LYS 102 2HB LYS 102 9.069 -11.965 1.265 836 1HG LYS 102 1HG LYS 102 9.437 -14.376 1.134 837 2HG LYS 102 2HG LYS 102 10.175 -14.172 -0.458 838 1HD LYS 102 1HD LYS 102 11.854 -12.656 0.608 839 2HD LYS 102 2HD LYS 102 11.175 -13.102 2.176 840 1HE LYS 102 1HE LYS 102 13.124 -14.452 1.730 841 2HE LYS 102 2HE LYS 102 11.681 -15.466 1.686 842 1HZ LYS 102 1HZ LYS 102 13.206 -14.423 -0.640 843 2HZ LYS 102 2HZ LYS 102 11.717 -15.214 -0.771 844 3HZ LYS 102 3HZ LYS 102 13.060 -16.043 -0.154 845 H ALA 103 H ALA 103 6.237 -11.508 1.224 846 HA ALA 103 HA ALA 103 5.657 -13.810 2.856 847 1HB ALA 103 1HB ALA 103 4.311 -12.296 4.192 848 2HB ALA 103 2HB ALA 103 4.466 -11.042 2.962 849 3HB ALA 103 3HB ALA 103 5.888 -11.581 3.854 850 H GLY 104 H GLY 104 4.383 -12.525 -0.002 851 1HA GLY 104 1HA GLY 104 2.790 -13.743 -1.271 852 2HA GLY 104 2HA GLY 104 2.121 -14.377 0.225 853 H VAL 105 H VAL 105 2.773 -10.998 0.070 854 HA VAL 105 HA VAL 105 -0.062 -10.452 0.316 855 HB VAL 105 HB VAL 105 2.287 -8.556 0.442 856 1HG1 VAL 105 1HG1 VAL 105 -0.601 -8.127 1.200 857 2HG1 VAL 105 2HG1 VAL 105 0.230 -7.412 -0.182 858 3HG1 VAL 105 3HG1 VAL 105 0.714 -6.981 1.455 859 1HG2 VAL 105 1HG2 VAL 105 1.928 -8.613 2.867 860 2HG2 VAL 105 2HG2 VAL 105 2.348 -10.202 2.229 861 3HG2 VAL 105 3HG2 VAL 105 0.675 -9.836 2.645 862 H PHE 106 H PHE 106 -1.307 -9.985 -1.335 863 HA PHE 106 HA PHE 106 -0.106 -8.845 -3.771 864 1HB PHE 106 1HB PHE 106 -2.550 -10.560 -3.355 865 2HB PHE 106 2HB PHE 106 -2.285 -9.663 -4.845 866 HD1 PHE 106 HD1 PHE 106 -1.016 -12.392 -2.719 867 HD2 PHE 106 HD2 PHE 106 -0.733 -10.408 -6.474 868 HE1 PHE 106 HE1 PHE 106 0.324 -14.257 -3.600 869 HE2 PHE 106 HE2 PHE 106 0.613 -12.269 -7.361 870 HZ PHE 106 HZ PHE 106 1.141 -14.198 -5.919 871 H ARG 107 H ARG 107 -2.433 -8.371 -1.256 872 HA ARG 107 HA ARG 107 -3.493 -6.007 -2.652 873 1HB ARG 107 1HB ARG 107 -4.720 -7.911 -0.730 874 2HB ARG 107 2HB ARG 107 -5.201 -6.229 -0.615 875 1HG ARG 107 1HG ARG 107 -6.792 -7.300 -1.969 876 2HG ARG 107 2HG ARG 107 -5.783 -6.335 -3.046 877 1HD ARG 107 1HD ARG 107 -4.674 -8.216 -3.883 878 2HD ARG 107 2HD ARG 107 -5.221 -9.239 -2.551 879 HE ARG 107 HE ARG 107 -7.549 -8.655 -3.622 880 1HH1 ARG 107 1HH1 ARG 107 -4.570 -9.429 -5.293 881 2HH1 ARG 107 2HH1 ARG 107 -5.375 -10.163 -6.647 882 1HH2 ARG 107 1HH2 ARG 107 -8.606 -9.647 -5.386 883 2HH2 ARG 107 2HH2 ARG 107 -7.652 -10.280 -6.697 884 H TRP 108 H TRP 108 -2.360 -4.292 -2.062 885 HA TRP 108 HA TRP 108 -1.798 -3.813 0.771 886 1HB TRP 108 1HB TRP 108 0.007 -3.301 -0.764 887 2HB TRP 108 2HB TRP 108 -1.055 -2.334 -1.769 888 HD1 TRP 108 HD1 TRP 108 -2.023 -0.006 -0.400 889 HE1 TRP 108 HE1 TRP 108 -0.630 1.621 1.018 890 HE3 TRP 108 HE3 TRP 108 1.944 -3.052 0.651 891 HZ2 TRP 108 HZ2 TRP 108 1.830 1.616 2.396 892 HZ3 TRP 108 HZ3 TRP 108 3.778 -2.155 2.016 893 HH2 TRP 108 HH2 TRP 108 3.723 0.130 2.869 894 H VAL 109 H VAL 109 -3.868 -3.490 1.575 895 HA VAL 109 HA VAL 109 -5.465 -1.383 0.278 896 HB VAL 109 HB VAL 109 -6.406 -3.475 2.246 897 1HG1 VAL 109 1HG1 VAL 109 -8.653 -2.743 1.575 898 2HG1 VAL 109 2HG1 VAL 109 -7.933 -1.484 0.571 899 3HG1 VAL 109 3HG1 VAL 109 -7.730 -1.440 2.322 900 1HG2 VAL 109 1HG2 VAL 109 -5.749 -4.503 0.137 901 2HG2 VAL 109 2HG2 VAL 109 -6.743 -3.350 -0.750 902 3HG2 VAL 109 3HG2 VAL 109 -7.502 -4.527 0.320 903 H THR 110 H THR 110 -4.764 0.472 1.188 904 HA THR 110 HA THR 110 -4.556 0.598 4.109 905 HB THR 110 HB THR 110 -3.880 2.739 2.082 906 HG1 THR 110 HG1 THR 110 -2.585 0.551 2.501 907 1HG2 THR 110 1HG2 THR 110 -3.248 2.536 5.032 908 2HG2 THR 110 2HG2 THR 110 -4.416 3.636 4.299 909 3HG2 THR 110 3HG2 THR 110 -2.700 3.811 3.943 910 H ASN 111 H ASN 111 -6.372 0.966 5.117 911 HA ASN 111 HA ASN 111 -8.414 2.644 3.841 912 1HB ASN 111 1HB ASN 111 -9.033 0.324 4.547 913 2HB ASN 111 2HB ASN 111 -8.699 0.780 6.212 914 1HD2 ASN 111 1HD2 ASN 111 -11.149 0.002 4.545 915 2HD2 ASN 111 2HD2 ASN 111 -12.335 1.173 5.015 916 H ILE 112 H ILE 112 -8.383 4.680 4.430 917 HA ILE 112 HA ILE 112 -6.904 5.567 6.728 918 HB ILE 112 HB ILE 112 -8.611 7.165 4.808 919 1HG1 ILE 112 1HG1 ILE 112 -6.813 5.982 3.632 920 2HG1 ILE 112 2HG1 ILE 112 -6.481 7.709 3.683 921 1HG2 ILE 112 1HG2 ILE 112 -7.285 9.085 5.578 922 2HG2 ILE 112 2HG2 ILE 112 -6.475 8.043 6.749 923 3HG2 ILE 112 3HG2 ILE 112 -8.206 8.349 6.889 924 1HD1 ILE 112 1HD1 ILE 112 -4.481 6.380 4.089 925 2HD1 ILE 112 2HD1 ILE 112 -5.256 5.639 5.490 926 3HD1 ILE 112 3HD1 ILE 112 -4.899 7.368 5.488 927 H HIS 113 H HIS 113 -10.265 5.195 5.835 928 HA HIS 113 HA HIS 113 -11.426 6.642 7.948 929 1HB HIS 113 1HB HIS 113 -12.668 5.821 5.948 930 2HB HIS 113 2HB HIS 113 -12.539 4.181 6.579 931 HD1 HIS 113 HD1 HIS 113 -14.055 3.552 8.591 932 HD2 HIS 113 HD2 HIS 113 -14.546 7.461 7.235 933 HE1 HIS 113 HE1 HIS 113 -16.168 4.390 9.668 934 HE2 HIS 113 HE2 HIS 113 -16.333 6.810 8.998 935 H GLU 114 H GLU 114 -10.481 3.252 7.656 936 HA GLU 114 HA GLU 114 -11.287 2.674 10.382 937 1HB GLU 114 1HB GLU 114 -9.808 0.915 8.415 938 2HB GLU 114 2HB GLU 114 -10.583 0.399 9.905 939 1HG GLU 114 1HG GLU 114 -12.006 1.550 7.518 940 2HG GLU 114 2HG GLU 114 -11.887 -0.161 7.912 941 H GLN 115 H GLN 115 -8.587 3.970 8.879 942 HA GLN 115 HA GLN 115 -6.415 4.327 9.439 943 1HB GLN 115 1HB GLN 115 -7.511 3.772 12.206 944 2HB GLN 115 2HB GLN 115 -5.887 4.372 11.899 945 1HG GLN 115 1HG GLN 115 -8.382 5.789 11.009 946 2HG GLN 115 2HG GLN 115 -7.566 6.107 12.539 947 1HE2 GLN 115 1HE2 GLN 115 -8.044 7.812 10.173 948 2HE2 GLN 115 2HE2 GLN 115 -6.486 8.388 9.704 949 H LYS 116 H LYS 116 -6.836 1.883 8.370 950 HA LYS 116 HA LYS 116 -4.957 0.171 9.827 951 1HB LYS 116 1HB LYS 116 -7.667 -0.707 8.819 952 2HB LYS 116 2HB LYS 116 -6.404 -1.815 9.337 953 1HG LYS 116 1HG LYS 116 -6.537 -1.068 11.573 954 2HG LYS 116 2HG LYS 116 -7.537 0.315 11.124 955 1HD LYS 116 1HD LYS 116 -9.343 -1.194 10.478 956 2HD LYS 116 2HD LYS 116 -8.343 -2.584 10.905 957 1HE LYS 116 1HE LYS 116 -8.324 -1.957 13.204 958 2HE LYS 116 2HE LYS 116 -9.087 -0.410 12.846 959 1HZ LYS 116 1HZ LYS 116 -11.105 -1.480 12.303 960 2HZ LYS 116 2HZ LYS 116 -10.595 -2.143 13.778 961 3HZ LYS 116 3HZ LYS 116 -10.398 -3.022 12.341 962 H ARG 117 H ARG 117 -3.579 -0.940 8.554 963 HA ARG 117 HA ARG 117 -3.999 -0.775 5.648 964 1HB ARG 117 1HB ARG 117 -1.455 -1.295 7.210 965 2HB ARG 117 2HB ARG 117 -1.575 -1.284 5.454 966 1HG ARG 117 1HG ARG 117 -2.428 1.098 5.677 967 2HG ARG 117 2HG ARG 117 -1.897 1.019 7.358 968 1HD ARG 117 1HD ARG 117 -0.154 0.596 4.933 969 2HD ARG 117 2HD ARG 117 -0.219 2.063 5.906 970 HE ARG 117 HE ARG 117 0.405 0.075 7.686 971 1HH1 ARG 117 1HH1 ARG 117 1.824 1.330 4.744 972 2HH1 ARG 117 2HH1 ARG 117 3.427 0.836 5.161 973 1HH2 ARG 117 1HH2 ARG 117 2.508 -0.539 8.254 974 2HH2 ARG 117 2HH2 ARG 117 3.819 -0.257 7.141 975 H TYR 118 H TYR 118 -4.927 -2.503 4.846 976 HA TYR 118 HA TYR 118 -4.696 -5.072 6.210 977 1HB TYR 118 1HB TYR 118 -6.396 -4.285 3.839 978 2HB TYR 118 2HB TYR 118 -6.520 -5.781 4.752 979 HD1 TYR 118 HD1 TYR 118 -7.265 -2.205 4.713 980 HD2 TYR 118 HD2 TYR 118 -7.587 -5.812 6.943 981 HE1 TYR 118 HE1 TYR 118 -8.959 -1.156 6.151 982 HE2 TYR 118 HE2 TYR 118 -9.279 -4.770 8.393 983 HH TYR 118 HH TYR 118 -10.803 -1.829 7.606 984 H TYR 119 H TYR 119 -3.431 -6.659 5.507 985 HA TYR 119 HA TYR 119 -2.362 -6.511 2.765 986 1HB TYR 119 1HB TYR 119 -1.259 -8.015 5.151 987 2HB TYR 119 2HB TYR 119 -0.514 -7.913 3.561 988 HD1 TYR 119 HD1 TYR 119 -1.110 -6.207 6.721 989 HD2 TYR 119 HD2 TYR 119 0.560 -5.823 2.830 990 HE1 TYR 119 HE1 TYR 119 0.134 -4.222 7.456 991 HE2 TYR 119 HE2 TYR 119 1.808 -3.834 3.554 992 HH TYR 119 HH TYR 119 1.934 -2.873 6.918 993 H TYR 120 H TYR 120 -3.670 -7.707 1.498 994 HA TYR 120 HA TYR 120 -4.514 -10.360 2.466 995 1HB TYR 120 1HB TYR 120 -5.548 -8.834 0.066 996 2HB TYR 120 2HB TYR 120 -6.170 -10.357 0.679 997 HD1 TYR 120 HD1 TYR 120 -6.146 -6.748 1.057 998 HD2 TYR 120 HD2 TYR 120 -7.502 -10.407 2.753 999 HE1 TYR 120 HE1 TYR 120 -7.795 -5.510 2.390 1000 HE2 TYR 120 HE2 TYR 120 -9.153 -9.176 4.101 1001 HH TYR 120 HH TYR 120 -9.871 -5.863 3.535 1002 H THR 121 H THR 121 -4.102 -12.193 1.229 1003 HA THR 121 HA THR 121 -2.092 -11.954 -0.859 1004 HB THR 121 HB THR 121 -1.903 -13.789 0.777 1005 HG1 THR 121 HG1 THR 121 -0.932 -14.462 -1.004 1006 1HG2 THR 121 1HG2 THR 121 -4.261 -14.200 1.213 1007 2HG2 THR 121 2HG2 THR 121 -3.467 -15.686 0.693 1008 3HG2 THR 121 3HG2 THR 121 -4.482 -14.789 -0.433 1009 H PHE 122 H PHE 122 -2.750 -13.727 -2.803 1010 HA PHE 122 HA PHE 122 -4.741 -12.281 -4.237 1011 1HB PHE 122 1HB PHE 122 -4.319 -13.761 -6.079 1012 2HB PHE 122 2HB PHE 122 -2.779 -13.410 -5.306 1013 HD1 PHE 122 HD1 PHE 122 -1.730 -15.146 -3.840 1014 HD2 PHE 122 HD2 PHE 122 -5.127 -15.959 -6.272 1015 HE1 PHE 122 HE1 PHE 122 -1.280 -17.554 -3.657 1016 HE2 PHE 122 HE2 PHE 122 -4.681 -18.373 -6.089 1017 HZ PHE 122 HZ PHE 122 -2.755 -19.172 -4.780 1018 H ASP 123 H ASP 123 -4.838 -14.997 -2.178 1019 HA ASP 123 HA ASP 123 -7.325 -16.115 -3.011 1020 1HB ASP 123 1HB ASP 123 -5.635 -17.313 -1.629 1021 2HB ASP 123 2HB ASP 123 -5.965 -16.207 -0.303 1022 H ASN 124 H ASN 124 -6.431 -13.278 -1.423 1023 HA ASN 124 HA ASN 124 -7.536 -11.565 -0.462 1024 1HB ASN 124 1HB ASN 124 -9.969 -13.194 -1.161 1025 2HB ASN 124 2HB ASN 124 -10.085 -11.697 -0.241 1026 1HD2 ASN 124 1HD2 ASN 124 -11.114 -12.343 -2.894 1027 2HD2 ASN 124 2HD2 ASN 124 -10.424 -11.168 -3.965 1028 H SER 125 H SER 125 -6.796 -14.284 0.813 1029 HA SER 125 HA SER 125 -8.121 -14.231 3.330 1030 1HB SER 125 1HB SER 125 -5.369 -15.283 2.614 1031 2HB SER 125 2HB SER 125 -6.242 -15.625 4.105 1032 HG SER 125 HG SER 125 -7.645 -16.190 1.787 1033 H LEU 126 H LEU 126 -7.753 -12.918 5.044 1034 HA LEU 126 HA LEU 126 -5.934 -10.713 4.759 1035 1HB LEU 126 1HB LEU 126 -8.124 -10.455 5.852 1036 2HB LEU 126 2HB LEU 126 -7.622 -11.559 7.119 1037 HG LEU 126 HG LEU 126 -5.881 -9.962 7.819 1038 1HD1 LEU 126 1HD1 LEU 126 -7.066 -8.206 5.675 1039 2HD1 LEU 126 2HD1 LEU 126 -5.438 -8.877 5.704 1040 3HD1 LEU 126 3HD1 LEU 126 -5.915 -7.675 6.901 1041 1HD2 LEU 126 1HD2 LEU 126 -7.362 -8.316 8.806 1042 2HD2 LEU 126 2HD2 LEU 126 -8.119 -9.909 8.836 1043 3HD2 LEU 126 3HD2 LEU 126 -8.620 -8.717 7.638 1044 H LEU 127 H LEU 127 -3.837 -11.129 4.943 1045 HA LEU 127 HA LEU 127 -2.859 -13.170 6.734 1046 1HB LEU 127 1HB LEU 127 -1.430 -11.214 4.935 1047 2HB LEU 127 2HB LEU 127 -0.615 -12.422 5.909 1048 HG LEU 127 HG LEU 127 -2.573 -12.990 3.683 1049 1HD1 LEU 127 1HD1 LEU 127 -0.432 -12.148 2.872 1050 2HD1 LEU 127 2HD1 LEU 127 -0.626 -13.859 2.495 1051 3HD1 LEU 127 3HD1 LEU 127 0.417 -13.362 3.829 1052 1HD2 LEU 127 1HD2 LEU 127 -1.939 -15.328 4.010 1053 2HD2 LEU 127 2HD2 LEU 127 -2.679 -14.661 5.466 1054 3HD2 LEU 127 3HD2 LEU 127 -0.929 -14.871 5.381 1055 H PHE 128 H PHE 128 -2.721 -9.638 6.498 1056 HA PHE 128 HA PHE 128 -2.329 -9.487 9.367 1057 1HB PHE 128 1HB PHE 128 -0.040 -9.642 8.257 1058 2HB PHE 128 2HB PHE 128 -0.389 -8.074 7.540 1059 HD1 PHE 128 HD1 PHE 128 -0.297 -9.770 10.842 1060 HD2 PHE 128 HD2 PHE 128 0.279 -6.161 8.665 1061 HE1 PHE 128 HE1 PHE 128 0.580 -8.705 12.865 1062 HE2 PHE 128 HE2 PHE 128 1.156 -5.079 10.695 1063 HZ PHE 128 HZ PHE 128 1.308 -6.350 12.801 1064 H THR 129 H THR 129 -3.114 -7.615 10.236 1065 HA THR 129 HA THR 129 -3.726 -5.398 8.438 1066 HB THR 129 HB THR 129 -5.849 -6.517 8.589 1067 HG1 THR 129 HG1 THR 129 -6.734 -4.633 8.863 1068 1HG2 THR 129 1HG2 THR 129 -5.540 -6.418 11.591 1069 2HG2 THR 129 2HG2 THR 129 -5.455 -7.864 10.588 1070 3HG2 THR 129 3HG2 THR 129 -6.969 -6.971 10.717 1071 H GLU 130 H GLU 130 -2.569 -3.774 9.205 1072 HA GLU 130 HA GLU 130 -2.152 -3.601 12.105 1073 1HB GLU 130 1HB GLU 130 -0.212 -2.123 11.494 1074 2HB GLU 130 2HB GLU 130 -0.063 -3.798 10.977 1075 1HG GLU 130 1HG GLU 130 -0.590 -3.226 8.728 1076 2HG GLU 130 2HG GLU 130 -1.016 -1.579 9.189 1077 H SER 131 H SER 131 -3.034 -1.994 13.196 1078 HA SER 131 HA SER 131 -4.434 0.127 11.838 1079 1HB SER 131 1HB SER 131 -3.909 -0.203 14.805 1080 2HB SER 131 2HB SER 131 -5.137 0.819 14.055 1081 HG SER 131 HG SER 131 -5.458 -1.636 13.122 1082 H ILE 132 H ILE 132 -3.387 1.850 11.086 1083 HA ILE 132 HA ILE 132 -0.668 2.335 11.667 1084 HB ILE 132 HB ILE 132 -1.072 4.546 10.449 1085 1HG1 ILE 132 1HG1 ILE 132 -3.743 3.217 9.922 1086 2HG1 ILE 132 2HG1 ILE 132 -3.496 4.688 10.854 1087 1HG2 ILE 132 1HG2 ILE 132 -0.082 2.624 9.381 1088 2HG2 ILE 132 2HG2 ILE 132 -1.205 3.406 8.268 1089 3HG2 ILE 132 3HG2 ILE 132 -1.673 1.923 9.097 1090 1HD1 ILE 132 1HD1 ILE 132 -2.909 4.345 7.924 1091 2HD1 ILE 132 2HD1 ILE 132 -2.680 5.822 8.857 1092 3HD1 ILE 132 3HD1 ILE 132 -4.303 5.175 8.616 1093 H GLN 133 H GLN 133 0.156 3.159 13.386 1094 HA GLN 133 HA GLN 133 -1.412 4.349 15.414 1095 1HB GLN 133 1HB GLN 133 1.484 3.728 15.069 1096 2HB GLN 133 2HB GLN 133 0.998 4.817 16.363 1097 1HG GLN 133 1HG GLN 133 -0.135 2.059 15.961 1098 2HG GLN 133 2HG GLN 133 1.207 2.437 17.043 1099 1HE2 GLN 133 1HE2 GLN 133 0.005 1.728 18.836 1100 2HE2 GLN 133 2HE2 GLN 133 -1.274 2.686 19.500 Start of MODEL 18 1 H ASP 7 H ASP 7 -5.888 15.721 -15.975 2 HA ASP 7 HA ASP 7 -7.901 14.073 -14.888 3 1HB ASP 7 1HB ASP 7 -6.280 13.538 -16.803 4 2HB ASP 7 2HB ASP 7 -5.129 13.107 -15.541 5 H GLN 8 H GLN 8 -8.166 13.159 -12.999 6 HA GLN 8 HA GLN 8 -6.748 14.035 -10.729 7 1HB GLN 8 1HB GLN 8 -9.139 13.370 -10.764 8 2HB GLN 8 2HB GLN 8 -8.646 11.700 -10.992 9 1HG GLN 8 1HG GLN 8 -9.162 11.931 -8.720 10 2HG GLN 8 2HG GLN 8 -7.406 11.884 -8.817 11 1HE2 GLN 8 1HE2 GLN 8 -10.194 13.820 -8.138 12 2HE2 GLN 8 2HE2 GLN 8 -9.353 15.141 -7.419 13 H VAL 9 H VAL 9 -6.366 11.274 -12.817 14 HA VAL 9 HA VAL 9 -5.025 9.512 -11.093 15 HB VAL 9 HB VAL 9 -4.769 9.879 -14.087 16 1HG1 VAL 9 1HG1 VAL 9 -3.740 7.619 -12.372 17 2HG1 VAL 9 2HG1 VAL 9 -2.756 8.794 -13.245 18 3HG1 VAL 9 3HG1 VAL 9 -3.756 7.644 -14.136 19 1HG2 VAL 9 1HG2 VAL 9 -6.989 9.202 -13.349 20 2HG2 VAL 9 2HG2 VAL 9 -6.294 7.875 -12.421 21 3HG2 VAL 9 3HG2 VAL 9 -6.186 7.870 -14.182 22 H VAL 10 H VAL 10 -3.904 12.276 -12.940 23 HA VAL 10 HA VAL 10 -1.132 11.815 -12.681 24 HB VAL 10 HB VAL 10 -2.550 14.473 -12.960 25 1HG1 VAL 10 1HG1 VAL 10 -0.193 14.661 -12.281 26 2HG1 VAL 10 2HG1 VAL 10 -0.469 15.278 -13.911 27 3HG1 VAL 10 3HG1 VAL 10 0.274 13.695 -13.682 28 1HG2 VAL 10 1HG2 VAL 10 -1.518 12.594 -15.081 29 2HG2 VAL 10 2HG2 VAL 10 -2.182 14.204 -15.368 30 3HG2 VAL 10 3HG2 VAL 10 -3.214 12.926 -14.721 31 H ILE 11 H ILE 11 -3.491 13.405 -10.629 32 HA ILE 11 HA ILE 11 -1.638 14.611 -8.853 33 HB ILE 11 HB ILE 11 -4.565 13.944 -8.537 34 1HG1 ILE 11 1HG1 ILE 11 -4.663 16.507 -8.451 35 2HG1 ILE 11 2HG1 ILE 11 -3.007 16.475 -9.044 36 1HG2 ILE 11 1HG2 ILE 11 -4.569 15.239 -6.474 37 2HG2 ILE 11 2HG2 ILE 11 -2.819 15.432 -6.583 38 3HG2 ILE 11 3HG2 ILE 11 -3.517 13.832 -6.335 39 1HD1 ILE 11 1HD1 ILE 11 -4.578 16.825 -10.848 40 2HD1 ILE 11 2HD1 ILE 11 -5.413 15.326 -10.436 41 3HD1 ILE 11 3HD1 ILE 11 -3.755 15.277 -11.036 42 H PHE 12 H PHE 12 -3.641 11.674 -8.541 43 HA PHE 12 HA PHE 12 -2.565 10.994 -6.008 44 1HB PHE 12 1HB PHE 12 -4.268 9.531 -7.989 45 2HB PHE 12 2HB PHE 12 -3.614 8.694 -6.582 46 HD1 PHE 12 HD1 PHE 12 -4.164 9.549 -4.296 47 HD2 PHE 12 HD2 PHE 12 -6.139 10.940 -7.798 48 HE1 PHE 12 HE1 PHE 12 -6.004 10.412 -2.909 49 HE2 PHE 12 HE2 PHE 12 -7.975 11.811 -6.415 50 HZ PHE 12 HZ PHE 12 -7.912 11.548 -3.970 51 H LYS 13 H LYS 13 -1.771 9.925 -9.297 52 HA LYS 13 HA LYS 13 -0.034 7.850 -8.481 53 1HB LYS 13 1HB LYS 13 -0.947 8.169 -10.815 54 2HB LYS 13 2HB LYS 13 0.238 9.453 -11.027 55 1HG LYS 13 1HG LYS 13 2.025 7.804 -10.521 56 2HG LYS 13 2HG LYS 13 0.793 6.545 -10.494 57 1HD LYS 13 1HD LYS 13 0.193 7.205 -12.831 58 2HD LYS 13 2HD LYS 13 1.597 8.275 -12.827 59 1HE LYS 13 1HE LYS 13 1.609 5.282 -12.459 60 2HE LYS 13 2HE LYS 13 2.157 6.167 -13.879 61 1HZ LYS 13 1HZ LYS 13 3.929 7.138 -12.578 62 2HZ LYS 13 2HZ LYS 13 3.991 5.452 -12.451 63 3HZ LYS 13 3HZ LYS 13 3.373 6.374 -11.168 64 H GLN 14 H GLN 14 0.452 11.282 -9.084 65 HA GLN 14 HA GLN 14 3.254 11.317 -8.889 66 1HB GLN 14 1HB GLN 14 1.796 13.164 -9.749 67 2HB GLN 14 2HB GLN 14 1.347 13.517 -8.088 68 1HG GLN 14 1HG GLN 14 3.651 14.057 -7.554 69 2HG GLN 14 2HG GLN 14 4.143 13.642 -9.196 70 1HE2 GLN 14 1HE2 GLN 14 1.702 14.814 -10.337 71 2HE2 GLN 14 2HE2 GLN 14 1.919 16.529 -10.267 72 H ILE 15 H ILE 15 0.721 11.315 -6.469 73 HA ILE 15 HA ILE 15 2.319 11.951 -4.220 74 HB ILE 15 HB ILE 15 -0.174 10.233 -4.309 75 1HG1 ILE 15 1HG1 ILE 15 0.114 13.199 -3.770 76 2HG1 ILE 15 2HG1 ILE 15 -0.504 12.496 -5.262 77 1HG2 ILE 15 1HG2 ILE 15 -0.414 10.879 -1.940 78 2HG2 ILE 15 2HG2 ILE 15 1.158 11.673 -2.017 79 3HG2 ILE 15 3HG2 ILE 15 1.040 9.928 -2.242 80 1HD1 ILE 15 1HD1 ILE 15 -1.757 12.199 -2.539 81 2HD1 ILE 15 2HD1 ILE 15 -2.384 11.547 -4.054 82 3HD1 ILE 15 3HD1 ILE 15 -2.297 13.292 -3.814 83 H PHE 16 H PHE 16 1.179 8.796 -5.439 84 HA PHE 16 HA PHE 16 2.632 7.264 -3.569 85 1HB PHE 16 1HB PHE 16 1.386 6.585 -6.226 86 2HB PHE 16 2HB PHE 16 2.226 5.382 -5.252 87 HD1 PHE 16 HD1 PHE 16 -0.671 7.674 -5.335 88 HD2 PHE 16 HD2 PHE 16 1.210 4.411 -3.352 89 HE1 PHE 16 HE1 PHE 16 -2.721 7.287 -4.035 90 HE2 PHE 16 HE2 PHE 16 -0.840 4.020 -2.048 91 HZ PHE 16 HZ PHE 16 -2.808 5.455 -2.386 92 H ASP 17 H ASP 17 3.353 8.167 -6.940 93 HA ASP 17 HA ASP 17 5.778 6.747 -7.116 94 1HB ASP 17 1HB ASP 17 4.525 8.974 -8.648 95 2HB ASP 17 2HB ASP 17 6.245 8.678 -8.887 96 H LYS 18 H LYS 18 4.996 9.790 -5.652 97 HA LYS 18 HA LYS 18 7.653 10.805 -5.514 98 1HB LYS 18 1HB LYS 18 5.519 12.141 -5.257 99 2HB LYS 18 2HB LYS 18 5.367 11.446 -3.650 100 1HG LYS 18 1HG LYS 18 7.584 12.423 -3.084 101 2HG LYS 18 2HG LYS 18 7.573 13.230 -4.653 102 1HD LYS 18 1HD LYS 18 5.575 13.609 -2.422 103 2HD LYS 18 2HD LYS 18 6.812 14.757 -2.933 104 1HE LYS 18 1HE LYS 18 4.472 13.808 -4.584 105 2HE LYS 18 2HE LYS 18 4.619 15.379 -3.799 106 1HZ LYS 18 1HZ LYS 18 6.015 14.353 -6.177 107 2HZ LYS 18 2HZ LYS 18 6.776 15.523 -5.218 108 3HZ LYS 18 3HZ LYS 18 5.271 15.861 -5.927 109 H VAL 19 H VAL 19 5.569 9.061 -3.215 110 HA VAL 19 HA VAL 19 7.429 9.189 -1.082 111 HB VAL 19 HB VAL 19 4.953 8.830 -0.828 112 1HG1 VAL 19 1HG1 VAL 19 4.616 7.100 -2.488 113 2HG1 VAL 19 2HG1 VAL 19 4.112 6.523 -0.899 114 3HG1 VAL 19 3HG1 VAL 19 5.651 5.998 -1.581 115 1HG2 VAL 19 1HG2 VAL 19 5.163 7.365 1.131 116 2HG2 VAL 19 2HG2 VAL 19 6.461 8.558 1.055 117 3HG2 VAL 19 3HG2 VAL 19 6.770 6.884 0.587 118 H ARG 20 H ARG 20 7.176 7.099 -3.811 119 HA ARG 20 HA ARG 20 8.433 4.778 -2.895 120 1HB ARG 20 1HB ARG 20 8.875 6.027 -5.609 121 2HB ARG 20 2HB ARG 20 9.046 4.333 -5.181 122 1HG ARG 20 1HG ARG 20 6.639 4.190 -4.791 123 2HG ARG 20 2HG ARG 20 6.474 5.891 -5.238 124 1HD ARG 20 1HD ARG 20 7.555 5.280 -7.440 125 2HD ARG 20 2HD ARG 20 7.353 3.594 -6.971 126 HE ARG 20 HE ARG 20 5.265 5.463 -7.754 127 1HH1 ARG 20 1HH1 ARG 20 6.059 2.369 -6.369 128 2HH1 ARG 20 2HH1 ARG 20 4.555 1.628 -6.817 129 1HH2 ARG 20 1HH2 ARG 20 3.275 4.518 -8.343 130 2HH2 ARG 20 2HH2 ARG 20 2.958 2.856 -7.919 131 H ASN 21 H ASN 21 9.751 7.903 -3.733 132 HA ASN 21 HA ASN 21 12.478 6.844 -3.364 133 1HB ASN 21 1HB ASN 21 11.588 9.177 -5.076 134 2HB ASN 21 2HB ASN 21 13.257 8.670 -4.839 135 1HD2 ASN 21 1HD2 ASN 21 10.257 8.011 -6.438 136 2HD2 ASN 21 2HD2 ASN 21 10.853 6.758 -7.476 137 H ASP 22 H ASP 22 10.293 9.536 -2.712 138 HA ASP 22 HA ASP 22 12.318 11.000 -1.263 139 1HB ASP 22 1HB ASP 22 10.535 12.115 -2.621 140 2HB ASP 22 2HB ASP 22 9.356 11.573 -1.429 141 H LEU 23 H LEU 23 9.724 8.820 -0.538 142 HA LEU 23 HA LEU 23 8.992 7.820 1.345 143 1HB LEU 23 1HB LEU 23 11.701 8.680 2.354 144 2HB LEU 23 2HB LEU 23 10.615 7.639 3.255 145 HG LEU 23 HG LEU 23 11.882 7.016 0.586 146 1HD1 LEU 23 1HD1 LEU 23 13.032 5.253 1.843 147 2HD1 LEU 23 2HD1 LEU 23 12.303 5.850 3.332 148 3HD1 LEU 23 3HD1 LEU 23 13.437 6.861 2.439 149 1HD2 LEU 23 1HD2 LEU 23 10.849 4.817 0.810 150 2HD2 LEU 23 2HD2 LEU 23 9.630 6.088 0.724 151 3HD2 LEU 23 3HD2 LEU 23 10.022 5.346 2.277 152 H ASN 24 H ASN 24 8.351 10.632 0.906 153 HA ASN 24 HA ASN 24 8.123 11.791 3.535 154 1HB ASN 24 1HB ASN 24 8.241 13.158 1.425 155 2HB ASN 24 2HB ASN 24 6.635 12.567 1.017 156 1HD2 ASN 24 1HD2 ASN 24 7.433 15.276 1.393 157 2HD2 ASN 24 2HD2 ASN 24 6.507 15.908 2.720 158 H TYR 25 H TYR 25 7.045 10.266 4.768 159 HA TYR 25 HA TYR 25 4.559 9.128 3.884 160 1HB TYR 25 1HB TYR 25 5.950 9.047 6.568 161 2HB TYR 25 2HB TYR 25 4.468 8.173 6.194 162 HD1 TYR 25 HD1 TYR 25 4.533 6.430 4.353 163 HD2 TYR 25 HD2 TYR 25 8.057 8.146 6.006 164 HE1 TYR 25 HE1 TYR 25 5.854 4.546 3.485 165 HE2 TYR 25 HE2 TYR 25 9.388 6.269 5.134 166 HH TYR 25 HH TYR 25 9.073 3.953 4.440 167 H GLN 26 H GLN 26 5.560 11.886 5.703 168 HA GLN 26 HA GLN 26 3.249 12.383 7.205 169 1HB GLN 26 1HB GLN 26 5.121 14.443 6.021 170 2HB GLN 26 2HB GLN 26 4.008 14.702 7.354 171 1HG GLN 26 1HG GLN 26 6.049 14.453 8.406 172 2HG GLN 26 2HG GLN 26 5.340 12.844 8.543 173 1HE2 GLN 26 1HE2 GLN 26 7.741 14.799 6.949 174 2HE2 GLN 26 2HE2 GLN 26 8.689 13.484 6.327 175 H TRP 27 H TRP 27 4.223 13.738 4.057 176 HA TRP 27 HA TRP 27 1.733 15.049 3.623 177 1HB TRP 