NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | position | program | type |
645670 | 6jxu | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H TYR 21 HT1 TYR 21 14.499 -5.268 0.075 2 HA TYR 21 HA TYR 21 13.061 -3.605 -0.850 3 HB2 TYR 21 HB2 TYR 21 11.849 -6.001 -2.236 4 HB3 TYR 21 HB1 TYR 21 10.994 -4.473 -2.065 5 HD1 TYR 21 HD1 TYR 21 11.643 -2.532 -3.358 6 HD2 TYR 21 HD2 TYR 21 13.782 -6.194 -3.718 7 HE1 TYR 21 HE1 TYR 21 12.724 -1.692 -5.401 8 HE2 TYR 21 HE2 TYR 21 14.870 -5.361 -5.761 9 HH TYR 21 HH TYR 21 14.363 -3.663 -7.555 10 H ILE 22 HN ILE 22 10.464 -3.654 -0.329 11 HA ILE 22 HA ILE 22 10.200 -5.185 2.180 12 HB ILE 22 HB ILE 22 9.232 -2.371 1.627 13 HG12 ILE 22 HG12 ILE 22 11.653 -2.552 2.134 14 HG13 ILE 22 HG11 ILE 22 10.767 -1.686 3.383 15 HG21 ILE 22 HG21 ILE 22 7.623 -3.658 2.956 16 HG22 ILE 22 HG22 ILE 22 8.366 -2.362 3.892 17 HG23 ILE 22 HG23 ILE 22 8.893 -4.030 4.120 18 HD11 ILE 22 HD11 ILE 22 12.398 -3.167 4.367 19 HD12 ILE 22 HD12 ILE 22 11.697 -4.546 3.519 20 HD13 ILE 22 HD13 ILE 22 10.769 -3.709 4.764 21 H LYS 23 HN LYS 23 8.628 -6.650 2.012 22 HA LYS 23 HA LYS 23 6.539 -6.279 0.013 23 HB2 LYS 23 HB2 LYS 23 7.477 -8.588 1.672 24 HB3 LYS 23 HB1 LYS 23 5.868 -8.624 0.972 25 HG2 LYS 23 HG2 LYS 23 7.040 -9.680 -0.668 26 HG3 LYS 23 HG1 LYS 23 7.161 -8.011 -1.230 27 HD2 LYS 23 HD2 LYS 23 9.354 -8.690 -1.397 28 HD3 LYS 23 HD1 LYS 23 9.341 -7.998 0.225 29 HE2 LYS 23 HE2 LYS 23 8.939 -10.931 -0.357 30 HE3 LYS 23 HE1 LYS 23 10.501 -10.213 0.037 31 HZ1 LYS 23 HZ1 LYS 23 8.144 -10.598 1.762 32 HZ2 LYS 23 HZ2 LYS 23 9.225 -9.331 2.095 33 HZ3 LYS 23 HZ3 LYS 23 9.777 -10.932 2.073 34 H LEU 24 HN LEU 24 4.846 -5.114 0.581 35 HA LEU 24 HA LEU 24 3.920 -5.157 3.354 36 HB2 LEU 24 HB2 LEU 24 3.140 -3.436 0.998 37 HB3 LEU 24 HB1 LEU 24 2.411 -3.314 2.587 38 HG LEU 24 HG LEU 24 5.323 -2.806 1.962 39 HD11 LEU 24 HD11 LEU 24 3.827 -1.109 1.020 40 HD12 LEU 24 HD12 LEU 24 4.797 -0.468 2.345 41 HD13 LEU 24 HD13 LEU 24 3.102 -0.872 2.609 42 HD21 LEU 24 HD21 LEU 24 5.101 -3.600 4.209 43 HD22 LEU 24 HD22 LEU 24 3.725 -2.537 4.503 44 HD23 LEU 24 HD23 LEU 24 5.333 -1.853 4.264 45 H LYS 25 HN LYS 25 2.386 -6.523 3.922 46 HA LYS 25 HA LYS 25 0.816 -7.889 1.901 47 HB2 LYS 25 HB2 LYS 25 0.654 -8.214 4.902 48 HB3 LYS 25 HB1 LYS 25 0.102 -9.343 3.672 49 HG2 LYS 25 HG2 LYS 25 2.429 -9.700 2.977 50 HG3 LYS 25 HG1 LYS 25 2.961 -8.599 4.248 51 HD2 LYS 25 HD2 LYS 25 3.237 -10.752 5.146 52 HD3 LYS 25 HD1 LYS 25 1.751 -10.138 5.872 53 HE2 LYS 25 HE2 LYS 25 0.429 -11.393 4.244 54 HE3 LYS 25 HE1 LYS 25 1.909 -11.987 3.493 55 HZ1 LYS 25 HZ1 LYS 25 0.786 -13.528 5.111 56 HZ2 LYS 25 HZ2 LYS 25 1.268 -12.474 6.340 57 HZ3 LYS 25 HZ3 LYS 25 2.430 -13.247 5.389 58 H VAL 26 HN VAL 26 -0.815 -6.728 1.100 59 HA VAL 26 HA VAL 26 -2.390 -5.000 2.851 60 HB VAL 26 HB VAL 26 -3.073 -5.373 -0.034 61 HG11 VAL 26 HG11 VAL 26 -3.613 -2.992 0.133 62 HG12 VAL 26 HG12 VAL 26 -3.049 -2.987 1.804 63 HG13 VAL 26 HG13 VAL 26 -4.459 -3.945 1.353 64 HG21 VAL 26 HG21 VAL 26 -0.728 -3.748 0.945 65 HG22 VAL 26 HG22 VAL 26 -1.414 -3.667 -0.677 66 HG23 VAL 26 HG23 VAL 26 -0.660 -5.158 -0.112 67 H ILE 27 HN ILE 27 -4.274 -5.571 3.680 68 HA ILE 27 HA ILE 27 -5.344 -8.197 3.112 69 HB ILE 27 HB ILE 27 -6.474 -6.116 4.989 70 HG12 ILE 27 HG12 ILE 27 -4.123 -6.556 5.551 71 HG13 ILE 27 HG11 ILE 27 -5.203 -7.212 6.776 72 HG21 ILE 27 HG21 ILE 27 -7.464 -8.048 6.125 73 HG22 ILE 27 HG22 ILE 27 -6.774 -9.116 4.903 74 HG23 ILE 27 HG23 ILE 27 -7.999 -7.933 4.448 75 HD11 ILE 27 HD11 ILE 27 -4.911 -9.444 5.835 76 HD12 ILE 27 HD12 ILE 27 -3.365 -8.728 6.295 77 HD13 ILE 27 HD13 ILE 27 -3.841 -8.786 4.598 78 H GLY 28 HN GLY 28 -6.495 -8.367 1.281 79 HA2 GLY 28 HA2 GLY 28 -8.111 -6.234 0.249 80 HA3 GLY 28 HA1 GLY 28 -8.035 -7.876 -0.374 81 H GLN 29 HN GLN 29 -10.403 -6.270 -0.065 82 HA GLN 29 HA GLN 29 -11.857 -6.927 2.256 83 HB2 GLN 29 HB2 GLN 29 -12.375 -5.150 0.485 84 HB3 GLN 29 HB1 GLN 29 -13.106 -6.452 -0.442 85 HG2 GLN 29 HG2 GLN 29 -14.823 -5.302 0.751 86 HG3 GLN 29 HG1 GLN 29 -14.620 -6.901 1.466 87 HE21 GLN 29 HE21 GLN 29 -13.879 -7.084 3.549 88 HE22 GLN 29 HE22 GLN 29 -13.687 -5.729 4.605 89 H ASP 30 HN ASP 30 -11.325 -8.638 -0.741 90 HA ASP 30 HA ASP 30 -13.294 -10.679 -0.084 91 HB2 ASP 30 HB2 ASP 30 -12.555 -11.718 -2.227 92 HB3 ASP 30 HB1 ASP 30 -13.126 -10.063 -2.418 93 H SER 31 HN SER 31 -10.654 -10.089 1.365 94 HA SER 31 HA SER 31 -9.119 -11.234 2.555 95 HB2 SER 31 HB2 SER 31 -10.697 -13.682 1.719 96 HB3 SER 31 HB1 SER 31 -9.500 -13.616 3.017 97 HG SER 31 HG SER 31 -12.051 -13.126 3.230 98 H SER 32 HN SER 32 -7.870 -10.408 0.645 99 HA SER 32 HA SER 32 -6.550 -12.649 -0.733 100 HB2 SER 32 HB2 SER 32 -5.982 -10.252 -2.115 101 HB3 SER 32 HB1 SER 32 -7.018 -11.573 -2.654 102 HG SER 32 HG SER 32 -8.748 -10.440 -2.185 103 H GLU 33 HN GLU 33 -4.322 -12.721 -0.667 104 HA GLU 33 HA GLU 33 -3.059 -10.956 1.292 105 HB2 GLU 33 HB2 GLU 33 -1.792 -13.340 -0.049 106 HB3 GLU 33 HB1 GLU 33 -1.336 -12.583 1.470 107 HG2 GLU 33 HG2 GLU 33 -3.170 -13.500 2.600 108 HG3 GLU 33 HG1 GLU 33 -3.992 -13.921 1.098 109 H ILE 34 HN ILE 34 -3.112 -9.131 -0.224 110 HA ILE 34 HA ILE 34 -1.587 -9.260 -2.641 111 HB ILE 34 HB ILE 34 -2.392 -6.770 -1.145 112 HG12 ILE 34 HG12 ILE 34 -4.365 -8.201 -1.503 113 HG13 ILE 34 HG11 ILE 34 -4.435 -6.757 -2.510 114 HG21 ILE 34 HG21 ILE 34 -0.920 -6.116 -2.805 115 HG22 ILE 34 HG22 ILE 34 -2.489 -5.952 -3.598 116 HG23 ILE 34 HG23 ILE 34 -1.477 -7.358 -3.926 117 HD11 ILE 34 HD11 ILE 34 -5.169 -8.684 -3.765 118 HD12 ILE 34 HD12 ILE 34 -3.661 -9.528 -3.407 119 HD13 ILE 34 HD13 ILE 34 -3.646 -8.087 -4.425 120 H HIS 35 HN HIS 35 0.557 -9.404 -2.703 121 HA HIS 35 HA HIS 35 2.117 -8.347 -0.455 122 HB2 HIS 35 HB2 HIS 35 2.411 -10.608 -2.296 123 HB3 HIS 35 HB1 HIS 35 3.891 -9.680 -2.098 124 HD2 HIS 35 HD2 HIS 35 3.914 -9.122 1.037 125 HE1 HIS 35 HE1 HIS 35 3.342 -13.297 1.403 126 HE2 HIS 35 HE2 HIS 35 4.328 -11.231 2.501 127 H PHE 36 HN PHE 36 2.275 -6.168 -0.948 128 HA PHE 36 HA PHE 36 3.135 -5.378 -3.607 129 HB2 PHE 36 HB2 PHE 36 1.554 -4.124 -1.815 130 HB3 PHE 36 HB1 PHE 36 3.099 -3.365 -1.437 131 HD1 PHE 36 HD1 PHE 36 0.309 -2.591 -2.992 132 HD2 PHE 36 HD2 PHE 36 4.402 -3.135 -4.000 133 HE1 PHE 36 HE1 PHE 36 0.029 -1.093 -4.924 134 HE2 PHE 36 HE2 PHE 36 4.134 -1.639 -5.928 135 HZ PHE 36 HZ PHE 36 1.943 -0.614 -6.394 136 H LYS 37 HN LYS 37 5.197 -5.350 -4.183 137 HA LYS 37 HA LYS 37 7.275 -5.376 -2.141 138 HB2 LYS 37 HB2 LYS 37 7.222 -6.905 -4.177 139 HB3 LYS 37 HB1 LYS 37 7.632 -5.492 -5.136 140 HG2 LYS 37 HG2 LYS 37 9.706 -5.232 -3.869 141 HG3 LYS 37 HG1 LYS 37 9.291 -6.649 -2.900 142 HD2 LYS 37 HD2 LYS 37 9.730 -6.622 -5.890 143 HD3 LYS 37 HD1 LYS 37 10.887 -7.197 -4.689 144 HE2 LYS 37 HE2 LYS 37 9.160 -8.849 -3.945 145 HE3 LYS 37 HE1 LYS 37 8.181 -8.356 -5.324 146 HZ1 LYS 37 HZ1 LYS 37 9.947 -9.066 -6.800 147 HZ2 LYS 37 HZ2 LYS 37 9.472 -10.344 -5.800 148 HZ3 LYS 37 HZ3 LYS 37 10.909 -9.514 -5.483 149 H VAL 38 HN VAL 38 7.538 -3.355 -1.332 150 HA VAL 38 HA VAL 38 7.771 -1.119 -3.218 151 HB VAL 38 HB VAL 38 7.412 0.374 -1.397 152 HG11 VAL 38 HG11 VAL 38 5.561 -1.987 -1.066 153 HG12 VAL 38 HG12 VAL 38 5.414 -0.729 -2.290 154 HG13 VAL 38 HG13 VAL 38 5.221 -0.324 -0.585 155 HG21 VAL 38 HG21 VAL 38 7.606 -2.008 0.444 156 HG22 VAL 38 HG22 VAL 38 7.187 -0.363 0.928 157 HG23 VAL 38 HG23 VAL 38 8.794 -0.715 0.287 158 H LYS 39 HN LYS 39 9.427 0.533 -2.740 159 HA LYS 39 HA LYS 39 11.980 -0.749 -2.035 160 HB2 LYS 39 HB2 LYS 39 11.540 0.209 -4.392 161 HB3 LYS 39 HB1 LYS 39 11.659 1.788 -3.633 162 HG2 LYS 39 HG2 LYS 39 13.937 1.180 -2.850 163 HG3 LYS 39 HG1 LYS 39 13.804 -0.321 -3.770 164 HD2 LYS 39 HD2 LYS 39 13.491 0.977 -5.827 165 HD3 LYS 39 HD1 LYS 39 13.636 2.473 -4.904 166 HE2 LYS 39 HE2 LYS 39 15.911 1.677 -4.178 167 HE3 LYS 39 HE1 LYS 39 15.745 0.371 -5.352 168 HZ1 LYS 39 HZ1 LYS 39 15.718 3.278 -5.966 169 HZ2 LYS 39 HZ2 LYS 39 15.502 2.046 -7.102 170 HZ3 LYS 39 HZ3 LYS 39 16.978 2.199 -6.296 171 H MET 40 HN MET 40 13.146 0.036 -0.359 172 HA MET 40 HA MET 40 11.976 2.043 1.324 173 HB2 MET 40 HB2 MET 40 13.130 0.113 2.288 174 HB3 MET 40 HB1 MET 40 14.637 0.623 1.539 175 HG2 MET 40 HG2 MET 40 14.599 1.192 3.898 176 HG3 MET 40 HG1 MET 40 14.645 2.643 2.901 177 HE1 MET 40 HE1 MET 40 12.612 0.372 5.252 178 HE2 MET 40 HE2 MET 40 11.551 0.281 3.848 179 HE3 MET 40 HE3 MET 40 11.018 1.125 5.303 180 H THR 41 HN THR 41 11.987 3.800 -0.169 181 HA THR 41 HA THR 41 13.825 5.769 0.344 182 HB THR 41 HB THR 41 15.493 4.447 -0.905 183 HG1 THR 41 HG1 THR 41 14.862 6.991 -1.294 184 HG21 THR 41 HG21 THR 41 13.972 3.313 -2.472 185 HG22 THR 41 HG22 THR 41 15.289 4.130 -3.316 186 HG23 THR 41 HG23 THR 41 13.676 4.846 -3.290 187 H THR 42 HN THR 42 11.532 4.329 -1.821 188 HA THR 42 HA THR 42 10.811 6.830 -3.078 189 HB THR 42 HB THR 42 9.304 4.220 -3.237 190 HG1 THR 42 HG1 THR 42 11.188 4.867 -5.204 191 HG21 THR 42 HG21 THR 42 8.184 6.167 -4.204 192 HG22 THR 42 HG22 THR 42 8.694 5.051 -5.470 193 HG23 THR 42 HG23 THR 42 9.614 6.525 -5.173 194 H HIS 43 HN HIS 43 8.994 8.023 -2.668 195 HA HIS 43 HA HIS 43 7.838 7.861 -0.087 196 HB2 HIS 43 HB2 HIS 43 7.582 9.618 -2.433 197 HB3 HIS 43 HB1 HIS 43 6.108 9.465 -1.485 198 HD2 HIS 43 HD2 HIS 43 6.286 10.423 1.168 199 HE1 HIS 43 HE1 HIS 43 9.915 12.480 0.467 200 HE2 HIS 43 HE2 HIS 43 8.094 11.990 2.161 201 H LEU 44 HN LEU 44 5.773 7.243 0.550 202 HA LEU 44 HA LEU 44 4.716 4.988 -0.771 203 HB2 LEU 44 HB2 LEU 44 3.773 6.672 1.524 204 HB3 LEU 44 HB1 LEU 44 2.771 5.379 0.891 205 HG LEU 44 HG LEU 44 5.605 4.862 1.742 206 HD11 LEU 44 HD11 LEU 44 4.641 4.087 3.905 207 HD12 LEU 44 HD12 LEU 44 3.136 4.890 3.459 208 HD13 LEU 44 HD13 LEU 44 4.608 5.836 3.677 209 HD21 LEU 44 HD21 LEU 44 4.732 2.589 2.055 210 HD22 LEU 44 HD22 LEU 44 4.533 3.154 0.395 211 HD23 LEU 44 HD23 LEU 44 3.152 3.133 1.492 212 H LYS 45 HN LYS 45 4.271 8.266 -1.387 213 HA LYS 45 HA LYS 45 1.617 8.458 -2.212 214 HB2 LYS 45 HB2 LYS 45 2.873 10.463 -2.099 215 HB3 LYS 45 HB1 LYS 45 4.145 9.824 -3.127 216 HG2 LYS 45 HG2 LYS 45 2.894 11.455 -4.356 217 HG3 LYS 45 HG1 LYS 45 2.559 9.861 -5.035 218 HD2 LYS 45 HD2 LYS 45 0.454 9.768 -3.829 219 HD3 LYS 45 HD1 LYS 45 0.797 11.322 -3.069 220 HE2 LYS 45 HE2 LYS 45 0.830 12.365 -5.314 221 HE3 LYS 45 HE1 LYS 45 0.379 10.811 -6.014 222 HZ1 LYS 45 HZ1 LYS 45 -1.737 10.995 -5.287 223 HZ2 LYS 45 HZ2 LYS 45 -1.392 12.650 -5.349 224 HZ3 LYS 45 HZ3 LYS 45 -1.322 11.828 -3.869 225 H LYS 46 HN LYS 46 4.499 7.481 -4.036 226 HA LYS 46 HA LYS 46 3.120 7.026 -6.474 227 HB2 LYS 46 HB2 LYS 46 5.653 7.419 -6.049 228 HB3 LYS 46 HB1 LYS 46 5.712 5.687 -5.755 229 HG2 LYS 46 HG2 LYS 46 6.333 6.113 -8.027 230 HG3 LYS 46 HG1 LYS 46 4.758 5.314 -8.011 231 HD2 LYS 46 HD2 LYS 46 3.703 7.573 -8.207 232 HD3 LYS 46 HD1 LYS 46 5.317 8.251 -8.425 233 HE2 LYS 46 HE2 LYS 46 5.614 7.168 -10.473 234 HE3 LYS 46 HE1 LYS 46 4.309 6.025 -10.163 235 HZ1 LYS 46 HZ1 LYS 46 4.018 8.924 -10.736 236 HZ2 LYS 46 HZ2 LYS 46 2.739 7.898 -10.305 237 HZ3 LYS 46 HZ3 LYS 46 3.583 7.640 -11.751 238 H LEU 47 HN LEU 47 3.673 5.109 -3.646 239 HA LEU 47 HA LEU 47 3.079 2.594 -4.897 240 HB2 LEU 47 HB2 LEU 47 3.477 3.504 -2.067 241 HB3 LEU 47 HB1 LEU 47 2.813 1.915 -2.392 242 HG LEU 47 HG LEU 47 5.132 1.615 -2.027 243 HD11 LEU 47 HD11 LEU 47 5.862 0.601 -4.040 244 HD12 LEU 47 HD12 LEU 47 4.842 1.653 -5.018 245 HD13 LEU 47 HD13 LEU 47 4.108 0.429 -3.983 246 HD21 LEU 47 HD21 LEU 47 5.647 3.772 -4.075 247 HD22 LEU 47 HD22 LEU 47 6.870 2.830 -3.220 248 HD23 LEU 47 HD23 LEU 47 5.834 3.946 -2.331 249 H LYS 48 HN LYS 48 1.347 4.930 -2.902 250 HA LYS 48 HA LYS 48 -1.021 3.475 -2.548 251 HB2 LYS 48 HB2 LYS 48 -0.500 6.444 -2.626 252 HB3 LYS 48 HB1 LYS 48 -2.063 5.760 -2.214 253 HG2 LYS 48 HG2 LYS 48 -1.129 4.666 -0.279 254 HG3 LYS 48 HG1 LYS 48 0.493 5.198 -0.727 255 HD2 LYS 48 HD2 LYS 48 -0.296 6.657 0.991 256 HD3 LYS 48 HD1 LYS 48 -0.317 7.558 -0.525 257 HE2 LYS 48 HE2 LYS 48 -2.731 7.062 -0.737 258 HE3 LYS 48 HE1 LYS 48 -2.677 6.262 0.834 259 HZ1 LYS 48 HZ1 LYS 48 -1.973 8.370 1.814 260 HZ2 LYS 48 HZ2 LYS 48 -3.474 8.513 1.055 261 HZ3 LYS 48 HZ3 LYS 48 -2.086 9.129 0.299 262 H GLU 49 HN GLU 49 -0.138 5.831 -5.066 263 HA GLU 49 HA GLU 49 -2.630 5.700 -6.397 264 HB2 GLU 49 HB2 GLU 49 -1.431 6.775 -8.291 265 HB3 GLU 49 HB1 GLU 49 -1.225 7.603 -6.756 266 HG2 GLU 49 HG2 GLU 49 0.981 6.657 -6.501 267 HG3 GLU 49 HG1 GLU 49 0.773 5.722 -7.982 268 H SER 50 HN SER 50 0.440 3.991 -6.916 269 HA SER 50 HA SER 50 -0.257 2.662 -9.270 270 HB2 SER 50 HB2 SER 50 1.612 1.796 -7.053 271 HB3 SER 50 HB1 SER 50 1.528 1.043 -8.648 272 HG SER 50 HG SER 50 2.519 3.555 -7.893 273 H TYR 51 HN TYR 51 -0.911 1.854 -5.899 274 HA TYR 51 HA TYR 51 -1.876 -0.760 -6.338 275 HB2 TYR 51 HB2 TYR 51 -1.283 0.208 -4.104 276 HB3 TYR 51 HB1 TYR 51 -2.741 1.188 -4.191 277 HD1 TYR 51 HD1 TYR 51 -1.495 -2.290 -3.993 278 HD2 TYR 51 HD2 TYR 51 -4.860 0.281 -3.597 279 HE1 TYR 51 HE1 TYR 51 -2.769 -4.124 -2.968 280 HE2 TYR 51 HE2 TYR 51 -6.144 -1.550 -2.574 281 HH TYR 51 HH TYR 51 -6.143 -3.982 -2.492 282 H CYS 52 HN CYS 52 -3.472 2.392 -6.235 283 HA CYS 52 HA CYS 52 -6.108 1.472 -6.613 284 HB2 CYS 52 HB2 CYS 52 -4.974 4.146 -7.461 285 HB3 CYS 52 HB1 CYS 52 -6.659 3.776 -7.116 286 HG CYS 52 HG CYS 52 -4.108 3.868 -4.832 287 H GLN 53 HN GLN 53 -3.636 2.599 -8.889 288 HA GLN 53 HA GLN 53 -5.194 2.459 -11.220 289 HB2 GLN 53 HB2 GLN 53 -2.202 2.128 -10.923 290 HB3 GLN 53 HB1 GLN 53 -3.049 2.454 -12.432 291 HG2 GLN 53 HG2 GLN 53 -3.769 4.599 -11.626 292 HG3 GLN 53 HG1 GLN 53 -3.092 4.272 -10.032 293 HE21 GLN 53 HE21 GLN 53 -2.516 6.478 -11.758 294 HE22 GLN 53 HE22 GLN 53 -0.822 6.418 -12.105 295 H ARG 54 HN ARG 54 -3.358 -0.013 -9.517 296 HA ARG 54 HA ARG 54 -3.523 -1.946 -11.610 297 HB2 ARG 54 HB2 ARG 54 -1.888 -1.899 -9.610 298 HB3 ARG 54 HB1 ARG 54 -3.201 -2.637 -8.700 299 HG2 ARG 54 HG2 ARG 54 -3.263 -4.390 -10.561 300 HG3 ARG 54 HG1 ARG 54 -1.695 -3.744 -11.042 301 HD2 ARG 54 HD2 ARG 54 -0.924 -5.307 -9.615 302 HD3 ARG 54 HD1 ARG 54 -1.274 -4.072 -8.409 303 HE ARG 54 HE ARG 54 -3.525 -5.262 -8.234 304 HH11 ARG 54 HH11 ARG 54 -0.507 -6.872 -9.077 305 HH12 ARG 54 HH12 ARG 54 -1.017 -8.460 -8.373 306 HH21 ARG 54 HH21 ARG 54 -4.226 -7.251 -7.371 307 HH22 ARG 54 HH22 ARG 54 -3.121 -8.673 -7.460 308 H GLN 55 HN GLN 55 -5.452 -1.243 -8.730 309 HA GLN 55 HA GLN 55 -7.184 -3.500 -9.154 310 HB2 GLN 55 HB2 GLN 55 -7.575 -1.100 -7.357 311 HB3 GLN 55 HB1 GLN 55 -8.504 -2.589 -7.304 312 HG2 GLN 55 HG2 GLN 55 -5.611 -2.196 -6.588 313 HG3 GLN 55 HG1 GLN 55 -6.939 -2.656 -5.524 314 HE21 GLN 55 HE21 GLN 55 -7.776 -4.777 -5.658 315 HE22 GLN 55 HE22 GLN 55 -6.857 -6.060 -6.371 316 H GLY 56 HN GLY 56 -6.909 -0.442 -10.523 317 HA2 GLY 56 HA2 GLY 56 -8.146 0.437 -12.274 318 HA3 GLY 56 HA1 GLY 56 -9.335 -0.830 -12.037 319 H VAL 57 HN VAL 57 -8.227 1.343 -9.514 320 HA VAL 57 HA VAL 57 -10.854 2.676 -9.583 321 HB VAL 57 HB VAL 57 -10.726 2.826 -7.078 322 HG11 VAL 57 HG11 VAL 57 -11.496 0.519 -6.676 323 HG12 VAL 57 HG12 VAL 57 -10.902 0.063 -8.274 324 HG13 VAL 57 HG13 VAL 57 -12.212 1.234 -8.119 325 HG21 VAL 57 HG21 VAL 57 -8.540 0.776 -7.420 326 HG22 VAL 57 HG22 VAL 57 -9.303 1.208 -5.889 327 HG23 VAL 57 HG23 VAL 57 -8.358 2.407 -6.773 328 HA PRO 58 HA PRO 58 -8.458 6.398 -9.548 329 HB2 PRO 58 HB2 PRO 58 -10.248 8.135 -8.482 330 HB3 PRO 58 HB1 PRO 58 -10.407 7.504 -10.128 331 HG2 PRO 58 HG2 PRO 58 -11.801 6.625 -7.641 332 HG3 PRO 58 HG1 PRO 58 -12.455 6.854 -9.275 333 HD2 PRO 58 HD2 PRO 58 -11.824 4.413 -8.298 334 HD3 PRO 58 HD1 PRO 58 -11.684 4.822 -10.019 335 H MET 59 HN MET 59 -7.356 7.825 -8.091 336 HA MET 59 HA MET 59 -6.826 6.677 -5.552 337 HB2 MET 59 HB2 MET 59 -5.305 8.161 -7.058 338 HB3 MET 59 HB1 MET 59 -6.091 9.504 -6.241 339 HG2 MET 59 HG2 MET 59 -5.343 8.642 -4.087 340 HG3 MET 59 HG1 MET 59 -4.575 7.280 -4.896 341 HE1 MET 59 HE1 MET 59 -2.974 8.922 -2.873 342 HE2 MET 59 HE2 MET 59 -1.475 9.277 -3.726 343 HE3 MET 59 HE3 MET 59 -2.208 7.681 -3.863 344 H ASN 60 HN ASN 60 -7.156 7.633 -3.472 345 HA ASN 60 HA ASN 60 -8.227 8.800 -1.830 346 HB2 ASN 60 HB2 ASN 60 -8.323 10.700 -3.629 347 HB3 ASN 60 HB1 ASN 60 -10.010 10.228 -3.778 348 HD21 ASN 60 HD21 ASN 60 -11.427 10.654 -2.108 349 HD22 ASN 60 HD22 ASN 60 -11.018 11.689 -0.782 350 H SER 61 HN SER 61 -9.482 6.624 -3.925 351 HA SER 61 HA SER 61 -12.178 6.591 -2.856 352 HB2 SER 61 HB2 SER 61 -12.502 4.626 -4.315 353 HB3 SER 61 HB1 SER 61 -11.820 5.983 -5.214 354 HG SER 61 HG SER 61 -10.060 4.873 -5.561 355 H LEU 62 HN LEU 62 -9.141 4.927 -2.456 356 HA LEU 62 HA LEU 62 -10.330 3.309 -0.305 357 HB2 LEU 62 HB2 LEU 62 -7.896 2.659 -1.973 358 HB3 LEU 62 HB1 LEU 62 -8.574 1.657 -0.706 359 HG LEU 62 HG LEU 62 -9.944 2.327 -3.313 360 HD11 LEU 62 HD11 LEU 62 -9.547 -0.032 -3.858 361 HD12 LEU 62 HD12 LEU 62 -8.608 -0.208 -2.376 362 HD13 LEU 62 HD13 LEU 62 -8.040 0.862 -3.659 363 HD21 LEU 62 HD21 LEU 62 -11.617 1.967 -1.677 364 HD22 LEU 62 HD22 LEU 62 -10.738 0.608 -0.975 365 HD23 LEU 62 HD23 LEU 62 -11.467 0.457 -2.575 366 H ARG 63 HN ARG 63 -9.367 3.332 1.665 367 HA ARG 63 HA ARG 63 -7.122 5.202 1.989 368 HB2 ARG 63 HB2 ARG 63 -7.857 5.436 4.336 369 HB3 ARG 63 HB1 ARG 63 -9.101 5.923 3.195 370 HG2 ARG 63 HG2 ARG 63 -10.309 3.877 3.558 371 HG3 ARG 63 HG1 ARG 63 -9.009 3.246 4.571 372 HD2 ARG 63 HD2 ARG 63 -9.405 4.947 6.225 373 HD3 ARG 63 HD1 ARG 63 -10.593 5.735 5.189 374 HE ARG 63 HE ARG 63 -10.943 3.197 6.626 375 HH11 ARG 63 HH11 ARG 63 -13.975 5.327 4.987 376 HH12 ARG 63 HH12 ARG 63 -12.262 5.813 4.658 377 HH21 ARG 63 HH21 ARG 63 -13.098 2.589 7.078 378 HH22 ARG 63 HH22 ARG 63 -14.438 3.523 6.313 379 H PHE 64 HN PHE 64 -5.247 4.489 2.728 380 HA PHE 64 HA PHE 64 -4.978 1.657 3.344 381 HB2 PHE 64 HB2 PHE 64 -2.895 3.808 2.898 382 HB3 PHE 64 HB1 PHE 64 -2.545 2.106 3.167 383 HD1 PHE 64 HD1 PHE 64 -4.017 4.530 0.819 384 HD2 PHE 64 HD2 PHE 64 -2.750 0.512 1.423 385 HE1 PHE 64 HE1 PHE 64 -4.202 4.114 -1.597 386 HE2 PHE 64 HE2 PHE 64 -2.934 0.092 -0.992 387 HZ PHE 64 HZ PHE 64 -3.660 1.894 -2.504 388 H LEU 65 HN LEU 65 -4.927 0.974 5.369 389 HA LEU 65 HA LEU 65 -4.354 2.931 7.486 390 HB2 LEU 65 HB2 LEU 65 -5.911 0.353 7.553 391 HB3 LEU 65 HB1 LEU 65 -5.513 1.283 8.983 392 HG LEU 65 HG LEU 65 -7.235 2.230 6.689 393 HD11 LEU 65 HD11 LEU 65 -9.073 2.030 8.210 394 HD12 LEU 65 HD12 LEU 65 -7.995 1.559 9.524 395 HD13 LEU 65 HD13 LEU 65 -8.230 0.480 8.147 396 HD21 LEU 65 HD21 LEU 65 -6.449 3.562 9.277 397 HD22 LEU 65 HD22 LEU 65 -7.732 4.128 8.211 398 HD23 LEU 65 HD23 LEU 65 -6.065 4.103 7.642 399 H PHE 66 HN PHE 66 -2.751 2.659 8.853 400 HA PHE 66 HA PHE 66 -1.357 0.096 9.016 401 HB2 PHE 66 HB2 PHE 66 -0.170 1.475 7.309 402 HB3 PHE 66 HB1 PHE 66 0.043 2.737 8.514 403 HD1 PHE 66 HD1 PHE 66 0.996 -0.691 7.574 404 HD2 PHE 66 HD2 PHE 66 1.771 2.619 10.126 405 HE1 PHE 66 HE1 PHE 66 3.106 -1.737 8.282 406 HE2 PHE 66 HE2 PHE 66 3.881 1.578 10.842 407 HZ PHE 66 HZ PHE 66 4.553 -0.601 9.916 408 H GLU 67 HN GLU 67 -1.534 -0.370 11.101 409 HA GLU 67 HA GLU 67 -1.390 -0.244 13.362 410 HB2 GLU 67 HB2 GLU 67 0.199 2.218 12.662 411 HB3 GLU 67 HB1 GLU 67 -0.075 1.721 14.326 412 HG2 GLU 67 HG2 GLU 67 0.912 -0.446 12.664 413 HG3 GLU 67 HG1 GLU 67 2.007 0.936 12.711 414 H GLY 68 HN GLY 68 -3.622 0.942 11.846 415 HA2 GLY 68 HA2 GLY 68 -5.656 1.719 12.763 416 HA3 GLY 68 HA1 GLY 68 -4.756 2.476 14.067 417 H GLN 69 HN GLN 69 -2.851 3.764 12.284 418 HA GLN 69 HA GLN 69 -4.455 6.082 11.623 419 HB2 GLN 69 HB2 GLN 69 -1.499 5.519 11.654 420 HB3 GLN 69 HB1 GLN 69 -2.140 6.998 10.956 421 HG2 GLN 69 HG2 GLN 69 -3.262 7.428 13.162 422 HG3 GLN 69 HG1 GLN 69 -2.333 6.075 13.807 423 HE21 GLN 69 HE21 GLN 69 -2.305 9.009 14.372 424 HE22 GLN 69 HE22 GLN 69 -0.648 9.468 14.203 425 H ARG 70 HN ARG 70 -4.112 7.198 9.507 426 HA ARG 70 HA ARG 70 -4.034 5.178 7.377 427 HB2 ARG 70 HB2 ARG 70 -5.280 6.873 6.007 428 HB3 ARG 70 HB1 ARG 70 -6.161 6.228 7.382 429 HG2 ARG 70 HG2 ARG 70 -5.583 8.278 8.649 430 HG3 ARG 70 HG1 ARG 70 -4.839 8.923 7.185 431 HD2 ARG 70 HD2 ARG 70 -7.710 8.030 7.370 432 HD3 ARG 70 HD1 ARG 70 -7.180 9.695 7.582 433 HE ARG 70 HE ARG 70 -6.168 9.226 5.206 434 HH11 ARG 70 HH11 ARG 70 -9.299 8.227 6.475 435 HH12 ARG 70 HH12 ARG 70 -10.107 8.317 4.859 436 HH21 ARG 70 HH21 ARG 70 -7.177 9.356 3.141 437 HH22 ARG 70 HH22 ARG 70 -8.945 8.973 3.024 438 H ILE 71 HN ILE 71 -2.615 5.268 5.810 439 HA ILE 71 HA ILE 71 -0.282 6.826 6.065 440 HB ILE 71 HB ILE 71 -1.265 5.218 3.708 441 HG12 ILE 71 HG12 ILE 71 -1.002 3.906 5.785 442 HG13 ILE 71 HG11 ILE 71 0.172 3.439 4.560 443 HG21 ILE 71 HG21 ILE 71 1.029 5.190 2.930 444 HG22 ILE 71 HG22 ILE 71 1.529 6.178 4.301 445 HG23 ILE 71 HG23 ILE 71 0.456 6.851 3.074 446 HD11 ILE 71 HD11 ILE 71 1.866 4.804 5.703 447 HD12 ILE 71 HD12 ILE 71 1.218 3.520 6.723 448 HD13 ILE 71 HD13 ILE 71 0.685 5.185 6.956 449 H ALA 72 HN ALA 72 0.181 8.823 5.377 450 HA ALA 72 HA ALA 72 -1.741 10.213 3.693 451 HB1 ALA 72 HB1 ALA 72 -0.446 12.220 4.207 452 HB2 ALA 72 HB2 ALA 72 0.765 11.237 5.031 453 HB3 ALA 72 HB3 ALA 72 -0.872 11.349 5.680 454 H ASP 73 HN ASP 73 -0.661 11.764 2.017 455 HA ASP 73 HA ASP 73 0.674 10.066 0.116 456 HB2 ASP 73 HB2 ASP 73 -0.477 12.821 0.078 457 HB3 ASP 73 HB1 ASP 73 0.654 12.356 -1.189 458 H ASN 74 HN ASN 74 1.725 12.071 2.570 459 HA ASN 74 HA ASN 74 4.312 12.580 1.264 460 HB2 ASN 74 HB2 ASN 74 4.673 14.235 3.087 461 HB3 ASN 74 HB1 ASN 74 3.251 14.601 2.114 462 HD21 ASN 74 HD21 ASN 74 4.439 13.773 5.223 463 HD22 ASN 74 HD22 ASN 74 2.926 13.858 6.060 464 H HIS 75 HN HIS 75 3.164 10.114 2.678 465 HA HIS 75 HA HIS 75 4.993 9.840 4.924 466 HB2 HIS 75 HB2 HIS 75 2.524 8.536 4.045 467 HB3 HIS 75 HB1 HIS 75 3.737 7.406 4.635 468 HD2 HIS 75 HD2 HIS 75 4.656 8.046 7.320 469 HE1 HIS 75 HE1 HIS 75 1.001 9.975 8.226 470 HE2 HIS 75 HE2 HIS 75 3.220 9.174 9.162 471 H THR 76 HN THR 76 6.605 8.336 5.061 472 HA THR 76 HA THR 76 7.354 6.953 2.567 473 HB THR 76 HB THR 76 9.640 7.517 4.249 474 HG1 THR 76 HG1 THR 76 8.146 9.410 4.670 475 HG21 THR 76 HG21 THR 76 9.636 6.916 1.824 476 HG22 THR 76 HG22 THR 76 10.591 8.349 2.206 477 HG23 THR 76 HG23 THR 76 8.994 8.522 1.477 478 HA PRO 77 HA PRO 77 7.341 3.267 5.057 479 HB2 PRO 77 HB2 PRO 77 9.737 2.370 3.576 480 HB3 PRO 77 HB1 PRO 77 8.141 1.620 3.694 481 HG2 PRO 77 HG2 PRO 77 8.922 2.809 1.445 482 HG3 PRO 77 HG1 PRO 77 7.241 2.907 2.010 483 HD2 PRO 77 HD2 PRO 77 9.410 4.955 2.176 484 HD3 PRO 77 HD1 PRO 77 7.685 5.164 1.811 485 H LYS 78 HN LYS 78 9.951 5.405 4.989 486 HA LYS 78 HA LYS 78 11.745 4.015 6.717 487 HB2 LYS 78 HB2 LYS 78 12.684 5.664 5.287 488 HB3 LYS 78 HB1 LYS 78 11.518 6.875 5.792 489 HG2 LYS 78 HG2 LYS 78 13.681 7.370 6.726 490 HG3 LYS 78 HG1 LYS 78 12.560 6.936 8.015 491 HD2 LYS 78 HD2 LYS 78 14.789 5.926 8.318 492 HD3 LYS 78 HD1 LYS 78 13.516 4.720 8.147 493 HE2 LYS 78 HE2 LYS 78 14.203 4.107 6.019 494 HE3 LYS 78 HE1 LYS 78 15.069 5.621 5.755 495 HZ1 LYS 78 HZ1 LYS 78 16.498 3.642 6.159 496 HZ2 LYS 78 HZ2 LYS 78 15.908 3.585 7.739 497 HZ3 LYS 78 HZ3 LYS 78 16.784 4.931 7.212 498 H GLU 79 HN GLU 79 9.102 6.297 7.167 499 HA GLU 79 HA GLU 79 9.644 6.437 10.030 500 HB2 GLU 79 HB2 GLU 79 7.858 8.121 10.084 501 HB3 GLU 79 HB1 GLU 79 9.092 8.526 8.902 502 HG2 GLU 79 HG2 GLU 79 7.445 7.261 7.273 503 HG3 GLU 79 HG1 GLU 79 6.268 7.725 8.501 504 H LEU 80 HN LEU 80 7.414 6.495 11.318 505 HA LEU 80 HA LEU 80 5.647 5.379 12.177 506 HB2 LEU 80 HB2 LEU 80 5.480 4.513 9.342 507 HB3 LEU 80 HB1 LEU 80 4.579 3.587 10.528 508 HG LEU 80 HG LEU 80 4.304 6.573 10.216 509 HD11 LEU 80 HD11 LEU 80 2.205 6.067 9.022 510 HD12 LEU 80 HD12 LEU 80 2.674 4.367 8.976 511 HD13 LEU 80 HD13 LEU 80 3.647 5.573 8.134 512 HD21 LEU 80 HD21 LEU 80 2.654 4.474 11.622 513 HD22 LEU 80 HD22 LEU 80 2.158 6.151 11.392 514 HD23 LEU 80 HD23 LEU 80 3.579 5.780 12.366 515 H GLY 81 HN GLY 81 7.812 3.306 10.301 516 HA2 GLY 81 HA2 GLY 81 9.239 1.803 11.631 517 HA3 GLY 81 HA1 GLY 81 7.817 1.448 12.600 518 H MET 82 HN MET 82 8.031 1.672 9.073 519 HA MET 82 HA MET 82 6.641 -0.803 8.760 520 HB2 MET 82 HB2 MET 82 7.893 1.158 6.860 521 HB3 MET 82 HB1 MET 82 7.328 -0.403 6.282 522 HG2 MET 82 HG2 MET 82 5.086 0.112 7.155 523 HG3 MET 82 HG1 MET 82 5.671 1.698 7.655 524 HE1 MET 82 HE1 MET 82 3.177 0.830 5.639 525 HE2 MET 82 HE2 MET 82 3.264 2.149 4.472 526 HE3 MET 82 HE3 MET 82 3.423 2.484 6.195 527 H GLU 83 HN GLU 83 7.399 -2.795 8.247 528 HA GLU 83 HA GLU 83 10.297 -3.099 7.827 529 HB2 GLU 83 HB2 GLU 83 8.592 -4.279 9.955 530 HB3 GLU 83 HB1 GLU 83 9.823 -5.313 9.241 531 HG2 GLU 83 HG2 GLU 83 10.898 -2.718 9.885 532 HG3 GLU 83 HG1 GLU 83 10.160 -3.476 11.295 533 H GLU 84 HN GLU 84 10.682 -5.581 7.337 534 HA GLU 84 HA GLU 84 9.449 -6.103 4.851 535 HB2 GLU 84 HB2 GLU 84 11.722 -6.813 5.322 536 HB3 GLU 84 HB1 GLU 84 11.167 -7.828 6.642 537 HG2 GLU 84 HG2 GLU 84 11.678 -9.225 4.792 538 HG3 GLU 84 HG1 GLU 84 9.930 -9.205 4.999 539 H GLU 85 HN GLU 85 7.829 -7.463 4.271 540 HA GLU 85 HA GLU 85 5.929 -8.689 4.410 541 HB2 GLU 85 HB2 GLU 85 7.516 -9.953 6.643 542 HB3 GLU 85 HB1 GLU 85 5.916 -10.527 6.198 543 HG2 GLU 85 HG2 GLU 85 8.246 -10.361 4.300 544 HG3 GLU 85 HG1 GLU 85 7.786 -11.812 5.189 545 H ASP 86 HN ASP 86 5.859 -6.157 5.590 546 HA ASP 86 HA ASP 86 4.589 -6.323 8.162 547 HB2 ASP 86 HB2 ASP 86 5.878 -4.312 6.848 548 HB3 ASP 86 HB1 ASP 86 4.193 -3.856 6.608 549 H VAL 87 HN VAL 87 2.411 -5.358 8.531 550 HA VAL 87 HA VAL 87 0.573 -6.331 6.447 551 HB VAL 87 HB VAL 87 -0.025 -5.989 9.387 552 HG11 VAL 87 HG11 VAL 87 -1.972 -7.411 8.885 553 HG12 VAL 87 HG12 VAL 87 -1.537 -7.378 7.176 554 HG13 VAL 87 HG13 VAL 87 -2.006 -5.889 7.996 555 HG21 VAL 87 HG21 VAL 87 0.594 -8.538 7.902 556 HG22 VAL 87 HG22 VAL 87 0.213 -8.377 9.616 557 HG23 VAL 87 HG23 VAL 87 1.711 -7.702 8.979 558 H ILE 88 HN ILE 88 -0.743 -4.955 5.485 559 HA ILE 88 HA ILE 88 -1.377 -2.402 6.787 560 HB ILE 88 HB ILE 88 0.424 -1.902 5.247 561 HG12 ILE 88 HG12 ILE 88 -2.166 -1.019 3.969 562 HG13 ILE 88 HG11 ILE 88 -1.513 -0.320 5.446 563 HG21 ILE 88 HG21 ILE 88 0.278 -2.336 2.858 564 HG22 ILE 88 HG22 ILE 88 -1.261 -3.162 3.093 565 HG23 ILE 88 HG23 ILE 88 0.216 -3.836 3.783 566 HD11 ILE 88 HD11 ILE 88 0.525 0.312 4.179 567 HD12 ILE 88 HD12 ILE 88 -0.945 1.097 3.606 568 HD13 ILE 88 HD13 ILE 88 -0.265 -0.261 2.710 569 H GLU 89 HN GLU 89 -3.473 -1.706 6.447 570 HA GLU 89 HA GLU 89 -5.204 -3.625 5.036 571 HB2 GLU 89 HB2 GLU 89 -5.846 -1.619 7.196 572 HB3 GLU 89 HB1 GLU 89 -7.034 -2.638 6.400 573 HG2 GLU 89 HG2 GLU 89 -5.995 -4.617 7.298 574 HG3 GLU 89 HG1 GLU 89 -4.693 -3.650 7.993 575 H VAL 90 HN VAL 90 -7.013 -2.832 3.842 576 HA VAL 90 HA VAL 90 -6.856 -0.042 2.993 577 HB VAL 90 HB VAL 90 -5.584 -1.299 1.318 578 HG11 VAL 90 HG11 VAL 90 -8.115 -2.868 0.841 579 HG12 VAL 90 HG12 VAL 90 -6.643 -3.486 1.589 580 HG13 VAL 90 HG13 VAL 90 -6.627 -2.979 -0.100 581 HG21 VAL 90 HG21 VAL 90 -8.261 -0.360 0.297 582 HG22 VAL 90 HG22 VAL 90 -6.806 -0.573 -0.677 583 HG23 VAL 90 HG23 VAL 90 -6.843 0.647 0.595 584 H TYR 91 HN TYR 91 -8.790 0.868 3.109 585 HA TYR 91 HA TYR 91 -11.180 -0.811 2.744 586 HB2 TYR 91 HB2 TYR 91 -10.712 1.245 4.915 587 HB3 TYR 91 HB1 TYR 91 -12.280 0.531 4.556 588 HD1 TYR 91 HD1 TYR 91 -12.675 -1.871 4.998 589 HD2 TYR 91 HD2 TYR 91 -9.049 0.034 6.145 590 HE1 TYR 91 HE1 TYR 91 -12.167 -3.750 6.501 591 HE2 TYR 91 HE2 TYR 91 -8.533 -1.838 7.652 592 HH TYR 91 HH TYR 91 -9.122 -3.884 8.336 593 H GLN 92 HN GLN 92 -13.063 0.371 2.026 594 HA GLN 92 HA GLN 92 -12.349 2.454 0.180 595 HB2 GLN 92 HB2 GLN 92 -14.072 0.619 -0.227 596 HB3 GLN 92 HB1 GLN 92 -15.146 1.533 0.823 597 HG2 GLN 92 HG2 GLN 92 -14.461 3.489 -0.844 598 HG3 GLN 92 HG1 GLN 92 -14.227 2.117 -1.925 599 HE21 GLN 92 HE21 GLN 92 -16.510 3.989 -0.118 600 HE22 GLN 92 HE22 GLN 92 -17.939 3.310 -0.826 601 H GLU 93 HN GLU 93 -12.868 4.582 0.232 602 HA GLU 93 HA GLU 93 -13.357 5.744 2.808 603 HB2 GLU 93 HB2 GLU 93 -12.957 6.882 0.048 604 HB3 GLU 93 HB1 GLU 93 -13.350 7.904 1.424 605 HG2 GLU 93 HG2 GLU 93 -11.023 6.026 1.532 606 HG3 GLU 93 HG1 GLU 93 -10.885 7.596 0.739 607 H GLN 94 HN GLN 94 -15.047 7.284 3.252 608 HA GLN 94 HA GLN 94 -17.622 6.266 2.690 609 HB2 GLN 94 HB2 GLN 94 -16.859 7.529 4.751 610 HB3 GLN 94 HB1 GLN 94 -16.962 8.997 3.793 611 HG2 GLN 94 HG2 GLN 94 -19.263 8.918 3.676 612 HG3 GLN 94 HG1 GLN 94 -19.325 7.187 4.014 613 HE21 GLN 94 HE21 GLN 94 -19.185 6.472 6.128 614 HE22 GLN 94 HE22 GLN 94 -19.372 7.535 7.481 615 H THR 95 HN THR 95 -15.657 8.676 1.159 616 HA THR 95 HA THR 95 -17.808 9.972 -0.235 617 HB THR 95 HB THR 95 -15.908 10.988 -1.570 618 HG1 THR 95 HG1 THR 95 -13.961 10.192 -1.297 619 HG21 THR 95 HG21 THR 95 -16.879 12.096 0.396 620 HG22 THR 95 HG22 THR 95 -15.145 12.396 0.279 621 HG23 THR 95 HG23 THR 95 -15.758 11.220 1.440 622 H GLY 96 HN GLY 96 -15.538 7.384 -0.885 623 HA2 GLY 96 HA2 GLY 96 -15.863 5.657 -2.449 624 HA3 GLY 96 HA1 GLY 96 -17.085 6.643 -3.243 625 H GLY 97 HN GLY 97 -14.643 8.694 -2.714 626 HA2 GLY 97 HA2 GLY 97 -12.566 8.131 -4.406 627 HA3 GLY 97 HA1 GLY 97 -13.839 8.753 -5.449 628 H1 ASN 357 HT1 ASN 357 -4.307 -20.809 -1.630 629 H2 ASN 357 HT2 ASN 357 -5.222 -19.998 -0.457 630 H3 ASN 357 HT3 ASN 357 -3.924 -20.972 0.009 631 HA ASN 357 HA ASN 357 -3.320 -18.660 0.144 632 HB2 ASN 357 HB2 ASN 357 -1.298 -18.741 -1.247 633 HB3 ASN 357 HB1 ASN 357 -1.579 -20.292 -0.463 634 HD21 ASN 357 HD21 ASN 357 -0.092 -19.540 -2.903 635 HD22 ASN 357 HD22 ASN 357 -0.733 -20.545 -4.156 636 H ASN 358 HN ASN 358 -3.140 -16.631 -0.806 637 HA ASN 358 HA ASN 358 -4.064 -16.247 -3.529 638 HB2 ASN 358 HB2 ASN 358 -5.705 -14.431 -2.582 639 HB3 ASN 358 HB1 ASN 358 -6.214 -16.115 -2.669 640 HD21 ASN 358 HD21 ASN 358 -6.503 -17.273 -0.778 641 HD22 ASN 358 HD22 ASN 358 -6.528 -16.518 0.777 642 H ARG 359 HN ARG 359 -1.593 -15.900 -2.430 643 HA ARG 359 HA ARG 359 -1.293 -13.047 -1.938 644 HB2 ARG 359 HB2 ARG 359 1.131 -13.694 -1.524 645 HB3 ARG 359 HB1 ARG 359 -0.049 -14.308 -0.378 646 HG2 ARG 359 HG2 ARG 359 -0.031 -16.418 -1.915 647 HG3 ARG 359 HG1 ARG 359 1.523 -15.773 -2.452 648 HD2 ARG 359 HD2 ARG 359 1.940 -17.296 -0.668 649 HD3 ARG 359 HD1 ARG 359 2.216 -15.668 -0.060 650 HE ARG 359 HE ARG 359 -0.333 -16.081 0.654 651 HH11 ARG 359 HH11 ARG 359 2.508 -18.139 0.945 652 HH12 ARG 359 HH12 ARG 359 1.964 -18.866 2.502 653 HH21 ARG 359 HH21 ARG 359 -1.058 -16.958 2.617 654 HH22 ARG 359 HH22 ARG 359 -0.063 -18.241 3.418 655 H ASP 360 HN ASP 360 -0.555 -11.659 -3.385 656 HA ASP 360 HA ASP 360 0.753 -12.695 -5.803 657 HB2 ASP 360 HB2 ASP 360 -1.636 -12.189 -6.280 658 HB3 ASP 360 HB1 ASP 360 -1.350 -10.520 -5.790 659 HA PRO 361 HA PRO 361 3.555 -9.465 -4.459 660 HB2 PRO 361 HB2 PRO 361 5.610 -10.163 -6.058 661 HB3 PRO 361 HB1 PRO 361 5.201 -11.069 -4.596 662 HG2 PRO 361 HG2 PRO 361 4.598 -11.721 -7.435 663 HG3 PRO 361 HG1 PRO 361 5.075 -12.797 -6.109 664 HD2 PRO 361 HD2 PRO 361 2.493 -12.496 -6.986 665 HD3 PRO 361 HD1 PRO 361 2.940 -13.019 -5.351 666 H ILE 362 HN ILE 362 3.551 -7.429 -5.153 667 HA ILE 362 HA ILE 362 3.249 -6.922 -8.043 668 HB ILE 362 HB ILE 362 2.594 -4.901 -5.918 669 HG12 ILE 362 HG12 ILE 362 0.638 -6.837 -7.166 670 HG13 ILE 362 HG11 ILE 362 1.277 -6.986 -5.531 671 HG21 ILE 362 HG21 ILE 362 1.690 -5.242 -8.774 672 HG22 