27 1HB TRP 27 3.905 15.721 2.583 178 2HB TRP 27 2HB TRP 27 3.835 14.275 1.587 179 HD1 TRP 27 HD1 TRP 27 1.801 17.522 2.162 180 HE1 TRP 27 HE1 TRP 27 0.677 18.155 -0.066 181 HE3 TRP 27 HE3 TRP 27 3.214 13.485 -0.634 182 HZ2 TRP 27 HZ2 TRP 27 0.421 17.089 -2.655 183 HZ3 TRP 27 HZ3 TRP 27 2.489 13.371 -2.981 184 HH2 TRP 27 HH2 TRP 27 1.122 15.136 -3.969 185 H PHE 28 H PHE 28 3.042 11.911 2.843 186 HA PHE 28 HA PHE 28 1.183 11.042 0.949 187 1HB PHE 28 1HB PHE 28 3.269 9.845 1.501 188 2HB PHE 28 2HB PHE 28 2.604 9.422 3.073 189 HD1 PHE 28 HD1 PHE 28 1.837 9.085 -0.559 190 HD2 PHE 28 HD2 PHE 28 1.589 7.373 3.331 191 HE1 PHE 28 HE1 PHE 28 0.907 7.027 -1.528 192 HE2 PHE 28 HE2 PHE 28 0.651 5.313 2.365 193 HZ PHE 28 HZ PHE 28 0.309 5.137 -0.069 194 H TYR 29 H TYR 29 1.165 10.533 4.491 195 HA TYR 29 HA TYR 29 -1.430 9.390 4.531 196 1HB TYR 29 1HB TYR 29 0.262 10.633 6.690 197 2HB TYR 29 2HB TYR 29 -1.341 9.986 7.011 198 HD1 TYR 29 HD1 TYR 29 -1.657 7.501 5.976 199 HD2 TYR 29 HD2 TYR 29 2.029 9.252 7.167 200 HE1 TYR 29 HE1 TYR 29 -0.701 5.259 6.297 201 HE2 TYR 29 HE2 TYR 29 2.997 7.018 7.488 202 HH TYR 29 HH TYR 29 2.246 4.739 7.933 203 H SER 30 H SER 30 -0.250 12.684 4.798 204 HA SER 30 HA SER 30 -2.583 13.884 5.782 205 1HB SER 30 1HB SER 30 -0.355 14.992 5.657 206 2HB SER 30 2HB SER 30 -0.544 15.112 3.910 207 HG SER 30 HG SER 30 -2.640 16.221 4.565 208 H GLU 31 H GLU 31 -1.508 13.292 2.440 209 HA GLU 31 HA GLU 31 -3.814 14.526 1.306 210 1HB GLU 31 1HB GLU 31 -1.636 12.798 0.172 211 2HB GLU 31 2HB GLU 31 -3.020 13.286 -0.802 212 1HG GLU 31 1HG GLU 31 -0.941 15.035 0.475 213 2HG GLU 31 2HG GLU 31 -1.305 14.837 -1.242 214 H LEU 32 H LEU 32 -2.982 11.218 2.174 215 HA LEU 32 HA LEU 32 -5.194 9.972 0.964 216 1HB LEU 32 1HB LEU 32 -3.672 9.252 3.468 217 2HB LEU 32 2HB LEU 32 -4.900 8.230 2.751 218 HG LEU 32 HG LEU 32 -2.293 9.031 1.459 219 1HD1 LEU 32 1HD1 LEU 32 -1.738 6.660 1.696 220 2HD1 LEU 32 2HD1 LEU 32 -3.258 6.393 2.550 221 3HD1 LEU 32 3HD1 LEU 32 -2.016 7.422 3.263 222 1HD2 LEU 32 1HD2 LEU 32 -4.040 8.805 -0.210 223 2HD2 LEU 32 2HD2 LEU 32 -4.516 7.249 0.469 224 3HD2 LEU 32 3HD2 LEU 32 -2.937 7.429 -0.297 225 H LYS 33 H LYS 33 -4.782 11.477 4.134 226 HA LYS 33 HA LYS 33 -7.374 10.770 5.086 227 1HB LYS 33 1HB LYS 33 -5.270 11.360 6.431 228 2HB LYS 33 2HB LYS 33 -5.673 13.037 6.109 229 1HG LYS 33 1HG LYS 33 -7.866 12.668 7.211 230 2HG LYS 33 2HG LYS 33 -7.332 11.039 7.630 231 1HD LYS 33 1HD LYS 33 -5.381 12.057 8.806 232 2HD LYS 33 2HD LYS 33 -6.089 13.643 8.504 233 1HE LYS 33 1HE LYS 33 -6.765 13.110 10.678 234 2HE LYS 33 2HE LYS 33 -8.170 12.740 9.682 235 1HZ LYS 33 1HZ LYS 33 -7.771 10.992 11.282 236 2HZ LYS 33 2HZ LYS 33 -6.190 10.775 10.713 237 3HZ LYS 33 3HZ LYS 33 -7.514 10.396 9.713 238 H ARG 34 H ARG 34 -6.220 13.287 3.034 239 HA ARG 34 HA ARG 34 -8.594 14.917 3.566 240 1HB ARG 34 1HB ARG 34 -6.093 15.562 1.998 241 2HB ARG 34 2HB ARG 34 -7.464 16.650 2.172 242 1HG ARG 34 1HG ARG 34 -7.096 16.393 4.696 243 2HG ARG 34 2HG ARG 34 -5.524 15.731 4.260 244 1HD ARG 34 1HD ARG 34 -6.516 18.408 3.308 245 2HD ARG 34 2HD ARG 34 -5.582 18.197 4.784 246 HE ARG 34 HE ARG 34 -4.311 17.082 2.453 247 1HH1 ARG 34 1HH1 ARG 34 -4.817 19.993 4.333 248 2HH1 ARG 34 2HH1 ARG 34 -3.356 20.759 3.783 249 1HH2 ARG 34 1HH2 ARG 34 -2.377 18.069 1.734 250 2HH2 ARG 34 2HH2 ARG 34 -1.958 19.656 2.327 251 H HIS 35 H HIS 35 -7.677 12.502 1.450 252 HA HIS 35 HA HIS 35 -9.625 13.448 -0.537 253 1HB HIS 35 1HB HIS 35 -6.855 12.412 -1.075 254 2HB HIS 35 2HB HIS 35 -8.126 12.276 -2.286 255 HD1 HIS 35 HD1 HIS 35 -5.558 14.545 -1.101 256 HD2 HIS 35 HD2 HIS 35 -9.241 14.921 -3.000 257 HE1 HIS 35 HE1 HIS 35 -5.568 16.846 -2.109 258 HE2 HIS 35 HE2 HIS 35 -7.733 16.994 -3.389 259 H ASN 36 H ASN 36 -7.750 10.589 0.485 260 HA ASN 36 HA ASN 36 -9.821 8.834 -0.539 261 1HB ASN 36 1HB ASN 36 -7.493 8.147 -0.827 262 2HB ASN 36 2HB ASN 36 -7.236 8.211 0.913 263 1HD2 ASN 36 1HD2 ASN 36 -6.670 6.075 1.075 264 2HD2 ASN 36 2HD2 ASN 36 -7.805 4.787 0.892 265 H VAL 37 H VAL 37 -11.552 9.360 0.748 266 HA VAL 37 HA VAL 37 -11.381 9.445 3.594 267 HB VAL 37 HB VAL 37 -13.837 9.336 1.834 268 1HG1 VAL 37 1HG1 VAL 37 -13.523 10.197 4.709 269 2HG1 VAL 37 2HG1 VAL 37 -14.324 8.731 4.143 270 3HG1 VAL 37 3HG1 VAL 37 -15.000 10.313 3.752 271 1HG2 VAL 37 1HG2 VAL 37 -12.462 11.240 1.265 272 2HG2 VAL 37 2HG2 VAL 37 -12.311 11.682 2.965 273 3HG2 VAL 37 3HG2 VAL 37 -13.879 11.789 2.162 274 H SER 38 H SER 38 -12.245 6.954 1.248 275 HA SER 38 HA SER 38 -13.108 5.271 3.486 276 1HB SER 38 1HB SER 38 -14.104 3.769 1.802 277 2HB SER 38 2HB SER 38 -14.728 5.410 1.683 278 HG SER 38 HG SER 38 -13.281 5.745 -0.073 279 H HIS 39 H HIS 39 -11.516 4.287 0.408 280 HA HIS 39 HA HIS 39 -9.304 3.106 1.788 281 1HB HIS 39 1HB HIS 39 -9.910 0.778 1.631 282 2HB HIS 39 2HB HIS 39 -11.184 1.614 2.511 283 HD1 HIS 39 HD1 HIS 39 -13.078 2.564 0.426 284 HD2 HIS 39 HD2 HIS 39 -11.087 -1.073 0.072 285 HE1 HIS 39 HE1 HIS 39 -14.450 1.192 -1.175 286 HE2 HIS 39 HE2 HIS 39 -13.149 -0.947 -1.492 287 H TYR 40 H TYR 40 -7.798 2.111 0.387 288 HA TYR 40 HA TYR 40 -8.511 2.119 -2.468 289 1HB TYR 40 1HB TYR 40 -6.365 3.010 -3.092 290 2HB TYR 40 2HB TYR 40 -7.074 4.095 -1.906 291 HD1 TYR 40 HD1 TYR 40 -4.405 1.652 -2.535 292 HD2 TYR 40 HD2 TYR 40 -6.077 4.364 0.283 293 HE1 TYR 40 HE1 TYR 40 -2.357 1.503 -1.189 294 HE2 TYR 40 HE2 TYR 40 -4.031 4.226 1.637 295 HH TYR 40 HH TYR 40 -1.154 2.873 0.505 296 H ILE 41 H ILE 41 -7.551 0.520 -3.731 297 HA ILE 41 HA ILE 41 -6.425 -1.712 -2.170 298 HB ILE 41 HB ILE 41 -7.808 -1.832 -4.862 299 1HG1 ILE 41 1HG1 ILE 41 -9.452 -3.256 -3.405 300 2HG1 ILE 41 2HG1 ILE 41 -8.764 -2.348 -2.064 301 1HG2 ILE 41 1HG2 ILE 41 -6.772 -4.029 -3.076 302 2HG2 ILE 41 2HG2 ILE 41 -6.127 -3.555 -4.648 303 3HG2 ILE 41 3HG2 ILE 41 -7.735 -4.271 -4.533 304 1HD1 ILE 41 1HD1 ILE 41 -9.475 -0.265 -3.099 305 2HD1 ILE 41 2HD1 ILE 41 -10.838 -1.358 -2.860 306 3HD1 ILE 41 3HD1 ILE 41 -10.136 -1.163 -4.467 307 H TYR 42 H TYR 42 -4.318 -1.877 -2.357 308 HA TYR 42 HA TYR 42 -2.977 -0.895 -4.772 309 1HB TYR 42 1HB TYR 42 -2.397 -0.264 -2.291 310 2HB TYR 42 2HB TYR 42 -1.588 -1.822 -2.277 311 HD1 TYR 42 HD1 TYR 42 -0.357 -1.878 -4.988 312 HD2 TYR 42 HD2 TYR 42 -0.712 1.294 -2.168 313 HE1 TYR 42 HE1 TYR 42 1.659 -0.817 -5.934 314 HE2 TYR 42 HE2 TYR 42 1.293 2.359 -3.105 315 HH TYR 42 HH TYR 42 2.670 1.380 -6.072 316 H TYR 43 H TYR 43 -2.815 -2.474 -6.282 317 HA TYR 43 HA TYR 43 -2.239 -5.212 -5.496 318 1HB TYR 43 1HB TYR 43 -2.579 -3.917 -8.207 319 2HB TYR 43 2HB TYR 43 -2.186 -5.617 -7.981 320 HD1 TYR 43 HD1 TYR 43 -3.834 -6.869 -6.293 321 HD2 TYR 43 HD2 TYR 43 -4.816 -3.380 -8.529 322 HE1 TYR 43 HE1 TYR 43 -6.222 -7.422 -6.098 323 HE2 TYR 43 HE2 TYR 43 -7.208 -3.929 -8.342 324 HH TYR 43 HH TYR 43 -8.590 -6.058 -7.990 325 H LEU 44 H LEU 44 -0.246 -5.567 -4.815 326 HA LEU 44 HA LEU 44 1.931 -3.872 -5.349 327 1HB LEU 44 1HB LEU 44 1.895 -6.676 -4.237 328 2HB LEU 44 2HB LEU 44 3.310 -5.647 -4.260 329 HG LEU 44 HG LEU 44 1.862 -4.004 -2.872 330 1HD1 LEU 44 1HD1 LEU 44 -0.268 -5.157 -3.212 331 2HD1 LEU 44 2HD1 LEU 44 0.156 -5.070 -1.502 332 3HD1 LEU 44 3HD1 LEU 44 0.371 -6.580 -2.387 333 1HD2 LEU 44 1HD2 LEU 44 2.545 -5.122 -0.808 334 2HD2 LEU 44 2HD2 LEU 44 3.819 -5.188 -2.026 335 3HD2 LEU 44 3HD2 LEU 44 2.831 -6.613 -1.707 336 H ALA 45 H ALA 45 0.939 -6.909 -6.827 337 HA ALA 45 HA ALA 45 3.438 -7.473 -8.033 338 1HB ALA 45 1HB ALA 45 2.282 -9.201 -9.256 339 2HB ALA 45 2HB ALA 45 0.721 -8.495 -8.829 340 3HB ALA 45 3HB ALA 45 1.748 -9.190 -7.574 341 H THR 46 H THR 46 0.505 -5.900 -9.266 342 HA THR 46 HA THR 46 1.815 -5.535 -11.852 343 HB THR 46 HB THR 46 -0.498 -4.625 -12.492 344 HG1 THR 46 HG1 THR 46 -1.928 -4.566 -10.943 345 1HG2 THR 46 1HG2 THR 46 -1.414 -6.896 -12.759 346 2HG2 THR 46 2HG2 THR 46 -0.197 -7.507 -11.638 347 3HG2 THR 46 3HG2 THR 46 0.296 -6.822 -13.187 348 H GLU 47 H GLU 47 1.564 -3.883 -9.000 349 HA GLU 47 HA GLU 47 1.846 -1.733 -8.335 350 1HB GLU 47 1HB GLU 47 3.802 -1.901 -9.858 351 2HB GLU 47 2HB GLU 47 2.807 -1.322 -11.179 352 1HG GLU 47 1HG GLU 47 4.247 0.415 -10.247 353 2HG GLU 47 2HG GLU 47 2.541 0.815 -10.093 354 H ASN 48 H ASN 48 -0.668 -2.498 -9.007 355 HA ASN 48 HA ASN 48 -1.843 -0.184 -10.397 356 1HB ASN 48 1HB ASN 48 -2.733 -3.028 -10.092 357 2HB ASN 48 2HB ASN 48 -3.938 -1.768 -10.334 358 1HD2 ASN 48 1HD2 ASN 48 -4.518 -2.708 -12.299 359 2HD2 ASN 48 2HD2 ASN 48 -3.540 -2.507 -13.716 360 H VAL 49 H VAL 49 -2.500 1.320 -9.016 361 HA VAL 49 HA VAL 49 -3.499 0.472 -6.378 362 HB VAL 49 HB VAL 49 -2.779 3.293 -7.130 363 1HG1 VAL 49 1HG1 VAL 49 -4.083 2.954 -5.088 364 2HG1 VAL 49 2HG1 VAL 49 -2.468 3.564 -4.730 365 3HG1 VAL 49 3HG1 VAL 49 -2.842 1.859 -4.476 366 1HG2 VAL 49 1HG2 VAL 49 -0.545 2.925 -6.212 367 2HG2 VAL 49 2HG2 VAL 49 -0.832 1.908 -7.626 368 3HG2 VAL 49 3HG2 VAL 49 -0.906 1.212 -6.008 369 H HIS 50 H HIS 50 -5.647 0.400 -6.208 370 HA HIS 50 HA HIS 50 -7.267 2.171 -7.914 371 1HB HIS 50 1HB HIS 50 -7.846 -0.446 -6.547 372 2HB HIS 50 2HB HIS 50 -9.148 0.595 -7.104 373 HD1 HIS 50 HD1 HIS 50 -10.031 -0.744 -9.013 374 HD2 HIS 50 HD2 HIS 50 -5.905 -0.257 -9.200 375 HE1 HIS 50 HE1 HIS 50 -9.340 -1.655 -11.255 376 HE2 HIS 50 HE2 HIS 50 -6.868 -1.177 -11.420 377 H ILE 51 H ILE 51 -7.472 4.068 -6.814 378 HA ILE 51 HA ILE 51 -8.011 3.997 -3.945 379 HB ILE 51 HB ILE 51 -7.590 6.381 -5.758 380 1HG1 ILE 51 1HG1 ILE 51 -5.459 6.527 -4.245 381 2HG1 ILE 51 2HG1 ILE 51 -5.741 4.808 -3.994 382 1HG2 ILE 51 1HG2 ILE 51 -7.821 6.221 -2.757 383 2HG2 ILE 51 2HG2 ILE 51 -8.967 6.975 -3.866 384 3HG2 ILE 51 3HG2 ILE 51 -7.353 7.659 -3.664 385 1HD1 ILE 51 1HD1 ILE 51 -4.139 5.164 -5.762 386 2HD1 ILE 51 2HD1 ILE 51 -5.294 6.170 -6.638 387 3HD1 ILE 51 3HD1 ILE 51 -5.614 4.450 -6.411 388 H VAL 52 H VAL 52 -10.079 3.603 -3.460 389 HA VAL 52 HA VAL 52 -12.214 4.929 -4.941 390 HB VAL 52 HB VAL 52 -12.439 3.169 -2.487 391 1HG1 VAL 52 1HG1 VAL 52 -14.376 4.581 -2.839 392 2HG1 VAL 52 2HG1 VAL 52 -14.775 2.899 -3.191 393 3HG1 VAL 52 3HG1 VAL 52 -14.499 4.037 -4.512 394 1HG2 VAL 52 1HG2 VAL 52 -13.076 1.363 -4.037 395 2HG2 VAL 52 2HG2 VAL 52 -11.412 1.894 -4.266 396 3HG2 VAL 52 3HG2 VAL 52 -12.663 2.407 -5.396 397 H LEU 53 H LEU 53 -12.538 7.008 -4.433 398 HA LEU 53 HA LEU 53 -11.407 8.231 -2.169 399 1HB LEU 53 1HB LEU 53 -13.630 9.227 -3.945 400 2HB LEU 53 2HB LEU 53 -12.748 10.211 -2.794 401 HG LEU 53 HG LEU 53 -11.608 8.890 -5.255 402 1HD1 LEU 53 1HD1 LEU 53 -12.066 11.787 -4.566 403 2HD1 LEU 53 2HD1 LEU 53 -12.974 10.837 -5.744 404 3HD1 LEU 53 3HD1 LEU 53 -11.266 11.188 -6.018 405 1HD2 LEU 53 1HD2 LEU 53 -9.993 8.895 -3.416 406 2HD2 LEU 53 2HD2 LEU 53 -10.243 10.629 -3.200 407 3HD2 LEU 53 3HD2 LEU 53 -9.524 10.019 -4.693 408 H LYS 54 H LYS 54 -14.867 8.287 -2.844 409 HA LYS 54 HA LYS 54 -15.481 7.419 -0.136 410 1HB LYS 54 1HB LYS 54 -15.211 9.874 0.018 411 2HB LYS 54 2HB LYS 54 -16.399 10.082 -1.260 412 1HG LYS 54 1HG LYS 54 -18.114 9.090 0.182 413 2HG LYS 54 2HG LYS 54 -16.913 8.910 1.466 414 1HD LYS 54 1HD LYS 54 -16.585 11.328 1.507 415 2HD LYS 54 2HD LYS 54 -17.754 11.518 0.200 416 1HE LYS 54 1HE LYS 54 -19.508 10.601 1.625 417 2HE LYS 54 2HE LYS 54 -18.341 10.380 2.929 418 1HZ LYS 54 1HZ LYS 54 -19.642 12.395 3.228 419 2HZ LYS 54 2HZ LYS 54 -19.118 12.986 1.727 420 3HZ LYS 54 3HZ LYS 54 -18.004 12.774 2.986 421 H ASN 55 H ASN 55 -17.272 9.140 -2.663 422 HA ASN 55 HA ASN 55 -18.563 6.647 -3.478 423 1HB ASN 55 1HB ASN 55 -20.809 7.660 -3.389 424 2HB ASN 55 2HB ASN 55 -20.083 7.572 -1.787 425 1HD2 ASN 55 1HD2 ASN 55 -21.014 9.673 -4.401 426 2HD2 ASN 55 2HD2 ASN 55 -20.918 11.153 -3.510 427 H ASP 56 H ASP 56 -16.746 9.004 -4.362 428 HA ASP 56 HA ASP 56 -18.194 10.187 -6.547 429 1HB ASP 56 1HB ASP 56 -15.224 10.337 -6.002 430 2HB ASP 56 2HB ASP 56 -16.190 11.445 -6.972 431 H ASN 57 H ASN 57 -15.027 8.580 -6.556 432 HA ASN 57 HA ASN 57 -15.826 6.724 -8.607 433 1HB ASN 57 1HB ASN 57 -14.293 7.494 -10.322 434 2HB ASN 57 2HB ASN 57 -15.400 8.797 -9.913 435 1HD2 ASN 57 1HD2 ASN 57 -12.673 8.778 -11.098 436 2HD2 ASN 57 2HD2 ASN 57 -11.747 9.840 -10.098 437 H THR 58 H THR 58 -13.751 5.593 -9.466 438 HA THR 58 HA THR 58 -11.892 5.189 -7.215 439 HB THR 58 HB THR 58 -12.537 3.243 -9.441 440 HG1 THR 58 HG1 THR 58 -13.911 3.860 -7.190 441 1HG2 THR 58 1HG2 THR 58 -10.329 2.933 -8.429 442 2HG2 THR 58 2HG2 THR 58 -11.418 1.611 -8.004 443 3HG2 THR 58 3HG2 THR 58 -11.069 2.878 -6.829 444 H VAL 59 H VAL 59 -10.035 6.213 -7.599 445 HA VAL 59 HA VAL 59 -9.126 6.724 -10.300 446 HB VAL 59 HB VAL 59 -7.732 7.333 -7.681 447 1HG1 VAL 59 1HG1 VAL 59 -7.282 8.413 -10.458 448 2HG1 VAL 59 2HG1 VAL 59 -6.219 7.314 -9.581 449 3HG1 VAL 59 3HG1 VAL 59 -6.460 8.961 -8.996 450 1HG2 VAL 59 1HG2 VAL 59 -9.536 9.076 -9.360 451 2HG2 VAL 59 2HG2 VAL 59 -8.575 9.635 -7.993 452 3HG2 VAL 59 3HG2 VAL 59 -9.871 8.466 -7.740 453 H LEU 60 H LEU 60 -8.180 5.118 -11.378 454 HA LEU 60 HA LEU 60 -6.671 3.110 -9.884 455 1HB LEU 60 1HB LEU 60 -6.798 1.730 -11.906 456 2HB LEU 60 2HB LEU 60 -8.381 2.195 -11.319 457 HG LEU 60 HG LEU 60 -7.066 3.713 -13.555 458 1HD1 LEU 60 1HD1 LEU 60 -8.240 2.263 -15.135 459 2HD1 LEU 60 2HD1 LEU 60 -8.751 1.225 -13.801 460 3HD1 LEU 60 3HD1 LEU 60 -7.039 1.364 -14.205 461 1HD2 LEU 60 1HD2 LEU 60 -9.036 4.712 -12.514 462 2HD2 LEU 60 2HD2 LEU 60 -9.944 3.225 -12.792 463 3HD2 LEU 60 3HD2 LEU 60 -9.390 4.187 -14.161 464 H LEU 61 H LEU 61 -4.620 3.484 -9.663 465 HA LEU 61 HA LEU 61 -3.121 4.883 -11.760 466 1HB LEU 61 1HB LEU 61 -2.074 4.034 -9.067 467 2HB LEU 61 2HB LEU 61 -1.442 5.275 -10.132 468 HG LEU 61 HG LEU 61 -4.057 5.462 -8.636 469 1HD1 LEU 61 1HD1 LEU 61 -2.871 7.101 -7.240 470 2HD1 LEU 61 2HD1 LEU 61 -1.371 6.709 -8.079 471 3HD1 LEU 61 3HD1 LEU 61 -2.182 5.484 -7.105 472 1HD2 LEU 61 1HD2 LEU 61 -3.980 7.819 -9.296 473 2HD2 LEU 61 2HD2 LEU 61 -4.052 6.753 -10.700 474 3HD2 LEU 61 3HD2 LEU 61 -2.525 7.505 -10.240 475 H LYS 62 H LYS 62 -2.439 3.473 -13.279 476 HA LYS 62 HA LYS 62 -1.423 0.877 -12.378 477 1HB LYS 62 1HB LYS 62 -1.549 0.286 -14.841 478 2HB LYS 62 2HB LYS 62 -3.083 0.542 -14.024 479 1HG LYS 62 1HG LYS 62 -3.215 2.789 -14.981 480 2HG LYS 62 2HG LYS 62 -1.678 2.520 -15.806 481 1HD LYS 62 1HD LYS 62 -2.659 0.659 -17.044 482 2HD LYS 62 2HD LYS 62 -4.193 0.903 -16.206 483 1HE LYS 62 1HE LYS 62 -4.254 1.903 -18.423 484 2HE LYS 62 2HE LYS 62 -4.365 3.143 -17.175 485 1HZ LYS 62 1HZ LYS 62 -1.869 2.408 -18.607 486 2HZ LYS 62 2HZ LYS 62 -2.057 3.675 -17.498 487 3HZ LYS 62 3HZ LYS 62 -2.847 3.738 -18.995 488 H GLY 63 H GLY 63 0.633 1.202 -11.787 489 1HA GLY 63 1HA GLY 63 2.401 2.901 -13.321 490 2HA GLY 63 2HA GLY 63 2.833 1.942 -11.912 491 H LEU 64 H LEU 64 2.183 -0.558 -12.627 492 HA LEU 64 HA LEU 64 2.957 -2.408 -13.669 493 1HB LEU 64 1HB LEU 64 1.507 -1.218 -15.454 494 2HB LEU 64 2HB LEU 64 3.037 -0.847 -16.226 495 HG LEU 64 HG LEU 64 3.536 -3.253 -16.390 496 1HD1 LEU 64 1HD1 LEU 64 1.802 -4.894 -15.908 497 2HD1 LEU 64 2HD1 LEU 64 0.751 -3.622 -15.292 498 3HD1 LEU 64 3HD1 LEU 64 2.252 -4.011 -14.451 499 1HD2 LEU 64 1HD2 LEU 64 0.869 -2.453 -17.551 500 2HD2 LEU 64 2HD2 LEU 64 1.881 -3.783 -18.115 501 3HD2 LEU 64 3HD2 LEU 64 2.451 -2.119 -18.254 502 H LYS 65 H LYS 65 4.969 -0.482 -12.652 503 HA LYS 65 HA LYS 65 7.187 -0.901 -14.498 504 1HB LYS 65 1HB LYS 65 6.866 0.709 -11.994 505 2HB LYS 65 2HB LYS 65 8.476 0.244 -12.523 506 1HG LYS 65 1HG LYS 65 7.697 1.255 -14.806 507 2HG LYS 65 2HG LYS 65 6.530 2.106 -13.789 508 1HD LYS 65 1HD LYS 65 8.345 2.976 -12.411 509 2HD LYS 65 2HD LYS 65 9.521 2.101 -13.388 510 1HE LYS 65 1HE LYS 65 9.532 4.376 -14.097 511 2HE LYS 65 2HE LYS 65 8.751 3.424 -15.359 512 1HZ LYS 65 1HZ LYS 65 7.666 5.600 -14.686 513 2HZ LYS 65 2HZ LYS 65 7.185 4.805 -13.267 514 3HZ LYS 65 3HZ LYS 65 6.660 4.240 -14.779 515 H ASN 66 H ASN 66 7.533 -3.046 -14.476 516 HA ASN 66 HA ASN 66 8.618 -4.945 -13.876 517 1HB ASN 66 1HB ASN 66 10.345 -3.511 -12.861 518 2HB ASN 66 2HB ASN 66 9.414 -3.446 -11.369 519 1HD2 ASN 66 1HD2 ASN 66 9.268 -5.302 -10.077 520 2HD2 ASN 66 2HD2 ASN 66 10.389 -6.610 -10.235 521 H ILE 67 H ILE 67 7.011 -6.331 -13.696 522 HA ILE 67 HA ILE 67 5.150 -6.332 -11.520 523 HB ILE 67 HB ILE 67 5.663 -8.341 -13.723 524 1HG1 ILE 67 1HG1 ILE 67 3.290 -7.560 -14.358 525 2HG1 ILE 67 2HG1 ILE 67 3.575 -6.218 -13.258 526 1HG2 ILE 67 1HG2 ILE 67 3.596 -9.458 -13.031 527 2HG2 ILE 67 2HG2 ILE 67 3.496 -8.395 -11.627 528 3HG2 ILE 67 3HG2 ILE 67 4.835 -9.532 -11.779 529 1HD1 ILE 67 1HD1 ILE 67 4.031 -5.556 -15.531 530 2HD1 ILE 67 2HD1 ILE 67 5.176 -6.884 -15.715 531 3HD1 ILE 67 3HD1 ILE 67 5.527 -5.567 -14.596 532 H VAL 68 H VAL 68 5.528 -7.093 -9.560 533 HA VAL 68 HA VAL 68 7.813 -8.804 -9.076 534 HB VAL 68 HB VAL 68 7.266 -6.867 -7.578 535 1HG1 VAL 68 1HG1 VAL 68 4.991 -8.623 -6.681 536 2HG1 VAL 68 2HG1 VAL 68 4.854 -7.083 -7.530 537 3HG1 VAL 68 3HG1 VAL 68 5.516 -7.131 -5.897 538 1HG2 VAL 68 1HG2 VAL 68 7.377 -9.577 -6.262 539 2HG2 VAL 68 2HG2 VAL 68 7.753 -8.044 -5.479 540 3HG2 VAL 68 3HG2 VAL 68 8.754 -8.621 -6.811 541 H SER 69 H SER 69 7.652 -10.822 -7.915 542 HA SER 69 HA SER 69 5.357 -12.319 -8.895 543 1HB SER 69 1HB SER 69 7.760 -13.009 -9.352 544 2HB SER 69 2HB SER 69 7.873 -13.432 -7.645 545 HG SER 69 HG SER 69 7.214 -15.113 -9.299 546 H VAL 70 H VAL 70 3.691 -12.339 -7.531 547 HA VAL 70 HA VAL 70 4.091 -12.609 -4.669 548 HB VAL 70 HB VAL 70 1.519 -12.559 -6.271 549 1HG1 VAL 70 1HG1 VAL 70 1.978 -12.319 -3.299 550 2HG1 VAL 70 2HG1 VAL 70 1.243 -13.689 -4.132 551 3HG1 VAL 70 3HG1 VAL 70 0.429 -12.124 -4.120 552 1HG2 VAL 70 1HG2 VAL 70 2.729 -10.457 -6.458 553 2HG2 VAL 70 2HG2 VAL 70 2.891 -10.378 -4.702 554 3HG2 VAL 70 3HG2 VAL 70 1.297 -10.256 -5.447 555 H LYS 71 H LYS 71 4.418 -14.545 -3.815 556 HA LYS 71 HA LYS 71 3.756 -16.919 -5.391 557 1HB LYS 71 1HB LYS 71 5.484 -16.609 -2.933 558 2HB LYS 71 2HB LYS 71 5.254 -18.101 -3.830 559 1HG LYS 71 1HG LYS 71 6.305 -17.100 -5.786 560 2HG LYS 71 2HG LYS 71 6.515 -15.586 -4.903 561 1HD LYS 71 1HD LYS 71 8.577 -16.887 -4.910 562 2HD LYS 71 2HD LYS 71 7.936 -16.733 -3.274 563 1HE LYS 71 1HE LYS 71 6.964 -18.978 -3.452 564 2HE LYS 71 2HE LYS 71 7.614 -19.126 -5.083 565 1HZ LYS 71 1HZ LYS 71 9.854 -18.838 -4.109 566 2HZ LYS 71 2HZ LYS 71 9.065 -20.244 -3.586 567 3HZ LYS 71 3HZ LYS 71 9.163 -18.901 -2.562 568 H PHE 72 H PHE 72 2.810 -18.782 -4.409 569 HA PHE 72 HA PHE 72 0.823 -18.156 -2.407 570 1HB PHE 72 1HB PHE 72 1.433 -20.620 -4.026 571 2HB PHE 72 2HB PHE 72 0.296 -20.666 -2.683 572 HD1 PHE 72 HD1 PHE 72 0.890 -19.483 -6.083 573 HD2 PHE 72 HD2 PHE 72 -1.820 -19.502 -2.802 574 HE1 PHE 72 HE1 PHE 72 -0.906 -18.694 -7.567 575 HE2 PHE 72 HE2 PHE 72 -3.621 -18.711 -4.281 576 HZ PHE 72 HZ PHE 72 -3.166 -18.309 -6.665 577 H SER 73 H SER 73 2.751 -17.598 -0.996 578 HA SER 73 HA SER 73 3.144 -19.830 0.834 579 1HB SER 73 1HB SER 73 5.437 -18.082 -0.112 580 2HB SER 73 2HB SER 73 5.537 -19.379 1.081 581 HG SER 73 HG SER 73 4.413 -20.299 -1.180 582 H LYS 74 H LYS 74 1.832 -18.913 2.324 583 HA LYS 74 HA LYS 74 2.028 -16.045 2.813 584 1HB LYS 74 1HB LYS 74 -0.076 -16.407 4.119 585 2HB LYS 74 2HB LYS 74 -0.192 -16.848 2.422 586 1HG LYS 74 1HG LYS 74 0.159 -19.213 3.063 587 2HG LYS 74 2HG LYS 74 0.129 -18.721 4.756 588 1HD LYS 74 1HD LYS 74 -2.137 -17.906 4.517 589 2HD LYS 74 2HD LYS 74 -2.114 -18.267 2.791 590 1HE LYS 74 1HE LYS 74 -1.802 -20.650 3.320 591 2HE LYS 74 2HE LYS 74 -1.893 -20.265 5.036 592 1HZ LYS 74 1HZ LYS 74 -4.144 -19.460 4.709 593 2HZ LYS 74 2HZ LYS 74 -4.009 -21.068 4.191 594 3HZ LYS 74 3HZ LYS 74 -4.059 -19.813 3.053 595 H ASP 75 H ASP 75 3.046 -15.222 4.496 596 HA ASP 75 HA ASP 75 3.213 -16.717 6.989 597 1HB ASP 75 1HB ASP 75 5.262 -17.415 5.963 598 2HB ASP 75 2HB ASP 75 5.632 -15.774 5.448 599 H ARG 76 H ARG 76 2.944 -15.453 8.682 600 HA ARG 76 HA ARG 76 2.585 -12.627 8.309 601 1HB ARG 76 1HB ARG 76 2.304 -14.468 10.667 602 2HB ARG 76 2HB ARG 76 2.201 -12.724 10.855 603 1HG ARG 76 1HG ARG 76 0.335 -12.703 9.239 604 2HG ARG 76 2HG ARG 76 0.415 -14.466 9.176 605 1HD ARG 76 1HD ARG 76 -0.128 -14.634 11.506 606 2HD ARG 76 2HD ARG 76 -0.015 -12.888 11.706 607 HE ARG 76 HE ARG 76 -1.930 -13.218 9.799 608 1HH1 ARG 76 1HH1 ARG 76 -1.479 -14.366 13.083 609 2HH1 ARG 76 2HH1 ARG 76 -3.187 -14.474 13.405 610 1HH2 ARG 76 1HH2 ARG 76 -4.173 -13.365 10.237 611 2HH2 ARG 76 2HH2 ARG 76 -4.706 -13.898 11.804 612 H HIS 77 H HIS 77 5.102 -14.706 9.483 613 HA HIS 77 HA HIS 77 6.329 -12.821 11.221 614 1HB HIS 77 1HB HIS 77 7.312 -15.387 9.988 615 2HB HIS 77 2HB HIS 77 8.330 -14.394 11.029 616 HD1 HIS 77 HD1 HIS 77 8.011 -14.627 13.525 617 HD2 HIS 77 HD2 HIS 77 5.007 -16.498 11.331 618 HE1 HIS 77 HE1 HIS 77 6.664 -15.935 15.192 619 HE2 HIS 77 HE2 HIS 77 4.863 -17.079 13.854 620 H LEU 78 H LEU 78 6.856 -13.695 7.831 621 HA LEU 78 HA LEU 78 9.089 -12.053 7.396 622 1HB LEU 78 1HB LEU 78 8.317 -13.727 5.774 623 2HB LEU 78 2HB LEU 78 6.881 -12.772 5.466 624 HG LEU 78 HG LEU 78 8.229 -10.993 4.485 625 1HD1 LEU 78 1HD1 LEU 78 10.232 -11.253 5.861 626 2HD1 LEU 78 2HD1 LEU 