ILE 362 HG22 ILE 362 2.869 -4.071 -8.187 673 HG23 ILE 362 HG23 ILE 362 1.183 -3.951 -7.684 674 HD11 ILE 362 HD11 ILE 362 -0.261 -4.604 -6.525 675 HD12 ILE 362 HD12 ILE 362 0.226 -4.949 -4.865 676 HD13 ILE 362 HD13 ILE 362 -0.978 -5.963 -5.660 677 H VAL 363 HN VAL 363 4.836 -5.927 -9.068 678 HA VAL 363 HA VAL 363 6.844 -4.459 -7.485 679 HB VAL 363 HB VAL 363 7.326 -5.845 -10.130 680 HG11 VAL 363 HG11 VAL 363 9.688 -5.506 -9.609 681 HG12 VAL 363 HG12 VAL 363 9.245 -4.692 -8.110 682 HG13 VAL 363 HG13 VAL 363 8.821 -3.970 -9.661 683 HG21 VAL 363 HG21 VAL 363 8.533 -7.562 -8.866 684 HG22 VAL 363 HG22 VAL 363 6.822 -7.517 -8.437 685 HG23 VAL 363 HG23 VAL 363 8.022 -6.806 -7.356 686 H ILE 364 HN ILE 364 6.846 -2.344 -7.887 687 HA ILE 364 HA ILE 364 5.724 -1.391 -10.433 688 HB ILE 364 HB ILE 364 5.500 0.813 -9.269 689 HG12 ILE 364 HG12 ILE 364 5.405 -0.051 -6.579 690 HG13 ILE 364 HG11 ILE 364 6.954 -0.594 -7.222 691 HG21 ILE 364 HG21 ILE 364 3.420 0.047 -9.216 692 HG22 ILE 364 HG22 ILE 364 3.731 -0.430 -7.548 693 HG23 ILE 364 HG23 ILE 364 3.949 -1.596 -8.854 694 HD11 ILE 364 HD11 ILE 364 7.444 1.694 -7.939 695 HD12 ILE 364 HD12 ILE 364 7.158 1.592 -6.202 696 HD13 ILE 364 HD13 ILE 364 5.904 2.227 -7.266 697 H SER 365 HN SER 365 6.676 0.933 -10.907 698 HA SER 365 HA SER 365 9.597 0.624 -10.911 699 HB2 SER 365 HB2 SER 365 9.128 2.374 -12.913 700 HB3 SER 365 HB1 SER 365 9.152 0.624 -13.144 701 HG SER 365 HG SER 365 7.077 0.647 -13.502 702 H ASP 366 HN ASP 366 10.771 2.117 -9.896 703 HA ASP 366 HA ASP 366 9.473 4.361 -8.629 704 HB2 ASP 366 HB2 ASP 366 11.108 3.264 -7.298 705 HB3 ASP 366 HB1 ASP 366 12.294 3.286 -8.598 706 H SER 367 HN SER 367 9.075 6.131 -9.779 707 HA SER 367 HA SER 367 11.235 7.325 -11.322 708 HB2 SER 367 HB2 SER 367 8.932 7.803 -12.867 709 HB3 SER 367 HB1 SER 367 10.319 6.807 -13.305 710 HG SER 367 HG SER 367 9.095 5.126 -13.118 711 HA PRO 368 HA PRO 368 9.669 10.874 -9.166 712 HB2 PRO 368 HB2 PRO 368 11.013 12.787 -10.551 713 HB3 PRO 368 HB1 PRO 368 11.791 11.747 -9.349 714 HG2 PRO 368 HG2 PRO 368 11.800 11.506 -12.325 715 HG3 PRO 368 HG1 PRO 368 13.129 11.272 -11.172 716 HD2 PRO 368 HD2 PRO 368 11.775 9.204 -12.263 717 HD3 PRO 368 HD1 PRO 368 12.465 9.144 -10.628 Start of MODEL 2 1 H TYR 21 HT1 TYR 21 14.949 -6.014 -0.926 2 HA TYR 21 HA TYR 21 14.108 -3.753 -1.007 3 HB2 TYR 21 HB2 TYR 21 12.178 -5.007 -2.970 4 HB3 TYR 21 HB1 TYR 21 11.852 -3.482 -2.156 5 HD1 TYR 21 HD1 TYR 21 13.836 -1.711 -2.371 6 HD2 TYR 21 HD2 TYR 21 13.127 -4.924 -5.069 7 HE1 TYR 21 HE1 TYR 21 15.072 -0.506 -4.121 8 HE2 TYR 21 HE2 TYR 21 14.362 -3.727 -6.827 9 HH TYR 21 HH TYR 21 14.926 -1.301 -7.351 10 H ILE 22 HN ILE 22 11.444 -3.419 -0.377 11 HA ILE 22 HA ILE 22 11.095 -5.395 1.783 12 HB ILE 22 HB ILE 22 9.991 -2.581 1.699 13 HG12 ILE 22 HG12 ILE 22 12.467 -2.563 1.739 14 HG13 ILE 22 HG11 ILE 22 11.765 -1.927 3.221 15 HG21 ILE 22 HG21 ILE 22 8.761 -4.124 3.131 16 HG22 ILE 22 HG22 ILE 22 9.608 -2.904 4.083 17 HG23 ILE 22 HG23 ILE 22 10.255 -4.541 3.973 18 HD11 ILE 22 HD11 ILE 22 13.668 -3.315 3.730 19 HD12 ILE 22 HD12 ILE 22 12.962 -4.666 2.843 20 HD13 ILE 22 HD13 ILE 22 12.198 -4.087 4.323 21 H LYS 23 HN LYS 23 9.172 -6.466 1.976 22 HA LYS 23 HA LYS 23 7.121 -5.808 -0.041 23 HB2 LYS 23 HB2 LYS 23 7.891 -8.479 1.140 24 HB3 LYS 23 HB1 LYS 23 6.469 -8.226 0.137 25 HG2 LYS 23 HG2 LYS 23 7.683 -8.471 -1.702 26 HG3 LYS 23 HG1 LYS 23 8.757 -7.163 -1.204 27 HD2 LYS 23 HD2 LYS 23 10.001 -9.233 -1.572 28 HD3 LYS 23 HD1 LYS 23 10.073 -8.739 0.121 29 HE2 LYS 23 HE2 LYS 23 7.813 -10.372 -0.084 30 HE3 LYS 23 HE1 LYS 23 9.056 -11.175 -1.041 31 HZ1 LYS 23 HZ1 LYS 23 9.173 -11.923 1.215 32 HZ2 LYS 23 HZ2 LYS 23 9.273 -10.335 1.801 33 HZ3 LYS 23 HZ3 LYS 23 10.544 -10.990 0.895 34 H LEU 24 HN LEU 24 5.172 -5.295 0.636 35 HA LEU 24 HA LEU 24 4.543 -5.683 3.489 36 HB2 LEU 24 HB2 LEU 24 3.366 -3.661 1.577 37 HB3 LEU 24 HB1 LEU 24 3.061 -3.769 3.299 38 HG LEU 24 HG LEU 24 5.722 -3.078 2.052 39 HD11 LEU 24 HD11 LEU 24 4.059 -1.318 1.719 40 HD12 LEU 24 HD12 LEU 24 5.295 -0.824 2.876 41 HD13 LEU 24 HD13 LEU 24 3.703 -1.324 3.447 42 HD21 LEU 24 HD21 LEU 24 6.023 -4.174 4.179 43 HD22 LEU 24 HD22 LEU 24 4.804 -3.139 4.922 44 HD23 LEU 24 HD23 LEU 24 6.327 -2.445 4.367 45 H LYS 25 HN LYS 25 2.529 -6.482 4.075 46 HA LYS 25 HA LYS 25 1.184 -7.997 1.966 47 HB2 LYS 25 HB2 LYS 25 0.751 -8.150 4.949 48 HB3 LYS 25 HB1 LYS 25 0.173 -9.282 3.735 49 HG2 LYS 25 HG2 LYS 25 2.441 -9.974 3.251 50 HG3 LYS 25 HG1 LYS 25 3.065 -8.784 4.396 51 HD2 LYS 25 HD2 LYS 25 3.007 -11.021 5.382 52 HD3 LYS 25 HD1 LYS 25 1.911 -9.920 6.223 53 HE2 LYS 25 HE2 LYS 25 0.014 -10.854 5.085 54 HE3 LYS 25 HE1 LYS 25 1.058 -11.835 4.057 55 HZ1 LYS 25 HZ1 LYS 25 0.129 -13.176 5.797 56 HZ2 LYS 25 HZ2 LYS 25 0.701 -12.121 6.990 57 HZ3 LYS 25 HZ3 LYS 25 1.796 -13.015 6.062 58 H VAL 26 HN VAL 26 -0.365 -6.888 0.976 59 HA VAL 26 HA VAL 26 -1.976 -4.970 2.467 60 HB VAL 26 HB VAL 26 -2.372 -5.658 -0.437 61 HG11 VAL 26 HG11 VAL 26 -3.169 -3.348 -0.562 62 HG12 VAL 26 HG12 VAL 26 -2.827 -3.136 1.156 63 HG13 VAL 26 HG13 VAL 26 -4.069 -4.276 0.638 64 HG21 VAL 26 HG21 VAL 26 -0.374 -3.690 0.678 65 HG22 VAL 26 HG22 VAL 26 -0.796 -3.878 -1.025 66 HG23 VAL 26 HG23 VAL 26 0.004 -5.192 -0.164 67 H ILE 27 HN ILE 27 -3.799 -5.555 3.407 68 HA ILE 27 HA ILE 27 -5.030 -8.111 2.699 69 HB ILE 27 HB ILE 27 -5.723 -6.280 4.998 70 HG12 ILE 27 HG12 ILE 27 -3.363 -7.022 5.109 71 HG13 ILE 27 HG11 ILE 27 -4.336 -7.697 6.410 72 HG21 ILE 27 HG21 ILE 27 -6.766 -8.264 5.961 73 HG22 ILE 27 HG22 ILE 27 -6.324 -9.195 4.530 74 HG23 ILE 27 HG23 ILE 27 -7.473 -7.864 4.396 75 HD11 ILE 27 HD11 ILE 27 -4.468 -9.816 5.200 76 HD12 ILE 27 HD12 ILE 27 -2.798 -9.344 5.512 77 HD13 ILE 27 HD13 ILE 27 -3.488 -9.134 3.903 78 H GLY 28 HN GLY 28 -6.541 -8.052 1.178 79 HA2 GLY 28 HA2 GLY 28 -8.150 -5.647 0.792 80 HA3 GLY 28 HA1 GLY 28 -8.091 -7.044 -0.276 81 H GLN 29 HN GLN 29 -10.535 -6.160 0.153 82 HA GLN 29 HA GLN 29 -11.819 -7.105 2.493 83 HB2 GLN 29 HB2 GLN 29 -12.742 -5.341 1.006 84 HB3 GLN 29 HB1 GLN 29 -13.041 -6.564 -0.219 85 HG2 GLN 29 HG2 GLN 29 -15.071 -6.011 1.002 86 HG3 GLN 29 HG1 GLN 29 -14.607 -7.692 1.254 87 HE21 GLN 29 HE21 GLN 29 -13.956 -8.367 3.276 88 HE22 GLN 29 HE22 GLN 29 -14.137 -7.385 4.689 89 H ASP 30 HN ASP 30 -10.854 -8.630 -0.451 90 HA ASP 30 HA ASP 30 -12.606 -10.902 -0.150 91 HB2 ASP 30 HB2 ASP 30 -11.520 -11.806 -2.098 92 HB3 ASP 30 HB1 ASP 30 -11.808 -10.093 -2.380 93 H SER 31 HN SER 31 -10.270 -9.971 1.750 94 HA SER 31 HA SER 31 -8.898 -10.934 3.263 95 HB2 SER 31 HB2 SER 31 -10.313 -13.482 2.441 96 HB3 SER 31 HB1 SER 31 -9.309 -13.289 3.879 97 HG SER 31 HG SER 31 -10.966 -11.360 4.111 98 H SER 32 HN SER 32 -7.682 -10.347 1.004 99 HA SER 32 HA SER 32 -6.157 -12.674 0.134 100 HB2 SER 32 HB2 SER 32 -5.172 -10.770 -1.409 101 HB3 SER 32 HB1 SER 32 -6.753 -11.478 -1.752 102 HG SER 32 HG SER 32 -7.677 -9.635 -1.303 103 H GLU 33 HN GLU 33 -3.766 -12.315 -0.176 104 HA GLU 33 HA GLU 33 -2.618 -10.633 1.949 105 HB2 GLU 33 HB2 GLU 33 -2.062 -13.522 1.323 106 HB3 GLU 33 HB1 GLU 33 -0.852 -12.525 2.114 107 HG2 GLU 33 HG2 GLU 33 -2.613 -12.032 3.864 108 HG3 GLU 33 HG1 GLU 33 -3.564 -13.320 3.124 109 H ILE 34 HN ILE 34 -2.702 -9.423 -0.236 110 HA ILE 34 HA ILE 34 -1.051 -10.017 -2.389 111 HB ILE 34 HB ILE 34 -1.628 -7.242 -1.357 112 HG12 ILE 34 HG12 ILE 34 -3.721 -8.509 -1.478 113 HG13 ILE 34 HG11 ILE 34 -3.655 -7.300 -2.758 114 HG21 ILE 34 HG21 ILE 34 0.020 -7.351 -3.154 115 HG22 ILE 34 HG22 ILE 34 -1.479 -6.600 -3.701 116 HG23 ILE 34 HG23 ILE 34 -1.116 -8.269 -4.141 117 HD11 ILE 34 HD11 ILE 34 -4.569 -9.342 -3.624 118 HD12 ILE 34 HD12 ILE 34 -3.181 -10.258 -3.040 119 HD13 ILE 34 HD13 ILE 34 -2.976 -9.080 -4.337 120 H HIS 35 HN HIS 35 1.059 -9.701 -2.884 121 HA HIS 35 HA HIS 35 2.827 -8.902 -0.675 122 HB2 HIS 35 HB2 HIS 35 2.860 -11.129 -2.374 123 HB3 HIS 35 HB1 HIS 35 4.161 -10.097 -2.954 124 HD2 HIS 35 HD2 HIS 35 4.466 -9.245 0.497 125 HE1 HIS 35 HE1 HIS 35 6.276 -13.063 0.321 126 HE2 HIS 35 HE2 HIS 35 5.759 -11.075 1.806 127 H PHE 36 HN PHE 36 2.601 -6.650 -1.066 128 HA PHE 36 HA PHE 36 3.321 -5.591 -3.663 129 HB2 PHE 36 HB2 PHE 36 1.635 -4.638 -1.865 130 HB3 PHE 36 HB1 PHE 36 3.083 -3.876 -1.220 131 HD1 PHE 36 HD1 PHE 36 4.325 -3.590 -4.107 132 HD2 PHE 36 HD2 PHE 36 0.609 -2.511 -2.342 133 HE1 PHE 36 HE1 PHE 36 4.088 -1.764 -5.736 134 HE2 PHE 36 HE2 PHE 36 0.365 -0.685 -3.967 135 HZ PHE 36 HZ PHE 36 2.101 -0.307 -5.669 136 H LYS 37 HN LYS 37 5.375 -5.392 -4.284 137 HA LYS 37 HA LYS 37 7.483 -5.278 -2.269 138 HB2 LYS 37 HB2 LYS 37 7.557 -6.724 -4.394 139 HB3 LYS 37 HB1 LYS 37 7.869 -5.225 -5.259 140 HG2 LYS 37 HG2 LYS 37 9.872 -4.863 -3.890 141 HG3 LYS 37 HG1 LYS 37 9.564 -6.385 -3.056 142 HD2 LYS 37 HD2 LYS 37 10.049 -6.100 -6.018 143 HD3 LYS 37 HD1 LYS 37 11.263 -6.597 -4.839 144 HE2 LYS 37 HE2 LYS 37 9.770 -8.509 -4.229 145 HE3 LYS 37 HE1 LYS 37 8.717 -8.042 -5.562 146 HZ1 LYS 37 HZ1 LYS 37 10.803 -8.256 -6.987 147 HZ2 LYS 37 HZ2 LYS 37 10.072 -9.685 -6.450 148 HZ3 LYS 37 HZ3 LYS 37 11.466 -9.110 -5.683 149 H VAL 38 HN VAL 38 7.793 -3.317 -1.425 150 HA VAL 38 HA VAL 38 7.425 -0.965 -3.118 151 HB VAL 38 HB VAL 38 7.433 0.359 -1.095 152 HG11 VAL 38 HG11 VAL 38 5.717 -2.101 -0.790 153 HG12 VAL 38 HG12 VAL 38 5.333 -0.678 -1.759 154 HG13 VAL 38 HG13 VAL 38 5.444 -0.546 -0.005 155 HG21 VAL 38 HG21 VAL 38 8.020 -2.220 0.364 156 HG22 VAL 38 HG22 VAL 38 7.628 -0.678 1.124 157 HG23 VAL 38 HG23 VAL 38 9.111 -0.845 0.186 158 H LYS 39 HN LYS 39 8.925 0.714 -3.190 159 HA LYS 39 HA LYS 39 11.686 -0.192 -3.184 160 HB2 LYS 39 HB2 LYS 39 10.397 1.181 -5.029 161 HB3 LYS 39 HB1 LYS 39 10.805 2.552 -4.010 162 HG2 LYS 39 HG2 LYS 39 13.178 1.980 -4.216 163 HG3 LYS 39 HG1 LYS 39 12.749 0.630 -5.269 164 HD2 LYS 39 HD2 LYS 39 11.823 2.128 -6.906 165 HD3 LYS 39 HD1 LYS 39 12.039 3.508 -5.831 166 HE2 LYS 39 HE2 LYS 39 14.510 3.027 -5.900 167 HE3 LYS 39 HE1 LYS 39 14.168 1.871 -7.186 168 HZ1 LYS 39 HZ1 LYS 39 13.654 3.515 -8.654 169 HZ2 LYS 39 HZ2 LYS 39 14.783 4.346 -7.711 170 HZ3 LYS 39 HZ3 LYS 39 13.128 4.596 -7.458 171 H MET 40 HN MET 40 12.743 0.009 -1.315 172 HA MET 40 HA MET 40 11.934 1.844 0.719 173 HB2 MET 40 HB2 MET 40 12.977 -0.443 1.082 174 HB3 MET 40 HB1 MET 40 14.517 0.290 0.653 175 HG2 MET 40 HG2 MET 40 14.086 0.111 3.100 176 HG3 MET 40 HG1 MET 40 14.447 1.739 2.532 177 HE1 MET 40 HE1 MET 40 13.328 1.689 5.332 178 HE2 MET 40 HE2 MET 40 12.639 0.086 5.080 179 HE3 MET 40 HE3 MET 40 11.598 1.430 5.555 180 H THR 41 HN THR 41 12.096 3.733 -0.649 181 HA THR 41 HA THR 41 14.140 5.439 0.054 182 HB THR 41 HB THR 41 15.516 3.974 -1.487 183 HG1 THR 41 HG1 THR 41 15.194 6.753 -1.994 184 HG21 THR 41 HG21 THR 41 13.800 5.275 -3.604 185 HG22 THR 41 HG22 THR 41 13.874 3.555 -3.227 186 HG23 THR 41 HG23 THR 41 15.281 4.368 -3.910 187 H THR 42 HN THR 42 11.479 4.527 -1.873 188 HA THR 42 HA THR 42 11.004 7.280 -2.766 189 HB THR 42 HB THR 42 9.370 4.895 -3.601 190 HG1 THR 42 HG1 THR 42 11.260 5.455 -5.431 191 HG21 THR 42 HG21 THR 42 8.607 7.170 -4.213 192 HG22 THR 42 HG22 THR 42 9.015 6.195 -5.625 193 HG23 THR 42 HG23 THR 42 10.134 7.433 -5.055 194 H HIS 43 HN HIS 43 8.988 8.275 -2.370 195 HA HIS 43 HA HIS 43 7.856 7.724 0.175 196 HB2 HIS 43 HB2 HIS 43 7.356 9.702 -1.994 197 HB3 HIS 43 HB1 HIS 43 6.061 9.430 -0.833 198 HD2 HIS 43 HD2 HIS 43 6.720 10.066 1.851 199 HE1 HIS 43 HE1 HIS 43 10.041 12.425 0.722 200 HE2 HIS 43 HE2 HIS 43 8.628 11.617 2.663 201 H LEU 44 HN LEU 44 5.649 7.223 0.659 202 HA LEU 44 HA LEU 44 4.693 4.998 -0.855 203 HB2 LEU 44 HB2 LEU 44 3.623 6.475 1.539 204 HB3 LEU 44 HB1 LEU 44 2.779 5.118 0.819 205 HG LEU 44 HG LEU 44 5.618 4.887 1.791 206 HD11 LEU 44 HD11 LEU 44 3.091 4.357 3.345 207 HD12 LEU 44 HD12 LEU 44 4.260 5.637 3.667 208 HD13 LEU 44 HD13 LEU 44 4.725 3.948 3.863 209 HD21 LEU 44 HD21 LEU 44 5.016 2.498 1.929 210 HD22 LEU 44 HD22 LEU 44 4.893 3.138 0.291 211 HD23 LEU 44 HD23 LEU 44 3.434 2.881 1.247 212 H LYS 45 HN LYS 45 4.433 8.196 -1.427 213 HA LYS 45 HA LYS 45 1.777 8.717 -2.051 214 HB2 LYS 45 HB2 LYS 45 3.270 10.537 -2.081 215 HB3 LYS 45 HB1 LYS 45 4.388 9.722 -3.161 216 HG2 LYS 45 HG2 LYS 45 3.304 11.466 -4.372 217 HG3 LYS 45 HG1 LYS 45 2.696 9.921 -4.969 218 HD2 LYS 45 HD2 LYS 45 0.692 10.180 -3.590 219 HD3 LYS 45 HD1 LYS 45 1.308 11.715 -2.980 220 HE2 LYS 45 HE2 LYS 45 1.146 12.728 -5.119 221 HE3 LYS 45 HE1 LYS 45 0.842 11.179 -5.900 222 HZ1 LYS 45 HZ1 LYS 45 -1.309 11.159 -5.240 223 HZ2 LYS 45 HZ2 LYS 45 -1.096 12.836 -5.313 224 HZ3 LYS 45 HZ3 LYS 45 -1.026 12.038 -3.818 225 H LYS 46 HN LYS 46 4.352 7.580 -4.230 226 HA LYS 46 HA LYS 46 2.626 7.158 -6.430 227 HB2 LYS 46 HB2 LYS 46 5.197 7.433 -6.396 228 HB3 LYS 46 HB1 LYS 46 5.236 5.711 -6.045 229 HG2 LYS 46 HG2 LYS 46 5.535 6.028 -8.398 230 HG3 LYS 46 HG1 LYS 46 3.948 5.306 -8.126 231 HD2 LYS 46 HD2 LYS 46 3.010 7.653 -8.223 232 HD3 LYS 46 HD1 LYS 46 4.594 8.170 -8.794 233 HE2 LYS 46 HE2 LYS 46 4.415 6.860 -10.757 234 HE3 LYS 46 HE1 LYS 46 3.009 5.996 -10.141 235 HZ1 LYS 46 HZ1 LYS 46 3.154 8.818 -11.021 236 HZ2 LYS 46 HZ2 LYS 46 1.840 8.202 -10.146 237 HZ3 LYS 46 HZ3 LYS 46 2.215 7.572 -11.676 238 H LEU 47 HN LEU 47 3.718 5.130 -3.795 239 HA LEU 47 HA LEU 47 2.923 2.633 -4.783 240 HB2 LEU 47 HB2 LEU 47 3.310 3.756 -2.031 241 HB3 LEU 47 HB1 LEU 47 2.627 2.157 -2.227 242 HG LEU 47 HG LEU 47 4.979 1.957 -1.784 243 HD11 LEU 47 HD11 LEU 47 5.695 0.644 -3.662 244 HD12 LEU 47 HD12 LEU 47 4.515 1.427 -4.709 245 HD13 LEU 47 HD13 LEU 47 3.972 0.387 -3.391 246 HD21 LEU 47 HD21 LEU 47 5.423 3.727 -4.184 247 HD22 LEU 47 HD22 LEU 47 6.679 2.903 -3.260 248 HD23 LEU 47 HD23 LEU 47 5.709 4.164 -2.499 249 H LYS 48 HN LYS 48 1.166 5.083 -2.936 250 HA LYS 48 HA LYS 48 -1.186 3.611 -2.507 251 HB2 LYS 48 HB2 LYS 48 -0.645 6.573 -2.613 252 HB3 LYS 48 HB1 LYS 48 -2.235 5.921 -2.241 253 HG2 LYS 48 HG2 LYS 48 -1.381 4.819 -0.280 254 HG3 LYS 48 HG1 LYS 48 0.268 5.298 -0.690 255 HD2 LYS 48 HD2 LYS 48 -0.464 6.814 0.981 256 HD3 LYS 48 HD1 LYS 48 -0.528 7.697 -0.546 257 HE2 LYS 48 HE2 LYS 48 -2.941 7.236 -0.686 258 HE3 LYS 48 HE1 LYS 48 -2.861 6.399 0.863 259 HZ1 LYS 48 HZ1 LYS 48 -2.239 8.436 1.937 260 HZ2 LYS 48 HZ2 LYS 48 -3.643 8.715 1.036 261 HZ3 LYS 48 HZ3 LYS 48 -2.150 9.258 0.451 262 H GLU 49 HN GLU 49 -0.466 6.044 -5.034 263 HA GLU 49 HA GLU 49 -2.982 5.723 -6.294 264 HB2 GLU 49 HB2 GLU 49 -1.851 6.897 -8.245 265 HB3 GLU 49 HB1 GLU 49 -1.934 7.769 -6.724 266 HG2 GLU 49 HG2 GLU 49 0.407 7.066 -6.270 267 HG3 GLU 49 HG1 GLU 49 0.459 6.370 -7.890 268 H SER 50 HN SER 50 0.134 4.147 -6.789 269 HA SER 50 HA SER 50 -0.478 2.910 -9.240 270 HB2 SER 50 HB2 SER 50 1.360 1.961 -7.027 271 HB3 SER 50 HB1 SER 50 1.332 1.317 -8.668 272 HG SER 50 HG SER 50 2.052 3.925 -7.820 273 H TYR 51 HN TYR 51 -1.083 1.922 -5.890 274 HA TYR 51 HA TYR 51 -2.059 -0.661 -6.513 275 HB2 TYR 51 HB2 TYR 51 -1.344 0.203 -4.221 276 HB3 TYR 51 HB1 TYR 51 -2.919 0.981 -4.133 277 HD1 TYR 51 HD1 TYR 51 -1.309 -2.337 -4.622 278 HD2 TYR 51 HD2 TYR 51 -4.771 -0.216 -3.348 279 HE1 TYR 51 HE1 TYR 51 -2.288 -4.436 -3.801 280 HE2 TYR 51 HE2 TYR 51 -5.756 -2.311 -2.521 281 HH TYR 51 HH TYR 51 -5.558 -4.715 -2.895 282 H CYS 52 HN CYS 52 -3.567 2.504 -6.280 283 HA CYS 52 HA CYS 52 -6.248 1.673 -6.402 284 HB2 CYS 52 HB2 CYS 52 -5.064 4.244 -7.476 285 HB3 CYS 52 HB1 CYS 52 -6.754 3.964 -7.072 286 HG CYS 52 HG CYS 52 -4.227 3.872 -4.759 287 H GLN 53 HN GLN 53 -3.946 2.603 -8.937 288 HA GLN 53 HA GLN 53 -5.713 2.270 -11.111 289 HB2 GLN 53 HB2 GLN 53 -2.698 2.021 -11.077 290 HB3 GLN 53 HB1 GLN 53 -3.696 2.280 -12.502 291 HG2 GLN 53 HG2 GLN 53 -4.257 4.463 -11.854 292 HG3 GLN 53 HG1 GLN 53 -3.704 4.201 -10.202 293 HE21 GLN 53 HE21 GLN 53 -2.953 6.305 -12.028 294 HE22 GLN 53 HE22 GLN 53 -1.239 6.189 -12.226 295 H ARG 54 HN ARG 54 -3.608 0.047 -9.393 296 HA ARG 54 HA ARG 54 -3.841 -2.103 -11.231 297 HB2 ARG 54 HB2 ARG 54 -2.141 -2.775 -9.944 298 HB3 ARG 54 HB1 ARG 54 -2.537 -1.581 -8.722 299 HG2 ARG 54 HG2 ARG 54 -2.839 -3.361 -7.407 300 HG3 ARG 54 HG1 ARG 54 -4.405 -3.481 -8.209 301 HD2 ARG 54 HD2 ARG 54 -3.425 -5.039 -9.845 302 HD3 ARG 54 HD1 ARG 54 -1.883 -4.941 -8.996 303 HE ARG 54 HE ARG 54 -4.246 -5.823 -7.508 304 HH11 ARG 54 HH11 ARG 54 -1.206 -6.648 -9.093 305 HH12 ARG 54 HH12 ARG 54 -1.016 -8.199 -8.175 306 HH21 ARG 54 HH21 ARG 54 -4.037 -7.786 -6.343 307 HH22 ARG 54 HH22 ARG 54 -2.567 -8.811 -6.610 308 H GLN 55 HN GLN 55 -5.834 -0.921 -8.649 309 HA GLN 55 HA GLN 55 -7.478 -3.323 -8.637 310 HB2 GLN 55 HB2 GLN 55 -7.617 -0.767 -7.033 311 HB3 GLN 55 HB1 GLN 55 -8.811 -2.051 -6.908 312 HG2 GLN 55 HG2 GLN 55 -5.888 -2.215 -6.219 313 HG3 GLN 55 HG1 GLN 55 -7.256 -2.262 -5.108 314 HE21 GLN 55 HE21 GLN 55 -8.562 -4.139 -5.051 315 HE22 GLN 55 HE22 GLN 55 -7.977 -5.655 -5.635 316 H GLY 56 HN GLY 56 -7.271 -0.452 -10.354 317 HA2 GLY 56 HA2 GLY 56 -8.597 0.206 -12.141 318 HA3 GLY 56 HA1 GLY 56 -9.795 -0.982 -11.658 319 H VAL 57 HN VAL 57 -8.435 1.590 -9.647 320 HA VAL 57 HA VAL 57 -10.944 3.085 -9.828 321 HB VAL 57 HB VAL 57 -10.788 3.392 -7.267 322 HG11 VAL 57 HG11 VAL 57 -12.192 1.398 -6.872 323 HG12 VAL 57 HG12 VAL 57 -11.736 0.795 -8.466 324 HG13 VAL 57 HG13 VAL 57 -12.659 2.291 -8.319 325 HG21 VAL 57 HG21 VAL 57 -9.315 0.777 -7.541 326 HG22 VAL 57 HG22 VAL 57 -9.897 1.484 -6.035 327 HG23 VAL 57 HG23 VAL 57 -8.630 2.294 -6.958 328 HA PRO 58 HA PRO 58 -8.202 6.556 -9.742 329 HB2 PRO 58 HB2 PRO 58 -9.751 8.465 -8.597 330 HB3 PRO 58 HB1 PRO 58 -10.031 7.873 -10.242 331 HG2 PRO 58 HG2 PRO 58 -11.427 7.103 -7.713 332 HG3 PRO 58 HG1 PRO 58 -12.113 7.450 -9.313 333 HD2 PRO 58 HD2 PRO 58 -11.735 4.928 -8.435 334 HD3 PRO 58 HD1 PRO 58 -11.579 5.373 -10.147 335 H MET 59 HN MET 59 -7.311 8.264 -8.169 336 HA MET 59 HA MET 59 -6.558 6.894 -5.752 337 HB2 MET 59 HB2 MET 59 -5.113 8.480 -7.249 338 HB3 MET 59 HB1 MET 59 -5.861 9.758 -6.298 339 HG2 MET 59 HG2 MET 59 -5.075 8.510 -4.248 340 HG3 MET 59 HG1 MET 59 -4.109 7.518 -5.338 341 HE1 MET 59 HE1 MET 59 -1.824 8.003 -4.380 342 HE2 MET 59 HE2 MET 59 -2.609 8.857 -3.052 343 HE3 MET 59 HE3 MET 59 -1.251 9.600 -3.896 344 H ASN 60 HN ASN 60 -6.795 7.735 -3.635 345 HA ASN 60 HA ASN 60 -7.797 8.755 -1.877 346 HB2 ASN 60 HB2 ASN 60 -8.677 10.570 -4.057 347 HB3 ASN 60 HB1 ASN 60 -9.588 10.618 -2.550 348 HD21 ASN 60 HD21 ASN 60 -8.671 11.472 -0.745 349 HD22 ASN 60 HD22 ASN 60 -7.138 12.275 -0.745 350 H SER 61 HN SER 61 -9.135 6.786 -4.004 351 HA SER 61 HA SER 61 -11.867 6.840 -3.042 352 HB2 SER 61 HB2 SER 61 -12.150 4.862 -4.520 353 HB3 SER 61 HB1 SER 61 -11.454 6.234 -5.380 354 HG SER 61 HG SER 61 -9.716 5.105 -5.738 355 H LEU 62 HN LEU 62 -8.970 4.883 -2.737 356 HA LEU 62 HA LEU 62 -10.229 3.349 -0.574 357 HB2 LEU 62 HB2 LEU 62 -7.751 2.670 -2.162 358 HB3 LEU 62 HB1 LEU 62 -8.539 1.650 -0.977 359 HG LEU 62 HG LEU 62 -9.782 2.496 -3.594 360 HD11 LEU 62 HD11 LEU 62 -9.376 0.178 -4.296 361 HD12 LEU 62 HD12 LEU 62 -8.467 -0.099 -2.810 362 HD13 LEU 62 HD13 LEU 62 -7.877 1.059 -4.002 363 HD21 LEU 62 HD21 LEU 62 -11.478 2.027 -1.991 364 HD22 LEU 62 HD22 LEU 62 -10.641 0.577 -1.442 365 HD23 LEU 62 HD23 LEU 62 -11.354 0.627 -3.055 366 H ARG 63 HN ARG 63 -9.391 3.439 1.431 367 HA ARG 63 HA ARG 63 -7.096 5.229 1.836 368 HB2 ARG 63 HB2 ARG 63 -7.909 5.544 4.113 369 HB3 ARG 63 HB1 ARG 63 -9.179 5.912 2.957 370 HG2 ARG 63 HG2 ARG 63 -10.304 3.869 3.420 371 HG3 ARG 63 HG1 ARG 63 -8.945 3.272 4.376 372 HD2 ARG 63 HD2 ARG 63 -9.323 5.172 5.953 373 HD3 ARG 63 HD1 ARG 63 -10.776 5.574 5.039 374 HE ARG 63 HE ARG 63 -10.363 3.112 6.604 375 HH11 ARG 63 HH11 ARG 63 -13.985 4.684 5.693 376 HH12 ARG 63 HH12 ARG 63 -12.487 5.450 5.023 377 HH21 ARG 63 HH21 ARG 63 -12.240 2.125 7.450 378 HH22 ARG 63 HH22 ARG 63 -13.843 2.846 7.050 379 H PHE 64 HN PHE 64 -5.275 4.511 2.710 380 HA PHE 64 HA PHE 64 -5.049 1.667 3.302 381 HB2 PHE 64 HB2 PHE 64 -3.056 3.867 2.778 382 HB3 PHE 64 HB1 PHE 64 -2.554 2.314 3.436 383 HD1 PHE 64 HD1 PHE 64 -3.653 4.112 0.490 384 HD2 PHE 64 HD2 PHE 64 -2.805 0.264 2.101 385 HE1 PHE 64 HE1 PHE 64 -3.543 3.186 -1.787 386 HE2 PHE 64 HE2 PHE 64 -2.693 -0.668 -0.171 387 HZ PHE 64 HZ PHE 64 -3.060 0.794 -2.116 388 H LEU 65 HN LEU 65 -4.950 0.907 5.303 389 HA LEU 65 HA LEU 65 -4.523 2.845 7.482 390 HB2 LEU 65 HB2 LEU 65 -6.151 0.307 7.477 391 HB3 LEU 65 HB1 LEU 65 -5.868 1.308 8.886 392 HG LEU 65 HG LEU 65 -7.320 2.210 6.402 393 HD11 LEU 65 HD11 LEU 65 -9.333 2.053 7.714 394 HD12 LEU 65 HD12 LEU 65 -8.418 1.484 9.110 395 HD13 LEU 65 HD13 LEU 65 -8.533 0.485 7.660 396 HD21 LEU 65 HD21 LEU 65 -6.845 3.535 9.067 397 HD22 LEU 65 HD22 LEU 65 -7.999 4.105 7.861 398 HD23 LEU 65 HD23 LEU 65 -6.276 4.075 7.486 399 H PHE 66 HN PHE 66 -2.846 2.586 8.714 400 HA PHE 66 HA PHE 66 -1.639 -0.076 9.024 401 HB2 PHE 66 HB2 PHE 66 -0.261 1.131 7.409 402 HB3 PHE 66 HB1 PHE 66 -0.170 2.518 8.487 403 HD1 PHE 66 HD1 PHE 66 0.619 -1.135 8.457 404 HD2 PHE 66 HD2 PHE 66 1.692 2.760 9.808 405 HE1 PHE 66 HE1 PHE 66 2.665 -2.050 9.474 406 HE2 PHE 66 HE2 PHE 66 3.733 1.844 10.824 407 HZ PHE 66 HZ PHE 66 4.223 -0.560 10.658 408 H GLU 67 HN GLU 67 -1.576 -0.591 11.106 409 HA GLU 67 HA GLU 67 -1.548 -0.463 13.375 410 HB2 GLU 67 HB2 GLU 67 0.071 1.901 12.564 411 HB3 GLU 67 HB1 GLU 67 -0.437 1.797 14.245 412 HG2 GLU 67 HG2 GLU 67 0.792 -0.608 13.028 413 HG3 GLU 67 HG1 GLU 67 1.840 0.764 13.389 414 H GLY 68 HN GLY 68 -3.748 0.752 11.739 415 HA2 GLY 68 HA2 GLY 68 -5.867 1.390 12.546 416 HA3 GLY 68 HA1 GLY 68 -5.095 2.055 13.978 417 H GLN 69 HN GLN 69 -3.092 3.368 12.071 418 HA GLN 69 HA GLN 69 -4.685 5.787 11.690 419 HB2 GLN 69 HB2 GLN 69 -1.703 5.395 11.374 420 HB3 GLN 69 HB1 GLN 69 -2.558 6.930 11.451 421 HG2 GLN 69 HG2 GLN 69 -3.180 6.500 13.753 422 HG3 GLN 69 HG1 GLN 69 -2.409 4.918 13.684 423 HE21 GLN 69 HE21 GLN 69 -1.884 7.183 15.435 424 HE22 GLN 69 HE22 GLN 69 -0.212 7.568 15.225 425 H ARG 70 HN ARG 70 -4.259 7.066 9.656 426 HA ARG 70 HA ARG 70 -4.291 5.202 7.398 427 HB2 ARG 70 HB2 ARG 70 -5.417 6.920 6.131 428 HB3 ARG 70 HB1 ARG 70 -6.244 6.691 7.664 429 HG2 ARG 70 HG2 ARG 70 -4.940 8.689 8.510 430 HG3 ARG 70 HG1 ARG 70 -4.477 8.973 6.831 431 HD2 ARG 70 HD2 ARG 70 -7.312 8.764 7.827 432 HD3 ARG 70 HD1 ARG 70 -6.463 10.281 7.542 433 HE ARG 70 HE ARG 70 -6.247 9.350 5.154 434 HH11 ARG 70 HH11 ARG 70 -8.980 8.771 7.304 435 HH12 ARG 70 HH12 ARG 70 -10.155 8.621 5.940 436 HH21 ARG 70 HH21 ARG 70 -7.718 9.163 3.417 437 HH22 ARG 70 HH22 ARG 70 -9.462 8.823 3.782 438 H ILE 71 HN ILE 71 -2.978 5.401 5.652 439 HA ILE 71 HA ILE 71 -0.457 6.713 6.111 440 HB ILE 71 HB ILE 71 -1.442 5.114 3.743 441 HG12 ILE 71 HG12 ILE 71 -1.306 3.790 5.792 442 HG13 ILE 71 HG11 ILE 71 -0.033 3.317 4.674 443 HG21 ILE 71 HG21 ILE 71 0.881 4.975 3.037 444 HG22 ILE 71 HG22 ILE 71 1.373 5.985 4.397 445 HG23 ILE 71 HG23 ILE 71 0.363 6.659 3.119 446 HD11 ILE 71 HD11 ILE 71 1.520 4.793 5.971 447 HD12 ILE 71 HD12 ILE 71 0.915 3.385 6.843 448 HD13 ILE 71 HD13 ILE 71 0.233 4.980 7.163 449 H ALA 72 HN ALA 72 0.102 8.659 5.452 450 HA ALA 72 HA ALA 72 -1.693 10.183 3.764 451 HB1 ALA 72 HB1 ALA 72 -0.273 12.085 4.327 452 HB2 ALA 72 HB2 ALA 72 0.869 11.003 5.124 453 HB3 ALA 72 HB3 ALA 72 -0.755 11.204 5.779 454 H ASP 73 HN ASP 73 -0.671 11.602 2.052 455 HA ASP 73 HA ASP 73 0.627 9.922 0.137 456 HB2 ASP 73 HB2 ASP 73 -0.387 12.735 0.168 457 HB3 ASP 73 HB1 ASP 73 0.735 12.260 -1.100 458 H ASN 74 HN ASN 74 1.733 11.999 2.582 459 HA ASN 74 HA ASN 74 4.352 12.342 1.297 460 HB2 ASN 74 HB2 ASN 74 4.798 14.062 2.931 461 HB3 ASN 74 HB1 ASN 74 3.214 14.362 2.227 462 HD21 ASN 74 HD21 ASN 74 4.973 13.822 5.075 463 HD22 ASN 74 HD22 ASN 74 3.640 13.769 6.178 464 H HIS 75 HN HIS 75 3.089 9.938 2.849 465 HA HIS 75 HA HIS 75 4.967 9.666 5.034 466 HB2 HIS 75 HB2 HIS 75 2.595 8.174 4.080 467 HB3 HIS 75 HB1 HIS 75 3.827 7.236 4.915 468 HD2 HIS 75 HD2 HIS 75 4.447 9.831 7.062 469 HE1 HIS 75 HE1 HIS 75 0.534 8.790 8.281 470 HE2 HIS 75 HE2 HIS 75 2.591 10.151 8.845 471 H THR 76 HN THR 76 6.616 8.215 5.190 472 HA THR 76 HA THR 76 7.457 6.888 2.693 473 HB THR 76 HB THR 76 9.645 7.463 4.528 474 HG1 THR 76 HG1 THR 76 8.190 9.324 4.899 475 HG21 THR 76 HG21 THR 76 9.893 6.821 2.156 476 HG22 THR 76 HG22 THR 76 10.695 8.346 2.523 477 HG23 THR 76 HG23 THR 76 9.146 8.346 1.682 478 HA PRO 77 HA PRO 77 7.401 3.138 5.099 479 HB2 PRO 77 HB2 PRO 77 9.717 2.222 3.512 480 HB3 PRO 77 HB1 PRO 77 8.099 1.523 3.640 481 HG2 PRO 77 HG2 PRO 77 8.879 2.769 1.419 482 HG3 PRO 77 HG1 PRO 77 7.211 2.897 2.016 483 HD2 PRO 77 HD2 PRO 77 9.450 4.864 2.232 484 HD3 PRO 77 HD1 PRO 77 7.732 5.145 1.883 485 H LYS 78 HN LYS 78 10.063 5.228 4.954 486 HA LYS 78 HA LYS 78 11.853 3.754 6.632 487 HB2 LYS 78 HB2 LYS 78 12.642 5.428 4.998 488 HB3 LYS 78 HB1 LYS 78 11.825 6.692 5.905 489 HG2 LYS 78 HG2 LYS 78 14.184 6.716 6.388 490 HG3 LYS 78 HG1 LYS 78 13.281 6.238 7.826 491 HD2 LYS 78 HD2 LYS 78 15.209 4.825 7.640 492 HD3 LYS 78 HD1 LYS 78 13.780 3.861 7.270 493 HE2 LYS 78 HE2 LYS 78 14.662 3.303 5.314 494 HE3 LYS 78 HE1 LYS 78 14.714 5.000 4.847 495 HZ1 LYS 78 HZ1 LYS 78 16.888 5.210 5.516 496 HZ2 LYS 78 HZ2 LYS 78 16.883 3.631 4.904 497 HZ3 LYS 78 HZ3 LYS 78 16.818 3.892 6.568 498 H GLU 79 HN GLU 79 9.246 6.014 7.114 499 HA GLU 79 HA GLU 79 9.900 6.164 9.974 500 HB2 GLU 79 HB2 GLU 79 8.489 8.104 10.109 501 HB3 GLU 79 HB1 GLU 79 9.592 8.315 8.757 502 HG2 GLU 79 HG2 GLU 79 7.563 7.278 7.415 503 HG3 GLU 79 HG1 GLU 79 6.657 7.937 8.776 504 H LEU 80 HN LEU 80 7.485 6.632 11.103 505 HA LEU 80 HA LEU 80 5.561 5.702 11.871 506 HB2 LEU 80 HB2 LEU 80 5.523 4.113 9.299 507 HB3 LEU 80 HB1 LEU 80 4.199 4.254 10.437 508 HG LEU 80 HG LEU 80 5.347 6.546 8.847 509 HD11 LEU 80 HD11 LEU 80 4.257 4.934 7.395 510 HD12 LEU 80 HD12 LEU 80 3.286 6.400 7.538 511 HD13 LEU 80 HD13 LEU 80 2.828 4.948 8.428 512 HD21 LEU 80 HD21 LEU 80 2.866 6.366 10.551 513 HD22 LEU 80 HD22 LEU 80 3.388 7.765 9.612 514 HD23 LEU 80 HD23 LEU 80 4.351 7.214 10.982 515 H GLY 81 HN GLY 81 7.394 3.192 10.156 516 HA2 GLY 81 HA2 GLY 81 8.695 1.683 11.678 517 HA3 GLY 81 HA1 GLY 81 7.197 1.527 12.588 518 H MET 82 HN MET 82 7.954 1.460 9.120 519 HA MET 82 HA MET 82 6.273 -0.899 8.837 520 HB2 MET 82 HB2 MET 82 7.330 1.176 6.984 521 HB3 MET 82 HB1 MET 82 7.018 -0.423 6.322 522 HG2 MET 82 HG2 MET 82 4.713 -0.307 7.062 523 HG3 MET 82 HG1 MET 82 5.010 1.270 7.789 524 HE1 MET 82 HE1 MET 82 2.677 0.526 5.551 525 HE2 MET 82 HE2 MET 82 2.716 2.080 4.716 526 HE3 MET 82 HE3 MET 82 2.848 2.020 6.473 527 H GLU 83 HN GLU 83 7.019 -2.875 8.528 528 HA GLU 83 HA GLU 83 9.872 -3.199 7.868 529 HB2 GLU 83 HB2 GLU 83 8.299 -4.735 9.942 530 HB3 GLU 83 HB1 GLU 83 9.931 -5.132 9.427 531 HG2 GLU 83 HG2 GLU 83 10.175 -2.500 10.105 532 HG3 GLU 83 HG1 GLU 83 8.990 -3.080 11.274 533 H GLU 84 HN GLU 84 10.179 -5.757 7.507 534 HA GLU 84 HA GLU 84 8.792 -6.319 5.096 535 HB2 GLU 84 HB2 GLU 84 11.080 -7.038 5.379 536 HB3 GLU 84 HB1 GLU 84 10.657 -7.975 6.801 537 HG2 GLU 84 HG2 GLU 84 11.016 -9.427 4.916 538 HG3 GLU 84 HG1 GLU 84 9.323 -9.478 5.406 539 H GLU 85 HN GLU 85 7.155 -7.707 4.661 540 HA GLU 85 HA GLU 85 5.338 -9.025 4.949 541 HB2 GLU 85 HB2 GLU 85 7.093 -9.984 7.166 542 HB3 GLU 85 HB1 GLU 85 5.425 -10.533 7.104 543 HG2 GLU 85 HG2 GLU 85 7.356 -10.794 4.816 544 HG3 GLU 85 HG1 GLU 85 7.087 -12.048 6.026 545 H ASP 86 HN ASP 86 5.492 -6.327 6.100 546 HA ASP 86 HA ASP 86 4.040 -6.319 8.554 547 HB2 ASP 86 HB2 ASP 86 5.396 -4.402 7.062 548 HB3 ASP 86 HB1 ASP 86 3.710 -3.899 6.974 549 H VAL 87 HN VAL 87 1.858 -5.499 8.841 550 HA VAL 87 HA VAL 87 0.118 -6.426 6.664 551 HB VAL 87 HB VAL 87 -0.507 -6.162 9.606 552 HG11 VAL 87 HG11 VAL 87 -2.589 -7.323 9.084 553 HG12 VAL 87 HG12 VAL 87 -2.173 -7.317 7.371 554 HG13 VAL 87 HG13 VAL 87 -2.481 -5.795 8.209 555 HG21 VAL 87 HG21 VAL 87 -0.072 -8.623 7.919 556 HG22 VAL 87 HG22 VAL 87 -0.520 -8.601 9.624 557 HG23 VAL 87 HG23 VAL 87 1.053 -7.984 9.118 558 H ILE 88 HN ILE 88 -0.952 -4.985 5.548 559 HA ILE 88 HA ILE 88 -1.835 -2.516 6.863 560 HB ILE 88 HB ILE 88 0.138 -1.935 5.551 561 HG12 ILE 88 HG12 ILE 88 -2.285 -0.961 4.037 562 HG13 ILE 88 HG11 ILE 88 -1.880 -0.399 5.657 563 HG21 ILE 88 HG21 ILE 88 0.220 -2.203 3.136 564 HG22 ILE 88 HG22 ILE 88 -1.325 -3.050 3.168 565 HG23 ILE 88 HG23 ILE 88 0.087 -3.764 3.945 566 HD11 ILE 88 HD11 ILE 88 0.288 0.395 4.803 567 HD12 ILE 88 HD12 ILE 88 -1.087 1.175 4.024 568 HD13 ILE 88 HD13 ILE 88 -0.199 -0.095 3.181 569 H GLU 89 HN GLU 89 -3.921 -1.976 6.429 570 HA GLU 89 HA GLU 89 -5.362 -3.777 4.604 571 HB2 GLU 89 HB2 GLU 89 -6.387 -2.160 6.941 572 HB3 GLU 89 HB1 GLU 89 -7.393 -3.133 5.880 573 HG2 GLU 89 HG2 GLU 89 -5.768 -5.051 6.578 574 HG3 GLU 89 HG1 GLU 89 -5.435 -3.993 7.947 575 H VAL 90 HN VAL 90 -7.048 -2.947 3.294 576 HA VAL 90 HA VAL 90 -6.917 -0.059 2.783 577 HB VAL 90 HB VAL 90 -5.575 -1.075 1.062 578 HG11 VAL 90 HG11 VAL 90 -7.925 -2.873 0.484 579 HG12 VAL 90 HG12 VAL 90 -6.388 -3.359 1.197 580 HG13 VAL 90 HG13 VAL 90 -6.445 -2.783 -0.468 581 HG21 VAL 90 HG21 VAL 90 -8.295 -0.339 -0.004 582 HG22 VAL 90 HG22 VAL 90 -6.814 -0.412 -0.959 583 HG23 VAL 90 HG23 VAL 90 -6.967 0.766 0.346 584 H TYR 91 HN TYR 91 -8.855 0.873 2.844 585 HA TYR 91 HA TYR 91 -11.243 -0.768 2.276 586 HB2 TYR 91 HB2 TYR 91 -10.859 1.230 4.517 587 HB3 TYR 91 HB1 TYR 91 -12.425 0.584 4.046 588 HD1 TYR 91 HD1 TYR 91 -13.063 -1.669 4.625 589 HD2 TYR 91 HD2 TYR 91 -9.199 -0.194 5.620 590 HE1 TYR 91 HE1 TYR 91 -12.733 -3.573 6.149 591 HE2 TYR 91 HE2 TYR 91 -8.860 -2.091 7.144 592 HH TYR 91 HH TYR 91 -9.721 -3.909 8.034 593 H GLN 92 HN GLN 92 -13.091 0.458 1.504 594 HA GLN 92 HA GLN 92 -12.245 2.688 -0.137 595 HB2 GLN 92 HB2 GLN 92 -13.791 0.850 -0.950 596 HB3 GLN 92 HB1 GLN 92 -15.031 1.545 0.087 597 HG2 GLN 92 HG2 GLN 92 -14.366 3.748 -1.227 598 HG3 GLN 92 HG1 GLN 92 -13.876 2.570 -2.444 599 HE21 GLN 92 HE21 GLN 92 -16.513 3.988 -0.721 600 HE22 GLN 92 HE22 GLN 92 -17.777 3.319 -1.691 601 H GLU 93 HN GLU 93 -12.814 4.786 0.114 602 HA GLU 93 HA GLU 93 -13.729 5.602 2.706 603 HB2 GLU 93 HB2 GLU 93 -13.000 7.107 0.195 604 HB3 GLU 93 HB1 GLU 93 -13.564 7.915 1.651 605 HG2 GLU 93 HG2 GLU 93 -11.234 6.044 1.740 606 HG3 GLU 93 HG1 GLU 93 -11.037 7.721 1.230 607 H GLN 94 HN GLN 94 -15.608 6.816 3.167 608 HA GLN 94 HA GLN 94 -17.957 5.916 1.878 609 HB2 GLN 94 HB2 GLN 94 -17.761 6.670 4.277 610 HB3 GLN 94 HB1 GLN 94 -17.700 8.325 3.687 611 HG2 GLN 94 HG2 GLN 94 -19.916 7.967 2.628 612 HG3 GLN 94 HG1 GLN 94 -19.974 6.378 3.388 613 HE21 GLN 94 HE21 GLN 94 -21.773 6.848 4.619 614 HE22 GLN 94 HE22 GLN 94 -21.731 7.945 5.956 615 H THR 95 HN THR 95 -15.912 8.679 1.484 616 HA THR 95 HA THR 95 -17.675 10.328 0.015 617 HB THR 95 HB THR 95 -15.027 10.861 -0.799 618 HG1 THR 95 HG1 THR 95 -13.990 10.869 1.283 619 HG21 THR 95 HG21 THR 95 -16.733 12.534 -0.267 620 HG22 THR 95 HG22 THR 95 -15.270 12.806 0.678 621 HG23 THR 95 HG23 THR 95 -16.677 12.058 1.430 622 H GLY 96 HN GLY 96 -15.955 7.485 -0.813 623 HA2 GLY 96 HA2 GLY 96 -16.161 6.264 -2.783 624 HA3 GLY 96 HA1 GLY 96 -16.929 7.654 -3.535 625 H GLY 97 HN GLY 97 -15.219 9.626 -3.481 626 HA2 GLY 97 HA2 GLY 97 -12.562 9.486 -3.699 627 HA3 GLY 97 HA1 GLY 97 -13.066 8.701 -5.192 628 H1 ASN 357 HT1 ASN 357 -5.337 -20.159 -2.958 629 H2 ASN 357 HT2 ASN 357 -5.117 -19.734 -1.337 630 H3 ASN 357 HT3 ASN 357 -4.223 -21.002 -2.002 631 HA ASN 357 HA ASN 357 -2.870 -19.039 -1.772 632 HB2 ASN 357 HB2 ASN 357 -2.073 -18.893 -4.103 633 HB3 ASN 357 HB1 ASN 357 -2.385 -20.557 -3.633 634 HD21 ASN 357 HD21 ASN 357 -2.306 -19.184 -6.262 635 HD22 ASN 357 HD22 ASN 357 -3.813 -19.577 -7.015 636 H ASN 358 HN ASN 358 -2.595 -16.851 -1.975 637 HA ASN 358 HA ASN 358 -4.285 -15.226 -3.604 638 HB2 ASN 358 HB2 ASN 358 -5.322 -13.954 -1.694 639 HB3 ASN 358 HB1 ASN 358 -5.956 -15.577 -1.930 640 HD21 ASN 358 HD21 ASN 358 -6.724 -15.449 0.223 641 HD22 ASN 358 HD22 ASN 358 -5.661 -15.735 1.556 642 H ARG 359 HN ARG 359 -1.465 -15.628 -3.093 643 HA ARG 359 HA ARG 359 -0.766 -12.922 -2.169 644 HB2 ARG 359 HB2 ARG 359 0.976 -15.385 -1.991 645 HB3 ARG 359 HB1 ARG 359 1.400 -13.776 -1.432 646 HG2 ARG 359 HG2 ARG 359 -0.711 -14.027 0.055 647 HG3 ARG 359 HG1 ARG 359 -0.495 -15.747 -0.256 648 HD2 ARG 359 HD2 ARG 359 0.644 -15.257 1.770 649 HD3 ARG 359 HD1 ARG 359 1.873 -15.501 0.530 650 HE ARG 359 HE ARG 359 1.253 -12.765 0.661 651 HH11 ARG 359 HH11 ARG 359 2.808 -15.296 2.550 652 HH12 ARG 359 HH12 ARG 359 3.881 -14.137 3.434 653 HH21 ARG 359 HH21 ARG 359 2.643 -11.274 1.742 654 HH22 ARG 359 HH22 ARG 359 3.836 -11.913 2.948 655 H ASP 360 HN ASP 360 -0.528 -11.807 -4.018 656 HA ASP 360 HA ASP 360 1.312 -12.939 -6.008 657 HB2 ASP 360 HB2 ASP 360 0.065 -12.155 -7.774 658 HB3 ASP 360 HB1 ASP 360 -1.217 -12.509 -6.627 659 HA PRO 361 HA PRO 361 3.807 -9.478 -4.918 660 HB2 PRO 361 HB2 PRO 361 5.765 -9.801 -6.735 661 HB3 PRO 361 HB1 PRO 361 5.560 -10.904 -5.366 662 HG2 PRO 361 HG2 PRO 361 4.785 -11.278 -8.213 663 HG3 PRO 361 HG1 PRO 361 5.444 -12.455 -7.061 664 HD2 PRO 361 HD2 PRO 361 2.776 -12.247 -7.729 665 HD3 PRO 361 HD1 PRO 361 3.389 -12.968 -6.227 666 H ILE 362 HN ILE 362 3.746 -7.383 -5.382 667 HA ILE 362 HA ILE 362 3.098 -6.583 -8.138 668 HB ILE 362 HB ILE 362 2.530 -4.977 -5.645 669 HG12 ILE 362 HG12 ILE 362 0.632 -6.633 -7.322 670 HG13 ILE 362 HG11 ILE 362 1.127 -6.985 -5.668 671 HG21 ILE 362 HG21 ILE 362 1.197 -3.572 -7.105 672 HG22 ILE 362 HG22 ILE 362 1.580 -4.604 -8.482 673 HG23 ILE 362 HG23 ILE 362 2.854 -3.669 -7.700 674 HD11 ILE 362 HD11 ILE 362 -0.435 -4.572 -6.558 675 HD12 ILE 362 HD12 ILE 362 0.040 -4.950 -4.902 676 HD13 ILE 362 HD13 ILE 362 -1.094 -5.997 -5.756 677 H VAL 363 HN VAL 363 4.481 -5.290 -9.176 678 HA VAL 363 HA VAL 363 6.555 -3.920 -7.602 679 HB VAL 363 HB VAL 363 8.142 -4.325 -9.510 680 HG11 VAL 363 HG11 VAL 363 8.312 -5.603 -7.453 681 HG12 VAL 363 HG12 VAL 363 8.700 -6.621 -8.840 682 HG13 VAL 363 HG13 VAL 363 7.128 -6.765 -8.053 683 HG21 VAL 363 HG21 VAL 363 7.668 -6.228 -11.011 684 HG22 VAL 363 HG22 VAL 363 6.563 -4.878 -11.260 685 HG23 VAL 363 HG23 VAL 363 6.026 -6.300 -10.366 686 H ILE 364 HN ILE 364 7.000 -1.834 -8.226 687 HA ILE 364 HA ILE 364 5.619 -0.847 -10.633 688 HB ILE 364 HB ILE 364 5.018 1.222 -9.499 689 HG12 ILE 364 HG12 ILE 364 5.704 0.066 -6.829 690 HG13 ILE 364 HG11 ILE 364 6.987 0.817 -7.775 691 HG21 ILE 364 HG21 ILE 364 3.303 0.328 -7.942 692 HG22 ILE 364 HG22 ILE 364 4.071 -1.254 -8.060 693 HG23 ILE 364 HG23 ILE 364 3.350 -0.515 -9.489 694 HD11 ILE 364 HD11 ILE 364 5.713 2.898 -7.847 695 HD12 ILE 364 HD12 ILE 364 6.003 2.377 -6.188 696 HD13 ILE 364 HD13 ILE 364 4.418 2.139 -6.921 697 H SER 365 HN SER 365 6.425 1.437 -11.174 698 HA SER 365 HA SER 365 9.349 1.438 -10.931 699 HB2 SER 365 HB2 SER 365 7.602 2.660 -13.083 700 HB3 SER 365 HB1 SER 365 9.365 2.686 -13.053 701 HG SER 365 HG SER 365 9.068 0.264 -12.877 702 H ASP 366 HN ASP 366 10.434 3.439 -10.676 703 HA ASP 366 HA ASP 366 9.168 5.220 -8.845 704 HB2 ASP 366 HB2 ASP 366 11.731 4.518 -9.231 705 HB3 ASP 366 HB1 ASP 366 11.711 6.004 -10.174 706 H SER 367 HN SER 367 8.823 7.482 -9.129 707 HA SER 367 HA SER 367 8.848 8.525 -11.838 708 HB2 SER 367 HB2 SER 367 6.266 8.536 -10.260 709 HB3 SER 367 HB1 SER 367 6.510 9.056 -11.928 710 HG SER 367 HG SER 367 7.344 6.607 -11.899 711 HA PRO 368 HA PRO 368 9.892 11.781 -8.807 712 HB2 PRO 368 HB2 PRO 368 11.774 12.755 -10.766 713 HB3 PRO 368 HB1 PRO 368 12.116 11.994 -9.210 714 HG2 PRO 368 HG2 PRO 368 12.698 10.845 -11.617 715 HG3 PRO 368 HG1 PRO 368 12.412 9.933 -10.122 716 HD2 PRO 368 HD2 PRO 368 10.558 10.440 -12.408 717 HD3 PRO 368 HD1 PRO 368 10.787 8.966 -11.442 Start of MODEL 3 1 H TYR 21 HT1 TYR 21 14.680 -4.795 -0.485 2 HA TYR 21 HA TYR 21 13.049 -3.205 -1.205 3 HB2 TYR 21 HB2 TYR 21 11.994 -5.568 -2.767 4 HB3 TYR 21 HB1 TYR 21 11.022 -4.143 -2.426 5 HD1 TYR 21 HD1 TYR 21 11.728 -1.930 -3.365 6 HD2 TYR 21 HD2 TYR 21 13.574 -5.580 -4.528 7 HE1 TYR 21 HE1 TYR 21 12.633 -0.829 -5.368 8 HE2 TYR 21 HE2 TYR 21 14.487 -4.488 -6.532 9 HH TYR 21 HH TYR 21 13.657 -2.318 -7.977 10 H ILE 22 HN ILE 22 10.731 -3.207 -0.367 11 HA ILE 22 HA ILE 22 10.570 -5.093 1.894 12 HB ILE 22 HB ILE 22 9.382 -2.321 1.663 13 HG12 ILE 22 HG12 ILE 22 11.830 -2.301 1.959 14 HG13 ILE 22 HG11 ILE 22 11.001 -1.680 3.380 15 HG21 ILE 22 HG21 ILE 22 7.975 -3.785 2.996 16 HG22 ILE 22 HG22 ILE 22 8.771 -2.592 4.021 17 HG23 ILE 22 HG23 ILE 22 9.361 -4.253 3.979 18 HD11 ILE 22 HD11 ILE 22 12.797 -3.066 4.098 19 HD12 ILE 22 HD12 ILE 22 12.274 -4.382 3.052 20 HD13 ILE 22 HD13 ILE 22 11.289 -3.915 4.436 21 H LYS 23 HN LYS 23 8.951 -6.516 1.863 22 HA LYS 23 HA LYS 23 6.807 -6.113 -0.099 23 HB2 LYS 23 HB2 LYS 23 8.221 -8.221 -0.036 24 HB3 LYS 23 HB1 LYS 23 7.401 -8.619 1.465 25 HG2 LYS 23 HG2 LYS 23 5.235 -8.412 0.159 26 HG3 LYS 23 HG1 LYS 23 6.242 -8.396 -1.290 27 HD2 LYS 23 HD2 LYS 23 5.657 -10.646 -1.030 28 HD3 LYS 23 HD1 LYS 23 7.287 -10.544 -0.358 29 HE2 LYS 23 HE2 LYS 23 5.167 -10.029 1.592 30 HE3 LYS 23 HE1 LYS 23 5.109 -11.646 0.891 31 HZ1 LYS 23 HZ1 LYS 23 6.452 -11.625 2.874 32 HZ2 LYS 23 HZ2 LYS 23 7.455 -10.402 2.242 33 HZ3 LYS 23 HZ3 LYS 23 7.436 -11.938 1.528 34 H LEU 24 HN LEU 24 5.076 -5.126 0.673 35 HA LEU 24 HA LEU 24 4.256 -5.574 3.452 36 HB2 LEU 24 HB2 LEU 24 3.269 -3.563 1.424 37 HB3 LEU 24 HB1 LEU 24 2.758 -3.650 3.098 38 HG LEU 24 HG LEU 24 5.576 -3.055 2.203 39 HD11 LEU 24 HD11 LEU 24 4.048 -1.281 1.536 40 HD12 LEU 24 HD12 LEU 24 5.103 -0.748 2.844 41 HD13 LEU 24 HD13 LEU 24 3.427 -1.181 3.184 42 HD21 LEU 24 HD21 LEU 24 5.503 -4.062 4.401 43 HD22 LEU 24 HD22 LEU 24 4.254 -2.930 4.915 44 HD23 LEU 24 HD23 LEU 24 5.879 -2.347 4.548 45 H LYS 25 HN LYS 25 2.477 -6.708 3.957 46 HA LYS 25 HA LYS 25 1.038 -7.984 1.773 47 HB2 LYS 25 HB2 LYS 25 0.815 -8.454 4.752 48 HB3 LYS 25 HB1 LYS 25 0.148 -9.472 3.481 49 HG2 LYS 25 HG2 LYS 25 2.227 -10.283 2.857 50 HG3 LYS 25 HG1 LYS 25 3.087 -8.933 3.598 51 HD2 LYS 25 HD2 LYS 25 3.506 -10.510 5.179 52 HD3 LYS 25 HD1 LYS 25 1.951 -9.944 5.786 53 HE2 LYS 25 HE2 LYS 25 0.806 -11.782 4.821 54 HE3 LYS 25 HE1 LYS 25 2.221 -12.251 3.879 55 HZ1 LYS 25 HZ1 LYS 25 1.909 -13.671 5.816 56 HZ2 LYS 25 HZ2 LYS 25 2.033 -12.335 6.841 57 HZ3 LYS 25 HZ3 LYS 25 3.368 -12.819 5.917 58 H VAL 26 HN VAL 26 -0.525 -6.784 0.943 59 HA VAL 26 HA VAL 26 -2.108 -4.993 2.592 60 HB VAL 26 HB VAL 26 -2.640 -5.544 -0.311 61 HG11 VAL 26 HG11 VAL 26 -3.402 -3.233 -0.309 62 HG12 VAL 26 HG12 VAL 26 -2.934 -3.069 1.382 63 HG13 VAL 26 HG13 VAL 26 -4.236 -4.170 0.932 64 HG21 VAL 26 HG21 VAL 26 -0.547 -3.664 0.775 65 HG22 VAL 26 HG22 VAL 26 -1.054 -3.781 -0.910 66 HG23 VAL 26 HG23 VAL 26 -0.238 -5.141 -0.139 67 H ILE 27 HN ILE 27 -3.775 -5.726 3.671 68 HA ILE 27 HA ILE 27 -5.183 -8.119 2.746 69 HB ILE 27 HB ILE 27 -5.605 -6.640 5.345 70 HG12 ILE 27 HG12 ILE 27 -3.265 -7.334 5.193 71 HG13 ILE 27 HG11 ILE 27 -4.123 -8.299 6.389 72 HG21 ILE 27 HG21 ILE 27 -6.542 -8.767 6.106 73 HG22 ILE 27 HG22 ILE 27 -6.266 -9.458 4.508 74 HG23 ILE 27 HG23 ILE 27 -7.413 -8.134 4.708 75 HD11 ILE 27 HD11 ILE 27 -4.318 -10.112 4.741 76 HD12 ILE 27 HD12 ILE 27 -2.644 -9.693 5.101 77 HD13 ILE 27 HD13 ILE 27 -3.386 -9.144 3.597 78 H GLY 28 HN GLY 28 -6.829 -7.771 1.415 79 HA2 GLY 28 HA2 GLY 28 -8.284 -5.254 1.484 80 HA3 GLY 28 HA1 GLY 28 -8.462 -6.529 0.288 81 H GLN 29 HN GLN 29 -10.700 -5.374 1.191 82 HA GLN 29 HA GLN 29 -11.886 -6.477 3.482 83 HB2 GLN 29 HB2 GLN 29 -12.735 -4.496 2.249 84 HB3 GLN 29 HB1 GLN 29 -13.258 -5.556 0.950 85 HG2 GLN 29 HG2 GLN 29 -15.137 -4.979 2.332 86 HG3 GLN 29 HG1 GLN 29 -14.775 -6.695 2.514 87 HE21 GLN 29 HE21 GLN 29 -13.977 -7.451 4.466 88 HE22 GLN 29 HE22 GLN 29 -14.018 -6.502 5.913 89 H ASP 30 HN ASP 30 -11.418 -7.760 0.298 90 HA ASP 30 HA ASP 30 -13.332 -9.905 0.673 91 HB2 ASP 30 HB2 ASP 30 -12.775 -10.586 -1.562 92 HB3 ASP 30 HB1 ASP 30 -12.944 -8.834 -1.558 93 H SER 31 HN SER 31 -10.718 -9.440 2.239 94 HA SER 31 HA SER 31 -9.196 -10.697 3.334 95 HB2 SER 31 HB2 SER 31 -10.617 -13.129 2.226 96 HB3 SER 31 HB1 SER 31 -9.650 -13.025 3.699 97 HG SER 31 HG SER 31 -12.165 -11.813 3.188 98 H SER 32 HN SER 32 -8.289 -9.675 1.059 99 HA SER 32 HA SER 32 -6.917 -11.797 -0.409 100 HB2 SER 32 HB2 SER 32 -6.125 -9.561 -1.661 101 HB3 SER 32 HB1 SER 32 -7.670 -10.337 -2.013 102 HG SER 32 HG SER 32 -8.693 -8.699 -1.164 103 H GLU 33 HN GLU 33 -4.571 -11.601 -0.765 104 HA GLU 33 HA GLU 33 -3.208 -10.047 1.331 105 HB2 GLU 33 HB2 GLU 33 -3.422 -12.602 1.724 106 HB3 GLU 33 HB1 GLU 33 -2.213 -12.744 0.454 107 HG2 GLU 33 HG2 GLU 33 -0.815 -11.127 1.838 108 HG3 GLU 33 HG1 GLU 33 -1.953 -11.450 3.146 109 H ILE 34 HN ILE 34 -3.110 -8.577 -0.563 110 HA ILE 34 HA ILE 34 -1.520 -9.291 -2.828 111 HB ILE 34 HB ILE 34 -2.151 -6.496 -1.885 112 HG12 ILE 34 HG12 ILE 34 -4.232 -7.804 -2.013 113 HG13 ILE 34 HG11 ILE 34 -4.161 -6.593 -3.286 114 HG21 ILE 34 HG21 ILE 34 -0.535 -6.451 -3.603 115 HG22 ILE 34 HG22 ILE 34 -2.075 -6.070 -4.373 116 HG23 ILE 34 HG23 ILE 34 -1.383 -7.683 -4.532 117 HD11 ILE 34 HD11 ILE 34 -5.056 -8.699 -4.100 118 HD12 ILE 34 HD12 ILE 34 -3.578 -9.530 -3.617 119 HD13 ILE 34 HD13 ILE 34 -3.530 -8.312 -4.893 120 H HIS 35 HN HIS 35 0.623 -9.128 -3.120 121 HA HIS 35 HA HIS 35 2.207 -8.265 -0.821 122 HB2 HIS 35 HB2 HIS 35 2.811 -10.016 -3.193 123 HB3 HIS 35 HB1 HIS 35 4.086 -9.395 -2.151 124 HD2 HIS 35 HD2 HIS 35 1.395 -10.098 0.247 125 HE1 HIS 35 HE1 HIS 35 3.357 -13.811 -0.272 126 HE2 HIS 35 HE2 HIS 35 1.571 -12.564 1.036 127 H PHE 36 HN PHE 36 2.329 -6.102 -0.985 128 HA PHE 36 HA PHE 36 2.990 -4.821 -3.497 129 HB2 PHE 36 HB2 PHE 36 1.527 -4.010 -1.376 130 HB3 PHE 36 HB1 PHE 36 3.075 -3.284 -0.960 131 HD1 PHE 36 HD1 PHE 36 3.618 -3.080 -4.163 132 HD2 PHE 36 HD2 PHE 36 0.664 -1.684 -1.437 133 HE1 PHE 36 HE1 PHE 36 3.120 -1.200 -5.670 134 HE2 PHE 36 HE2 PHE 36 0.164 0.198 -2.937 135 HZ PHE 36 HZ PHE 36 1.393 0.437 -5.058 136 H LYS 37 HN LYS 37 5.025 -4.696 -4.190 137 HA LYS 37 HA LYS 37 7.203 -4.925 -2.245 138 HB2 LYS 37 HB2 LYS 37 7.005 -6.260 -4.466 139 HB3 LYS 37 HB1 LYS 37 7.539 -4.769 -5.228 140 HG2 LYS 37 HG2 LYS 37 9.605 -4.813 -4.033 141 HG3 LYS 37 HG1 LYS 37 9.064 -6.172 -3.047 142 HD2 LYS 37 HD2 LYS 37 9.430 -6.258 -6.042 143 HD3 LYS 37 HD1 LYS 37 10.618 -6.829 -4.869 144 HE2 LYS 37 HE2 LYS 37 8.736 -8.319 -3.973 145 HE3 LYS 37 HE1 LYS 37 7.887 -7.935 -5.469 146 HZ1 LYS 37 HZ1 LYS 37 9.718 -8.857 -6.725 147 HZ2 LYS 37 HZ2 LYS 37 9.141 -10.005 -5.627 148 HZ3 LYS 37 HZ3 LYS 37 10.580 -9.176 -5.303 149 H VAL 38 HN VAL 38 7.458 -2.963 -1.307 150 HA VAL 38 HA VAL 38 7.540 -0.578 -3.004 151 HB VAL 38 HB VAL 38 7.350 0.735 -1.002 152 HG11 VAL 38 HG11 VAL 38 5.491 -1.629 -0.779 153 HG12 VAL 38 HG12 VAL 38 5.290 -0.277 -1.896 154 HG13 VAL 38 HG13 VAL 38 5.208 -0.004 -0.155 155 HG21 VAL 38 HG21 VAL 38 7.630 -1.845 0.538 156 HG22 VAL 38 HG22 VAL 38 7.267 -0.265 1.231 157 HG23 VAL 38 HG23 VAL 38 8.824 -0.547 0.453 158 H LYS 39 HN LYS 39 9.212 1.041 -2.586 159 HA LYS 39 HA LYS 39 11.811 -0.236 -2.091 160 HB2 LYS 39 HB2 LYS 39 11.426 0.682 -4.385 161 HB3 LYS 39 HB1 LYS 39 11.238 2.278 -3.670 162 HG2 LYS 39 HG2 LYS 39 13.526 2.150 -2.804 163 HG3 LYS 39 HG1 LYS 39 13.713 0.569 -3.562 164 HD2 LYS 39 HD2 LYS 39 13.425 1.535 -5.753 165 HD3 LYS 39 HD1 LYS 39 13.073 3.115 -5.044 166 HE2 LYS 39 HE2 LYS 39 15.324 3.204 -4.108 167 HE3 LYS 39 HE1 LYS 39 15.677 1.614 -4.781 168 HZ1 LYS 39 HZ1 LYS 39 16.550 3.459 -6.120 169 HZ2 LYS 39 HZ2 LYS 39 14.969 4.010 -6.396 170 HZ3 LYS 39 HZ3 LYS 39 15.459 2.494 -6.982 171 H MET 40 HN MET 40 13.222 0.642 -0.658 172 HA MET 40 HA MET 40 12.118 2.465 1.284 173 HB2 MET 40 HB2 MET 40 13.410 0.520 2.019 174 HB3 MET 40 HB1 MET 40 14.821 1.115 1.155 175 HG2 MET 40 HG2 MET 40 15.027 1.551 3.520 176 HG3 MET 40 HG1 MET 40 14.903 3.063 2.625 177 HE1 MET 40 HE1 MET 40 13.443 0.723 5.261 178 HE2 MET 40 HE2 MET 40 12.240 0.419 4.008 179 HE3 MET 40 HE3 MET 40 11.780 1.272 5.481 180 H THR 41 HN THR 41 11.946 4.261 -0.230 181 HA THR 41 HA THR 41 13.695 6.298 0.266 182 HB THR 41 HB THR 41 15.216 4.769 -1.233 183 HG1 THR 41 HG1 THR 41 15.097 7.511 -1.948 184 HG21 THR 41 HG21 THR 41 13.660 4.559 -3.118 185 HG22 THR 41 HG22 THR 41 15.150 5.362 -3.608 186 HG23 THR 41 HG23 THR 41 13.686 6.307 -3.340 187 H THR 42 HN THR 42 11.400 4.840 -1.897 188 HA THR 42 HA THR 42 10.611 7.391 -3.032 189 HB THR 42 HB THR 42 9.083 4.839 -3.423 190 HG1 THR 42 HG1 THR 42 11.332 5.447 -5.039 191 HG21 THR 42 HG21 THR 42 8.259 6.921 -4.441 192 HG22 THR 42 HG22 THR 42 8.755 5.754 -5.667 193 HG23 THR 42 HG23 THR 42 9.800 7.119 -5.275 194 H HIS 43 HN HIS 43 8.710 8.450 -2.606 195 HA HIS 43 HA HIS 43 7.577 8.192 -0.037 196 HB2 HIS 43 HB2 HIS 43 6.880 9.772 -2.492 197 HB3 HIS 43 HB1 HIS 43 5.754 9.720 -1.141 198 HD2 HIS 43 HD2 HIS 43 6.845 10.782 1.312 199 HE1 HIS 43 HE1 HIS 43 9.724 13.074 -0.774 200 HE2 HIS 43 HE2 HIS 43 8.412 12.846 1.380 201 H LEU 44 HN LEU 44 5.625 7.360 0.640 202 HA LEU 44 HA LEU 44 4.672 5.074 -0.721 203 HB2 LEU 44 HB2 LEU 44 3.631 6.630 1.629 204 HB3 LEU 44 HB1 LEU 44 2.799 5.216 1.009 205 HG LEU 44 HG LEU 44 5.656 5.207 1.995 206 HD11 LEU 44 HD11 LEU 44 3.144 4.280 3.378 207 HD12 LEU 44 HD12 LEU 44 4.111 5.685 3.823 208 HD13 LEU 44 HD13 LEU 44 4.791 4.065 3.968 209 HD21 LEU 44 HD21 LEU 44 5.198 2.719 2.051 210 HD22 LEU 44 HD22 LEU 44 5.360 3.443 0.452 211 HD23 LEU 44 HD23 LEU 44 3.761 3.056 1.085 212 H LYS 45 HN LYS 45 4.059 8.316 -1.193 213 HA LYS 45 HA LYS 45 1.382 8.439 -1.946 214 HB2 LYS 45 HB2 LYS 45 2.452 10.501 -1.793 215 HB3 LYS 45 HB1 LYS 45 3.857 9.952 -2.691 216 HG2 LYS 45 HG2 LYS 45 2.700 11.515 -4.044 217 HG3 LYS 45 HG1 LYS 45 2.431 9.919 -4.744 218 HD2 LYS 45 HD2 LYS 45 0.217 9.840 -3.982 219 HD3 LYS 45 HD1 LYS 45 0.476 11.143 -2.823 220 HE2 LYS 45 HE2 LYS 45 0.705 12.742 -4.623 221 HE3 LYS 45 HE1 LYS 45 0.548 11.458 -5.818 222 HZ1 LYS 45 HZ1 LYS 45 -1.685 11.192 -5.362 223 HZ2 LYS 45 HZ2 LYS 45 -1.495 12.867 -5.227 224 HZ3 LYS 45 HZ3 LYS 45 -1.581 11.915 -3.829 225 H LYS 46 HN LYS 46 4.267 7.680 -3.876 226 HA LYS 46 HA LYS 46 2.873 7.283 -6.310 227 HB2 LYS 46 HB2 LYS 46 5.367 7.739 -5.999 228 HB3 LYS 46 HB1 LYS 46 5.524 6.036 -5.591 229 HG2 LYS 46 HG2 LYS 46 6.087 6.305 -7.888 230 HG3 LYS 46 HG1 LYS 46 4.529 5.482 -7.806 231 HD2 LYS 46 HD2 LYS 46 3.505 7.826 -8.042 232 HD3 LYS 46 HD1 LYS 46 5.113 8.329 -8.556 233 HE2 LYS 46 HE2 LYS 46 5.064 6.893 -10.429 234 HE3 LYS 46 HE1 LYS 46 3.646 6.037 -9.827 235 HZ1 LYS 46 HZ1 LYS 46 3.739 8.839 -10.794 236 HZ2 LYS 46 HZ2 LYS 46 2.377 8.110 -10.100 237 HZ3 LYS 46 HZ3 LYS 46 3.001 7.528 -11.566 238 H LEU 47 HN LEU 47 3.574 5.259 -3.580 239 HA LEU 47 HA LEU 47 3.031 2.776 -4.888 240 HB2 LEU 47 HB2 LEU 47 3.308 3.628 -2.022 241 HB3 LEU 47 HB1 LEU 47 2.719 2.026 -2.415 242 HG LEU 47 HG LEU 47 5.042 1.829 -1.957 243 HD11 LEU 47 HD11 LEU 47 5.872 0.836 -3.938 244 HD12 LEU 47 HD12 LEU 47 4.859 1.855 -4.957 245 HD13 LEU 47 HD13 LEU 47 4.123 0.608 -3.950 246 HD21 LEU 47 HD21 LEU 47 5.754 4.107 -2.173 247 HD22 LEU 47 HD22 LEU 47 5.453 4.082 -3.909 248 HD23 LEU 47 HD23 LEU 47 6.748 3.099 -3.225 249 H LYS 48 HN LYS 48 1.208 4.973 -2.808 250 HA LYS 48 HA LYS 48 -1.135 3.497 -2.543 251 HB2 LYS 48 HB2 LYS 48 -0.634 6.465 -2.570 252 HB3 LYS 48 HB1 LYS 48 -2.224 5.783 -2.262 253 HG2 LYS 48 HG2 LYS 48 -1.419 4.656 -0.298 254 HG3 LYS 48 HG1 LYS 48 0.238 5.155 -0.643 255 HD2 LYS 48 HD2 LYS 48 -0.605 6.603 1.053 256 HD3 LYS 48 HD1 LYS 48 -0.539 7.535 -0.442 257 HE2 LYS 48 HE2 LYS 48 -2.958 7.064 -0.774 258 HE3 LYS 48 HE1 LYS 48 -2.979 6.271 0.800 259 HZ1 LYS 48 HZ1 LYS 48 -2.352 8.342 1.836 260 HZ2 LYS 48 HZ2 LYS 48 -3.746 8.572 0.909 261 HZ3 LYS 48 HZ3 LYS 48 -2.248 9.114 0.325 262 H GLU 49 HN GLU 49 -0.319 5.931 -5.021 263 HA GLU 49 HA GLU 49 -2.791 5.684 -6.376 264 HB2 GLU 49 HB2 GLU 49 -1.584 6.832 -8.270 265 HB3 GLU 49 HB1 GLU 49 -1.592 7.685 -6.734 266 HG2 GLU 49 HG2 GLU 49 0.691 6.854 -6.304 267 HG3 GLU 49 HG1 GLU 49 0.685 6.102 -7.900 268 H SER 50 HN SER 50 0.291 4.010 -6.734 269 HA SER 50 HA SER 50 -0.248 2.770 -9.204 270 HB2 SER 50 HB2 SER 50 1.511 1.871 -6.914 271 HB3 SER 50 HB1 SER 50 1.498 1.127 -8.515 272 HG SER 50 HG SER 50 2.353 3.705 -7.748 273 H TYR 51 HN TYR 51 -0.964 1.782 -5.881 274 HA TYR 51 HA TYR 51 -1.963 -0.783 -6.501 275 HB2 TYR 51 HB2 TYR 51 -1.377 0.029 -4.201 276 HB3 TYR 51 HB1 TYR 51 -2.840 1.005 -4.221 277 HD1 TYR 51 HD1 TYR 51 -1.615 -2.495 -4.404 278 HD2 TYR 51 HD2 TYR 51 -4.909 0.069 -3.594 279 HE1 TYR 51 HE1 TYR 51 -2.890 -4.412 -3.542 280 HE2 TYR 51 HE2 TYR 51 -6.191 -1.841 -2.730 281 HH TYR 51 HH TYR 51 -4.750 -4.893 -2.106 282 H CYS 52 HN CYS 52 -3.445 2.409 -6.388 283 HA CYS 52 HA CYS 52 -6.120 1.602 -6.732 284 HB2 CYS 52 HB2 CYS 52 -4.822 4.178 -7.652 285 HB3 CYS 52 HB1 CYS 52 -6.542 3.918 -7.382 286 HG CYS 52 HG CYS 52 -4.134 3.848 -4.944 287 H GLN 53 HN GLN 53 -3.623 2.571 -9.068 288 HA GLN 53 HA GLN 53 -5.147 2.332 -11.405 289 HB2 GLN 53 HB2 GLN 53 -2.192 1.770 -11.077 290 HB3 GLN 53 HB1 GLN 53 -3.013 2.136 -12.587 291 HG2 GLN 53 HG2 GLN 53 -3.397 4.375 -11.950 292 HG3 GLN 53 HG1 GLN 53 -2.962 4.050 -10.272 293 HE21 GLN 53 HE21 GLN 53 -1.881 6.033 -12.094 294 HE22 GLN 53 HE22 GLN 53 -0.185 5.721 -12.201 295 H ARG 54 HN ARG 54 -3.225 -0.016 -9.636 296 HA ARG 54 HA ARG 54 -3.427 -2.170 -11.428 297 HB2 ARG 54 HB2 ARG 54 -1.862 -1.907 -9.448 298 HB3 ARG 54 HB1 ARG 54 -3.209 -2.382 -8.428 299 HG2 ARG 54 HG2 ARG 54 -2.446 -4.454 -8.689 300 HG3 ARG 54 HG1 ARG 54 -3.168 -4.376 -10.298 301 HD2 ARG 54 HD2 ARG 54 -1.136 -3.916 -11.322 302 HD3 ARG 54 HD1 ARG 54 -0.398 -3.353 -9.825 303 HE ARG 54 HE ARG 54 -0.995 -6.040 -9.454 304 HH11 ARG 54 HH11 ARG 54 1.019 -4.078 -11.567 305 HH12 ARG 54 HH12 ARG 54 2.276 -5.360 -11.742 306 HH21 ARG 54 HH21 ARG 54 0.552 -7.679 -9.639 307 HH22 ARG 54 HH22 ARG 54 2.004 -7.393 -10.688 308 H GLN 55 HN GLN 55 -5.475 -1.179 -8.716 309 HA GLN 55 HA GLN 55 -7.194 -3.478 -9.009 310 HB2 GLN 55 HB2 GLN 55 -7.361 -1.023 -7.271 311 HB3 GLN 55 HB1 GLN 55 -8.568 -2.304 -7.255 312 HG2 GLN 55 HG2 GLN 55 -5.661 -2.522 -6.510 313 HG3 GLN 55 HG1 GLN 55 -7.058 -2.666 -5.443 314 HE21 GLN 55 HE21 GLN 55 -8.270 -4.554 -5.465 315 HE22 GLN 55 HE22 GLN 55 -7.712 -6.008 -6.209 316 H GLY 56 HN GLY 56 -6.918 -0.590 -10.641 317 HA2 GLY 56 HA2 GLY 56 -8.209 0.220 -12.377 318 HA3 GLY 56 HA1 GLY 56 -9.375 -1.051 -12.049 319 H VAL 57 HN VAL 57 -8.297 1.214 -9.610 320 HA VAL 57 HA VAL 57 -10.897 2.581 -9.785 321 HB VAL 57 HB VAL 57 -10.819 2.746 -7.247 322 HG11 VAL 57 HG11 VAL 57 -11.807 0.515 -6.916 323 HG12 VAL 57 HG12 VAL 57 -11.206 0.031 -8.503 324 HG13 VAL 57 HG13 VAL 57 -12.413 1.311 -8.369 325 HG21 VAL 57 HG21 VAL 57 -8.835 0.499 -7.576 326 HG22 VAL 57 HG22 VAL 57 -9.560 1.017 -6.054 327 HG23 VAL 57 HG23 VAL 57 -8.488 2.106 -6.936 328 HA PRO 58 HA PRO 58 -8.531 6.308 -9.705 329 HB2 PRO 58 HB2 PRO 58 -10.286 7.953 -8.388 330 HB3 PRO 58 HB1 PRO 58 -10.440 7.518 -10.095 331 HG2 PRO 58 HG2 PRO 58 -11.852 6.368 -7.733 332 HG3 PRO 58 HG1 PRO 58 -12.486 6.758 -9.345 333 HD2 PRO 58 HD2 PRO 58 -11.895 4.238 -8.643 334 HD3 PRO 58 HD1 PRO 58 -11.641 4.835 -10.295 335 H MET 59 HN MET 59 -7.379 7.700 -8.242 336 HA MET 59 HA MET 59 -6.686 6.401 -5.808 337 HB2 MET 59 HB2 MET 59 -5.202 7.907 -7.292 338 HB3 MET 59 HB1 MET 59 -5.966 9.252 -6.456 339 HG2 MET 59 HG2 MET 59 -5.248 8.080 -4.303 340 HG3 MET 59 HG1 MET 59 -4.198 7.110 -5.333 341 HE1 MET 59 HE1 MET 59 -1.890 7.918 -4.163 342 HE2 MET 59 HE2 MET 59 -3.058 8.547 -3.001 343 HE3 MET 59 HE3 MET 59 -1.741 9.572 -3.571 344 H ASN 60 HN ASN 60 -6.872 7.228 -3.687 345 HA ASN 60 HA ASN 60 -7.821 8.250 -1.901 346 HB2 ASN 60 HB2 ASN 60 -8.965 10.079 -4.005 347 HB3 ASN 60 HB1 ASN 60 -9.407 10.223 -2.307 348 HD21 ASN 60 HD21 ASN 60 -8.490 12.189 -1.960 349 HD22 ASN 60 HD22 ASN 60 -6.783 12.466 -1.990 350 H SER 61 HN SER 61 -9.221 6.274 -3.956 351 HA SER 61 HA SER 61 -11.927 6.431 -2.885 352 HB2 SER 61 HB2 SER 61 -12.417 4.570 -4.425 353 HB3 SER 61 HB1 SER 61 -11.641 5.904 -5.278 354 HG SER 61 HG SER 61 -9.955 4.687 -5.671 355 H LEU 62 HN LEU 62 -8.974 4.718 -2.514 356 HA LEU 62 HA LEU 62 -10.195 2.962 -0.502 357 HB2 LEU 62 HB2 LEU 62 -7.789 2.450 -2.256 358 HB3 LEU 62 HB1 LEU 62 -8.314 1.401 -0.955 359 HG LEU 62 HG LEU 62 -9.915 2.015 -3.440 360 HD11 LEU 62 HD11 LEU 62 -9.421 -0.311 -4.052 361 HD12 LEU 62 HD12 LEU 62 -8.352 -0.440 -2.654 362 HD13 LEU 62 HD13 LEU 62 -7.963 0.679 -3.961 363 HD21 LEU 62 HD21 LEU 62 -11.428 1.534 -1.684 364 HD22 LEU 62 HD22 LEU 62 -10.417 0.227 -1.072 365 HD23 LEU 62 HD23 LEU 62 -11.259 0.045 -2.611 366 H ARG 63 HN ARG 63 -9.361 3.043 1.505 367 HA ARG 63 HA ARG 63 -7.093 4.862 1.919 368 HB2 ARG 63 HB2 ARG 63 -7.888 5.005 4.275 369 HB3 ARG 63 HB1 ARG 63 -9.044 5.611 3.099 370 HG2 ARG 63 HG2 ARG 63 -10.335 3.561 3.279 371 HG3 ARG 63 HG1 ARG 63 -9.152 2.901 4.412 372 HD2 ARG 63 HD2 ARG 63 -9.648 4.661 5.998 373 HD3 ARG 63 HD1 ARG 63 -10.761 5.411 4.856 374 HE ARG 63 HE ARG 63 -11.198 2.774 6.105 375 HH11 ARG 63 HH11 ARG 63 -14.106 5.454 5.228 376 HH12 ARG 63 HH12 ARG 63 -12.401 5.794 4.720 377 HH21 ARG 63 HH21 ARG 63 -13.353 2.311 6.705 378 HH22 ARG 63 HH22 ARG 63 -14.638 3.513 6.308 379 H PHE 64 HN PHE 64 -5.246 4.132 2.653 380 HA PHE 64 HA PHE 64 -4.992 1.299 3.278 381 HB2 PHE 64 HB2 PHE 64 -2.863 3.418 2.880 382 HB3 PHE 64 HB1 PHE 64 -2.573 1.695 3.071 383 HD1 PHE 64 HD1 PHE 64 -3.968 4.271 0.844 384 HD2 PHE 64 HD2 PHE 64 -2.826 0.190 1.254 385 HE1 PHE 64 HE1 PHE 64 -4.174 3.974 -1.587 386 HE2 PHE 64 HE2 PHE 64 -3.030 -0.112 -1.179 387 HZ PHE 64 HZ PHE 64 -3.705 1.781 -2.599 388 H LEU 65 HN LEU 65 -4.967 0.626 5.314 389 HA LEU 65 HA LEU 65 -4.366 2.602 7.403 390 HB2 LEU 65 HB2 LEU 65 -6.045 0.105 7.487 391 HB3 LEU 65 HB1 LEU 65 -5.624 1.040 8.907 392 HG LEU 65 HG LEU 65 -7.261 2.024 6.564 393 HD11 LEU 65 HD11 LEU 65 -9.079 2.093 8.227 394 HD12 LEU 65 HD12 LEU 65 -8.015 1.304 9.391 395 HD13 LEU 65 HD13 LEU 65 -8.494 0.458 7.919 396 HD21 LEU 65 HD21 LEU 65 -6.421 3.388 9.118 397 HD22 LEU 65 HD22 LEU 65 -7.673 3.991 8.032 398 HD23 LEU 65 HD23 LEU 65 -6.007 3.858 7.469 399 H PHE 66 HN PHE 66 -2.671 2.395 8.583 400 HA PHE 66 HA PHE 66 -1.385 -0.231 8.886 401 HB2 PHE 66 HB2 PHE 66 -0.118 1.112 7.235 402 HB3 PHE 66 HB1 PHE 66 0.037 2.405 8.418 403 HD1 PHE 66 HD1 PHE 66 0.717 -1.263 8.157 404 HD2 PHE 66 HD2 PHE 66 2.015 2.546 9.552 405 HE1 PHE 66 HE1 PHE 66 2.794 -2.281 8.991 406 HE2 PHE 66 HE2 PHE 66 4.094 1.533 10.390 407 HZ PHE 66 HZ PHE 66 4.490 -0.884 10.111 408 H GLU 67 HN GLU 67 -1.471 -0.741 10.951 409 HA GLU 67 HA GLU 67 -1.438 -0.642 13.214 410 HB2 GLU 67 HB2 GLU 67 0.060 1.939 12.721 411 HB3 GLU 67 HB1 GLU 67 -0.098 1.158 14.289 412 HG2 GLU 67 HG2 GLU 67 1.258 0.008 11.858 413 HG3 GLU 67 HG1 GLU 67 2.054 0.672 13.285 414 H GLY 68 HN GLY 68 -3.642 0.503 11.686 415 HA2 GLY 68 HA2 GLY 68 -5.717 1.259 12.472 416 HA3 GLY 68 HA1 GLY 68 -4.914 1.927 13.884 417 H GLN 69 HN GLN 69 -2.934 3.130 11.810 418 HA GLN 69 HA GLN 69 -4.472 5.597 11.465 419 HB2 GLN 69 HB2 GLN 69 -1.524 5.191 10.984 420 HB3 GLN 69 HB1 GLN 69 -2.375 6.712 11.218 421 HG2 GLN 69 HG2 GLN 69 -2.202 4.594 13.341 422 HG3 GLN 69 HG1 GLN 69 -1.007 5.877 13.161 423 HE21 GLN 69 HE21 GLN 69 -1.457 6.747 15.150 424 HE22 GLN 69 HE22 GLN 69 -2.912 7.622 15.482 425 H ARG 70 HN ARG 70 -4.074 6.837 9.404 426 HA ARG 70 HA ARG 70 -4.146 4.946 7.158 427 HB2 ARG 70 HB2 ARG 70 -5.273 6.815 5.911 428 HB3 ARG 70 HB1 ARG 70 -6.187 6.162 7.260 429 HG2 ARG 70 HG2 ARG 70 -5.363 8.083 8.638 430 HG3 ARG 70 HG1 ARG 70 -4.679 8.762 7.160 431 HD2 ARG 70 HD2 ARG 70 -7.580 8.016 7.443 432 HD3 ARG 70 HD1 ARG 70 -6.961 9.620 7.822 433 HE ARG 70 HE ARG 70 -6.161 9.622 5.425 434 HH11 ARG 70 HH11 ARG 70 -8.971 7.765 6.470 435 HH12 ARG 70 HH12 ARG 70 -9.783 7.897 4.861 436 HH21 ARG 70 HH21 ARG 70 -7.178 9.801 3.379 437 HH22 ARG 70 HH22 ARG 70 -8.790 9.002 3.144 438 H ILE 71 HN ILE 71 -2.741 5.048 5.545 439 HA ILE 71 HA ILE 71 -0.341 6.525 5.868 440 HB ILE 71 HB ILE 71 -1.339 5.005 3.454 441 HG12 ILE 71 HG12 ILE 71 -1.137 3.603 5.468 442 HG13 ILE 71 HG11 ILE 71 0.072 3.175 4.263 443 HG21 ILE 71 HG21 ILE 71 0.945 4.973 2.683 444 HG22 ILE 71 HG22 ILE 71 1.475 5.854 4.116 445 HG23 ILE 71 HG23 ILE 71 0.435 6.645 2.931 446 HD11 ILE 71 HD11 ILE 71 1.724 4.524 5.525 447 HD12 ILE 71 HD12 ILE 71 1.084 3.148 6.423 448 HD13 ILE 71 HD13 ILE 71 0.499 4.775 6.771 449 H ALA 72 HN ALA 72 0.102 8.523 5.296 450 HA ALA 72 HA ALA 72 -1.801 10.056 3.741 451 HB1 ALA 72 HB1 ALA 72 -0.450 11.983 4.356 452 HB2 ALA 72 HB2 ALA 72 0.781 10.920 5.035 453 HB3 ALA 72 HB3 ALA 72 -0.817 11.003 5.776 454 H ASP 73 HN ASP 73 -0.934 11.594 2.090 455 HA ASP 73 HA ASP 73 0.456 10.110 0.057 456 HB2 ASP 73 HB2 ASP 73 -1.003 12.697 0.215 457 HB3 ASP 73 HB1 ASP 73 0.186 12.521 -1.072 458 H ASN 74 HN ASN 74 1.658 11.529 2.626 459 HA ASN 74 HA ASN 74 4.087 12.414 1.229 460 HB2 ASN 74 HB2 ASN 74 4.394 14.124 3.014 461 HB3 ASN 74 HB1 ASN 74 2.970 14.408 2.020 462 HD21 ASN 74 HD21 ASN 74 4.160 13.567 5.147 463 HD22 ASN 74 HD22 ASN 74 2.654 13.690 5.987 464 H HIS 75 HN HIS 75 3.077 9.929 2.723 465 HA HIS 75 HA HIS 75 4.975 9.793 4.932 466 HB2 HIS 75 HB2 HIS 75 2.687 8.106 4.005 467 HB3 HIS 75 HB1 HIS 75 3.941 7.360 4.989 468 HD2 HIS 75 HD2 HIS 75 4.102 10.360 6.787 469 HE1 HIS 75 HE1 HIS 75 0.414 8.759 8.111 470 HE2 HIS 75 HE2 HIS 75 2.345 10.281 8.703 471 H THR 76 HN THR 76 6.403 7.956 5.142 472 HA THR 76 HA THR 76 7.240 6.702 2.626 473 HB THR 76 HB THR 76 9.650 7.149 3.868 474 HG1 THR 76 HG1 THR 76 7.966 8.920 4.923 475 HG21 THR 76 HG21 THR 76 9.157 7.389 1.465 476 HG22 THR 76 HG22 THR 76 10.088 8.752 2.087 477 HG23 THR 76 HG23 THR 76 8.358 8.928 1.796 478 HA PRO 77 HA PRO 77 7.567 3.069 5.154 479 HB2 PRO 77 HB2 PRO 77 9.990 2.262 3.691 480 HB3 PRO 77 HB1 PRO 77 8.404 1.483 3.748 481 HG2 PRO 77 HG2 PRO 77 9.271 2.730 1.546 482 HG3 PRO 77 HG1 PRO 77 7.561 2.736 2.020 483 HD2 PRO 77 HD2 PRO 77 9.611 4.885 2.335 484 HD3 PRO 77 HD1 PRO 77 7.902 5.015 1.869 485 H LYS 78 HN LYS 78 10.045 5.364 4.989 486 HA LYS 78 HA LYS 78 11.916 4.105 6.758 487 HB2 LYS 78 HB2 LYS 78 12.599 5.768 5.071 488 HB3 LYS 78 HB1 LYS 78 11.661 6.995 5.907 489 HG2 LYS 78 HG2 LYS 78 13.865 7.372 6.570 490 HG3 LYS 78 HG1 LYS 78 13.133 6.517 7.927 491 HD2 LYS 78 HD2 LYS 78 15.249 5.523 7.595 492 HD3 LYS 78 HD1 LYS 78 14.079 4.391 6.916 493 HE2 LYS 78 HE2 LYS 78 14.696 4.849 4.745 494 HE3 LYS 78 HE1 LYS 78 15.304 6.455 5.147 495 HZ1 LYS 78 HZ1 LYS 78 17.148 5.058 4.678 496 HZ2 LYS 78 HZ2 LYS 78 16.603 3.855 5.733 497 HZ3 LYS 78 HZ3 LYS 78 17.143 5.333 6.345 498 H GLU 79 HN GLU 79 9.055 6.004 7.136 499 HA GLU 79 HA GLU 79 9.709 6.494 9.958 500 HB2 GLU 79 HB2 GLU 79 7.929 8.160 9.949 501 HB3 GLU 79 HB1 GLU 79 9.086 8.490 8.665 502 HG2 GLU 79 HG2 GLU 79 7.465 7.218 7.146 503 HG3 GLU 79 HG1 GLU 79 6.299 7.419 8.451 504 H LEU 80 HN LEU 80 7.584 6.517 11.327 505 HA LEU 80 HA LEU 80 5.891 5.396 12.315 506 HB2 LEU 80 HB2 LEU 80 5.535 4.098 9.613 507 HB3 LEU 80 HB1 LEU 80 4.441 3.889 10.966 508 HG LEU 80 HG LEU 80 5.022 6.581 9.741 509 HD11 LEU 80 HD11 LEU 80 2.926 6.361 8.532 510 HD12 LEU 80 HD12 LEU 80 2.736 4.716 9.135 511 HD13 LEU 80 HD13 LEU 80 4.063 5.106 8.042 512 HD21 LEU 80 HD21 LEU 80 2.815 5.588 11.539 513 HD22 LEU 80 HD22 LEU 80 2.926 7.206 10.848 514 HD23 LEU 80 HD23 LEU 80 4.139 6.654 12.003 515 H GLY 81 HN GLY 81 7.420 3.037 10.120 516 HA2 GLY 81 HA2 GLY 81 9.084 1.561 11.367 517 HA3 GLY 81 HA1 GLY 81 7.735 1.243 12.447 518 H MET 82 HN MET 82 8.448 1.210 8.962 519 HA MET 82 HA MET 82 6.652 -1.070 8.645 520 HB2 MET 82 HB2 MET 82 7.882 0.914 6.780 521 HB3 MET 82 HB1 MET 82 7.424 -0.660 6.145 522 HG2 MET 82 HG2 MET 82 5.140 -0.309 6.905 523 HG3 MET 82 HG1 MET 82 5.595 1.264 7.558 524 HE1 MET 82 HE1 MET 82 3.223 0.566 5.422 525 HE2 MET 82 HE2 MET 82 3.344 1.972 4.365 526 HE3 MET 82 HE3 MET 82 3.466 2.171 6.113 527 H GLU 83 HN GLU 83 7.335 -3.092 8.356 528 HA GLU 83 HA GLU 83 10.176 -3.518 7.706 529 HB2 GLU 83 HB2 GLU 83 8.793 -4.234 10.119 530 HB3 GLU 83 HB1 GLU 83 9.285 -5.697 9.274 531 HG2 GLU 83 HG2 GLU 83 11.073 -3.424 10.111 532 HG3 GLU 83 HG1 GLU 83 10.981 -5.022 10.851 533 H GLU 84 HN GLU 84 10.458 -5.980 7.184 534 HA GLU 84 HA GLU 84 8.818 -6.502 4.901 535 HB2 GLU 84 HB2 GLU 84 11.120 -7.118 4.770 536 HB3 GLU 84 HB1 GLU 84 11.035 -8.024 6.271 537 HG2 GLU 84 HG2 GLU 84 11.156 -9.543 4.428 538 HG3 GLU 84 HG1 GLU 84 9.565 -9.661 5.179 539 H GLU 85 HN GLU 85 7.161 -7.915 4.673 540 HA GLU 85 HA GLU 85 5.543 -9.440 5.144 541 HB2 GLU 85 HB2 GLU 85 7.496 -10.117 7.300 542 HB3 GLU 85 HB1 GLU 85 5.851 -10.719 7.445 543 HG2 GLU 85 HG2 GLU 85 7.534 -11.156 4.998 544 HG3 GLU 85 HG1 GLU 85 7.514 -12.263 6.370 545 H ASP 86 HN ASP 86 5.639 -6.632 6.106 546 HA ASP 86 HA ASP 86 4.220 -6.597 8.595 547 HB2 ASP 86 HB2 ASP 86 5.587 -4.697 7.087 548 HB3 ASP 86 HB1 ASP 86 3.902 -4.182 7.018 549 H VAL 87 HN VAL 87 2.069 -5.503 8.774 550 HA VAL 87 HA VAL 87 0.298 -6.565 6.672 551 HB VAL 87 HB VAL 87 -0.445 -6.038 9.552 552 HG11 VAL 87 HG11 VAL 87 -2.420 -7.374 9.041 553 HG12 VAL 87 HG12 VAL 87 -1.860 -7.587 7.383 554 HG13 VAL 87 HG13 VAL 87 -2.310 -5.983 7.962 555 HG21 VAL 87 HG21 VAL 87 0.290 -8.651 8.235 556 HG22 VAL 87 HG22 VAL 87 -0.334 -8.465 9.875 557 HG23 VAL 87 HG23 VAL 87 1.240 -7.794 9.448 558 H ILE 88 HN ILE 88 -0.765 -5.147 5.496 559 HA ILE 88 HA ILE 88 -1.519 -2.577 6.700 560 HB ILE 88 HB ILE 88 0.376 -2.070 5.305 561 HG12 ILE 88 HG12 ILE 88 -2.119 -1.325 3.769 562 HG13 ILE 88 HG11 ILE 88 -1.584 -0.529 5.247 563 HG21 ILE 88 HG21 ILE 88 0.579 -2.651 2.996 564 HG22 ILE 88 HG22 ILE 88 -1.032 -3.362 2.984 565 HG23 ILE 88 HG23 ILE 88 0.259 -4.124 3.912 566 HD11 ILE 88 HD11 ILE 88 0.507 0.107 4.100 567 HD12 ILE 88 HD12 ILE 88 -0.934 0.782 3.345 568 HD13 ILE 88 HD13 ILE 88 -0.127 -0.604 2.616 569 H GLU 89 HN GLU 89 -3.644 -2.278 6.593 570 HA GLU 89 HA GLU 89 -5.212 -4.048 4.874 571 HB2 GLU 89 HB2 GLU 89 -6.105 -2.244 7.133 572 HB3 GLU 89 HB1 GLU 89 -7.117 -3.397 6.273 573 HG2 GLU 89 HG2 GLU 89 -5.717 -5.231 7.105 574 HG3 GLU 89 HG1 GLU 89 -4.731 -4.065 7.986 575 H VAL 90 HN VAL 90 -6.973 -3.238 3.626 576 HA VAL 90 HA VAL 90 -6.844 -0.370 3.016 577 HB VAL 90 HB VAL 90 -5.531 -1.497 1.289 578 HG11 VAL 90 HG11 VAL 90 -8.037 -3.067 0.706 579 HG12 VAL 90 HG12 VAL 90 -6.540 -3.707 1.386 580 HG13 VAL 90 HG13 VAL 90 -6.564 -3.082 -0.264 581 HG21 VAL 90 HG21 VAL 90 -8.203 -0.533 0.282 582 HG22 VAL 90 HG22 VAL 90 -6.734 -0.673 -0.684 583 HG23 VAL 90 HG23 VAL 90 -6.804 0.470 0.658 584 H TYR 91 HN TYR 91 -8.782 0.568 2.974 585 HA TYR 91 HA TYR 91 -11.163 -1.130 2.610 586 HB2 TYR 91 HB2 TYR 91 -10.774 1.046 4.675 587 HB3 TYR 91 HB1 TYR 91 -12.321 0.288 4.313 588 HD1 TYR 91 HD1 TYR 91 -12.856 -1.892 5.153 589 HD2 TYR 91 HD2 TYR 91 -8.971 -0.263 5.730 590 HE1 TYR 91 HE1 TYR 91 -12.361 -3.665 6.784 591 HE2 TYR 91 HE2 TYR 91 -8.464 -2.028 7.359 592 HH TYR 91 HH TYR 91 -9.204 -3.804 8.447 593 H GLN 92 HN GLN 92 -13.134 0.197 2.113 594 HA GLN 92 HA GLN 92 -12.464 2.053 -0.003 595 HB2 GLN 92 HB2 GLN 92 -14.253 0.229 -0.137 596 HB3 GLN 92 HB1 GLN 92 -15.233 1.260 0.896 597 HG2 GLN 92 HG2 GLN 92 -14.600 3.035 -0.993 598 HG3 GLN 92 HG1 GLN 92 -14.511 1.557 -1.951 599 HE21 GLN 92 HE21 GLN 92 -16.556 3.759 -0.261 600 HE22 GLN 92 HE22 GLN 92 -18.062 3.064 -0.754 601 H GLU 93 HN GLU 93 -12.715 4.211 0.055 602 HA GLU 93 HA GLU 93 -13.200 5.466 2.587 603 HB2 GLU 93 HB2 GLU 93 -12.500 6.449 -0.160 604 HB3 GLU 93 HB1 GLU 93 -12.979 7.583 1.097 605 HG2 GLU 93 HG2 GLU 93 -10.793 5.593 1.557 606 HG3 GLU 93 HG1 GLU 93 -10.484 7.124 0.737 607 H GLN 94 HN GLN 94 -14.785 7.085 2.992 608 HA GLN 94 HA GLN 94 -17.399 6.345 2.171 609 HB2 GLN 94 HB2 GLN 94 -16.985 7.243 4.387 610 HB3 GLN 94 HB1 GLN 94 -16.390 8.747 3.704 611 HG2 GLN 94 HG2 GLN 94 -18.534 9.402 3.007 612 HG3 GLN 94 HG1 GLN 94 -19.193 7.786 3.250 613 HE21 GLN 94 HE21 GLN 94 -19.706 7.103 5.304 614 HE22 GLN 94 HE22 GLN 94 -19.829 8.189 6.645 615 H THR 95 HN THR 95 -15.096 8.683 1.073 616 HA THR 95 HA THR 95 -16.848 10.409 -0.329 617 HB THR 95 HB THR 95 -14.644 10.841 -1.675 618 HG1 THR 95 HG1 THR 95 -12.810 10.170 -0.333 619 HG21 THR 95 HG21 THR 95 -15.582 12.326 0.063 620 HG22 THR 95 HG22 THR 95 -13.821 12.281 0.100 621 HG23 THR 95 HG23 THR 95 -14.751 11.377 1.294 622 H GLY 96 HN GLY 96 -14.944 7.578 -1.292 623 HA2 GLY 96 HA2 GLY 96 -15.697 6.006 -2.918 624 HA3 GLY 96 HA1 GLY 96 -16.707 7.264 -3.619 625 H GLY 97 HN GLY 97 -13.865 8.722 -2.972 626 HA2 GLY 97 HA2 GLY 97 -11.823 8.900 -4.138 627 HA3 GLY 97 HA1 GLY 97 -12.461 7.818 -5.368 628 H1 ASN 357 HT1 ASN 357 -5.997 -18.233 -5.904 629 H2 ASN 357 HT2 ASN 357 -6.495 -18.023 -4.303 630 H3 ASN 357 HT3 ASN 357 -5.463 -19.301 -4.706 631 HA ASN 357 HA ASN 357 -4.171 -17.634 -3.661 632 HB2 ASN 357 HB2 ASN 357 -2.589 -17.066 -5.475 633 HB3 ASN 357 HB1 ASN 357 -3.081 -18.751 -5.541 634 HD21 ASN 357 HD21 ASN 357 -2.053 -16.826 -7.577 635 HD22 ASN 357 HD22 ASN 357 -3.191 -16.912 -8.877 636 H ASN 358 HN ASN 358 -3.744 -15.525 -3.223 637 HA ASN 358 HA ASN 358 -4.936 -13.436 -4.879 638 HB2 ASN 358 HB2 ASN 358 -5.819 -12.335 -2.744 639 HB3 ASN 358 HB1 ASN 358 -6.721 -13.712 -3.363 640 HD21 ASN 358 HD21 ASN 358 -7.159 -15.319 -2.020 641 HD22 ASN 358 HD22 ASN 358 -6.443 -15.547 -0.460 642 H ARG 359 HN ARG 359 -2.259 -14.387 -4.285 643 HA ARG 359 HA ARG 359 -1.125 -12.118 -2.806 644 HB2 ARG 359 HB2 ARG 359 -0.061 -14.860 -3.466 645 HB3 ARG 359 HB1 ARG 359 1.005 -13.559 -2.948 646 HG2 ARG 359 HG2 ARG 359 -0.166 -13.375 -0.852 647 HG3 ARG 359 HG1 ARG 359 -1.346 -14.581 -1.367 648 HD2 ARG 359 HD2 ARG 359 0.233 -16.319 -1.268 649 HD3 ARG 359 HD1 ARG 359 1.593 -15.197 -1.261 650 HE ARG 359 HE ARG 359 0.304 -14.559 1.017 651 HH11 ARG 359 HH11 ARG 359 1.471 -17.611 -0.312 652 HH12 ARG 359 HH12 ARG 359 1.697 -18.353 1.317 653 HH21 ARG 359 HH21 ARG 359 0.584 -15.457 3.063 654 HH22 ARG 359 HH22 ARG 359 1.205 -17.144 3.206 655 H ASP 360 HN ASP 360 -1.400 -10.651 -4.559 656 HA ASP 360 HA ASP 360 0.084 -11.202 -7.012 657 HB2 ASP 360 HB2 ASP 360 -2.195 -10.184 -7.122 658 HB3 ASP 360 HB1 ASP 360 -1.558 -8.765 -6.299 659 HA PRO 361 HA PRO 361 3.467 -8.795 -5.332 660 HB2 PRO 361 HB2 PRO 361 5.282 -9.436 -7.203 661 HB3 PRO 361 HB1 PRO 361 4.755 -10.603 -5.982 662 HG2 PRO 361 HG2 PRO 361 4.018 -10.425 -8.849 663 HG3 PRO 361 HG1 PRO 361 4.205 -11.852 -7.818 664 HD2 PRO 361 HD2 PRO 361 1.788 -10.639 -8.522 665 HD3 PRO 361 HD1 PRO 361 2.027 -11.827 -7.228 666 H ILE 362 HN ILE 362 3.034 -6.644 -5.574 667 HA ILE 362 HA ILE 362 3.057 -5.519 -8.283 668 HB ILE 362 HB ILE 362 2.241 -4.081 -5.768 669 HG12 ILE 362 HG12 ILE 362 0.477 -5.555 -7.740 670 HG13 ILE 362 HG11 ILE 362 0.823 -6.083 -6.098 671 HG21 ILE 362 HG21 ILE 362 1.066 -2.605 -7.347 672 HG22 ILE 362 HG22 ILE 362 1.714 -3.545 -8.692 673 HG23 ILE 362 HG23 ILE 362 2.806 -2.643 -7.642 674 HD11 ILE 362 HD11 ILE 362 -0.584 -3.532 -6.835 675 HD12 ILE 362 HD12 ILE 362 -0.309 -4.146 -5.203 676 HD13 ILE 362 HD13 ILE 362 -1.369 -5.019 -6.311 677 H VAL 363 HN VAL 363 4.808 -4.585 -9.002 678 HA VAL 363 HA VAL 363 6.651 -3.313 -7.081 679 HB VAL 363 HB VAL 363 7.527 -4.416 -9.750 680 HG11 VAL 363 HG11 VAL 363 8.986 -2.768 -8.688 681 HG12 VAL 363 HG12 VAL 363 9.746 -4.359 -8.729 682 HG13 VAL 363 HG13 VAL 363 9.047 -3.755 -7.228 683 HG21 VAL 363 HG21 VAL 363 6.634 -6.310 -8.555 684 HG22 VAL 363 HG22 VAL 363 7.516 -5.855 -7.097 685 HG23 VAL 363 HG23 VAL 363 8.396 -6.392 -8.529 686 H ILE 364 HN ILE 364 7.300 -1.226 -7.571 687 HA ILE 364 HA ILE 364 6.043 -0.047 -9.957 688 HB ILE 364 HB ILE 364 6.005 2.084 -8.802 689 HG12 ILE 364 HG12 ILE 364 6.748 0.940 -6.176 690 HG13 ILE 364 HG11 ILE 364 8.074 1.158 -7.312 691 HG21 ILE 364 HG21 ILE 364 4.331 1.575 -7.125 692 HG22 ILE 364 HG22 ILE 364 4.865 -0.104 -7.072 693 HG23 ILE 364 HG23 ILE 364 4.119 0.539 -8.535 694 HD11 ILE 364 HD11 ILE 364 7.806 3.075 -5.828 695 HD12 ILE 364 HD12 ILE 364 6.162 3.306 -6.424 696 HD13 ILE 364 HD13 ILE 364 7.532 3.515 -7.514 697 H SER 365 HN SER 365 7.186 2.142 -10.485 698 HA SER 365 HA SER 365 10.036 1.547 -10.852 699 HB2 SER 365 HB2 SER 365 8.198 3.336 -12.463 700 HB3 SER 365 HB1 SER 365 9.904 3.047 -12.807 701 HG SER 365 HG SER 365 7.932 1.677 -13.733 702 H ASP 366 HN ASP 366 11.453 2.764 -9.802 703 HA ASP 366 HA ASP 366 10.540 5.293 -8.614 704 HB2 ASP 366 HB2 ASP 366 11.312 3.764 -6.939 705 HB3 ASP 366 HB1 ASP 366 12.770 3.402 -7.858 706 H SER 367 HN SER 367 11.314 7.154 -9.392 707 HA SER 367 HA SER 367 13.959 7.268 -10.585 708 HB2 SER 367 HB2 SER 367 11.568 8.250 -12.150 709 HB3 SER 367 HB1 SER 367 13.248 8.181 -12.686 710 HG SER 367 HG SER 367 12.234 5.766 -11.849 711 HA PRO 368 HA PRO 368 13.048 11.037 -8.145 712 HB2 PRO 368 HB2 PRO 368 15.896 10.944 -7.510 713 HB3 PRO 368 HB1 PRO 368 14.511 10.840 -6.416 714 HG2 PRO 368 HG2 PRO 368 16.121 8.732 -6.885 715 HG3 PRO 368 HG1 PRO 368 14.387 8.557 -6.548 716 HD2 PRO 368 HD2 PRO 368 15.805 8.482 -9.183 717 HD3 PRO 368 HD1 PRO 368 14.510 7.430 -8.570 Start of MODEL 4 1 H TYR 21 HT1 TYR 21 14.903 -4.519 -0.975 2 HA TYR 21 HA TYR 21 13.092 -3.076 -1.731 3 HB2 TYR 21 HB2 TYR 21 12.689 -5.416 -3.555 4 HB3 TYR 21 HB1 TYR 21 11.284 -4.511 -3.006 5 HD1 TYR 21 HD1 TYR 21 10.545 -2.814 -4.370 6 HD2 TYR 21 HD2 TYR 21 14.679 -3.812 -4.442 7 HE1 TYR 21 HE1 TYR 21 10.912 -1.145 -6.135 8 HE2 TYR 21 HE2 TYR 21 15.059 -2.141 -6.206 9 HH TYR 21 HH TYR 21 13.606 -1.041 -8.041 10 H ILE 22 HN ILE 22 10.996 -3.245 -0.704 11 HA ILE 22 HA ILE 22 10.976 -5.370 1.335 12 HB ILE 22 HB ILE 22 9.509 -2.729 1.422 13 HG12 ILE 22 HG12 ILE 22 11.932 -2.346 1.421 14 HG13 ILE 22 HG11 ILE 22 11.232 -1.966 2.989 15 HG21 ILE 22 HG21 ILE 22 8.515 -4.480 2.794 16 HG22 ILE 22 HG22 ILE 22 9.230 -3.220 3.798 17 HG23 ILE 22 HG23 ILE 22 10.067 -4.756 3.582 18 HD11 ILE 22 HD11 ILE 22 13.236 -3.090 3.438 19 HD12 ILE 22 HD12 ILE 22 12.914 -4.326 2.223 20 HD13 ILE 22 HD13 ILE 22 11.966 -4.284 3.709 21 H LYS 23 HN LYS 23 9.160 -6.617 1.644 22 HA LYS 23 HA LYS 23 7.051 -6.302 -0.392 23 HB2 LYS 23 HB2 LYS 23 8.406 -8.328 -0.637 24 HB3 LYS 23 HB1 LYS 23 8.036 -8.784 1.018 25 HG2 LYS 23 HG2 LYS 23 5.583 -8.755 0.268 26 HG3 LYS 23 HG1 LYS 23 6.240 -8.780 -1.372 27 HD2 LYS 23 HD2 LYS 23 6.147 -11.023 -1.064 28 HD3 LYS 23 HD1 LYS 23 7.702 -10.750 -0.276 29 HE2 LYS 23 HE2 LYS 23 5.012 -11.230 0.953 30 HE3 LYS 23 HE1 LYS 23 6.535 -12.058 1.257 31 HZ1 LYS 23 HZ1 LYS 23 5.839 -10.577 3.077 32 HZ2 LYS 23 HZ2 LYS 23 5.975 -9.249 2.039 33 HZ3 LYS 23 HZ3 LYS 23 7.353 -10.146 2.440 34 H LEU 24 HN LEU 24 5.443 -5.230 0.587 35 HA LEU 24 HA LEU 24 4.769 -5.765 3.364 36 HB2 LEU 24 HB2 LEU 24 3.576 -3.848 1.362 37 HB3 LEU 24 HB1 LEU 24 3.103 -3.958 3.046 38 HG LEU 24 HG LEU 24 5.864 -3.199 2.092 39 HD11 LEU 24 HD11 LEU 24 4.237 -1.494 1.491 40 HD12 LEU 24 HD12 LEU 24 5.260 -0.936 2.814 41 HD13 LEU 24 HD13 LEU 24 3.615 -1.483 3.142 42 HD21 LEU 24 HD21 LEU 24 6.118 -2.447 4.456 43 HD22 LEU 24 HD22 LEU 24 5.970 -4.193 4.268 44 HD23 LEU 24 HD23 LEU 24 4.590 -3.247 4.823 45 H LYS 25 HN LYS 25 2.563 -6.236 4.018 46 HA LYS 25 HA LYS 25 1.191 -7.975 2.071 47 HB2 LYS 25 HB2 LYS 25 0.887 -8.045 5.077 48 HB3 LYS 25 HB1 LYS 25 0.326 -9.239 3.916 49 HG2 LYS 25 HG2 LYS 25 2.481 -10.054 3.539 50 HG3 LYS 25 HG1 LYS 25 3.238 -8.628 4.258 51 HD2 LYS 25 HD2 LYS 25 3.472 -10.193 5.939 52 HD3 LYS 25 HD1 LYS 25 1.982 -9.376 6.411 53 HE2 LYS 25 HE2 LYS 25 1.622 -11.716 6.653 54 HE3 LYS 25 HE1 LYS 25 0.722 -11.187 5.234 55 HZ1 LYS 25 HZ1 LYS 25 1.867 -12.566 3.952 56 HZ2 LYS 25 HZ2 LYS 25 2.540 -13.237 5.357 57 HZ3 LYS 25 HZ3 LYS 25 3.360 -12.001 4.540 58 H VAL 26 HN VAL 26 -0.280 -6.643 1.132 59 HA VAL 26 HA VAL 26 -1.839 -4.837 2.814 60 HB VAL 26 HB VAL 26 -2.272 -5.171 -0.137 61 HG11 VAL 26 HG11 VAL 26 -2.968 -2.859 -0.024 62 HG12 VAL 26 HG12 VAL 26 -2.504 -2.776 1.675 63 HG13 VAL 26 HG13 VAL 26 -3.843 -3.809 1.176 64 HG21 VAL 26 HG21 VAL 26 -0.122 -3.484 1.139 65 HG22 VAL 26 HG22 VAL 26 -0.596 -3.425 -0.559 66 HG23 VAL 26 HG23 VAL 26 0.130 -4.889 0.104 67 H ILE 27 HN ILE 27 -3.567 -5.619 3.779 68 HA ILE 27 HA ILE 27 -4.911 -7.964 2.679 69 HB ILE 27 HB ILE 27 -5.402 -6.547 5.301 70 HG12 ILE 27 HG12 ILE 27 -3.146 -7.507 5.202 71 HG13 ILE 27 HG11 ILE 27 -4.161 -8.402 6.325 72 HG21 ILE 27 HG21 ILE 27 -6.652 -8.531 5.931 73 HG22 ILE 27 HG22 ILE 27 -6.316 -9.265 4.362 74 HG23 ILE 27 HG23 ILE 27 -7.330 -7.825 4.463 75 HD11 ILE 27 HD11 ILE 27 -4.515 -10.104 4.575 76 HD12 ILE 27 HD12 ILE 27 -2.831 -9.932 5.064 77 HD13 ILE 27 HD13 ILE 27 -3.383 -9.229 3.544 78 H GLY 28 HN GLY 28 -6.393 -7.555 1.201 79 HA2 GLY 28 HA2 GLY 28 -7.853 -5.079 1.124 80 HA3 GLY 28 HA1 GLY 28 -8.058 -6.450 0.041 81 H GLN 29 HN GLN 29 -10.268 -5.139 0.841 82 HA GLN 29 HA GLN 29 -11.456 -6.133 3.212 83 HB2 GLN 29 HB2 GLN 29 -12.255 -4.098 2.108 84 HB3 GLN 29 HB1 GLN 29 -12.745 -5.031 0.703 85 HG2 GLN 29 HG2 GLN 29 -14.667 -4.482 2.049 86 HG3 GLN 29 HG1 GLN 29 -14.390 -6.222 2.084 87 HE21 GLN 29 HE21 GLN 29 -13.642 -7.181 3.996 88 HE22 GLN 29 HE22 GLN 29 -13.753 -6.366 5.521 89 H ASP 30 HN ASP 30 -11.081 -7.400 0.019 90 HA ASP 30 HA ASP 30 -13.084 -9.463 0.380 91 HB2 ASP 30 HB2 ASP 30 -12.307 -10.261 -1.854 92 HB3 ASP 30 HB1 ASP 30 -12.840 -8.583 -1.849 93 H SER 31 HN SER 31 -10.425 -9.102 1.921 94 HA SER 31 HA SER 31 -8.979 -10.420 3.042 95 HB2 SER 31 HB2 SER 31 -10.784 -12.635 2.063 96 HB3 SER 31 HB1 SER 31 -9.557 -12.806 3.322 97 HG SER 31 HG SER 31 -12.024 -12.090 3.669 98 H SER 32 HN SER 32 -7.911 -9.598 0.784 99 HA SER 32 HA SER 32 -6.613 -11.951 -0.414 100 HB2 SER 32 HB2 SER 32 -5.859 -9.880 -2.000 101 HB3 SER 32 HB1 SER 32 -7.312 -10.837 -2.288 102 HG SER 32 HG SER 32 -8.471 -9.153 -1.867 103 H GLU 33 HN GLU 33 -4.269 -11.844 -0.718 104 HA GLU 33 HA GLU 33 -3.009 -10.013 1.222 105 HB2 GLU 33 HB2 GLU 33 -2.994 -12.674 1.474 106 HB3 GLU 33 HB1 GLU 33 -1.611 -12.506 0.400 107 HG2 GLU 33 HG2 GLU 33 -0.641 -10.882 2.015 108 HG3 GLU 33 HG1 GLU 33 -1.969 -11.256 3.112 109 H ILE 34 HN ILE 34 -2.760 -8.419 -0.363 110 HA ILE 34 HA ILE 34 -1.313 -8.969 -2.789 111 HB ILE 34 HB ILE 34 -1.963 -6.292 -1.556 112 HG12 ILE 34 HG12 ILE 34 -4.007 -7.564 -1.944 113 HG13 ILE 34 HG11 ILE 34 -3.882 -6.247 -3.102 114 HG21 ILE 34 HG21 ILE 34 -0.215 -6.107 -3.187 115 HG22 ILE 34 HG22 ILE 34 -1.708 -5.466 -3.875 116 HG23 ILE 34 HG23 ILE 34 -1.138 -7.068 -4.342 117 HD11 ILE 34 HD11 ILE 34 -4.687 -8.201 -4.216 118 HD12 ILE 34 HD12 ILE 34 -3.337 -9.160 -3.609 119 HD13 ILE 34 HD13 ILE 34 -3.048 -7.868 -4.774 120 H HIS 35 HN HIS 35 0.791 -9.189 -2.910 121 HA HIS 35 HA HIS 35 2.475 -8.198 -0.731 122 HB2 HIS 35 HB2 HIS 35 2.876 -10.285 -2.870 123 HB3 HIS 35 HB1 HIS 35 4.233 -9.639 -1.958 124 HD2 HIS 35 HD2 HIS 35 1.601 -9.800 0.589 125 HE1 HIS 35 HE1 HIS 35 3.299 -13.672 0.518 126 HE2 HIS 35 HE2 HIS 35 1.624 -12.159 1.680 127 H PHE 36 HN PHE 36 2.212 -6.017 -1.493 128 HA PHE 36 HA PHE 36 3.205 -5.225 -4.048 129 HB2 PHE 36 HB2 PHE 36 1.712 -4.041 -2.005 130 HB3 PHE 36 HB1 PHE 36 3.209 -3.115 -2.067 131 HD1 PHE 36 HD1 PHE 36 1.117 -4.723 -4.700 132 HD2 PHE 36 HD2 PHE 36 2.843 -1.141 -3.191 133 HE1 PHE 36 HE1 PHE 36 0.261 -3.495 -6.652 134 HE2 PHE 36 HE2 PHE 36 1.989 0.096 -5.141 135 HZ PHE 36 HZ PHE 36 0.694 -1.080 -6.873 136 H LYS 37 HN LYS 37 5.272 -5.195 -4.613 137 HA LYS 37 HA LYS 37 7.335 -5.194 -2.575 138 HB2 LYS 37 HB2 LYS 37 7.439 -6.591 -4.676 139 HB3 LYS 37 HB1 LYS 37 7.688 -5.102 -5.576 140 HG2 LYS 37 HG2 LYS 37 9.768 -4.704 -4.518 141 HG3 LYS 37 HG1 LYS 37 9.477 -5.969 -3.326 142 HD2 LYS 37 HD2 LYS 37 9.754 -6.469 -6.285 143 HD3 LYS 37 HD1 LYS 37 11.086 -6.591 -5.135 144 HE2 LYS 37 HE2 LYS 37 9.397 -8.182 -3.875 145 HE3 LYS 37 HE1 LYS 37 8.705 -8.347 -5.488 146 HZ1 LYS 37 HZ1 LYS 37 11.042 -8.886 -6.231 147 HZ2 LYS 37 HZ2 LYS 37 10.274 -10.055 -5.288 148 HZ3 LYS 37 HZ3 LYS 37 11.438 -9.046 -4.595 149 H VAL 38 HN VAL 38 7.604 -3.306 -1.608 150 HA VAL 38 HA VAL 38 7.575 -0.841 -3.183 151 HB VAL 38 HB VAL 38 7.396 0.361 -1.115 152 HG11 VAL 38 HG11 VAL 38 5.621 -2.066 -0.920 153 HG12 VAL 38 HG12 VAL 38 5.357 -0.717 -2.022 154 HG13 VAL 38 HG13 VAL 38 5.298 -0.454 -0.280 155 HG21 VAL 38 HG21 VAL 38 7.802 -2.283 0.282 156 HG22 VAL 38 HG22 VAL 38 7.401 -0.756 1.067 157 HG23 VAL 38 HG23 VAL 38 8.946 -0.942 0.239 158 H LYS 39 HN LYS 39 9.206 0.824 -2.634 159 HA LYS 39 HA LYS 39 11.858 -0.408 -2.301 160 HB2 LYS 39 HB2 LYS 39 11.291 0.599 -4.542 161 HB3 LYS 39 HB1 LYS 39 11.192 2.161 -3.743 162 HG2 LYS 39 HG2 LYS 39 13.534 2.014 -3.121 163 HG3 LYS 39 HG1 LYS 39 13.641 0.414 -3.859 164 HD2 LYS 39 HD2 LYS 39 12.995 1.427 -6.030 165 HD3 LYS 39 HD1 LYS 39 13.043 3.016 -5.264 166 HE2 LYS 39 HE2 LYS 39 15.402 2.725 -4.762 167 HE3 LYS 39 HE1 LYS 39 15.364 1.101 -5.451 168 HZ1 LYS 39 HZ1 LYS 39 14.721 3.556 -6.994 169 HZ2 LYS 39 HZ2 LYS 39 14.941 1.988 -7.597 170 HZ3 LYS 39 HZ3 LYS 39 16.256 2.833 -6.961 171 H MET 40 HN MET 40 13.074 0.259 -0.636 172 HA MET 40 HA MET 40 11.994 2.196 1.194 173 HB2 MET 40 HB2 MET 40 13.126 0.142 1.981 174 HB3 MET 40 HB1 MET 40 14.634 0.726 1.296 175 HG2 MET 40 HG2 MET 40 14.573 1.105 3.687 176 HG3 MET 40 HG1 MET 40 14.599 2.636 2.815 177 HE1 MET 40 HE1 MET 40 12.865 0.472 5.428 178 HE2 MET 40 HE2 MET 40 11.906 -0.012 4.029 179 HE3 MET 40 HE3 MET 40 11.164 0.922 5.328 180 H THR 41 HN THR 41 12.031 3.969 -0.294 181 HA THR 41 HA THR 41 13.954 5.862 0.237 182 HB THR 41 HB THR 41 15.290 4.207 -1.333 183 HG1 THR 41 HG1 THR 41 15.252 7.043 -1.419 184 HG21 THR 41 HG21 THR 41 13.882 5.948 -3.363 185 HG22 THR 41 HG22 THR 41 13.649 4.211 -3.166 186 HG23 THR 41 HG23 THR 41 15.213 4.838 -3.689 187 H THR 42 HN THR 42 11.554 4.575 -1.931 188 HA THR 42 HA THR 42 10.822 7.199 -2.936 189 HB THR 42 HB THR 42 9.297 4.665 -3.476 190 HG1 THR 42 HG1 THR 42 11.213 5.182 -5.350 191 HG21 THR 42 HG21 THR 42 8.435 6.822 -4.318 192 HG22 THR 42 HG22 THR 42 8.870 5.717 -5.621 193 HG23 THR 42 HG23 THR 42 9.941 7.055 -5.205 194 H HIS 43 HN HIS 43 8.784 8.153 -2.561 195 HA HIS 43 HA HIS 43 7.745 7.803 0.061 196 HB2 HIS 43 HB2 HIS 43 6.552 9.335 -2.260 197 HB3 HIS 43 HB1 HIS 43 6.105 9.511 -0.568 198 HD2 HIS 43 HD2 HIS 43 8.300 10.558 1.060 199 HE1 HIS 43 HE1 HIS 43 9.987 12.503 -2.298 200 HE2 HIS 43 HE2 HIS 43 10.109 12.218 0.216 201 H LEU 44 HN LEU 44 5.591 7.208 0.642 202 HA LEU 44 HA LEU 44 4.724 4.833 -0.641 203 HB2 LEU 44 HB2 LEU 44 3.714 6.504 1.617 204 HB3 LEU 44 HB1 LEU 44 2.671 5.266 0.938 205 HG LEU 44 HG LEU 44 5.456 4.599 1.840 206 HD11 LEU 44 HD11 LEU 44 2.978 4.661 3.554 207 HD12 LEU 44 HD12 LEU 44 4.414 5.664 3.746 208 HD13 LEU 44 HD13 LEU 44 4.514 3.925 4.003 209 HD21 LEU 44 HD21 LEU 44 4.457 2.376 2.133 210 HD22 LEU 44 HD22 LEU 44 4.301 2.961 0.476 211 HD23 LEU 44 HD23 LEU 44 2.912 3.006 1.562 212 H LYS 45 HN LYS 45 4.166 8.090 -1.274 213 HA LYS 45 HA LYS 45 1.568 8.200 -2.241 214 HB2 LYS 45 HB2 LYS 45 2.866 10.210 -2.048 215 HB3 LYS 45 HB1 LYS 45 4.094 9.595 -3.142 216 HG2 LYS 45 HG2 LYS 45 2.839 11.207 -4.331 217 HG3 LYS 45 HG1 LYS 45 2.367 9.628 -4.958 218 HD2 LYS 45 HD2 LYS 45 0.399 9.693 -3.436 219 HD3 LYS 45 HD1 LYS 45 0.845 11.341 -2.999 220 HE2 LYS 45 HE2 LYS 45 0.672 11.962 -5.397 221 HE3 LYS 45 HE1 LYS 45 0.091 10.334 -5.740 222 HZ1 LYS 45 HZ1 LYS 45 -1.942 10.899 -5.100 223 HZ2 LYS 45 HZ2 LYS 45 -1.429 12.507 -5.004 224 HZ3 LYS 45 HZ3 LYS 45 -1.396 11.525 -3.624 225 H LYS 46 HN LYS 46 4.557 7.277 -3.889 226 HA LYS 46 HA LYS 46 3.376 6.792 -6.411 227 HB2 LYS 46 HB2 LYS 46 5.870 7.163 -5.776 228 HB3 LYS 46 HB1 LYS 46 5.887 5.431 -5.480 229 HG2 LYS 46 HG2 LYS 46 6.700 5.874 -7.696 230 HG3 LYS 46 HG1 LYS 46 5.138 5.057 -7.804 231 HD2 LYS 46 HD2 LYS 46 4.091 7.330 -8.067 232 HD3 LYS 46 HD1 LYS 46 5.723 7.985 -8.206 233 HE2 LYS 46 HE2 LYS 46 6.097 6.975 -10.246 234 HE3 LYS 46 HE1 LYS 46 4.895 5.718 -9.958 235 HZ1 LYS 46 HZ1 LYS 46 4.303 8.575 -10.514 236 HZ2 LYS 46 HZ2 LYS 46 3.147 7.372 -10.233 237 HZ3 LYS 46 HZ3 LYS 46 4.132 7.298 -11.611 238 H LEU 47 HN LEU 47 3.649 4.899 -3.535 239 HA LEU 47 HA LEU 47 3.125 2.387 -4.853 240 HB2 LEU 47 HB2 LEU 47 3.356 3.239 -1.982 241 HB3 LEU 47 HB1 LEU 47 2.748 1.651 -2.399 242 HG LEU 47 HG LEU 47 5.031 1.353 -1.900 243 HD11 LEU 47 HD11 LEU 47 5.945 0.471 -3.900 244 HD12 LEU 47 HD12 LEU 47 4.985 1.562 -4.898 245 HD13 LEU 47 HD13 LEU 47 4.196 0.267 -3.997 246 HD21 LEU 47 HD21 LEU 47 5.589 3.710 -3.693 247 HD22 LEU 47 HD22 LEU 47 6.827 2.659 -3.007 248 HD23 LEU 47 HD23 LEU 47 5.805 3.626 -1.944 249 H LYS 48 HN LYS 48 1.341 4.706 -2.878 250 HA LYS 48 HA LYS 48 -1.065 3.272 -2.692 251 HB2 LYS 48 HB2 LYS 48 -0.541 6.245 -2.609 252 HB3 LYS 48 HB1 LYS 48 -2.089 5.514 -2.215 253 HG2 LYS 48 HG2 LYS 48 -1.077 4.316 -0.360 254 HG3 LYS 48 HG1 LYS 48 0.504 4.976 -0.781 255 HD2 LYS 48 HD2 LYS 48 -0.304 6.297 1.005 256 HD3 LYS 48 HD1 LYS 48 -0.510 7.272 -0.452 257 HE2 LYS 48 HE2 LYS 48 -2.878 6.490 -0.549 258 HE3 LYS 48 HE1 LYS 48 -2.631 5.704 1.009 259 HZ1 LYS 48 HZ1 LYS 48 -2.225 7.818 2.026 260 HZ2 LYS 48 HZ2 LYS 48 -3.673 7.920 1.159 261 HZ3 LYS 48 HZ3 LYS 48 -2.261 8.616 0.526 262 H GLU 49 HN GLU 49 0.047 5.639 -5.100 263 HA GLU 49 HA GLU 49 -2.401 5.716 -6.523 264 HB2 GLU 49 HB2 GLU 49 -1.067 6.738 -8.356 265 HB3 GLU 49 HB1 GLU 49 -0.833 7.519 -6.799 266 HG2 GLU 49 HG2 GLU 49 1.298 6.499 -6.521 267 HG3 GLU 49 HG1 GLU 49 1.051 5.465 -7.926 268 H SER 50 HN SER 50 0.568 3.835 -6.996 269 HA SER 50 HA SER 50 -0.196 2.568 -9.375 270 HB2 SER 50 HB2 SER 50 1.630 1.526 -7.194 271 HB3 SER 50 HB1 SER 50 1.560 0.932 -8.853 272 HG SER 50 HG SER 50 2.586 3.350 -7.856 273 H TYR 51 HN TYR 51 -0.910 1.858 -6.032 274 HA TYR 51 HA TYR 51 -1.915 -0.761 -6.404 275 HB2 TYR 51 HB2 TYR 51 -1.222 0.320 -4.216 276 HB3 TYR 51 HB1 TYR 51 -2.753 1.188 -4.253 277 HD1 TYR 51 HD1 TYR 51 -1.127 -2.018 -3.677 278 HD2 TYR 51 HD2 TYR 51 -4.878 -0.028 -3.959 279 HE1 TYR 51 HE1 TYR 51 -2.221 -3.935 -2.596 280 HE2 TYR 51 HE2 TYR 51 -5.980 -1.944 -2.878 281 HH TYR 51 HH TYR 51 -5.450 -4.488 -2.667 282 H CYS 52 HN CYS 52 -3.475 2.424 -6.272 283 HA CYS 52 HA CYS 52 -6.125 1.532 -6.538 284 HB2 CYS 52 HB2 CYS 52 -4.978 4.163 -7.498 285 HB3 CYS 52 HB1 CYS 52 -6.665 3.828 -7.127 286 HG CYS 52 HG CYS 52 -4.105 3.877 -4.849 287 H GLN 53 HN GLN 53 -3.687 2.439 -8.925 288 HA GLN 53 HA GLN 53 -5.324 2.270 -11.212 289 HB2 GLN 53 HB2 GLN 53 -2.337 1.845 -10.963 290 HB3 GLN 53 HB1 GLN 53 -3.205 2.126 -12.467 291 HG2 GLN 53 HG2 GLN 53 -3.838 4.336 -11.743 292 HG3 GLN 53 HG1 GLN 53 -3.116 4.058 -10.160 293 HE21 GLN 53 HE21 GLN 53 -2.528 6.159 -12.016 294 HE22 GLN 53 HE22 GLN 53 -0.855 6.014 -12.424 295 H ARG 54 HN ARG 54 -3.597 -0.145 -9.363 296 HA ARG 54 HA ARG 54 -3.832 -2.214 -11.314 297 HB2 ARG 54 HB2 ARG 54 -2.113 -2.383 -9.622 298 HB3 ARG 54 HB1 ARG 54 -3.315 -2.336 -8.339 299 HG2 ARG 54 HG2 ARG 54 -4.072 -4.493 -8.802 300 HG3 ARG 54 HG1 ARG 54 -3.347 -4.502 -10.409 301 HD2 ARG 54 HD2 ARG 54 -1.111 -4.485 -9.362 302 HD3 ARG 54 HD1 ARG 54 -1.880 -4.568 -7.778 303 HE ARG 54 HE ARG 54 -2.260 -6.802 -8.101 304 HH11 ARG 54 HH11 ARG 54 -1.400 -5.314 -11.179 305 HH12 ARG 54 HH12 ARG 54 -1.226 -6.898 -12.021 306 HH21 ARG 54 HH21 ARG 54 -2.004 -8.827 -9.106 307 HH22 ARG 54 HH22 ARG 54 -1.611 -8.867 -10.875 308 H GLN 55 HN GLN 55 -5.675 -1.296 -8.431 309 HA GLN 55 HA GLN 55 -7.517 -3.443 -8.572 310 HB2 GLN 55 HB2 GLN 55 -7.816 -0.718 -7.294 311 HB3 GLN 55 HB1 GLN 55 -8.904 -2.074 -7.039 312 HG2 GLN 55 HG2 GLN 55 -6.062 -1.759 -6.154 313 HG3 GLN 55 HG1 GLN 55 -7.497 -2.058 -5.176 314 HE21 GLN 55 HE21 GLN 55 -8.411 -4.152 -5.183 315 HE22 GLN 55 HE22 GLN 55 -7.473 -5.536 -5.631 316 H GLY 56 HN GLY 56 -7.374 -0.290 -10.073 317 HA2 GLY 56 HA2 GLY 56 -8.458 0.126 -12.160 318 HA3 GLY 56 HA1 GLY 56 -9.685 -1.050 -11.719 319 H VAL 57 HN VAL 57 -8.576 1.371 -9.485 320 HA VAL 57 HA VAL 57 -11.040 2.918 -9.911 321 HB VAL 57 HB VAL 57 -11.128 3.218 -7.380 322 HG11 VAL 57 HG11 VAL 57 -12.373 1.144 -7.026 323 HG12 VAL 57 HG12 VAL 57 -11.664 0.466 -8.492 324 HG13 VAL 57 HG13 VAL 57 -12.746 1.854 -8.598 325 HG21 VAL 57 HG21 VAL 57 -9.334 0.793 -7.471 326 HG22 VAL 57 HG22 VAL 57 -10.148 1.408 -6.033 327 HG23 VAL 57 HG23 VAL 57 -8.914 2.381 -6.832 328 HA PRO 58 HA PRO 58 -8.369 6.444 -9.786 329 HB2 PRO 58 HB2 PRO 58 -10.012 8.284 -8.586 330 HB3 PRO 58 HB1 PRO 58 -10.148 7.808 -10.285 331 HG2 PRO 58 HG2 PRO 58 -11.738 6.872 -7.942 332 HG3 PRO 58 HG1 PRO 58 -12.282 7.267 -9.585 333 HD2 PRO 58 HD2 PRO 58 -11.947 4.727 -8.784 334 HD3 PRO 58 HD1 PRO 58 -11.595 5.240 -10.447 335 H MET 59 HN MET 59 -7.329 7.967 -8.232 336 HA MET 59 HA MET 59 -6.722 6.579 -5.802 337 HB2 MET 59 HB2 MET 59 -5.153 8.061 -7.244 338 HB3 MET 59 HB1 MET 59 -5.872 9.405 -6.364 339 HG2 MET 59 HG2 MET 59 -5.173 8.398 -4.253 340 HG3 MET 59 HG1 MET 59 -4.444 7.059 -5.134 341 HE1 MET 59 HE1 MET 59 -2.867 8.428 -3.035 342 HE2 MET 59 HE2 MET 59 -1.355 8.969 -3.760 343 HE3 MET 59 HE3 MET 59 -1.975 7.358 -4.120 344 H ASN 60 HN ASN 60 -6.849 7.535 -3.671 345 HA ASN 60 HA ASN 60 -7.821 8.615 -1.925 346 HB2 ASN 60 HB2 ASN 60 -7.915 10.607 -3.655 347 HB3 ASN 60 HB1 ASN 60 -9.637 10.235 -3.672 348 HD21 ASN 60 HD21 ASN 60 -10.872 10.652 -1.856 349 HD22 ASN 60 HD22 ASN 60 -10.290 11.607 -0.533 350 H SER 61 HN SER 61 -9.171 6.565 -3.990 351 HA SER 61 HA SER 61 -11.888 6.611 -3.006 352 HB2 SER 61 HB2 SER 61 -12.125 4.545 -4.395 353 HB3 SER 61 HB1 SER 61 -11.502 5.920 -5.309 354 HG SER 61 HG SER 61 -9.743 4.837 -5.677 355 H LEU 62 HN LEU 62 -8.927 4.839 -2.502 356 HA LEU 62 HA LEU 62 -10.215 3.255 -0.393 357 HB2 LEU 62 HB2 LEU 62 -7.640 2.679 -1.860 358 HB3 LEU 62 HB1 LEU 62 -8.424 1.640 -0.688 359 HG LEU 62 HG LEU 62 -9.796 2.406 -3.249 360 HD11 LEU 62 HD11 LEU 62 -8.970 0.296 -4.201 361 HD12 LEU 62 HD12 LEU 62 -7.932 0.079 -2.793 362 HD13 LEU 62 HD13 LEU 62 -7.665 1.437 -3.884 363 HD21 LEU 62 HD21 LEU 62 -11.086 1.403 -1.361 364 HD22 LEU 62 HD22 LEU 62 -10.069 -0.031 -1.493 365 HD23 LEU 62 HD23 LEU 62 -11.106 0.443 -2.840 366 H ARG 63 HN ARG 63 -9.364 3.204 1.617 367 HA ARG 63 HA ARG 63 -7.243 5.161 2.189 368 HB2 ARG 63 HB2 ARG 63 -8.141 5.223 4.491 369 HB3 ARG 63 HB1 ARG 63 -9.344 5.703 3.303 370 HG2 ARG 63 HG2 ARG 63 -10.496 3.639 3.510 371 HG3 ARG 63 HG1 ARG 63 -9.181 2.927 4.447 372 HD2 ARG 63 HD2 ARG 63 -9.619 4.431 6.281 373 HD3 ARG 63 HD1 ARG 63 -10.849 5.273 5.340 374 HE ARG 63 HE ARG 63 -11.075 2.620 6.553 375 HH11 ARG 63 HH11 ARG 63 -14.186 4.582 4.857 376 HH12 ARG 63 HH12 ARG 63 -12.515 5.260 4.706 377 HH21 ARG 63 HH21 ARG 63 -13.176 1.760 6.780 378 HH22 ARG 63 HH22 ARG 63 -14.555 2.645 6.025 379 H PHE 64 HN PHE 64 -5.364 4.430 2.855 380 HA PHE 64 HA PHE 64 -5.057 1.596 3.427 381 HB2 PHE 64 HB2 PHE 64 -3.084 3.833 2.942 382 HB3 PHE 64 HB1 PHE 64 -2.584 2.223 3.443 383 HD1 PHE 64 HD1 PHE 64 -4.231 4.140 0.758 384 HD2 PHE 64 HD2 PHE 64 -2.473 0.439 1.906 385 HE1 PHE 64 HE1 PHE 64 -4.241 3.412 -1.592 386 HE2 PHE 64 HE2 PHE 64 -2.481 -0.297 -0.441 387 HZ PHE 64 HZ PHE 64 -3.365 1.189 -2.194 388 H LEU 65 HN LEU 65 -5.183 0.890 5.439 389 HA LEU 65 HA LEU 65 -4.656 2.783 7.620 390 HB2 LEU 65 HB2 LEU 65 -6.229 0.209 7.635 391 HB3 LEU 65 HB1 LEU 65 -5.975 1.242 9.028 392 HG LEU 65 HG LEU 65 -7.433 2.081 6.522 393 HD11 LEU 65 HD11 LEU 65 -9.469 1.869 7.829 394 HD12 LEU 65 HD12 LEU 65 -8.543 1.276 9.207 395 HD13 LEU 65 HD13 LEU 65 -8.634 0.318 7.729 396 HD21 LEU 65 HD21 LEU 65 -7.150 3.416 9.214 397 HD22 LEU 65 HD22 LEU 65 -8.168 3.981 7.890 398 HD23 LEU 65 HD23 LEU 65 -6.415 3.948 7.701 399 H PHE 66 HN PHE 66 -3.078 2.458 9.017 400 HA PHE 66 HA PHE 66 -1.774 -0.158 9.163 401 HB2 PHE 66 HB2 PHE 66 -0.495 1.218 7.529 402 HB3 PHE 66 HB1 PHE 66 -0.277 2.446 8.769 403 HD1 PHE 66 HD1 PHE 66 0.208 -1.247 8.443 404 HD2 PHE 66 HD2 PHE 66 1.774 2.483 9.770 405 HE1 PHE 66 HE1 PHE 66 2.255 -2.378 9.198 406 HE2 PHE 66 HE2 PHE 66 3.825 1.354 10.526 407 HZ PHE 66 HZ PHE 66 4.067 -1.079 10.240 408 H GLU 67 HN GLU 67 -1.800 -0.719 11.211 409 HA GLU 67 HA GLU 67 -1.691 -0.691 13.470 410 HB2 GLU 67 HB2 GLU 67 -0.072 1.751 12.814 411 HB3 GLU 67 HB1 GLU 67 -0.384 1.296 14.483 412 HG2 GLU 67 HG2 GLU 67 0.900 -0.493 12.434 413 HG3 GLU 67 HG1 GLU 67 1.778 0.471 13.620 414 H GLY 68 HN GLY 68 -3.888 0.631 11.989 415 HA2 GLY 68 HA2 GLY 68 -5.941 1.267 13.041 416 HA3 GLY 68 HA1 GLY 68 -5.006 2.089 14.280 417 H GLN 69 HN GLN 69 -3.262 3.553 12.694 418 HA GLN 69 HA GLN 69 -4.994 5.708 11.894 419 HB2 GLN 69 HB2 GLN 69 -1.986 5.423 11.801 420 HB3 GLN 69 HB1 GLN 69 -2.858 6.896 11.406 421 HG2 GLN 69 HG2 GLN 69 -3.759 6.926 13.713 422 HG3 GLN 69 HG1 GLN 69 -2.754 5.524 14.081 423 HE21 GLN 69 HE21 GLN 69 -2.716 8.192 15.242 424 HE22 GLN 69 HE22 GLN 69 -1.113 8.793 15.008 425 H ARG 70 HN ARG 70 -4.170 6.905 9.767 426 HA ARG 70 HA ARG 70 -4.201 4.860 7.656 427 HB2 ARG 70 HB2 ARG 70 -5.260 6.641 6.224 428 HB3 ARG 70 HB1 ARG 70 -6.257 6.040 7.539 429 HG2 ARG 70 HG2 ARG 70 -5.560 8.044 8.866 430 HG3 ARG 70 HG1 ARG 70 -4.792 8.659 7.399 431 HD2 ARG 70 HD2 ARG 70 -7.708 7.942 7.690 432 HD3 ARG 70 HD1 ARG 70 -7.049 9.576 7.707 433 HE ARG 70 HE ARG 70 -6.196 8.896 5.366 434 HH11 ARG 70 HH11 ARG 70 -9.243 7.838 6.809 435 HH12 ARG 70 HH12 ARG 70 -10.104 7.801 5.220 436 HH21 ARG 70 HH21 ARG 70 -7.255 8.784 3.338 437 HH22 ARG 70 HH22 ARG 70 -9.008 8.329 3.301 438 H ILE 71 HN ILE 71 -2.849 5.027 5.951 439 HA ILE 71 HA ILE 71 -0.405 6.442 6.377 440 HB ILE 71 HB ILE 71 -1.385 4.818 4.028 441 HG12 ILE 71 HG12 ILE 71 -1.086 3.540 6.102 442 HG13 ILE 71 HG11 ILE 71 0.116 3.090 4.898 443 HG21 ILE 71 HG21 ILE 71 0.903 4.779 3.229 444 HG22 ILE 71 HG22 ILE 71 1.405 5.825 4.558 445 HG23 ILE 71 HG23 ILE 71 0.311 6.438 3.318 446 HD11 ILE 71 HD11 ILE 71 1.737 4.572 6.057 447 HD12 ILE 71 HD12 ILE 71 1.173 3.217 7.031 448 HD13 ILE 71 HD13 ILE 71 0.527 4.833 7.314 449 H ALA 72 HN ALA 72 0.113 8.409 5.760 450 HA ALA 72 HA ALA 72 -1.684 9.974 4.144 451 HB1 ALA 72 HB1 ALA 72 -0.075 11.799 4.544 452 HB2 ALA 72 HB2 ALA 72 1.000 10.653 5.343 453 HB3 ALA 72 HB3 ALA 72 -0.581 11.010 6.039 454 H ASP 73 HN ASP 73 -0.918 11.189 2.249 455 HA ASP 73 HA ASP 73 0.221 9.442 0.335 456 HB2 ASP 73 HB2 ASP 73 -0.807 12.215 0.344 457 HB3 ASP 73 HB1 ASP 73 0.358 11.830 -0.918 458 H ASN 74 HN ASN 74 1.541 12.150 2.167 459 HA ASN 74 HA ASN 74 4.062 12.035 0.747 460 HB2 ASN 74 HB2 ASN 74 4.699 13.953 1.978 461 HB3 ASN 74 HB1 ASN 74 2.982 14.164 1.638 462 HD21 ASN 74 HD21 ASN 74 5.296 14.375 3.965 463 HD22 ASN 74 HD22 ASN 74 4.292 14.310 5.375 464 H HIS 75 HN HIS 75 2.842 9.968 2.860 465 HA HIS 75 HA HIS 75 4.885 9.824 4.848 466 HB2 HIS 75 HB2 HIS 75 2.479 8.284 4.144 467 HB3 HIS 75 HB1 HIS 75 3.781 7.322 4.836 468 HD2 HIS 75 HD2 HIS 75 4.628 9.942 6.900 469 HE1 HIS 75 HE1 HIS 75 0.894 8.852 8.564 470 HE2 HIS 75 HE2 HIS 75 3.140 9.933 9.026 471 H THR 76 HN THR 76 6.423 8.129 5.105 472 HA THR 76 HA THR 76 7.226 6.766 2.626 473 HB THR 76 HB THR 76 9.473 7.610 4.320 474 HG1 THR 76 HG1 THR 76 7.577 9.437 3.637 475 HG21 THR 76 HG21 THR 76 9.354 6.652 1.868 476 HG22 THR 76 HG22 THR 76 10.592 7.820 2.322 477 HG23 THR 76 HG23 THR 76 9.158 8.353 1.449 478 HA PRO 77 HA PRO 77 7.429 3.218 5.320 479 HB2 PRO 77 HB2 PRO 77 9.753 2.288 3.745 480 HB3 PRO 77 HB1 PRO 77 8.186 1.508 4.002 481 HG2 PRO 77 HG2 PRO 77 8.788 2.579 1.645 482 HG3 PRO 77 HG1 PRO 77 7.149 2.695 2.314 483 HD2 PRO 77 HD2 PRO 77 9.303 4.766 2.241 484 HD3 PRO 77 HD1 PRO 77 7.560 4.941 1.944 485 H LYS 78 HN LYS 78 9.969 5.415 4.956 486 HA LYS 78 HA LYS 78 11.947 4.227 6.601 487 HB2 LYS 78 HB2 LYS 78 12.390 6.072 4.994 488 HB3 LYS 78 HB1 LYS 78 11.459 7.155 6.015 489 HG2 LYS 78 HG2 LYS 78 13.719 7.584 6.495 490 HG3 LYS 78 HG1 LYS 78 13.102 6.647 7.855 491 HD2 LYS 78 HD2 LYS 78 15.268 5.807 7.264 492 HD3 LYS 78 HD1 LYS 78 14.059 4.605 6.808 493 HE2 LYS 78 HE2 LYS 78 14.225 5.173 4.516 494 HE3 LYS 78 HE1 LYS 78 15.130 6.642 4.871 495 HZ1 LYS 78 HZ1 LYS 78 16.092 3.858 5.229 496 HZ2 LYS 78 HZ2 LYS 78 16.956 5.243 5.669 497 HZ3 LYS 78 HZ3 LYS 78 16.597 4.952 4.043 498 H GLU 79 HN GLU 79 9.076 6.113 7.219 499 HA GLU 79 HA GLU 79 9.753 6.174 10.079 500 HB2 GLU 79 HB2 GLU 79 7.897 7.908 10.205 501 HB3 GLU 79 HB1 GLU 79 9.375 8.398 9.390 502 HG2 GLU 79 HG2 GLU 79 8.264 7.883 7.220 503 HG3 GLU 79 HG1 GLU 79 6.768 7.611 8.115 504 H LEU 80 HN LEU 80 7.584 6.192 11.418 505 HA LEU 80 HA LEU 80 5.733 5.117 12.158 506 HB2 LEU 80 HB2 LEU 80 5.477 4.312 9.270 507 HB3 LEU 80 HB1 LEU 80 4.349 3.775 10.501 508 HG LEU 80 HG LEU 80 4.884 6.686 9.910 509 HD11 LEU 80 HD11 LEU 80 2.698 6.618 8.730 510 HD12 LEU 80 HD12 LEU 80 2.752 4.856 8.830 511 HD13 LEU 80 HD13 LEU 80 3.982 5.727 7.914 512 HD21 LEU 80 HD21 LEU 80 2.657 5.296 11.399 513 HD22 LEU 80 HD22 LEU 80 2.784 7.031 11.107 514 HD23 LEU 80 HD23 LEU 80 3.970 6.221 12.128 515 H GLY 81 HN GLY 81 8.215 3.422 10.474 516 HA2 GLY 81 HA2 GLY 81 9.373 1.579 11.338 517 HA3 GLY 81 HA1 GLY 81 8.038 1.285 12.439 518 H MET 82 HN MET 82 7.906 1.648 8.919 519 HA MET 82 HA MET 82 6.356 -0.752 8.667 520 HB2 MET 82 HB2 MET 82 6.994 1.517 7.040 521 HB3 MET 82 HB1 MET 82 7.350 0.052 6.135 522 HG2 MET 82 HG2 MET 82 5.106 -0.740 6.422 523 HG3 MET 82 HG1 MET 82 4.728 0.606 7.496 524 HE1 MET 82 HE1 MET 82 2.871 -0.106 5.091 525 HE2 MET 82 HE2 MET 82 2.582 1.474 4.363 526 HE3 MET 82 HE3 MET 82 2.592 1.300 6.118 527 H GLU 83 HN GLU 83 7.195 -2.727 8.698 528 HA GLU 83 HA GLU 83 9.959 -3.083 7.707 529 HB2 GLU 83 HB2 GLU 83 8.454 -4.554 9.867 530 HB3 GLU 83 HB1 GLU 83 9.995 -5.094 9.216 531 HG2 GLU 83 HG2 GLU 83 11.020 -2.984 9.935 532 HG3 GLU 83 HG1 GLU 83 9.478 -2.495 10.639 533 H GLU 84 HN GLU 84 10.237 -5.654 7.361 534 HA GLU 84 HA GLU 84 8.724 -6.238 5.012 535 HB2 GLU 84 HB2 GLU 84 11.017 -6.917 5.068 536 HB3 GLU 84 HB1 GLU 84 10.798 -7.776 6.583 537 HG2 GLU 84 HG2 GLU 84 11.012 -9.339 4.764 538 HG3 GLU 84 HG1 GLU 84 9.385 -9.421 5.433 539 H GLU 85 HN GLU 85 7.111 -7.718 