78 10.628 -11.272 4.145 627 3HD1 LEU 78 3HD1 LEU 78 10.590 -12.781 5.056 628 1HD2 LEU 78 1HD2 LEU 78 8.917 -13.714 3.384 629 2HD2 LEU 78 2HD2 LEU 78 9.034 -12.186 2.507 630 3HD2 LEU 78 3HD2 LEU 78 7.460 -12.785 3.030 631 H ILE 79 H ILE 79 5.624 -11.350 6.989 632 HA ILE 79 HA ILE 79 5.834 -8.664 6.237 633 HB ILE 79 HB ILE 79 3.680 -9.942 7.933 634 1HG1 ILE 79 1HG1 ILE 79 3.790 -9.570 4.932 635 2HG1 ILE 79 2HG1 ILE 79 4.109 -11.091 5.761 636 1HG2 ILE 79 1HG2 ILE 79 3.641 -7.429 6.264 637 2HG2 ILE 79 2HG2 ILE 79 3.571 -7.524 8.025 638 3HG2 ILE 79 3HG2 ILE 79 2.237 -8.150 7.054 639 1HD1 ILE 79 1HD1 ILE 79 1.510 -9.572 5.781 640 2HD1 ILE 79 2HD1 ILE 79 1.824 -11.091 6.621 641 3HD1 ILE 79 3HD1 ILE 79 1.862 -11.035 4.860 642 H GLU 80 H GLU 80 5.497 -10.127 9.431 643 HA GLU 80 HA GLU 80 5.538 -7.865 11.036 644 1HB GLU 80 1HB GLU 80 5.013 -10.146 11.789 645 2HB GLU 80 2HB GLU 80 6.694 -10.607 11.568 646 1HG GLU 80 1HG GLU 80 7.330 -8.975 13.302 647 2HG GLU 80 2HG GLU 80 5.618 -8.627 13.556 648 H THR 81 H THR 81 8.281 -9.941 10.112 649 HA THR 81 HA THR 81 10.268 -8.434 11.380 650 HB THR 81 HB THR 81 10.600 -10.170 8.926 651 HG1 THR 81 HG1 THR 81 9.688 -11.469 10.450 652 1HG2 THR 81 1HG2 THR 81 12.881 -10.511 9.786 653 2HG2 THR 81 2HG2 THR 81 12.555 -9.364 11.086 654 3HG2 THR 81 3HG2 THR 81 12.574 -8.816 9.410 655 H THR 82 H THR 82 8.951 -8.223 8.097 656 HA THR 82 HA THR 82 10.875 -6.375 7.144 657 HB THR 82 HB THR 82 8.052 -6.745 6.125 658 HG1 THR 82 HG1 THR 82 9.005 -8.749 6.045 659 1HG2 THR 82 1HG2 THR 82 8.914 -5.929 4.026 660 2HG2 THR 82 2HG2 THR 82 10.554 -5.873 4.674 661 3HG2 THR 82 3HG2 THR 82 9.330 -4.765 5.284 662 H SER 83 H SER 83 7.784 -6.001 8.793 663 HA SER 83 HA SER 83 7.600 -3.189 8.489 664 1HB SER 83 1HB SER 83 6.462 -4.967 10.661 665 2HB SER 83 2HB SER 83 5.965 -3.307 10.327 666 HG SER 83 HG SER 83 5.638 -5.607 8.703 667 H ASN 84 H ASN 84 9.048 -5.288 10.942 668 HA ASN 84 HA ASN 84 9.945 -3.214 12.642 669 1HB ASN 84 1HB ASN 84 10.944 -6.043 12.243 670 2HB ASN 84 2HB ASN 84 11.540 -4.962 13.494 671 1HD2 ASN 84 1HD2 ASN 84 10.180 -7.524 13.760 672 2HD2 ASN 84 2HD2 ASN 84 8.763 -7.210 14.709 673 H LYS 85 H LYS 85 11.344 -4.856 9.867 674 HA LYS 85 HA LYS 85 13.914 -3.717 9.932 675 1HB LYS 85 1HB LYS 85 13.079 -5.656 8.508 676 2HB LYS 85 2HB LYS 85 12.362 -4.459 7.445 677 1HG LYS 85 1HG LYS 85 14.567 -3.536 6.970 678 2HG LYS 85 2HG LYS 85 15.302 -4.712 8.064 679 1HD LYS 85 1HD LYS 85 14.207 -6.500 6.614 680 2HD LYS 85 2HD LYS 85 13.899 -5.213 5.449 681 1HE LYS 85 1HE LYS 85 16.623 -5.948 6.511 682 2HE LYS 85 2HE LYS 85 15.960 -6.532 4.987 683 1HZ LYS 85 1HZ LYS 85 16.478 -3.688 5.674 684 2HZ LYS 85 2HZ LYS 85 15.860 -4.248 4.194 685 3HZ LYS 85 3HZ LYS 85 17.438 -4.651 4.666 686 H LEU 86 H LEU 86 10.908 -2.687 8.373 687 HA LEU 86 HA LEU 86 11.902 -0.360 7.140 688 1HB LEU 86 1HB LEU 86 9.761 -1.411 6.553 689 2HB LEU 86 2HB LEU 86 9.116 -0.977 8.124 690 HG LEU 86 HG LEU 86 9.445 1.437 7.501 691 1HD1 LEU 86 1HD1 LEU 86 11.102 1.158 5.752 692 2HD1 LEU 86 2HD1 LEU 86 9.669 1.964 5.120 693 3HD1 LEU 86 3HD1 LEU 86 9.946 0.258 4.773 694 1HD2 LEU 86 1HD2 LEU 86 7.261 0.384 7.386 695 2HD2 LEU 86 2HD2 LEU 86 7.615 -0.209 5.764 696 3HD2 LEU 86 3HD2 LEU 86 7.469 1.526 6.057 697 H LYS 87 H LYS 87 10.391 -0.893 10.296 698 HA LYS 87 HA LYS 87 10.299 1.842 11.016 699 1HB LYS 87 1HB LYS 87 8.892 0.091 12.051 700 2HB LYS 87 2HB LYS 87 10.322 -0.587 12.811 701 1HG LYS 87 1HG LYS 87 9.135 0.723 14.422 702 2HG LYS 87 2HG LYS 87 10.645 1.544 14.022 703 1HD LYS 87 1HD LYS 87 9.411 3.013 12.475 704 2HD LYS 87 2HD LYS 87 7.907 2.212 12.935 705 1HE LYS 87 1HE LYS 87 8.084 4.254 14.174 706 2HE LYS 87 2HE LYS 87 8.323 2.907 15.286 707 1HZ LYS 87 1HZ LYS 87 9.937 4.566 15.760 708 2HZ LYS 87 2HZ LYS 87 10.412 4.674 14.137 709 3HZ LYS 87 3HZ LYS 87 10.755 3.272 15.028 710 H SER 88 H SER 88 12.612 -0.744 11.778 711 HA SER 88 HA SER 88 14.117 0.962 13.533 712 1HB SER 88 1HB SER 88 14.796 -1.789 12.477 713 2HB SER 88 2HB SER 88 15.558 -0.979 13.847 714 HG SER 88 HG SER 88 13.036 -2.168 13.638 715 H ARG 89 H ARG 89 14.652 -0.409 10.281 716 HA ARG 89 HA ARG 89 17.250 0.955 10.226 717 1HB ARG 89 1HB ARG 89 16.185 -1.126 8.310 718 2HB ARG 89 2HB ARG 89 17.832 -0.514 8.389 719 1HG ARG 89 1HG ARG 89 16.435 -2.102 10.532 720 2HG ARG 89 2HG ARG 89 17.656 -2.711 9.412 721 1HD ARG 89 1HD ARG 89 19.347 -1.373 10.385 722 2HD ARG 89 2HD ARG 89 18.170 -0.412 11.282 723 HE ARG 89 HE ARG 89 17.789 -2.952 12.201 724 1HH1 ARG 89 1HH1 ARG 89 20.626 -0.910 11.905 725 2HH1 ARG 89 2HH1 ARG 89 21.370 -1.523 13.355 726 1HH2 ARG 89 1HH2 ARG 89 18.745 -3.730 14.116 727 2HH2 ARG 89 2HH2 ARG 89 20.288 -3.112 14.626 728 H GLU 90 H GLU 90 14.127 1.430 9.204 729 HA GLU 90 HA GLU 90 13.143 3.041 7.956 730 1HB GLU 90 1HB GLU 90 15.028 4.502 8.631 731 2HB GLU 90 2HB GLU 90 15.928 3.951 7.224 732 1HG GLU 90 1HG GLU 90 14.160 4.869 5.775 733 2HG GLU 90 2HG GLU 90 13.341 5.484 7.210 734 H ILE 91 H ILE 91 15.940 1.599 6.358 735 HA ILE 91 HA ILE 91 16.326 0.952 4.218 736 HB ILE 91 HB ILE 91 14.833 -0.868 3.455 737 1HG1 ILE 91 1HG1 ILE 91 13.243 -0.255 5.960 738 2HG1 ILE 91 2HG1 ILE 91 12.684 0.044 4.319 739 1HG2 ILE 91 1HG2 ILE 91 15.654 -0.936 6.353 740 2HG2 ILE 91 2HG2 ILE 91 16.666 -1.314 4.958 741 3HG2 ILE 91 3HG2 ILE 91 15.295 -2.347 5.359 742 1HD1 ILE 91 1HD1 ILE 91 11.728 -1.989 5.259 743 2HD1 ILE 91 2HD1 ILE 91 13.347 -2.653 5.477 744 3HD1 ILE 91 3HD1 ILE 91 12.733 -2.337 3.853 745 H THR 92 H THR 92 13.624 0.184 2.672 746 HA THR 92 HA THR 92 12.986 2.856 1.705 747 HB THR 92 HB THR 92 13.841 0.705 -0.238 748 HG1 THR 92 HG1 THR 92 15.345 2.540 1.225 749 1HG2 THR 92 1HG2 THR 92 13.494 3.691 -0.569 750 2HG2 THR 92 2HG2 THR 92 12.341 2.468 -1.103 751 3HG2 THR 92 3HG2 THR 92 13.945 2.543 -1.831 752 H PHE 93 H PHE 93 11.020 2.947 0.541 753 HA PHE 93 HA PHE 93 8.974 1.304 1.450 754 1HB PHE 93 1HB PHE 93 8.731 3.628 0.536 755 2HB PHE 93 2HB PHE 93 8.948 2.966 -1.078 756 HD1 PHE 93 HD1 PHE 93 6.837 2.364 1.941 757 HD2 PHE 93 HD2 PHE 93 7.060 2.571 -2.304 758 HE1 PHE 93 HE1 PHE 93 4.414 1.961 1.797 759 HE2 PHE 93 HE2 PHE 93 4.639 2.168 -2.456 760 HZ PHE 93 HZ PHE 93 3.311 1.864 -0.405 761 H GLN 94 H GLN 94 10.976 1.062 -1.401 762 HA GLN 94 HA GLN 94 9.537 -0.841 -2.847 763 1HB GLN 94 1HB GLN 94 12.439 -0.127 -2.702 764 2HB GLN 94 2HB GLN 94 11.936 -1.538 -3.621 765 1HG GLN 94 1HG GLN 94 12.169 0.371 -5.070 766 2HG GLN 94 2HG GLN 94 10.482 -0.126 -4.987 767 1HE2 GLN 94 1HE2 GLN 94 12.803 2.312 -4.128 768 2HE2 GLN 94 2HE2 GLN 94 11.651 3.533 -3.678 769 H GLU 95 H GLU 95 12.162 -1.360 -0.474 770 HA GLU 95 HA GLU 95 12.210 -4.139 -0.547 771 1HB GLU 95 1HB GLU 95 12.909 -2.155 1.587 772 2HB GLU 95 2HB GLU 95 12.958 -3.876 1.935 773 1HG GLU 95 1HG GLU 95 14.511 -4.130 -0.010 774 2HG GLU 95 2HG GLU 95 14.574 -2.369 -0.097 775 H TYR 96 H TYR 96 10.255 -1.983 1.464 776 HA TYR 96 HA TYR 96 9.094 -3.908 3.107 777 1HB TYR 96 1HB TYR 96 8.932 -1.426 3.402 778 2HB TYR 96 2HB TYR 96 7.756 -1.390 2.094 779 HD1 TYR 96 HD1 TYR 96 5.554 -1.227 2.769 780 HD2 TYR 96 HD2 TYR 96 8.293 -3.341 5.240 781 HE1 TYR 96 HE1 TYR 96 3.752 -1.665 4.387 782 HE2 TYR 96 HE2 TYR 96 6.502 -3.791 6.859 783 HH TYR 96 HH TYR 96 4.394 -3.136 7.504 784 H ARG 97 H ARG 97 8.120 -2.764 -0.100 785 HA ARG 97 HA ARG 97 5.748 -4.381 -0.127 786 1HB ARG 97 1HB ARG 97 7.143 -2.965 -2.401 787 2HB ARG 97 2HB ARG 97 5.539 -3.683 -2.474 788 1HG ARG 97 1HG ARG 97 4.871 -2.116 -0.627 789 2HG ARG 97 2HG ARG 97 6.420 -1.303 -0.862 790 1HD ARG 97 1HD ARG 97 4.255 -1.667 -2.931 791 2HD ARG 97 2HD ARG 97 4.654 -0.170 -2.089 792 HE ARG 97 HE ARG 97 6.965 -0.599 -3.222 793 1HH1 ARG 97 1HH1 ARG 97 3.797 -1.165 -4.586 794 2HH1 ARG 97 2HH1 ARG 97 4.294 -0.840 -6.222 795 1HH2 ARG 97 1HH2 ARG 97 7.617 -0.179 -5.416 796 2HH2 ARG 97 2HH2 ARG 97 6.434 -0.313 -6.684 797 H ARG 98 H ARG 98 9.030 -4.712 -1.347 798 HA ARG 98 HA ARG 98 8.661 -6.919 -3.034 799 1HB ARG 98 1HB ARG 98 11.052 -6.123 -1.360 800 2HB ARG 98 2HB ARG 98 11.085 -7.405 -2.561 801 1HG ARG 98 1HG ARG 98 10.383 -4.546 -3.177 802 2HG ARG 98 2HG ARG 98 12.004 -5.224 -3.331 803 1HD ARG 98 1HD ARG 98 11.261 -6.776 -4.998 804 2HD ARG 98 2HD ARG 98 9.578 -6.311 -4.747 805 HE ARG 98 HE ARG 98 10.063 -4.206 -5.779 806 1HH1 ARG 98 1HH1 ARG 98 12.633 -6.569 -6.026 807 2HH1 ARG 98 2HH1 ARG 98 13.392 -5.787 -7.385 808 1HH2 ARG 98 1HH2 ARG 98 11.054 -3.185 -7.566 809 2HH2 ARG 98 2HH2 ARG 98 12.495 -3.861 -8.258 810 H ASN 99 H ASN 99 9.314 -6.729 0.424 811 HA ASN 99 HA ASN 99 9.460 -9.548 0.802 812 1HB ASN 99 1HB ASN 99 9.166 -7.223 2.691 813 2HB ASN 99 2HB ASN 99 9.192 -8.891 3.253 814 1HD2 ASN 99 1HD2 ASN 99 11.058 -8.396 4.442 815 2HD2 ASN 99 2HD2 ASN 99 12.609 -8.289 3.676 816 H LEU 100 H LEU 100 6.886 -7.156 1.052 817 HA LEU 100 HA LEU 100 4.973 -8.801 2.299 818 1HB LEU 100 1HB LEU 100 4.727 -6.403 0.507 819 2HB LEU 100 2HB LEU 100 3.318 -7.218 1.164 820 HG LEU 100 HG LEU 100 5.522 -6.057 2.865 821 1HD1 LEU 100 1HD1 LEU 100 2.847 -4.882 2.139 822 2HD1 LEU 100 2HD1 LEU 100 4.427 -4.275 1.643 823 3HD1 LEU 100 3HD1 LEU 100 3.961 -4.241 3.345 824 1HD2 LEU 100 1HD2 LEU 100 4.251 -7.844 3.927 825 2HD2 LEU 100 2HD2 LEU 100 2.743 -7.017 3.530 826 3HD2 LEU 100 3HD2 LEU 100 3.880 -6.284 4.661 827 H ALA 101 H ALA 101 5.560 -8.145 -1.153 828 HA ALA 101 HA ALA 101 3.569 -9.892 -2.138 829 1HB ALA 101 1HB ALA 101 6.162 -9.084 -3.457 830 2HB ALA 101 2HB ALA 101 4.657 -8.165 -3.513 831 3HB ALA 101 3HB ALA 101 4.744 -9.758 -4.264 832 H LYS 102 H LYS 102 6.828 -10.383 -1.033 833 HA LYS 102 HA LYS 102 7.172 -13.029 -2.019 834 1HB LYS 102 1HB LYS 102 8.964 -11.374 -1.291 835 2HB LYS 102 2HB LYS 102 8.537 -11.779 0.364 836 1HG LYS 102 1HG LYS 102 10.484 -13.015 -0.317 837 2HG LYS 102 2HG LYS 102 9.129 -14.121 -0.076 838 1HD LYS 102 1HD LYS 102 8.795 -14.354 -2.418 839 2HD LYS 102 2HD LYS 102 9.887 -13.014 -2.774 840 1HE LYS 102 1HE LYS 102 10.912 -15.206 -3.217 841 2HE LYS 102 2HE LYS 102 11.776 -14.295 -1.983 842 1HZ LYS 102 1HZ LYS 102 11.467 -16.670 -1.443 843 2HZ LYS 102 2HZ LYS 102 9.791 -16.421 -1.388 844 3HZ LYS 102 3HZ LYS 102 10.801 -15.628 -0.281 845 H ALA 103 H ALA 103 5.493 -11.659 0.643 846 HA ALA 103 HA ALA 103 5.353 -14.198 2.096 847 1HB ALA 103 1HB ALA 103 5.794 -12.209 3.418 848 2HB ALA 103 2HB ALA 103 4.229 -12.896 3.847 849 3HB ALA 103 3HB ALA 103 4.315 -11.460 2.825 850 H GLY 104 H GLY 104 3.765 -12.826 -0.426 851 1HA GLY 104 1HA GLY 104 1.955 -14.005 -1.441 852 2HA GLY 104 2HA GLY 104 1.401 -14.465 0.158 853 H VAL 105 H VAL 105 2.234 -11.219 0.179 854 HA VAL 105 HA VAL 105 -0.537 -10.454 0.336 855 HB VAL 105 HB VAL 105 1.937 -8.719 0.457 856 1HG1 VAL 105 1HG1 VAL 105 0.004 -7.401 -0.145 857 2HG1 VAL 105 2HG1 VAL 105 0.435 -7.073 1.534 858 3HG1 VAL 105 3HG1 VAL 105 -0.935 -8.120 1.162 859 1HG2 VAL 105 1HG2 VAL 105 1.886 -10.370 2.247 860 2HG2 VAL 105 2HG2 VAL 105 0.246 -9.880 2.671 861 3HG2 VAL 105 3HG2 VAL 105 1.585 -8.753 2.884 862 H PHE 106 H PHE 106 -1.622 -10.379 -1.509 863 HA PHE 106 HA PHE 106 -0.374 -9.130 -3.855 864 1HB PHE 106 1HB PHE 106 -1.232 -11.401 -4.190 865 2HB PHE 106 2HB PHE 106 -2.822 -10.898 -3.633 866 HD1 PHE 106 HD1 PHE 106 -0.304 -10.241 -6.284 867 HD2 PHE 106 HD2 PHE 106 -4.402 -10.141 -5.148 868 HE1 PHE 106 HE1 PHE 106 -0.929 -9.674 -8.595 869 HE2 PHE 106 HE2 PHE 106 -5.032 -9.569 -7.454 870 HZ PHE 106 HZ PHE 106 -3.294 -9.335 -9.184 871 H ARG 107 H ARG 107 -2.990 -8.862 -1.585 872 HA ARG 107 HA ARG 107 -3.951 -6.473 -3.011 873 1HB ARG 107 1HB ARG 107 -5.455 -8.511 -1.389 874 2HB ARG 107 2HB ARG 107 -6.111 -6.911 -1.696 875 1HG ARG 107 1HG ARG 107 -6.067 -7.302 -4.074 876 2HG ARG 107 2HG ARG 107 -5.282 -8.862 -3.830 877 1HD ARG 107 1HD ARG 107 -7.729 -9.009 -4.269 878 2HD ARG 107 2HD ARG 107 -7.220 -9.752 -2.756 879 HE ARG 107 HE ARG 107 -8.399 -8.151 -1.584 880 1HH1 ARG 107 1HH1 ARG 107 -8.312 -7.246 -4.975 881 2HH1 ARG 107 2HH1 ARG 107 -9.588 -6.077 -4.821 882 1HH2 ARG 107 1HH2 ARG 107 -10.108 -6.638 -1.399 883 2HH2 ARG 107 2HH2 ARG 107 -10.622 -5.756 -2.813 884 H TRP 108 H TRP 108 -2.801 -4.912 -2.033 885 HA TRP 108 HA TRP 108 -2.802 -4.717 0.878 886 1HB TRP 108 1HB TRP 108 -0.729 -4.225 -0.387 887 2HB TRP 108 2HB TRP 108 -1.558 -2.938 -1.241 888 HD1 TRP 108 HD1 TRP 108 -2.940 -1.898 1.660 889 HE1 TRP 108 HE1 TRP 108 -1.452 -0.409 3.122 890 HE3 TRP 108 HE3 TRP 108 1.617 -3.145 -0.289 891 HZ2 TRP 108 HZ2 TRP 108 1.291 0.167 3.421 892 HZ3 TRP 108 HZ3 TRP 108 3.625 -2.071 0.642 893 HH2 TRP 108 HH2 TRP 108 3.462 -0.451 2.457 894 H VAL 109 H VAL 109 -4.902 -4.232 1.430 895 HA VAL 109 HA VAL 109 -6.135 -1.921 0.095 896 HB VAL 109 HB VAL 109 -7.464 -3.953 1.901 897 1HG1 VAL 109 1HG1 VAL 109 -8.610 -1.811 1.874 898 2HG1 VAL 109 2HG1 VAL 109 -9.553 -3.023 1.004 899 3HG1 VAL 109 3HG1 VAL 109 -8.622 -1.819 0.111 900 1HG2 VAL 109 1HG2 VAL 109 -8.434 -4.892 -0.142 901 2HG2 VAL 109 2HG2 VAL 109 -6.674 -5.011 -0.152 902 3HG2 VAL 109 3HG2 VAL 109 -7.480 -3.770 -1.112 903 H THR 110 H THR 110 -5.359 -0.147 1.158 904 HA THR 110 HA THR 110 -5.409 -0.132 4.071 905 HB THR 110 HB THR 110 -4.624 2.121 2.215 906 HG1 THR 110 HG1 THR 110 -2.624 1.338 2.258 907 1HG2 THR 110 1HG2 THR 110 -5.265 2.835 4.476 908 2HG2 THR 110 2HG2 THR 110 -3.539 3.058 4.193 909 3HG2 THR 110 3HG2 THR 110 -4.106 1.696 5.158 910 H ASN 111 H ASN 111 -7.173 0.397 5.101 911 HA ASN 111 HA ASN 111 -9.183 2.055 3.749 912 1HB ASN 111 1HB ASN 111 -9.880 -0.188 4.619 913 2HB ASN 111 2HB ASN 111 -9.478 0.354 6.242 914 1HD2 ASN 111 1HD2 ASN 111 -12.017 -0.503 4.923 915 2HD2 ASN 111 2HD2 ASN 111 -13.137 0.768 5.288 916 H ILE 112 H ILE 112 -8.798 4.128 4.131 917 HA ILE 112 HA ILE 112 -7.383 5.078 6.420 918 HB ILE 112 HB ILE 112 -8.958 6.634 4.360 919 1HG1 ILE 112 1HG1 ILE 112 -7.169 5.311 3.341 920 2HG1 ILE 112 2HG1 ILE 112 -6.775 7.025 3.290 921 1HG2 ILE 112 1HG2 ILE 112 -7.609 8.554 5.053 922 2HG2 ILE 112 2HG2 ILE 112 -6.850 7.569 6.303 923 3HG2 ILE 112 3HG2 ILE 112 -8.575 7.929 6.390 924 1HD1 ILE 112 1HD1 ILE 112 -5.687 5.033 5.264 925 2HD1 ILE 112 2HD1 ILE 112 -5.274 6.746 5.180 926 3HD1 ILE 112 3HD1 ILE 112 -4.839 5.667 3.855 927 H HIS 113 H HIS 113 -10.742 4.816 5.493 928 HA HIS 113 HA HIS 113 -11.904 6.444 7.476 929 1HB HIS 113 1HB HIS 113 -13.062 5.406 5.462 930 2HB HIS 113 2HB HIS 113 -13.093 3.894 6.370 931 HD1 HIS 113 HD1 HIS 113 -15.118 3.522 7.738 932 HD2 HIS 113 HD2 HIS 113 -14.508 7.557 6.917 933 HE1 HIS 113 HE1 HIS 113 -17.114 4.723 8.692 934 HE2 HIS 113 HE2 HIS 113 -16.810 7.128 8.009 935 H GLU 114 H GLU 114 -10.724 3.164 7.477 936 HA GLU 114 HA GLU 114 -11.714 2.692 10.178 937 1HB GLU 114 1HB GLU 114 -11.586 1.063 8.040 938 2HB GLU 114 2HB GLU 114 -10.046 0.676 8.795 939 1HG GLU 114 1HG GLU 114 -11.804 -0.834 9.508 940 2HG GLU 114 2HG GLU 114 -11.170 0.108 10.859 941 H GLN 115 H GLN 115 -8.955 3.760 8.570 942 HA GLN 115 HA GLN 115 -6.902 4.444 9.259 943 1HB GLN 115 1HB GLN 115 -8.366 4.972 11.400 944 2HB GLN 115 2HB GLN 115 -7.446 3.648 12.097 945 1HG GLN 115 1HG GLN 115 -6.219 5.496 12.714 946 2HG GLN 115 2HG GLN 115 -5.380 4.948 11.265 947 1HE2 GLN 115 1HE2 GLN 115 -7.585 5.992 9.551 948 2HE2 GLN 115 2HE2 GLN 115 -7.347 7.700 9.504 949 H LYS 116 H LYS 116 -7.397 1.733 8.395 950 HA LYS 116 HA LYS 116 -5.172 0.373 9.750 951 1HB LYS 116 1HB LYS 116 -7.786 -0.967 9.033 952 2HB LYS 116 2HB LYS 116 -6.374 -1.758 9.713 953 1HG LYS 116 1HG LYS 116 -6.621 -0.470 11.761 954 2HG LYS 116 2HG LYS 116 -8.019 0.361 11.075 955 1HD LYS 116 1HD LYS 116 -9.124 -1.862 10.826 956 2HD LYS 116 2HD LYS 116 -7.765 -2.579 11.696 957 1HE LYS 116 1HE LYS 116 -8.257 -1.170 13.626 958 2HE LYS 116 2HE LYS 116 -9.601 -0.432 12.755 959 1HZ LYS 116 1HZ LYS 116 -9.359 -3.241 13.678 960 2HZ LYS 116 2HZ LYS 116 -10.548 -2.734 12.579 961 3HZ LYS 116 3HZ LYS 116 -10.509 -2.085 14.147 962 H ARG 117 H ARG 117 -3.920 -0.930 8.487 963 HA ARG 117 HA ARG 117 -4.454 -0.983 5.604 964 1HB ARG 117 1HB ARG 117 -2.076 -2.018 7.163 965 2HB ARG 117 2HB ARG 117 -2.214 -1.983 5.415 966 1HG ARG 117 1HG ARG 117 -2.250 0.471 5.485 967 2HG ARG 117 2HG ARG 117 -2.054 0.404 7.242 968 1HD ARG 117 1HD ARG 117 0.032 -0.866 6.937 969 2HD ARG 117 2HD ARG 117 -0.152 -0.723 5.194 970 HE ARG 117 HE ARG 117 -0.157 1.844 6.367 971 1HH1 ARG 117 1HH1 ARG 117 1.950 -0.847 5.639 972 2HH1 ARG 117 2HH1 ARG 117 3.382 0.127 5.530 973 1HH2 ARG 117 1HH2 ARG 117 1.747 3.161 6.242 974 2HH2 ARG 117 2HH2 ARG 117 3.264 2.407 5.873 975 H TYR 118 H TYR 118 -5.144 -2.824 4.595 976 HA TYR 118 HA TYR 118 -5.177 -5.289 6.208 977 1HB TYR 118 1HB TYR 118 -7.070 -4.438 4.008 978 2HB TYR 118 2HB TYR 118 -7.101 -6.001 4.814 979 HD1 TYR 118 HD1 TYR 118 -8.127 -2.552 4.962 980 HD2 TYR 118 HD2 TYR 118 -7.649 -6.096 7.267 981 HE1 TYR 118 HE1 TYR 118 -9.632 -1.632 6.674 982 HE2 TYR 118 HE2 TYR 118 -9.153 -5.184 8.986 983 HH TYR 118 HH TYR 118 -11.119 -2.468 8.447 984 H TYR 119 H TYR 119 -3.585 -6.579 5.576 985 HA TYR 119 HA TYR 119 -2.738 -6.589 2.779 986 1HB TYR 119 1HB TYR 119 -1.542 -7.985 5.188 987 2HB TYR 119 2HB TYR 119 -0.856 -7.981 3.569 988 HD1 TYR 119 HD1 TYR 119 -0.511 -5.498 2.590 989 HD2 TYR 119 HD2 TYR 119 -0.645 -6.527 6.715 990 HE1 TYR 119 HE1 TYR 119 0.768 -3.471 3.132 991 HE2 TYR 119 HE2 TYR 119 0.631 -4.501 7.270 992 HH TYR 119 HH TYR 119 2.303 -2.991 6.034 993 H TYR 120 H TYR 120 -3.976 -7.834 1.538 994 HA TYR 120 HA TYR 120 -4.957 -10.383 2.613 995 1HB TYR 120 1HB TYR 120 -5.801 -8.805 0.179 996 2HB TYR 120 2HB TYR 120 -6.444 -10.386 0.601 997 HD1 TYR 120 HD1 TYR 120 -6.554 -6.831 1.264 998 HD2 TYR 120 HD2 TYR 120 -7.844 -10.642 2.641 999 HE1 TYR 120 HE1 TYR 120 -8.286 -5.748 2.628 1000 HE2 TYR 120 HE2 TYR 120 -9.577 -9.568 4.014 1001 HH TYR 120 HH TYR 120 -10.017 -7.374 5.048 1002 H THR 121 H THR 121 -4.369 -12.285 1.814 1003 HA THR 121 HA THR 121 -2.192 -12.558 0.014 1004 HB THR 121 HB THR 121 -2.429 -14.262 1.632 1005 HG1 THR 121 HG1 THR 121 -3.455 -15.998 -0.145 1006 1HG2 THR 121 1HG2 THR 121 -4.761 -13.924 2.192 1007 2HG2 THR 121 2HG2 THR 121 -4.443 -15.633 1.892 1008 3HG2 THR 121 3HG2 THR 121 -5.256 -14.658 0.667 1009 H PHE 122 H PHE 122 -2.491 -14.159 -1.927 1010 HA PHE 122 HA PHE 122 -3.914 -12.767 -3.904 1011 1HB PHE 122 1HB PHE 122 -1.924 -14.203 -4.329 1012 2HB PHE 122 2HB PHE 122 -2.918 -15.624 -4.034 1013 HD1 PHE 122 HD1 PHE 122 -2.308 -12.810 -6.316 1014 HD2 PHE 122 HD2 PHE 122 -4.426 -16.447 -5.689 1015 HE1 PHE 122 HE1 PHE 122 -2.954 -12.839 -8.691 1016 HE2 PHE 122 HE2 PHE 122 -5.075 -16.483 -8.059 1017 HZ PHE 122 HZ PHE 122 -4.340 -14.679 -9.563 1018 H ASP 123 H ASP 123 -4.770 -15.579 -1.978 1019 HA ASP 123 HA ASP 123 -7.202 -16.080 -3.459 1020 1HB ASP 123 1HB ASP 123 -7.622 -17.812 -1.742 1021 2HB ASP 123 2HB ASP 123 -6.027 -17.969 -2.469 1022 H ASN 124 H ASN 124 -6.449 -13.620 -1.670 1023 HA ASN 124 HA ASN 124 -7.544 -12.001 -0.564 1024 1HB ASN 124 1HB ASN 124 -9.187 -12.304 -2.421 1025 2HB ASN 124 2HB ASN 124 -10.100 -13.389 -1.377 1026 1HD2 ASN 124 1HD2 ASN 124 -11.900 -12.100 -1.349 1027 2HD2 ASN 124 2HD2 ASN 124 -11.966 -10.593 -0.500 1028 H SER 125 H SER 125 -6.717 -12.673 1.390 1029 HA SER 125 HA SER 125 -8.735 -13.217 3.357 1030 1HB SER 125 1HB SER 125 -7.989 -15.512 2.651 1031 2HB SER 125 2HB SER 125 -6.352 -15.084 3.154 1032 HG SER 125 HG SER 125 -7.461 -16.206 4.789 1033 H LEU 126 H LEU 126 -8.116 -12.390 5.376 1034 HA LEU 126 HA LEU 126 -6.109 -10.370 5.193 1035 1HB LEU 126 1HB LEU 126 -8.215 -10.063 6.441 1036 2HB LEU 126 2HB LEU 126 -7.695 -11.279 7.593 1037 HG LEU 126 HG LEU 126 -5.796 -9.843 8.238 1038 1HD1 LEU 126 1HD1 LEU 126 -5.493 -8.632 6.157 1039 2HD1 LEU 126 2HD1 LEU 126 -5.741 -7.510 7.496 1040 3HD1 LEU 126 3HD1 LEU 126 -7.057 -7.842 6.370 1041 1HD2 LEU 126 1HD2 LEU 126 -7.876 -9.741 9.499 1042 2HD2 LEU 126 2HD2 LEU 126 -8.493 -8.506 8.403 1043 3HD2 LEU 126 3HD2 LEU 126 -7.106 -8.156 9.434 1044 H LEU 127 H LEU 127 -4.084 -11.151 5.048 1045 HA LEU 127 HA LEU 127 -3.101 -13.194 6.816 1046 1HB LEU 127 1HB LEU 127 -1.812 -11.406 4.775 1047 2HB LEU 127 2HB LEU 127 -0.847 -12.408 5.842 1048 HG LEU 127 HG LEU 127 -2.909 -13.416 3.880 1049 1HD1 LEU 127 1HD1 LEU 127 -0.899 -12.522 2.804 1050 2HD1 LEU 127 2HD1 LEU 127 -0.987 -14.276 2.652 1051 3HD1 LEU 127 3HD1 LEU 127 0.105 -13.547 3.830 1052 1HD2 LEU 127 1HD2 LEU 127 -1.014 -14.873 5.723 1053 2HD2 LEU 127 2HD2 LEU 127 -1.988 -15.634 4.462 1054 3HD2 LEU 127 3HD2 LEU 127 -2.773 -14.846 5.833 1055 H PHE 128 H PHE 128 -2.741 -9.688 6.513 1056 HA PHE 128 HA PHE 128 -2.007 -9.537 9.321 1057 1HB PHE 128 1HB PHE 128 0.109 -9.862 7.935 1058 2HB PHE 128 2HB PHE 128 -0.221 -8.286 7.227 1059 HD1 PHE 128 HD1 PHE 128 0.792 -10.084 10.240 1060 HD2 PHE 128 HD2 PHE 128 0.118 -6.260 8.498 1061 HE1 PHE 128 HE1 PHE 128 2.010 -9.025 12.097 1062 HE2 PHE 128 HE2 PHE 128 1.334 -5.197 10.351 1063 HZ PHE 128 HZ PHE 128 2.282 -6.578 12.153 1064 H THR 129 H THR 129 -2.631 -7.618 10.242 1065 HA THR 129 HA THR 129 -3.382 -5.428 8.451 1066 HB THR 129 HB THR 129 -5.462 -6.646 9.085 1067 HG1 THR 129 HG1 THR 129 -5.349 -4.284 8.772 1068 1HG2 THR 129 1HG2 THR 129 -4.790 -7.439 11.303 1069 2HG2 THR 129 2HG2 THR 129 -6.283 -6.505 11.390 1070 3HG2 THR 129 3HG2 THR 129 -4.758 -5.775 11.892 1071 H GLU 130 H GLU 130 -3.005 -3.381 9.285 1072 HA GLU 130 HA GLU 130 -1.967 -3.197 12.006 1073 1HB GLU 130 1HB GLU 130 -0.024 -3.616 10.501 1074 2HB GLU 130 2HB GLU 130 -0.437 -2.155 9.614 1075 1HG GLU 130 1HG GLU 130 1.389 -1.833 11.236 1076 2HG GLU 130 2HG GLU 130 -0.005 -0.791 11.539 1077 H SER 131 H SER 131 -2.237 -1.200 12.937 1078 HA SER 131 HA SER 131 -4.118 0.529 11.521 1079 1HB SER 131 1HB SER 131 -3.245 0.572 14.421 1080 2HB SER 131 2HB SER 131 -4.583 1.485 13.720 1081 HG SER 131 HG SER 131 -4.851 -1.108 13.108 1082 H ILE 132 H ILE 132 -3.529 2.404 10.663 1083 HA ILE 132 HA ILE 132 -0.800 3.257 10.843 1084 HB ILE 132 HB ILE 132 -1.619 5.204 9.411 1085 1HG1 ILE 132 1HG1 ILE 132 -4.110 3.488 9.268 1086 2HG1 ILE 132 2HG1 ILE 132 -4.006 5.041 10.088 1087 1HG2 ILE 132 1HG2 ILE 132 -1.715 3.827 7.410 1088 2HG2 ILE 132 2HG2 ILE 132 -2.041 2.401 8.392 1089 3HG2 ILE 132 3HG2 ILE 132 -0.489 3.225 8.526 1090 1HD1 ILE 132 1HD1 ILE 132 -5.056 5.241 7.901 1091 2HD1 ILE 132 2HD1 ILE 132 -3.604 4.587 7.141 1092 3HD1 ILE 132 3HD1 ILE 132 -3.542 6.141 7.969 1093 H GLN 133 H GLN 133 -0.232 3.985 12.741 1094 HA GLN 133 HA GLN 133 0.083 5.406 14.468 1095 1HB GLN 133 1HB GLN 133 -0.507 7.245 12.862 1096 2HB GLN 133 2HB GLN 133 -2.180 7.098 13.383 1097 1HG GLN 133 1HG GLN 133 -1.244 8.917 14.563 1098 2HG GLN 133 2HG GLN 133 -1.399 7.588 15.711 1099 1HE2 GLN 133 1HE2 GLN 133 0.340 9.916 15.802 1100 2HE2 GLN 133 2HE2 GLN 133 1.959 9.309 15.897 Start of MODEL 19 1 H ASP 7 H ASP 7 -4.269 14.707 -16.088 2 HA ASP 7 HA ASP 7 -6.766 14.477 -14.829 3 1HB ASP 7 1HB ASP 7 -4.676 12.427 -15.560 4 2HB ASP 7 2HB ASP 7 -6.244 11.992 -14.888 5 H GLN 8 H GLN 8 -7.372 13.455 -12.901 6 HA GLN 8 HA GLN 8 -5.842 14.165 -10.637 7 1HB GLN 8 1HB GLN 8 -8.372 13.880 -10.793 8 2HB GLN 8 2HB GLN 8 -8.088 12.152 -10.670 9 1HG GLN 8 1HG GLN 8 -7.157 12.378 -8.497 10 2HG GLN 8 2HG GLN 8 -7.133 14.136 -8.630 11 1HE2 GLN 8 1HE2 GLN 8 -9.791 14.122 -9.952 12 2HE2 GLN 8 2HE2 GLN 8 -10.923 13.877 -8.659 13 H VAL 9 H VAL 9 -6.104 11.268 -12.553 14 HA VAL 9 HA VAL 9 -4.811 9.430 -10.897 15 HB VAL 9 HB VAL 9 -4.623 9.692 -13.906 16 1HG1 VAL 9 1HG1 VAL 9 -2.807 8.316 -13.066 17 2HG1 VAL 9 2HG1 VAL 9 -4.003 7.316 -13.890 18 3HG1 VAL 9 3HG1 VAL 9 -3.948 7.352 -12.128 19 1HG2 VAL 9 1HG2 VAL 9 -6.431 8.015 -12.172 20 2HG2 VAL 9 2HG2 VAL 9 -6.354 7.955 -13.934 21 3HG2 VAL 9 3HG2 VAL 9 -6.907 9.421 -13.123 22 H VAL 10 H VAL 10 -3.502 11.929 -13.022 23 HA VAL 10 HA VAL 10 -0.774 11.243 -12.715 24 HB VAL 10 HB VAL 10 -1.971 13.949 -13.356 25 1HG1 VAL 10 1HG1 VAL 10 0.210 14.434 -14.373 26 2HG1 VAL 10 2HG1 VAL 10 0.816 12.883 -13.797 27 3HG1 VAL 10 3HG1 VAL 10 0.350 14.127 -12.640 28 1HG2 VAL 10 1HG2 VAL 10 -1.021 11.749 -15.186 29 2HG2 VAL 10 2HG2 VAL 10 -1.539 13.354 -15.698 30 3HG2 VAL 10 3HG2 VAL 10 -2.693 12.253 -14.944 31 H ILE 11 H ILE 11 -2.924 13.461 -11.001 32 HA ILE 11 HA ILE 11 -0.984 14.535 -9.255 33 HB ILE 11 HB ILE 11 -3.981 14.368 -9.137 34 1HG1 ILE 11 1HG1 ILE 11 -3.742 16.857 -9.103 35 2HG1 ILE 11 2HG1 ILE 11 -2.002 16.656 -9.255 36 1HG2 ILE 11 1HG2 ILE 11 -2.241 15.498 -6.945 37 2HG2 ILE 11 2HG2 ILE 11 -3.247 14.054 -6.830 38 3HG2 ILE 11 3HG2 ILE 11 -3.997 15.633 -7.050 39 1HD1 ILE 11 1HD1 ILE 11 -4.041 15.728 -11.265 40 2HD1 ILE 11 2HD1 ILE 11 -2.285 15.628 -11.426 41 3HD1 ILE 11 3HD1 ILE 11 -3.080 17.204 -11.377 42 H PHE 12 H PHE 12 -3.296 11.853 -8.821 43 HA PHE 12 HA PHE 12 -2.456 11.228 -6.205 44 1HB PHE 12 1HB PHE 12 -4.148 9.927 -8.245 45 2HB PHE 12 2HB PHE 12 -3.442 8.855 -7.036 46 HD1 PHE 12 HD1 PHE 12 -5.651 11.750 -7.552 47 HD2 PHE 12 HD2 PHE 12 -4.162 8.891 -4.773 48 HE1 PHE 12 HE1 PHE 12 -7.384 12.420 -5.944 49 HE2 PHE 12 HE2 PHE 12 -5.896 9.556 -3.158 50 HZ PHE 12 HZ PHE 12 -7.506 11.321 -3.747 51 H LYS 13 H LYS 13 -1.405 9.936 -9.355 52 HA LYS 13 HA LYS 13 0.362 8.043 -8.156 53 1HB LYS 13 1HB LYS 13 -0.522 7.979 -10.549 54 2HB LYS 13 2HB LYS 13 0.692 9.200 -10.921 55 1HG LYS 13 1HG LYS 13 2.266 7.417 -9.727 56 2HG LYS 13 2HG LYS 13 1.009 6.321 -10.301 57 1HD LYS 13 1HD LYS 13 2.642 6.382 -12.004 58 2HD LYS 13 2HD LYS 13 1.314 7.396 -12.577 59 1HE LYS 13 1HE LYS 13 3.453 8.474 -13.001 60 2HE LYS 13 2HE LYS 13 2.519 9.389 -11.820 61 1HZ LYS 13 1HZ LYS 13 4.812 9.235 -11.132 62 2HZ LYS 13 2HZ LYS 13 4.772 7.547 -11.220 63 3HZ LYS 13 3HZ LYS 13 3.849 8.354 -10.053 64 H GLN 14 H GLN 14 0.497 11.419 -8.722 65 HA GLN 14 HA GLN 14 3.351 11.692 -8.530 66 1HB GLN 14 1HB GLN 14 1.683 13.375 -9.535 67 2HB GLN 14 2HB GLN 14 1.297 13.810 -7.877 68 1HG GLN 14 1HG GLN 14 2.856 15.392 -8.633 69 2HG GLN 14 2HG GLN 14 3.740 14.310 -7.557 70 1HE2 GLN 14 1HE2 GLN 14 2.788 13.458 -10.810 71 2HE2 GLN 14 2HE2 GLN 14 4.384 13.432 -11.479 72 H ILE 15 H ILE 15 0.583 11.884 -6.371 73 HA ILE 15 HA ILE 15 1.846 12.592 -3.988 74 HB ILE 15 HB ILE 15 -0.557 10.813 -4.438 75 1HG1 ILE 15 1HG1 ILE 15 -0.386 13.737 -3.684 76 2HG1 ILE 15 2HG1 ILE 15 -0.743 13.134 -5.299 77 1HG2 ILE 15 1HG2 ILE 15 0.371 10.396 -2.231 78 2HG2 ILE 15 2HG2 ILE 15 -1.155 11.275 -2.109 79 3HG2 ILE 15 3HG2 ILE 15 0.372 12.128 -1.892 80 1HD1 ILE 15 1HD1 ILE 15 -2.771 13.806 -4.181 81 2HD1 ILE 15 2HD1 ILE 15 -2.416 12.729 -2.829 82 3HD1 ILE 15 3HD1 ILE 15 -2.769 12.059 -4.423 83 H PHE 16 H PHE 16 1.019 9.342 -5.170 84 HA PHE 16 HA PHE 16 2.363 7.946 -3.127 85 1HB PHE 16 1HB PHE 16 1.412 7.153 -5.870 86 2HB PHE 16 2HB PHE 16 2.255 6.016 -4.826 87 HD1 PHE 16 HD1 PHE 16 1.018 4.686 -3.423 88 HD2 PHE 16 HD2 PHE 16 -0.653 8.362 -4.761 89 HE1 PHE 16 HE1 PHE 16 -1.108 4.123 -2.313 90 HE2 PHE 16 HE2 PHE 16 -2.780 7.805 -3.658 91 HZ PHE 16 HZ PHE 16 -3.010 5.684 -2.430 92 H ASP 17 H ASP 17 3.443 9.280 -6.161 93 HA ASP 17 HA ASP 17 5.887 7.792 -6.282 94 1HB ASP 17 1HB ASP 17 4.627 9.029 -8.195 95 2HB ASP 17 2HB ASP 17 5.490 10.452 -7.620 96 H LYS 18 H LYS 18 4.932 10.984 -5.137 97 HA LYS 18 HA LYS 18 7.433 12.034 -4.530 98 1HB LYS 18 1HB LYS 18 5.301 13.330 -4.440 99 2HB LYS 18 2HB LYS 18 4.863 12.471 -2.971 100 1HG LYS 18 1HG LYS 18 5.736 14.644 -2.433 101 2HG LYS 18 2HG LYS 18 6.837 13.395 -1.852 102 1HD LYS 18 1HD LYS 18 8.297 14.908 -2.805 103 2HD LYS 18 2HD LYS 18 8.041 13.772 -4.128 104 1HE LYS 18 1HE LYS 18 6.561 16.378 -3.784 105 2HE LYS 18 2HE LYS 18 7.960 16.152 -4.826 106 1HZ LYS 18 1HZ LYS 18 6.657 14.469 -6.062 107 2HZ LYS 18 2HZ LYS 18 5.976 16.022 -6.124 108 3HZ LYS 18 3HZ LYS 18 5.305 14.852 -5.105 109 H VAL 19 H VAL 19 5.258 10.109 -2.480 110 HA VAL 19 HA VAL 19 7.097 10.080 -0.289 111 HB VAL 19 HB VAL 19 4.647 9.912 0.032 112 1HG1 VAL 19 1HG1 VAL 19 4.972 7.138 -1.099 113 2HG1 VAL 19 2HG1 VAL 19 4.101 8.474 -1.850 114 3HG1 VAL 19 3HG1 VAL 19 3.514 7.777 -0.341 115 1HG2 VAL 19 1HG2 VAL 19 6.204 7.562 1.105 116 2HG2 VAL 19 2HG2 VAL 19 4.707 8.207 1.778 117 3HG2 VAL 19 3HG2 VAL 19 6.172 9.186 1.790 118 H ARG 20 H ARG 20 6.600 8.112 -3.089 119 HA ARG 20 HA ARG 20 7.676 5.681 -2.179 120 1HB ARG 20 1HB ARG 20 6.423 5.752 -4.236 121 2HB ARG 20 2HB ARG 20 7.569 6.876 -4.955 122 1HG ARG 20 1HG ARG 20 9.286 5.169 -4.938 123 2HG ARG 20 2HG ARG 20 8.182 4.041 -4.152 124 1HD ARG 20 1HD ARG 20 8.308 3.566 -6.523 125 2HD ARG 20 2HD ARG 20 6.700 4.146 -6.102 126 HE ARG 20 HE ARG 20 7.190 6.202 -7.197 127 1HH1 ARG 20 1HH1 ARG 20 9.777 3.860 -7.513 128 2HH1 ARG 20 2HH1 ARG 20 10.355 4.521 -9.014 129 1HH2 ARG 20 1HH2 ARG 20 7.965 7.076 -9.179 130 2HH2 ARG 20 2HH2 ARG 20 9.349 6.326 -9.943 131 H ASN 21 H ASN 21 9.216 8.533 -3.577 132 HA ASN 21 HA ASN 21 11.793 7.135 -3.501 133 1HB ASN 21 1HB ASN 21 11.018 9.682 -4.930 134 2HB ASN 21 2HB ASN 21 12.614 8.938 -4.982 135 1HD2 ASN 21 1HD2 ASN 21 9.384 8.868 -6.161 136 2HD2 ASN 21 2HD2 ASN 21 9.609 7.605 -7.320 137 H ASP 22 H ASP 22 10.076 9.794 -2.051 138 HA ASP 22 HA ASP 22 12.552 10.860 -0.919 139 1HB ASP 22 1HB ASP 22 10.757 12.361 -1.888 140 2HB ASP 22 2HB ASP 22 9.754 11.919 -0.509 141 H LEU 23 H LEU 23 9.811 8.955 -0.074 142 HA LEU 23 HA LEU 23 9.234 7.772 1.762 143 1HB LEU 23 1HB LEU 23 12.004 8.489 2.725 144 2HB LEU 23 2HB LEU 23 10.944 7.325 3.497 145 HG LEU 23 HG LEU 23 12.208 7.104 0.770 146 1HD1 LEU 23 1HD1 LEU 23 12.454 5.396 3.235 147 2HD1 LEU 23 2HD1 LEU 23 13.645 6.573 2.687 148 3HD1 LEU 23 3HD1 LEU 23 13.290 5.153 1.702 149 1HD2 LEU 23 1HD2 LEU 23 10.203 5.276 2.087 150 2HD2 LEU 23 2HD2 LEU 23 11.075 4.943 0.589 151 3HD2 LEU 23 3HD2 LEU 23 9.922 6.274 0.659 152 H ASN 24 H ASN 24 8.778 10.644 1.533 153 HA ASN 24 HA ASN 24 8.759 11.598 4.268 154 1HB ASN 24 1HB ASN 24 7.679 13.622 3.283 155 2HB ASN 24 2HB ASN 24 9.239 13.241 2.567 156 1HD2 ASN 24 1HD2 ASN 24 7.121 14.851 1.468 157 2HD2 ASN 24 2HD2 ASN 24 6.645 14.102 -0.017 158 H TYR 25 H TYR 25 7.464 9.559 4.730 159 HA TYR 25 HA TYR 25 4.819 9.215 3.895 160 1HB TYR 25 1HB TYR 25 6.150 8.392 6.484 161 2HB TYR 25 2HB TYR 25 4.558 7.843 5.974 162 HD1 TYR 25 HD1 TYR 25 8.158 7.522 5.457 163 HD2 TYR 25 HD2 TYR 25 4.320 6.297 4.084 164 HE1 TYR 25 HE1 TYR 25 9.200 5.680 4.206 165 HE2 TYR 25 HE2 TYR 25 5.354 4.453 2.827 166 HH TYR 25 HH TYR 25 8.605 3.515 3.283 167 H GLN 26 H GLN 26 6.176 11.386 6.203 168 HA GLN 26 HA GLN 26 3.982 12.023 7.788 169 1HB GLN 26 1HB GLN 26 6.285 12.787 8.200 170 2HB GLN 26 2HB GLN 26 6.204 13.821 6.786 171 1HG GLN 26 1HG GLN 26 4.144 14.245 8.858 172 2HG GLN 26 2HG GLN 26 5.797 14.690 9.276 173 1HE2 GLN 26 1HE2 GLN 26 6.850 16.286 8.053 174 2HE2 GLN 26 2HE2 GLN 26 5.948 17.448 7.134 175 H TRP 27 H TRP 27 4.910 13.195 4.582 176 HA TRP 27 HA TRP 27 2.822 15.130 4.381 177 1HB TRP 27 1HB TRP 27 3.935 15.745 2.515 178 2HB TRP 27 2HB TRP 27 5.115 14.505 2.912 179 HD1 TRP 27 HD1 TRP 27 4.626 12.005 1.667 180 HE1 TRP 27 HE1 TRP 27 3.682 11.553 -0.688 181 HE3 TRP 27 HE3 TRP 27 2.519 16.551 0.696 182 HZ2 TRP 27 HZ2 TRP 27 2.316 12.917 -2.690 183 HZ3 TRP 27 HZ3 TRP 27 1.440 16.877 -1.479 184 HH2 TRP 27 HH2 TRP 27 1.332 15.111 -3.135 185 H PHE 28 H PHE 28 3.131 11.745 3.736 186 HA PHE 28 HA PHE 28 1.213 11.693 1.626 187 1HB PHE 28 1HB PHE 28 3.166 10.209 1.674 188 2HB PHE 28 2HB PHE 28 2.581 9.456 3.150 189 HD1 PHE 28 HD1 PHE 28 1.247 10.192 -0.265 190 HD2 PHE 28 HD2 PHE 28 1.695 7.381 2.894 191 HE1 PHE 28 HE1 PHE 28 0.079 8.497 -1.615 192 HE2 PHE 28 HE2 PHE 28 0.524 5.682 1.554 193 HZ PHE 28 HZ PHE 28 -0.284 6.240 -0.701 194 H TYR 29 H TYR 29 1.224 10.612 5.023 195 HA TYR 29 HA TYR 29 -1.330 9.389 4.878 196 1HB TYR 29 1HB TYR 29 0.377 10.296 7.184 197 2HB TYR 29 2HB TYR 29 -1.228 9.615 7.435 198 HD1 TYR 29 HD1 TYR 29 -1.667 7.261 6.994 199 HD2 TYR 29 HD2 TYR 29 2.209 8.904 6.388 200 HE1 TYR 29 HE1 TYR 29 -0.734 4.990 6.860 201 HE2 TYR 29 HE2 TYR 29 3.155 6.638 6.248 202 HH TYR 29 HH TYR 29 2.604 4.364 6.981 203 H SER 30 H SER 30 -0.285 12.658 5.554 204 HA SER 30 HA SER 30 -2.889 13.558 6.368 205 1HB SER 30 1HB SER 30 -0.744 14.695 7.027 206 2HB SER 30 2HB SER 30 -0.564 15.217 5.353 207 HG SER 30 HG SER 30 -1.597 16.722 6.910 208 H GLU 31 H GLU 31 -0.970 13.537 3.424 209 HA GLU 31 HA GLU 31 -2.630 14.933 1.682 210 1HB GLU 31 1HB GLU 31 -0.255 13.826 1.424 211 2HB GLU 31 2HB GLU 31 -1.168 12.448 0.843 212 1HG GLU 31 1HG GLU 31 -0.302 14.731 -0.566 213 2HG GLU 31 2HG GLU 31 -1.168 13.325 -1.171 214 H LEU 32 H LEU 32 -2.497 11.437 2.339 215 HA LEU 32 HA LEU 32 -4.681 10.638 0.817 216 1HB LEU 32 1HB LEU 32 -3.587 9.500 3.379 217 2HB LEU 32 2HB LEU 32 -4.848 8.723 2.445 218 HG LEU 32 HG LEU 32 -2.026 9.256 1.513 219 1HD1 LEU 32 1HD1 LEU 32 -2.224 7.474 3.188 220 2HD1 LEU 32 2HD1 LEU 32 -1.788 6.841 1.601 221 3HD1 LEU 32 3HD1 LEU 32 -3.441 6.681 2.189 222 1HD2 LEU 32 1HD2 LEU 32 -3.610 9.405 -0.333 223 2HD2 LEU 32 2HD2 LEU 32 -4.318 7.859 0.137 224 3HD2 LEU 32 3HD2 LEU 32 -2.655 7.927 -0.447 225 H LYS 33 H LYS 33 -4.579 11.697 4.208 226 HA LYS 33 HA LYS 33 -7.239 11.047 4.808 227 1HB LYS 33 1HB LYS 33 -5.361 11.620 6.426 228 2HB LYS 33 2HB LYS 33 -5.709 13.310 6.082 229 1HG LYS 33 1HG LYS 33 -7.955 13.058 6.934 230 2HG LYS 33 2HG LYS 33 -7.690 11.332 7.195 231 1HD LYS 33 1HD LYS 33 -5.814 11.957 8.745 232 2HD LYS 33 2HD LYS 33 -6.342 13.636 8.596 233 1HE LYS 33 1HE LYS 33 -8.552 13.007 9.453 234 2HE LYS 33 2HE LYS 33 -8.009 11.336 9.611 235 1HZ LYS 33 1HZ LYS 33 -6.966 13.694 11.089 236 2HZ LYS 33 2HZ LYS 33 -6.284 12.143 11.163 237 3HZ LYS 33 3HZ LYS 33 -7.862 12.399 11.729 238 H ARG 34 H ARG 34 -5.905 13.757 3.111 239 HA ARG 34 HA ARG 34 -8.201 15.457 3.347 240 1HB ARG 34 1HB ARG 34 -5.976 15.456 1.300 241 2HB ARG 34 2HB ARG 34 -7.151 16.744 1.523 242 1HG ARG 34 1HG ARG 34 -6.273 17.237 3.704 243 2HG ARG 34 2HG ARG 34 -5.185 15.848 3.618 244 1HD ARG 34 1HD ARG 34 -3.965 17.871 3.119 245 2HD ARG 34 2HD ARG 34 -4.078 16.868 1.672 246 HE ARG 34 HE ARG 34 -6.101 18.942 1.970 247 1HH1 ARG 34 1HH1 ARG 34 -3.149 17.839 0.430 248 2HH1 ARG 34 2HH1 ARG 34 -3.111 19.147 -0.712 249 1HH2 ARG 34 1HH2 ARG 34 -6.072 20.652 0.432 250 2HH2 ARG 34 2HH2 ARG 34 -4.768 20.735 -0.716 251 H HIS 35 H HIS 35 -6.986 13.204 0.908 252 HA HIS 35 HA HIS 35 -9.353 13.730 -0.745 253 1HB HIS 35 1HB HIS 35 -6.668 12.513 -1.400 254 2HB HIS 35 2HB HIS 35 -8.024 12.513 -2.524 255 HD1 HIS 35 HD1 HIS 35 -5.128 14.493 -1.582 256 HD2 HIS 35 HD2 HIS 35 -8.946 15.268 -3.085 257 HE1 HIS 35 HE1 HIS 35 -5.041 16.820 -2.539 258 HE2 HIS 35 HE2 HIS 35 -7.365 17.287 -3.397 259 H ASN 36 H ASN 36 -7.315 10.912 0.022 260 HA ASN 36 HA ASN 36 -9.582 9.142 -0.394 261 1HB ASN 36 1HB ASN 36 -7.408 8.483 -1.312 262 2HB ASN 36 2HB ASN 36 -6.697 8.542 0.297 263 1HD2 ASN 36 1HD2 ASN 36 -6.087 6.403 0.253 264 2HD2 ASN 36 2HD2 ASN 36 -7.222 5.108 0.373 265 H VAL 37 H VAL 37 -10.788 9.957 1.409 266 HA VAL 37 HA VAL 37 -9.790 9.461 4.083 267 HB VAL 37 HB VAL 37 -12.625 10.190 3.351 268 1HG1 VAL 37 1HG1 VAL 37 -12.614 11.287 5.549 269 2HG1 VAL 37 2HG1 VAL 37 -10.955 10.741 5.805 270 3HG1 VAL 37 3HG1 VAL 37 -12.261 9.563 5.674 271 1HG2 VAL 37 1HG2 VAL 37 -11.972 12.553 3.556 272 2HG2 VAL 37 2HG2 VAL 37 -11.194 11.753 2.191 273 3HG2 VAL 37 3HG2 VAL 37 -10.283 12.058 3.670 274 H SER 38 H SER 38 -10.929 7.520 1.716 275 HA SER 38 HA SER 38 -12.508 5.834 3.512 276 1HB SER 38 1HB SER 38 -13.523 6.536 1.326 277 2HB SER 38 2HB SER 38 -12.264 5.607 0.508 278 HG SER 38 HG SER 38 -14.559 4.766 1.700 279 H HIS 39 H HIS 39 -10.528 4.955 0.668 280 HA HIS 39 HA HIS 39 -8.545 3.537 2.065 281 1HB HIS 39 1HB HIS 39 -9.308 1.236 1.848 282 2HB HIS 39 2HB HIS 39 -10.474 2.148 2.798 283 HD1 HIS 39 HD1 HIS 39 -12.684 2.945 1.369 284 HD2 HIS 39 HD2 HIS 39 -10.369 -0.109 -0.256 285 HE1 HIS 39 HE1 HIS 39 -14.146 1.808 -0.326 286 HE2 HIS 39 HE2 HIS 39 -12.778 -0.113 -1.208 287 H TYR 40 H TYR 40 -7.013 2.680 0.649 288 HA TYR 40 HA TYR 40 -7.826 2.590 -2.175 289 1HB TYR 40 1HB TYR 40 -5.674 3.274 -2.907 290 2HB TYR 40 2HB TYR 40 -6.142 4.402 -1.647 291 HD1 TYR 40 HD1 TYR 40 -4.891 4.553 0.401 292 HD2 TYR 40 HD2 TYR 40 -3.901 1.627 -2.524 293 HE1 TYR 40 HE1 TYR 40 -2.750 4.148 1.534 294 HE2 TYR 40 HE2 TYR 40 -1.758 1.202 -1.397 295 HH TYR 40 HH TYR 40 -1.098 2.304 1.719 296 H ILE 41 H ILE 41 -7.485 0.774 -3.269 297 HA ILE 41 HA ILE 41 -6.374 -1.490 -1.762 298 HB ILE 41 HB ILE 41 -8.068 -1.542 -4.267 299 1HG1 ILE 41 1HG1 ILE 41 -8.928 -2.072 -1.413 300 2HG1 ILE 41 2HG1 ILE 41 -9.241 -0.574 -2.283 301 1HG2 ILE 41 1HG2 ILE 41 -7.350 -3.744 -2.335 302 2HG2 ILE 41 2HG2 ILE 41 -6.661 -3.523 -3.943 303 3HG2 ILE 41 3HG2 ILE 41 -8.374 -3.905 -3.760 304 1HD1 ILE 41 1HD1 ILE 41 -10.584 -1.783 -3.908 305 2HD1 ILE 41 2HD1 ILE 41 -11.189 -2.035 -2.271 306 3HD1 ILE 41 3HD1 ILE 41 -10.250 -3.298 -3.069 307 H TYR 42 H TYR 42 -4.236 -1.683 -2.191 308 HA TYR 42 HA TYR 42 -3.310 -1.174 -4.920 309 1HB TYR 42 1HB TYR 42 -2.184 -0.240 -2.790 310 2HB TYR 42 2HB TYR 42 -1.580 -1.871 -2.543 311 HD1 TYR 42 HD1 TYR 42 -0.298 1.026 -3.265 312 HD2 TYR 42 HD2 TYR 42 -0.868 -2.654 -5.327 313 HE1 TYR 42 HE1 TYR 42 1.641 1.531 -4.693 314 HE2 TYR 42 HE2 TYR 42 1.068 -2.157 -6.758 315 HH TYR 42 HH TYR 42 2.311 -0.111 -7.531 316 H TYR 43 H TYR 43 -3.218 -2.851 -6.283 317 HA TYR 43 HA TYR 43 -3.011 -5.561 -5.202 318 1HB TYR 43 1HB TYR 43 -3.452 -4.591 -8.038 319 2HB TYR 43 2HB TYR 43 -3.407 -6.280 -7.548 320 HD1 TYR 43 HD1 TYR 43 -5.213 -7.190 -6.091 321 HD2 TYR 43 HD2 TYR 43 -5.403 -3.260 -7.708 322 HE1 TYR 43 HE1 TYR 43 -7.627 -7.117 -5.619 323 HE2 TYR 43 HE2 TYR 43 -7.814 -3.181 -7.243 324 HH TYR 43 HH TYR 43 -9.399 -5.496 -5.284 325 H LEU 44 H LEU 44 -1.020 -6.154 -4.729 326 HA LEU 44 HA LEU 44 1.279 -4.843 -5.579 327 1HB LEU 44 1HB LEU 44 0.697 -7.349 -4.115 328 2HB LEU 44 2HB LEU 44 2.324 -7.152 -4.746 329 HG LEU 44 HG LEU 44 1.035 -5.016 -3.069 330 1HD1 LEU 44 1HD1 LEU 44 2.688 -7.330 -2.080 331 2HD1 LEU 44 2HD1 LEU 44 0.972 -7.071 -1.762 332 3HD1 LEU 44 3HD1 LEU 44 2.168 -5.939 -1.127 333 1HD2 LEU 44 1HD2 LEU 44 3.019 -4.423 -4.365 334 2HD2 LEU 44 2HD2 LEU 44 3.905 -5.753 -3.617 335 3HD2 LEU 44 3HD2 LEU 44 3.344 -4.402 -2.633 336 H ALA 45 H ALA 45 -0.044 -7.931 -6.743 337 HA ALA 45 HA ALA 45 2.153 -8.422 -8.490 338 1HB ALA 45 1HB ALA 45 0.816 -10.259 -9.365 339 2HB ALA 45 2HB ALA 45 -0.595 -9.657 -8.495 340 3HB ALA 45 3HB ALA 45 0.808 -10.246 -7.601 341 H THR 46 H THR 46 -0.935 -6.809 -8.859 342 HA THR 46 HA THR 46 -0.718 -6.784 -11.754 343 HB THR 46 HB THR 46 -2.773 -5.290 -10.130 344 HG1 THR 46 HG1 THR 46 -2.605 -8.067 -10.721 345 1HG2 THR 46 1HG2 THR 46 -2.872 -6.598 -12.855 346 2HG2 THR 46 2HG2 THR 46 -2.710 -4.871 -12.549 347 3HG2 THR 46 3HG2 THR 46 -4.187 -5.712 -12.082 348 H GLU 47 H GLU 47 0.295 -4.860 -9.158 349 HA GLU 47 HA GLU 47 1.230 -2.816 -8.930 350 1HB GLU 47 1HB GLU 47 1.534 -2.986 -11.932 351 2HB GLU 47 2HB GLU 47 2.282 -1.761 -10.916 352 1HG GLU 47 1HG GLU 47 3.232 -3.853 -9.653 353 2HG GLU 47 2HG GLU 47 2.923 -4.647 -11.197 354 H ASN 48 H ASN 48 -1.695 -3.143 -9.603 355 HA ASN 48 HA ASN 48 -2.221 -0.413 -10.555 356 1HB ASN 48 1HB ASN 48 -3.703 -2.980 -10.878 357 2HB ASN 48 2HB ASN 48 -4.649 -1.499 -10.743 358 1HD2 ASN 48 1HD2 ASN 48 -2.210 -3.173 -12.623 359 2HD2 ASN 48 2HD2 ASN 48 -2.447 -2.268 -14.079 360 H VAL 49 H VAL 49 -3.252 0.993 -9.289 361 HA VAL 49 HA VAL 49 -3.989 0.046 -6.591 362 HB VAL 49 HB VAL 49 -3.231 2.886 -7.228 363 1HG1 VAL 49 1HG1 VAL 49 -2.663 2.931 -4.840 364 2HG1 VAL 49 2HG1 VAL 49 -3.163 1.244 -4.703 365 3HG1 VAL 49 3HG1 VAL 49 -4.347 2.485 -5.113 366 1HG2 VAL 49 1HG2 VAL 49 -1.334 0.688 -6.415 367 2HG2 VAL 49 2HG2 VAL 49 -0.940 2.404 -6.529 368 3HG2 VAL 49 3HG2 VAL 49 -1.367 1.498 -7.981 369 H HIS 50 H HIS 50 -6.095 0.176 -6.133 370 HA HIS 50 HA HIS 50 -7.760 2.026 -7.701 371 1HB HIS 50 1HB HIS 50 -8.482 -0.422 -6.080 372 2HB HIS 50 2HB HIS 50 -9.679 0.669 -6.766 373 HD1 HIS 50 HD1 HIS 50 -10.594 -0.159 -8.896 374 HD2 HIS 50 HD2 HIS 50 -6.659 -1.383 -8.333 375 HE1 HIS 50 HE1 HIS 50 -10.029 -1.581 -10.892 376 HE2 HIS 50 HE2 HIS 50 -7.721 -2.483 -10.416 377 H ILE 51 H ILE 51 -7.662 3.954 -6.675 378 HA ILE 51 HA ILE 51 -7.921 4.042 -3.761 379 HB ILE 51 HB ILE 51 -7.456 6.317 -5.705 380 1HG1 ILE 51 1HG1 ILE 51 -5.162 6.292 -4.447 381 2HG1 ILE 51 2HG1 ILE 51 -5.573 4.618 -4.097 382 1HG2 ILE 51 1HG2 ILE 51 -8.547 7.078 -3.695 383 2HG2 ILE 51 2HG2 ILE 51 -6.865 7.609 -3.693 384 3HG2 ILE 51 3HG2 ILE 51 -7.359 6.240 -2.694 385 1HD1 ILE 51 1HD1 ILE 51 -5.738 4.167 -6.492 386 2HD1 ILE 51 2HD1 ILE 51 -4.146 4.783 -6.046 387 3HD1 ILE 51 3HD1 ILE 51 -5.317 5.843 -6.830 388 H VAL 52 H VAL 52 -10.029 3.757 -3.203 389 HA VAL 52 HA VAL 52 -12.111 5.129 -4.708 390 HB VAL 52 HB VAL 52 -12.450 3.437 -2.227 391 1HG1 VAL 52 1HG1 VAL 52 -14.387 4.325 -4.368 392 2HG1 VAL 52 2HG1 VAL 52 -14.345 4.874 -2.692 393 3HG1 VAL 52 3HG1 VAL 52 -14.765 3.201 -3.062 394 1HG2 VAL 52 1HG2 VAL 52 -12.604 2.603 -5.123 395 2HG2 VAL 52 2HG2 VAL 52 -13.041 1.599 -3.741 396 3HG2 VAL 52 3HG2 VAL 52 -11.369 2.114 -3.963 397 H LEU 53 H LEU 53 -12.309 7.215 -4.284 398 HA LEU 53 HA LEU 53 -11.482 8.388 -1.814 399 1HB LEU 53 1HB LEU 53 -13.109 9.617 -4.036 400 2HB LEU 53 2HB LEU 53 -12.226 10.478 -2.791 401 HG LEU 53 HG LEU 53 -10.970 8.766 -4.934 402 1HD1 LEU 53 1HD1 LEU 53 -11.972 10.790 -5.851 403 2HD1 LEU 53 2HD1 LEU 53 -10.210 10.872 -5.890 404 3HD1 LEU 53 3HD1 LEU 53 -11.107 11.762 -4.660 405 1HD2 LEU 53 1HD2 LEU 53 -9.746 10.581 -2.860 406 2HD2 LEU 53 2HD2 LEU 53 -8.873 9.758 -4.153 407 3HD2 LEU 53 3HD2 LEU 53 -9.660 8.819 -2.885 408 H LYS 54 H LYS 54 -12.925 9.857 -0.577 409 HA LYS 54 HA LYS 54 -15.195 8.514 0.425 410 1HB LYS 54 1HB LYS 54 -15.616 10.566 1.709 411 2HB LYS 54 2HB LYS 54 -13.917 10.116 1.779 412 1HG LYS 54 1HG LYS 54 -13.337 11.820 0.197 413 2HG LYS 54 2HG LYS 54 -15.039 12.193 -0.087 414 1HD LYS 54 1HD LYS 54 -15.246 12.877 2.279 415 2HD LYS 54 2HD LYS 54 -13.521 12.577 2.493 416 1HE LYS 54 1HE LYS 54 -14.683 14.534 0.513 417 2HE LYS 54 2HE LYS 54 -14.099 14.970 2.118 418 1HZ LYS 54 1HZ LYS 54 -12.445 15.375 0.394 419 2HZ LYS 54 2HZ LYS 54 -12.448 13.733 -0.025 420 3HZ LYS 54 3HZ LYS 54 -11.903 14.219 