4.712 540 HA GLU 85 HA GLU 85 5.347 -9.055 5.187 541 HB2 GLU 85 HB2 GLU 85 7.278 -9.919 7.308 542 HB3 GLU 85 HB1 GLU 85 5.621 -10.506 7.355 543 HG2 GLU 85 HG2 GLU 85 7.353 -10.761 4.918 544 HG3 GLU 85 HG1 GLU 85 7.315 -11.975 6.195 545 H ASP 86 HN ASP 86 5.491 -6.315 6.197 546 HA ASP 86 HA ASP 86 4.090 -6.340 8.723 547 HB2 ASP 86 HB2 ASP 86 5.439 -4.369 7.135 548 HB3 ASP 86 HB1 ASP 86 3.799 -3.813 7.454 549 H VAL 87 HN VAL 87 1.916 -5.732 9.026 550 HA VAL 87 HA VAL 87 0.246 -6.420 6.721 551 HB VAL 87 HB VAL 87 -0.606 -6.220 9.608 552 HG11 VAL 87 HG11 VAL 87 -2.457 -6.038 8.086 553 HG12 VAL 87 HG12 VAL 87 -2.484 -7.637 8.826 554 HG13 VAL 87 HG13 VAL 87 -1.900 -7.441 7.175 555 HG21 VAL 87 HG21 VAL 87 0.241 -8.659 8.047 556 HG22 VAL 87 HG22 VAL 87 -0.457 -8.667 9.666 557 HG23 VAL 87 HG23 VAL 87 1.119 -7.925 9.389 558 H ILE 88 HN ILE 88 -0.814 -4.928 5.661 559 HA ILE 88 HA ILE 88 -1.674 -2.494 7.064 560 HB ILE 88 HB ILE 88 0.246 -1.839 5.747 561 HG12 ILE 88 HG12 ILE 88 -2.235 -0.989 4.247 562 HG13 ILE 88 HG11 ILE 88 -1.776 -0.349 5.822 563 HG21 ILE 88 HG21 ILE 88 0.407 -2.168 3.356 564 HG22 ILE 88 HG22 ILE 88 -1.152 -2.993 3.340 565 HG23 ILE 88 HG23 ILE 88 0.224 -3.723 4.168 566 HD11 ILE 88 HD11 ILE 88 0.374 0.399 4.781 567 HD12 ILE 88 HD12 ILE 88 -1.071 1.208 4.180 568 HD13 ILE 88 HD13 ILE 88 -0.303 -0.057 3.219 569 H GLU 89 HN GLU 89 -3.752 -1.875 6.626 570 HA GLU 89 HA GLU 89 -5.295 -3.725 4.940 571 HB2 GLU 89 HB2 GLU 89 -6.331 -1.757 6.983 572 HB3 GLU 89 HB1 GLU 89 -7.241 -3.029 6.187 573 HG2 GLU 89 HG2 GLU 89 -6.156 -4.715 7.401 574 HG3 GLU 89 HG1 GLU 89 -4.888 -3.618 7.947 575 H VAL 90 HN VAL 90 -7.007 -2.909 3.615 576 HA VAL 90 HA VAL 90 -6.895 -0.074 2.932 577 HB VAL 90 HB VAL 90 -5.329 -1.101 1.375 578 HG11 VAL 90 HG11 VAL 90 -7.612 -2.869 0.517 579 HG12 VAL 90 HG12 VAL 90 -6.177 -3.383 1.403 580 HG13 VAL 90 HG13 VAL 90 -6.024 -2.782 -0.248 581 HG21 VAL 90 HG21 VAL 90 -7.933 -0.351 0.054 582 HG22 VAL 90 HG22 VAL 90 -6.355 -0.387 -0.737 583 HG23 VAL 90 HG23 VAL 90 -6.662 0.759 0.569 584 H TYR 91 HN TYR 91 -8.893 0.717 2.810 585 HA TYR 91 HA TYR 91 -11.091 -1.042 1.960 586 HB2 TYR 91 HB2 TYR 91 -11.233 0.768 4.386 587 HB3 TYR 91 HB1 TYR 91 -12.527 -0.256 3.769 588 HD1 TYR 91 HD1 TYR 91 -12.173 -2.772 3.790 589 HD2 TYR 91 HD2 TYR 91 -9.666 -0.075 5.919 590 HE1 TYR 91 HE1 TYR 91 -11.365 -4.631 5.182 591 HE2 TYR 91 HE2 TYR 91 -8.854 -1.924 7.318 592 HH TYR 91 HH TYR 91 -8.946 -4.091 7.756 593 H GLN 92 HN GLN 92 -13.025 0.166 1.288 594 HA GLN 92 HA GLN 92 -12.287 2.485 -0.230 595 HB2 GLN 92 HB2 GLN 92 -13.898 0.717 -1.018 596 HB3 GLN 92 HB1 GLN 92 -15.057 1.341 0.149 597 HG2 GLN 92 HG2 GLN 92 -14.659 3.606 -1.039 598 HG3 GLN 92 HG1 GLN 92 -14.014 2.613 -2.345 599 HE21 GLN 92 HE21 GLN 92 -16.848 3.489 -0.534 600 HE22 GLN 92 HE22 GLN 92 -18.002 2.769 -1.606 601 H GLU 93 HN GLU 93 -12.859 4.577 0.058 602 HA GLU 93 HA GLU 93 -13.581 5.399 2.723 603 HB2 GLU 93 HB2 GLU 93 -12.916 6.884 0.185 604 HB3 GLU 93 HB1 GLU 93 -13.420 7.715 1.649 605 HG2 GLU 93 HG2 GLU 93 -11.154 5.789 1.773 606 HG3 GLU 93 HG1 GLU 93 -10.895 7.398 1.101 607 H GLN 94 HN GLN 94 -15.291 7.038 3.085 608 HA GLN 94 HA GLN 94 -17.786 6.092 2.113 609 HB2 GLN 94 HB2 GLN 94 -17.403 7.097 4.378 610 HB3 GLN 94 HB1 GLN 94 -17.239 8.664 3.602 611 HG2 GLN 94 HG2 GLN 94 -19.482 8.737 2.996 612 HG3 GLN 94 HG1 GLN 94 -19.700 7.004 3.224 613 HE21 GLN 94 HE21 GLN 94 -19.949 6.191 5.303 614 HE22 GLN 94 HE22 GLN 94 -20.359 7.207 6.640 615 H THR 95 HN THR 95 -15.594 8.551 1.100 616 HA THR 95 HA THR 95 -17.381 10.178 -0.374 617 HB THR 95 HB THR 95 -14.598 9.954 -1.339 618 HG1 THR 95 HG1 THR 95 -14.884 11.216 1.142 619 HG21 THR 95 HG21 THR 95 -15.977 11.791 -2.064 620 HG22 THR 95 HG22 THR 95 -14.726 12.426 -0.994 621 HG23 THR 95 HG23 THR 95 -16.371 12.208 -0.398 622 H GLY 96 HN GLY 96 -15.735 7.183 -1.054 623 HA2 GLY 96 HA2 GLY 96 -16.439 5.690 -2.751 624 HA3 GLY 96 HA1 GLY 96 -17.124 7.048 -3.628 625 H GLY 97 HN GLY 97 -14.941 8.772 -3.643 626 HA2 GLY 97 HA2 GLY 97 -12.460 8.255 -4.197 627 HA3 GLY 97 HA1 GLY 97 -13.191 7.343 -5.511 628 H1 ASN 357 HT1 ASN 357 -4.291 -20.544 -3.592 629 H2 ASN 357 HT2 ASN 357 -3.904 -20.420 -1.952 630 H3 ASN 357 HT3 ASN 357 -2.893 -21.283 -2.995 631 HA ASN 357 HA ASN 357 -1.935 -19.162 -2.473 632 HB2 ASN 357 HB2 ASN 357 -1.622 -18.324 -4.784 633 HB3 ASN 357 HB1 ASN 357 -1.457 -20.069 -4.674 634 HD21 ASN 357 HD21 ASN 357 -3.003 -17.513 -6.238 635 HD22 ASN 357 HD22 ASN 357 -4.163 -18.440 -7.123 636 H ASN 358 HN ASN 358 -2.409 -17.277 -1.582 637 HA ASN 358 HA ASN 358 -4.720 -15.770 -2.624 638 HB2 ASN 358 HB2 ASN 358 -5.435 -15.171 -0.432 639 HB3 ASN 358 HB1 ASN 358 -5.196 -16.912 -0.408 640 HD21 ASN 358 HD21 ASN 358 -5.228 -15.020 1.778 641 HD22 ASN 358 HD22 ASN 358 -3.701 -15.161 2.571 642 H ARG 359 HN ARG 359 -1.561 -15.792 -2.505 643 HA ARG 359 HA ARG 359 -1.151 -13.008 -1.703 644 HB2 ARG 359 HB2 ARG 359 1.179 -14.549 -2.624 645 HB3 ARG 359 HB1 ARG 359 0.993 -13.543 -1.195 646 HG2 ARG 359 HG2 ARG 359 -0.499 -16.060 -1.080 647 HG3 ARG 359 HG1 ARG 359 1.247 -16.257 -1.204 648 HD2 ARG 359 HD2 ARG 359 0.881 -14.231 0.679 649 HD3 ARG 359 HD1 ARG 359 -0.366 -15.421 1.045 650 HE ARG 359 HE ARG 359 2.232 -16.576 0.637 651 HH11 ARG 359 HH11 ARG 359 0.119 -15.000 2.972 652 HH12 ARG 359 HH12 ARG 359 0.900 -15.803 4.386 653 HH21 ARG 359 HH21 ARG 359 3.291 -17.552 2.417 654 HH22 ARG 359 HH22 ARG 359 2.678 -17.213 4.080 655 H ASP 360 HN ASP 360 -0.425 -11.463 -3.129 656 HA ASP 360 HA ASP 360 0.067 -12.256 -5.916 657 HB2 ASP 360 HB2 ASP 360 -2.319 -11.534 -5.687 658 HB3 ASP 360 HB1 ASP 360 -1.750 -9.958 -5.143 659 HA PRO 361 HA PRO 361 3.342 -9.340 -4.615 660 HB2 PRO 361 HB2 PRO 361 5.012 -10.835 -6.477 661 HB3 PRO 361 HB1 PRO 361 5.178 -10.670 -4.724 662 HG2 PRO 361 HG2 PRO 361 4.493 -13.005 -5.888 663 HG3 PRO 361 HG1 PRO 361 3.919 -12.531 -4.277 664 HD2 PRO 361 HD2 PRO 361 2.492 -12.369 -6.907 665 HD3 PRO 361 HD1 PRO 361 1.887 -12.921 -5.330 666 H ILE 362 HN ILE 362 3.705 -7.434 -5.577 667 HA ILE 362 HA ILE 362 3.745 -7.295 -8.509 668 HB ILE 362 HB ILE 362 2.214 -5.382 -6.746 669 HG12 ILE 362 HG12 ILE 362 0.531 -6.476 -8.697 670 HG13 ILE 362 HG11 ILE 362 1.458 -7.839 -8.075 671 HG21 ILE 362 HG21 ILE 362 2.533 -5.432 -9.743 672 HG22 ILE 362 HG22 ILE 362 3.241 -4.252 -8.644 673 HG23 ILE 362 HG23 ILE 362 1.490 -4.333 -8.839 674 HD11 ILE 362 HD11 ILE 362 -0.160 -5.904 -6.437 675 HD12 ILE 362 HD12 ILE 362 0.775 -7.261 -5.807 676 HD13 ILE 362 HD13 ILE 362 -0.613 -7.558 -6.854 677 H VAL 363 HN VAL 363 5.190 -5.895 -9.393 678 HA VAL 363 HA VAL 363 6.871 -4.385 -7.497 679 HB VAL 363 HB VAL 363 7.714 -5.200 -10.272 680 HG11 VAL 363 HG11 VAL 363 9.960 -4.882 -9.389 681 HG12 VAL 363 HG12 VAL 363 9.292 -4.487 -7.805 682 HG13 VAL 363 HG13 VAL 363 8.990 -3.424 -9.180 683 HG21 VAL 363 HG21 VAL 363 8.093 -6.764 -7.720 684 HG22 VAL 363 HG22 VAL 363 8.904 -7.106 -9.248 685 HG23 VAL 363 HG23 VAL 363 7.150 -7.255 -9.127 686 H ILE 364 HN ILE 364 7.005 -2.220 -7.726 687 HA ILE 364 HA ILE 364 5.437 -0.977 -9.850 688 HB ILE 364 HB ILE 364 5.783 1.123 -8.551 689 HG12 ILE 364 HG12 ILE 364 6.591 -0.177 -6.089 690 HG13 ILE 364 HG11 ILE 364 7.828 -0.353 -7.331 691 HG21 ILE 364 HG21 ILE 364 4.303 0.482 -6.691 692 HG22 ILE 364 HG22 ILE 364 4.614 -1.216 -7.053 693 HG23 ILE 364 HG23 ILE 364 3.787 -0.202 -8.235 694 HD11 ILE 364 HD11 ILE 364 7.886 2.051 -7.639 695 HD12 ILE 364 HD12 ILE 364 8.192 1.625 -5.955 696 HD13 ILE 364 HD13 ILE 364 6.615 2.249 -6.435 697 H SER 365 HN SER 365 6.476 1.384 -10.342 698 HA SER 365 HA SER 365 9.216 0.859 -11.299 699 HB2 SER 365 HB2 SER 365 7.356 2.809 -12.627 700 HB3 SER 365 HB1 SER 365 8.746 1.964 -13.308 701 HG SER 365 HG SER 365 7.277 0.017 -12.730 702 H ASP 366 HN ASP 366 10.591 1.972 -10.048 703 HA ASP 366 HA ASP 366 9.841 4.441 -8.752 704 HB2 ASP 366 HB2 ASP 366 11.300 2.844 -7.598 705 HB3 ASP 366 HB1 ASP 366 12.493 2.983 -8.884 706 H SER 367 HN SER 367 10.210 6.460 -9.492 707 HA SER 367 HA SER 367 12.171 6.852 -11.626 708 HB2 SER 367 HB2 SER 367 10.119 8.496 -12.434 709 HB3 SER 367 HB1 SER 367 10.499 6.922 -13.131 710 HG SER 367 HG SER 367 8.959 5.981 -11.834 711 HA PRO 368 HA PRO 368 12.955 10.515 -9.244 712 HB2 PRO 368 HB2 PRO 368 14.757 11.681 -10.859 713 HB3 PRO 368 HB1 PRO 368 15.132 10.195 -9.978 714 HG2 PRO 368 HG2 PRO 368 14.429 10.547 -12.846 715 HG3 PRO 368 HG1 PRO 368 15.589 9.435 -12.097 716 HD2 PRO 368 HD2 PRO 368 13.038 8.748 -12.915 717 HD3 PRO 368 HD1 PRO 368 14.011 7.849 -11.736 Start of MODEL 5 1 H TYR 21 HT1 TYR 21 14.550 -5.012 -2.325 2 HA TYR 21 HA TYR 21 13.332 -3.384 -1.075 3 HB2 TYR 21 HB2 TYR 21 11.656 -5.113 -2.899 4 HB3 TYR 21 HB1 TYR 21 11.144 -3.534 -2.321 5 HD1 TYR 21 HD1 TYR 21 13.769 -2.078 -2.535 6 HD2 TYR 21 HD2 TYR 21 11.812 -4.749 -5.207 7 HE1 TYR 21 HE1 TYR 21 14.907 -1.008 -4.432 8 HE2 TYR 21 HE2 TYR 21 12.950 -3.687 -7.110 9 HH TYR 21 HH TYR 21 14.009 -1.626 -7.693 10 H ILE 22 HN ILE 22 11.023 -3.011 -0.180 11 HA ILE 22 HA ILE 22 10.641 -4.983 1.954 12 HB ILE 22 HB ILE 22 9.427 -2.221 1.751 13 HG12 ILE 22 HG12 ILE 22 11.874 -2.049 1.802 14 HG13 ILE 22 HG11 ILE 22 11.170 -1.475 3.308 15 HG21 ILE 22 HG21 ILE 22 8.234 -3.727 3.236 16 HG22 ILE 22 HG22 ILE 22 9.068 -2.478 4.164 17 HG23 ILE 22 HG23 ILE 22 9.736 -4.109 4.084 18 HD11 ILE 22 HD11 ILE 22 13.142 -2.766 3.763 19 HD12 ILE 22 HD12 ILE 22 12.502 -4.130 2.848 20 HD13 ILE 22 HD13 ILE 22 11.725 -3.634 4.350 21 H LYS 23 HN LYS 23 8.954 -6.318 1.904 22 HA LYS 23 HA LYS 23 6.828 -5.768 -0.058 23 HB2 LYS 23 HB2 LYS 23 8.199 -7.899 -0.166 24 HB3 LYS 23 HB1 LYS 23 7.401 -8.382 1.322 25 HG2 LYS 23 HG2 LYS 23 5.218 -8.158 0.142 26 HG3 LYS 23 HG1 LYS 23 6.118 -7.875 -1.350 27 HD2 LYS 23 HD2 LYS 23 5.598 -10.182 -1.348 28 HD3 LYS 23 HD1 LYS 23 7.297 -10.073 -0.885 29 HE2 LYS 23 HE2 LYS 23 5.288 -10.038 1.294 30 HE3 LYS 23 HE1 LYS 23 5.533 -11.567 0.451 31 HZ1 LYS 23 HZ1 LYS 23 6.970 -11.464 2.341 32 HZ2 LYS 23 HZ2 LYS 23 7.603 -9.964 1.866 33 HZ3 LYS 23 HZ3 LYS 23 7.924 -11.349 0.946 34 H LEU 24 HN LEU 24 4.997 -4.994 0.701 35 HA LEU 24 HA LEU 24 4.317 -5.440 3.525 36 HB2 LEU 24 HB2 LEU 24 3.141 -3.439 1.595 37 HB3 LEU 24 HB1 LEU 24 2.859 -3.515 3.325 38 HG LEU 24 HG LEU 24 5.524 -2.893 2.042 39 HD11 LEU 24 HD11 LEU 24 3.868 -1.134 1.643 40 HD12 LEU 24 HD12 LEU 24 5.129 -0.606 2.759 41 HD13 LEU 24 HD13 LEU 24 3.539 -1.057 3.375 42 HD21 LEU 24 HD21 LEU 24 5.779 -3.921 4.217 43 HD22 LEU 24 HD22 LEU 24 4.600 -2.810 4.911 44 HD23 LEU 24 HD23 LEU 24 6.145 -2.199 4.325 45 H LYS 25 HN LYS 25 2.447 -6.403 4.130 46 HA LYS 25 HA LYS 25 0.949 -7.773 2.028 47 HB2 LYS 25 HB2 LYS 25 1.345 -8.176 4.958 48 HB3 LYS 25 HB1 LYS 25 -0.119 -8.799 4.213 49 HG2 LYS 25 HG2 LYS 25 1.233 -10.098 2.645 50 HG3 LYS 25 HG1 LYS 25 2.700 -9.484 3.409 51 HD2 LYS 25 HD2 LYS 25 1.878 -11.792 4.125 52 HD3 LYS 25 HD1 LYS 25 2.285 -10.645 5.401 53 HE2 LYS 25 HE2 LYS 25 0.080 -10.319 5.992 54 HE3 LYS 25 HE1 LYS 25 -0.527 -10.787 4.405 55 HZ1 LYS 25 HZ1 LYS 25 -0.194 -13.040 4.875 56 HZ2 LYS 25 HZ2 LYS 25 -0.918 -12.401 6.269 57 HZ3 LYS 25 HZ3 LYS 25 0.746 -12.719 6.249 58 H VAL 26 HN VAL 26 -0.651 -6.570 1.222 59 HA VAL 26 HA VAL 26 -2.216 -4.877 3.026 60 HB VAL 26 HB VAL 26 -2.729 -5.046 0.078 61 HG11 VAL 26 HG11 VAL 26 -3.369 -2.715 0.367 62 HG12 VAL 26 HG12 VAL 26 -2.893 -2.787 2.065 63 HG13 VAL 26 HG13 VAL 26 -4.245 -3.760 1.486 64 HG21 VAL 26 HG21 VAL 26 -0.530 -3.410 1.334 65 HG22 VAL 26 HG22 VAL 26 -1.065 -3.310 -0.342 66 HG23 VAL 26 HG23 VAL 26 -0.308 -4.786 0.256 67 H ILE 27 HN ILE 27 -4.067 -5.579 3.825 68 HA ILE 27 HA ILE 27 -5.228 -8.050 2.819 69 HB ILE 27 HB ILE 27 -6.197 -6.395 5.153 70 HG12 ILE 27 HG12 ILE 27 -3.846 -6.967 5.521 71 HG13 ILE 27 HG11 ILE 27 -4.879 -7.902 6.594 72 HG21 ILE 27 HG21 ILE 27 -7.171 -8.519 5.906 73 HG22 ILE 27 HG22 ILE 27 -6.574 -9.305 4.444 74 HG23 ILE 27 HG23 ILE 27 -7.796 -8.036 4.330 75 HD11 ILE 27 HD11 ILE 27 -4.641 -9.843 5.135 76 HD12 ILE 27 HD12 ILE 27 -3.073 -9.256 5.685 77 HD13 ILE 27 HD13 ILE 27 -3.620 -8.904 4.047 78 H GLY 28 HN GLY 28 -6.615 -7.936 1.202 79 HA2 GLY 28 HA2 GLY 28 -8.133 -5.528 0.681 80 HA3 GLY 28 HA1 GLY 28 -8.123 -6.991 -0.291 81 H GLN 29 HN GLN 29 -10.445 -5.547 0.321 82 HA GLN 29 HA GLN 29 -11.871 -6.632 2.525 83 HB2 GLN 29 HB2 GLN 29 -12.417 -4.473 1.417 84 HB3 GLN 29 HB1 GLN 29 -12.943 -5.359 -0.004 85 HG2 GLN 29 HG2 GLN 29 -14.812 -4.608 1.393 86 HG3 GLN 29 HG1 GLN 29 -14.748 -6.363 1.229 87 HE21 GLN 29 HE21 GLN 29 -14.346 -7.617 3.007 88 HE22 GLN 29 HE22 GLN 29 -14.329 -6.991 4.618 89 H ASP 30 HN ASP 30 -10.997 -7.904 -0.479 90 HA ASP 30 HA ASP 30 -13.225 -9.794 -0.562 91 HB2 ASP 30 HB2 ASP 30 -12.200 -10.515 -2.728 92 HB3 ASP 30 HB1 ASP 30 -12.694 -8.829 -2.699 93 H SER 31 HN SER 31 -10.635 -9.606 1.204 94 HA SER 31 HA SER 31 -9.401 -11.055 2.422 95 HB2 SER 31 HB2 SER 31 -10.960 -13.293 1.124 96 HB3 SER 31 HB1 SER 31 -10.104 -13.335 2.664 97 HG SER 31 HG SER 31 -12.598 -12.327 2.045 98 H SER 32 HN SER 32 -8.096 -10.129 0.298 99 HA SER 32 HA SER 32 -6.724 -12.496 -0.783 100 HB2 SER 32 HB2 SER 32 -6.044 -10.979 -2.691 101 HB3 SER 32 HB1 SER 32 -7.763 -11.362 -2.617 102 HG SER 32 HG SER 32 -8.220 -9.339 -1.955 103 H GLU 33 HN GLU 33 -4.510 -12.570 -0.711 104 HA GLU 33 HA GLU 33 -3.237 -10.725 1.139 105 HB2 GLU 33 HB2 GLU 33 -2.671 -13.434 0.101 106 HB3 GLU 33 HB1 GLU 33 -1.256 -12.431 0.385 107 HG2 GLU 33 HG2 GLU 33 -2.273 -12.015 2.704 108 HG3 GLU 33 HG1 GLU 33 -3.289 -13.411 2.345 109 H ILE 34 HN ILE 34 -3.161 -8.848 -0.179 110 HA ILE 34 HA ILE 34 -1.770 -8.969 -2.711 111 HB ILE 34 HB ILE 34 -2.629 -6.519 -1.173 112 HG12 ILE 34 HG12 ILE 34 -4.558 -7.966 -1.633 113 HG13 ILE 34 HG11 ILE 34 -4.618 -6.510 -2.620 114 HG21 ILE 34 HG21 ILE 34 -0.993 -5.979 -2.833 115 HG22 ILE 34 HG22 ILE 34 -2.574 -5.476 -3.436 116 HG23 ILE 34 HG23 ILE 34 -1.828 -6.954 -4.042 117 HD11 ILE 34 HD11 ILE 34 -5.269 -8.386 -3.953 118 HD12 ILE 34 HD12 ILE 34 -3.811 -9.269 -3.505 119 HD13 ILE 34 HD13 ILE 34 -3.693 -7.825 -4.508 120 H HIS 35 HN HIS 35 0.340 -9.359 -2.608 121 HA HIS 35 HA HIS 35 1.919 -8.212 -0.441 122 HB2 HIS 35 HB2 HIS 35 2.514 -10.253 -2.579 123 HB3 HIS 35 HB1 HIS 35 3.771 -9.583 -1.546 124 HD2 HIS 35 HD2 HIS 35 0.472 -10.269 0.293 125 HE1 HIS 35 HE1 HIS 35 3.095 -13.495 1.067 126 HE2 HIS 35 HE2 HIS 35 0.857 -12.455 1.643 127 H PHE 36 HN PHE 36 1.829 -6.044 -1.047 128 HA PHE 36 HA PHE 36 2.790 -5.214 -3.639 129 HB2 PHE 36 HB2 PHE 36 1.106 -4.096 -1.785 130 HB3 PHE 36 HB1 PHE 36 2.585 -3.174 -1.535 131 HD1 PHE 36 HD1 PHE 36 0.476 -4.410 -4.352 132 HD2 PHE 36 HD2 PHE 36 2.858 -1.263 -2.774 133 HE1 PHE 36 HE1 PHE 36 -0.078 -3.021 -6.304 134 HE2 PHE 36 HE2 PHE 36 2.308 0.132 -4.724 135 HZ PHE 36 HZ PHE 36 0.839 -0.744 -6.490 136 H LYS 37 HN LYS 37 4.885 -5.123 -4.128 137 HA LYS 37 HA LYS 37 6.844 -4.937 -1.965 138 HB2 LYS 37 HB2 LYS 37 7.098 -6.615 -3.811 139 HB3 LYS 37 HB1 LYS 37 7.333 -5.278 -4.932 140 HG2 LYS 37 HG2 LYS 37 9.381 -4.687 -3.972 141 HG3 LYS 37 HG1 LYS 37 9.068 -5.630 -2.514 142 HD2 LYS 37 HD2 LYS 37 9.218 -6.997 -5.170 143 HD3 LYS 37 HD1 LYS 37 10.701 -6.546 -4.330 144 HE2 LYS 37 HE2 LYS 37 9.936 -7.810 -2.355 145 HE3 LYS 37 HE1 LYS 37 8.495 -8.297 -3.248 146 HZ1 LYS 37 HZ1 LYS 37 9.987 -9.347 -4.892 147 HZ2 LYS 37 HZ2 LYS 37 10.099 -10.043 -3.356 148 HZ3 LYS 37 HZ3 LYS 37 11.307 -8.992 -3.895 149 H VAL 38 HN VAL 38 7.524 -3.018 -1.311 150 HA VAL 38 HA VAL 38 7.338 -0.750 -3.170 151 HB VAL 38 HB VAL 38 7.212 0.711 -1.283 152 HG11 VAL 38 HG11 VAL 38 5.483 -1.696 -0.721 153 HG12 VAL 38 HG12 VAL 38 5.140 -0.458 -1.929 154 HG13 VAL 38 HG13 VAL 38 5.168 -0.036 -0.217 155 HG21 VAL 38 HG21 VAL 38 7.691 -1.701 0.467 156 HG22 VAL 38 HG22 VAL 38 7.346 -0.064 1.028 157 HG23 VAL 38 HG23 VAL 38 8.847 -0.402 0.162 158 H LYS 39 HN LYS 39 8.970 0.929 -2.994 159 HA LYS 39 HA LYS 39 11.650 -0.220 -2.654 160 HB2 LYS 39 HB2 LYS 39 11.092 0.654 -4.898 161 HB3 LYS 39 HB1 LYS 39 10.752 2.230 -4.199 162 HG2 LYS 39 HG2 LYS 39 13.071 2.483 -3.557 163 HG3 LYS 39 HG1 LYS 39 13.435 0.860 -4.155 164 HD2 LYS 39 HD2 LYS 39 12.877 1.526 -6.414 165 HD3 LYS 39 HD1 LYS 39 12.371 3.121 -5.850 166 HE2 LYS 39 HE2 LYS 39 14.639 3.620 -5.146 167 HE3 LYS 39 HE1 LYS 39 15.162 2.003 -5.608 168 HZ1 LYS 39 HZ1 LYS 39 15.661 3.810 -7.242 169 HZ2 LYS 39 HZ2 LYS 39 13.996 3.931 -7.539 170 HZ3 LYS 39 HZ3 LYS 39 14.818 2.490 -7.875 171 H MET 40 HN MET 40 12.691 0.322 -0.844 172 HA MET 40 HA MET 40 11.763 2.405 0.874 173 HB2 MET 40 HB2 MET 40 12.741 0.359 1.790 174 HB3 MET 40 HB1 MET 40 14.277 0.724 1.014 175 HG2 MET 40 HG2 MET 40 14.427 1.279 3.337 176 HG3 MET 40 HG1 MET 40 14.444 2.767 2.396 177 HE1 MET 40 HE1 MET 40 12.938 0.919 5.340 178 HE2 MET 40 HE2 MET 40 11.880 0.280 4.079 179 HE3 MET 40 HE3 MET 40 11.226 1.347 5.325 180 H THR 41 HN THR 41 11.919 4.172 -0.605 181 HA THR 41 HA THR 41 13.985 5.924 -0.105 182 HB THR 41 HB THR 41 14.778 4.045 -2.096 183 HG1 THR 41 HG1 THR 41 15.795 6.209 -0.694 184 HG21 THR 41 HG21 THR 41 13.628 5.411 -3.774 185 HG22 THR 41 HG22 THR 41 15.379 5.527 -3.967 186 HG23 THR 41 HG23 THR 41 14.485 6.846 -3.210 187 H THR 42 HN THR 42 11.466 4.804 -2.221 188 HA THR 42 HA THR 42 10.858 7.500 -3.133 189 HB THR 42 HB THR 42 9.230 5.058 -3.788 190 HG1 THR 42 HG1 THR 42 11.005 5.426 -5.722 191 HG21 THR 42 HG21 THR 42 8.378 7.222 -4.530 192 HG22 THR 42 HG22 THR 42 8.901 6.267 -5.919 193 HG23 THR 42 HG23 THR 42 9.917 7.578 -5.316 194 H HIS 43 HN HIS 43 8.911 8.539 -2.652 195 HA HIS 43 HA HIS 43 7.837 8.101 -0.075 196 HB2 HIS 43 HB2 HIS 43 7.456 10.010 -2.263 197 HB3 HIS 43 HB1 HIS 43 5.969 9.666 -1.387 198 HD2 HIS 43 HD2 HIS 43 6.026 10.345 1.358 199 HE1 HIS 43 HE1 HIS 43 9.398 12.858 0.921 200 HE2 HIS 43 HE2 HIS 43 7.605 12.045 2.515 201 H LEU 44 HN LEU 44 5.655 7.533 0.488 202 HA LEU 44 HA LEU 44 4.754 5.232 -0.926 203 HB2 LEU 44 HB2 LEU 44 3.765 6.738 1.466 204 HB3 LEU 44 HB1 LEU 44 2.785 5.472 0.750 205 HG LEU 44 HG LEU 44 5.627 4.950 1.575 206 HD11 LEU 44 HD11 LEU 44 3.158 4.791 3.295 207 HD12 LEU 44 HD12 LEU 44 4.575 5.809 3.557 208 HD13 LEU 44 HD13 LEU 44 4.709 4.057 3.698 209 HD21 LEU 44 HD21 LEU 44 4.811 2.646 1.733 210 HD22 LEU 44 HD22 LEU 44 4.556 3.313 0.119 211 HD23 LEU 44 HD23 LEU 44 3.204 3.183 1.245 212 H LYS 45 HN LYS 45 4.345 8.438 -1.558 213 HA LYS 45 HA LYS 45 1.667 8.729 -2.275 214 HB2 LYS 45 HB2 LYS 45 3.027 10.676 -2.251 215 HB3 LYS 45 HB1 LYS 45 4.207 9.958 -3.336 216 HG2 LYS 45 HG2 LYS 45 3.023 11.564 -4.594 217 HG3 LYS 45 HG1 LYS 45 2.431 9.987 -5.120 218 HD2 LYS 45 HD2 LYS 45 0.569 10.319 -3.397 219 HD3 LYS 45 HD1 LYS 45 1.078 12.008 -3.357 220 HE2 LYS 45 HE2 LYS 45 0.729 12.138 -5.795 221 HE3 LYS 45 HE1 LYS 45 0.150 10.472 -5.781 222 HZ1 LYS 45 HZ1 LYS 45 -1.835 11.458 -5.547 223 HZ2 LYS 45 HZ2 LYS 45 -1.187 12.899 -4.956 224 HZ3 LYS 45 HZ3 LYS 45 -1.407 11.587 -3.910 225 H LYS 46 HN LYS 46 4.439 7.783 -4.299 226 HA LYS 46 HA LYS 46 2.929 7.235 -6.615 227 HB2 LYS 46 HB2 LYS 46 5.379 7.639 -6.598 228 HB3 LYS 46 HB1 LYS 46 5.614 6.083 -5.814 229 HG2 LYS 46 HG2 LYS 46 6.085 5.867 -8.155 230 HG3 LYS 46 HG1 LYS 46 4.603 4.982 -7.785 231 HD2 LYS 46 HD2 LYS 46 3.366 7.097 -8.504 232 HD3 LYS 46 HD1 LYS 46 4.904 7.622 -9.189 233 HE2 LYS 46 HE2 LYS 46 4.965 5.744 -10.664 234 HE3 LYS 46 HE1 LYS 46 3.585 4.998 -9.857 235 HZ1 LYS 46 HZ1 LYS 46 3.609 7.405 -11.577 236 HZ2 LYS 46 HZ2 LYS 46 2.302 7.032 -10.563 237 HZ3 LYS 46 HZ3 LYS 46 2.751 5.965 -11.801 238 H LEU 47 HN LEU 47 3.864 5.270 -3.870 239 HA LEU 47 HA LEU 47 3.134 2.763 -4.956 240 HB2 LEU 47 HB2 LEU 47 3.585 3.806 -2.188 241 HB3 LEU 47 HB1 LEU 47 2.882 2.215 -2.401 242 HG LEU 47 HG LEU 47 5.239 1.971 -2.044 243 HD11 LEU 47 HD11 LEU 47 5.881 0.708 -3.968 244 HD12 LEU 47 HD12 LEU 47 4.737 1.583 -4.986 245 HD13 LEU 47 HD13 LEU 47 4.147 0.503 -3.722 246 HD21 LEU 47 HD21 LEU 47 5.629 3.841 -4.375 247 HD22 LEU 47 HD22 LEU 47 6.908 2.969 -3.531 248 HD23 LEU 47 HD23 LEU 47 5.970 4.200 -2.683 249 H LYS 48 HN LYS 48 1.371 5.152 -3.036 250 HA LYS 48 HA LYS 48 -0.952 3.627 -2.624 251 HB2 LYS 48 HB2 LYS 48 -0.428 6.587 -2.626 252 HB3 LYS 48 HB1 LYS 48 -2.038 5.938 -2.340 253 HG2 LYS 48 HG2 LYS 48 -1.224 4.709 -0.410 254 HG3 LYS 48 HG1 LYS 48 0.415 5.290 -0.715 255 HD2 LYS 48 HD2 LYS 48 -0.491 6.656 1.007 256 HD3 LYS 48 HD1 LYS 48 -0.485 7.628 -0.464 257 HE2 LYS 48 HE2 LYS 48 -2.865 7.098 -0.799 258 HE3 LYS 48 HE1 LYS 48 -2.857 6.173 0.701 259 HZ1 LYS 48 HZ1 LYS 48 -2.299 8.194 1.902 260 HZ2 LYS 48 HZ2 LYS 48 -3.735 8.399 1.032 261 HZ3 LYS 48 HZ3 LYS 48 -2.299 9.086 0.453 262 H GLU 49 HN GLU 49 -0.160 5.972 -5.199 263 HA GLU 49 HA GLU 49 -2.703 5.704 -6.451 264 HB2 GLU 49 HB2 GLU 49 -1.556 6.790 -8.429 265 HB3 GLU 49 HB1 GLU 49 -1.560 7.710 -6.934 266 HG2 GLU 49 HG2 GLU 49 0.724 7.173 -6.521 267 HG3 GLU 49 HG1 GLU 49 0.757 6.040 -7.870 268 H SER 50 HN SER 50 0.380 4.053 -6.833 269 HA SER 50 HA SER 50 -0.247 2.697 -9.226 270 HB2 SER 50 HB2 SER 50 1.606 1.846 -6.986 271 HB3 SER 50 HB1 SER 50 1.572 1.148 -8.605 272 HG SER 50 HG SER 50 2.279 3.797 -7.862 273 H TYR 51 HN TYR 51 -0.848 1.959 -5.836 274 HA TYR 51 HA TYR 51 -1.792 -0.675 -6.188 275 HB2 TYR 51 HB2 TYR 51 -1.150 0.384 -3.993 276 HB3 TYR 51 HB1 TYR 51 -2.661 1.284 -4.050 277 HD1 TYR 51 HD1 TYR 51 -1.092 -1.900 -3.356 278 HD2 TYR 51 HD2 TYR 51 -4.828 0.064 -3.873 279 HE1 TYR 51 HE1 TYR 51 -2.228 -3.790 -2.280 280 HE2 TYR 51 HE2 TYR 51 -5.978 -1.824 -2.796 281 HH TYR 51 HH TYR 51 -5.579 -4.230 -2.384 282 H CYS 52 HN CYS 52 -3.415 2.467 -6.171 283 HA CYS 52 HA CYS 52 -6.050 1.553 -6.387 284 HB2 CYS 52 HB2 CYS 52 -4.898 4.097 -7.559 285 HB3 CYS 52 HB1 CYS 52 -6.590 3.792 -7.181 286 HG CYS 52 HG CYS 52 -4.062 4.018 -4.880 287 H GLN 53 HN GLN 53 -3.662 2.383 -8.861 288 HA GLN 53 HA GLN 53 -5.263 1.935 -11.121 289 HB2 GLN 53 HB2 GLN 53 -2.276 1.687 -10.754 290 HB3 GLN 53 HB1 GLN 53 -3.084 1.646 -12.314 291 HG2 GLN 53 HG2 GLN 53 -3.754 3.890 -12.152 292 HG3 GLN 53 HG1 GLN 53 -3.385 3.957 -10.428 293 HE21 GLN 53 HE21 GLN 53 -2.441 5.628 -12.650 294 HE22 GLN 53 HE22 GLN 53 -0.713 5.526 -12.607 295 H ARG 54 HN ARG 54 -3.282 -0.230 -9.183 296 HA ARG 54 HA ARG 54 -3.416 -2.496 -10.851 297 HB2 ARG 54 HB2 ARG 54 -1.775 -2.339 -9.071 298 HB3 ARG 54 HB1 ARG 54 -3.043 -2.255 -7.860 299 HG2 ARG 54 HG2 ARG 54 -2.152 -4.443 -7.786 300 HG3 ARG 54 HG1 ARG 54 -3.733 -4.562 -8.557 301 HD2 ARG 54 HD2 ARG 54 -2.752 -4.775 -10.715 302 HD3 ARG 54 HD1 ARG 54 -1.154 -4.360 -10.095 303 HE ARG 54 HE ARG 54 -1.730 -6.572 -8.695 304 HH11 ARG 54 HH11 ARG 54 -1.953 -5.840 -12.123 305 HH12 ARG 54 HH12 ARG 54 -1.627 -7.536 -12.629 306 HH21 ARG 54 HH21 ARG 54 -1.285 -8.750 -9.275 307 HH22 ARG 54 HH22 ARG 54 -1.256 -9.166 -11.038 308 H GLN 55 HN GLN 55 -5.586 -1.242 -8.394 309 HA GLN 55 HA GLN 55 -7.274 -3.601 -8.519 310 HB2 GLN 55 HB2 GLN 55 -7.502 -1.018 -6.975 311 HB3 GLN 55 HB1 GLN 55 -8.719 -2.286 -6.920 312 HG2 GLN 55 HG2 GLN 55 -5.838 -2.563 -6.093 313 HG3 GLN 55 HG1 GLN 55 -7.224 -2.408 -5.014 314 HE21 GLN 55 HE21 GLN 55 -8.585 -4.157 -4.709 315 HE22 GLN 55 HE22 GLN 55 -8.164 -5.759 -5.210 316 H GLY 56 HN GLY 56 -6.911 -0.742 -10.237 317 HA2 GLY 56 HA2 GLY 56 -8.074 -0.055 -12.117 318 HA3 GLY 56 HA1 GLY 56 -9.290 -1.278 -11.779 319 H VAL 57 HN VAL 57 -8.312 1.020 -9.354 320 HA VAL 57 HA VAL 57 -10.848 2.478 -9.732 321 HB VAL 57 HB VAL 57 -10.908 2.736 -7.218 322 HG11 VAL 57 HG11 VAL 57 -11.861 0.499 -6.811 323 HG12 VAL 57 HG12 VAL 57 -11.180 -0.047 -8.343 324 HG13 VAL 57 HG13 VAL 57 -12.417 1.209 -8.326 325 HG21 VAL 57 HG21 VAL 57 -8.859 0.528 -7.333 326 HG22 VAL 57 HG22 VAL 57 -9.698 1.069 -5.880 327 HG23 VAL 57 HG23 VAL 57 -8.603 2.162 -6.724 328 HA PRO 58 HA PRO 58 -8.379 6.134 -9.549 329 HB2 PRO 58 HB2 PRO 58 -10.062 7.909 -8.355 330 HB3 PRO 58 HB1 PRO 58 -10.267 7.357 -10.024 331 HG2 PRO 58 HG2 PRO 58 -11.696 6.472 -7.567 332 HG3 PRO 58 HG1 PRO 58 -12.326 6.741 -9.204 333 HD2 PRO 58 HD2 PRO 58 -11.775 4.271 -8.217 334 HD3 PRO 58 HD1 PRO 58 -11.676 4.676 -9.940 335 H MET 59 HN MET 59 -7.444 7.746 -8.049 336 HA MET 59 HA MET 59 -6.638 6.456 -5.617 337 HB2 MET 59 HB2 MET 59 -5.219 7.962 -7.166 338 HB3 MET 59 HB1 MET 59 -5.999 9.305 -6.341 339 HG2 MET 59 HG2 MET 59 -5.159 8.469 -4.199 340 HG3 MET 59 HG1 MET 59 -4.358 7.143 -5.039 341 HE1 MET 59 HE1 MET 59 -2.731 8.878 -3.082 342 HE2 MET 59 HE2 MET 59 -1.287 9.267 -4.015 343 HE3 MET 59 HE3 MET 59 -1.985 7.649 -4.099 344 H ASN 60 HN ASN 60 -6.773 7.404 -3.514 345 HA ASN 60 HA ASN 60 -7.734 8.424 -1.738 346 HB2 ASN 60 HB2 ASN 60 -7.776 10.446 -3.400 347 HB3 ASN 60 HB1 ASN 60 -9.505 10.122 -3.455 348 HD21 ASN 60 HD21 ASN 60 -9.850 12.179 -2.523 349 HD22 ASN 60 HD22 ASN 60 -9.616 12.443 -0.828 350 H SER 61 HN SER 61 -9.180 6.450 -3.819 351 HA SER 61 HA SER 61 -11.844 6.496 -2.651 352 HB2 SER 61 HB2 SER 61 -10.860 4.332 -4.483 353 HB3 SER 61 HB1 SER 61 -12.476 5.030 -4.350 354 HG SER 61 HG SER 61 -10.283 5.875 -5.811 355 H LEU 62 HN LEU 62 -8.822 5.055 -2.124 356 HA LEU 62 HA LEU 62 -10.013 3.085 -0.297 357 HB2 LEU 62 HB2 LEU 62 -7.484 2.783 -1.925 358 HB3 LEU 62 HB1 LEU 62 -8.059 1.638 -0.730 359 HG LEU 62 HG LEU 62 -9.538 2.344 -3.269 360 HD11 LEU 62 HD11 LEU 62 -7.845 -0.054 -2.588 361 HD12 LEU 62 HD12 LEU 62 -7.473 1.188 -3.783 362 HD13 LEU 62 HD13 LEU 62 -8.850 0.113 -4.029 363 HD21 LEU 62 HD21 LEU 62 -11.091 1.620 -1.613 364 HD22 LEU 62 HD22 LEU 62 -10.031 0.306 -1.102 365 HD23 LEU 62 HD23 LEU 62 -10.802 0.252 -2.687 366 H ARG 63 HN ARG 63 -9.281 3.120 1.746 367 HA ARG 63 HA ARG 63 -7.154 5.047 2.355 368 HB2 ARG 63 HB2 ARG 63 -8.032 5.070 4.650 369 HB3 ARG 63 HB1 ARG 63 -9.267 5.511 3.481 370 HG2 ARG 63 HG2 ARG 63 -10.327 3.390 3.683 371 HG3 ARG 63 HG1 ARG 63 -8.990 2.750 4.641 372 HD2 ARG 63 HD2 ARG 63 -9.511 4.246 6.455 373 HD3 ARG 63 HD1 ARG 63 -10.752 5.043 5.491 374 HE ARG 63 HE ARG 63 -10.940 2.452 6.804 375 HH11 ARG 63 HH11 ARG 63 -14.006 4.054 4.694 376 HH12 ARG 63 HH12 ARG 63 -12.375 4.843 4.640 377 HH21 ARG 63 HH21 ARG 63 -12.988 1.464 6.911 378 HH22 ARG 63 HH22 ARG 63 -14.351 2.189 5.981 379 H PHE 64 HN PHE 64 -5.264 4.378 3.082 380 HA PHE 64 HA PHE 64 -4.893 1.533 3.609 381 HB2 PHE 64 HB2 PHE 64 -2.948 3.787 3.082 382 HB3 PHE 64 HB1 PHE 64 -2.446 2.156 3.507 383 HD1 PHE 64 HD1 PHE 64 -3.958 4.260 0.928 384 HD2 PHE 64 HD2 PHE 64 -2.652 0.339 1.942 385 HE1 PHE 64 HE1 PHE 64 -4.100 3.607 -1.439 386 HE2 PHE 64 HE2 PHE 64 -2.789 -0.323 -0.424 387 HZ PHE 64 HZ PHE 64 -3.516 1.314 -2.117 388 H LEU 65 HN LEU 65 -5.115 0.926 5.650 389 HA LEU 65 HA LEU 65 -4.462 2.845 7.775 390 HB2 LEU 65 HB2 LEU 65 -6.109 0.320 7.855 391 HB3 LEU 65 HB1 LEU 65 -5.793 1.351 9.238 392 HG LEU 65 HG LEU 65 -7.370 2.093 6.773 393 HD11 LEU 65 HD11 LEU 65 -9.242 2.250 8.325 394 HD12 LEU 65 HD12 LEU 65 -8.198 1.719 9.646 395 HD13 LEU 65 HD13 LEU 65 -8.558 0.624 8.310 396 HD21 LEU 65 HD21 LEU 65 -6.617 3.729 9.188 397 HD22 LEU 65 HD22 LEU 65 -7.843 4.191 8.007 398 HD23 LEU 65 HD23 LEU 65 -6.158 4.031 7.511 399 H PHE 66 HN PHE 66 -2.675 2.627 8.838 400 HA PHE 66 HA PHE 66 -1.448 -0.040 9.110 401 HB2 PHE 66 HB2 PHE 66 -0.220 1.507 7.534 402 HB3 PHE 66 HB1 PHE 66 0.041 2.588 8.896 403 HD1 PHE 66 HD1 PHE 66 0.759 -0.804 7.608 404 HD2 PHE 66 HD2 PHE 66 1.815 2.230 10.402 405 HE1 PHE 66 HE1 PHE 66 2.802 -2.047 8.184 406 HE2 PHE 66 HE2 PHE 66 3.859 0.989 10.981 407 HZ PHE 66 HZ PHE 66 4.353 -1.152 9.871 408 H GLU 67 HN GLU 67 -1.817 -0.600 11.155 409 HA GLU 67 HA GLU 67 -1.796 -0.619 13.417 410 HB2 GLU 67 HB2 GLU 67 0.029 1.739 12.980 411 HB3 GLU 67 HB1 GLU 67 -0.370 1.141 14.587 412 HG2 GLU 67 HG2 GLU 67 0.874 -0.532 12.418 413 HG3 GLU 67 HG1 GLU 67 1.781 0.296 13.681 414 H GLY 68 HN GLY 68 -3.735 1.007 11.794 415 HA2 GLY 68 HA2 GLY 68 -5.790 1.814 12.698 416 HA3 GLY 68 HA1 GLY 68 -4.903 2.408 14.094 417 H GLN 69 HN GLN 69 -2.834 3.460 12.102 418 HA GLN 69 HA GLN 69 -4.147 6.034 11.728 419 HB2 GLN 69 HB2 GLN 69 -1.257 5.311 11.219 420 HB3 GLN 69 HB1 GLN 69 -1.936 6.928 11.359 421 HG2 GLN 69 HG2 GLN 69 -2.586 6.282 13.727 422 HG3 GLN 69 HG1 GLN 69 -1.527 4.888 13.518 423 HE21 GLN 69 HE21 GLN 69 -1.339 7.194 15.329 424 HE22 GLN 69 HE22 GLN 69 0.207 7.904 15.018 425 H ARG 70 HN ARG 70 -3.987 7.189 9.679 426 HA ARG 70 HA ARG 70 -4.168 5.300 7.449 427 HB2 ARG 70 HB2 ARG 70 -5.342 7.082 6.232 428 HB3 ARG 70 HB1 ARG 70 -6.131 6.702 7.755 429 HG2 ARG 70 HG2 ARG 70 -4.937 8.691 8.736 430 HG3 ARG 70 HG1 ARG 70 -4.464 9.111 7.090 431 HD2 ARG 70 HD2 ARG 70 -7.284 8.806 8.116 432 HD3 ARG 70 HD1 ARG 70 -6.467 10.326 7.762 433 HE ARG 70 HE ARG 70 -6.352 9.438 5.392 434 HH11 ARG 70 HH11 ARG 70 -8.919 8.566 7.651 435 HH12 ARG 70 HH12 ARG 70 -10.123 8.264 6.341 436 HH21 ARG 70 HH21 ARG 70 -7.861 9.064 3.704 437 HH22 ARG 70 HH22 ARG 70 -9.542 8.544 4.135 438 H ILE 71 HN ILE 71 -2.739 5.230 5.884 439 HA ILE 71 HA ILE 71 -0.310 6.700 6.063 440 HB ILE 71 HB ILE 71 -1.343 4.921 3.844 441 HG12 ILE 71 HG12 ILE 71 -1.087 3.748 5.979 442 HG13 ILE 71 HG11 ILE 71 0.134 3.217 4.828 443 HG21 ILE 71 HG21 ILE 71 0.978 4.785 3.099 444 HG22 ILE 71 HG22 ILE 71 1.444 5.949 4.338 445 HG23 ILE 71 HG23 ILE 71 0.372 6.439 3.027 446 HD11 ILE 71 HD11 ILE 71 1.743 4.759 5.939 447 HD12 ILE 71 HD12 ILE 71 1.155 3.451 6.968 448 HD13 ILE 71 HD13 ILE 71 0.509 5.081 7.158 449 H ALA 72 HN ALA 72 0.035 8.692 5.385 450 HA ALA 72 HA ALA 72 -1.841 9.977 3.593 451 HB1 ALA 72 HB1 ALA 72 -0.507 12.003 4.032 452 HB2 ALA 72 HB2 ALA 72 0.617 11.033 4.985 453 HB3 ALA 72 HB3 ALA 72 -1.055 11.221 5.514 454 H ASP 73 HN ASP 73 -0.811 11.466 1.886 455 HA ASP 73 HA ASP 73 0.566 9.779 0.031 456 HB2 ASP 73 HB2 ASP 73 -0.447 12.608 -0.044 457 HB3 ASP 73 HB1 ASP 73 0.576 11.991 -1.336 458 H ASN 74 HN ASN 74 1.493 12.181 2.317 459 HA ASN 74 HA ASN 74 4.163 12.421 1.143 460 HB2 ASN 74 HB2 ASN 74 4.533 14.201 2.796 461 HB3 ASN 74 HB1 ASN 74 3.077 14.509 1.856 462 HD21 ASN 74 HD21 ASN 74 4.379 13.758 4.960 463 HD22 ASN 74 HD22 ASN 74 2.913 13.962 5.857 464 H HIS 75 HN HIS 75 2.997 10.026 2.573 465 HA HIS 75 HA HIS 75 4.665 9.837 4.944 466 HB2 HIS 75 HB2 HIS 75 2.314 8.469 3.919 467 HB3 HIS 75 HB1 HIS 75 3.538 7.328 4.461 468 HD2 HIS 75 HD2 HIS 75 4.072 7.327 7.195 469 HE1 HIS 75 HE1 HIS 75 0.850 9.890 8.162 470 HE2 HIS 75 HE2 HIS 75 2.490 8.186 9.065 471 H THR 76 HN THR 76 6.303 8.329 5.227 472 HA THR 76 HA THR 76 7.371 7.144 2.744 473 HB THR 76 HB THR 76 9.517 7.532 4.537 474 HG1 THR 76 HG1 THR 76 7.787 9.240 5.270 475 HG21 THR 76 HG21 THR 76 9.652 7.548 2.095 476 HG22 THR 76 HG22 THR 76 10.362 9.012 2.776 477 HG23 THR 76 HG23 THR 76 8.756 9.064 2.049 478 HA PRO 77 HA PRO 77 7.269 3.284 4.942 479 HB2 PRO 77 HB2 PRO 77 9.672 2.441 3.469 480 HB3 PRO 77 HB1 PRO 77 8.032 1.786 3.408 481 HG2 PRO 77 HG2 PRO 77 9.057 3.171 1.357 482 HG3 PRO 77 HG1 PRO 77 7.336 3.258 1.791 483 HD2 PRO 77 HD2 PRO 77 9.524 5.215 2.369 484 HD3 PRO 77 HD1 PRO 77 7.845 5.508 1.866 485 H LYS 78 HN LYS 78 9.978 5.357 4.977 486 HA LYS 78 HA LYS 78 11.668 3.821 6.691 487 HB2 LYS 78 HB2 LYS 78 12.481 5.620 5.178 488 HB3 LYS 78 HB1 LYS 78 11.665 6.801 6.189 489 HG2 LYS 78 HG2 LYS 78 13.861 6.907 6.907 490 HG3 LYS 78 HG1 LYS 78 13.104 5.850 8.099 491 HD2 LYS 78 HD2 LYS 78 15.260 4.955 7.411 492 HD3 LYS 78 HD1 LYS 78 13.957 3.890 6.877 493 HE2 LYS 78 HE2 LYS 78 14.209 4.500 4.649 494 HE3 LYS 78 HE1 LYS 78 15.017 6.014 5.052 495 HZ1 LYS 78 HZ1 LYS 78 16.520 4.317 4.130 496 HZ2 LYS 78 HZ2 LYS 78 16.201 3.325 5.460 497 HZ3 LYS 78 HZ3 LYS 78 16.972 4.814 5.682 498 H GLU 79 HN GLU 79 9.174 6.249 7.172 499 HA GLU 79 HA GLU 79 9.720 6.470 10.007 500 HB2 GLU 79 HB2 GLU 79 7.945 8.095 10.047 501 HB3 GLU 79 HB1 GLU 79 8.973 8.424 8.662 502 HG2 GLU 79 HG2 GLU 79 7.300 7.165 7.269 503 HG3 GLU 79 HG1 GLU 79 6.250 7.165 8.683 504 H LEU 80 HN LEU 80 7.646 6.367 11.439 505 HA LEU 80 HA LEU 80 6.007 5.164 12.439 506 HB2 LEU 80 HB2 LEU 80 5.650 3.941 9.705 507 HB3 LEU 80 HB1 LEU 80 4.632 3.568 11.081 508 HG LEU 80 HG LEU 80 4.917 6.288 9.800 509 HD11 LEU 80 HD11 LEU 80 2.624 5.912 9.042 510 HD12 LEU 80 HD12 LEU 80 2.666 4.285 9.720 511 HD13 LEU 80 HD13 LEU 80 3.730 4.712 8.379 512 HD21 LEU 80 HD21 LEU 80 3.224 5.303 12.089 513 HD22 LEU 80 HD22 LEU 80 2.944 6.826 11.239 514 HD23 LEU 80 HD23 LEU 80 4.451 6.573 12.123 515 H GLY 81 HN GLY 81 7.836 3.063 10.225 516 HA2 GLY 81 HA2 GLY 81 9.511 1.584 11.300 517 HA3 GLY 81 HA1 GLY 81 8.281 1.233 12.506 518 H MET 82 HN MET 82 8.414 1.286 8.936 519 HA MET 82 HA MET 82 6.701 -1.042 8.813 520 HB2 MET 82 HB2 MET 82 7.958 0.756 6.758 521 HB3 MET 82 HB1 MET 82 7.224 -0.767 6.281 522 HG2 MET 82 HG2 MET 82 5.111 -0.032 7.324 523 HG3 MET 82 HG1 MET 82 5.865 1.519 7.681 524 HE1 MET 82 HE1 MET 82 3.126 0.954 5.991 525 HE2 MET 82 HE2 MET 82 3.281 2.184 4.737 526 HE3 MET 82 HE3 MET 82 3.692 2.569 6.406 527 H GLU 83 HN GLU 83 7.316 -3.093 8.548 528 HA GLU 83 HA GLU 83 10.160 -3.594 7.942 529 HB2 GLU 83 HB2 GLU 83 8.479 -4.514 10.158 530 HB3 GLU 83 HB1 GLU 83 9.359 -5.806 9.353 531 HG2 GLU 83 HG2 GLU 83 10.526 -3.330 10.597 532 HG3 GLU 83 HG1 GLU 83 10.639 -4.978 11.211 533 H GLU 84 HN GLU 84 10.374 -6.099 7.473 534 HA GLU 84 HA GLU 84 8.930 -6.552 5.041 535 HB2 GLU 84 HB2 GLU 84 11.286 -7.215 5.327 536 HB3 GLU 84 HB1 GLU 84 10.819 -8.351 6.581 537 HG2 GLU 84 HG2 GLU 84 11.285 -9.363 4.355 538 HG3 GLU 84 HG1 GLU 84 9.702 -9.744 5.028 539 H GLU 85 HN GLU 85 7.315 -8.029 4.633 540 HA GLU 85 HA GLU 85 5.535 -9.393 4.995 541 HB2 GLU 85 HB2 GLU 85 7.139 -10.197 7.424 542 HB3 GLU 85 HB1 GLU 85 5.585 -10.912 7.029 543 HG2 GLU 85 HG2 GLU 85 7.906 -10.935 5.128 544 HG3 GLU 85 HG1 GLU 85 7.647 -12.193 6.334 545 H ASP 86 HN ASP 86 5.794 -6.631 6.111 546 HA ASP 86 HA ASP 86 4.324 -6.547 8.549 547 HB2 ASP 86 HB2 ASP 86 5.803 -4.703 7.171 548 HB3 ASP 86 HB1 ASP 86 4.159 -4.161 6.838 549 H VAL 87 HN VAL 87 2.187 -5.524 8.774 550 HA VAL 87 HA VAL 87 0.433 -6.398 6.570 551 HB VAL 87 HB VAL 87 -0.283 -6.290 9.506 552 HG11 VAL 87 HG11 VAL 87 -2.276 -7.540 8.822 553 HG12 VAL 87 HG12 VAL 87 -1.768 -7.425 7.137 554 HG13 VAL 87 HG13 VAL 87 -2.191 -5.966 8.033 555 HG21 VAL 87 HG21 VAL 87 0.375 -8.677 7.782 556 HG22 VAL 87 HG22 VAL 87 -0.193 -8.731 9.451 557 HG23 VAL 87 HG23 VAL 87 1.378 -8.026 9.075 558 H ILE 88 HN ILE 88 -0.874 -4.977 5.682 559 HA ILE 88 HA ILE 88 -1.595 -2.539 7.136 560 HB ILE 88 HB ILE 88 0.283 -1.901 5.714 561 HG12 ILE 88 HG12 ILE 88 -2.276 -0.901 4.455 562 HG13 ILE 88 HG11 ILE 88 -1.682 -0.358 6.021 563 HG21 ILE 88 HG21 ILE 88 0.193 -2.095 3.285 564 HG22 ILE 88 HG22 ILE 88 -1.343 -2.952 3.406 565 HG23 ILE 88 HG23 ILE 88 0.123 -3.678 4.060 566 HD11 ILE 88 HD11 ILE 88 0.442 0.316 4.811 567 HD12 ILE 88 HD12 ILE 88 -1.002 1.276 4.490 568 HD13 ILE 88 HD13 ILE 88 -0.463 0.075 3.317 569 H GLU 89 HN GLU 89 -3.680 -1.814 6.664 570 HA GLU 89 HA GLU 89 -5.273 -3.718 5.087 571 HB2 GLU 89 HB2 GLU 89 -6.033 -1.856 7.330 572 HB3 GLU 89 HB1 GLU 89 -7.202 -2.768 6.388 573 HG2 GLU 89 HG2 GLU 89 -6.480 -4.810 7.247 574 HG3 GLU 89 HG1 GLU 89 -4.956 -4.130 7.818 575 H VAL 90 HN VAL 90 -6.831 -3.018 3.658 576 HA VAL 90 HA VAL 90 -6.790 -0.165 2.968 577 HB VAL 90 HB VAL 90 -5.397 -1.365 1.336 578 HG11 VAL 90 HG11 VAL 90 -7.878 -2.931 0.652 579 HG12 VAL 90 HG12 VAL 90 -6.464 -3.568 1.488 580 HG13 VAL 90 HG13 VAL 90 -6.326 -3.013 -0.179 581 HG21 VAL 90 HG21 VAL 90 -8.024 -0.407 0.218 582 HG22 VAL 90 HG22 VAL 90 -6.541 -0.623 -0.711 583 HG23 VAL 90 HG23 VAL 90 -6.608 0.580 0.577 584 H TYR 91 HN TYR 91 -8.752 0.687 2.996 585 HA TYR 91 HA TYR 91 -11.061 -1.076 2.527 586 HB2 TYR 91 HB2 TYR 91 -10.765 1.014 4.693 587 HB3 TYR 91 HB1 TYR 91 -12.299 0.268 4.257 588 HD1 TYR 91 HD1 TYR 91 -12.638 -2.171 4.656 589 HD2 TYR 91 HD2 TYR 91 -9.190 -0.116 6.066 590 HE1 TYR 91 HE1 TYR 91 -12.174 -4.022 6.208 591 HE2 TYR 91 HE2 TYR 91 -8.719 -1.958 7.621 592 HH TYR 91 HH TYR 91 -9.358 -3.928 8.397 593 H GLN 92 HN GLN 92 -13.019 0.078 1.867 594 HA GLN 92 HA GLN 92 -12.370 2.080 -0.093 595 HB2 GLN 92 HB2 GLN 92 -13.971 0.313 -0.623 596 HB3 GLN 92 HB1 GLN 92 -15.009 0.835 0.694 597 HG2 GLN 92 HG2 GLN 92 -15.536 2.867 -0.414 598 HG3 GLN 92 HG1 GLN 92 -14.306 2.582 -1.644 599 HE21 GLN 92 HE21 GLN 92 -17.430 1.624 -0.440 600 HE22 GLN 92 HE22 GLN 92 -17.952 0.809 -1.873 601 H GLU 93 HN GLU 93 -12.519 4.194 0.139 602 HA GLU 93 HA GLU 93 -13.246 5.353 2.650 603 HB2 GLU 93 HB2 GLU 93 -12.249 6.371 0.024 604 HB3 GLU 93 HB1 GLU 93 -12.967 7.513 1.150 605 HG2 GLU 93 HG2 GLU 93 -10.685 5.675 1.823 606 HG3 GLU 93 HG1 GLU 93 -10.497 7.349 1.297 607 H GLN 94 HN GLN 94 -14.948 6.762 3.104 608 HA GLN 94 HA GLN 94 -17.438 6.099 1.947 609 HB2 GLN 94 HB2 GLN 94 -16.640 8.344 3.804 610 HB3 GLN 94 HB1 GLN 94 -18.303 8.007 3.343 611 HG2 GLN 94 HG2 GLN 94 -17.803 5.624 4.215 612 HG3 GLN 94 HG1 GLN 94 -16.453 6.398 5.041 613 HE21 GLN 94 HE21 GLN 94 -16.868 7.870 6.688 614 HE22 GLN 94 HE22 GLN 94 -18.419 7.994 7.442 615 H THR 95 HN THR 95 -15.044 8.350 1.041 616 HA THR 95 HA THR 95 -16.683 10.289 -0.224 617 HB THR 95 HB THR 95 -14.360 10.485 -1.587 618 HG1 THR 95 HG1 THR 95 -12.866 9.273 -0.706 619 HG21 THR 95 HG21 THR 95 -15.289 12.268 -0.251 620 HG22 THR 95 HG22 THR 95 -13.608 12.026 0.223 621 HG23 THR 95 HG23 THR 95 -14.906 11.404 1.239 622 H GLY 96 HN GLY 96 -15.490 7.144 -1.138 623 HA2 GLY 96 HA2 GLY 96 -16.340 5.838 -2.893 624 HA3 GLY 96 HA1 GLY 96 -17.049 7.286 -3.595 625 H GLY 97 HN GLY 97 -14.647 8.854 -3.527 626 HA2 GLY 97 HA2 GLY 97 -12.351 7.899 -4.560 627 HA3 GLY 97 HA1 GLY 97 -13.436 7.860 -5.944 628 H1 ASN 357 HT1 ASN 357 -3.894 -20.736 -4.329 629 H2 ASN 357 HT2 ASN 357 -4.867 -20.648 -2.947 630 H3 ASN 357 HT3 ASN 357 -3.430 -21.539 -2.912 631 HA ASN 357 HA ASN 357 -3.052 -19.520 -1.780 632 HB2 ASN 357 HB2 ASN 357 -1.223 -18.590 -3.104 633 HB3 ASN 357 HB1 ASN 357 -1.232 -20.346 -3.220 634 HD21 ASN 357 HD21 ASN 357 -0.160 -18.223 -5.009 635 HD22 ASN 357 HD22 ASN 357 -0.845 -18.566 -6.559 636 H ASN 358 HN ASN 358 -3.238 -17.261 -1.604 637 HA ASN 358 HA ASN 358 -4.769 -15.914 -3.723 638 HB2 ASN 358 HB2 ASN 358 -6.121 -14.755 -1.999 639 HB3 ASN 358 HB1 ASN 358 -6.385 -16.492 -2.009 640 HD21 ASN 358 HD21 ASN 358 -5.898 -17.673 -0.218 641 HD22 ASN 358 HD22 ASN 358 -5.344 -16.980 1.265 642 H ARG 359 HN ARG 359 -1.915 -15.967 -2.767 643 HA ARG 359 HA ARG 359 -1.600 -13.166 -1.978 644 HB2 ARG 359 HB2 ARG 359 0.929 -14.290 -1.976 645 HB3 ARG 359 HB1 ARG 359 -0.089 -14.040 -0.568 646 HG2 ARG 359 HG2 ARG 359 -0.992 -16.307 -0.830 647 HG3 ARG 359 HG1 ARG 359 0.055 -16.554 -2.225 648 HD2 ARG 359 HD2 ARG 359 1.030 -17.558 -0.241 649 HD3 ARG 359 HD1 ARG 359 2.020 -16.215 -0.807 650 HE ARG 359 HE ARG 359 0.093 -15.537 1.257 651 HH11 ARG 359 HH11 ARG 359 3.371 -16.620 0.542 652 HH12 ARG 359 HH12 ARG 359 4.039 -15.973 2.089 653 HH21 ARG 359 HH21 ARG 359 0.911 -14.686 3.206 654 HH22 ARG 359 HH22 ARG 359 2.663 -14.931 3.597 655 H ASP 360 HN ASP 360 -0.852 -11.694 -3.351 656 HA ASP 360 HA ASP 360 0.431 -12.594 -5.841 657 HB2 ASP 360 HB2 ASP 360 -1.880 -12.039 -6.384 658 HB3 ASP 360 HB1 ASP 360 -1.721 -10.476 -5.590 659 HA PRO 361 HA PRO 361 3.288 -9.476 -4.294 660 HB2 PRO 361 HB2 PRO 361 5.434 -10.334 -5.662 661 HB3 PRO 361 HB1 PRO 361 4.844 -11.188 -4.230 662 HG2 PRO 361 HG2 PRO 361 4.494 -11.874 -7.104 663 HG3 PRO 361 HG1 PRO 361 4.763 -12.943 -5.715 664 HD2 PRO 361 HD2 PRO 361 2.307 -12.471 -6.883 665 HD3 PRO 361 HD1 PRO 361 2.546 -13.065 -5.229 666 H ILE 362 HN ILE 362 3.294 -7.471 -5.116 667 HA ILE 362 HA ILE 362 3.394 -7.175 -8.040 668 HB ILE 362 HB ILE 362 1.961 -5.368 -6.099 669 HG12 ILE 362 HG12 ILE 362 0.549 -6.909 -8.225 670 HG13 ILE 362 HG11 ILE 362 1.082 -7.792 -6.797 671 HG21 ILE 362 HG21 ILE 362 1.057 -4.301 -8.132 672 HG22 ILE 362 HG22 ILE 362 2.118 -5.312 -9.112 673 HG23 ILE 362 HG23 ILE 362 2.807 -4.131 -7.998 674 HD11 ILE 362 HD11 ILE 362 -0.632 -5.325 -6.711 675 HD12 ILE 362 HD12 ILE 362 -0.222 -6.391 -5.368 676 HD13 ILE 362 HD13 ILE 362 -1.251 -6.976 -6.676 677 H VAL 363 HN VAL 363 5.088 -6.179 -8.816 678 HA VAL 363 HA VAL 363 6.616 -4.366 -7.069 679 HB VAL 363 HB VAL 363 7.565 -5.702 -9.614 680 HG11 VAL 363 HG11 VAL 363 9.776 -5.029 -8.895 681 HG12 VAL 363 HG12 VAL 363 9.110 -4.330 -7.418 682 HG13 VAL 363 HG13 VAL 363 8.719 -3.619 -8.985 683 HG21 VAL 363 HG21 VAL 363 8.887 -7.170 -8.091 684 HG22 VAL 363 HG22 VAL 363 7.147 -7.448 -8.030 685 HG23 VAL 363 HG23 VAL 363 7.944 -6.541 -6.745 686 H ILE 364 HN ILE 364 6.419 -2.254 -7.512 687 HA ILE 364 HA ILE 364 5.146 -1.442 -9.997 688 HB ILE 364 HB ILE 364 4.954 0.760 -9.036 689 HG12 ILE 364 HG12 ILE 364 6.091 0.085 -6.408 690 HG13 ILE 364 HG11 ILE 364 7.281 0.195 -7.702 691 HG21 ILE 364 HG21 ILE 364 3.614 0.255 -7.049 692 HG22 ILE 364 HG22 ILE 364 4.304 -1.368 -7.001 693 HG23 ILE 364 HG23 ILE 364 3.294 -0.879 -8.362 694 HD11 ILE 364 HD11 ILE 364 5.298 2.342 -6.973 695 HD12 ILE 364 HD12 ILE 364 6.548 2.451 -8.212 696 HD13 ILE 364 HD13 ILE 364 7.001 2.315 -6.512 697 H SER 365 HN SER 365 6.010 0.622 -11.021 698 HA SER 365 HA SER 365 8.896 0.302 -11.419 699 HB2 SER 365 HB2 SER 365 6.962 1.752 -13.229 700 HB3 SER 365 HB1 SER 365 8.593 1.200 -13.612 701 HG SER 365 HG SER 365 7.820 -0.954 -13.377 702 H ASP 366 HN ASP 366 9.748 1.593 -9.851 703 HA ASP 366 HA ASP 366 8.761 4.204 -9.249 704 HB2 ASP 366 HB2 ASP 366 9.898 3.328 -7.437 705 HB3 ASP 366 HB1 ASP 366 11.119 2.558 -8.440 706 H SER 367 HN SER 367 8.936 5.876 -10.578 707 HA SER 367 HA SER 367 11.466 6.335 -11.969 708 HB2 SER 367 HB2 SER 367 8.931 6.808 -13.498 709 HB3 SER 367 HB1 SER 367 10.556 6.481 -14.102 710 HG SER 367 HG SER 367 9.748 4.383 -12.677 711 HA PRO 368 HA PRO 368 10.277 10.248 -10.014 712 HB2 PRO 368 HB2 PRO 368 12.691 11.460 -10.456 713 HB3 PRO 368 HB1 PRO 368 12.363 10.395 -9.083 714 HG2 PRO 368 HG2 PRO 368 13.767 9.792 -11.636 715 HG3 PRO 368 HG1 PRO 368 14.135 9.247 -9.988 716 HD2 PRO 368 HD2 PRO 368 12.894 7.669 -11.797 717 HD3 PRO 368 HD1 PRO 368 12.588 7.556 -10.053 Start of MODEL 6 1 H TYR 21 HT1 TYR 21 14.216 -4.470 -1.410 2 HA TYR 21 HA TYR 21 12.396 -3.088 -2.064 3 HB2 TYR 21 HB2 TYR 21 11.850 -5.418 -3.865 4 HB3 TYR 21 HB1 TYR 21 10.493 -4.466 -3.275 5 HD1 TYR 21 HD1 TYR 21 9.799 -2.664 -4.533 6 HD2 TYR 21 HD2 TYR 21 13.830 -3.968 -4.893 7 HE1 TYR 21 HE1 TYR 21 10.163 -1.017 -6.322 8 HE2 TYR 21 HE2 TYR 21 14.212 -2.326 -6.681 9 HH TYR 21 HH TYR 21 12.483 -1.118 -8.459 10 H ILE 22 HN ILE 22 10.846 -2.953 -0.524 11 HA ILE 22 HA ILE 22 10.690 -5.140 1.376 12 HB ILE 22 HB ILE 22 9.287 -2.466 1.479 13 HG12 ILE 22 HG12 ILE 22 11.724 -2.165 1.356 14 HG13 ILE 22 HG11 ILE 22 11.111 -1.730 2.946 15 HG21 ILE 22 HG21 ILE 22 8.320 -4.190 2.918 16 HG22 ILE 22 HG22 ILE 22 9.079 -2.909 3.864 17 HG23 ILE 22 HG23 ILE 22 9.898 -4.459 3.659 18 HD11 ILE 22 HD11 ILE 22 13.175 -2.937 3.169 19 HD12 ILE 22 HD12 ILE 22 12.542 -4.270 2.205 20 HD13 ILE 22 HD13 ILE 22 11.853 -3.925 3.791 21 H LYS 23 HN LYS 23 9.066 -6.562 1.522 22 HA LYS 23 HA LYS 23 6.807 -6.199 -0.318 23 HB2 LYS 23 HB2 LYS 23 8.234 -8.258 -0.422 24 HB3 LYS 23 HB1 LYS 23 7.642 -8.683 1.176 25 HG2 LYS 23 HG2 LYS 23 5.310 -8.563 0.165 26 HG3 LYS 23 HG1 LYS 23 6.125 -8.544 -1.402 27 HD2 LYS 23 HD2 LYS 23 5.706 -10.805 -1.064 28 HD3 LYS 23 HD1 LYS 23 7.374 -10.627 -0.516 29 HE2 LYS 23 HE2 LYS 23 5.213 -10.257 1.484 30 HE3 LYS 23 HE1 LYS 23 5.524 -11.893 0.917 31 HZ1 LYS 23 HZ1 LYS 23 6.784 -11.410 2.901 32 HZ2 LYS 23 HZ2 LYS 23 7.521 -10.070 2.172 33 HZ3 LYS 23 HZ3 LYS 23 7.841 -11.634 1.600 34 H LEU 24 HN LEU 24 5.065 -5.319 0.531 35 HA LEU 24 HA LEU 24 4.428 -5.785 3.361 36 HB2 LEU 24 HB2 LEU 24 3.256 -3.795 1.415 37 HB3 LEU 24 HB1 LEU 24 2.892 -3.890 3.126 38 HG LEU 24 HG LEU 24 5.606 -3.226 1.983 39 HD11 LEU 24 HD11 LEU 24 3.991 -1.475 1.486 40 HD12 LEU 24 HD12 LEU 24 5.136 -0.941 2.717 41 HD13 LEU 24 HD13 LEU 24 3.505 -1.427 3.180 42 HD21 LEU 24 HD21 LEU 24 5.706 -4.272 4.187 43 HD22 LEU 24 HD22 LEU 24 4.548 -3.093 4.803 44 HD23 LEU 24 HD23 LEU 24 6.144 -2.565 4.270 45 H LYS 25 HN LYS 25 2.461 -6.651 3.996 46 HA LYS 25 HA LYS 25 1.054 -8.124 1.895 47 HB2 LYS 25 HB2 LYS 25 0.705 -8.409 4.879 48 HB3 LYS 25 HB1 LYS 25 0.222 -9.545 3.627 49 HG2 LYS 25 HG2 LYS 25 2.467 -10.155 3.188 50 HG3 LYS 25 HG1 LYS 25 3.091 -8.817 4.156 51 HD2 LYS 25 HD2 LYS 25 3.337 -10.581 5.618 52 HD3 LYS 25 HD1 LYS 25 1.745 -9.974 6.080 53 HE2 LYS 25 HE2 LYS 25 1.412 -12.267 5.931 54 HE3 LYS 25 HE1 LYS 25 0.843 -11.677 4.373 55 HZ1 LYS 25 HZ1 LYS 25 2.159 -13.368 3.680 56 HZ2 LYS 25 HZ2 LYS 25 3.215 -13.256 5.008 57 HZ3 LYS 25 HZ3 LYS 25 3.338 -12.148 3.739 58 H VAL 26 HN VAL 26 -0.582 -7.037 1.023 59 HA VAL 26 HA VAL 26 -2.127 -5.152 2.629 60 HB VAL 26 HB VAL 26 -2.779 -5.770 -0.225 61 HG11 VAL 26 HG11 VAL 26 -3.418 -3.440 -0.287 62 HG12 VAL 26 HG12 VAL 26 -2.799 -3.201 1.346 63 HG13 VAL 26 HG13 VAL 26 -4.196 -4.243 1.076 64 HG21 VAL 26 HG21 VAL 26 -0.512 -3.984 0.648 65 HG22 VAL 26 HG22 VAL 26 -1.127 -4.149 -0.997 66 HG23 VAL 26 HG23 VAL 26 -0.349 -5.518 -0.205 67 H ILE 27 HN ILE 27 -3.927 -5.730 3.610 68 HA ILE 27 HA ILE 27 -5.203 -8.262 2.842 69 HB ILE 27 HB ILE 27 -5.571 -6.680 5.387 70 HG12 ILE 27 HG12 ILE 27 -3.262 -7.486 5.194 71 HG13 ILE 27 HG11 ILE 27 -4.130 -8.363 6.450 72 HG21 ILE 27 HG21 ILE 27 -6.559 -8.769 6.236 73 HG22 ILE 27 HG22 ILE 27 -6.394 -9.479 4.631 74 HG23 ILE 27 HG23 ILE 27 -7.463 -8.099 4.878 75 HD11 ILE 27 HD11 ILE 27 -4.471 -10.217 4.849 76 HD12 ILE 27 HD12 ILE 27 -2.777 -9.893 5.212 77 HD13 ILE 27 HD13 ILE 27 -3.469 -9.346 3.685 78 H GLY 28 HN GLY 28 -7.007 -8.177 1.715 79 HA2 GLY 28 HA2 GLY 28 -8.579 -5.715 1.664 80 HA3 GLY 28 HA1 GLY 28 -8.740 -7.074 0.557 81 H GLN 29 HN GLN 29 -11.057 -6.200 1.410 82 HA GLN 29 HA GLN 29 -11.906 -7.260 3.917 83 HB2 GLN 29 HB2 GLN 29 -12.999 -5.341 2.763 84 HB3 GLN 29 HB1 GLN 29 -13.602 -6.458 1.548 85 HG2 GLN 29 HG2 GLN 29 -15.286 -5.872 3.237 86 HG3 GLN 29 HG1 GLN 29 -14.940 -7.601 3.186 87 HE21 GLN 29 HE21 GLN 29 -13.892 -8.567 4.907 88 HE22 GLN 29 HE22 GLN 29 -13.707 -7.787 6.441 89 H ASP 30 HN ASP 30 -11.461 -8.608 0.805 90 HA ASP 30 HA ASP 30 -13.299 -10.809 1.214 91 HB2 ASP 30 HB2 ASP 30 -12.754 -11.494 -0.976 92 HB3 ASP 30 HB1 ASP 30 -12.729 -9.735 -1.049 93 H SER 31 HN SER 31 -10.540 -10.076 2.616 94 HA SER 31 HA SER 31 -8.935 -11.181 3.755 95 HB2 SER 31 HB2 SER 31 -10.422 -13.737 3.140 96 HB3 SER 31 HB1 SER 31 -9.352 -13.410 4.502 97 HG SER 31 HG SER 31 -11.067 -11.606 4.835 98 H SER 32 HN SER 32 -7.718 -10.498 1.854 99 HA SER 32 HA SER 32 -6.743 -12.749 0.245 100 HB2 SER 32 HB2 SER 32 -5.746 -10.496 -0.948 101 HB3 SER 32 HB1 SER 32 -7.265 -11.273 -1.399 102 HG SER 32 HG SER 32 -8.378 -9.698 -0.490 103 H GLU 33 HN GLU 33 -4.331 -12.174 -0.495 104 HA GLU 33 HA GLU 33 -2.792 -11.171 1.794 105 HB2 GLU 33 HB2 GLU 33 -3.079 -13.799 1.599 106 HB3 GLU 33 HB1 GLU 33 -1.833 -13.623 0.374 107 HG2 GLU 33 HG2 GLU 33 -0.801 -12.165 2.431 108 HG3 GLU 33 HG1 GLU 33 -1.646 -13.457 3.282 109 H ILE 34 HN ILE 34 -3.164 -9.575 -0.230 110 HA ILE 34 HA ILE 34 -1.538 -9.908 -2.515 111 HB ILE 34 HB ILE 34 -2.341 -7.260 -1.327 112 HG12 ILE 34 HG12 ILE 34 -4.319 -8.714 -1.415 113 HG13 ILE 34 HG11 ILE 34 -4.425 -7.421 -2.605 114 HG21 ILE 34 HG21 ILE 34 -0.787 -7.129 -3.179 115 HG22 ILE 34 HG22 ILE 34 -2.375 -6.536 -3.666 116 HG23 ILE 34 HG23 ILE 34 -1.846 -8.142 -4.163 117 HD11 ILE 34 HD11 ILE 34 -5.211 -9.509 -3.530 118 HD12 ILE 34 HD12 ILE 34 -3.673 -10.285 -3.156 119 HD13 ILE 34 HD13 ILE 34 -3.740 -8.992 -4.355 120 H HIS 35 HN HIS 35 0.553 -9.403 -2.923 121 HA HIS 35 HA HIS 35 2.157 -8.493 -0.626 122 HB2 HIS 35 HB2 HIS 35 2.831 -10.281 -2.959 123 HB3 HIS 35 HB1 HIS 35 4.064 -9.584 -1.916 124 HD2 HIS 35 HD2 HIS 35 1.577 -10.364 0.591 125 HE1 HIS 35 HE1 HIS 35 3.522 -14.050 -0.107 126 HE2 HIS 35 HE2 HIS 35 1.805 -12.850 1.313 127 H PHE 36 HN PHE 36 2.296 -6.327 -0.901 128 HA PHE 36 HA PHE 36 2.831 -5.247 -3.559 129 HB2 PHE 36 HB2 PHE 36 1.158 -4.253 -1.871 130 HB3 PHE 36 HB1 PHE 36 2.567 -3.662 -1.004 131 HD1 PHE 36 HD1 PHE 36 3.344 -3.632 -4.425 132 HD2 PHE 36 HD2 PHE 36 1.080 -1.536 -1.489 133 HE1 PHE 36 HE1 PHE 36 3.357 -1.630 -5.849 134 HE2 PHE 36 HE2 PHE 36 1.094 0.471 -2.907 135 HZ PHE 36 HZ PHE 36 2.232 0.427 -5.090 136 H LYS 37 HN LYS 37 4.884 -5.144 -4.224 137 HA LYS 37 HA LYS 37 7.020 -5.025 -2.232 138 HB2 LYS 37 HB2 LYS 37 7.171 -5.263 -5.245 139 HB3 LYS 37 HB1 LYS 37 8.538 -5.362 -4.144 140 HG2 LYS 37 HG2 LYS 37 7.314 -7.319 -3.065 141 HG3 LYS 37 HG1 LYS 37 6.276 -7.298 -4.492 142 HD2 LYS 37 HD2 LYS 37 8.286 -7.553 -5.909 143 HD3 LYS 37 HD1 LYS 37 9.273 -7.664 -4.451 144 HE2 LYS 37 HE2 LYS 37 7.966 -9.643 -3.760 145 HE3 LYS 37 HE1 LYS 37 7.066 -9.549 -5.273 146 HZ1 LYS 37 HZ1 LYS 37 9.118 -9.903 -6.484 147 HZ2 LYS 37 HZ2 LYS 37 8.859 -11.166 -5.392 148 HZ3 LYS 37 HZ3 LYS 37 9.996 -9.965 -5.038 149 H VAL 38 HN VAL 38 7.282 -3.056 -1.425 150 HA VAL 38 HA VAL 38 7.149 -0.730 -3.202 151 HB VAL 38 HB VAL 38 7.019 0.633 -1.195 152 HG11 VAL 38 HG11 VAL 38 5.145 -1.726 -1.038 153 HG12 VAL 38 HG12 VAL 38 4.956 -0.331 -2.098 154 HG13 VAL 38 HG13 VAL 38 4.868 -0.126 -0.349 155 HG21 VAL 38 HG21 VAL 38 7.280 -1.960 0.333 156 HG22 VAL 38 HG22 VAL 38 6.917 -0.385 1.037 157 HG23 VAL 38 HG23 VAL 38 8.476 -0.665 0.265 158 H LYS 39 HN LYS 39 8.697 1.058 -2.689 159 HA LYS 39 HA LYS 39 11.409 -0.043 -2.509 160 HB2 LYS 39 HB2 LYS 39 10.391 1.401 -4.499 161 HB3 LYS 39 HB1 LYS 39 10.864 2.732 -3.453 162 HG2 LYS 39 HG2 LYS 39 13.149 2.098 -3.533 163 HG3 LYS 39 HG1 LYS 39 12.758 0.561 -4.311 164 HD2 LYS 39 HD2 LYS 39 11.953 1.753 -6.281 165 HD3 LYS 39 HD1 LYS 39 12.310 3.295 -5.504 166 HE2 LYS 39 HE2 LYS 39 14.676 2.739 -5.450 167 HE3 LYS 39 HE1 LYS 39 14.336 1.166 -6.170 168 HZ1 LYS 39 HZ1 LYS 39 15.129 2.908 -7.747 169 HZ2 LYS 39 HZ2 LYS 39 13.673 3.741 -7.495 170 HZ3 LYS 39 HZ3 LYS 39 13.661 2.187 -8.179 171 H MET 40 HN MET 40 12.592 0.382 -0.755 172 HA MET 40 HA MET 40 11.562 2.143 1.285 173 HB2 MET 40 HB2 MET 40 12.524 0.027 1.964 174 HB3 MET 40 HB1 MET 40 14.038 0.408 1.162 175 HG2 MET 40 HG2 MET 40 14.217 0.650 3.575 176 HG3 MET 40 HG1 MET 40 14.457 2.191 2.757 177 HE1 MET 40 HE1 MET 40 12.342 0.005 5.010 178 HE2 MET 40 HE2 MET 40 11.066 0.234 3.812 179 HE3 MET 40 HE3 MET 40 10.923 0.972 5.407 180 H THR 41 HN THR 41 11.722 4.061 -0.091 181 HA THR 41 HA THR 41 13.726 5.781 0.695 182 HB THR 41 HB THR 41 15.158 4.305 -0.796 183 HG1 THR 41 HG1 THR 41 15.013 7.028 -0.670 184 HG21 THR 41 HG21 THR 41 13.597 5.697 -2.973 185 HG22 THR 41 HG22 THR 41 13.610 3.967 -2.640 186 HG23 THR 41 HG23 THR 41 15.073 4.765 -3.217 187 H THR 42 HN THR 42 11.348 4.900 -1.700 188 HA THR 42 HA THR 42 10.909 7.674 -2.463 189 HB THR 42 HB THR 42 9.306 5.299 -3.393 190 HG1 THR 42 HG1 THR 42 11.195 5.915 -5.172 191 HG21 THR 42 HG21 THR 42 8.472 7.535 -3.981 192 HG22 THR 42 HG22 THR 42 9.012 6.648 -5.408 193 HG23 THR 42 HG23 THR 42 10.028 7.914 -4.719 194 H HIS 43 HN HIS 43 8.889 8.718 -2.206 195 HA HIS 43 HA HIS 43 7.589 8.328 0.259 196 HB2 HIS 43 HB2 HIS 43 6.926 9.953 -2.190 197 HB3 HIS 43 HB1 HIS 43 5.838 9.899 -0.807 198 HD2 HIS 43 HD2 HIS 43 6.569 11.394 1.353 199 HE1 HIS 43 HE1 HIS 43 10.136 12.891 -0.352 200 HE2 HIS 43 HE2 HIS 43 8.402 13.223 1.467 201 H LEU 44 HN LEU 44 5.501 7.573 0.729 202 HA LEU 44 HA LEU 44 4.728 5.281 -0.754 203 HB2 LEU 44 HB2 LEU 44 3.500 6.750 1.560 204 HB3 LEU 44 HB1 LEU 44 2.710 5.366 0.827 205 HG LEU 44 HG LEU 44 5.522 5.227 1.898 206 HD11 LEU 44 HD11 LEU 44 2.954 4.623 3.347 207 HD12 LEU 44 HD12 LEU 44 4.126 5.879 3.747 208 HD13 LEU 44 HD13 LEU 44 4.567 4.179 3.905 209 HD21 LEU 44 HD21 LEU 44 4.994 2.812 2.003 210 HD22 LEU 44 HD22 LEU 44 4.964 3.464 0.366 211 HD23 LEU 44 HD23 LEU 44 3.451 3.147 1.216 212 H LYS 45 HN LYS 45 4.203 8.498 -1.301 213 HA LYS 45 HA LYS 45 1.588 8.716 -2.205 214 HB2 LYS 45 HB2 LYS 45 2.892 10.696 -2.056 215 HB3 LYS 45 HB1 LYS 45 4.161 10.030 -3.072 216 HG2 LYS 45 HG2 LYS 45 3.030 11.623 -4.380 217 HG3 LYS 45 HG1 LYS 45 2.495 10.046 -4.961 218 HD2 LYS 45 HD2 LYS 45 0.529 10.322 -3.351 219 HD3 LYS 45 HD1 LYS 45 1.018 12.014 -3.248 220 HE2 LYS 45 HE2 LYS 45 0.788 12.224 -5.673 221 HE3 LYS 45 HE1 LYS 45 0.286 10.535 -5.772 222 HZ1 LYS 45 HZ1 LYS 45 -1.782 11.164 -5.352 223 HZ2 LYS 45 HZ2 LYS 45 -1.297 12.781 -5.288 224 HZ3 LYS 45 HZ3 LYS 45 -1.316 11.848 -3.869 225 H LYS 46 HN LYS 46 4.510 7.843 -4.024 226 HA LYS 46 HA LYS 46 3.174 7.329 -6.464 227 HB2 LYS 46 HB2 LYS 46 5.786 7.603 -5.727 228 HB3 LYS 46 HB1 LYS 46 5.684 5.869 -5.992 229 HG2 LYS 46 HG2 LYS 46 6.400 6.890 -8.019 230 HG3 LYS 46 HG1 LYS 46 4.742 6.331 -8.248 231 HD2 LYS 46 HD2 LYS 46 3.927 8.612 -7.822 232 HD3 LYS 46 HD1 LYS 46 5.591 9.159 -7.623 233 HE2 LYS 46 HE2 LYS 46 4.848 9.712 -9.837 234 HE3 LYS 46 HE1 LYS 46 6.059 8.435 -9.945 235 HZ1 LYS 46 HZ1 LYS 46 3.129 7.924 -9.981 236 HZ2 LYS 46 HZ2 LYS 46 4.379 6.835 -10.352 237 HZ3 LYS 46 HZ3 LYS 46 4.064 8.134 -11.383 238 H LEU 47 HN LEU 47 3.839 5.386 -3.653 239 HA LEU 47 HA LEU 47 3.305 2.877 -4.916 240 HB2 LEU 47 HB2 LEU 47 3.536 3.756 -2.054 241 HB3 LEU 47 HB1 LEU 47 3.014 2.134 -2.459 242 HG LEU 47 HG LEU 47 5.295 1.903 -2.030 243 HD11 LEU 47 HD11 LEU 47 6.283 1.234 -4.080 244 HD12 LEU 47 HD12 LEU 47 5.261 2.335 -5.002 245 HD13 LEU 47 HD13 LEU 47 4.550 0.929 -4.210 246 HD21 LEU 47 HD21 LEU 47 5.685 4.447 -3.581 247 HD22 LEU 47 HD22 LEU 47 7.012 3.389 -3.098 248 HD23 LEU 47 HD23 LEU 47 6.004 4.156 -1.871 249 H LYS 48 HN LYS 48 1.444 5.103 -2.886 250 HA LYS 48 HA LYS 48 -0.891 3.576 -2.665 251 HB2 LYS 48 HB2 LYS 48 -0.413 6.548 -2.586 252 HB3 LYS 48 HB1 LYS 48 -2.005 5.849 -2.329 253 HG2 LYS 48 HG2 LYS 48 -1.205 4.633 -0.402 254 HG3 LYS 48 HG1 LYS 48 0.439 5.209 -0.689 255 HD2 LYS 48 HD2 LYS 48 -0.485 6.562 1.042 256 HD3 LYS 48 HD1 LYS 48 -0.441 7.550 -0.417 257 HE2 LYS 48 HE2 LYS 48 -2.829 7.002 -0.801 258 HE3 LYS 48 HE1 LYS 48 -2.841 6.130 0.730 259 HZ1 LYS 48 HZ1 LYS 48 -2.346 8.166 1.888 260 HZ2 LYS 48 HZ2 LYS 48 -3.715 8.394 0.917 261 HZ3 LYS 48 HZ3 LYS 48 -2.221 9.023 0.424 262 H GLU 49 HN GLU 49 -0.030 6.070 -5.073 263 HA GLU 49 HA GLU 49 -2.478 5.908 -6.474 264 HB2 GLU 49 HB2 GLU 49 -1.269 7.046 -8.326 265 HB3 GLU 49 HB1 GLU 49 -1.092 7.848 -6.773 266 HG2 GLU 49 HG2 GLU 49 1.127 6.977 -6.517 267 HG3 GLU 49 HG1 GLU 49 0.948 5.991 -7.966 268 H SER 50 HN SER 50 0.586 4.183 -6.852 269 HA SER 50 HA SER 50 -0.035 2.900 -9.277 270 HB2 SER 50 HB2 SER 50 1.772 1.989 -7.029 271 HB3 SER 50 HB1 SER 50 1.740 1.287 -8.647 272 HG SER 50 HG SER 50 2.656 3.807 -7.801 273 H TYR 51 HN TYR 51 -0.709 2.041 -5.916 274 HA TYR 51 HA TYR 51 -1.703 -0.549 -6.460 275 HB2 TYR 51 HB2 TYR 51 -1.058 0.366 -4.185 276 HB3 TYR 51 HB1 TYR 51 -2.588 1.238 -4.189 277 HD1 TYR 51 HD1 TYR 51 -1.050 -2.115 -4.142 278 HD2 TYR 51 HD2 TYR 51 -4.649 0.115 -3.717 279 HE1 TYR 51 HE1 TYR 51 -2.172 -4.109 -3.243 280 HE2 TYR 51 HE2 TYR 51 -5.782 -1.875 -2.817 281 HH TYR 51 HH TYR 51 -5.577 -4.272 -2.825 282 H CYS 52 HN CYS 52 -3.205 2.642 -6.339 283 HA CYS 52 HA CYS 52 -5.877 1.805 -6.648 284 HB2 CYS 52 HB2 CYS 52 -4.643 4.389 -7.635 285 HB3 CYS 52 HB1 CYS 52 -6.348 4.099 -7.311 286 HG CYS 52 HG CYS 52 -3.891 4.099 -4.924 287 H GLN 53 HN GLN 53 -3.354 2.675 -8.963 288 HA GLN 53 HA GLN 53 -4.904 2.384 -11.302 289 HB2 GLN 53 HB2 GLN 53 -1.919 2.078 -10.896 290 HB3 GLN 53 HB1 GLN 53 -2.711 2.205 -12.461 291 HG2 GLN 53 HG2 GLN 53 -3.365 4.437 -12.058 292 HG3 GLN 53 HG1 GLN 53 -2.952 4.325 -10.349 293 HE21 GLN 53 HE21 GLN 53 -2.054 6.261 -12.281 294 HE22 GLN 53 HE22 GLN 53 -0.329 6.145 -12.335 295 H ARG 54 HN ARG 54 -2.944 0.139 -9.424 296 HA ARG 54 HA ARG 54 -3.042 -2.072 -11.145 297 HB2 ARG 54 HB2 ARG 54 -1.522 -1.998 -9.253 298 HB3 ARG 54 HB1 ARG 54 -2.869 -1.942 -8.126 299 HG2 ARG 54 HG2 ARG 54 -2.224 -4.141 -7.985 300 HG3 ARG 54 HG1 ARG 54 -3.512 -4.225 -9.187 301 HD2 ARG 54 HD2 ARG 54 -1.974 -4.416 -10.967 302 HD3 ARG 54 HD1 ARG 54 -0.623 -3.914 -9.954 303 HE ARG 54 HE ARG 54 -1.948 -6.379 -9.173 304 HH11 ARG 54 HH11 ARG 54 0.708 -4.847 -10.899 305 HH12 ARG 54 HH12 ARG 54 1.713 -6.341 -10.908 306 HH21 ARG 54 HH21 ARG 54 -0.684 -8.304 -9.127 307 HH22 ARG 54 HH22 ARG 54 0.945 -8.262 -9.919 308 H GLN 55 HN GLN 55 -5.278 -0.980 -8.625 309 HA GLN 55 HA GLN 55 -7.021 -3.250 -8.934 310 HB2 GLN 55 HB2 GLN 55 -7.574 -0.606 -7.578 311 HB3 GLN 55 HB1 GLN 55 -8.513 -2.078 -7.399 312 HG2 GLN 55 HG2 GLN 55 -5.707 -1.569 -6.448 313 HG3 GLN 55 HG1 GLN 55 -7.153 -1.800 -5.467 314 HE21 GLN 55 HE21 GLN 55 -8.107 -3.896 -5.404 315 HE22 GLN 55 HE22 GLN 55 -7.152 -5.302 -5.715 316 H GLY 56 HN GLY 56 -6.695 -0.114 -10.363 317 HA2 GLY 56 HA2 GLY 56 -7.666 0.513 -12.410 318 HA3 GLY 56 HA1 GLY 56 -8.881 -0.738 -12.194 319 H VAL 57 HN VAL 57 -8.000 1.633 -9.764 320 HA VAL 57 HA VAL 57 -10.574 3.001 -10.185 321 HB VAL 57 HB VAL 57 -10.782 3.218 -7.694 322 HG11 VAL 57 HG11 VAL 57 -11.605 0.922 -7.316 323 HG12 VAL 57 HG12 VAL 57 -10.822 0.417 -8.812 324 HG13 VAL 57 HG13 VAL 57 -12.136 1.593 -8.857 325 HG21 VAL 57 HG21 VAL 57 -8.550 1.191 -7.700 326 HG22 VAL 57 HG22 VAL 57 -9.542 1.588 -6.299 327 HG23 VAL 57 HG23 VAL 57 -8.507 2.819 -7.021 328 HA PRO 58 HA PRO 58 -8.221 6.735 -9.863 329 HB2 PRO 58 HB2 PRO 58 -9.957 8.408 -8.606 330 HB3 PRO 58 HB1 PRO 58 -10.152 7.916 -10.296 331 HG2 PRO 58 HG2 PRO 58 -11.513 6.842 -7.864 332 HG3 PRO 58 HG1 PRO 58 -12.196 7.226 -9.456 333 HD2 PRO 58 HD2 PRO 58 -11.600 4.702 -8.736 334 HD3 PRO 58 HD1 PRO 58 -11.435 5.272 -10.409 335 H MET 59 HN MET 59 -7.241 8.237 -8.272 336 HA MET 59 HA MET 59 -6.560 6.833 -5.869 337 HB2 MET 59 HB2 MET 59 -5.107 8.451 -7.356 338 HB3 MET 59 HB1 MET 59 -5.789 9.686 -6.304 339 HG2 MET 59 HG2 MET 59 -4.971 8.353 -4.355 340 HG3 MET 59 HG1 MET 59 -4.134 7.309 -5.499 341 HE1 MET 59 HE1 MET 59 -1.829 7.734 -4.263 342 HE2 MET 59 HE2 MET 59 -2.693 8.735 -3.095 343 HE3 MET 59 HE3 MET 59 -1.226 9.343 -3.863 344 H ASN 60 HN ASN 60 -6.720 7.705 -3.742 345 HA ASN 60 HA ASN 60 -7.734 8.626 -1.951 346 HB2 ASN 60 HB2 ASN 60 -7.692 10.729 -3.655 347 HB3 ASN 60 HB1 ASN 60 -9.427 10.554 -3.410 348 HD21 ASN 60 HD21 ASN 60 -9.880 12.217 -2.096 349 HD22 ASN 60 HD22 ASN 60 -9.148 12.487 -0.554 350 H SER 61 HN SER 61 -8.991 6.604 -3.823 351 HA SER 61 HA SER 61 -11.794 6.871 -3.033 352 HB2 SER 61 HB2 SER 61 -12.105 4.857 -4.505 353 HB3 SER 61 HB1 SER 61 -11.443 6.256 -5.354 354 HG SER 61 HG SER 61 -9.736 5.123 -5.794 355 H LEU 62 HN LEU 62 -8.932 4.945 -2.603 356 HA LEU 62 HA LEU 62 -10.261 3.340 -0.533 357 HB2 LEU 62 HB2 LEU 62 -7.698 2.723 -2.005 358 HB3 LEU 62 HB1 LEU 62 -8.548 1.669 -0.892 359 HG LEU 62 HG LEU 62 -9.667 2.578 -3.545 360 HD11 LEU 62 HD11 LEU 62 -9.157 0.327 -4.335 361 HD12 LEU 62 HD12 LEU 62 -8.361 -0.035 -2.802 362 HD13 LEU 62 HD13 LEU 62 -7.690 1.192 -3.877 363 HD21 LEU 62 HD21 LEU 62 -11.396 1.993 -1.961 364 HD22 LEU 62 HD22 LEU 62 -10.566 0.487 -1.565 365 HD23 LEU 62 HD23 LEU 62 -11.254 0.720 -3.172 366 H ARG 63 HN ARG 63 -9.322 3.179 1.474 367 HA ARG 63 HA ARG 63 -7.175 5.118 2.014 368 HB2 ARG 63 HB2 ARG 63 -8.051 5.145 4.355 369 HB3 ARG 63 HB1 ARG 63 -9.183 5.766 3.162 370 HG2 ARG 63 HG2 ARG 63 -10.334 3.569 3.184 371 HG3 ARG 63 HG1 ARG 63 -9.246 3.057 4.477 372 HD2 ARG 63 HD2 ARG 63 -10.047 4.920 5.861 373 HD3 ARG 63 HD1 ARG 63 -11.163 5.383 4.578 374 HE ARG 63 HE ARG 63 -11.333 2.725 5.825 375 HH11 ARG 63 HH11 ARG 63 -14.389 5.375 5.616 376 HH12 ARG 63 HH12 ARG 63 -12.762 5.834 4.972 377 HH21 ARG 63 HH21 ARG 63 -13.386 2.092 6.590 378 HH22 ARG 63 HH22 ARG 63 -14.745 3.274 6.493 379 H PHE 64 HN PHE 64 -5.307 4.394 2.745 380 HA PHE 64 HA PHE 64 -5.010 1.554 3.324 381 HB2 PHE 64 HB2 PHE 64 -3.007 3.772 2.856 382 HB3 PHE 64 HB1 PHE 64 -2.548 2.132 3.305 383 HD1 PHE 64 HD1 PHE 64 -3.867 4.273 0.658 384 HD2 PHE 64 HD2 PHE 64 -2.788 0.302 1.745 385 HE1 PHE 64 HE1 PHE 64 -3.907 3.617 -1.712 386 HE2 PHE 64 HE2 PHE 64 -2.825 -0.359 -0.623 387 HZ PHE 64 HZ PHE 64 -3.386 1.302 -2.354 388 H LEU 65 HN LEU 65 -5.035 0.842 5.337 389 HA LEU 65 HA LEU 65 -4.452 2.766 7.486 390 HB2 LEU 65 HB2 LEU 65 -6.141 0.268 7.546 391 HB3 LEU 65 HB1 LEU 65 -5.797 1.274 8.939 392 HG LEU 65 HG LEU 65 -7.376 2.078 6.493 393 HD11 LEU 65 HD11 LEU 65 -9.240 2.237 8.068 394 HD12 LEU 65 HD12 LEU 65 -8.198 1.638 9.358 395 HD13 LEU 65 HD13 LEU 65 -8.590 0.600 7.988 396 HD21 LEU 65 HD21 LEU 65 -6.568 3.667 8.922 397 HD22 LEU 65 HD22 LEU 65 -7.840 4.151 7.799 398 HD23 LEU 65 HD23 LEU 65 -6.175 4.002 7.236 399 H PHE 66 HN PHE 66 -2.617 2.523 8.464 400 HA PHE 66 HA PHE 66 -1.465 -0.177 8.722 401 HB2 PHE 66 HB2 PHE 66 -0.168 1.352 7.210 402 HB3 PHE 66 HB1 PHE 66 0.056 2.439 8.576 403 HD1 PHE 66 HD1 PHE 66 0.798 -0.971 7.340 404 HD2 PHE 66 HD2 PHE 66 1.775 2.091 10.130 405 HE1 PHE 66 HE1 PHE 66 2.811 -2.218 8.001 406 HE2 PHE 66 HE2 PHE 66 3.788 0.845 10.796 407 HZ PHE 66 HZ PHE 66 4.310 -1.315 9.733 408 H GLU 67 HN GLU 67 -1.720 -0.826 10.750 409 HA GLU 67 HA GLU 67 -1.807 -0.869 13.016 410 HB2 GLU 67 HB2 GLU 67 0.020 1.494 12.631 411 HB3 GLU 67 HB1 GLU 67 -0.446 0.938 14.232 412 HG2 GLU 67 HG2 GLU 67 0.942 -0.746 12.158 413 HG3 GLU 67 HG1 GLU 67 1.738 0.068 13.503 414 H GLY 68 HN GLY 68 -3.778 0.605 11.408 415 HA2 GLY 68 HA2 GLY 68 -5.843 1.451 12.177 416 HA3 GLY 68 HA1 GLY 68 -5.039 2.030 13.626 417 H GLN 69 HN GLN 69 -2.872 3.231 11.924 418 HA GLN 69 HA GLN 69 -4.211 5.774 11.525 419 HB2 GLN 69 HB2 GLN 69 -1.291 5.018 11.271 420 HB3 GLN 69 HB1 GLN 69 -1.927 6.654 11.160 421 HG2 GLN 69 HG2 GLN 69 -2.735 6.483 13.467 422 HG3 GLN 69 HG1 GLN 69 -2.058 4.860 13.575 423 HE21 GLN 69 HE21 GLN 69 -1.494 7.284 15.106 424 HE22 GLN 69 HE22 GLN 69 0.207 7.558 14.952 425 H ARG 70 HN ARG 70 -4.537 6.793 9.587 426 HA ARG 70 HA ARG 70 -4.347 5.135 7.232 427 HB2 ARG 70 HB2 ARG 70 -5.447 7.082 6.084 428 HB3 ARG 70 HB1 ARG 70 -6.367 6.389 7.411 429 HG2 ARG 70 HG2 ARG 70 -5.507 8.217 8.863 430 HG3 ARG 70 HG1 ARG 70 -4.787 8.945 7.427 431 HD2 ARG 70 HD2 ARG 70 -7.701 8.243 7.553 432 HD3 ARG 70 HD1 ARG 70 -7.093 9.781 8.161 433 HE ARG 70 HE ARG 70 -6.150 10.040 5.814 434 HH11 ARG 70 HH11 ARG 70 -9.100 8.236 6.522 435 HH12 ARG 70 HH12 ARG 70 -9.824 8.581 4.897 436 HH21 ARG 70 HH21 ARG 70 -7.050 10.500 3.765 437 HH22 ARG 70 HH22 ARG 70 -8.676 9.818 3.366 438 H ILE 71 HN ILE 71 -2.875 5.218 5.720 439 HA ILE 71 HA ILE 71 -0.474 6.677 6.097 440 HB ILE 71 HB ILE 71 -1.447 5.063 3.737 441 HG12 ILE 71 HG12 ILE 71 -1.212 3.743 5.772 442 HG13 ILE 71 HG11 ILE 71 0.066 3.329 4.634 443 HG21 ILE 71 HG21 ILE 71 0.814 5.041 2.925 444 HG22 ILE 71 HG22 ILE 71 1.366 5.974 4.316 445 HG23 ILE 71 HG23 ILE 71 0.297 6.716 3.126 446 