1.506 421 H ASN 55 H ASN 55 -14.721 10.642 -2.212 422 HA ASN 55 HA ASN 55 -17.550 11.301 -2.458 423 1HB ASN 55 1HB ASN 55 -15.699 12.994 -2.845 424 2HB ASN 55 2HB ASN 55 -15.290 12.097 -4.305 425 1HD2 ASN 55 1HD2 ASN 55 -15.758 13.834 -5.632 426 2HD2 ASN 55 2HD2 ASN 55 -17.377 14.356 -5.935 427 H ASP 56 H ASP 56 -16.272 8.572 -2.851 428 HA ASP 56 HA ASP 56 -16.993 6.720 -3.950 429 1HB ASP 56 1HB ASP 56 -19.173 7.538 -4.302 430 2HB ASP 56 2HB ASP 56 -18.631 8.719 -5.489 431 H ASN 57 H ASN 57 -15.859 9.387 -5.931 432 HA ASN 57 HA ASN 57 -15.210 8.024 -8.255 433 1HB ASN 57 1HB ASN 57 -15.124 10.462 -8.085 434 2HB ASN 57 2HB ASN 57 -13.759 10.353 -6.982 435 1HD2 ASN 57 1HD2 ASN 57 -11.727 9.948 -7.783 436 2HD2 ASN 57 2HD2 ASN 57 -11.364 9.953 -9.472 437 H THR 58 H THR 58 -13.757 6.549 -8.774 438 HA THR 58 HA THR 58 -11.705 5.873 -6.788 439 HB THR 58 HB THR 58 -12.801 4.146 -9.019 440 HG1 THR 58 HG1 THR 58 -13.961 4.844 -6.761 441 1HG2 THR 58 1HG2 THR 58 -11.730 2.314 -7.758 442 2HG2 THR 58 2HG2 THR 58 -11.052 3.500 -6.641 443 3HG2 THR 58 3HG2 THR 58 -10.556 3.499 -8.334 444 H VAL 59 H VAL 59 -9.690 6.380 -7.242 445 HA VAL 59 HA VAL 59 -8.924 7.027 -9.990 446 HB VAL 59 HB VAL 59 -7.303 7.334 -7.453 447 1HG1 VAL 59 1HG1 VAL 59 -6.935 8.480 -10.215 448 2HG1 VAL 59 2HG1 VAL 59 -5.927 7.256 -9.442 449 3HG1 VAL 59 3HG1 VAL 59 -5.966 8.899 -8.802 450 1HG2 VAL 59 1HG2 VAL 59 -8.940 9.402 -8.915 451 2HG2 VAL 59 2HG2 VAL 59 -7.912 9.692 -7.511 452 3HG2 VAL 59 3HG2 VAL 59 -9.349 8.676 -7.360 453 H LEU 60 H LEU 60 -7.595 5.749 -11.177 454 HA LEU 60 HA LEU 60 -6.574 3.309 -9.880 455 1HB LEU 60 1HB LEU 60 -8.287 2.844 -11.531 456 2HB LEU 60 2HB LEU 60 -7.427 3.786 -12.732 457 HG LEU 60 HG LEU 60 -5.604 2.153 -12.732 458 1HD1 LEU 60 1HD1 LEU 60 -7.319 0.612 -10.790 459 2HD1 LEU 60 2HD1 LEU 60 -5.785 1.399 -10.418 460 3HD1 LEU 60 3HD1 LEU 60 -5.829 0.042 -11.542 461 1HD2 LEU 60 1HD2 LEU 60 -6.813 0.315 -13.790 462 2HD2 LEU 60 2HD2 LEU 60 -7.459 1.878 -14.293 463 3HD2 LEU 60 3HD2 LEU 60 -8.324 0.907 -13.099 464 H LEU 61 H LEU 61 -4.474 3.533 -9.472 465 HA LEU 61 HA LEU 61 -2.801 5.000 -11.385 466 1HB LEU 61 1HB LEU 61 -1.909 3.892 -8.732 467 2HB LEU 61 2HB LEU 61 -1.130 5.123 -9.708 468 HG LEU 61 HG LEU 61 -3.730 5.456 -8.215 469 1HD1 LEU 61 1HD1 LEU 61 -2.453 7.028 -6.844 470 2HD1 LEU 61 2HD1 LEU 61 -0.989 6.615 -7.736 471 3HD1 LEU 61 3HD1 LEU 61 -1.792 5.397 -6.746 472 1HD2 LEU 61 1HD2 LEU 61 -3.693 6.723 -10.305 473 2HD2 LEU 61 2HD2 LEU 61 -2.147 7.436 -9.847 474 3HD2 LEU 61 3HD2 LEU 61 -3.595 7.789 -8.904 475 H LYS 62 H LYS 62 -0.770 4.116 -12.027 476 HA LYS 62 HA LYS 62 -0.638 1.183 -11.936 477 1HB LYS 62 1HB LYS 62 0.323 1.242 -14.222 478 2HB LYS 62 2HB LYS 62 -1.332 1.832 -14.169 479 1HG LYS 62 1HG LYS 62 -0.532 4.133 -14.246 480 2HG LYS 62 2HG LYS 62 1.134 3.559 -14.258 481 1HD LYS 62 1HD LYS 62 0.719 3.990 -16.499 482 2HD LYS 62 2HD LYS 62 0.421 2.256 -16.380 483 1HE LYS 62 1HE LYS 62 -1.727 4.369 -16.235 484 2HE LYS 62 2HE LYS 62 -1.275 3.520 -17.712 485 1HZ LYS 62 1HZ LYS 62 -3.169 2.455 -16.792 486 2HZ LYS 62 2HZ LYS 62 -2.468 2.349 -15.255 487 3HZ LYS 62 3HZ LYS 62 -1.849 1.418 -16.533 488 H GLY 63 H GLY 63 1.152 0.482 -11.006 489 1HA GLY 63 1HA GLY 63 3.342 2.102 -10.284 490 2HA GLY 63 2HA GLY 63 3.335 0.344 -10.298 491 H LEU 64 H LEU 64 3.931 -0.759 -12.240 492 HA LEU 64 HA LEU 64 5.336 0.944 -14.182 493 1HB LEU 64 1HB LEU 64 6.205 -1.726 -13.078 494 2HB LEU 64 2HB LEU 64 6.938 -0.967 -14.476 495 HG LEU 64 HG LEU 64 6.899 0.195 -11.689 496 1HD1 LEU 64 1HD1 LEU 64 9.149 -1.052 -13.260 497 2HD1 LEU 64 2HD1 LEU 64 8.330 -1.780 -11.879 498 3HD1 LEU 64 3HD1 LEU 64 9.278 -0.309 -11.665 499 1HD2 LEU 64 1HD2 LEU 64 8.272 1.127 -14.210 500 2HD2 LEU 64 2HD2 LEU 64 8.480 1.830 -12.606 501 3HD2 LEU 64 3HD2 LEU 64 6.913 1.920 -13.411 502 H LYS 65 H LYS 65 4.150 -2.422 -13.820 503 HA LYS 65 HA LYS 65 2.580 -2.198 -16.222 504 1HB LYS 65 1HB LYS 65 3.811 -4.034 -17.423 505 2HB LYS 65 2HB LYS 65 4.674 -2.506 -17.332 506 1HG LYS 65 1HG LYS 65 6.026 -3.367 -15.495 507 2HG LYS 65 2HG LYS 65 5.144 -4.889 -15.554 508 1HD LYS 65 1HD LYS 65 5.961 -5.284 -17.815 509 2HD LYS 65 2HD LYS 65 6.819 -3.744 -17.783 510 1HE LYS 65 1HE LYS 65 7.328 -6.130 -16.009 511 2HE LYS 65 2HE LYS 65 8.360 -5.551 -17.317 512 1HZ LYS 65 1HZ LYS 65 9.268 -4.785 -15.275 513 2HZ LYS 65 2HZ LYS 65 7.774 -4.186 -14.743 514 3HZ LYS 65 3HZ LYS 65 8.575 -3.437 -16.040 515 H ASN 66 H ASN 66 4.202 -4.532 -14.108 516 HA ASN 66 HA ASN 66 2.098 -5.773 -12.914 517 1HB ASN 66 1HB ASN 66 1.235 -6.373 -15.153 518 2HB ASN 66 2HB ASN 66 2.759 -7.169 -15.531 519 1HD2 ASN 66 1HD2 ASN 66 3.218 -9.164 -14.607 520 2HD2 ASN 66 2HD2 ASN 66 2.015 -10.104 -13.801 521 H ILE 67 H ILE 67 3.015 -7.096 -11.400 522 HA ILE 67 HA ILE 67 5.617 -8.253 -12.058 523 HB ILE 67 HB ILE 67 6.089 -6.189 -10.851 524 1HG1 ILE 67 1HG1 ILE 67 7.432 -7.181 -8.974 525 2HG1 ILE 67 2HG1 ILE 67 6.650 -8.725 -9.314 526 1HG2 ILE 67 1HG2 ILE 67 5.464 -5.886 -8.510 527 2HG2 ILE 67 2HG2 ILE 67 4.484 -7.348 -8.590 528 3HG2 ILE 67 3HG2 ILE 67 4.052 -5.949 -9.568 529 1HD1 ILE 67 1HD1 ILE 67 8.320 -7.148 -11.258 530 2HD1 ILE 67 2HD1 ILE 67 7.573 -8.718 -11.556 531 3HD1 ILE 67 3HD1 ILE 67 8.854 -8.564 -10.352 532 H VAL 68 H VAL 68 4.997 -10.310 -12.153 533 HA VAL 68 HA VAL 68 3.087 -11.375 -10.245 534 HB VAL 68 HB VAL 68 3.027 -11.868 -12.708 535 1HG1 VAL 68 1HG1 VAL 68 5.390 -13.627 -12.079 536 2HG1 VAL 68 2HG1 VAL 68 5.390 -12.195 -13.110 537 3HG1 VAL 68 3HG1 VAL 68 4.481 -13.626 -13.592 538 1HG2 VAL 68 1HG2 VAL 68 2.342 -14.191 -12.447 539 2HG2 VAL 68 2HG2 VAL 68 1.770 -13.199 -11.103 540 3HG2 VAL 68 3HG2 VAL 68 3.161 -14.264 -10.885 541 H SER 69 H SER 69 5.764 -10.592 -9.341 542 HA SER 69 HA SER 69 7.119 -13.048 -8.657 543 1HB SER 69 1HB SER 69 7.562 -10.222 -7.664 544 2HB SER 69 2HB SER 69 8.646 -11.589 -7.395 545 HG SER 69 HG SER 69 8.183 -11.463 -9.989 546 H VAL 70 H VAL 70 4.418 -11.474 -7.523 547 HA VAL 70 HA VAL 70 4.661 -11.940 -4.727 548 HB VAL 70 HB VAL 70 2.154 -11.644 -6.398 549 1HG1 VAL 70 1HG1 VAL 70 1.726 -12.710 -4.233 550 2HG1 VAL 70 2HG1 VAL 70 1.033 -11.091 -4.311 551 3HG1 VAL 70 3HG1 VAL 70 2.527 -11.365 -3.417 552 1HG2 VAL 70 1HG2 VAL 70 2.167 -9.314 -5.606 553 2HG2 VAL 70 2HG2 VAL 70 3.583 -9.694 -6.588 554 3HG2 VAL 70 3HG2 VAL 70 3.726 -9.601 -4.833 555 H LYS 71 H LYS 71 4.690 -13.835 -3.759 556 HA LYS 71 HA LYS 71 3.856 -16.210 -5.226 557 1HB LYS 71 1HB LYS 71 5.304 -15.953 -2.581 558 2HB LYS 71 2HB LYS 71 5.029 -17.451 -3.459 559 1HG LYS 71 1HG LYS 71 6.668 -15.127 -4.450 560 2HG LYS 71 2HG LYS 71 7.310 -16.609 -3.736 561 1HD LYS 71 1HD LYS 71 6.352 -17.921 -5.544 562 2HD LYS 71 2HD LYS 71 5.632 -16.465 -6.240 563 1HE LYS 71 1HE LYS 71 7.856 -15.534 -6.605 564 2HE LYS 71 2HE LYS 71 8.585 -16.964 -5.876 565 1HZ LYS 71 1HZ LYS 71 8.623 -17.051 -8.295 566 2HZ LYS 71 2HZ LYS 71 6.928 -16.956 -8.345 567 3HZ LYS 71 3HZ LYS 71 7.689 -18.308 -7.652 568 H PHE 72 H PHE 72 2.556 -17.854 -4.182 569 HA PHE 72 HA PHE 72 0.379 -16.757 -2.641 570 1HB PHE 72 1HB PHE 72 0.888 -19.637 -3.437 571 2HB PHE 72 2HB PHE 72 -0.629 -18.971 -2.842 572 HD1 PHE 72 HD1 PHE 72 1.523 -19.433 -5.708 573 HD2 PHE 72 HD2 PHE 72 -1.925 -17.411 -4.254 574 HE1 PHE 72 HE1 PHE 72 0.844 -18.943 -8.020 575 HE2 PHE 72 HE2 PHE 72 -2.611 -16.918 -6.564 576 HZ PHE 72 HZ PHE 72 -1.231 -17.685 -8.450 577 H SER 73 H SER 73 1.735 -16.135 -0.824 578 HA SER 73 HA SER 73 2.452 -18.405 0.906 579 1HB SER 73 1HB SER 73 3.772 -15.682 0.806 580 2HB SER 73 2HB SER 73 4.255 -17.038 1.828 581 HG SER 73 HG SER 73 5.286 -16.571 -0.407 582 H LYS 74 H LYS 74 2.703 -17.589 3.261 583 HA LYS 74 HA LYS 74 0.539 -15.756 4.002 584 1HB LYS 74 1HB LYS 74 -0.187 -17.456 5.729 585 2HB LYS 74 2HB LYS 74 -0.539 -17.895 4.062 586 1HG LYS 74 1HG LYS 74 1.572 -19.256 4.079 587 2HG LYS 74 2HG LYS 74 1.665 -18.951 5.814 588 1HD LYS 74 1HD LYS 74 -0.428 -20.075 6.179 589 2HD LYS 74 2HD LYS 74 -0.691 -20.241 4.440 590 1HE LYS 74 1HE LYS 74 1.348 -21.623 4.300 591 2HE LYS 74 2HE LYS 74 1.515 -21.516 6.051 592 1HZ LYS 74 1HZ LYS 74 0.450 -23.579 5.257 593 2HZ LYS 74 2HZ LYS 74 -0.855 -22.669 4.678 594 3HZ LYS 74 3HZ LYS 74 -0.514 -22.707 6.342 595 H ASP 75 H ASP 75 3.326 -15.363 4.002 596 HA ASP 75 HA ASP 75 4.451 -16.006 6.560 597 1HB ASP 75 1HB ASP 75 5.405 -14.369 4.221 598 2HB ASP 75 2HB ASP 75 6.301 -14.437 5.729 599 H ARG 76 H ARG 76 2.745 -14.990 7.845 600 HA ARG 76 HA ARG 76 2.406 -12.189 7.937 601 1HB ARG 76 1HB ARG 76 1.965 -14.314 10.033 602 2HB ARG 76 2HB ARG 76 1.529 -12.626 10.260 603 1HG ARG 76 1HG ARG 76 0.040 -12.773 8.308 604 2HG ARG 76 2HG ARG 76 0.437 -14.484 8.162 605 1HD ARG 76 1HD ARG 76 -0.799 -13.209 10.596 606 2HD ARG 76 2HD ARG 76 -1.707 -14.050 9.341 607 HE ARG 76 HE ARG 76 -0.098 -15.988 10.017 608 1HH1 ARG 76 1HH1 ARG 76 -1.643 -13.653 12.127 609 2HH1 ARG 76 2HH1 ARG 76 -1.678 -14.721 13.498 610 1HH2 ARG 76 1HH2 ARG 76 -0.172 -17.407 11.803 611 2HH2 ARG 76 2HH2 ARG 76 -0.849 -16.864 13.313 612 H HIS 77 H HIS 77 4.725 -14.362 9.408 613 HA HIS 77 HA HIS 77 5.851 -12.501 11.220 614 1HB HIS 77 1HB HIS 77 6.990 -14.983 9.931 615 2HB HIS 77 2HB HIS 77 7.871 -14.028 11.120 616 HD1 HIS 77 HD1 HIS 77 5.391 -16.695 10.800 617 HD2 HIS 77 HD2 HIS 77 6.592 -14.004 13.730 618 HE1 HIS 77 HE1 HIS 77 4.491 -17.603 12.962 619 HE2 HIS 77 HE2 HIS 77 5.078 -15.867 14.694 620 H LEU 78 H LEU 78 6.382 -13.163 7.815 621 HA LEU 78 HA LEU 78 8.701 -11.516 7.588 622 1HB LEU 78 1HB LEU 78 8.131 -13.303 5.965 623 2HB LEU 78 2HB LEU 78 6.756 -12.355 5.437 624 HG LEU 78 HG LEU 78 8.259 -10.596 4.623 625 1HD1 LEU 78 1HD1 LEU 78 10.473 -12.456 5.480 626 2HD1 LEU 78 2HD1 LEU 78 10.079 -10.903 6.222 627 3HD1 LEU 78 3HD1 LEU 78 10.672 -10.966 4.560 628 1HD2 LEU 78 1HD2 LEU 78 9.239 -11.837 2.757 629 2HD2 LEU 78 2HD2 LEU 78 7.601 -12.386 3.103 630 3HD2 LEU 78 3HD2 LEU 78 8.983 -13.349 3.625 631 H ILE 79 H ILE 79 5.229 -11.027 7.179 632 HA ILE 79 HA ILE 79 5.275 -8.372 6.272 633 HB ILE 79 HB ILE 79 3.240 -9.648 8.115 634 1HG1 ILE 79 1HG1 ILE 79 3.258 -9.442 5.095 635 2HG1 ILE 79 2HG1 ILE 79 3.602 -10.907 6.008 636 1HG2 ILE 79 1HG2 ILE 79 1.703 -7.956 7.214 637 2HG2 ILE 79 2HG2 ILE 79 3.036 -7.240 6.308 638 3HG2 ILE 79 3HG2 ILE 79 3.059 -7.225 8.072 639 1HD1 ILE 79 1HD1 ILE 79 1.323 -10.858 5.113 640 2HD1 ILE 79 2HD1 ILE 79 0.993 -9.409 6.063 641 3HD1 ILE 79 3HD1 ILE 79 1.349 -10.933 6.876 642 H GLU 80 H GLU 80 5.129 -9.681 9.589 643 HA GLU 80 HA GLU 80 5.207 -7.307 11.020 644 1HB GLU 80 1HB GLU 80 6.465 -9.974 11.667 645 2HB GLU 80 2HB GLU 80 6.317 -8.655 12.809 646 1HG GLU 80 1HG GLU 80 3.856 -8.758 12.524 647 2HG GLU 80 2HG GLU 80 4.086 -10.193 11.524 648 H THR 81 H THR 81 7.899 -9.307 9.892 649 HA THR 81 HA THR 81 9.979 -7.740 10.907 650 HB THR 81 HB THR 81 10.056 -9.449 8.410 651 HG1 THR 81 HG1 THR 81 9.368 -10.783 10.034 652 1HG2 THR 81 1HG2 THR 81 12.232 -8.614 10.335 653 2HG2 THR 81 2HG2 THR 81 12.030 -8.034 8.682 654 3HG2 THR 81 3HG2 THR 81 12.431 -9.724 8.977 655 H THR 82 H THR 82 8.277 -7.596 7.797 656 HA THR 82 HA THR 82 9.949 -5.668 6.595 657 HB THR 82 HB THR 82 7.023 -6.205 6.038 658 HG1 THR 82 HG1 THR 82 8.177 -8.103 5.754 659 1HG2 THR 82 1HG2 THR 82 7.831 -4.115 5.050 660 2HG2 THR 82 2HG2 THR 82 7.531 -5.330 3.808 661 3HG2 THR 82 3HG2 THR 82 9.184 -4.978 4.319 662 H SER 83 H SER 83 6.851 -5.328 8.329 663 HA SER 83 HA SER 83 6.677 -2.526 8.081 664 1HB SER 83 1HB SER 83 4.810 -4.117 8.717 665 2HB SER 83 2HB SER 83 5.529 -4.203 10.323 666 HG SER 83 HG SER 83 3.948 -2.279 9.221 667 H ASN 84 H ASN 84 8.053 -4.620 10.583 668 HA ASN 84 HA ASN 84 8.798 -2.577 12.385 669 1HB ASN 84 1HB ASN 84 8.697 -4.967 12.996 670 2HB ASN 84 2HB ASN 84 10.069 -5.290 11.943 671 1HD2 ASN 84 1HD2 ASN 84 11.401 -6.033 13.527 672 2HD2 ASN 84 2HD2 ASN 84 12.040 -5.041 14.790 673 H LYS 85 H LYS 85 10.437 -4.069 9.648 674 HA LYS 85 HA LYS 85 12.961 -2.875 10.033 675 1HB LYS 85 1HB LYS 85 12.521 -4.846 8.588 676 2HB LYS 85 2HB LYS 85 11.684 -3.799 7.453 677 1HG LYS 85 1HG LYS 85 13.653 -2.736 6.797 678 2HG LYS 85 2HG LYS 85 14.540 -3.306 8.214 679 1HD LYS 85 1HD LYS 85 15.213 -4.538 6.220 680 2HD LYS 85 2HD LYS 85 14.408 -5.605 7.368 681 1HE LYS 85 1HE LYS 85 12.311 -5.344 6.060 682 2HE LYS 85 2HE LYS 85 13.213 -4.405 4.870 683 1HZ LYS 85 1HZ LYS 85 14.670 -6.356 4.557 684 2HZ LYS 85 2HZ LYS 85 13.057 -6.676 4.142 685 3HZ LYS 85 3HZ LYS 85 13.681 -7.247 5.608 686 H LEU 86 H LEU 86 10.069 -1.827 8.289 687 HA LEU 86 HA LEU 86 11.210 0.550 7.219 688 1HB LEU 86 1HB LEU 86 9.143 -0.348 6.314 689 2HB LEU 86 2HB LEU 86 8.345 -0.162 7.863 690 HG LEU 86 HG LEU 86 8.648 2.318 7.648 691 1HD1 LEU 86 1HD1 LEU 86 10.521 2.280 6.076 692 2HD1 LEU 86 2HD1 LEU 86 9.177 3.245 5.469 693 3HD1 LEU 86 3HD1 LEU 86 9.460 1.627 4.831 694 1HD2 LEU 86 1HD2 LEU 86 7.079 0.946 5.468 695 2HD2 LEU 86 2HD2 LEU 86 6.852 2.610 6.006 696 3HD2 LEU 86 3HD2 LEU 86 6.522 1.276 7.110 697 H LYS 87 H LYS 87 9.286 -0.145 10.096 698 HA LYS 87 HA LYS 87 9.063 2.421 11.142 699 1HB LYS 87 1HB LYS 87 7.827 0.400 11.907 700 2HB LYS 87 2HB LYS 87 9.303 -0.180 12.667 701 1HG LYS 87 1HG LYS 87 9.298 1.816 14.121 702 2HG LYS 87 2HG LYS 87 7.756 2.297 13.404 703 1HD LYS 87 1HD LYS 87 6.794 0.132 14.147 704 2HD LYS 87 2HD LYS 87 8.318 -0.232 14.956 705 1HE LYS 87 1HE LYS 87 8.041 1.819 16.315 706 2HE LYS 87 2HE LYS 87 6.471 2.076 15.556 707 1HZ LYS 87 1HZ LYS 87 6.096 1.007 17.621 708 2HZ LYS 87 2HZ LYS 87 7.275 -0.171 17.317 709 3HZ LYS 87 3HZ LYS 87 5.833 -0.164 16.421 710 H SER 88 H SER 88 11.725 0.168 11.269 711 HA SER 88 HA SER 88 13.088 1.717 13.322 712 1HB SER 88 1HB SER 88 13.990 -0.817 11.938 713 2HB SER 88 2HB SER 88 14.662 -0.120 13.415 714 HG SER 88 HG SER 88 12.089 -1.256 13.026 715 H ARG 89 H ARG 89 13.859 0.520 10.024 716 HA ARG 89 HA ARG 89 16.241 2.221 10.099 717 1HB ARG 89 1HB ARG 89 15.504 -0.048 8.251 718 2HB ARG 89 2HB ARG 89 16.989 0.886 8.146 719 1HG ARG 89 1HG ARG 89 17.502 0.154 10.486 720 2HG ARG 89 2HG ARG 89 16.125 -0.943 10.367 721 1HD ARG 89 1HD ARG 89 18.215 -2.087 9.847 722 2HD ARG 89 2HD ARG 89 17.151 -2.034 8.440 723 HE ARG 89 HE ARG 89 18.791 0.181 8.241 724 1HH1 ARG 89 1HH1 ARG 89 19.220 -3.296 8.353 725 2HH1 ARG 89 2HH1 ARG 89 20.673 -3.270 7.390 726 1HH2 ARG 89 1HH2 ARG 89 20.689 0.219 6.985 727 2HH2 ARG 89 2HH2 ARG 89 21.507 -1.269 6.608 728 H GLU 90 H GLU 90 13.155 2.517 8.963 729 HA GLU 90 HA GLU 90 12.139 3.841 7.408 730 1HB GLU 90 1HB GLU 90 14.815 5.246 7.452 731 2HB GLU 90 2HB GLU 90 13.345 5.896 6.742 732 1HG GLU 90 1HG GLU 90 12.298 6.041 8.884 733 2HG GLU 90 2HG GLU 90 13.633 5.177 9.649 734 H ILE 91 H ILE 91 12.856 1.555 6.280 735 HA ILE 91 HA ILE 91 14.698 1.730 4.136 736 HB ILE 91 HB ILE 91 13.699 -0.371 3.324 737 1HG1 ILE 91 1HG1 ILE 91 11.771 -0.038 5.634 738 2HG1 ILE 91 2HG1 ILE 91 11.351 0.122 3.933 739 1HG2 ILE 91 1HG2 ILE 91 15.432 -0.462 5.005 740 2HG2 ILE 91 2HG2 ILE 91 14.247 -1.733 5.306 741 3HG2 ILE 91 3HG2 ILE 91 14.239 -0.267 6.289 742 1HD1 ILE 91 1HD1 ILE 91 11.919 -2.218 3.571 743 2HD1 ILE 91 2HD1 ILE 91 10.680 -2.036 4.816 744 3HD1 ILE 91 3HD1 ILE 91 12.349 -2.378 5.275 745 H THR 92 H THR 92 14.240 1.661 1.875 746 HA THR 92 HA THR 92 12.522 3.685 0.997 747 HB THR 92 HB THR 92 13.273 1.610 -0.970 748 HG1 THR 92 HG1 THR 92 15.255 1.446 -0.275 749 1HG2 THR 92 1HG2 THR 92 12.433 3.777 -1.687 750 2HG2 THR 92 2HG2 THR 92 14.116 3.592 -2.181 751 3HG2 THR 92 3HG2 THR 92 13.710 4.594 -0.787 752 H PHE 93 H PHE 93 10.687 3.529 -0.442 753 HA PHE 93 HA PHE 93 8.674 1.806 0.451 754 1HB PHE 93 1HB PHE 93 8.335 4.022 -0.700 755 2HB PHE 93 2HB PHE 93 8.761 3.239 -2.217 756 HD1 PHE 93 HD1 PHE 93 7.160 2.027 -3.444 757 HD2 PHE 93 HD2 PHE 93 6.303 3.250 0.540 758 HE1 PHE 93 HE1 PHE 93 4.808 1.380 -3.757 759 HE2 PHE 93 HE2 PHE 93 3.946 2.603 0.234 760 HZ PHE 93 HZ PHE 93 3.196 1.667 -1.915 761 H GLN 94 H GLN 94 11.035 1.562 -2.070 762 HA GLN 94 HA GLN 94 10.097 -0.628 -3.531 763 1HB GLN 94 1HB GLN 94 11.984 0.693 -4.269 764 2HB GLN 94 2HB GLN 94 12.908 0.241 -2.847 765 1HG GLN 94 1HG GLN 94 12.894 -2.100 -3.629 766 2HG GLN 94 2HG GLN 94 12.064 -1.573 -5.093 767 1HE2 GLN 94 1HE2 GLN 94 15.037 -1.475 -3.284 768 2HE2 GLN 94 2HE2 GLN 94 16.040 -0.910 -4.586 769 H GLU 95 H GLU 95 12.377 -0.580 -0.794 770 HA GLU 95 HA GLU 95 12.620 -3.337 -0.453 771 1HB GLU 95 1HB GLU 95 13.034 -0.977 1.344 772 2HB GLU 95 2HB GLU 95 13.102 -2.593 2.024 773 1HG GLU 95 1HG GLU 95 15.315 -1.722 1.445 774 2HG GLU 95 2HG GLU 95 14.914 -3.191 0.557 775 H TYR 96 H TYR 96 10.359 -1.049 0.994 776 HA TYR 96 HA TYR 96 9.147 -2.784 2.823 777 1HB TYR 96 1HB TYR 96 8.916 -0.280 2.727 778 2HB TYR 96 2HB TYR 96 7.819 -0.490 1.367 779 HD1 TYR 96 HD1 TYR 96 8.242 -1.857 4.819 780 HD2 TYR 96 HD2 TYR 96 5.571 -0.362 1.867 781 HE1 TYR 96 HE1 TYR 96 6.378 -2.081 6.401 782 HE2 TYR 96 HE2 TYR 96 3.696 -0.584 3.446 783 HH TYR 96 HH TYR 96 3.175 -1.985 5.518 784 H ARG 97 H ARG 97 8.027 -1.816 -0.407 785 HA ARG 97 HA ARG 97 5.798 -3.535 -0.442 786 1HB ARG 97 1HB ARG 97 5.619 -1.758 -1.892 787 2HB ARG 97 2HB ARG 97 7.278 -1.911 -2.463 788 1HG ARG 97 1HG ARG 97 6.627 -3.935 -3.707 789 2HG ARG 97 2HG ARG 97 4.964 -3.696 -3.172 790 1HD ARG 97 1HD ARG 97 4.922 -1.520 -4.295 791 2HD ARG 97 2HD ARG 97 6.581 -1.778 -4.841 792 HE ARG 97 HE ARG 97 4.672 -3.826 -5.589 793 1HH1 ARG 97 1HH1 ARG 97 6.316 -0.893 -6.549 794 2HH1 ARG 97 2HH1 ARG 97 6.091 -1.171 -8.245 795 1HH2 ARG 97 1HH2 ARG 97 4.376 -4.189 -7.827 796 2HH2 ARG 97 2HH2 ARG 97 4.984 -3.029 -8.977 797 H ARG 98 H ARG 98 9.110 -3.966 -1.564 798 HA ARG 98 HA ARG 98 8.755 -6.288 -3.088 799 1HB ARG 98 1HB ARG 98 10.796 -5.024 -3.229 800 2HB ARG 98 2HB ARG 98 11.142 -5.301 -1.529 801 1HG ARG 98 1HG ARG 98 11.482 -7.666 -1.956 802 2HG ARG 98 2HG ARG 98 11.068 -7.431 -3.657 803 1HD ARG 98 1HD ARG 98 12.986 -6.000 -3.969 804 2HD ARG 98 2HD ARG 98 13.364 -6.078 -2.247 805 HE ARG 98 HE ARG 98 13.670 -8.562 -2.685 806 1HH1 ARG 98 1HH1 ARG 98 14.295 -6.107 -5.105 807 2HH1 ARG 98 2HH1 ARG 98 15.463 -7.060 -5.963 808 1HH2 ARG 98 1HH2 ARG 98 15.223 -9.803 -3.779 809 2HH2 ARG 98 2HH2 ARG 98 15.998 -9.168 -5.201 810 H ASN 99 H ASN 99 9.598 -5.946 0.353 811 HA ASN 99 HA ASN 99 9.859 -8.750 0.766 812 1HB ASN 99 1HB ASN 99 9.664 -6.403 2.636 813 2HB ASN 99 2HB ASN 99 9.709 -8.056 3.242 814 1HD2 ASN 99 1HD2 ASN 99 11.483 -5.553 1.596 815 2HD2 ASN 99 2HD2 ASN 99 13.047 -6.285 1.743 816 H LEU 100 H LEU 100 7.195 -6.483 1.058 817 HA LEU 100 HA LEU 100 5.417 -8.218 2.425 818 1HB LEU 100 1HB LEU 100 4.863 -5.912 0.559 819 2HB LEU 100 2HB LEU 100 3.637 -6.725 1.514 820 HG LEU 100 HG LEU 100 6.000 -5.226 2.655 821 1HD1 LEU 100 1HD1 LEU 100 4.351 -3.548 3.308 822 2HD1 LEU 100 2HD1 LEU 100 3.097 -4.445 2.452 823 3HD1 LEU 100 3HD1 LEU 100 4.434 -3.723 1.557 824 1HD2 LEU 100 1HD2 LEU 100 4.784 -5.442 4.774 825 2HD2 LEU 100 2HD2 LEU 100 5.244 -7.013 4.114 826 3HD2 LEU 100 3HD2 LEU 100 3.578 -6.449 3.971 827 H ALA 101 H ALA 101 6.143 -7.678 -0.973 828 HA ALA 101 HA ALA 101 4.045 -9.177 -2.088 829 1HB ALA 101 1HB ALA 101 5.395 -9.232 -4.119 830 2HB ALA 101 2HB ALA 101 6.805 -8.694 -3.204 831 3HB ALA 101 3HB ALA 101 5.413 -7.627 -3.389 832 H LYS 102 H LYS 102 7.283 -10.110 -1.006 833 HA LYS 102 HA LYS 102 7.094 -12.804 -1.926 834 1HB LYS 102 1HB LYS 102 9.252 -11.669 -1.440 835 2HB LYS 102 2HB LYS 102 8.851 -11.697 0.273 836 1HG LYS 102 1HG LYS 102 8.705 -14.199 0.093 837 2HG LYS 102 2HG LYS 102 9.376 -14.043 -1.531 838 1HD LYS 102 1HD LYS 102 11.367 -12.977 -0.606 839 2HD LYS 102 2HD LYS 102 10.688 -13.102 1.019 840 1HE LYS 102 1HE LYS 102 10.615 -15.564 0.747 841 2HE LYS 102 2HE LYS 102 11.407 -15.384 -0.818 842 1HZ LYS 102 1HZ LYS 102 13.032 -15.923 0.824 843 2HZ LYS 102 2HZ LYS 102 12.522 -14.664 1.839 844 3HZ LYS 102 3HZ LYS 102 13.277 -14.307 0.363 845 H ALA 103 H ALA 103 5.939 -11.136 0.872 846 HA ALA 103 HA ALA 103 5.764 -13.369 2.626 847 1HB ALA 103 1HB ALA 103 4.226 -10.779 2.697 848 2HB ALA 103 2HB ALA 103 5.808 -11.053 3.427 849 3HB ALA 103 3HB ALA 103 4.397 -11.928 4.023 850 H GLY 104 H GLY 104 3.968 -12.467 -0.096 851 1HA GLY 104 1HA GLY 104 2.373 -13.974 -1.033 852 2HA GLY 104 2HA GLY 104 1.937 -14.478 0.594 853 H VAL 105 H VAL 105 2.300 -11.153 0.392 854 HA VAL 105 HA VAL 105 -0.537 -10.742 0.696 855 HB VAL 105 HB VAL 105 1.683 -8.692 0.548 856 1HG1 VAL 105 1HG1 VAL 105 -1.138 -8.476 1.595 857 2HG1 VAL 105 2HG1 VAL 105 -0.509 -7.736 0.123 858 3HG1 VAL 105 3HG1 VAL 105 0.095 -7.218 1.695 859 1HG2 VAL 105 1HG2 VAL 105 0.428 -9.988 2.968 860 2HG2 VAL 105 2HG2 VAL 105 1.612 -8.681 2.991 861 3HG2 VAL 105 3HG2 VAL 105 2.064 -10.269 2.371 862 H PHE 106 H PHE 106 -1.838 -10.584 -0.996 863 HA PHE 106 HA PHE 106 -0.783 -9.533 -3.521 864 1HB PHE 106 1HB PHE 106 -1.925 -11.709 -3.640 865 2HB PHE 106 2HB PHE 106 -3.372 -10.992 -2.936 866 HD1 PHE 106 HD1 PHE 106 -4.930 -9.836 -4.269 867 HD2 PHE 106 HD2 PHE 106 -1.177 -10.983 -5.905 868 HE1 PHE 106 HE1 PHE 106 -5.734 -9.248 -6.516 869 HE2 PHE 106 HE2 PHE 106 -1.977 -10.403 -8.158 870 HZ PHE 106 HZ PHE 106 -4.258 -9.530 -8.467 871 H ARG 107 H ARG 107 -3.080 -8.968 -0.975 872 HA ARG 107 HA ARG 107 -3.852 -6.431 -2.270 873 1HB ARG 107 1HB ARG 107 -5.464 -7.989 -0.240 874 2HB ARG 107 2HB ARG 107 -5.944 -6.503 -1.035 875 1HG ARG 107 1HG ARG 107 -6.033 -7.708 -3.180 876 2HG ARG 107 2HG ARG 107 -5.612 -9.203 -2.327 877 1HD ARG 107 1HD ARG 107 -7.604 -8.898 -0.891 878 2HD ARG 107 2HD ARG 107 -8.042 -7.478 -1.835 879 HE ARG 107 HE ARG 107 -7.773 -9.675 -3.569 880 1HH1 ARG 107 1HH1 ARG 107 -9.859 -8.521 -0.996 881 2HH1 ARG 107 2HH1 ARG 107 -11.271 -9.333 -1.597 882 1HH2 ARG 107 1HH2 ARG 107 -9.647 -10.722 -4.378 883 2HH2 ARG 107 2HH2 ARG 107 -11.149 -10.576 -3.514 884 H TRP 108 H TRP 108 -2.362 -5.045 -1.262 885 HA TRP 108 HA TRP 108 -2.703 -4.939 1.644 886 1HB TRP 108 1HB TRP 108 -0.760 -3.349 1.677 887 2HB TRP 108 2HB TRP 108 -0.368 -4.990 1.197 888 HD1 TRP 108 HD1 TRP 108 -1.447 -4.250 -1.944 889 HE1 TRP 108 HE1 TRP 108 0.262 -3.045 -3.429 890 HE3 TRP 108 HE3 TRP 108 1.726 -2.525 1.661 891 HZ2 TRP 108 HZ2 TRP 108 2.643 -1.573 -3.129 892 HZ3 TRP 108 HZ3 TRP 108 3.703 -1.246 0.989 893 HH2 TRP 108 HH2 TRP 108 4.157 -0.772 -1.363 894 H VAL 109 H VAL 109 -4.376 -3.886 2.133 895 HA VAL 109 HA VAL 109 -5.199 -1.577 0.498 896 HB VAL 109 HB VAL 109 -6.938 -3.297 2.277 897 1HG1 VAL 109 1HG1 VAL 109 -7.622 -1.279 0.147 898 2HG1 VAL 109 2HG1 VAL 109 -7.840 -1.090 1.887 899 3HG1 VAL 109 3HG1 VAL 109 -8.782 -2.292 1.007 900 1HG2 VAL 109 1HG2 VAL 109 -6.041 -4.672 0.489 901 2HG2 VAL 109 2HG2 VAL 109 -6.537 -3.475 -0.706 902 3HG2 VAL 109 3HG2 VAL 109 -7.754 -4.354 0.218 903 H THR 110 H THR 110 -4.829 0.313 1.470 904 HA THR 110 HA THR 110 -4.694 0.365 4.396 905 HB THR 110 HB THR 110 -3.938 2.594 2.497 906 HG1 THR 110 HG1 THR 110 -2.764 0.346 2.543 907 1HG2 THR 110 1HG2 THR 110 -2.618 3.395 4.405 908 2HG2 THR 110 2HG2 THR 110 -3.208 2.048 5.379 909 3HG2 THR 110 3HG2 THR 110 -4.330 3.285 4.812 910 H ASN 111 H ASN 111 -6.657 0.594 5.237 911 HA ASN 111 HA ASN 111 -8.597 2.376 3.987 912 1HB ASN 111 1HB ASN 111 -8.804 0.452 6.312 913 2HB ASN 111 2HB ASN 111 -10.109 1.530 5.835 914 1HD2 ASN 111 1HD2 ASN 111 -11.502 -0.114 5.327 915 2HD2 ASN 111 2HD2 ASN 111 -11.289 -1.131 3.948 916 H ILE 112 H ILE 112 -8.208 4.450 4.430 917 HA ILE 112 HA ILE 112 -7.186 5.397 6.909 918 HB ILE 112 HB ILE 112 -8.486 6.762 4.559 919 1HG1 ILE 112 1HG1 ILE 112 -6.279 7.915 4.449 920 2HG1 ILE 112 2HG1 ILE 112 -5.744 6.961 5.825 921 1HG2 ILE 112 1HG2 ILE 112 -9.306 7.971 6.496 922 2HG2 ILE 112 2HG2 ILE 112 -8.117 8.939 5.628 923 3HG2 ILE 112 3HG2 ILE 112 -7.663 8.121 7.122 924 1HD1 ILE 112 1HD1 ILE 112 -4.892 6.070 3.738 925 2HD1 ILE 112 2HD1 ILE 112 -6.539 5.878 3.135 926 3HD1 ILE 112 3HD1 ILE 112 -5.989 4.927 4.515 927 H HIS 113 H HIS 113 -10.363 4.881 5.563 928 HA HIS 113 HA HIS 113 -11.904 6.191 7.512 929 1HB HIS 113 1HB HIS 113 -12.690 5.343 5.271 930 2HB HIS 113 2HB HIS 113 -12.687 3.721 5.955 931 HD1 HIS 113 HD1 HIS 113 -14.595 3.100 7.575 932 HD2 HIS 113 HD2 HIS 113 -14.755 7.022 6.173 933 HE1 HIS 113 HE1 HIS 113 -16.886 3.956 8.181 934 HE2 HIS 113 HE2 HIS 113 -16.936 6.348 7.383 935 H GLU 114 H GLU 114 -10.445 3.002 7.434 936 HA GLU 114 HA GLU 114 -11.766 2.273 9.947 937 1HB GLU 114 1HB GLU 114 -10.043 0.571 8.136 938 2HB GLU 114 2HB GLU 114 -10.987 0.011 9.510 939 1HG GLU 114 1HG GLU 114 -12.087 1.179 6.963 940 2HG GLU 114 2HG GLU 114 -12.089 -0.523 7.416 941 H GLN 115 H GLN 115 -8.954 3.647 8.829 942 HA GLN 115 HA GLN 115 -6.955 4.194 9.732 943 1HB GLN 115 1HB GLN 115 -8.652 4.519 11.745 944 2HB GLN 115 2HB GLN 115 -7.742 3.178 12.424 945 1HG GLN 115 1HG GLN 115 -6.816 5.237 13.219 946 2HG GLN 115 2HG GLN 115 -5.666 4.485 12.113 947 1HE2 GLN 115 1HE2 GLN 115 -5.261 5.441 10.134 948 2HE2 GLN 115 2HE2 GLN 115 -5.766 7.046 9.750 949 H LYS 116 H LYS 116 -7.370 1.528 8.657 950 HA LYS 116 HA LYS 116 -5.190 0.135 10.033 951 1HB LYS 116 1HB LYS 116 -7.851 -1.096 9.309 952 2HB LYS 116 2HB LYS 116 -6.427 -2.026 9.742 953 1HG LYS 116 1HG LYS 116 -6.416 -1.013 11.954 954 2HG LYS 116 2HG LYS 116 -7.824 -0.039 11.519 955 1HD LYS 116 1HD LYS 116 -9.148 -2.049 11.212 956 2HD LYS 116 2HD LYS 116 -7.741 -3.054 11.559 957 1HE LYS 116 1HE LYS 116 -9.157 -2.911 13.516 958 2HE LYS 116 2HE LYS 116 -7.629 -2.087 13.813 959 1HZ LYS 116 1HZ LYS 116 -9.505 -0.820 14.641 960 2HZ LYS 116 2HZ LYS 116 -10.193 -0.765 13.093 961 3HZ LYS 116 3HZ LYS 116 -8.724 0.024 13.397 962 H ARG 117 H ARG 117 -3.846 -1.005 8.725 963 HA ARG 117 HA ARG 117 -4.433 -0.990 5.845 964 1HB ARG 117 1HB ARG 117 -2.188 -0.145 6.902 965 2HB ARG 117 2HB ARG 117 -1.814 -1.860 7.031 966 1HG ARG 117 1HG ARG 117 -2.335 -2.014 4.555 967 2HG ARG 117 2HG ARG 117 -2.313 -0.251 4.544 968 1HD ARG 117 1HD ARG 117 -0.073 -2.168 5.082 969 2HD ARG 117 2HD ARG 117 -0.154 -0.867 3.898 970 HE ARG 117 HE ARG 117 0.544 -0.656 6.708 971 1HH1 ARG 117 1HH1 ARG 117 -0.387 1.091 3.808 972 2HH1 ARG 117 2HH1 ARG 117 0.345 2.570 4.329 973 1HH2 ARG 117 1HH2 ARG 117 1.483 1.247 7.383 974 2HH2 ARG 117 2HH2 ARG 117 1.405 2.678 6.381 975 H TYR 118 H TYR 118 -5.367 -2.766 5.119 976 HA TYR 118 HA TYR 118 -5.148 -5.240 6.642 977 1HB TYR 118 1HB TYR 118 -6.938 -4.394 4.363 978 2HB TYR 118 2HB TYR 118 -6.952 -6.012 5.053 979 HD1 TYR 118 HD1 TYR 118 -7.424 -6.198 7.580 980 HD2 TYR 118 HD2 TYR 118 -8.266 -2.714 5.286 981 HE1 TYR 118 HE1 TYR 118 -9.022 -5.461 9.296 982 HE2 TYR 118 HE2 TYR 118 -9.865 -1.968 6.997 983 HH TYR 118 HH TYR 118 -11.260 -2.979 8.771 984 H TYR 119 H TYR 119 -3.786 -6.785 6.105 985 HA TYR 119 HA TYR 119 -2.678 -6.855 3.387 986 1HB TYR 119 1HB TYR 119 -1.729 -8.150 5.954 987 2HB TYR 119 2HB TYR 119 -0.976 -8.401 4.386 988 HD1 TYR 119 HD1 TYR 119 0.446 -6.727 3.409 989 HD2 TYR 119 HD2 TYR 119 -1.541 -5.978 7.095 990 HE1 TYR 119 HE1 TYR 119 1.893 -4.776 3.789 991 HE2 TYR 119 HE2 TYR 119 -0.102 -4.026 7.478 992 HH TYR 119 HH TYR 119 2.022 -3.130 6.814 993 H TYR 120 H TYR 120 -3.980 -8.048 2.128 994 HA TYR 120 HA TYR 120 -4.954 -10.626 3.169 995 1HB TYR 120 1HB TYR 120 -5.873 -9.007 0.782 996 2HB TYR 120 2HB TYR 120 -6.495 -10.595 1.208 997 HD1 TYR 120 HD1 TYR 120 -6.768 -7.061 1.750 998 HD2 TYR 120 HD2 TYR 120 -7.707 -10.855 3.428 999 HE1 TYR 120 HE1 TYR 120 -8.477 -6.006 3.168 1000 HE2 TYR 120 HE2 TYR 120 -9.419 -9.807 4.850 1001 HH TYR 120 HH TYR 120 -10.530 -6.644 4.352 1002 H THR 121 H THR 121 -4.380 -12.513 2.196 1003 HA THR 121 HA THR 121 -2.269 -12.476 0.231 1004 HB THR 121 HB THR 121 -2.397 -14.226 2.013 1005 HG1 THR 121 HG1 THR 121 -1.152 -15.044 0.487 1006 1HG2 THR 121 1HG2 THR 121 -4.759 -15.195 0.405 1007 2HG2 THR 121 2HG2 THR 121 -4.791 -14.599 2.065 1008 3HG2 THR 121 3HG2 THR 121 -3.964 -16.111 1.685 1009 H PHE 122 H PHE 122 -2.723 -14.267 -1.635 1010 HA PHE 122 HA PHE 122 -4.426 -12.955 -3.443 1011 1HB PHE 122 1HB PHE 122 -2.484 -14.348 -4.109 1012 2HB PHE 122 2HB PHE 122 -3.375 -15.786 -3.620 1013 HD1 PHE 122 HD1 PHE 122 -3.311 -12.989 -6.028 1014 HD2 PHE 122 HD2 PHE 122 -4.977 -16.777 -5.047 1015 HE1 PHE 122 HE1 PHE 122 -4.300 -13.134 -8.276 1016 HE2 PHE 122 HE2 PHE 122 -5.969 -16.929 -7.291 1017 HZ PHE 122 HZ PHE 122 -5.630 -15.105 -8.910 1018 H ASP 123 H ASP 123 -4.921 -15.748 -1.373 1019 HA ASP 123 HA ASP 123 -7.491 -16.339 -2.591 1020 1HB ASP 123 1HB ASP 123 -5.838 -18.108 -1.818 1021 2HB ASP 123 2HB ASP 123 -6.276 -17.671 -0.170 1022 H ASN 124 H ASN 124 -7.338 -13.819 -1.438 1023 HA ASN 124 HA ASN 124 -8.502 -12.356 -0.176 1024 1HB ASN 124 1HB ASN 124 -10.879 -12.732 0.014 1025 2HB ASN 124 2HB ASN 124 -10.310 -13.309 -1.545 1026 1HD2 ASN 124 1HD2 ASN 124 -11.544 -14.245 1.592 1027 2HD2 ASN 124 2HD2 ASN 124 -11.968 -15.861 1.146 1028 H SER 125 H SER 125 -6.933 -14.393 1.370 1029 HA SER 125 HA SER 125 -8.499 -14.553 3.827 1030 1HB SER 125 1HB SER 125 -5.750 -15.669 3.237 1031 2HB SER 125 2HB SER 125 -6.785 -16.071 4.610 1032 HG SER 125 HG SER 125 -7.972 -16.404 2.145 1033 H LEU 126 H LEU 126 -8.136 -13.295 5.558 1034 HA LEU 126 HA LEU 126 -6.383 -11.049 5.342 1035 1HB LEU 126 1HB LEU 126 -8.515 -10.877 6.504 1036 2HB LEU 126 2HB LEU 126 -8.006 -12.093 7.662 1037 HG LEU 126 HG LEU 126 -6.241 -10.566 8.472 1038 1HD1 LEU 126 1HD1 LEU 126 -6.299 -8.205 7.814 1039 2HD1 LEU 126 2HD1 LEU 126 -7.510 -8.583 6.588 1040 3HD1 LEU 126 3HD1 LEU 126 -5.884 -9.257 6.460 1041 1HD2 LEU 126 1HD2 LEU 126 -9.033 -9.433 8.506 1042 2HD2 LEU 126 2HD2 LEU 126 -7.735 -8.986 9.612 1043 3HD2 LEU 126 3HD2 LEU 126 -8.372 -10.630 9.620 1044 H LEU 127 H LEU 127 -4.276 -11.181 5.611 1045 HA LEU 127 HA LEU 127 -3.148 -13.267 7.299 1046 1HB LEU 127 1HB LEU 127 -1.811 -11.223 5.520 1047 2HB LEU 127 2HB LEU 127 -0.973 -12.476 6.412 1048 HG LEU 127 HG LEU 127 -2.944 -12.916 4.169 1049 1HD1 LEU 127 1HD1 LEU 127 -0.987 -13.739 2.941 1050 2HD1 LEU 127 2HD1 LEU 127 0.047 -13.285 4.295 1051 3HD1 LEU 127 3HD1 LEU 127 -0.818 -12.042 3.389 1052 1HD2 LEU 127 1HD2 LEU 127 -1.319 -14.922 5.732 1053 2HD2 LEU 127 2HD2 LEU 127 -2.365 -15.274 4.355 1054 3HD2 LEU 127 3HD2 LEU 127 -3.060 -14.683 5.864 1055 H PHE 128 H PHE 128 -2.717 -9.732 6.923 1056 HA PHE 128 HA PHE 128 -2.196 -9.620 9.812 1057 1HB PHE 128 1HB PHE 128 -0.079 -9.684 8.365 1058 2HB PHE 128 2HB PHE 128 -0.540 -8.076 7.819 1059 HD1 PHE 128 HD1 PHE 128 0.438 -10.079 10.751 1060 HD2 PHE 128 HD2 PHE 128 -0.176 -6.173 9.175 1061 HE1 PHE 128 HE1 PHE 128 1.557 -9.114 12.719 1062 HE2 PHE 128 HE2 PHE 128 0.941 -5.199 11.140 1063 HZ PHE 128 HZ PHE 128 1.812 -6.672 12.915 1064 H THR 129 H THR 129 -2.771 -7.700 10.817 1065 HA THR 129 HA THR 129 -4.097 -5.684 9.132 1066 HB THR 129 HB THR 129 -4.899 -6.417 11.956 1067 HG1 THR 129 HG1 THR 129 -5.587 -7.504 9.499 1068 1HG2 THR 129 1HG2 THR 129 -6.277 -4.748 9.846 1069 2HG2 THR 129 2HG2 THR 129 -5.459 -4.130 11.281 1070 3HG2 THR 129 3HG2 THR 129 -6.909 -5.116 11.453 1071 H GLU 130 H GLU 130 -2.821 -3.949 9.113 1072 HA GLU 130 HA GLU 130 -1.153 -3.375 11.456 1073 1HB GLU 130 1HB GLU 130 -0.078 -3.590 9.236 1074 2HB GLU 130 2HB GLU 130 -1.038 -2.236 8.659 1075 1HG GLU 130 1HG GLU 130 0.048 -0.797 10.339 1076 2HG GLU 130 2HG GLU 130 1.055 -2.164 10.821 1077 H SER 131 H SER 131 -2.212 -2.130 12.872 1078 HA SER 131 HA SER 131 -4.185 -0.213 12.031 1079 1HB SER 131 1HB SER 131 -2.998 -0.508 14.794 1080 2HB SER 131 2HB SER 131 -4.580 0.141 14.359 1081 HG SER 131 HG SER 131 -3.673 -2.543 14.253 1082 H ILE 132 H ILE 132 -3.511 1.636 11.094 1083 HA ILE 132 HA ILE 132 -0.962 2.801 11.765 1084 HB ILE 132 HB ILE 132 -1.695 4.632 10.161 1085 1HG1 ILE 132 1HG1 ILE 132 -3.910 2.648 9.572 1086 2HG1 ILE 132 2HG1 ILE 132 -4.135 4.206 10.361 1087 1HG2 ILE 132 1HG2 ILE 132 -1.582 1.793 9.153 1088 2HG2 ILE 132 2HG2 ILE 132 -0.200 2.818 9.530 1089 3HG2 ILE 132 3HG2 ILE 132 -1.271 3.241 8.197 1090 1HD1 ILE 132 1HD1 ILE 132 -4.761 4.329 8.032 1091 2HD1 ILE 132 2HD1 ILE 132 -3.162 3.765 7.545 1092 3HD1 ILE 132 3HD1 ILE 132 -3.344 5.332 8.335 1093 H GLN 133 H GLN 133 -1.297 3.205 13.964 1094 HA GLN 133 HA GLN 133 -3.328 5.149 14.724 1095 1HB GLN 133 1HB GLN 133 -2.571 4.671 17.040 1096 2HB GLN 133 2HB GLN 133 -3.092 3.229 16.178 1097 1HG GLN 133 1HG GLN 133 -0.847 2.520 15.842 1098 2HG GLN 133 2HG GLN 133 -0.211 4.055 16.425 1099 1HE2 GLN 133 1HE2 GLN 133 -2.887 2.456 17.960 1100 2HE2 GLN 133 2HE2 GLN 133 -2.048 1.991 19.404 Start of MODEL 20 1 H ASP 7 H ASP 7 -4.855 16.127 -15.168 2 HA ASP 7 HA ASP 7 -6.824 14.004 -15.374 3 1HB ASP 7 1HB ASP 7 -3.806 13.952 -15.577 4 2HB ASP 7 2HB ASP 7 -4.835 12.536 -15.756 5 H GLN 8 H GLN 8 -7.699 13.463 -13.540 6 HA GLN 8 HA GLN 8 -6.752 13.766 -10.978 7 1HB GLN 8 1HB GLN 8 -9.082 13.302 -11.536 8 2HB GLN 8 2HB GLN 8 -8.653 11.678 -12.051 9 1HG GLN 8 1HG GLN 8 -8.044 11.089 -9.785 10 2HG GLN 8 2HG GLN 8 -8.375 12.735 -9.249 11 1HE2 GLN 8 1HE2 GLN 8 -10.497 13.418 -9.034 12 2HE2 GLN 8 2HE2 GLN 8 -11.835 12.326 -9.064 13 H VAL 9 H VAL 9 -6.178 11.131 -13.212 14 HA VAL 9 HA VAL 9 -5.121 9.240 -11.436 15 HB VAL 9 HB VAL 9 -4.341 9.683 -14.321 16 1HG1 VAL 9 1HG1 VAL 9 -2.774 8.231 -13.170 17 2HG1 VAL 9 2HG1 VAL 9 -3.758 7.300 -14.301 18 3HG1 VAL 9 3HG1 VAL 9 -4.105 7.240 -12.574 19 1HG2 VAL 9 1HG2 VAL 9 -6.516 7.962 -13.142 20 2HG2 VAL 9 2HG2 VAL 9 -6.042 7.995 -14.841 21 3HG2 VAL 9 3HG2 VAL 9 -6.747 9.429 -14.093 22 H VAL 10 H VAL 10 -3.624 11.977 -13.089 23 HA VAL 10 HA VAL 10 -0.938 11.292 -12.505 24 HB VAL 10 HB VAL 10 -2.153 13.990 -13.120 25 1HG1 VAL 10 1HG1 VAL 10 0.127 14.717 -13.640 26 2HG1 VAL 10 2HG1 VAL 10 0.753 13.160 -13.099 27 3HG1 VAL 10 3HG1 VAL 10 -0.024 14.247 -11.948 28 1HG2 VAL 10 1HG2 VAL 10 -1.194 13.599 -15.363 29 2HG2 VAL 10 2HG2 VAL 10 -2.431 12.419 -14.932 30 3HG2 VAL 10 3HG2 VAL 10 -0.724 11.977 -14.855 31 H ILE 11 H ILE 11 -3.299 13.353 -10.856 32 HA ILE 11 HA ILE 11 -1.598 14.425 -8.914 33 HB ILE 11 HB ILE 11 -4.568 13.900 -8.879 34 1HG1 ILE 11 1HG1 ILE 11 -4.608 16.431 -8.808 35 2HG1 ILE 11 2HG1 ILE 11 -2.869 16.395 -9.061 36 1HG2 ILE 11 1HG2 ILE 11 -3.828 13.683 -6.584 37 2HG2 ILE 11 2HG2 ILE 11 -4.706 15.199 -6.795 38 3HG2 ILE 11 3HG2 ILE 11 -2.944 15.202 -6.698 39 1HD1 ILE 11 1HD1 ILE 11 -3.212 15.278 -11.205 40 2HD1 ILE 11 2HD1 ILE 11 -4.047 16.830 -11.128 41 3HD1 ILE 11 3HD1 ILE 11 -4.956 15.329 -10.946 42 H PHE 12 H PHE 12 -3.651 11.519 -8.768 43 HA PHE 12 HA PHE 12 -2.861 10.861 -6.128 44 1HB PHE 12 1HB PHE 12 -4.323 9.378 -8.286 45 2HB PHE 12 2HB PHE 12 -3.874 8.574 -6.785 46 HD1 PHE 12 HD1 PHE 12 -5.899 11.281 -8.250 47 HD2 PHE 12 HD2 PHE 12 -5.019 9.023 -4.754 48 HE1 PHE 12 HE1 PHE 12 -7.897 12.206 -7.154 49 HE2 PHE 12 HE2 PHE 12 -7.017 9.943 -3.652 50 HZ PHE 12 HZ PHE 12 -8.459 11.537 -4.850 51 H LYS 13 H LYS 13 -1.773 9.670 -9.323 52 HA LYS 13 HA LYS 13 -0.132 7.634 -8.238 53 1HB LYS 13 1HB LYS 13 0.819 7.358 -10.402 54 2HB LYS 13 2HB LYS 13 -0.876 7.753 -10.642 55 1HG LYS 13 1HG LYS 13 -0.367 9.949 -11.351 56 2HG LYS 13 2HG LYS 13 1.300 9.821 -10.788 57 1HD LYS 13 1HD LYS 13 1.698 8.064 -12.484 58 2HD LYS 13 2HD LYS 13 0.052 8.301 -13.076 59 1HE LYS 13 1HE LYS 13 0.545 10.569 -13.701 60 2HE LYS 13 2HE LYS 13 2.140 10.472 -12.955 61 1HZ LYS 13 1HZ LYS 13 2.793 8.839 -14.586 62 2HZ LYS 13 2HZ LYS 13 2.230 10.233 -15.370 63 3HZ LYS 13 3HZ LYS 13 1.246 8.853 -15.283 64 H GLN 14 H GLN 14 0.358 11.022 -8.796 65 HA GLN 14 HA GLN 14 3.190 11.004 -8.554 66 1HB GLN 14 1HB GLN 14 2.045 12.804 -9.702 67 2HB GLN 14 2HB GLN 14 1.159 13.217 -8.241 68 1HG GLN 14 1HG GLN 14 3.113 14.046 -7.190 69 2HG GLN 14 2HG GLN 14 4.155 13.375 -8.447 70 1HE2 GLN 14 1HE2 GLN 14 1.140 14.866 -9.271 71 2HE2 GLN 14 2HE2 GLN 14 1.801 16.305 -9.975 72 H ILE 15 H ILE 15 0.527 11.288 -6.285 73 HA ILE 15 HA ILE 15 2.005 12.065 -4.017 74 HB ILE 15 HB ILE 15 -0.470 10.331 -4.138 75 1HG1 ILE 15 1HG1 ILE 15 -0.196 13.314 -3.718 76 2HG1 ILE 15 2HG1 ILE 15 -0.730 12.547 -5.211 77 1HG2 ILE 15 1HG2 ILE 15 0.711 11.887 -1.841 78 2HG2 ILE 15 2HG2 ILE 15 0.652 10.130 -1.989 79 3HG2 ILE 15 3HG2 ILE 15 -0.843 11.051 -1.819 80 1HD1 ILE 15 1HD1 ILE 15 -2.599 13.415 -3.910 81 2HD1 ILE 15 2HD1 ILE 15 -2.138 12.384 -2.557 82 3HD1 ILE 15 3HD1 ILE 15 -2.682 11.660 -4.070 83 H PHE 16 H PHE 16 1.111 8.846 -5.234 84 HA PHE 16 HA PHE 16 2.584 7.430 -3.255 85 1HB PHE 16 1HB PHE 16 1.441 6.601 -5.922 86 2HB PHE 16 2HB PHE 16 2.295 5.482 -4.867 87 HD1 PHE 16 HD1 PHE 16 1.236 4.513 -2.998 88 HD2 PHE 16 HD2 PHE 16 -0.685 7.651 -5.139 89 HE1 PHE 16 HE1 PHE 16 -0.851 4.063 -1.777 90 HE2 PHE 16 HE2 PHE 16 -2.774 7.209 -3.919 91 HZ PHE 16 HZ PHE 16 -2.858 5.411 -2.235 92 H ASP 17 H ASP 17 3.353 8.745 -6.391 93 HA ASP 17 HA ASP 17 5.795 7.367 -6.802 94 1HB ASP 17 1HB ASP 17 4.663 8.486 -8.644 95 2HB ASP 17 2HB ASP 17 4.852 10.045 -7.848 96 H LYS 18 H LYS 18 4.977 10.411 -5.223 97 HA LYS 18 HA LYS 18 7.644 11.222 -4.757 98 1HB LYS 18 1HB LYS 18 5.051 11.982 -3.417 99 2HB LYS 18 2HB LYS 18 6.597 12.700 -2.981 100 1HG LYS 18 1HG LYS 18 5.318 12.797 -5.707 101 2HG LYS 18 2HG LYS 18 5.358 14.112 -4.531 102 1HD LYS 18 1HD LYS 18 7.818 12.810 -5.694 103 2HD LYS 18 2HD LYS 18 7.084 14.282 -6.333 104 1HE LYS 18 1HE LYS 18 7.533 15.477 -4.329 105 2HE LYS 18 2HE LYS 18 7.976 14.001 -3.472 106 1HZ LYS 18 1HZ LYS 18 9.487 15.012 -5.817 107 2HZ LYS 18 2HZ LYS 18 9.958 13.815 -4.705 108 3HZ LYS 18 3HZ LYS 18 9.867 15.439 -4.220 109 H VAL 19 H VAL 19 5.335 9.382 -2.772 110 HA VAL 19 HA VAL 19 7.034 9.400 -0.491 111 HB VAL 19 HB VAL 19 4.570 9.098 -0.356 112 1HG1 VAL 19 1HG1 VAL 19 5.175 6.325 -1.365 113 2HG1 VAL 19 2HG1 VAL 19 4.213 7.558 -2.180 114 3HG1 VAL 19 3HG1 VAL 19 3.638 6.845 -0.675 115 1HG2 VAL 19 1HG2 VAL 19 5.984 8.588 1.542 116 2HG2 VAL 19 2HG2 VAL 19 6.251 6.955 0.934 117 3HG2 VAL 19 3HG2 VAL 19 4.642 7.446 1.462 118 H ARG 20 H ARG 20 6.805 7.297 -3.273 119 HA ARG 20 HA ARG 20 8.244 5.152 -2.004 120 1HB ARG 20 1HB ARG 20 8.257 4.077 -4.192 121 2HB ARG 20 2HB ARG 20 6.650 4.660 -3.799 122 1HG ARG 20 1HG ARG 20 7.009 6.603 -5.247 123 2HG ARG 20 2HG ARG 20 8.609 5.984 -5.660 124 1HD ARG 20 1HD ARG 20 7.621 4.008 -6.657 125 2HD ARG 20 2HD ARG 20 6.012 4.533 -6.160 126 HE ARG 20 HE ARG 20 7.257 6.516 -7.761 127 1HH1 ARG 20 1HH1 ARG 20 5.744 3.356 -8.037 128 2HH1 ARG 20 2HH1 ARG 20 5.169 3.644 -9.646 129 1HH2 ARG 20 1HH2 ARG 20 6.502 6.883 -9.860 130 2HH2 ARG 20 2HH2 ARG 20 5.589 5.641 -10.684 131 H ASN 21 H ASN 21 9.111 8.081 -3.498 132 HA ASN 21 HA ASN 21 11.854 7.121 -3.964 133 1HB ASN 21 1HB ASN 21 10.298 9.400 -5.158 134 2HB ASN 21 2HB ASN 21 12.051 9.338 -5.254 135 1HD2 ASN 21 1HD2 ASN 21 11.945 9.231 -7.500 136 2HD2 ASN 21 2HD2 ASN 21 11.475 7.788 -8.328 137 H ASP 22 H ASP 22 9.982 9.751 -2.513 138 HA ASP 22 HA ASP 22 12.426 10.904 -1.401 139 1HB ASP 22 1HB ASP 22 9.585 11.929 -1.501 140 2HB ASP 22 2HB ASP 22 10.917 12.783 -0.730 141 H LEU 23 H LEU 23 9.748 8.984 -0.485 142 HA LEU 23 HA LEU 23 9.093 8.025 1.458 143 1HB LEU 23 1HB LEU 23 11.856 8.879 2.316 144 2HB LEU 23 2HB LEU 23 10.797 7.893 3.307 145 HG LEU 23 HG LEU 23 11.865 7.123 0.587 146 1HD1 LEU 23 1HD1 LEU 23 13.602 7.100 2.295 147 2HD1 LEU 23 2HD1 LEU 23 13.168 5.459 1.814 148 3HD1 LEU 23 3HD1 LEU 23 12.574 6.118 3.338 149 1HD2 LEU 23 1HD2 LEU 23 10.242 5.530 2.565 150 2HD2 LEU 23 2HD2 LEU 23 10.885 4.949 1.030 151 3HD2 LEU 23 3HD2 LEU 23 9.640 6.198 1.048 152 H ASN 24 H ASN 24 8.429 10.779 0.941 153 HA ASN 24 HA ASN 24 8.480 12.094 3.514 154 1HB ASN 24 1HB ASN 24 7.142 13.861 2.389 155 2HB ASN 24 2HB ASN 24 8.655 13.515 1.564 156 1HD2 ASN 24 1HD2 ASN 24 6.083 14.691 0.662 157 2HD2 ASN 24 2HD2 ASN 24 5.610 13.754 -0.708 158 H TYR 25 H TYR 25 7.428 10.407 4.683 159 HA TYR 25 HA TYR 25 4.854 9.456 4.025 160 1HB TYR 25 1HB TYR 25 6.407 9.397 6.609 161 2HB TYR 25 2HB TYR 25 4.849 8.602 6.398 162 HD1 TYR 25 HD1 TYR 25 8.404 8.402 5.825 163 HD2 TYR 25 HD2 TYR 25 4.645 6.754 4.711 164 HE1 TYR 25 HE1 TYR 25 9.547 6.427 4.916 165 HE2 TYR 25 HE2 TYR 25 5.780 4.769 3.803 166 HH TYR 25 HH TYR 25 9.097 4.118 4.373 167 H GLN 26 H GLN 26 5.924 12.224 5.874 168 HA GLN 26 HA GLN 26 3.579 12.674 7.356 169 1HB GLN 26 1HB GLN 26 5.663 13.802 7.904 170 2HB GLN 26 2HB GLN 26 5.647 14.644 6.361 171 1HG GLN 26 1HG GLN 26 4.966 16.111 8.164 172 2HG GLN 26 2HG GLN 26 3.643 15.857 7.029 173 1HE2 GLN 26 1HE2 GLN 26 1.835 14.698 7.681 174 2HE2 GLN 26 2HE2 GLN 26 1.518 14.343 9.345 175 H TRP 27 H TRP 27 4.616 14.025 4.225 176 HA TRP 27 HA TRP 27 2.208 15.471 3.771 177 1HB TRP 27 1HB TRP 27 4.405 15.966 2.688 178 2HB TRP 27 2HB TRP 27 4.243 14.488 1.750 179 HD1 TRP 27 HD1 TRP 27 2.731 18.008 2.064 180 HE1 TRP 27 HE1 TRP 27 1.528 18.580 -0.143 181 HE3 TRP 27 HE3 TRP 27 3.120 13.475 -0.268 182 HZ2 TRP 27 HZ2 TRP 27 0.844 17.283 -2.549 183 HZ3 TRP 27 HZ3 TRP 27 2.166 13.225 -2.522 184 HH2 TRP 27 HH2 TRP 27 1.052 15.089 -3.638 185 H PHE 28 H PHE 28 3.268 12.229 3.140 186 HA PHE 28 HA PHE 28 1.331 11.511 1.213 187 1HB PHE 28 1HB PHE 28 3.450 10.298 1.565 188 2HB PHE 28 2HB PHE 28 2.877 9.764 3.138 189 HD1 PHE 28 HD1 PHE 28 1.545 9.783 -0.358 190 HD2 PHE 28 HD2 PHE 28 2.261 7.577 3.211 191 HE1 PHE 28 HE1 PHE 28 0.585 7.775 -1.409 192 HE2 PHE 28 HE2 PHE 28 1.299 5.570 2.168 193 HZ PHE 28 HZ PHE 28 0.460 5.666 -0.144 194 H TYR 29 H TYR 29 1.483 10.926 4.736 195 HA TYR 29 HA TYR 29 -0.911 9.474 4.916 196 1HB TYR 29 1HB TYR 29 0.538 11.142 6.967 197 2HB TYR 29 2HB TYR 29 -0.882 10.177 7.346 198 HD1 TYR 29 HD1 TYR 29 -0.384 7.716 5.830 199 HD2 TYR 29 HD2 TYR 29 2.298 10.132 8.082 200 HE1 TYR 29 HE1 TYR 29 1.034 5.748 6.243 201 HE2 TYR 29 HE2 TYR 29 3.732 8.177 8.486 202 HH TYR 29 HH TYR 29 3.388 5.258 6.798 203 H SER 30 H SER 30 -0.316 12.956 5.199 204 HA SER 30 HA SER 30 -2.909 13.608 6.099 205 1HB SER 30 1HB SER 30 -2.218 15.940 5.253 206 2HB SER 30 2HB SER 30 -1.253 15.211 6.536 207 HG SER 30 HG SER 30 -0.014 16.129 4.786 208 H GLU 31 H GLU 31 -1.466 13.460 2.861 209 HA GLU 31 HA GLU 31 -3.785 14.474 1.555 210 1HB GLU 31 1HB GLU 31 -1.349 13.013 0.590 211 2HB GLU 31 2HB GLU 31 -2.684 13.377 -0.498 212 1HG GLU 31 1HG GLU 31 -0.939 15.302 0.996 213 2HG GLU 31 2HG GLU 31 -1.115 15.116 -0.751 214 H LEU 32 