HD11 ILE 71 HD11 ILE 71 1.597 4.810 5.906 447 HD12 ILE 71 HD12 ILE 71 0.985 3.442 6.835 448 HD13 ILE 71 HD13 ILE 71 0.311 5.051 7.089 449 H ALA 72 HN ALA 72 0.009 8.662 5.510 450 HA ALA 72 HA ALA 72 -1.767 10.174 3.796 451 HB1 ALA 72 HB1 ALA 72 -0.312 12.076 4.345 452 HB2 ALA 72 HB2 ALA 72 0.790 10.984 5.184 453 HB3 ALA 72 HB3 ALA 72 -0.845 11.225 5.797 454 H ASP 73 HN ASP 73 -0.758 11.559 2.052 455 HA ASP 73 HA ASP 73 0.559 9.835 0.197 456 HB2 ASP 73 HB2 ASP 73 -0.382 12.680 0.126 457 HB3 ASP 73 HB1 ASP 73 0.661 12.072 -1.152 458 H ASN 74 HN ASN 74 1.594 12.291 2.414 459 HA ASN 74 HA ASN 74 4.237 12.466 1.191 460 HB2 ASN 74 HB2 ASN 74 4.688 14.201 2.869 461 HB3 ASN 74 HB1 ASN 74 3.207 14.539 1.983 462 HD21 ASN 74 HD21 ASN 74 4.599 13.808 5.047 463 HD22 ASN 74 HD22 ASN 74 3.149 13.973 5.980 464 H HIS 75 HN HIS 75 2.966 10.137 2.863 465 HA HIS 75 HA HIS 75 4.869 9.900 5.037 466 HB2 HIS 75 HB2 HIS 75 2.447 8.450 4.151 467 HB3 HIS 75 HB1 HIS 75 3.681 7.460 4.917 468 HD2 HIS 75 HD2 HIS 75 4.451 9.975 7.094 469 HE1 HIS 75 HE1 HIS 75 0.549 9.031 8.432 470 HE2 HIS 75 HE2 HIS 75 2.782 10.044 9.075 471 H THR 76 HN THR 76 6.418 8.248 5.211 472 HA THR 76 HA THR 76 7.171 6.971 2.666 473 HB THR 76 HB THR 76 9.547 7.217 3.332 474 HG1 THR 76 HG1 THR 76 8.415 8.760 5.458 475 HG21 THR 76 HG21 THR 76 8.775 8.823 1.778 476 HG22 THR 76 HG22 THR 76 9.667 9.726 3.002 477 HG23 THR 76 HG23 THR 76 7.905 9.718 3.023 478 HA PRO 77 HA PRO 77 7.304 3.173 4.931 479 HB2 PRO 77 HB2 PRO 77 9.781 2.367 3.576 480 HB3 PRO 77 HB1 PRO 77 8.158 1.681 3.439 481 HG2 PRO 77 HG2 PRO 77 9.272 3.061 1.431 482 HG3 PRO 77 HG1 PRO 77 7.527 3.106 1.758 483 HD2 PRO 77 HD2 PRO 77 9.626 5.123 2.444 484 HD3 PRO 77 HD1 PRO 77 7.976 5.371 1.831 485 H LYS 78 HN LYS 78 9.956 5.340 5.006 486 HA LYS 78 HA LYS 78 11.637 3.897 6.801 487 HB2 LYS 78 HB2 LYS 78 12.468 5.710 5.327 488 HB3 LYS 78 HB1 LYS 78 11.529 6.870 6.253 489 HG2 LYS 78 HG2 LYS 78 13.848 6.940 6.935 490 HG3 LYS 78 HG1 LYS 78 12.844 6.334 8.255 491 HD2 LYS 78 HD2 LYS 78 14.832 4.994 8.143 492 HD3 LYS 78 HD1 LYS 78 13.476 4.017 7.583 493 HE2 LYS 78 HE2 LYS 78 14.113 4.540 5.254 494 HE3 LYS 78 HE1 LYS 78 15.516 5.418 5.863 495 HZ1 LYS 78 HZ1 LYS 78 16.070 3.160 5.183 496 HZ2 LYS 78 HZ2 LYS 78 14.972 2.534 6.309 497 HZ3 LYS 78 HZ3 LYS 78 16.338 3.381 6.837 498 H GLU 79 HN GLU 79 9.186 6.432 7.167 499 HA GLU 79 HA GLU 79 9.480 6.428 10.044 500 HB2 GLU 79 HB2 GLU 79 7.671 8.080 10.037 501 HB3 GLU 79 HB1 GLU 79 8.937 8.527 8.905 502 HG2 GLU 79 HG2 GLU 79 7.412 7.315 7.172 503 HG3 GLU 79 HG1 GLU 79 6.158 7.597 8.377 504 H LEU 80 HN LEU 80 7.313 6.240 11.317 505 HA LEU 80 HA LEU 80 5.533 5.012 12.031 506 HB2 LEU 80 HB2 LEU 80 5.447 3.860 9.239 507 HB3 LEU 80 HB1 LEU 80 4.223 3.640 10.473 508 HG LEU 80 HG LEU 80 4.894 6.428 9.665 509 HD11 LEU 80 HD11 LEU 80 3.333 6.316 7.790 510 HD12 LEU 80 HD12 LEU 80 3.169 4.575 8.024 511 HD13 LEU 80 HD13 LEU 80 4.720 5.256 7.530 512 HD21 LEU 80 HD21 LEU 80 2.329 5.012 10.386 513 HD22 LEU 80 HD22 LEU 80 2.511 6.741 10.090 514 HD23 LEU 80 HD23 LEU 80 3.311 5.995 11.474 515 H GLY 81 HN GLY 81 7.746 3.177 9.944 516 HA2 GLY 81 HA2 GLY 81 9.263 1.590 10.982 517 HA3 GLY 81 HA1 GLY 81 7.987 1.202 12.124 518 H MET 82 HN MET 82 7.946 1.456 8.574 519 HA MET 82 HA MET 82 6.420 -0.965 8.371 520 HB2 MET 82 HB2 MET 82 7.583 0.962 6.381 521 HB3 MET 82 HB1 MET 82 6.907 -0.574 5.852 522 HG2 MET 82 HG2 MET 82 4.780 0.036 6.952 523 HG3 MET 82 HG1 MET 82 5.472 1.609 7.340 524 HE1 MET 82 HE1 MET 82 2.749 0.905 5.660 525 HE2 MET 82 HE2 MET 82 2.807 2.154 4.416 526 HE3 MET 82 HE3 MET 82 3.193 2.559 6.089 527 H GLU 83 HN GLU 83 7.297 -2.898 8.592 528 HA GLU 83 HA GLU 83 10.073 -3.297 7.683 529 HB2 GLU 83 HB2 GLU 83 8.427 -4.688 9.795 530 HB3 GLU 83 HB1 GLU 83 9.935 -5.355 9.184 531 HG2 GLU 83 HG2 GLU 83 9.688 -2.632 10.432 532 HG3 GLU 83 HG1 GLU 83 10.135 -4.090 11.315 533 H GLU 84 HN GLU 84 10.432 -5.732 7.128 534 HA GLU 84 HA GLU 84 8.856 -6.302 4.832 535 HB2 GLU 84 HB2 GLU 84 11.185 -6.890 4.825 536 HB3 GLU 84 HB1 GLU 84 11.009 -7.850 6.285 537 HG2 GLU 84 HG2 GLU 84 11.249 -9.231 4.286 538 HG3 GLU 84 HG1 GLU 84 9.699 -9.492 5.085 539 H GLU 85 HN GLU 85 7.336 -7.905 4.499 540 HA GLU 85 HA GLU 85 5.668 -9.369 4.957 541 HB2 GLU 85 HB2 GLU 85 7.676 -10.055 7.024 542 HB3 GLU 85 HB1 GLU 85 6.036 -10.610 7.322 543 HG2 GLU 85 HG2 GLU 85 7.549 -11.154 4.785 544 HG3 GLU 85 HG1 GLU 85 7.510 -12.250 6.166 545 H ASP 86 HN ASP 86 5.757 -6.566 6.054 546 HA ASP 86 HA ASP 86 4.236 -6.673 8.487 547 HB2 ASP 86 HB2 ASP 86 5.738 -4.715 7.254 548 HB3 ASP 86 HB1 ASP 86 4.085 -4.156 7.007 549 H VAL 87 HN VAL 87 2.065 -5.704 8.675 550 HA VAL 87 HA VAL 87 0.423 -6.526 6.372 551 HB VAL 87 HB VAL 87 -0.287 -6.441 9.307 552 HG11 VAL 87 HG11 VAL 87 -2.413 -7.469 8.644 553 HG12 VAL 87 HG12 VAL 87 -1.971 -7.270 6.949 554 HG13 VAL 87 HG13 VAL 87 -2.229 -5.851 7.965 555 HG21 VAL 87 HG21 VAL 87 0.055 -8.751 7.404 556 HG22 VAL 87 HG22 VAL 87 -0.466 -8.869 9.084 557 HG23 VAL 87 HG23 VAL 87 1.161 -8.302 8.704 558 H ILE 88 HN ILE 88 -0.846 -5.123 5.389 559 HA ILE 88 HA ILE 88 -1.574 -2.623 6.744 560 HB ILE 88 HB ILE 88 0.326 -2.102 5.280 561 HG12 ILE 88 HG12 ILE 88 -2.226 -1.054 4.045 562 HG13 ILE 88 HG11 ILE 88 -1.579 -0.487 5.582 563 HG21 ILE 88 HG21 ILE 88 0.206 -2.364 2.871 564 HG22 ILE 88 HG22 ILE 88 -1.378 -3.125 3.017 565 HG23 ILE 88 HG23 ILE 88 0.050 -3.926 3.675 566 HD11 ILE 88 HD11 ILE 88 0.492 0.184 4.388 567 HD12 ILE 88 HD12 ILE 88 -0.952 1.049 3.868 568 HD13 ILE 88 HD13 ILE 88 -0.298 -0.250 2.872 569 H GLU 89 HN GLU 89 -3.685 -2.011 6.386 570 HA GLU 89 HA GLU 89 -5.268 -3.855 4.727 571 HB2 GLU 89 HB2 GLU 89 -6.073 -2.113 7.058 572 HB3 GLU 89 HB1 GLU 89 -7.201 -3.058 6.097 573 HG2 GLU 89 HG2 GLU 89 -6.234 -5.102 6.820 574 HG3 GLU 89 HG1 GLU 89 -4.879 -4.263 7.576 575 H VAL 90 HN VAL 90 -6.966 -3.060 3.433 576 HA VAL 90 HA VAL 90 -6.890 -0.188 2.859 577 HB VAL 90 HB VAL 90 -5.475 -1.235 1.176 578 HG11 VAL 90 HG11 VAL 90 -7.874 -2.928 0.493 579 HG12 VAL 90 HG12 VAL 90 -6.358 -3.490 1.198 580 HG13 VAL 90 HG13 VAL 90 -6.382 -2.844 -0.443 581 HG21 VAL 90 HG21 VAL 90 -8.142 -0.361 0.074 582 HG22 VAL 90 HG22 VAL 90 -6.639 -0.450 -0.844 583 HG23 VAL 90 HG23 VAL 90 -6.786 0.683 0.499 584 H TYR 91 HN TYR 91 -8.832 0.682 2.876 585 HA TYR 91 HA TYR 91 -11.165 -0.985 2.217 586 HB2 TYR 91 HB2 TYR 91 -10.922 0.935 4.544 587 HB3 TYR 91 HB1 TYR 91 -12.429 0.188 4.025 588 HD1 TYR 91 HD1 TYR 91 -12.699 -2.297 4.222 589 HD2 TYR 91 HD2 TYR 91 -9.366 -0.245 5.898 590 HE1 TYR 91 HE1 TYR 91 -12.221 -4.244 5.645 591 HE2 TYR 91 HE2 TYR 91 -8.882 -2.189 7.326 592 HH TYR 91 HH TYR 91 -9.385 -4.320 7.788 593 H GLN 92 HN GLN 92 -13.150 0.490 1.838 594 HA GLN 92 HA GLN 92 -12.274 2.544 -0.029 595 HB2 GLN 92 HB2 GLN 92 -14.045 0.817 -0.589 596 HB3 GLN 92 HB1 GLN 92 -15.109 1.665 0.524 597 HG2 GLN 92 HG2 GLN 92 -14.397 3.735 -0.966 598 HG3 GLN 92 HG1 GLN 92 -14.133 2.462 -2.156 599 HE21 GLN 92 HE21 GLN 92 -16.467 4.202 -0.284 600 HE22 GLN 92 HE22 GLN 92 -17.874 3.582 -1.081 601 H GLU 93 HN GLU 93 -12.726 4.701 0.123 602 HA GLU 93 HA GLU 93 -13.268 5.729 2.756 603 HB2 GLU 93 HB2 GLU 93 -12.517 6.900 0.110 604 HB3 GLU 93 HB1 GLU 93 -13.222 7.959 1.325 605 HG2 GLU 93 HG2 GLU 93 -10.833 6.215 1.848 606 HG3 GLU 93 HG1 GLU 93 -10.716 7.874 1.258 607 H GLN 94 HN GLN 94 -14.923 7.426 3.126 608 HA GLN 94 HA GLN 94 -17.489 6.475 2.373 609 HB2 GLN 94 HB2 GLN 94 -18.354 8.041 3.849 610 HB3 GLN 94 HB1 GLN 94 -16.747 7.771 4.504 611 HG2 GLN 94 HG2 GLN 94 -15.971 9.808 3.354 612 HG3 GLN 94 HG1 GLN 94 -17.616 10.088 2.790 613 HE21 GLN 94 HE21 GLN 94 -19.219 10.648 4.304 614 HE22 GLN 94 HE22 GLN 94 -18.797 11.313 5.843 615 H THR 95 HN THR 95 -15.312 8.731 0.995 616 HA THR 95 HA THR 95 -17.224 10.248 -0.484 617 HB THR 95 HB THR 95 -14.979 10.714 -1.837 618 HG1 THR 95 HG1 THR 95 -13.174 10.380 -0.496 619 HG21 THR 95 HG21 THR 95 -16.179 12.377 -0.524 620 HG22 THR 95 HG22 THR 95 -14.449 12.478 -0.196 621 HG23 THR 95 HG23 THR 95 -15.523 11.701 0.967 622 H GLY 96 HN GLY 96 -15.344 7.346 -1.022 623 HA2 GLY 96 HA2 GLY 96 -15.639 5.678 -2.599 624 HA3 GLY 96 HA1 GLY 96 -16.977 6.603 -3.265 625 H GLY 97 HN GLY 97 -14.219 8.497 -2.990 626 HA2 GLY 97 HA2 GLY 97 -12.340 8.324 -4.656 627 HA3 GLY 97 HA1 GLY 97 -13.615 8.063 -5.841 628 H1 ASN 357 HT1 ASN 357 -4.433 -20.302 -3.999 629 H2 ASN 357 HT2 ASN 357 -5.128 -20.209 -2.462 630 H3 ASN 357 HT3 ASN 357 -3.728 -21.122 -2.697 631 HA ASN 357 HA ASN 357 -3.212 -19.056 -1.614 632 HB2 ASN 357 HB2 ASN 357 -1.475 -18.258 -3.152 633 HB3 ASN 357 HB1 ASN 357 -1.533 -20.014 -3.135 634 HD21 ASN 357 HD21 ASN 357 -0.475 -18.199 -5.155 635 HD22 ASN 357 HD22 ASN 357 -1.329 -18.551 -6.618 636 H ASN 358 HN ASN 358 -3.279 -16.819 -1.536 637 HA ASN 358 HA ASN 358 -4.982 -15.476 -3.518 638 HB2 ASN 358 HB2 ASN 358 -6.029 -14.189 -1.607 639 HB3 ASN 358 HB1 ASN 358 -6.497 -15.879 -1.717 640 HD21 ASN 358 HD21 ASN 358 -7.122 -15.147 0.553 641 HD22 ASN 358 HD22 ASN 358 -5.960 -15.457 1.793 642 H ARG 359 HN ARG 359 -2.095 -15.583 -3.053 643 HA ARG 359 HA ARG 359 -1.552 -12.822 -2.226 644 HB2 ARG 359 HB2 ARG 359 0.871 -13.602 -2.232 645 HB3 ARG 359 HB1 ARG 359 -0.166 -14.266 -0.981 646 HG2 ARG 359 HG2 ARG 359 -0.363 -16.345 -2.170 647 HG3 ARG 359 HG1 ARG 359 0.527 -15.691 -3.544 648 HD2 ARG 359 HD2 ARG 359 1.910 -17.139 -2.075 649 HD3 ARG 359 HD1 ARG 359 2.534 -15.497 -2.230 650 HE ARG 359 HE ARG 359 0.899 -15.550 0.026 651 HH11 ARG 359 HH11 ARG 359 3.893 -17.026 -1.098 652 HH12 ARG 359 HH12 ARG 359 4.574 -17.163 0.566 653 HH21 ARG 359 HH21 ARG 359 1.737 -15.640 2.116 654 HH22 ARG 359 HH22 ARG 359 3.366 -16.382 2.375 655 H ASP 360 HN ASP 360 -0.653 -11.375 -3.575 656 HA ASP 360 HA ASP 360 0.127 -12.214 -6.271 657 HB2 ASP 360 HB2 ASP 360 -2.247 -11.438 -6.330 658 HB3 ASP 360 HB1 ASP 360 -1.712 -9.875 -5.715 659 HA PRO 361 HA PRO 361 3.422 -9.469 -4.874 660 HB2 PRO 361 HB2 PRO 361 4.891 -10.379 -7.207 661 HB3 PRO 361 HB1 PRO 361 5.223 -10.686 -5.500 662 HG2 PRO 361 HG2 PRO 361 4.410 -12.622 -7.216 663 HG3 PRO 361 HG1 PRO 361 4.075 -12.649 -5.474 664 HD2 PRO 361 HD2 PRO 361 2.269 -11.888 -7.729 665 HD3 PRO 361 HD1 PRO 361 1.912 -12.796 -6.245 666 H ILE 362 HN ILE 362 2.772 -7.435 -5.288 667 HA ILE 362 HA ILE 362 2.578 -6.500 -8.051 668 HB ILE 362 HB ILE 362 1.918 -4.998 -5.521 669 HG12 ILE 362 HG12 ILE 362 0.069 -6.468 -7.415 670 HG13 ILE 362 HG11 ILE 362 0.473 -6.971 -5.775 671 HG21 ILE 362 HG21 ILE 362 1.200 -4.431 -8.394 672 HG22 ILE 362 HG22 ILE 362 2.427 -3.579 -7.454 673 HG23 ILE 362 HG23 ILE 362 0.728 -3.467 -6.994 674 HD11 ILE 362 HD11 ILE 362 -0.869 -4.366 -6.428 675 HD12 ILE 362 HD12 ILE 362 -0.653 -5.104 -4.842 676 HD13 ILE 362 HD13 ILE 362 -1.736 -5.847 -6.020 677 H VAL 363 HN VAL 363 4.261 -5.559 -8.974 678 HA VAL 363 HA VAL 363 6.176 -4.138 -7.245 679 HB VAL 363 HB VAL 363 6.992 -5.418 -9.841 680 HG11 VAL 363 HG11 VAL 363 8.470 -3.727 -8.901 681 HG12 VAL 363 HG12 VAL 363 9.224 -5.321 -8.853 682 HG13 VAL 363 HG13 VAL 363 8.543 -4.621 -7.384 683 HG21 VAL 363 HG21 VAL 363 7.945 -7.279 -8.414 684 HG22 VAL 363 HG22 VAL 363 6.198 -7.297 -8.648 685 HG23 VAL 363 HG23 VAL 363 6.878 -6.713 -7.128 686 H ILE 364 HN ILE 364 6.586 -2.075 -7.790 687 HA ILE 364 HA ILE 364 5.815 -1.171 -10.478 688 HB ILE 364 HB ILE 364 4.040 -0.376 -9.156 689 HG12 ILE 364 HG12 ILE 364 5.674 1.373 -10.481 690 HG13 ILE 364 HG11 ILE 364 4.081 1.768 -9.850 691 HG21 ILE 364 HG21 ILE 364 5.947 0.744 -7.121 692 HG22 ILE 364 HG22 ILE 364 5.164 -0.828 -6.976 693 HG23 ILE 364 HG23 ILE 364 4.189 0.641 -7.020 694 HD11 ILE 364 HD11 ILE 364 5.116 2.657 -7.818 695 HD12 ILE 364 HD12 ILE 364 5.710 3.470 -9.265 696 HD13 ILE 364 HD13 ILE 364 6.710 2.261 -8.460 697 H SER 365 HN SER 365 7.239 0.135 -11.473 698 HA SER 365 HA SER 365 9.842 0.409 -10.284 699 HB2 SER 365 HB2 SER 365 9.161 1.633 -12.916 700 HB3 SER 365 HB1 SER 365 10.601 0.737 -12.431 701 HG SER 365 HG SER 365 9.698 -0.963 -13.247 702 H ASP 366 HN ASP 366 10.580 2.115 -9.235 703 HA ASP 366 HA ASP 366 9.025 4.572 -9.166 704 HB2 ASP 366 HB2 ASP 366 9.669 4.334 -7.014 705 HB3 ASP 366 HB1 ASP 366 10.976 3.236 -7.432 706 H SER 367 HN SER 367 9.839 6.604 -9.750 707 HA SER 367 HA SER 367 12.371 6.623 -11.209 708 HB2 SER 367 HB2 SER 367 10.799 8.297 -12.733 709 HB3 SER 367 HB1 SER 367 11.230 6.640 -13.157 710 HG SER 367 HG SER 367 9.291 6.030 -11.943 711 HA PRO 368 HA PRO 368 13.173 10.315 -8.902 712 HB2 PRO 368 HB2 PRO 368 14.534 11.238 -11.376 713 HB3 PRO 368 HB1 PRO 368 15.171 11.085 -9.733 714 HG2 PRO 368 HG2 PRO 368 15.875 9.347 -11.603 715 HG3 PRO 368 HG1 PRO 368 15.571 8.821 -9.935 716 HD2 PRO 368 HD2 PRO 368 13.838 8.534 -12.346 717 HD3 PRO 368 HD1 PRO 368 14.108 7.403 -11.003 Start of MODEL 7 1 H TYR 21 HT1 TYR 21 14.408 -6.126 -1.393 2 HA TYR 21 HA TYR 21 13.120 -3.478 -1.610 3 HB2 TYR 21 HB2 TYR 21 12.903 -6.016 -3.149 4 HB3 TYR 21 HB1 TYR 21 11.409 -5.147 -2.818 5 HD1 TYR 21 HD1 TYR 21 10.876 -3.132 -3.973 6 HD2 TYR 21 HD2 TYR 21 14.703 -4.923 -4.470 7 HE1 TYR 21 HE1 TYR 21 11.326 -1.635 -5.870 8 HE2 TYR 21 HE2 TYR 21 15.162 -3.429 -6.365 9 HH TYR 21 HH TYR 21 13.772 -2.128 -8.058 10 H ILE 22 HN ILE 22 11.031 -3.346 -0.689 11 HA ILE 22 HA ILE 22 10.690 -5.175 1.588 12 HB ILE 22 HB ILE 22 9.292 -2.532 1.165 13 HG12 ILE 22 HG12 ILE 22 11.769 -2.246 1.218 14 HG13 ILE 22 HG11 ILE 22 10.950 -1.479 2.573 15 HG21 ILE 22 HG21 ILE 22 8.216 -4.028 2.753 16 HG22 ILE 22 HG22 ILE 22 8.915 -2.639 3.581 17 HG23 ILE 22 HG23 ILE 22 9.731 -4.200 3.639 18 HD11 ILE 22 HD11 ILE 22 12.933 -2.543 3.370 19 HD12 ILE 22 HD12 ILE 22 12.483 -4.063 2.602 20 HD13 ILE 22 HD13 ILE 22 11.541 -3.454 3.960 21 H LYS 23 HN LYS 23 8.950 -6.480 1.739 22 HA LYS 23 HA LYS 23 6.901 -6.209 -0.362 23 HB2 LYS 23 HB2 LYS 23 8.224 -8.212 -0.650 24 HB3 LYS 23 HB1 LYS 23 7.977 -8.667 1.027 25 HG2 LYS 23 HG2 LYS 23 5.507 -8.801 0.480 26 HG3 LYS 23 HG1 LYS 23 5.985 -8.680 -1.212 27 HD2 LYS 23 HD2 LYS 23 5.667 -11.024 -0.397 28 HD3 LYS 23 HD1 LYS 23 7.257 -10.696 -1.082 29 HE2 LYS 23 HE2 LYS 23 7.141 -12.045 1.089 30 HE3 LYS 23 HE1 LYS 23 8.294 -10.720 1.009 31 HZ1 LYS 23 HZ1 LYS 23 6.204 -11.112 2.841 32 HZ2 LYS 23 HZ2 LYS 23 5.888 -9.699 1.967 33 HZ3 LYS 23 HZ3 LYS 23 7.356 -9.859 2.794 34 H LEU 24 HN LEU 24 5.309 -5.086 0.625 35 HA LEU 24 HA LEU 24 4.535 -5.685 3.361 36 HB2 LEU 24 HB2 LEU 24 3.395 -3.717 1.374 37 HB3 LEU 24 HB1 LEU 24 2.921 -3.840 3.058 38 HG LEU 24 HG LEU 24 5.714 -3.140 2.141 39 HD11 LEU 24 HD11 LEU 24 4.157 -1.409 1.438 40 HD12 LEU 24 HD12 LEU 24 5.145 -0.841 2.783 41 HD13 LEU 24 HD13 LEU 24 3.478 -1.337 3.066 42 HD21 LEU 24 HD21 LEU 24 5.669 -4.109 4.358 43 HD22 LEU 24 HD22 LEU 24 4.359 -3.028 4.838 44 HD23 LEU 24 HD23 LEU 24 5.959 -2.375 4.481 45 H LYS 25 HN LYS 25 2.356 -6.236 3.958 46 HA LYS 25 HA LYS 25 1.017 -7.855 1.897 47 HB2 LYS 25 HB2 LYS 25 0.836 -8.101 4.901 48 HB3 LYS 25 HB1 LYS 25 0.059 -9.153 3.727 49 HG2 LYS 25 HG2 LYS 25 2.289 -9.830 2.915 50 HG3 LYS 25 HG1 LYS 25 3.016 -8.850 4.191 51 HD2 LYS 25 HD2 LYS 25 2.951 -11.086 4.991 52 HD3 LYS 25 HD1 LYS 25 1.680 -10.204 5.838 53 HE2 LYS 25 HE2 LYS 25 0.011 -11.118 4.329 54 HE3 LYS 25 HE1 LYS 25 1.269 -11.945 3.412 55 HZ1 LYS 25 HZ1 LYS 25 0.127 -13.424 4.948 56 HZ2 LYS 25 HZ2 LYS 25 0.605 -12.458 6.260 57 HZ3 LYS 25 HZ3 LYS 25 1.772 -13.275 5.349 58 H VAL 26 HN VAL 26 -0.609 -6.761 1.034 59 HA VAL 26 HA VAL 26 -2.196 -4.956 2.707 60 HB VAL 26 HB VAL 26 -2.766 -5.365 -0.199 61 HG11 VAL 26 HG11 VAL 26 -3.350 -3.017 -0.108 62 HG12 VAL 26 HG12 VAL 26 -2.760 -2.913 1.551 63 HG13 VAL 26 HG13 VAL 26 -4.173 -3.902 1.178 64 HG21 VAL 26 HG21 VAL 26 -0.455 -3.731 0.844 65 HG22 VAL 26 HG22 VAL 26 -1.059 -3.708 -0.813 66 HG23 VAL 26 HG23 VAL 26 -0.342 -5.179 -0.155 67 H ILE 27 HN ILE 27 -3.892 -5.804 3.715 68 HA ILE 27 HA ILE 27 -5.059 -8.297 2.802 69 HB ILE 27 HB ILE 27 -5.904 -6.589 5.148 70 HG12 ILE 27 HG12 ILE 27 -3.554 -7.245 5.383 71 HG13 ILE 27 HG11 ILE 27 -4.560 -8.121 6.531 72 HG21 ILE 27 HG21 ILE 27 -6.860 -8.724 5.972 73 HG22 ILE 27 HG22 ILE 27 -6.448 -9.465 4.426 74 HG23 ILE 27 HG23 ILE 27 -7.615 -8.144 4.487 75 HD11 ILE 27 HD11 ILE 27 -4.499 -10.083 5.049 76 HD12 ILE 27 HD12 ILE 27 -2.893 -9.583 5.583 77 HD13 ILE 27 HD13 ILE 27 -3.439 -9.196 3.950 78 H GLY 28 HN GLY 28 -6.537 -8.292 1.284 79 HA2 GLY 28 HA2 GLY 28 -8.114 -5.916 0.738 80 HA3 GLY 28 HA1 GLY 28 -8.084 -7.392 -0.214 81 H GLN 29 HN GLN 29 -10.466 -6.226 0.206 82 HA GLN 29 HA GLN 29 -11.873 -7.003 2.517 83 HB2 GLN 29 HB2 GLN 29 -12.799 -5.300 1.121 84 HB3 GLN 29 HB1 GLN 29 -12.762 -6.343 -0.292 85 HG2 GLN 29 HG2 GLN 29 -15.014 -6.182 0.390 86 HG3 GLN 29 HG1 GLN 29 -14.456 -7.789 0.840 87 HE21 GLN 29 HE21 GLN 29 -14.095 -8.261 3.029 88 HE22 GLN 29 HE22 GLN 29 -14.818 -7.313 4.284 89 H ASP 30 HN ASP 30 -11.156 -8.647 -0.488 90 HA ASP 30 HA ASP 30 -12.900 -10.873 0.068 91 HB2 ASP 30 HB2 ASP 30 -11.569 -11.859 -1.955 92 HB3 ASP 30 HB1 ASP 30 -12.716 -10.551 -2.219 93 H SER 31 HN SER 31 -10.618 -10.123 1.889 94 HA SER 31 HA SER 31 -9.181 -11.167 3.296 95 HB2 SER 31 HB2 SER 31 -10.129 -13.828 2.269 96 HB3 SER 31 HB1 SER 31 -9.643 -13.383 3.901 97 HG SER 31 HG SER 31 -11.725 -11.871 3.105 98 H SER 32 HN SER 32 -8.213 -10.459 0.717 99 HA SER 32 HA SER 32 -6.432 -12.622 -0.056 100 HB2 SER 32 HB2 SER 32 -5.738 -10.521 -1.640 101 HB3 SER 32 HB1 SER 32 -7.021 -11.668 -2.027 102 HG SER 32 HG SER 32 -8.430 -10.137 -1.797 103 H GLU 33 HN GLU 33 -4.135 -12.244 -0.292 104 HA GLU 33 HA GLU 33 -3.082 -10.332 1.683 105 HB2 GLU 33 HB2 GLU 33 -2.306 -13.183 1.117 106 HB3 GLU 33 HB1 GLU 33 -1.162 -12.066 1.844 107 HG2 GLU 33 HG2 GLU 33 -2.525 -11.791 3.764 108 HG3 GLU 33 HG1 GLU 33 -3.877 -12.628 3.001 109 H ILE 34 HN ILE 34 -3.033 -8.917 -0.185 110 HA ILE 34 HA ILE 34 -1.490 -9.507 -2.489 111 HB ILE 34 HB ILE 34 -2.184 -6.786 -1.384 112 HG12 ILE 34 HG12 ILE 34 -4.209 -8.133 -1.633 113 HG13 ILE 34 HG11 ILE 34 -4.153 -6.877 -2.866 114 HG21 ILE 34 HG21 ILE 34 -0.524 -6.581 -3.077 115 HG22 ILE 34 HG22 ILE 34 -2.071 -6.136 -3.801 116 HG23 ILE 34 HG23 ILE 34 -1.371 -7.721 -4.124 117 HD11 ILE 34 HD11 ILE 34 -4.929 -8.908 -3.859 118 HD12 ILE 34 HD12 ILE 34 -3.546 -9.801 -3.226 119 HD13 ILE 34 HD13 ILE 34 -3.308 -8.572 -4.468 120 H HIS 35 HN HIS 35 0.632 -9.513 -2.752 121 HA HIS 35 HA HIS 35 2.306 -8.474 -0.588 122 HB2 HIS 35 HB2 HIS 35 2.604 -10.625 -2.613 123 HB3 HIS 35 HB1 HIS 35 4.068 -9.765 -2.149 124 HD2 HIS 35 HD2 HIS 35 3.154 -9.520 1.087 125 HE1 HIS 35 HE1 HIS 35 3.531 -13.722 0.821 126 HE2 HIS 35 HE2 HIS 35 3.698 -11.718 2.361 127 H PHE 36 HN PHE 36 2.110 -6.311 -1.149 128 HA PHE 36 HA PHE 36 2.890 -5.371 -3.754 129 HB2 PHE 36 HB2 PHE 36 1.256 -4.338 -1.912 130 HB3 PHE 36 HB1 PHE 36 2.737 -3.532 -1.411 131 HD1 PHE 36 HD1 PHE 36 0.955 -4.286 -4.612 132 HD2 PHE 36 HD2 PHE 36 3.048 -1.430 -2.249 133 HE1 PHE 36 HE1 PHE 36 0.603 -2.585 -6.355 134 HE2 PHE 36 HE2 PHE 36 2.698 0.271 -3.991 135 HZ PHE 36 HZ PHE 36 1.474 -0.305 -6.045 136 H LYS 37 HN LYS 37 4.942 -5.326 -4.361 137 HA LYS 37 HA LYS 37 7.048 -5.182 -2.355 138 HB2 LYS 37 HB2 LYS 37 7.139 -6.781 -4.312 139 HB3 LYS 37 HB1 LYS 37 7.360 -5.382 -5.356 140 HG2 LYS 37 HG2 LYS 37 9.463 -4.900 -4.462 141 HG3 LYS 37 HG1 LYS 37 9.189 -5.907 -3.040 142 HD2 LYS 37 HD2 LYS 37 9.332 -7.027 -5.829 143 HD3 LYS 37 HD1 LYS 37 10.754 -6.841 -4.803 144 HE2 LYS 37 HE2 LYS 37 9.527 -8.202 -3.068 145 HE3 LYS 37 HE1 LYS 37 8.326 -8.547 -4.310 146 HZ1 LYS 37 HZ1 LYS 37 9.907 -9.676 -5.604 147 HZ2 LYS 37 HZ2 LYS 37 10.124 -10.245 -4.029 148 HZ3 LYS 37 HZ3 LYS 37 11.204 -9.118 -4.675 149 H VAL 38 HN VAL 38 7.574 -3.260 -1.639 150 HA VAL 38 HA VAL 38 7.394 -0.957 -3.453 151 HB VAL 38 HB VAL 38 7.271 0.452 -1.496 152 HG11 VAL 38 HG11 VAL 38 5.403 -1.909 -1.295 153 HG12 VAL 38 HG12 VAL 38 5.183 -0.482 -2.308 154 HG13 VAL 38 HG13 VAL 38 5.138 -0.332 -0.552 155 HG21 VAL 38 HG21 VAL 38 7.549 -2.078 0.118 156 HG22 VAL 38 HG22 VAL 38 7.206 -0.476 0.768 157 HG23 VAL 38 HG23 VAL 38 8.749 -0.795 -0.021 158 H LYS 39 HN LYS 39 8.979 0.776 -3.066 159 HA LYS 39 HA LYS 39 11.669 -0.359 -2.751 160 HB2 LYS 39 HB2 LYS 39 10.828 0.768 -4.939 161 HB3 LYS 39 HB1 LYS 39 11.033 2.273 -4.058 162 HG2 LYS 39 HG2 LYS 39 13.400 1.753 -3.721 163 HG3 LYS 39 HG1 LYS 39 13.188 0.245 -4.618 164 HD2 LYS 39 HD2 LYS 39 12.626 1.437 -6.621 165 HD3 LYS 39 HD1 LYS 39 12.587 2.972 -5.755 166 HE2 LYS 39 HE2 LYS 39 14.997 2.716 -5.273 167 HE3 LYS 39 HE1 LYS 39 15.007 1.242 -6.242 168 HZ1 LYS 39 HZ1 LYS 39 15.693 3.461 -7.318 169 HZ2 LYS 39 HZ2 LYS 39 14.028 3.772 -7.409 170 HZ3 LYS 39 HZ3 LYS 39 14.688 2.417 -8.184 171 H MET 40 HN MET 40 12.677 0.148 -0.907 172 HA MET 40 HA MET 40 11.647 2.145 0.872 173 HB2 MET 40 HB2 MET 40 12.629 0.074 1.735 174 HB3 MET 40 HB1 MET 40 14.184 0.503 1.032 175 HG2 MET 40 HG2 MET 40 14.166 0.932 3.415 176 HG3 MET 40 HG1 MET 40 14.326 2.434 2.511 177 HE1 MET 40 HE1 MET 40 11.228 0.143 3.667 178 HE2 MET 40 HE2 MET 40 10.764 1.101 5.075 179 HE3 MET 40 HE3 MET 40 12.362 0.354 5.001 180 H THR 41 HN THR 41 11.815 3.941 -0.561 181 HA THR 41 HA THR 41 13.827 5.731 0.047 182 HB THR 41 HB THR 41 15.217 4.186 -1.424 183 HG1 THR 41 HG1 THR 41 15.692 6.464 -1.022 184 HG21 THR 41 HG21 THR 41 13.512 5.402 -3.600 185 HG22 THR 41 HG22 THR 41 13.575 3.699 -3.153 186 HG23 THR 41 HG23 THR 41 14.989 4.479 -3.860 187 H THR 42 HN THR 42 11.304 4.619 -2.035 188 HA THR 42 HA THR 42 10.726 7.300 -3.021 189 HB THR 42 HB THR 42 9.105 4.823 -3.593 190 HG1 THR 42 HG1 THR 42 10.878 5.378 -5.557 191 HG21 THR 42 HG21 THR 42 8.162 6.958 -4.310 192 HG22 THR 42 HG22 THR 42 8.644 5.992 -5.704 193 HG23 THR 42 HG23 THR 42 9.651 7.338 -5.173 194 H HIS 43 HN HIS 43 8.875 8.443 -2.466 195 HA HIS 43 HA HIS 43 7.752 7.985 0.085 196 HB2 HIS 43 HB2 HIS 43 7.178 9.871 -2.169 197 HB3 HIS 43 HB1 HIS 43 6.043 9.760 -0.825 198 HD2 HIS 43 HD2 HIS 43 6.871 10.881 1.552 199 HE1 HIS 43 HE1 HIS 43 10.546 12.333 0.042 200 HE2 HIS 43 HE2 HIS 43 9.041 12.195 2.078 201 H LEU 44 HN LEU 44 5.562 7.526 0.634 202 HA LEU 44 HA LEU 44 4.519 5.295 -0.758 203 HB2 LEU 44 HB2 LEU 44 3.710 6.901 1.606 204 HB3 LEU 44 HB1 LEU 44 2.502 5.866 0.866 205 HG LEU 44 HG LEU 44 5.121 4.609 1.447 206 HD11 LEU 44 HD11 LEU 44 3.185 5.387 3.616 207 HD12 LEU 44 HD12 LEU 44 4.861 5.914 3.450 208 HD13 LEU 44 HD13 LEU 44 4.497 4.222 3.799 209 HD21 LEU 44 HD21 LEU 44 3.706 2.725 2.020 210 HD22 LEU 44 HD22 LEU 44 3.243 3.384 0.450 211 HD23 LEU 44 HD23 LEU 44 2.268 3.738 1.877 212 H LYS 45 HN LYS 45 4.229 8.558 -1.423 213 HA LYS 45 HA LYS 45 1.571 8.840 -2.228 214 HB2 LYS 45 HB2 LYS 45 2.945 10.787 -2.111 215 HB3 LYS 45 HB1 LYS 45 4.116 10.115 -3.234 216 HG2 LYS 45 HG2 LYS 45 2.875 11.774 -4.387 217 HG3 LYS 45 HG1 LYS 45 2.358 10.203 -5.003 218 HD2 LYS 45 HD2 LYS 45 0.504 10.419 -3.177 219 HD3 LYS 45 HD1 LYS 45 0.895 12.139 -3.260 220 HE2 LYS 45 HE2 LYS 45 0.567 11.979 -5.746 221 HE3 LYS 45 HE1 LYS 45 -0.074 10.359 -5.486 222 HZ1 LYS 45 HZ1 LYS 45 -2.013 11.447 -5.322 223 HZ2 LYS 45 HZ2 LYS 45 -1.287 12.931 -4.978 224 HZ3 LYS 45 HZ3 LYS 45 -1.513 11.799 -3.738 225 H LYS 46 HN LYS 46 4.416 7.901 -4.146 226 HA LYS 46 HA LYS 46 2.944 7.363 -6.505 227 HB2 LYS 46 HB2 LYS 46 5.400 7.858 -6.427 228 HB3 LYS 46 HB1 LYS 46 5.654 6.263 -5.733 229 HG2 LYS 46 HG2 LYS 46 6.140 6.138 -8.062 230 HG3 LYS 46 HG1 LYS 46 4.623 5.282 -7.780 231 HD2 LYS 46 HD2 LYS 46 3.501 7.522 -8.375 232 HD3 LYS 46 HD1 LYS 46 5.067 7.961 -9.053 233 HE2 LYS 46 HE2 LYS 46 4.979 6.123 -10.590 234 HE3 LYS 46 HE1 LYS 46 3.536 5.480 -9.810 235 HZ1 LYS 46 HZ1 LYS 46 3.751 7.996 -11.364 236 HZ2 LYS 46 HZ2 LYS 46 2.388 7.569 -10.457 237 HZ3 LYS 46 HZ3 LYS 46 2.867 6.614 -11.773 238 H LEU 47 HN LEU 47 3.839 5.485 -3.728 239 HA LEU 47 HA LEU 47 3.312 2.908 -4.761 240 HB2 LEU 47 HB2 LEU 47 3.489 4.089 -2.009 241 HB3 LEU 47 HB1 LEU 47 2.930 2.443 -2.211 242 HG LEU 47 HG LEU 47 5.041 1.750 -3.116 243 HD11 LEU 47 HD11 LEU 47 6.906 3.259 -3.462 244 HD12 LEU 47 HD12 LEU 47 5.912 4.633 -2.977 245 HD13 LEU 47 HD13 LEU 47 5.534 3.747 -4.455 246 HD21 LEU 47 HD21 LEU 47 5.357 3.518 -0.703 247 HD22 LEU 47 HD22 LEU 47 6.572 2.367 -1.253 248 HD23 LEU 47 HD23 LEU 47 4.987 1.794 -0.732 249 H LYS 48 HN LYS 48 1.351 5.215 -2.920 250 HA LYS 48 HA LYS 48 -0.951 3.626 -2.692 251 HB2 LYS 48 HB2 LYS 48 -0.547 6.612 -2.625 252 HB3 LYS 48 HB1 LYS 48 -2.118 5.867 -2.362 253 HG2 LYS 48 HG2 LYS 48 -1.355 4.759 -0.396 254 HG3 LYS 48 HG1 LYS 48 0.318 5.205 -0.726 255 HD2 LYS 48 HD2 LYS 48 -0.392 6.694 0.946 256 HD3 LYS 48 HD1 LYS 48 -0.460 7.626 -0.552 257 HE2 LYS 48 HE2 LYS 48 -2.875 7.182 -0.691 258 HE3 LYS 48 HE1 LYS 48 -2.788 6.289 0.826 259 HZ1 LYS 48 HZ1 LYS 48 -1.986 8.349 1.889 260 HZ2 LYS 48 HZ2 LYS 48 -3.546 8.502 1.262 261 HZ3 LYS 48 HZ3 LYS 48 -2.236 9.187 0.432 262 H GLU 49 HN GLU 49 -0.086 6.075 -5.153 263 HA GLU 49 HA GLU 49 -2.551 5.812 -6.540 264 HB2 GLU 49 HB2 GLU 49 -1.387 6.993 -8.416 265 HB3 GLU 49 HB1 GLU 49 -1.337 7.832 -6.875 266 HG2 GLU 49 HG2 GLU 49 0.949 7.110 -6.529 267 HG3 GLU 49 HG1 GLU 49 0.903 6.194 -8.034 268 H SER 50 HN SER 50 0.548 4.150 -6.835 269 HA SER 50 HA SER 50 -0.012 2.859 -9.287 270 HB2 SER 50 HB2 SER 50 1.800 1.970 -7.025 271 HB3 SER 50 HB1 SER 50 1.793 1.289 -8.653 272 HG SER 50 HG SER 50 2.532 3.898 -7.828 273 H TYR 51 HN TYR 51 -0.717 2.059 -5.932 274 HA TYR 51 HA TYR 51 -1.636 -0.576 -6.410 275 HB2 TYR 51 HB2 TYR 51 -0.998 0.381 -4.164 276 HB3 TYR 51 HB1 TYR 51 -2.521 1.264 -4.178 277 HD1 TYR 51 HD1 TYR 51 -1.063 -2.146 -4.229 278 HD2 TYR 51 HD2 TYR 51 -4.528 0.216 -3.508 279 HE1 TYR 51 HE1 TYR 51 -2.197 -4.108 -3.279 280 HE2 TYR 51 HE2 TYR 51 -5.669 -1.741 -2.553 281 HH TYR 51 HH TYR 51 -5.562 -4.132 -2.591 282 H CYS 52 HN CYS 52 -3.167 2.586 -6.468 283 HA CYS 52 HA CYS 52 -5.844 1.721 -6.640 284 HB2 CYS 52 HB2 CYS 52 -4.612 4.238 -7.789 285 HB3 CYS 52 HB1 CYS 52 -6.325 3.969 -7.489 286 HG CYS 52 HG CYS 52 -3.969 3.999 -5.004 287 H GLN 53 HN GLN 53 -3.416 2.465 -9.112 288 HA GLN 53 HA GLN 53 -5.032 2.046 -11.369 289 HB2 GLN 53 HB2 GLN 53 -2.060 1.548 -11.127 290 HB3 GLN 53 HB1 GLN 53 -2.953 1.835 -12.613 291 HG2 GLN 53 HG2 GLN 53 -3.349 4.096 -12.054 292 HG3 GLN 53 HG1 GLN 53 -2.805 3.849 -10.395 293 HE21 GLN 53 HE21 GLN 53 -1.848 5.775 -12.337 294 HE22 GLN 53 HE22 GLN 53 -0.157 5.463 -12.534 295 H ARG 54 HN ARG 54 -3.201 -0.136 -9.344 296 HA ARG 54 HA ARG 54 -3.353 -2.425 -10.995 297 HB2 ARG 54 HB2 ARG 54 -1.726 -2.352 -9.235 298 HB3 ARG 54 HB1 ARG 54 -2.972 -2.100 -8.019 299 HG2 ARG 54 HG2 ARG 54 -2.228 -4.356 -7.868 300 HG3 ARG 54 HG1 ARG 54 -3.858 -4.364 -8.541 301 HD2 ARG 54 HD2 ARG 54 -3.063 -4.815 -10.714 302 HD3 ARG 54 HD1 ARG 54 -1.402 -4.426 -10.272 303 HE ARG 54 HE ARG 54 -2.317 -6.591 -8.716 304 HH11 ARG 54 HH11 ARG 54 -1.408 -5.761 -11.992 305 HH12 ARG 54 HH12 ARG 54 -0.811 -7.416 -12.380 306 HH21 ARG 54 HH21 ARG 54 -1.547 -8.736 -9.139 307 HH22 ARG 54 HH22 ARG 54 -0.905 -9.085 -10.795 308 H GLN 55 HN GLN 55 -5.402 -1.202 -8.384 309 HA GLN 55 HA GLN 55 -7.187 -3.454 -8.509 310 HB2 GLN 55 HB2 GLN 55 -7.396 -0.800 -7.085 311 HB3 GLN 55 HB1 GLN 55 -8.582 -2.089 -6.935 312 HG2 GLN 55 HG2 GLN 55 -5.738 -2.038 -5.991 313 HG3 GLN 55 HG1 GLN 55 -7.211 -2.286 -5.056 314 HE21 GLN 55 HE21 GLN 55 -8.276 -4.304 -5.188 315 HE22 GLN 55 HE22 GLN 55 -7.444 -5.722 -5.728 316 H GLY 56 HN GLY 56 -6.802 -0.653 -10.346 317 HA2 GLY 56 HA2 GLY 56 -8.007 -0.021 -12.226 318 HA3 GLY 56 HA1 GLY 56 -9.209 -1.240 -11.826 319 H VAL 57 HN VAL 57 -8.151 1.208 -9.559 320 HA VAL 57 HA VAL 57 -10.706 2.622 -9.930 321 HB VAL 57 HB VAL 57 -10.783 2.930 -7.428 322 HG11 VAL 57 HG11 VAL 57 -11.739 0.702 -6.972 323 HG12 VAL 57 HG12 VAL 57 -11.047 0.118 -8.486 324 HG13 VAL 57 HG13 VAL 57 -12.285 1.374 -8.509 325 HG21 VAL 57 HG21 VAL 57 -8.721 0.729 -7.469 326 HG22 VAL 57 HG22 VAL 57 -9.567 1.310 -6.036 327 HG23 VAL 57 HG23 VAL 57 -8.472 2.384 -6.908 328 HA PRO 58 HA PRO 58 -8.203 6.279 -9.800 329 HB2 PRO 58 HB2 PRO 58 -9.930 8.087 -8.741 330 HB3 PRO 58 HB1 PRO 58 -10.088 7.472 -10.392 331 HG2 PRO 58 HG2 PRO 58 -11.566 6.649 -7.933 332 HG3 PRO 58 HG1 PRO 58 -12.175 6.900 -9.581 333 HD2 PRO 58 HD2 PRO 58 -11.662 4.437 -8.585 334 HD3 PRO 58 HD1 PRO 58 -11.480 4.836 -10.305 335 H MET 59 HN MET 59 -7.289 7.900 -8.266 336 HA MET 59 HA MET 59 -6.692 6.631 -5.758 337 HB2 MET 59 HB2 MET 59 -5.118 8.070 -7.227 338 HB3 MET 59 HB1 MET 59 -5.914 9.449 -6.476 339 HG2 MET 59 HG2 MET 59 -5.250 8.646 -4.276 340 HG3 MET 59 HG1 MET 59 -4.471 7.250 -5.012 341 HE1 MET 59 HE1 MET 59 -1.424 9.326 -3.758 342 HE2 MET 59 HE2 MET 59 -2.161 7.725 -3.823 343 HE3 MET 59 HE3 MET 59 -2.976 9.036 -2.970 344 H ASN 60 HN ASN 60 -6.893 7.749 -3.677 345 HA ASN 60 HA ASN 60 -7.978 8.879 -2.033 346 HB2 ASN 60 HB2 ASN 60 -9.068 10.426 -4.371 347 HB3 ASN 60 HB1 ASN 60 -9.667 10.701 -2.741 348 HD21 ASN 60 HD21 ASN 60 -8.895 12.808 -2.756 349 HD22 ASN 60 HD22 ASN 60 -7.214 13.165 -2.580 350 H SER 61 HN SER 61 -9.180 6.623 -3.880 351 HA SER 61 HA SER 61 -11.962 6.792 -3.038 352 HB2 SER 61 HB2 SER 61 -12.180 4.665 -4.355 353 HB3 SER 61 HB1 SER 61 -11.579 6.026 -5.304 354 HG SER 61 HG SER 61 -9.805 4.959 -5.646 355 H LEU 62 HN LEU 62 -9.065 4.892 -2.470 356 HA LEU 62 HA LEU 62 -10.428 3.470 -0.287 357 HB2 LEU 62 HB2 LEU 62 -7.918 2.651 -1.746 358 HB3 LEU 62 HB1 LEU 62 -8.799 1.704 -0.561 359 HG LEU 62 HG LEU 62 -9.907 2.497 -3.261 360 HD11 LEU 62 HD11 LEU 62 -9.515 0.149 -3.889 361 HD12 LEU 62 HD12 LEU 62 -8.663 -0.102 -2.364 362 HD13 LEU 62 HD13 LEU 62 -8.014 1.016 -3.564 363 HD21 LEU 62 HD21 LEU 62 -11.677 2.098 -1.723 364 HD22 LEU 62 HD22 LEU 62 -10.882 0.665 -1.075 365 HD23 LEU 62 HD23 LEU 62 -11.526 0.651 -2.717 366 H ARG 63 HN ARG 63 -9.381 3.263 1.695 367 HA ARG 63 HA ARG 63 -7.214 5.205 2.128 368 HB2 ARG 63 HB2 ARG 63 -7.962 5.312 4.476 369 HB3 ARG 63 HB1 ARG 63 -9.216 5.812 3.355 370 HG2 ARG 63 HG2 ARG 63 -10.386 3.741 3.634 371 HG3 ARG 63 HG1 ARG 63 -9.059 3.068 4.582 372 HD2 ARG 63 HD2 ARG 63 -9.443 4.682 6.338 373 HD3 ARG 63 HD1 ARG 63 -10.688 5.475 5.378 374 HE ARG 63 HE ARG 63 -10.905 2.830 6.645 375 HH11 ARG 63 HH11 ARG 63 -14.061 5.071 5.441 376 HH12 ARG 63 HH12 ARG 63 -12.379 5.597 5.015 377 HH21 ARG 63 HH21 ARG 63 -13.013 2.158 7.189 378 HH22 ARG 63 HH22 ARG 63 -14.410 3.155 6.636 379 H PHE 64 HN PHE 64 -5.343 4.550 2.967 380 HA PHE 64 HA PHE 64 -4.979 1.689 3.431 381 HB2 PHE 64 HB2 PHE 64 -3.037 3.969 3.016 382 HB3 PHE 64 HB1 PHE 64 -2.529 2.334 3.420 383 HD1 PHE 64 HD1 PHE 64 -4.139 4.427 0.849 384 HD2 PHE 64 HD2 PHE 64 -2.488 0.615 1.784 385 HE1 PHE 64 HE1 PHE 64 -4.164 3.835 -1.540 386 HE2 PHE 64 HE2 PHE 64 -2.511 0.017 -0.602 387 HZ PHE 64 HZ PHE 64 -3.347 1.626 -2.265 388 H LEU 65 HN LEU 65 -5.028 0.950 5.438 389 HA LEU 65 HA LEU 65 -4.506 2.837 7.631 390 HB2 LEU 65 HB2 LEU 65 -6.033 0.237 7.657 391 HB3 LEU 65 HB1 LEU 65 -5.776 1.272 9.046 392 HG LEU 65 HG LEU 65 -7.236 2.183 6.570 393 HD11 LEU 65 HD11 LEU 65 -9.301 1.777 7.795 394 HD12 LEU 65 HD12 LEU 65 -8.384 1.073 9.127 395 HD13 LEU 65 HD13 LEU 65 -8.407 0.275 7.554 396 HD21 LEU 65 HD21 LEU 65 -7.103 3.255 9.387 397 HD22 LEU 65 HD22 LEU 65 -8.102 3.907 8.086 398 HD23 LEU 65 HD23 LEU 65 -6.343 3.966 7.963 399 H PHE 66 HN PHE 66 -2.867 2.541 8.942 