H LEU 32 -2.747 11.268 2.511 215 HA LEU 32 HA LEU 32 -4.662 9.799 1.060 216 1HB LEU 32 1HB LEU 32 -3.443 9.204 3.757 217 2HB LEU 32 2HB LEU 32 -4.388 8.068 2.816 218 HG LEU 32 HG LEU 32 -1.708 9.226 2.051 219 1HD1 LEU 32 1HD1 LEU 32 -1.529 7.569 3.793 220 2HD1 LEU 32 2HD1 LEU 32 -0.973 6.880 2.268 221 3HD1 LEU 32 3HD1 LEU 32 -2.569 6.462 2.894 222 1HD2 LEU 32 1HD2 LEU 32 -3.453 7.247 0.587 223 2HD2 LEU 32 2HD2 LEU 32 -1.809 7.699 0.139 224 3HD2 LEU 32 3HD2 LEU 32 -3.102 8.897 0.078 225 H LYS 33 H LYS 33 -4.746 11.268 4.274 226 HA LYS 33 HA LYS 33 -7.309 10.335 4.981 227 1HB LYS 33 1HB LYS 33 -5.428 11.359 6.443 228 2HB LYS 33 2HB LYS 33 -6.133 12.907 6.008 229 1HG LYS 33 1HG LYS 33 -7.795 10.729 7.222 230 2HG LYS 33 2HG LYS 33 -6.835 11.819 8.220 231 1HD LYS 33 1HD LYS 33 -8.034 13.729 7.367 232 2HD LYS 33 2HD LYS 33 -8.911 12.712 6.221 233 1HE LYS 33 1HE LYS 33 -10.280 13.267 8.176 234 2HE LYS 33 2HE LYS 33 -9.984 11.534 8.057 235 1HZ LYS 33 1HZ LYS 33 -8.472 13.390 9.816 236 2HZ LYS 33 2HZ LYS 33 -8.306 11.700 9.750 237 3HZ LYS 33 3HZ LYS 33 -9.743 12.389 10.325 238 H ARG 34 H ARG 34 -6.221 13.048 3.093 239 HA ARG 34 HA ARG 34 -8.688 14.496 3.222 240 1HB ARG 34 1HB ARG 34 -6.339 14.754 1.342 241 2HB ARG 34 2HB ARG 34 -7.706 15.855 1.375 242 1HG ARG 34 1HG ARG 34 -7.144 16.420 3.715 243 2HG ARG 34 2HG ARG 34 -5.716 15.386 3.585 244 1HD ARG 34 1HD ARG 34 -5.062 17.670 3.201 245 2HD ARG 34 2HD ARG 34 -4.943 16.781 1.682 246 HE ARG 34 HE ARG 34 -7.205 18.562 2.357 247 1HH1 ARG 34 1HH1 ARG 34 -4.802 17.374 0.088 248 2HH1 ARG 34 2HH1 ARG 34 -5.454 18.274 -1.253 249 1HH2 ARG 34 1HH2 ARG 34 -8.044 19.752 0.604 250 2HH2 ARG 34 2HH2 ARG 34 -7.279 19.637 -0.953 251 H HIS 35 H HIS 35 -7.429 11.978 1.139 252 HA HIS 35 HA HIS 35 -9.685 12.457 -0.697 253 1HB HIS 35 1HB HIS 35 -6.883 11.575 -1.388 254 2HB HIS 35 2HB HIS 35 -8.222 11.619 -2.530 255 HD1 HIS 35 HD1 HIS 35 -5.508 13.644 -1.270 256 HD2 HIS 35 HD2 HIS 35 -9.302 14.377 -2.810 257 HE1 HIS 35 HE1 HIS 35 -5.504 16.064 -1.951 258 HE2 HIS 35 HE2 HIS 35 -7.872 16.538 -2.679 259 H ASN 36 H ASN 36 -7.460 9.975 0.514 260 HA ASN 36 HA ASN 36 -8.993 7.826 -0.673 261 1HB ASN 36 1HB ASN 36 -6.630 7.770 1.219 262 2HB ASN 36 2HB ASN 36 -7.317 6.362 0.423 263 1HD2 ASN 36 1HD2 ASN 36 -5.382 5.884 -0.564 264 2HD2 ASN 36 2HD2 ASN 36 -4.764 6.803 -1.884 265 H VAL 37 H VAL 37 -10.493 9.371 1.128 266 HA VAL 37 HA VAL 37 -10.453 8.719 3.798 267 HB VAL 37 HB VAL 37 -12.988 9.246 2.254 268 1HG1 VAL 37 1HG1 VAL 37 -13.732 10.288 4.345 269 2HG1 VAL 37 2HG1 VAL 37 -12.204 9.849 5.106 270 3HG1 VAL 37 3HG1 VAL 37 -13.319 8.589 4.580 271 1HG2 VAL 37 1HG2 VAL 37 -12.559 11.635 2.651 272 2HG2 VAL 37 2HG2 VAL 37 -11.331 10.905 1.616 273 3HG2 VAL 37 3HG2 VAL 37 -10.975 11.229 3.312 274 H SER 38 H SER 38 -12.065 6.931 1.181 275 HA SER 38 HA SER 38 -13.233 5.056 3.011 276 1HB SER 38 1HB SER 38 -12.861 4.833 0.016 277 2HB SER 38 2HB SER 38 -13.885 3.798 1.009 278 HG SER 38 HG SER 38 -14.813 5.749 -0.165 279 H HIS 39 H HIS 39 -11.105 4.192 0.290 280 HA HIS 39 HA HIS 39 -9.020 3.122 1.856 281 1HB HIS 39 1HB HIS 39 -9.449 0.704 1.527 282 2HB HIS 39 2HB HIS 39 -10.656 1.454 2.563 283 HD1 HIS 39 HD1 HIS 39 -13.072 1.299 1.836 284 HD2 HIS 39 HD2 HIS 39 -10.410 -0.009 -1.088 285 HE1 HIS 39 HE1 HIS 39 -14.491 0.256 0.033 286 HE2 HIS 39 HE2 HIS 39 -12.858 -0.625 -1.674 287 H TYR 40 H TYR 40 -7.331 2.311 0.579 288 HA TYR 40 HA TYR 40 -7.864 2.327 -2.314 289 1HB TYR 40 1HB TYR 40 -5.591 3.080 -2.721 290 2HB TYR 40 2HB TYR 40 -6.403 4.208 -1.646 291 HD1 TYR 40 HD1 TYR 40 -3.701 1.778 -1.981 292 HD2 TYR 40 HD2 TYR 40 -5.726 4.382 0.708 293 HE1 TYR 40 HE1 TYR 40 -1.826 1.595 -0.404 294 HE2 TYR 40 HE2 TYR 40 -3.853 4.208 2.293 295 HH TYR 40 HH TYR 40 -2.029 2.650 2.816 296 H ILE 41 H ILE 41 -7.225 0.613 -3.488 297 HA ILE 41 HA ILE 41 -6.119 -1.667 -1.996 298 HB ILE 41 HB ILE 41 -7.551 -1.667 -4.659 299 1HG1 ILE 41 1HG1 ILE 41 -8.597 -2.547 -1.964 300 2HG1 ILE 41 2HG1 ILE 41 -8.956 -0.979 -2.681 301 1HG2 ILE 41 1HG2 ILE 41 -6.735 -3.920 -2.829 302 2HG2 ILE 41 2HG2 ILE 41 -6.019 -3.535 -4.393 303 3HG2 ILE 41 3HG2 ILE 41 -7.690 -4.091 -4.302 304 1HD1 ILE 41 1HD1 ILE 41 -10.778 -2.522 -3.035 305 2HD1 ILE 41 2HD1 ILE 41 -9.689 -3.668 -3.815 306 3HD1 ILE 41 3HD1 ILE 41 -10.022 -2.109 -4.572 307 H TYR 42 H TYR 42 -4.002 -1.848 -2.206 308 HA TYR 42 HA TYR 42 -2.695 -0.985 -4.689 309 1HB TYR 42 1HB TYR 42 -2.029 -0.183 -2.309 310 2HB TYR 42 2HB TYR 42 -1.306 -1.774 -2.135 311 HD1 TYR 42 HD1 TYR 42 -0.595 1.505 -2.858 312 HD2 TYR 42 HD2 TYR 42 0.227 -2.403 -4.325 313 HE1 TYR 42 HE1 TYR 42 1.452 2.342 -3.928 314 HE2 TYR 42 HE2 TYR 42 2.275 -1.574 -5.402 315 HH TYR 42 HH TYR 42 3.094 0.708 -6.278 316 H TYR 43 H TYR 43 -2.035 -2.504 -6.103 317 HA TYR 43 HA TYR 43 -1.776 -5.267 -5.161 318 1HB TYR 43 1HB TYR 43 -1.799 -4.188 -7.990 319 2HB TYR 43 2HB TYR 43 -1.747 -5.889 -7.540 320 HD1 TYR 43 HD1 TYR 43 -3.716 -6.112 -5.433 321 HD2 TYR 43 HD2 TYR 43 -3.843 -3.795 -8.990 322 HE1 TYR 43 HE1 TYR 43 -6.174 -6.174 -5.378 323 HE2 TYR 43 HE2 TYR 43 -6.296 -3.843 -8.950 324 HH TYR 43 HH TYR 43 -8.105 -5.283 -7.998 325 H LEU 44 H LEU 44 0.146 -5.885 -4.532 326 HA LEU 44 HA LEU 44 2.478 -4.308 -4.949 327 1HB LEU 44 1HB LEU 44 2.181 -7.077 -3.780 328 2HB LEU 44 2HB LEU 44 3.611 -6.068 -3.654 329 HG LEU 44 HG LEU 44 0.925 -5.263 -2.535 330 1HD1 LEU 44 1HD1 LEU 44 3.251 -6.577 -1.141 331 2HD1 LEU 44 2HD1 LEU 44 1.678 -7.310 -1.455 332 3HD1 LEU 44 3HD1 LEU 44 1.809 -5.933 -0.358 333 1HD2 LEU 44 1HD2 LEU 44 2.251 -3.679 -1.241 334 2HD2 LEU 44 2HD2 LEU 44 2.488 -3.428 -2.971 335 3HD2 LEU 44 3HD2 LEU 44 3.724 -4.257 -2.018 336 H ALA 45 H ALA 45 1.032 -6.450 -6.991 337 HA ALA 45 HA ALA 45 3.493 -7.583 -8.054 338 1HB ALA 45 1HB ALA 45 0.655 -7.958 -8.992 339 2HB ALA 45 2HB ALA 45 1.508 -9.012 -7.864 340 3HB ALA 45 3HB ALA 45 2.063 -8.871 -9.533 341 H THR 46 H THR 46 0.725 -5.774 -9.411 342 HA THR 46 HA THR 46 2.362 -5.042 -11.708 343 HB THR 46 HB THR 46 0.084 -4.056 -12.469 344 HG1 THR 46 HG1 THR 46 -1.672 -4.726 -11.370 345 1HG2 THR 46 1HG2 THR 46 0.443 -7.034 -12.130 346 2HG2 THR 46 2HG2 THR 46 1.098 -6.052 -13.441 347 3HG2 THR 46 3HG2 THR 46 -0.646 -6.249 -13.272 348 H GLU 47 H GLU 47 1.635 -3.709 -8.744 349 HA GLU 47 HA GLU 47 1.816 -1.640 -7.833 350 1HB GLU 47 1HB GLU 47 3.908 -1.620 -9.246 351 2HB GLU 47 2HB GLU 47 2.991 -0.779 -10.487 352 1HG GLU 47 1HG GLU 47 2.661 1.106 -9.031 353 2HG GLU 47 2HG GLU 47 3.414 0.248 -7.688 354 H ASN 48 H ASN 48 -0.549 -2.498 -9.233 355 HA ASN 48 HA ASN 48 -1.657 0.015 -10.251 356 1HB ASN 48 1HB ASN 48 -2.942 -2.719 -10.057 357 2HB ASN 48 2HB ASN 48 -3.654 -1.305 -10.813 358 1HD2 ASN 48 1HD2 ASN 48 -0.979 -0.559 -11.937 359 2HD2 ASN 48 2HD2 ASN 48 -0.770 -1.612 -13.285 360 H VAL 49 H VAL 49 -3.233 1.156 -9.132 361 HA VAL 49 HA VAL 49 -3.880 0.129 -6.444 362 HB VAL 49 HB VAL 49 -3.279 3.039 -6.956 363 1HG1 VAL 49 1HG1 VAL 49 -3.032 3.115 -4.516 364 2HG1 VAL 49 2HG1 VAL 49 -3.461 1.405 -4.433 365 3HG1 VAL 49 3HG1 VAL 49 -4.639 2.581 -5.012 366 1HG2 VAL 49 1HG2 VAL 49 -1.244 1.812 -7.441 367 2HG2 VAL 49 2HG2 VAL 49 -1.382 0.940 -5.915 368 3HG2 VAL 49 3HG2 VAL 49 -1.086 2.680 -5.913 369 H HIS 50 H HIS 50 -5.977 0.198 -5.973 370 HA HIS 50 HA HIS 50 -7.764 1.846 -7.644 371 1HB HIS 50 1HB HIS 50 -8.298 -0.560 -5.891 372 2HB HIS 50 2HB HIS 50 -9.583 0.430 -6.568 373 HD1 HIS 50 HD1 HIS 50 -10.434 -0.282 -8.788 374 HD2 HIS 50 HD2 HIS 50 -6.639 -1.795 -8.002 375 HE1 HIS 50 HE1 HIS 50 -9.913 -1.829 -10.699 376 HE2 HIS 50 HE2 HIS 50 -7.727 -2.919 -10.069 377 H ILE 51 H ILE 51 -7.766 3.837 -6.678 378 HA ILE 51 HA ILE 51 -8.106 4.009 -3.786 379 HB ILE 51 HB ILE 51 -7.813 6.224 -5.827 380 1HG1 ILE 51 1HG1 ILE 51 -5.619 6.541 -4.473 381 2HG1 ILE 51 2HG1 ILE 51 -5.878 4.875 -3.965 382 1HG2 ILE 51 1HG2 ILE 51 -9.125 6.956 -3.921 383 2HG2 ILE 51 2HG2 ILE 51 -7.532 7.714 -3.908 384 3HG2 ILE 51 3HG2 ILE 51 -7.876 6.370 -2.819 385 1HD1 ILE 51 1HD1 ILE 51 -5.876 4.182 -6.312 386 2HD1 ILE 51 2HD1 ILE 51 -4.370 4.970 -5.840 387 3HD1 ILE 51 3HD1 ILE 51 -5.565 5.851 -6.791 388 H VAL 52 H VAL 52 -10.165 3.378 -3.338 389 HA VAL 52 HA VAL 52 -12.381 4.489 -4.823 390 HB VAL 52 HB VAL 52 -12.531 2.928 -2.240 391 1HG1 VAL 52 1HG1 VAL 52 -14.791 2.347 -3.100 392 2HG1 VAL 52 2HG1 VAL 52 -14.530 3.473 -4.434 393 3HG1 VAL 52 3HG1 VAL 52 -14.583 4.067 -2.775 394 1HG2 VAL 52 1HG2 VAL 52 -12.510 1.897 -5.076 395 2HG2 VAL 52 2HG2 VAL 52 -12.911 0.938 -3.652 396 3HG2 VAL 52 3HG2 VAL 52 -11.289 1.604 -3.839 397 H LEU 53 H LEU 53 -13.008 6.486 -4.493 398 HA LEU 53 HA LEU 53 -12.269 7.998 -2.193 399 1HB LEU 53 1HB LEU 53 -14.301 8.624 -4.341 400 2HB LEU 53 2HB LEU 53 -13.642 9.769 -3.191 401 HG LEU 53 HG LEU 53 -12.088 8.351 -5.360 402 1HD1 LEU 53 1HD1 LEU 53 -11.892 10.587 -6.343 403 2HD1 LEU 53 2HD1 LEU 53 -12.944 11.227 -5.081 404 3HD1 LEU 53 3HD1 LEU 53 -13.573 10.057 -6.241 405 1HD2 LEU 53 1HD2 LEU 53 -11.191 10.456 -3.393 406 2HD2 LEU 53 2HD2 LEU 53 -10.229 9.780 -4.708 407 3HD2 LEU 53 3HD2 LEU 53 -10.728 8.754 -3.364 408 H LYS 54 H LYS 54 -14.032 9.264 -0.977 409 HA LYS 54 HA LYS 54 -15.840 7.304 0.160 410 1HB LYS 54 1HB LYS 54 -14.450 9.259 1.344 411 2HB LYS 54 2HB LYS 54 -15.920 10.163 1.008 412 1HG LYS 54 1HG LYS 54 -17.141 8.201 2.131 413 2HG LYS 54 2HG LYS 54 -15.553 7.757 2.755 414 1HD LYS 54 1HD LYS 54 -16.538 9.077 4.437 415 2HD LYS 54 2HD LYS 54 -15.400 10.150 3.618 416 1HE LYS 54 1HE LYS 54 -17.465 11.329 3.990 417 2HE LYS 54 2HE LYS 54 -17.272 11.033 2.262 418 1HZ LYS 54 1HZ LYS 54 -18.745 9.066 2.557 419 2HZ LYS 54 2HZ LYS 54 -19.511 10.549 2.855 420 3HZ LYS 54 3HZ LYS 54 -19.037 9.566 4.153 421 H ASN 55 H ASN 55 -16.078 8.735 -2.578 422 HA ASN 55 HA ASN 55 -18.935 9.276 -2.335 423 1HB ASN 55 1HB ASN 55 -17.647 11.444 -2.293 424 2HB ASN 55 2HB ASN 55 -17.085 11.068 -3.919 425 1HD2 ASN 55 1HD2 ASN 55 -18.096 12.962 -4.673 426 2HD2 ASN 55 2HD2 ASN 55 -19.805 13.028 -4.918 427 H ASP 56 H ASP 56 -17.804 6.929 -3.210 428 HA ASP 56 HA ASP 56 -18.609 5.398 -4.693 429 1HB ASP 56 1HB ASP 56 -20.588 6.541 -5.138 430 2HB ASP 56 2HB ASP 56 -19.759 7.866 -5.942 431 H ASN 57 H ASN 57 -17.006 8.161 -6.260 432 HA ASN 57 HA ASN 57 -16.172 6.677 -8.531 433 1HB ASN 57 1HB ASN 57 -16.383 9.133 -8.543 434 2HB ASN 57 2HB ASN 57 -15.035 9.254 -7.419 435 1HD2 ASN 57 1HD2 ASN 57 -13.808 10.477 -8.839 436 2HD2 ASN 57 2HD2 ASN 57 -13.086 9.793 -10.256 437 H THR 58 H THR 58 -14.209 5.761 -9.060 438 HA THR 58 HA THR 58 -12.311 5.395 -6.834 439 HB THR 58 HB THR 58 -13.033 3.342 -8.937 440 HG1 THR 58 HG1 THR 58 -14.444 3.954 -6.901 441 1HG2 THR 58 1HG2 THR 58 -11.670 1.814 -7.582 442 2HG2 THR 58 2HG2 THR 58 -11.239 3.149 -6.512 443 3HG2 THR 58 3HG2 THR 58 -10.710 3.162 -8.194 444 H VAL 59 H VAL 59 -10.276 5.932 -7.251 445 HA VAL 59 HA VAL 59 -9.516 6.683 -9.975 446 HB VAL 59 HB VAL 59 -7.875 6.979 -7.455 447 1HG1 VAL 59 1HG1 VAL 59 -6.745 8.756 -8.726 448 2HG1 VAL 59 2HG1 VAL 59 -7.739 8.363 -10.131 449 3HG1 VAL 59 3HG1 VAL 59 -6.599 7.176 -9.496 450 1HG2 VAL 59 1HG2 VAL 59 -9.991 8.117 -7.115 451 2HG2 VAL 59 2HG2 VAL 59 -9.804 8.965 -8.652 452 3HG2 VAL 59 3HG2 VAL 59 -8.688 9.286 -7.325 453 H LEU 60 H LEU 60 -8.493 5.235 -11.219 454 HA LEU 60 HA LEU 60 -7.104 3.016 -9.902 455 1HB LEU 60 1HB LEU 60 -8.793 2.350 -11.492 456 2HB LEU 60 2HB LEU 60 -8.070 3.348 -12.737 457 HG LEU 60 HG LEU 60 -6.122 1.898 -12.835 458 1HD1 LEU 60 1HD1 LEU 60 -6.007 1.247 -10.487 459 2HD1 LEU 60 2HD1 LEU 60 -6.014 -0.173 -11.533 460 3HD1 LEU 60 3HD1 LEU 60 -7.479 0.292 -10.669 461 1HD2 LEU 60 1HD2 LEU 60 -8.703 0.342 -12.903 462 2HD2 LEU 60 2HD2 LEU 60 -7.195 -0.122 -13.693 463 3HD2 LEU 60 3HD2 LEU 60 -8.050 1.330 -14.210 464 H LEU 61 H LEU 61 -5.046 3.405 -9.529 465 HA LEU 61 HA LEU 61 -3.471 4.976 -11.422 466 1HB LEU 61 1HB LEU 61 -2.665 3.771 -8.772 467 2HB LEU 61 2HB LEU 61 -1.703 4.874 -9.739 468 HG LEU 61 HG LEU 61 -4.288 5.512 -8.327 469 1HD1 LEU 61 1HD1 LEU 61 -2.364 5.336 -6.853 470 2HD1 LEU 61 2HD1 LEU 61 -2.878 7.016 -7.012 471 3HD1 LEU 61 3HD1 LEU 61 -1.457 6.442 -7.884 472 1HD2 LEU 61 1HD2 LEU 61 -4.195 6.705 -10.435 473 2HD2 LEU 61 2HD2 LEU 61 -2.554 7.245 -10.082 474 3HD2 LEU 61 3HD2 LEU 61 -3.903 7.815 -9.096 475 H LYS 62 H LYS 62 -1.738 4.150 -12.559 476 HA LYS 62 HA LYS 62 -1.356 1.243 -12.412 477 1HB LYS 62 1HB LYS 62 -1.581 2.915 -14.921 478 2HB LYS 62 2HB LYS 62 -1.101 1.224 -14.884 479 1HG LYS 62 1HG LYS 62 -3.273 0.596 -14.015 480 2HG LYS 62 2HG LYS 62 -3.761 2.294 -13.966 481 1HD LYS 62 1HD LYS 62 -3.542 2.449 -16.382 482 2HD LYS 62 2HD LYS 62 -2.959 0.785 -16.457 483 1HE LYS 62 1HE LYS 62 -5.093 -0.024 -15.647 484 2HE LYS 62 2HE LYS 62 -5.679 1.629 -15.466 485 1HZ LYS 62 1HZ LYS 62 -5.471 1.933 -17.848 486 2HZ LYS 62 2HZ LYS 62 -6.485 0.617 -17.506 487 3HZ LYS 62 3HZ LYS 62 -4.892 0.349 -18.031 488 H GLY 63 H GLY 63 0.617 1.316 -11.357 489 1HA GLY 63 1HA GLY 63 2.844 2.780 -12.385 490 2HA GLY 63 2HA GLY 63 2.926 1.376 -11.321 491 H LEU 64 H LEU 64 2.203 -0.713 -12.450 492 HA LEU 64 HA LEU 64 2.339 -2.286 -14.072 493 1HB LEU 64 1HB LEU 64 0.792 -0.577 -15.122 494 2HB LEU 64 2HB LEU 64 2.176 -0.002 -16.030 495 HG LEU 64 HG LEU 64 2.390 -2.199 -17.108 496 1HD1 LEU 64 1HD1 LEU 64 0.636 -3.879 -16.812 497 2HD1 LEU 64 2HD1 LEU 64 -0.101 -2.888 -15.552 498 3HD1 LEU 64 3HD1 LEU 64 1.502 -3.581 -15.305 499 1HD2 LEU 64 1HD2 LEU 64 0.347 -2.085 -18.456 500 2HD2 LEU 64 2HD2 LEU 64 1.040 -0.488 -18.177 501 3HD2 LEU 64 3HD2 LEU 64 -0.375 -1.006 -17.259 502 H LYS 65 H LYS 65 4.797 -1.024 -13.091 503 HA LYS 65 HA LYS 65 6.536 -1.212 -15.433 504 1HB LYS 65 1HB LYS 65 7.055 -0.199 -12.634 505 2HB LYS 65 2HB LYS 65 8.290 -0.315 -13.882 506 1HG LYS 65 1HG LYS 65 6.913 1.198 -15.299 507 2HG LYS 65 2HG LYS 65 5.815 1.399 -13.935 508 1HD LYS 65 1HD LYS 65 8.734 1.933 -13.581 509 2HD LYS 65 2HD LYS 65 7.721 3.135 -14.375 510 1HE LYS 65 1HE LYS 65 7.870 3.676 -12.045 511 2HE LYS 65 2HE LYS 65 6.235 3.125 -12.392 512 1HZ LYS 65 1HZ LYS 65 6.458 1.355 -11.057 513 2HZ LYS 65 2HZ LYS 65 7.720 2.249 -10.355 514 3HZ LYS 65 3HZ LYS 65 8.071 1.060 -11.509 515 H ASN 66 H ASN 66 5.217 -3.381 -13.625 516 HA ASN 66 HA ASN 66 5.638 -5.537 -13.108 517 1HB ASN 66 1HB ASN 66 6.668 -5.743 -15.289 518 2HB ASN 66 2HB ASN 66 8.176 -5.068 -14.685 519 1HD2 ASN 66 1HD2 ASN 66 6.117 -7.862 -14.804 520 2HD2 ASN 66 2HD2 ASN 66 7.267 -8.979 -14.144 521 H ILE 67 H ILE 67 5.737 -5.415 -10.925 522 HA ILE 67 HA ILE 67 8.434 -5.288 -9.754 523 HB ILE 67 HB ILE 67 5.726 -4.930 -8.445 524 1HG1 ILE 67 1HG1 ILE 67 6.833 -2.745 -7.708 525 2HG1 ILE 67 2HG1 ILE 67 8.093 -3.101 -8.880 526 1HG2 ILE 67 1HG2 ILE 67 8.425 -5.066 -7.111 527 2HG2 ILE 67 2HG2 ILE 67 7.143 -6.270 -6.987 528 3HG2 ILE 67 3HG2 ILE 67 6.904 -4.653 -6.323 529 1HD1 ILE 67 1HD1 ILE 67 6.468 -1.540 -9.771 530 2HD1 ILE 67 2HD1 ILE 67 5.175 -2.705 -9.492 531 3HD1 ILE 67 3HD1 ILE 67 6.438 -3.056 -10.671 532 H VAL 68 H VAL 68 5.355 -6.978 -9.372 533 HA VAL 68 HA VAL 68 4.814 -9.108 -8.771 534 HB VAL 68 HB VAL 68 7.032 -9.844 -10.682 535 1HG1 VAL 68 1HG1 VAL 68 5.578 -11.743 -11.215 536 2HG1 VAL 68 2HG1 VAL 68 4.418 -11.194 -10.005 537 3HG1 VAL 68 3HG1 VAL 68 6.022 -11.732 -9.508 538 1HG2 VAL 68 1HG2 VAL 68 5.652 -8.079 -11.659 539 2HG2 VAL 68 2HG2 VAL 68 4.199 -9.015 -11.306 540 3HG2 VAL 68 3HG2 VAL 68 5.377 -9.623 -12.467 541 H SER 69 H SER 69 5.889 -8.524 -6.612 542 HA SER 69 HA SER 69 8.089 -10.392 -6.077 543 1HB SER 69 1HB SER 69 6.998 -8.173 -4.325 544 2HB SER 69 2HB SER 69 8.432 -9.150 -4.003 545 HG SER 69 HG SER 69 8.677 -8.109 -6.435 546 H VAL 70 H VAL 70 4.904 -10.501 -6.215 547 HA VAL 70 HA VAL 70 4.192 -11.450 -3.609 548 HB VAL 70 HB VAL 70 2.627 -11.684 -6.185 549 1HG1 VAL 70 1HG1 VAL 70 1.727 -11.831 -3.307 550 2HG1 VAL 70 2HG1 VAL 70 1.868 -13.197 -4.415 551 3HG1 VAL 70 3HG1 VAL 70 0.685 -11.925 -4.729 552 1HG2 VAL 70 1HG2 VAL 70 1.450 -9.666 -5.425 553 2HG2 VAL 70 2HG2 VAL 70 3.163 -9.361 -5.713 554 3HG2 VAL 70 3HG2 VAL 70 2.566 -9.539 -4.064 555 H LYS 71 H LYS 71 4.526 -13.391 -2.848 556 HA LYS 71 HA LYS 71 4.955 -15.631 -4.700 557 1HB LYS 71 1HB LYS 71 5.761 -15.129 -1.846 558 2HB LYS 71 2HB LYS 71 5.741 -16.758 -2.504 559 1HG LYS 71 1HG LYS 71 7.303 -14.489 -3.711 560 2HG LYS 71 2HG LYS 71 7.966 -15.639 -2.548 561 1HD LYS 71 1HD LYS 71 7.382 -17.481 -4.084 562 2HD LYS 71 2HD LYS 71 6.810 -16.295 -5.258 563 1HE LYS 71 1HE LYS 71 9.023 -15.356 -5.453 564 2HE LYS 71 2HE LYS 71 9.621 -16.413 -4.172 565 1HZ LYS 71 1HZ LYS 71 9.213 -18.319 -5.562 566 2HZ LYS 71 2HZ LYS 71 10.193 -17.215 -6.397 567 3HZ LYS 71 3HZ LYS 71 8.547 -17.346 -6.779 568 H PHE 72 H PHE 72 3.962 -17.702 -4.140 569 HA PHE 72 HA PHE 72 1.258 -17.369 -3.196 570 1HB PHE 72 1HB PHE 72 2.761 -19.845 -4.088 571 2HB PHE 72 2HB PHE 72 1.054 -19.817 -3.655 572 HD1 PHE 72 HD1 PHE 72 -0.580 -18.798 -5.108 573 HD2 PHE 72 HD2 PHE 72 3.541 -18.868 -6.153 574 HE1 PHE 72 HE1 PHE 72 -1.161 -18.207 -7.426 575 HE2 PHE 72 HE2 PHE 72 2.974 -18.275 -8.469 576 HZ PHE 72 HZ PHE 72 0.618 -17.944 -9.110 577 H SER 73 H SER 73 1.803 -16.648 -1.075 578 HA SER 73 HA SER 73 2.303 -18.858 0.769 579 1HB SER 73 1HB SER 73 3.785 -16.216 0.882 580 2HB SER 73 2HB SER 73 3.920 -17.529 2.052 581 HG SER 73 HG SER 73 4.330 -18.503 -0.401 582 H LYS 74 H LYS 74 2.098 -17.872 3.116 583 HA LYS 74 HA LYS 74 -0.017 -15.875 3.298 584 1HB LYS 74 1HB LYS 74 -1.437 -17.457 4.636 585 2HB LYS 74 2HB LYS 74 -1.309 -17.878 2.932 586 1HG LYS 74 1HG LYS 74 0.363 -19.570 3.463 587 2HG LYS 74 2HG LYS 74 0.268 -19.138 5.169 588 1HD LYS 74 1HD LYS 74 -2.092 -19.809 5.198 589 2HD LYS 74 2HD LYS 74 -1.980 -20.254 3.492 590 1HE LYS 74 1HE LYS 74 -1.779 -22.217 4.939 591 2HE LYS 74 2HE LYS 74 -0.294 -21.934 4.028 592 1HZ LYS 74 1HZ LYS 74 0.248 -22.462 6.291 593 2HZ LYS 74 2HZ LYS 74 -0.782 -21.253 6.879 594 3HZ LYS 74 3HZ LYS 74 0.616 -20.828 6.021 595 H ASP 75 H ASP 75 2.712 -15.933 4.130 596 HA ASP 75 HA ASP 75 2.719 -16.773 6.914 597 1HB ASP 75 1HB ASP 75 4.664 -17.384 5.620 598 2HB ASP 75 2HB ASP 75 4.930 -15.707 5.152 599 H ARG 76 H ARG 76 2.600 -15.491 8.609 600 HA ARG 76 HA ARG 76 2.231 -12.631 8.175 601 1HB ARG 76 1HB ARG 76 1.727 -14.481 10.492 602 2HB ARG 76 2HB ARG 76 1.666 -12.736 10.683 603 1HG ARG 76 1HG ARG 76 -0.413 -12.704 9.939 604 2HG ARG 76 2HG ARG 76 0.094 -13.448 8.423 605 1HD ARG 76 1HD ARG 76 -0.330 -15.114 10.876 606 2HD ARG 76 2HD ARG 76 -1.696 -14.624 9.876 607 HE ARG 76 HE ARG 76 0.139 -15.709 8.138 608 1HH1 ARG 76 1HH1 ARG 76 -1.550 -16.845 10.988 609 2HH1 ARG 76 2HH1 ARG 76 -1.690 -18.479 10.406 610 1HH2 ARG 76 1HH2 ARG 76 -0.033 -17.845 7.377 611 2HH2 ARG 76 2HH2 ARG 76 -0.842 -19.046 8.345 612 H HIS 77 H HIS 77 4.688 -14.777 9.114 613 HA HIS 77 HA HIS 77 6.027 -13.167 11.040 614 1HB HIS 77 1HB HIS 77 6.889 -15.496 9.345 615 2HB HIS 77 2HB HIS 77 8.050 -14.613 10.329 616 HD1 HIS 77 HD1 HIS 77 7.773 -14.786 12.924 617 HD2 HIS 77 HD2 HIS 77 5.230 -17.227 10.724 618 HE1 HIS 77 HE1 HIS 77 6.850 -16.450 14.563 619 HE2 HIS 77 HE2 HIS 77 5.503 -18.056 13.159 620 H LEU 78 H LEU 78 6.580 -13.692 7.562 621 HA LEU 78 HA LEU 78 8.748 -11.912 7.364 622 1HB LEU 78 1HB LEU 78 8.100 -13.650 5.688 623 2HB LEU 78 2HB LEU 78 6.774 -12.616 5.193 624 HG LEU 78 HG LEU 78 8.337 -10.911 4.435 625 1HD1 LEU 78 1HD1 LEU 78 10.748 -11.337 4.425 626 2HD1 LEU 78 2HD1 LEU 78 10.486 -12.828 5.331 627 3HD1 LEU 78 3HD1 LEU 78 10.110 -11.270 6.069 628 1HD2 LEU 78 1HD2 LEU 78 9.312 -12.104 2.562 629 2HD2 LEU 78 2HD2 LEU 78 7.686 -12.703 2.886 630 3HD2 LEU 78 3HD2 LEU 78 9.089 -13.641 3.399 631 H ILE 79 H ILE 79 5.274 -11.400 7.199 632 HA ILE 79 HA ILE 79 5.274 -8.717 6.357 633 HB ILE 79 HB ILE 79 3.371 -10.044 8.302 634 1HG1 ILE 79 1HG1 ILE 79 3.154 -9.707 5.303 635 2HG1 ILE 79 2HG1 ILE 79 3.547 -11.214 6.124 636 1HG2 ILE 79 1HG2 ILE 79 1.787 -8.305 7.642 637 2HG2 ILE 79 2HG2 ILE 79 3.015 -7.568 6.612 638 3HG2 ILE 79 3HG2 ILE 79 3.236 -7.604 8.361 639 1HD1 ILE 79 1HD1 ILE 79 0.968 -9.687 6.413 640 2HD1 ILE 79 2HD1 ILE 79 1.361 -11.228 7.176 641 3HD1 ILE 79 3HD1 ILE 79 1.212 -11.125 5.422 642 H GLU 80 H GLU 80 5.232 -10.110 9.618 643 HA GLU 80 HA GLU 80 5.482 -7.713 11.046 644 1HB GLU 80 1HB GLU 80 4.728 -9.748 12.097 645 2HB GLU 80 2HB GLU 80 6.255 -10.543 11.752 646 1HG GLU 80 1HG GLU 80 7.408 -9.130 13.304 647 2HG GLU 80 2HG GLU 80 5.951 -8.169 13.570 648 H THR 81 H THR 81 7.898 -9.898 9.713 649 HA THR 81 HA THR 81 10.169 -8.705 10.892 650 HB THR 81 HB THR 81 10.025 -10.179 8.250 651 HG1 THR 81 HG1 THR 81 9.175 -11.378 10.063 652 1HG2 THR 81 1HG2 THR 81 12.137 -8.989 8.582 653 2HG2 THR 81 2HG2 THR 81 12.374 -10.732 8.705 654 3HG2 THR 81 3HG2 THR 81 12.323 -9.745 10.166 655 H THR 82 H THR 82 8.554 -8.176 7.771 656 HA THR 82 HA THR 82 10.399 -6.229 6.854 657 HB THR 82 HB THR 82 7.531 -6.646 5.990 658 HG1 THR 82 HG1 THR 82 8.505 -8.555 5.585 659 1HG2 THR 82 1HG2 THR 82 8.473 -4.534 5.188 660 2HG2 THR 82 2HG2 THR 82 8.291 -5.683 3.861 661 3HG2 THR 82 3HG2 THR 82 9.882 -5.392 4.564 662 H SER 83 H SER 83 7.439 -6.054 8.747 663 HA SER 83 HA SER 83 7.079 -3.267 8.686 664 1HB SER 83 1HB SER 83 5.427 -4.934 9.568 665 2HB SER 83 2HB SER 83 6.453 -5.136 10.986 666 HG SER 83 HG SER 83 4.665 -3.597 11.181 667 H ASN 84 H ASN 84 8.865 -5.342 10.956 668 HA ASN 84 HA ASN 84 9.941 -3.218 12.490 669 1HB ASN 84 1HB ASN 84 10.647 -6.120 12.172 670 2HB ASN 84 2HB ASN 84 11.683 -5.043 13.098 671 1HD2 ASN 84 1HD2 ASN 84 8.617 -6.663 12.970 672 2HD2 ASN 84 2HD2 ASN 84 8.160 -6.348 14.616 673 H LYS 85 H LYS 85 10.929 -4.826 9.561 674 HA LYS 85 HA LYS 85 13.577 -3.936 9.363 675 1HB LYS 85 1HB LYS 85 12.364 -5.632 7.902 676 2HB LYS 85 2HB LYS 85 11.656 -4.266 7.057 677 1HG LYS 85 1HG LYS 85 13.482 -4.987 5.762 678 2HG LYS 85 2HG LYS 85 14.002 -3.503 6.561 679 1HD LYS 85 1HD LYS 85 15.320 -4.689 8.123 680 2HD LYS 85 2HD LYS 85 14.575 -6.230 7.691 681 1HE LYS 85 1HE LYS 85 16.368 -4.556 5.935 682 2HE LYS 85 2HE LYS 85 16.808 -6.060 6.743 683 1HZ LYS 85 1HZ LYS 85 16.290 -6.559 4.490 684 2HZ LYS 85 2HZ LYS 85 14.826 -5.709 4.561 685 3HZ LYS 85 3HZ LYS 85 15.011 -7.151 5.435 686 H LEU 86 H LEU 86 10.565 -2.512 8.138 687 HA LEU 86 HA LEU 86 11.676 -0.149 7.085 688 1HB LEU 86 1HB LEU 86 9.407 -0.945 6.563 689 2HB LEU 86 2HB LEU 86 8.912 -0.630 8.212 690 HG LEU 86 HG LEU 86 9.518 1.815 7.759 691 1HD1 LEU 86 1HD1 LEU 86 10.829 1.480 5.752 692 2HD1 LEU 86 2HD1 LEU 86 9.429 2.498 5.409 693 3HD1 LEU 86 3HD1 LEU 86 9.426 0.801 4.926 694 1HD2 LEU 86 1HD2 LEU 86 7.232 0.560 6.252 695 2HD2 LEU 86 2HD2 LEU 86 7.367 2.261 6.696 696 3HD2 LEU 86 3HD2 LEU 86 7.225 1.029 7.952 697 H LYS 87 H LYS 87 10.501 -1.000 10.284 698 HA LYS 87 HA LYS 87 10.551 1.604 11.380 699 1HB LYS 87 1HB LYS 87 9.324 -0.399 12.292 700 2HB LYS 87 2HB LYS 87 10.870 -1.011 12.859 701 1HG LYS 87 1HG LYS 87 11.114 1.063 14.218 702 2HG LYS 87 2HG LYS 87 9.469 1.500 13.747 703 1HD LYS 87 1HD LYS 87 8.736 -0.726 14.674 704 2HD LYS 87 2HD LYS 87 10.362 -0.899 15.337 705 1HE LYS 87 1HE LYS 87 8.347 1.247 15.982 706 2HE LYS 87 2HE LYS 87 8.893 -0.048 17.043 707 1HZ LYS 87 1HZ LYS 87 10.442 2.292 16.085 708 2HZ LYS 87 2HZ LYS 87 11.169 0.959 16.837 709 3HZ LYS 87 3HZ LYS 87 10.037 1.891 17.685 710 H SER 88 H SER 88 12.900 -1.059 11.435 711 HA SER 88 HA SER 88 14.721 0.433 13.099 712 1HB SER 88 1HB SER 88 14.434 -2.014 13.338 713 2HB SER 88 2HB SER 88 15.097 -2.236 11.721 714 HG SER 88 HG SER 88 16.373 -1.408 14.088 715 H ARG 89 H ARG 89 14.765 -0.779 9.736 716 HA ARG 89 HA ARG 89 17.336 0.560 9.348 717 1HB ARG 89 1HB ARG 89 15.967 -1.733 8.096 718 2HB ARG 89 2HB ARG 89 16.934 -0.737 7.017 719 1HG ARG 89 1HG ARG 89 17.917 -2.016 9.559 720 2HG ARG 89 2HG ARG 89 18.199 -2.621 7.922 721 1HD ARG 89 1HD ARG 89 19.129 0.015 9.061 722 2HD ARG 89 2HD ARG 89 20.135 -1.384 8.683 723 HE ARG 89 HE ARG 89 18.809 -0.679 6.348 724 1HH1 ARG 89 1HH1 ARG 89 21.195 0.706 8.506 725 2HH1 ARG 89 2HH1 ARG 89 21.931 1.678 7.261 726 1HH2 ARG 89 1HH2 ARG 89 19.795 0.598 4.714 727 2HH2 ARG 89 2HH2 ARG 89 21.145 1.612 5.126 728 H GLU 90 H GLU 90 14.077 1.112 8.716 729 HA GLU 90 HA GLU 90 12.980 2.782 7.651 730 1HB GLU 90 1HB GLU 90 14.824 4.256 8.308 731 2HB GLU 90 2HB GLU 90 15.724 3.782 6.875 732 1HG GLU 90 1HG GLU 90 14.014 4.777 5.458 733 2HG GLU 90 2HG GLU 90 13.085 5.230 6.886 734 H ILE 91 H ILE 91 15.727 1.695 5.695 735 HA ILE 91 HA ILE 91 15.967 1.086 3.536 736 HB ILE 91 HB ILE 91 14.529 -0.689 2.727 737 1HG1 ILE 91 1HG1 ILE 91 12.726 -0.093 5.087 738 2HG1 ILE 91 2HG1 ILE 91 12.334 0.233 3.401 739 1HG2 ILE 91 1HG2 ILE 91 15.091 -0.884 5.681 740 2HG2 ILE 91 2HG2 ILE 91 16.210 -1.247 4.368 741 3HG2 ILE 91 3HG2 ILE 91 14.782 -2.253 4.611 742 1HD1 ILE 91 1HD1 ILE 91 12.422 -2.160 2.922 743 2HD1 ILE 91 2HD1 ILE 91 11.248 -1.790 4.185 744 3HD1 ILE 91 3HD1 ILE 91 12.812 -2.484 4.612 745 H THR 92 H THR 92 14.232 0.544 1.452 746 HA THR 92 HA THR 92 13.141 3.215 0.885 747 HB THR 92 HB THR 92 13.554 1.072 -1.183 748 HG1 THR 92 HG1 THR 92 15.556 1.219 -0.170 749 1HG2 THR 92 1HG2 THR 92 13.890 2.998 -2.660 750 2HG2 THR 92 2HG2 THR 92 13.705 4.088 -1.288 751 3HG2 THR 92 3HG2 THR 92 12.342 3.108 -1.822 752 H PHE 93 H PHE 93 11.031 3.428 0.065 753 HA PHE 93 HA PHE 93 9.067 1.747 1.098 754 1HB PHE 93 1HB PHE 93 8.732 4.121 0.389 755 2HB PHE 93 2HB PHE 93 8.783 3.589 -1.288 756 HD1 PHE 93 HD1 PHE 93 6.900 3.286 1.874 757 HD2 PHE 93 HD2 PHE 93 6.861 2.734 -2.345 758 HE1 PHE 93 HE1 PHE 93 4.474 2.879 1.954 759 HE2 PHE 93 HE2 PHE 93 4.438 2.326 -2.274 760 HZ PHE 93 HZ PHE 93 3.239 2.397 -0.122 761 H GLN 94 H GLN 94 10.663 1.751 -2.015 762 HA GLN 94 HA GLN 94 9.070 -0.081 -3.400 763 1HB GLN 94 1HB GLN 94 10.835 1.273 -4.451 764 2HB GLN 94 2HB GLN 94 12.058 0.358 -3.582 765 1HG GLN 94 1HG GLN 94 11.306 -1.683 -4.770 766 2HG GLN 94 2HG GLN 94 10.201 -0.679 -5.710 767 1HE2 GLN 94 1HE2 GLN 94 11.225 -1.203 -7.649 768 2HE2 GLN 94 2HE2 GLN 94 12.777 -0.564 -8.070 769 H GLU 95 H GLU 95 11.819 -0.579 -1.229 770 HA GLU 95 HA GLU 95 11.971 -3.401 -1.603 771 1HB GLU 95 1HB GLU 95 13.032 -1.746 0.696 772 2HB GLU 95 2HB GLU 95 13.569 -3.354 0.222 773 1HG GLU 95 1HG GLU 95 14.457 -2.484 -1.848 774 2HG GLU 95 2HG GLU 95 13.830 -0.880 -1.473 775 H TYR 96 H TYR 96 10.420 -1.266 0.696 776 HA TYR 96 HA TYR 96 9.554 -3.077 2.618 777 1HB TYR 96 1HB TYR 96 9.390 -0.600 2.765 778 2HB TYR 96 2HB TYR 96 8.105 -0.631 1.570 779 HD1 TYR 96 HD1 TYR 96 6.114 -0.051 2.538 780 HD2 TYR 96 HD2 TYR 96 8.747 -2.615 4.687 781 HE1 TYR 96 HE1 TYR 96 4.452 -0.234 4.338 782 HE2 TYR 96 HE2 TYR 96 7.088 -2.809 6.495 783 HH TYR 96 HH TYR 96 5.188 -1.726 7.380 784 H ARG 97 H ARG 97 7.898 -2.003 -0.340 785 HA ARG 97 HA ARG 97 5.622 -3.619 -0.115 786 1HB ARG 97 1HB ARG 97 6.995 -2.757 -2.663 787 2HB ARG 97 2HB ARG 97 5.326 -3.276 -2.507 788 1HG ARG 97 1HG ARG 97 4.782 -1.317 -1.225 789 2HG ARG 97 2HG ARG 97 6.480 -0.828 -1.193 790 1HD ARG 97 1HD ARG 97 4.658 -0.989 -3.589 791 2HD ARG 97 2HD ARG 97 5.387 0.457 -2.888 792 HE ARG 97 HE ARG 97 7.466 -1.236 -3.581 793 1HH1 ARG 97 1HH1 ARG 97 4.926 0.534 -5.214 794 2HH1 ARG 97 2HH1 ARG 97 5.807 0.664 -6.714 795 1HH2 ARG 97 1HH2 ARG 97 8.621 -1.065 -5.546 796 2HH2 ARG 97 2HH2 ARG 97 7.915 -0.224 -6.893 797 H ARG 98 H ARG 98 8.774 -4.237 -1.573 798 HA ARG 98 HA ARG 98 8.244 -6.570 -2.965 799 1HB ARG 98 1HB ARG 98 10.719 -5.516 -1.640 800 2HB ARG 98 2HB ARG 98 10.725 -7.101 -2.400 801 1HG ARG 98 1HG ARG 98 10.176 -6.142 -4.530 802 2HG ARG 98 2HG ARG 98 9.976 -4.546 -3.801 803 1HD ARG 98 1HD ARG 98 12.159 -4.898 -4.976 804 2HD ARG 98 2HD ARG 98 12.297 -4.403 -3.291 805 HE ARG 98 HE ARG 98 12.375 -7.248 -3.580 806 1HH1 ARG 98 1HH1 ARG 98 14.314 -4.341 -3.887 807 2HH1 ARG 98 2HH1 ARG 98 15.809 -5.158 -3.535 808 1HH2 ARG 98 1HH2 ARG 98 14.356 -8.320 -3.148 809 2HH2 ARG 98 2HH2 ARG 98 15.834 -7.412 -3.141 810 H ASN 99 H ASN 99 9.528 -6.339 0.356 811 HA ASN 99 HA ASN 99 9.525 -9.178 0.621 812 1HB ASN 99 1HB ASN 99 10.032 -6.969 2.604 813 2HB ASN 99 2HB ASN 99 10.106 -8.677 3.030 814 1HD2 ASN 99 1HD2 ASN 99 12.244 -6.770 3.131 815 2HD2 ASN 99 2HD2 ASN 99 13.469 -7.336 2.047 816 H LEU 100 H LEU 100 7.208 -6.690 1.365 817 HA LEU 100 HA LEU 100 5.573 -8.291 3.054 818 1HB LEU 100 1HB LEU 100 4.962 -5.902 1.322 819 2HB LEU 100 2HB LEU 100 3.758 -6.681 2.333 820 HG LEU 100 HG LEU 100 6.316 -5.459 3.373 821 1HD1 LEU 100 1HD1 LEU 100 4.838 -3.757 2.443 822 2HD1 LEU 100 2HD1 LEU 100 4.902 -3.658 4.203 823 3HD1 LEU 100 3HD1 LEU 100 3.503 -4.382 3.412 824 1HD2 LEU 100 1HD2 LEU 100 5.237 -5.699 5.552 825 2HD2 LEU 100 2HD2 LEU 100 5.426 -7.263 4.759 826 3HD2 LEU 100 3HD2 LEU 100 3.850 -6.470 4.784 827 H ALA 101 H ALA 101 5.705 -7.719 -0.421 828 HA ALA 101 HA ALA 101 3.498 -9.363 -1.091 829 1HB ALA 101 1HB ALA 101 4.391 -9.259 -3.372 830 2HB ALA 101 2HB ALA 101 5.879 -8.544 -2.753 831 3HB ALA 101 3HB ALA 101 4.354 -7.670 -2.610 832 H LYS 102 H LYS 102 6.918 -9.964 -0.603 833 HA LYS 102 HA LYS 102 7.053 -12.584 -1.614 834 1HB LYS 102 1HB LYS 102 8.631 -11.257 0.598 835 2HB LYS 102 2HB LYS 102 9.018 -12.832 -0.077 836 1HG LYS 102 1HG LYS 102 8.920 -10.288 -1.677 837 2HG LYS 102 2HG LYS 102 10.386 -10.968 -0.969 838 1HD LYS 102 1HD LYS 102 10.030 -13.025 -2.282 839 2HD LYS 102 2HD LYS 102 8.616 -12.278 -3.030 840 1HE LYS 102 1HE LYS 102 9.995 -10.543 -3.991 841 2HE LYS 102 2HE LYS 102 11.419 -11.175 -3.167 842 1HZ LYS 102 1HZ LYS 102 11.459 -11.918 -5.411 843 2HZ LYS 102 2HZ LYS 102 9.867 -12.490 -5.328 844 3HZ LYS 102 3HZ LYS 102 11.093 -13.262 -4.440 845 H ALA 103 H ALA 103 5.649 -11.317 1.261 846 HA ALA 103 HA ALA 103 5.710 -13.758 2.768 847 1HB ALA 103 1HB ALA 103 4.083 -11.251 3.159 848 2HB ALA 103 2HB ALA 103 5.642 -11.608 3.899 849 3HB ALA 103 3HB ALA 103 4.225 -12.571 4.320 850 H GLY 104 H GLY 104 3.898 -12.675 0.163 851 1HA GLY 104 1HA GLY 104 2.357 -14.222 -0.876 852 2HA GLY 104 2HA GLY 104 1.806 -14.671 0.734 853 H VAL 105 H VAL 105 2.298 -11.418 0.732 854 HA VAL 105 HA VAL 105 -0.528 -10.883 0.684 855 HB VAL 105 HB VAL 105 1.767 -8.939 1.005 856 1HG1 VAL 105 1HG1 VAL 105 -1.162 -8.651 1.668 857 2HG1 VAL 105 2HG1 VAL 105 -0.318 -7.866 0.333 858 3HG1 VAL 105 3HG1 VAL 105 0.096 -7.461 1.998 859 1HG2 VAL 105 1HG2 VAL 105 1.350 -9.103 3.403 860 2HG2 VAL 105 2HG2 VAL 105 1.780 -10.680 2.735 861 3HG2 VAL 105 3HG2 VAL 105 0.097 -10.311 3.115 862 H PHE 106 H PHE 106 -1.627 -10.356 -1.048 863 HA PHE 106 HA PHE 106 -0.214 -9.128 -3.324 864 1HB PHE 106 1HB PHE 106 -0.996 -11.424 -3.786 865 2HB PHE 106 2HB PHE 106 -2.636 -10.948 -3.363 866 HD1 PHE 106 HD1 PHE 106 -3.990 -9.660 -4.889 867 HD2 PHE 106 HD2 PHE 106 0.021 -10.690 -5.864 868 HE1 PHE 106 HE1 PHE 106 -4.401 -9.032 -7.232 869 HE2 PHE 106 HE2 PHE 106 -0.386 -10.066 -8.207 870 HZ PHE 106 HZ PHE 106 -2.596 -9.234 -8.894 871 H ARG 107 H ARG 107 -2.877 -9.033 -1.136 872 HA ARG 107 HA ARG 107 -4.058 -6.762 -2.586 873 1HB ARG 107 1HB ARG 107 -5.462 -8.834 -2.115 874 2HB ARG 107 2HB ARG 107 -5.367 -8.401 -0.415 875 1HG ARG 107 1HG ARG 107 -7.362 -7.454 -0.974 876 2HG ARG 107 2HG ARG 107 -6.276 -6.097 -1.276 877 1HD ARG 107 1HD ARG 107 -7.729 -6.239 -3.144 878 2HD ARG 107 2HD ARG 107 -6.164 -6.861 -3.671 879 HE ARG 107 HE ARG 107 -8.438 -8.593 -2.917 880 1HH1 ARG 107 1HH1 ARG 107 -5.674 -7.870 -4.940 881 2HH1 ARG 107 2HH1 ARG 107 -5.888 -9.264 -5.949 882 1HH2 ARG 107 1HH2 ARG 107 -8.741 -10.414 -4.281 883 2HH2 ARG 107 2HH2 ARG 107 -7.618 -10.699 -5.584 884 H TRP 108 H TRP 108 -2.788 -5.116 -1.764 885 HA TRP 108 HA TRP 108 -2.632 -4.707 1.111 886 1HB TRP 108 1HB TRP 108 -0.652 -4.191 -0.185 887 2HB TRP 108 2HB TRP 108 -1.574 -3.164 -1.272 888 HD1 TRP 108 HD1 TRP 108 -2.924 -1.121 0.618 889 HE1 TRP 108 HE1 TRP 108 -1.528 0.524 2.019 890 HE3 TRP 108 HE3 TRP 108 1.503 -3.670 0.680 891 HZ2 TRP 108 HZ2 TRP 108 1.098 0.716 3.011 892 HZ3 TRP 108 HZ3 TRP 108 3.409 -2.677 1.871 893 HH2 TRP 108 HH2 TRP 108 3.210 -0.530 3.013 894 H VAL 109 H VAL 109 -4.571 -4.118 1.936 895 HA VAL 109 HA VAL 109 -5.988 -1.918 0.578 896 HB VAL 109 HB VAL 109 -7.196 -4.067 2.336 897 1HG1 VAL 109 1HG1 VAL 109 -8.511 -1.804 0.834 898 2HG1 VAL 109 2HG1 VAL 109 -8.336 -1.928 2.584 899 3HG1 VAL 109 3HG1 VAL 109 -9.347 -3.082 1.716 900 1HG2 VAL 109 1HG2 VAL 109 -7.499 -3.601 -0.630 901 2HG2 VAL 109 2HG2 VAL 109 -8.301 -4.852 0.321 902 3HG2 VAL 109 3HG2 VAL 109 -6.551 -4.888 0.116 903 H THR 110 H THR 110 -5.607 -0.079 1.634 904 HA THR 110 HA THR 110 -5.551 -0.186 4.574 905 HB THR 110 HB THR 110 -4.520 2.047 2.813 906 HG1 THR 110 HG1 THR 110 -3.455 -0.301 3.168 907 1HG2 THR 110 1HG2 THR 110 -5.198 2.734 5.077 908 2HG2 THR 110 2HG2 THR 110 -3.451 2.837 4.861 909 3HG2 THR 110 3HG2 THR 110 -4.147 1.490 5.762 910 H ASN 111 H ASN 111 -7.421 0.292 5.439 911 HA ASN 111 HA ASN 111 -9.307 2.057 4.093 912 1HB ASN 111 1HB ASN 111 -10.043 -0.093 5.180 913 2HB ASN 111 2HB ASN 111 -9.594 0.593 6.734 914 1HD2 ASN 111 1HD2 ASN 111 -12.173 -0.326 5.659 915 2HD2 ASN 111 2HD2 ASN 111 -13.257 1.008 5.859 916 H ILE 112 H ILE 112 -8.872 4.153 4.339 917 HA ILE 112 HA ILE 112 -7.325 5.152 6.531 918 HB ILE 112 HB ILE 112 -8.807 6.654 4.361 919 1HG1 ILE 112 1HG1 ILE 112 -7.075 5.147 3.477 920 2HG1 ILE 112 2HG1 ILE 112 -6.614 6.831 3.267 921 1HG2 ILE 112 1HG2 ILE 112 -7.330 8.531 4.919 922 2HG2 ILE 112 2HG2 ILE 112 -6.676 7.606 6.269 923 3HG2 ILE 112 3HG2 ILE 112 -8.372 8.088 6.271 924 1HD1 ILE 112 1HD1 ILE 112 -5.167 6.650 5.247 925 2HD1 ILE 112 2HD1 ILE 112 -4.711 5.534 3.959 926 3HD1 ILE 112 3HD1 ILE 112 -5.588 4.941 5.371 927 H HIS 113 H HIS 113 -10.707 4.902 5.779 928 HA HIS 113 HA HIS 113 -11.669 6.864 7.580 929 1HB HIS 113 1HB HIS 113 -12.955 5.754 5.677 930 2HB HIS 113 2HB HIS 113 -13.154 4.369 6.746 931 HD1 HIS 113 HD1 HIS 113 -15.325 4.373 7.906 932 HD2 HIS 113 HD2 HIS 113 -13.991 8.233 7.106 933 HE1 HIS 113 HE1 HIS 113 -17.120 5.910 8.778 934 HE2 HIS 113 HE2 HIS 113 -16.240 8.239 8.393 935 H GLU 114 H GLU 114 -10.841 3.466 7.912 936 HA GLU 114 HA GLU 114 -11.625 3.497 10.732 937 1HB GLU 114 1HB GLU 114 -10.478 1.220 9.101 938 2HB GLU 114 2HB GLU 114 -11.144 1.105 10.721 939 1HG GLU 114 1HG GLU 114 -13.341 1.812 9.792 940 2HG GLU 114 2HG GLU 114 -12.628 1.713 8.182 941 H GLN 115 H GLN 115 -8.982 4.345 8.926 942 HA GLN 115 HA GLN 115 -6.720 4.435 9.197 943 1HB GLN 115 1HB GLN 115 -7.605 4.460 12.086 944 2HB GLN 115 2HB GLN 115 -5.930 4.668 11.601 945 1HG GLN 115 1HG GLN 115 -8.180 6.438 10.676 946 2HG GLN 115 2HG GLN 115 -7.152 6.787 12.065 947 1HE2 GLN 115 1HE2 GLN 115 -4.762 5.701 10.814 948 2HE2 GLN 115 2HE2 GLN 115 -4.276 6.856 9.624 949 H LYS 116 H LYS 116 -7.552 1.996 8.509 950 HA LYS 116 HA LYS 116 -6.158 0.105 10.289 951 1HB LYS 116 1HB LYS 116 -8.712 0.247 10.518 952 2HB LYS 116 2HB LYS 116 -8.775 -0.486 8.927 953 1HG LYS 116 1HG LYS 116 -7.725 -2.480 9.742 954 2HG LYS 116 2HG LYS 116 -7.449 -1.732 11.321 955 1HD LYS 116 1HD LYS 116 -9.829 -1.525 11.683 956 2HD LYS 116 2HD LYS 116 -10.157 -2.157 10.069 957 1HE LYS 116 1HE LYS 116 -9.027 -4.273 10.766 958 2HE LYS 116 2HE LYS 116 -8.950 -3.621 12.405 959 1HZ LYS 116 1HZ LYS 116 -11.334 -4.396 10.835 960 2HZ LYS 116 2HZ LYS 116 -11.463 -3.320 12.137 961 3HZ LYS 116 3HZ LYS 116 -10.881 -4.888 12.395 962 H ARG 117 H ARG 117 -4.680 -1.019 9.200 963 HA ARG 117 HA ARG 117 -4.875 -1.125 6.275 964 1HB ARG 117 1HB ARG 117 -2.835 -0.111 7.219 965 2HB ARG 117 2HB ARG 117 -2.491 -1.604 8.075 966 1HG ARG 117 1HG ARG 117 -1.943 -2.742 6.116 967 2HG ARG 117 2HG ARG 117 -2.751 -1.555 5.089 968 1HD ARG 117 1HD ARG 117 -0.302 -1.374 4.974 969 2HD ARG 117 2HD ARG 117 -1.052 0.092 5.599 970 HE ARG 117 HE ARG 117 -0.421 -1.195 7.862 971 1HH1 ARG 117 1HH1 ARG 117 1.450 -0.600 4.976 972 2HH1 ARG 117 2HH1 ARG 117 2.973 -0.584 5.802 973 1HH2 ARG 117 1HH2 ARG 117 1.586 -1.143 8.981 974 2HH2 ARG 117 2HH2 ARG 117 3.047 -0.870 8.075 975 H TYR 118 H TYR 118 -5.474 -2.926 5.345 976 HA TYR 118 HA TYR 118 -5.434 -5.436 6.870 977 1HB TYR 118 1HB TYR 118 -6.997 -4.623 4.411 978 2HB TYR 118 2HB TYR 118 -7.063 -6.215 5.151 979 HD1 TYR 118 HD1 TYR 118 -8.453 -6.640 7.006 980 HD2 TYR 118 HD2 TYR 118 -7.873 -2.638 5.679 981 HE1 TYR 118 HE1 TYR 118 -10.313 -5.905 8.437 982 HE2 TYR 118 HE2 TYR 118 -9.728 -1.889 7.111 983 HH TYR 118 HH TYR 118 -11.531 -2.595 8.335 984 H TYR 119 H TYR 119 -4.419 -7.243 6.106 985 HA TYR 119 HA TYR 119 -2.982 -7.005 3.540 986 1HB TYR 119 1HB TYR 119 -2.221 -8.542 6.031 987 2HB TYR 119 2HB TYR 119 -1.383 -8.680 4.490 988 HD1 TYR 119 HD1 TYR 119 0.095 -6.958 3.724 989 HD2 TYR 119 HD2 TYR 119 -2.033 -6.505 7.377 990 HE1 TYR 119 HE1 TYR 119 1.574 -5.103 4.343 991 HE2 TYR 119 HE2 TYR 119 -0.557 -4.646 8.013 992 HH TYR 119 HH TYR 119 1.575 -3.764 7.539 993 H TYR 120 H TYR 120 -3.999 -8.172 2.037 994 HA TYR 120 HA TYR 120 -5.117 -10.777 2.846 995 1HB TYR 120 1HB TYR 120 -5.903 -9.022 0.510 996 2HB TYR 120 2HB TYR 120 -6.571 -10.613 0.847 997 HD1 TYR 120 HD1 TYR 120 -8.075 -10.943 2.770 998 HD2 TYR 120 HD2 TYR 120 -6.609 -7.086 1.742 999 HE1 TYR 120 HE1 TYR 120 -9.822 -9.915 4.159 1000 HE2 TYR 120 HE2 TYR 120 -8.351 -6.046 3.131 1001 HH TYR 120 HH TYR 120 -10.482 -6.534 4.083 1002 H THR 121 H THR 121 -4.551 -12.587 1.743 1003 HA THR 121 HA THR 121 -2.179 -12.558 0.162 1004 HB THR 121 HB THR 121 -2.812 -14.466 1.622 1005 HG1 THR 121 HG1 THR 121 -1.352 -15.147 0.188 1006 1HG2 THR 121 1HG2 THR 121 -4.873 -15.038 -0.507 1007 2HG2 THR 121 2HG2 THR 121 -5.210 -14.530 1.148 1008 3HG2 THR 121 3HG2 THR 121 -4.461 -16.097 0.841 1009 H PHE 122 H PHE 122 -2.407 -14.126 -1.961 1010 HA PHE 122 HA PHE 122 -3.427 -12.410 -3.927 1011 1HB PHE 122 1HB PHE 122 -2.973 -14.322 -5.501 1012 2HB PHE 122 2HB PHE 122 -1.613 -13.829 -4.501 1013 HD1 PHE 122 HD1 PHE 122 -0.727 -15.278 -2.802 1014 HD2 PHE 122 HD2 PHE 122 -4.093 -16.454 -5.125 1015 HE1 PHE 122 HE1 PHE 122 -0.459 -17.593 -2.012 1016 HE2 PHE 122 HE2 PHE 122 -3.831 -18.770 -4.338 1017 HZ PHE 122 HZ PHE 122 -2.015 -19.343 -2.779 1018 H ASP 123 H ASP 123 -4.915 -15.128 -2.316 1019 HA ASP 123 HA ASP 123 -7.144 -15.206 -4.184 1020 1HB ASP 123 1HB ASP 123 -6.235 -17.287 -3.136 1021 2HB ASP 123 2HB ASP 123 -6.784 -16.694 -1.572 1022 H ASN 124 H ASN 124 -6.267 -13.133 -1.942 1023 HA ASN 124 HA ASN 124 -7.229 -11.546 -0.673 1024 1HB ASN 124 1HB ASN 124 -8.785 -11.394 -2.677 1025 2HB ASN 124 2HB ASN 124 -9.913 -12.390 -1.765 1026 1HD2 ASN 124 1HD2 ASN 124 -10.906 -11.530 0.073 1027 2HD2 ASN 124 2HD2 ASN 124 -10.947 -9.828 0.371 1028 H SER 125 H SER 125 -6.537 -13.122 0.964 1029 HA SER 125 HA SER 125 -8.816 -13.732 2.708 1030 1HB SER 125 1HB SER 125 -6.302 -15.417 2.516 1031 2HB SER 125 2HB SER 125 -7.736 -15.759 3.486 1032 HG SER 125 HG SER 125 -8.671 -16.581 1.791 1033 H LEU 126 H LEU 126 -8.495 -13.184 4.873 1034 HA LEU 126 HA LEU 126 -6.657 -11.031 5.204 1035 1HB LEU 126 1HB LEU 126 -8.948 -11.146 6.204 1036 2HB LEU 126 2HB LEU 126 -8.347 -12.362 7.317 1037 HG LEU 126 HG LEU 126 -6.732 -10.709 8.214 1038 1HD1 LEU 126 1HD1 LEU 126 -6.555 -9.318 6.194 1039 2HD1 LEU 126 2HD1 LEU 126 -6.948 -8.367 7.626 1040 3HD1 LEU 126 3HD1 LEU 126 -8.205 -8.753 6.453 1041 1HD2 LEU 126 1HD2 LEU 126 -9.620 -9.833 8.256 1042 2HD2 LEU 126 2HD2 LEU 126 -8.380 -9.364 9.420 1043 3HD2 LEU 126 3HD2 LEU 126 -8.889 -11.049 9.304 1044 H LEU 127 H LEU 127 -4.597 -11.244 5.628 1045 HA LEU 127 HA LEU 127 -3.659 -13.562 7.170 1046 1HB LEU 127 1HB LEU 127 -2.178 -11.579 5.439 1047 2HB LEU 127 2HB LEU 127 -1.396 -12.845 6.369 1048 HG LEU 127 HG LEU 127 -3.377 -13.292 4.134 1049 1HD1 LEU 127 1HD1 LEU 127 -1.242 -12.416 3.332 1050 2HD1 LEU 127 2HD1 LEU 127 -1.454 -14.106 2.874 1051 3HD1 LEU 127 3HD1 LEU 127 -0.386 -13.682 4.212 1052 1HD2 LEU 127 1HD2 LEU 127 -3.475 -15.041 5.823 1053 2HD2 LEU 127 2HD2 LEU 127 -1.723 -15.234 5.747 1054 3HD2 LEU 127 3HD2 LEU 127 -2.717 -15.644 4.347 1055 H PHE 128 H PHE 128 -3.395 -10.030 7.016 1056 HA PHE 128 HA PHE 128 -2.757 -9.992 9.869 1057 1HB PHE 128 1HB PHE 128 -0.643 -9.955 8.373 1058 2HB PHE 128 2HB PHE 128 -1.151 -8.333 7.925 1059 HD1 PHE 128 HD1 PHE 128 -1.054 -6.511 9.535 1060 HD2 PHE 128 HD2 PHE 128 0.201 -10.445 10.561 1061 HE1 PHE 128 HE1 PHE 128 0.095 -5.623 11.517 1062 HE2 PHE 128 HE2 PHE 128 1.347 -9.562 12.552 1063 HZ PHE 128 HZ PHE 128 1.292 -7.148 13.032 1064 H THR 129 H THR 129 -3.378 -8.039 10.902 1065 HA THR 129 HA THR 129 -4.517 -5.930 9.227 1066 HB THR 129 HB THR 129 -6.104 -7.063 11.531 1067 HG1 THR 129 HG1 THR 129 -5.836 -8.002 8.985 1068 1HG2 THR 129 1HG2 THR 129 -7.926 -5.766 10.519 1069 2HG2 THR 129 2HG2 THR 129 -6.819 -5.191 9.271 1070 3HG2 THR 129 3HG2 THR 129 -6.564 -4.736 10.957 1071 H GLU 130 H GLU 130 -3.638 -4.092 9.918 1072 HA GLU 130 HA GLU 130 -3.179 -3.759 12.805 1073 1HB GLU 130 1HB GLU 130 -1.057 -2.545 12.210 1074 2HB GLU 130 2HB GLU 130 -1.023 -4.278 11.921 1075 1HG GLU 130 1HG GLU 130 -1.302 -3.962 9.573 1076 2HG GLU 130 2HG GLU 130 -1.599 -2.238 9.788 1077 H SER 131 H SER 131 -3.871 -1.848 13.601 1078 HA SER 131 HA SER 131 -4.963 0.124 11.808 1079 1HB SER 131 1HB SER 131 -4.634 0.122 14.819 1080 2HB SER 131 2HB SER 131 -5.491 1.362 13.902 1081 HG SER 131 HG SER 131 -7.135 0.067 13.677 1082 H ILE 132 H ILE 132 -3.982 1.902 11.081 1083 HA ILE 132 HA ILE 132 -1.140 2.067 11.554 1084 HB ILE 132 HB ILE 132 -1.252 3.901 9.793 1085 1HG1 ILE 132 1HG1 ILE 132 -4.042 2.779 9.435 1086 2HG1 ILE 132 2HG1 ILE 132 -3.675 4.382 10.061 1087 1HG2 ILE 132 1HG2 ILE 132 -0.497 1.648 9.309 1088 2HG2 ILE 132 2HG2 ILE 132 -1.462 2.265 7.966 1089 3HG2 ILE 132 3HG2 ILE 132 -2.163 1.111 9.101 1090 1HD1 ILE 132 1HD1 ILE 132 -4.327 4.511 7.749 1091 2HD1 ILE 132 2HD1 ILE 132 -3.071 3.359 7.300 1092 3HD1 ILE 132 3HD1 ILE 132 -2.626 4.952 7.914 1093 H GLN 133 H GLN 133 -0.810 2.861 13.515 1094 HA GLN 133 HA GLN 133 -0.258 4.453 15.017 1095 1HB GLN 133 1HB GLN 133 -0.132 5.794 12.661 1096 2HB GLN 133 2HB GLN 133 -1.356 6.738 13.492 1097 1HG GLN 133 1HG GLN 133 1.007 6.141 15.112 1098 2HG GLN 133 2HG GLN 133 1.328 7.121 13.684 1099 1HE2 GLN 133 1HE2 GLN 133 0.426 9.161 13.526 1100 2HE2 GLN 133 2HE2 GLN 133 -0.213 9.998 14.897
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