400 HA PHE 66 HA PHE 66 -1.513 -0.056 9.073 401 HB2 PHE 66 HB2 PHE 66 -0.367 1.487 7.419 402 HB3 PHE 66 HB1 PHE 66 -0.045 2.573 8.765 403 HD1 PHE 66 HD1 PHE 66 0.835 -0.568 7.156 404 HD2 PHE 66 HD2 PHE 66 1.570 1.969 10.492 405 HE1 PHE 66 HE1 PHE 66 2.905 -1.806 7.637 406 HE2 PHE 66 HE2 PHE 66 3.643 0.735 10.981 407 HZ PHE 66 HZ PHE 66 4.313 -1.154 9.546 408 H GLU 67 HN GLU 67 -1.577 -0.602 11.155 409 HA GLU 67 HA GLU 67 -1.495 -0.522 13.421 410 HB2 GLU 67 HB2 GLU 67 0.347 1.622 12.569 411 HB3 GLU 67 HB1 GLU 67 -0.213 1.726 14.232 412 HG2 GLU 67 HG2 GLU 67 0.997 -0.762 13.067 413 HG3 GLU 67 HG1 GLU 67 1.944 0.494 13.865 414 H GLY 68 HN GLY 68 -3.726 0.703 11.997 415 HA2 GLY 68 HA2 GLY 68 -5.728 1.529 12.898 416 HA3 GLY 68 HA1 GLY 68 -4.821 2.202 14.244 417 H GLN 69 HN GLN 69 -2.881 3.382 12.267 418 HA GLN 69 HA GLN 69 -4.353 5.856 11.863 419 HB2 GLN 69 HB2 GLN 69 -1.427 5.183 11.491 420 HB3 GLN 69 HB1 GLN 69 -2.119 6.785 11.293 421 HG2 GLN 69 HG2 GLN 69 -2.726 6.873 13.614 422 HG3 GLN 69 HG1 GLN 69 -2.211 5.206 13.848 423 HE21 GLN 69 HE21 GLN 69 -1.358 7.768 15.070 424 HE22 GLN 69 HE22 GLN 69 0.359 7.810 14.873 425 H ARG 70 HN ARG 70 -3.994 7.047 9.776 426 HA ARG 70 HA ARG 70 -4.174 5.130 7.553 427 HB2 ARG 70 HB2 ARG 70 -5.373 6.955 6.329 428 HB3 ARG 70 HB1 ARG 70 -6.222 6.329 7.733 429 HG2 ARG 70 HG2 ARG 70 -5.549 8.273 9.031 430 HG3 ARG 70 HG1 ARG 70 -4.645 8.895 7.649 431 HD2 ARG 70 HD2 ARG 70 -7.614 8.366 7.678 432 HD3 ARG 70 HD1 ARG 70 -6.871 9.947 7.915 433 HE ARG 70 HE ARG 70 -5.860 9.449 5.591 434 HH11 ARG 70 HH11 ARG 70 -9.081 8.491 6.691 435 HH12 ARG 70 HH12 ARG 70 -9.783 8.558 5.022 436 HH21 ARG 70 HH21 ARG 70 -6.736 9.501 3.468 437 HH22 ARG 70 HH22 ARG 70 -8.489 9.115 3.252 438 H ILE 71 HN ILE 71 -2.805 5.223 5.912 439 HA ILE 71 HA ILE 71 -0.394 6.691 6.172 440 HB ILE 71 HB ILE 71 -1.460 5.121 3.822 441 HG12 ILE 71 HG12 ILE 71 -1.194 3.748 5.819 442 HG13 ILE 71 HG11 ILE 71 0.053 3.350 4.643 443 HG21 ILE 71 HG21 ILE 71 0.854 5.049 3.037 444 HG22 ILE 71 HG22 ILE 71 1.340 6.094 4.370 445 HG23 ILE 71 HG23 ILE 71 0.256 6.704 3.124 446 HD11 ILE 71 HD11 ILE 71 1.642 4.754 5.905 447 HD12 ILE 71 HD12 ILE 71 1.006 3.406 6.847 448 HD13 ILE 71 HD13 ILE 71 0.389 5.037 7.113 449 H ALA 72 HN ALA 72 0.051 8.677 5.592 450 HA ALA 72 HA ALA 72 -1.838 10.255 4.100 451 HB1 ALA 72 HB1 ALA 72 -0.293 12.102 4.552 452 HB2 ALA 72 HB2 ALA 72 0.879 10.955 5.207 453 HB3 ALA 72 HB3 ALA 72 -0.670 11.198 6.018 454 H ASP 73 HN ASP 73 -0.805 11.825 2.417 455 HA ASP 73 HA ASP 73 0.242 10.161 0.294 456 HB2 ASP 73 HB2 ASP 73 -0.969 12.853 0.510 457 HB3 ASP 73 HB1 ASP 73 0.224 12.661 -0.772 458 H ASN 74 HN ASN 74 1.526 12.154 2.701 459 HA ASN 74 HA ASN 74 4.052 12.492 1.227 460 HB2 ASN 74 HB2 ASN 74 4.601 14.267 2.822 461 HB3 ASN 74 HB1 ASN 74 3.054 14.593 2.051 462 HD21 ASN 74 HD21 ASN 74 4.677 13.835 5.000 463 HD22 ASN 74 HD22 ASN 74 3.318 14.049 6.047 464 H HIS 75 HN HIS 75 2.962 10.114 2.738 465 HA HIS 75 HA HIS 75 4.775 9.895 4.990 466 HB2 HIS 75 HB2 HIS 75 2.379 8.520 4.075 467 HB3 HIS 75 HB1 HIS 75 3.633 7.396 4.590 468 HD2 HIS 75 HD2 HIS 75 4.685 9.439 7.077 469 HE1 HIS 75 HE1 HIS 75 0.793 8.609 8.514 470 HE2 HIS 75 HE2 HIS 75 3.025 9.674 9.052 471 H THR 76 HN THR 76 6.425 8.431 5.186 472 HA THR 76 HA THR 76 7.409 7.235 2.672 473 HB THR 76 HB THR 76 9.419 7.686 4.761 474 HG1 THR 76 HG1 THR 76 7.953 9.552 5.012 475 HG21 THR 76 HG21 THR 76 10.699 8.581 2.912 476 HG22 THR 76 HG22 THR 76 9.255 8.652 1.902 477 HG23 THR 76 HG23 THR 76 9.908 7.092 2.403 478 HA PRO 77 HA PRO 77 7.029 3.283 4.703 479 HB2 PRO 77 HB2 PRO 77 9.529 2.541 3.280 480 HB3 PRO 77 HB1 PRO 77 7.939 1.762 3.246 481 HG2 PRO 77 HG2 PRO 77 8.773 3.178 1.169 482 HG3 PRO 77 HG1 PRO 77 7.080 3.248 1.698 483 HD2 PRO 77 HD2 PRO 77 9.273 5.228 2.135 484 HD3 PRO 77 HD1 PRO 77 7.563 5.504 1.745 485 H LYS 78 HN LYS 78 9.847 5.234 4.961 486 HA LYS 78 HA LYS 78 11.215 3.552 6.850 487 HB2 LYS 78 HB2 LYS 78 12.370 5.157 5.301 488 HB3 LYS 78 HB1 LYS 78 11.684 6.477 6.235 489 HG2 LYS 78 HG2 LYS 78 13.907 6.183 6.980 490 HG3 LYS 78 HG1 LYS 78 12.857 5.541 8.243 491 HD2 LYS 78 HD2 LYS 78 14.509 3.920 8.062 492 HD3 LYS 78 HD1 LYS 78 13.216 3.270 7.058 493 HE2 LYS 78 HE2 LYS 78 14.530 3.272 5.265 494 HE3 LYS 78 HE1 LYS 78 14.909 4.977 5.493 495 HZ1 LYS 78 HZ1 LYS 78 16.655 4.364 7.033 496 HZ2 LYS 78 HZ2 LYS 78 16.896 3.588 5.546 497 HZ3 LYS 78 HZ3 LYS 78 16.278 2.726 6.861 498 H GLU 79 HN GLU 79 8.732 5.913 6.949 499 HA GLU 79 HA GLU 79 9.108 6.528 9.770 500 HB2 GLU 79 HB2 GLU 79 6.903 7.389 7.883 501 HB3 GLU 79 HB1 GLU 79 7.213 8.038 9.487 502 HG2 GLU 79 HG2 GLU 79 9.243 9.037 8.788 503 HG3 GLU 79 HG1 GLU 79 9.204 8.181 7.247 504 H LEU 80 HN LEU 80 7.102 6.377 11.163 505 HA LEU 80 HA LEU 80 5.468 5.199 12.200 506 HB2 LEU 80 HB2 LEU 80 5.123 3.823 9.534 507 HB3 LEU 80 HB1 LEU 80 4.062 3.611 10.911 508 HG LEU 80 HG LEU 80 4.288 6.409 10.318 509 HD11 LEU 80 HD11 LEU 80 3.249 6.416 8.104 510 HD12 LEU 80 HD12 LEU 80 3.437 4.665 8.008 511 HD13 LEU 80 HD13 LEU 80 4.863 5.703 8.053 512 HD21 LEU 80 HD21 LEU 80 1.992 4.475 10.072 513 HD22 LEU 80 HD22 LEU 80 1.872 6.233 10.142 514 HD23 LEU 80 HD23 LEU 80 2.462 5.333 11.540 515 H GLY 81 HN GLY 81 7.400 3.100 10.078 516 HA2 GLY 81 HA2 GLY 81 9.052 1.663 11.248 517 HA3 GLY 81 HA1 GLY 81 7.764 1.286 12.385 518 H MET 82 HN MET 82 8.134 1.338 8.838 519 HA MET 82 HA MET 82 6.473 -1.023 8.617 520 HB2 MET 82 HB2 MET 82 7.817 0.750 6.578 521 HB3 MET 82 HB1 MET 82 6.978 -0.730 6.134 522 HG2 MET 82 HG2 MET 82 4.932 0.175 7.193 523 HG3 MET 82 HG1 MET 82 5.794 1.689 7.466 524 HE1 MET 82 HE1 MET 82 3.697 2.833 6.173 525 HE2 MET 82 HE2 MET 82 3.009 1.237 5.867 526 HE3 MET 82 HE3 MET 82 3.218 2.377 4.538 527 H GLU 83 HN GLU 83 7.205 -3.017 8.621 528 HA GLU 83 HA GLU 83 10.062 -3.484 8.062 529 HB2 GLU 83 HB2 GLU 83 8.170 -4.972 9.891 530 HB3 GLU 83 HB1 GLU 83 9.812 -5.488 9.530 531 HG2 GLU 83 HG2 GLU 83 9.112 -2.851 10.792 532 HG3 GLU 83 HG1 GLU 83 9.551 -4.301 11.695 533 H GLU 84 HN GLU 84 10.210 -6.100 7.686 534 HA GLU 84 HA GLU 84 8.910 -6.490 5.149 535 HB2 GLU 84 HB2 GLU 84 11.243 -7.230 5.563 536 HB3 GLU 84 HB1 GLU 84 10.655 -8.373 6.759 537 HG2 GLU 84 HG2 GLU 84 11.224 -9.314 4.501 538 HG3 GLU 84 HG1 GLU 84 9.628 -9.716 5.132 539 H GLU 85 HN GLU 85 7.328 -8.006 4.654 540 HA GLU 85 HA GLU 85 5.431 -9.212 4.975 541 HB2 GLU 85 HB2 GLU 85 7.265 -10.258 7.073 542 HB3 GLU 85 HB1 GLU 85 5.565 -10.686 7.204 543 HG2 GLU 85 HG2 GLU 85 7.139 -11.096 4.684 544 HG3 GLU 85 HG1 GLU 85 7.056 -12.306 5.964 545 H ASP 86 HN ASP 86 5.556 -6.529 6.005 546 HA ASP 86 HA ASP 86 4.154 -6.518 8.525 547 HB2 ASP 86 HB2 ASP 86 5.684 -4.647 7.223 548 HB3 ASP 86 HB1 ASP 86 4.050 -4.047 6.942 549 H VAL 87 HN VAL 87 2.014 -5.522 8.775 550 HA VAL 87 HA VAL 87 0.293 -6.331 6.529 551 HB VAL 87 HB VAL 87 -0.518 -6.007 9.416 552 HG11 VAL 87 HG11 VAL 87 -2.474 -7.302 8.768 553 HG12 VAL 87 HG12 VAL 87 -1.881 -7.388 7.108 554 HG13 VAL 87 HG13 VAL 87 -2.345 -5.833 7.801 555 HG21 VAL 87 HG21 VAL 87 0.074 -8.594 7.990 556 HG22 VAL 87 HG22 VAL 87 -0.323 -8.366 9.693 557 HG23 VAL 87 HG23 VAL 87 1.215 -7.781 9.061 558 H ILE 88 HN ILE 88 -0.934 -4.915 5.535 559 HA ILE 88 HA ILE 88 -1.573 -2.375 6.843 560 HB ILE 88 HB ILE 88 0.309 -1.901 5.351 561 HG12 ILE 88 HG12 ILE 88 -2.190 -0.849 4.028 562 HG13 ILE 88 HG11 ILE 88 -1.659 -0.299 5.616 563 HG21 ILE 88 HG21 ILE 88 0.121 -2.194 2.929 564 HG22 ILE 88 HG22 ILE 88 -1.414 -3.029 3.156 565 HG23 ILE 88 HG23 ILE 88 0.073 -3.732 3.791 566 HD11 ILE 88 HD11 ILE 88 0.473 0.416 4.609 567 HD12 ILE 88 HD12 ILE 88 -0.927 1.248 3.936 568 HD13 ILE 88 HD13 ILE 88 -0.151 -0.048 3.027 569 H GLU 89 HN GLU 89 -3.653 -1.756 6.552 570 HA GLU 89 HA GLU 89 -5.350 -3.618 5.042 571 HB2 GLU 89 HB2 GLU 89 -6.250 -1.556 7.046 572 HB3 GLU 89 HB1 GLU 89 -7.151 -2.942 6.451 573 HG2 GLU 89 HG2 GLU 89 -6.243 -4.321 7.951 574 HG3 GLU 89 HG1 GLU 89 -4.627 -3.653 7.724 575 H VAL 90 HN VAL 90 -7.019 -2.864 3.705 576 HA VAL 90 HA VAL 90 -6.922 -0.046 2.940 577 HB VAL 90 HB VAL 90 -5.485 -1.149 1.322 578 HG11 VAL 90 HG11 VAL 90 -7.819 -2.946 0.685 579 HG12 VAL 90 HG12 VAL 90 -6.338 -3.427 1.513 580 HG13 VAL 90 HG13 VAL 90 -6.276 -2.902 -0.169 581 HG21 VAL 90 HG21 VAL 90 -8.167 -0.452 0.136 582 HG22 VAL 90 HG22 VAL 90 -6.636 -0.513 -0.740 583 HG23 VAL 90 HG23 VAL 90 -6.875 0.678 0.540 584 H TYR 91 HN TYR 91 -8.895 0.760 3.069 585 HA TYR 91 HA TYR 91 -11.167 -0.967 2.364 586 HB2 TYR 91 HB2 TYR 91 -10.811 0.704 4.832 587 HB3 TYR 91 HB1 TYR 91 -12.421 0.349 4.213 588 HD1 TYR 91 HD1 TYR 91 -13.144 -2.056 4.010 589 HD2 TYR 91 HD2 TYR 91 -9.609 -0.903 6.080 590 HE1 TYR 91 HE1 TYR 91 -13.124 -4.224 5.171 591 HE2 TYR 91 HE2 TYR 91 -9.578 -3.068 7.246 592 HH TYR 91 HH TYR 91 -11.682 -4.870 7.828 593 H GLN 92 HN GLN 92 -13.172 0.320 1.943 594 HA GLN 92 HA GLN 92 -12.537 2.407 0.086 595 HB2 GLN 92 HB2 GLN 92 -14.326 0.716 -0.295 596 HB3 GLN 92 HB1 GLN 92 -15.253 1.449 1.007 597 HG2 GLN 92 HG2 GLN 92 -15.157 3.599 -0.313 598 HG3 GLN 92 HG1 GLN 92 -14.526 2.639 -1.651 599 HE21 GLN 92 HE21 GLN 92 -17.290 3.328 0.334 600 HE22 GLN 92 HE22 GLN 92 -18.453 2.516 -0.654 601 H GLU 93 HN GLU 93 -12.738 4.550 0.305 602 HA GLU 93 HA GLU 93 -13.124 5.654 2.925 603 HB2 GLU 93 HB2 GLU 93 -12.412 6.716 0.225 604 HB3 GLU 93 HB1 GLU 93 -12.998 7.845 1.437 605 HG2 GLU 93 HG2 GLU 93 -10.699 5.977 1.919 606 HG3 GLU 93 HG1 GLU 93 -10.507 7.602 1.264 607 H GLN 94 HN GLN 94 -14.616 7.532 3.263 608 HA GLN 94 HA GLN 94 -17.281 6.760 2.741 609 HB2 GLN 94 HB2 GLN 94 -16.889 7.963 4.736 610 HB3 GLN 94 HB1 GLN 94 -16.034 9.246 3.894 611 HG2 GLN 94 HG2 GLN 94 -18.112 9.986 2.879 612 HG3 GLN 94 HG1 GLN 94 -18.977 8.673 3.678 613 HE21 GLN 94 HE21 GLN 94 -19.507 8.853 5.800 614 HE22 GLN 94 HE22 GLN 94 -19.272 10.294 6.727 615 H THR 95 HN THR 95 -15.121 9.098 1.243 616 HA THR 95 HA THR 95 -17.035 10.390 -0.379 617 HB THR 95 HB THR 95 -14.862 10.772 -1.839 618 HG1 THR 95 HG1 THR 95 -12.987 10.531 -0.522 619 HG21 THR 95 HG21 THR 95 -15.983 12.495 -0.507 620 HG22 THR 95 HG22 THR 95 -14.231 12.616 -0.355 621 HG23 THR 95 HG23 THR 95 -15.181 11.899 0.945 622 H GLY 96 HN GLY 96 -14.789 7.711 -1.028 623 HA2 GLY 96 HA2 GLY 96 -15.239 5.837 -2.366 624 HA3 GLY 96 HA1 GLY 96 -16.653 6.662 -3.006 625 H GLY 97 HN GLY 97 -13.999 8.704 -3.052 626 HA2 GLY 97 HA2 GLY 97 -12.449 9.289 -4.665 627 HA3 GLY 97 HA1 GLY 97 -12.805 7.786 -5.504 628 H1 ASN 357 HT1 ASN 357 -4.243 -19.737 -5.018 629 H2 ASN 357 HT2 ASN 357 -4.910 -20.203 -3.536 630 H3 ASN 357 HT3 ASN 357 -3.535 -20.988 -4.127 631 HA ASN 357 HA ASN 357 -2.960 -19.466 -2.370 632 HB2 ASN 357 HB2 ASN 357 -1.168 -18.307 -3.496 633 HB3 ASN 357 HB1 ASN 357 -1.375 -19.880 -4.258 634 HD21 ASN 357 HD21 ASN 357 -0.283 -17.242 -5.166 635 HD22 ASN 357 HD22 ASN 357 -1.085 -16.937 -6.669 636 H ASN 358 HN ASN 358 -3.036 -17.415 -1.465 637 HA ASN 358 HA ASN 358 -4.981 -15.598 -2.729 638 HB2 ASN 358 HB2 ASN 358 -5.706 -14.908 -0.541 639 HB3 ASN 358 HB1 ASN 358 -5.738 -16.665 -0.606 640 HD21 ASN 358 HD21 ASN 358 -5.768 -15.355 1.803 641 HD22 ASN 358 HD22 ASN 358 -4.252 -15.571 2.619 642 H ARG 359 HN ARG 359 -1.827 -15.884 -2.440 643 HA ARG 359 HA ARG 359 -1.334 -13.064 -1.764 644 HB2 ARG 359 HB2 ARG 359 0.432 -15.503 -1.714 645 HB3 ARG 359 HB1 ARG 359 1.116 -13.879 -1.711 646 HG2 ARG 359 HG2 ARG 359 0.504 -13.489 0.425 647 HG3 ARG 359 HG1 ARG 359 -1.006 -14.383 0.271 648 HD2 ARG 359 HD2 ARG 359 0.413 -16.483 0.252 649 HD3 ARG 359 HD1 ARG 359 1.753 -15.459 0.767 650 HE ARG 359 HE ARG 359 -0.374 -14.959 2.496 651 HH11 ARG 359 HH11 ARG 359 1.784 -17.593 1.640 652 HH12 ARG 359 HH12 ARG 359 1.605 -18.415 3.235 653 HH21 ARG 359 HH21 ARG 359 -0.608 -15.921 4.527 654 HH22 ARG 359 HH22 ARG 359 0.258 -17.470 4.870 655 H ASP 360 HN ASP 360 -0.814 -11.680 -3.291 656 HA ASP 360 HA ASP 360 0.183 -12.685 -5.876 657 HB2 ASP 360 HB2 ASP 360 -2.202 -12.096 -6.079 658 HB3 ASP 360 HB1 ASP 360 -1.865 -10.490 -5.446 659 HA PRO 361 HA PRO 361 3.259 -9.601 -4.673 660 HB2 PRO 361 HB2 PRO 361 5.164 -10.390 -6.408 661 HB3 PRO 361 HB1 PRO 361 4.817 -11.288 -4.924 662 HG2 PRO 361 HG2 PRO 361 3.978 -11.886 -7.720 663 HG3 PRO 361 HG1 PRO 361 4.506 -12.994 -6.439 664 HD2 PRO 361 HD2 PRO 361 1.883 -12.577 -7.108 665 HD3 PRO 361 HD1 PRO 361 2.430 -13.125 -5.514 666 H ILE 362 HN ILE 362 3.512 -7.582 -5.412 667 HA ILE 362 HA ILE 362 3.253 -7.069 -8.297 668 HB ILE 362 HB ILE 362 1.931 -5.341 -6.208 669 HG12 ILE 362 HG12 ILE 362 0.497 -7.149 -8.154 670 HG13 ILE 362 HG11 ILE 362 0.926 -7.678 -6.528 671 HG21 ILE 362 HG21 ILE 362 0.828 -4.304 -8.142 672 HG22 ILE 362 HG22 ILE 362 1.766 -5.342 -9.219 673 HG23 ILE 362 HG23 ILE 362 2.584 -4.145 -8.213 674 HD11 ILE 362 HD11 ILE 362 -0.734 -5.250 -7.106 675 HD12 ILE 362 HD12 ILE 362 -0.462 -6.028 -5.549 676 HD13 ILE 362 HD13 ILE 362 -1.402 -6.851 -6.791 677 H VAL 363 HN VAL 363 4.868 -5.862 -9.051 678 HA VAL 363 HA VAL 363 6.482 -4.331 -7.126 679 HB VAL 363 HB VAL 363 7.355 -5.205 -9.877 680 HG11 VAL 363 HG11 VAL 363 8.925 -4.322 -7.460 681 HG12 VAL 363 HG12 VAL 363 8.605 -3.348 -8.896 682 HG13 VAL 363 HG13 VAL 363 9.600 -4.800 -9.019 683 HG21 VAL 363 HG21 VAL 363 8.614 -7.011 -8.738 684 HG22 VAL 363 HG22 VAL 363 6.864 -7.218 -8.652 685 HG23 VAL 363 HG23 VAL 363 7.752 -6.626 -7.247 686 H ILE 364 HN ILE 364 6.723 -2.183 -7.381 687 HA ILE 364 HA ILE 364 5.104 -0.872 -9.405 688 HB ILE 364 HB ILE 364 5.672 1.211 -8.221 689 HG12 ILE 364 HG12 ILE 364 7.018 -0.401 -6.077 690 HG13 ILE 364 HG11 ILE 364 7.949 0.160 -7.463 691 HG21 ILE 364 HG21 ILE 364 4.472 0.718 -6.142 692 HG22 ILE 364 HG22 ILE 364 4.713 -1.008 -6.422 693 HG23 ILE 364 HG23 ILE 364 3.722 -0.064 -7.533 694 HD11 ILE 364 HD11 ILE 364 7.364 2.454 -6.951 695 HD12 ILE 364 HD12 ILE 364 8.130 1.677 -5.564 696 HD13 ILE 364 HD13 ILE 364 6.382 1.912 -5.588 697 H SER 365 HN SER 365 6.075 1.218 -10.317 698 HA SER 365 HA SER 365 8.779 0.657 -11.332 699 HB2 SER 365 HB2 SER 365 6.546 2.149 -12.739 700 HB3 SER 365 HB1 SER 365 8.135 1.774 -13.408 701 HG SER 365 HG SER 365 7.469 -0.518 -12.940 702 H ASP 366 HN ASP 366 10.019 1.889 -10.020 703 HA ASP 366 HA ASP 366 9.245 4.546 -9.216 704 HB2 ASP 366 HB2 ASP 366 10.482 3.126 -7.666 705 HB3 ASP 366 HB1 ASP 366 11.808 2.990 -8.812 706 H SER 367 HN SER 367 9.323 6.110 -10.678 707 HA SER 367 HA SER 367 11.787 6.415 -12.247 708 HB2 SER 367 HB2 SER 367 10.098 7.450 -14.003 709 HB3 SER 367 HB1 SER 367 10.401 5.713 -13.957 710 HG SER 367 HG SER 367 8.247 7.059 -12.669 711 HA PRO 368 HA PRO 368 11.437 10.344 -10.043 712 HB2 PRO 368 HB2 PRO 368 14.010 10.868 -11.383 713 HB3 PRO 368 HB1 PRO 368 13.627 10.848 -9.658 714 HG2 PRO 368 HG2 PRO 368 15.096 8.914 -10.770 715 HG3 PRO 368 HG1 PRO 368 13.954 8.584 -9.453 716 HD2 PRO 368 HD2 PRO 368 13.642 8.097 -12.385 717 HD3 PRO 368 HD1 PRO 368 13.160 7.078 -11.009 Start of MODEL 8 1 H TYR 21 HT1 TYR 21 14.110 -5.868 -1.439 2 HA TYR 21 HA TYR 21 12.958 -3.839 -1.715 3 HB2 TYR 21 HB2 TYR 21 11.130 -5.463 -3.499 4 HB3 TYR 21 HB1 TYR 21 10.774 -3.833 -2.940 5 HD1 TYR 21 HD1 TYR 21 12.735 -2.082 -3.454 6 HD2 TYR 21 HD2 TYR 21 12.067 -5.696 -5.594 7 HE1 TYR 21 HE1 TYR 21 13.938 -1.154 -5.388 8 HE2 TYR 21 HE2 TYR 21 13.270 -4.780 -7.533 9 HH TYR 21 HH TYR 21 13.758 -2.389 -8.437 10 H ILE 22 HN ILE 22 10.850 -3.312 -0.598 11 HA ILE 22 HA ILE 22 10.493 -5.238 1.540 12 HB ILE 22 HB ILE 22 9.071 -2.594 1.276 13 HG12 ILE 22 HG12 ILE 22 11.505 -2.229 1.056 14 HG13 ILE 22 HG11 ILE 22 10.865 -1.561 2.552 15 HG21 ILE 22 HG21 ILE 22 8.191 -4.111 2.955 16 HG22 ILE 22 HG22 ILE 22 8.965 -2.722 3.717 17 HG23 ILE 22 HG23 ILE 22 9.796 -4.277 3.669 18 HD11 ILE 22 HD11 ILE 22 12.930 -2.585 3.068 19 HD12 ILE 22 HD12 ILE 22 12.493 -4.057 2.203 20 HD13 ILE 22 HD13 ILE 22 11.666 -3.639 3.704 21 H LYS 23 HN LYS 23 8.821 -6.562 1.774 22 HA LYS 23 HA LYS 23 6.634 -6.378 -0.182 23 HB2 LYS 23 HB2 LYS 23 8.002 -8.591 1.228 24 HB3 LYS 23 HB1 LYS 23 6.274 -8.784 0.977 25 HG2 LYS 23 HG2 LYS 23 6.486 -8.797 -1.337 26 HG3 LYS 23 HG1 LYS 23 8.079 -8.039 -1.287 27 HD2 LYS 23 HD2 LYS 23 8.103 -10.473 -1.865 28 HD3 LYS 23 HD1 LYS 23 9.086 -10.049 -0.466 29 HE2 LYS 23 HE2 LYS 23 6.285 -10.840 0.064 30 HE3 LYS 23 HE1 LYS 23 7.370 -12.108 -0.494 31 HZ1 LYS 23 HZ1 LYS 23 7.094 -11.334 2.073 32 HZ2 LYS 23 HZ2 LYS 23 8.472 -10.453 1.607 33 HZ3 LYS 23 HZ3 LYS 23 8.450 -12.138 1.450 34 H LEU 24 HN LEU 24 4.916 -5.337 0.557 35 HA LEU 24 HA LEU 24 4.196 -5.569 3.393 36 HB2 LEU 24 HB2 LEU 24 3.240 -3.686 1.232 37 HB3 LEU 24 HB1 LEU 24 2.590 -3.718 2.860 38 HG LEU 24 HG LEU 24 5.456 -3.081 2.154 39 HD11 LEU 24 HD11 LEU 24 3.939 -1.338 1.397 40 HD12 LEU 24 HD12 LEU 24 4.865 -0.789 2.793 41 HD13 LEU 24 HD13 LEU 24 3.184 -1.282 2.989 42 HD21 LEU 24 HD21 LEU 24 5.358 -4.046 4.341 43 HD22 LEU 24 HD22 LEU 24 3.957 -3.063 4.769 44 HD23 LEU 24 HD23 LEU 24 5.528 -2.300 4.527 45 H LYS 25 HN LYS 25 2.462 -6.715 4.036 46 HA LYS 25 HA LYS 25 0.971 -8.127 1.971 47 HB2 LYS 25 HB2 LYS 25 0.989 -8.477 4.975 48 HB3 LYS 25 HB1 LYS 25 0.103 -9.487 3.844 49 HG2 LYS 25 HG2 LYS 25 2.298 -10.063 2.781 50 HG3 LYS 25 HG1 LYS 25 3.085 -9.231 4.123 51 HD2 LYS 25 HD2 LYS 25 3.045 -11.530 4.695 52 HD3 LYS 25 HD1 LYS 25 1.787 -10.758 5.664 53 HE2 LYS 25 HE2 LYS 25 0.120 -11.471 3.963 54 HE3 LYS 25 HE1 LYS 25 1.405 -12.341 3.125 55 HZ1 LYS 25 HZ1 LYS 25 0.177 -13.840 4.515 56 HZ2 LYS 25 HZ2 LYS 25 0.424 -12.865 5.878 57 HZ3 LYS 25 HZ3 LYS 25 1.734 -13.650 5.159 58 H VAL 26 HN VAL 26 -0.812 -7.258 1.226 59 HA VAL 26 HA VAL 26 -2.405 -5.494 2.946 60 HB VAL 26 HB VAL 26 -3.065 -5.958 0.066 61 HG11 VAL 26 HG11 VAL 26 -3.729 -3.597 0.199 62 HG12 VAL 26 HG12 VAL 26 -3.198 -3.559 1.880 63 HG13 VAL 26 HG13 VAL 26 -4.544 -4.594 1.404 64 HG21 VAL 26 HG21 VAL 26 -0.835 -4.163 1.017 65 HG22 VAL 26 HG22 VAL 26 -1.503 -4.184 -0.616 66 HG23 VAL 26 HG23 VAL 26 -0.661 -5.602 0.012 67 H ILE 27 HN ILE 27 -4.097 -6.356 3.956 68 HA ILE 27 HA ILE 27 -5.146 -8.918 3.011 69 HB ILE 27 HB ILE 27 -5.736 -7.465 5.595 70 HG12 ILE 27 HG12 ILE 27 -3.372 -8.132 5.436 71 HG13 ILE 27 HG11 ILE 27 -4.224 -9.070 6.657 72 HG21 ILE 27 HG21 ILE 27 -6.611 -9.648 6.335 73 HG22 ILE 27 HG22 ILE 27 -6.376 -10.272 4.703 74 HG23 ILE 27 HG23 ILE 27 -7.524 -8.964 4.991 75 HD11 ILE 27 HD11 ILE 27 -4.421 -10.920 5.038 76 HD12 ILE 27 HD12 ILE 27 -2.749 -10.504 5.411 77 HD13 ILE 27 HD13 ILE 27 -3.472 -9.981 3.888 78 H GLY 28 HN GLY 28 -6.890 -8.952 1.782 79 HA2 GLY 28 HA2 GLY 28 -8.672 -6.632 1.734 80 HA3 GLY 28 HA1 GLY 28 -8.638 -7.940 0.556 81 H GLN 29 HN GLN 29 -11.042 -7.061 1.575 82 HA GLN 29 HA GLN 29 -11.941 -8.467 3.846 83 HB2 GLN 29 HB2 GLN 29 -13.052 -6.484 2.725 84 HB3 GLN 29 HB1 GLN 29 -13.656 -7.609 1.517 85 HG2 GLN 29 HG2 GLN 29 -15.333 -7.126 3.210 86 HG3 GLN 29 HG1 GLN 29 -14.873 -8.828 3.229 87 HE21 GLN 29 HE21 GLN 29 -13.787 -9.654 4.999 88 HE22 GLN 29 HE22 GLN 29 -13.629 -8.783 6.486 89 H ASP 30 HN ASP 30 -11.352 -9.455 0.615 90 HA ASP 30 HA ASP 30 -13.036 -11.816 0.760 91 HB2 ASP 30 HB2 ASP 30 -12.140 -12.308 -1.491 92 HB3 ASP 30 HB1 ASP 30 -12.796 -10.676 -1.391 93 H SER 31 HN SER 31 -10.500 -11.146 2.430 94 HA SER 31 HA SER 31 -8.906 -12.313 3.532 95 HB2 SER 31 HB2 SER 31 -10.091 -14.746 2.180 96 HB3 SER 31 HB1 SER 31 -9.042 -14.746 3.598 97 HG SER 31 HG SER 31 -11.704 -13.806 3.365 98 H SER 32 HN SER 32 -8.222 -11.097 1.124 99 HA SER 32 HA SER 32 -6.475 -12.933 -0.293 100 HB2 SER 32 HB2 SER 32 -5.932 -10.531 -1.396 101 HB3 SER 32 HB1 SER 32 -7.312 -11.516 -1.884 102 HG SER 32 HG SER 32 -8.604 -10.055 -1.102 103 H GLU 33 HN GLU 33 -4.203 -12.520 -0.517 104 HA GLU 33 HA GLU 33 -3.021 -10.957 1.681 105 HB2 GLU 33 HB2 GLU 33 -2.389 -13.742 0.739 106 HB3 GLU 33 HB1 GLU 33 -1.163 -12.771 1.540 107 HG2 GLU 33 HG2 GLU 33 -2.594 -12.590 3.506 108 HG3 GLU 33 HG1 GLU 33 -3.830 -13.550 2.694 109 H ILE 34 HN ILE 34 -3.095 -9.393 -0.150 110 HA ILE 34 HA ILE 34 -1.504 -9.784 -2.469 111 HB ILE 34 HB ILE 34 -2.334 -7.154 -1.238 112 HG12 ILE 34 HG12 ILE 34 -4.298 -8.592 -1.530 113 HG13 ILE 34 HG11 ILE 34 -4.318 -7.282 -2.703 114 HG21 ILE 34 HG21 ILE 34 -1.627 -7.905 -4.065 115 HG22 ILE 34 HG22 ILE 34 -0.648 -6.937 -2.963 116 HG23 ILE 34 HG23 ILE 34 -2.199 -6.323 -3.537 117 HD11 ILE 34 HD11 ILE 34 -5.010 -9.342 -3.736 118 HD12 ILE 34 HD12 ILE 34 -3.519 -10.134 -3.227 119 HD13 ILE 34 HD13 ILE 34 -3.465 -8.826 -4.412 120 H HIS 35 HN HIS 35 0.603 -9.325 -2.863 121 HA HIS 35 HA HIS 35 2.191 -8.395 -0.570 122 HB2 HIS 35 HB2 HIS 35 2.569 -10.571 -2.503 123 HB3 HIS 35 HB1 HIS 35 3.997 -9.566 -2.281 124 HD2 HIS 35 HD2 HIS 35 4.203 -9.129 0.796 125 HE1 HIS 35 HE1 HIS 35 3.486 -13.272 1.207 126 HE2 HIS 35 HE2 HIS 35 4.602 -11.247 2.246 127 H PHE 36 HN PHE 36 2.169 -6.242 -0.957 128 HA PHE 36 HA PHE 36 2.716 -5.174 -3.581 129 HB2 PHE 36 HB2 PHE 36 1.277 -4.198 -1.567 130 HB3 PHE 36 HB1 PHE 36 2.819 -3.474 -1.129 131 HD1 PHE 36 HD1 PHE 36 1.172 -4.053 -4.420 132 HD2 PHE 36 HD2 PHE 36 2.763 -1.244 -1.654 133 HE1 PHE 36 HE1 PHE 36 0.768 -2.244 -6.034 134 HE2 PHE 36 HE2 PHE 36 2.360 0.572 -3.264 135 HZ PHE 36 HZ PHE 36 1.362 0.072 -5.457 136 H LYS 37 HN LYS 37 4.706 -5.149 -4.386 137 HA LYS 37 HA LYS 37 7.010 -5.236 -2.610 138 HB2 LYS 37 HB2 LYS 37 6.738 -6.595 -4.769 139 HB3 LYS 37 HB1 LYS 37 7.047 -5.093 -5.624 140 HG2 LYS 37 HG2 LYS 37 9.229 -4.920 -4.616 141 HG3 LYS 37 HG1 LYS 37 8.921 -6.356 -3.638 142 HD2 LYS 37 HD2 LYS 37 8.841 -6.400 -6.645 143 HD3 LYS 37 HD1 LYS 37 10.328 -6.668 -5.738 144 HE2 LYS 37 HE2 LYS 37 9.186 -8.523 -4.537 145 HE3 LYS 37 HE1 LYS 37 7.798 -8.301 -5.599 146 HZ1 LYS 37 HZ1 LYS 37 9.124 -8.872 -7.480 147 HZ2 LYS 37 HZ2 LYS 37 9.327 -10.082 -6.317 148 HZ3 LYS 37 HZ3 LYS 37 10.536 -8.927 -6.553 149 H VAL 38 HN VAL 38 7.329 -3.288 -1.679 150 HA VAL 38 HA VAL 38 7.202 -0.884 -3.346 151 HB VAL 38 HB VAL 38 7.163 0.401 -1.306 152 HG11 VAL 38 HG11 VAL 38 5.300 -1.966 -1.128 153 HG12 VAL 38 HG12 VAL 38 5.042 -0.509 -2.086 154 HG13 VAL 38 HG13 VAL 38 5.071 -0.413 -0.326 155 HG21 VAL 38 HG21 VAL 38 7.472 -2.212 0.168 156 HG22 VAL 38 HG22 VAL 38 7.228 -0.628 0.903 157 HG23 VAL 38 HG23 VAL 38 8.714 -0.969 0.014 158 H LYS 39 HN LYS 39 8.801 0.767 -3.099 159 HA LYS 39 HA LYS 39 11.516 -0.330 -2.913 160 HB2 LYS 39 HB2 LYS 39 10.727 0.729 -5.051 161 HB3 LYS 39 HB1 LYS 39 10.569 2.249 -4.187 162 HG2 LYS 39 HG2 LYS 39 12.965 2.266 -3.759 163 HG3 LYS 39 HG1 LYS 39 13.132 0.720 -4.593 164 HD2 LYS 39 HD2 LYS 39 12.285 1.747 -6.652 165 HD3 LYS 39 HD1 LYS 39 12.125 3.292 -5.816 166 HE2 LYS 39 HE2 LYS 39 14.523 3.381 -5.459 167 HE3 LYS 39 HE1 LYS 39 14.714 1.786 -6.187 168 HZ1 LYS 39 HZ1 LYS 39 15.254 3.589 -7.724 169 HZ2 LYS 39 HZ2 LYS 39 13.674 4.188 -7.603 170 HZ3 LYS 39 HZ3 LYS 39 13.958 2.662 -8.280 171 H MET 40 HN MET 40 12.621 0.124 -1.117 172 HA MET 40 HA MET 40 11.664 2.073 0.758 173 HB2 MET 40 HB2 MET 40 12.621 -0.034 1.545 174 HB3 MET 40 HB1 MET 40 14.162 0.374 0.805 175 HG2 MET 40 HG2 MET 40 14.286 0.772 3.169 176 HG3 MET 40 HG1 MET 40 14.347 2.312 2.317 177 HE1 MET 40 HE1 MET 40 12.501 0.330 5.163 178 HE2 MET 40 HE2 MET 40 11.835 -0.257 3.642 179 HE3 MET 40 HE3 MET 40 10.821 0.669 4.750 180 H THR 41 HN THR 41 11.828 3.993 -0.432 181 HA THR 41 HA THR 41 13.891 5.660 0.214 182 HB THR 41 HB THR 41 15.242 4.205 -1.393 183 HG1 THR 41 HG1 THR 41 15.055 7.005 -1.945 184 HG21 THR 41 HG21 THR 41 15.052 4.618 -3.760 185 HG22 THR 41 HG22 THR 41 13.732 5.756 -3.499 186 HG23 THR 41 HG23 THR 41 13.497 4.043 -3.160 187 H THR 42 HN THR 42 11.515 4.815 -2.231 188 HA THR 42 HA THR 42 10.954 7.586 -2.842 189 HB THR 42 HB THR 42 9.333 5.197 -3.722 190 HG1 THR 42 HG1 THR 42 11.047 5.823 -5.634 191 HG21 THR 42 HG21 THR 42 8.437 7.455 -4.191 192 HG22 THR 42 HG22 THR 42 8.840 6.575 -5.664 193 HG23 THR 42 HG23 THR 42 9.915 7.843 -5.072 194 H HIS 43 HN HIS 43 9.098 8.688 -2.251 195 HA HIS 43 HA HIS 43 7.920 8.085 0.224 196 HB2 HIS 43 HB2 HIS 43 7.409 10.076 -1.933 197 HB3 HIS 43 HB1 HIS 43 6.142 9.825 -0.738 198 HD2 HIS 43 HD2 HIS 43 6.581 10.906 1.719 199 HE1 HIS 43 HE1 HIS 43 10.414 12.464 0.842 200 HE2 HIS 43 HE2 HIS 43 8.593 12.285 2.600 201 H LEU 44 HN LEU 44 5.757 7.516 0.740 202 HA LEU 44 HA LEU 44 4.784 5.311 -0.732 203 HB2 LEU 44 HB2 LEU 44 3.840 6.853 1.637 204 HB3 LEU 44 HB1 LEU 44 2.724 5.747 0.856 205 HG LEU 44 HG LEU 44 5.438 4.751 1.609 206 HD11 LEU 44 HD11 LEU 44 3.153 5.205 3.508 207 HD12 LEU 44 HD12 LEU 44 4.810 5.794 3.642 208 HD13 LEU 44 HD13 LEU 44 4.471 4.072 3.815 209 HD21 LEU 44 HD21 LEU 44 2.730 3.436 1.660 210 HD22 LEU 44 HD22 LEU 44 4.306 2.655 1.798 211 HD23 LEU 44 HD23 LEU 44 3.823 3.404 0.276 212 H LYS 45 HN LYS 45 4.436 8.573 -1.314 213 HA LYS 45 HA LYS 45 1.823 8.887 -2.209 214 HB2 LYS 45 HB2 LYS 45 3.202 10.820 -2.055 215 HB3 LYS 45 HB1 LYS 45 4.441 10.111 -3.080 216 HG2 LYS 45 HG2 LYS 45 3.340 11.775 -4.356 217 HG3 LYS 45 HG1 LYS 45 2.801 10.211 -4.974 218 HD2 LYS 45 HD2 LYS 45 0.807 10.458 -3.421 219 HD3 LYS 45 HD1 LYS 45 1.310 12.136 -3.211 220 HE2 LYS 45 HE2 LYS 45 1.066 12.557 -5.565 221 HE3 LYS 45 HE1 LYS 45 0.731 10.853 -5.874 222 HZ1 LYS 45 HZ1 LYS 45 -1.402 11.272 -5.546 223 HZ2 LYS 45 HZ2 LYS 45 -1.072 12.890 -5.182 224 HZ3 LYS 45 HZ3 LYS 45 -1.081 11.730 -3.942 225 H LYS 46 HN LYS 46 4.704 7.786 -3.951 226 HA LYS 46 HA LYS 46 3.374 7.332 -6.419 227 HB2 LYS 46 HB2 LYS 46 5.828 7.730 -6.176 228 HB3 LYS 46 HB1 LYS 46 5.977 6.143 -5.433 229 HG2 LYS 46 HG2 LYS 46 6.632 5.969 -7.719 230 HG3 LYS 46 HG1 LYS 46 5.080 5.148 -7.529 231 HD2 LYS 46 HD2 LYS 46 4.058 7.410 -8.246 232 HD3 LYS 46 HD1 LYS 46 5.682 7.781 -8.827 233 HE2 LYS 46 HE2 LYS 46 5.646 5.969 -10.352 234 HE3 LYS 46 HE1 LYS 46 4.190 5.292 -9.619 235 HZ1 LYS 46 HZ1 LYS 46 4.404 7.798 -11.186 236 HZ2 LYS 46 HZ2 LYS 46 3.015 7.343 -10.333 237 HZ3 LYS 46 HZ3 LYS 46 3.573 6.389 -11.616 238 H LEU 47 HN LEU 47 3.989 5.405 -3.585 239 HA LEU 47 HA LEU 47 3.374 2.886 -4.744 240 HB2 LEU 47 HB2 LEU 47 3.569 3.903 -1.924 241 HB3 LEU 47 HB1 LEU 47 2.989 2.284 -2.251 242 HG LEU 47 HG LEU 47 5.276 2.044 -1.732 243 HD11 LEU 47 HD11 LEU 47 4.469 0.850 -3.781 244 HD12 LEU 47 HD12 LEU 47 6.213 1.081 -3.676 245 HD13 LEU 47 HD13 LEU 47 5.251 2.111 -4.734 246 HD21 LEU 47 HD21 LEU 47 5.789 4.332 -3.624 247 HD22 LEU 47 HD22 LEU 47 7.050 3.320 -2.916 248 HD23 LEU 47 HD23 LEU 47 6.029 4.313 -1.875 249 H LYS 48 HN LYS 48 1.503 5.219 -2.848 250 HA LYS 48 HA LYS 48 -0.846 3.726 -2.604 251 HB2 LYS 48 HB2 LYS 48 -0.384 6.703 -2.646 252 HB3 LYS 48 HB1 LYS 48 -1.948 5.981 -2.299 253 HG2 LYS 48 HG2 LYS 48 -1.040 4.862 -0.355 254 HG3 LYS 48 HG1 LYS 48 0.573 5.473 -0.729 255 HD2 LYS 48 HD2 LYS 48 -0.324 6.864 0.980 256 HD3 LYS 48 HD1 LYS 48 -0.369 7.794 -0.520 257 HE2 LYS 48 HE2 LYS 48 -2.739 7.203 -0.794 258 HE3 LYS 48 HE1 LYS 48 -2.683 6.313 0.727 259 HZ1 LYS 48 HZ1 LYS 48 -2.220 8.347 1.897 260 HZ2 LYS 48 HZ2 LYS 48 -3.612 8.555 0.964 261 HZ3 LYS 48 HZ3 LYS 48 -2.144 9.224 0.444 262 H GLU 49 HN GLU 49 0.063 6.094 -5.122 263 HA GLU 49 HA GLU 49 -2.411 5.896 -6.492 264 HB2 GLU 49 HB2 GLU 49 -1.195 6.967 -8.396 265 HB3 GLU 49 HB1 GLU 49 -1.084 7.839 -6.876 266 HG2 GLU 49 HG2 GLU 49 1.155 6.961 -6.521 267 HG3 GLU 49 HG1 GLU 49 1.043 6.051 -8.026 268 H SER 50 HN SER 50 0.640 4.148 -6.809 269 HA SER 50 HA SER 50 0.036 2.813 -9.207 270 HB2 SER 50 HB2 SER 50 1.795 1.907 -6.911 271 HB3 SER 50 HB1 SER 50 1.787 1.201 -8.527 272 HG SER 50 HG SER 50 2.666 3.761 -7.707 273 H TYR 51 HN TYR 51 -0.685 2.033 -5.829 274 HA TYR 51 HA TYR 51 -1.702 -0.567 -6.333 275 HB2 TYR 51 HB2 TYR 51 -0.992 0.341 -4.079 276 HB3 TYR 51 HB1 TYR 51 -2.500 1.247 -4.053 277 HD1 TYR 51 HD1 TYR 51 -1.033 -2.132 -3.997 278 HD2 TYR 51 HD2 TYR 51 -4.581 0.170 -3.559 279 HE1 TYR 51 HE1 TYR 51 -2.180 -4.092 -3.058 280 HE2 TYR 51 HE2 TYR 51 -5.739 -1.783 -2.618 281 HH TYR 51 HH TYR 51 -5.528 -4.256 -2.684 282 H CYS 52 HN CYS 52 -3.196 2.634 -6.175 283 HA CYS 52 HA CYS 52 -5.876 1.810 -6.377 284 HB2 CYS 52 HB2 CYS 52 -4.639 4.368 -7.421 285 HB3 CYS 52 HB1 CYS 52 -6.348 4.101 -7.091 286 HG CYS 52 HG CYS 52 -3.867 4.121 -4.725 287 H GLN 53 HN GLN 53 -3.497 2.697 -8.844 288 HA GLN 53 HA GLN 53 -5.242 2.317 -11.048 289 HB2 GLN 53 HB2 GLN 53 -2.221 2.322 -10.925 290 HB3 GLN 53 HB1 GLN 53 -3.169 2.387 -12.405 291 HG2 GLN 53 HG2 GLN 53 -4.152 4.502 -11.702 292 HG3 GLN 53 HG1 GLN 53 -3.232 4.439 -10.201 293 HE21 GLN 53 HE21 GLN 53 -3.228 6.462 -12.261 294 HE22 GLN 53 HE22 GLN 53 -1.599 6.580 -12.829 295 H ARG 54 HN ARG 54 -3.309 0.168 -9.140 296 HA ARG 54 HA ARG 54 -3.218 -1.997 -10.983 297 HB2 ARG 54 HB2 ARG 54 -1.643 -2.001 -9.183 298 HB3 ARG 54 HB1 ARG 54 -2.912 -1.840 -7.980 299 HG2 ARG 54 HG2 ARG 54 -2.171 -4.072 -7.866 300 HG3 ARG 54 HG1 ARG 54 -3.723 -4.117 -8.702 301 HD2 ARG 54 HD2 ARG 54 -2.700 -4.455 -10.795 302 HD3 ARG 54 HD1 ARG 54 -1.112 -3.999 -10.182 303 HE ARG 54 HE ARG 54 -1.934 -6.239 -8.751 304 HH11 ARG 54 HH11 ARG 54 -1.150 -5.356 -12.053 305 HH12 ARG 54 HH12 ARG 54 -0.566 -7.004 -12.489 306 HH21 ARG 54 HH21 ARG 54 -1.179 -8.363 -9.225 307 HH22 ARG 54 HH22 ARG 54 -0.607 -8.690 -10.912 308 H GLN 55 HN GLN 55 -5.382 -1.050 -8.369 309 HA GLN 55 HA GLN 55 -7.096 -3.329 -8.625 310 HB2 GLN 55 HB2 GLN 55 -7.459 -0.663 -7.253 311 HB3 GLN 55 HB1 GLN 55 -8.632 -1.969 -7.173 312 HG2 GLN 55 HG2 GLN 55 -5.798 -2.043 -6.157 313 HG3 GLN 55 HG1 GLN 55 -7.262 -1.935 -5.179 314 HE21 GLN 55 HE21 GLN 55 -8.682 -3.740 -5.133 315 HE22 GLN 55 HE22 GLN 55 -8.080 -5.333 -5.440 316 H GLY 56 HN GLY 56 -6.864 -0.205 -10.110 317 HA2 GLY 56 HA2 GLY 56 -7.873 0.302 -12.193 318 HA3 GLY 56 HA1 GLY 56 -9.105 -0.908 -11.860 319 H VAL 57 HN VAL 57 -8.127 1.461 -9.504 320 HA VAL 57 HA VAL 57 -10.647 2.920 -9.939 321 HB VAL 57 HB VAL 57 -10.768 3.214 -7.435 322 HG11 VAL 57 HG11 VAL 57 -11.711 0.946 -7.019 323 HG12 VAL 57 HG12 VAL 57 -11.064 0.444 -8.584 324 HG13 VAL 57 HG13 VAL 57 -12.292 1.709 -8.500 325 HG21 VAL 57 HG21 VAL 57 -8.765 0.960 -7.446 326 HG22 VAL 57 HG22 VAL 57 -9.611 1.587 -6.029 327 HG23 VAL 57 HG23 VAL 57 -8.467 2.612 -6.899 328 HA PRO 58 HA PRO 58 -8.173 6.589 -9.763 329 HB2 PRO 58 HB2 PRO 58 -9.869 8.330 -8.518 330 HB3 PRO 58 HB1 PRO 58 -10.055 7.839 -10.207 331 HG2 PRO 58 HG2 PRO 58 -11.485 6.828 -7.791 332 HG3 PRO 58 HG1 PRO 58 -12.127 7.194 -9.406 333 HD2 PRO 58 HD2 PRO 58 -11.611 4.675 -8.618 334 HD3 PRO 58 HD1 PRO 58 -11.399 5.202 -10.300 335 H MET 59 HN MET 59 -7.287 8.233 -8.178 336 HA MET 59 HA MET 59 -6.547 6.844 -5.759 337 HB2 MET 59 HB2 MET 59 -5.078 8.382 -7.294 338 HB3 MET 59 HB1 MET 59 -5.764 9.682 -6.329 339 HG2 MET 59 HG2 MET 59 -4.935 8.550 -4.291 340 HG3 MET 59 HG1 MET 59 -4.162 7.344 -5.317 341 HE1 MET 59 HE1 MET 59 -2.518 8.803 -3.167 342 HE2 MET 59 HE2 MET 59 -1.081 9.330 -4.043 343 HE3 MET 59 HE3 MET 59 -1.756 7.729 -4.342 344 H ASN 60 HN ASN 60 -6.683 7.816 -3.642 345 HA ASN 60 HA ASN 60 -7.684 8.863 -1.895 346 HB2 ASN 60 HB2 ASN 60 -7.639 10.866 -3.598 347 HB3 ASN 60 HB1 ASN 60 -9.373 10.584 -3.671 348 HD21 ASN 60 HD21 ASN 60 -10.637 11.021 -1.874 349 HD22 ASN 60 HD22 ASN 60 -10.051 11.942 -0.533 350 H SER 61 HN SER 61 -9.013 6.790 -3.869 351 HA SER 61 HA SER 61 -11.765 6.965 -2.940 352 HB2 SER 61 HB2 SER 61 -12.060 4.915 -4.358 353 HB3 SER 61 HB1 SER 61 -11.426 6.298 -5.253 354 HG SER 61 HG SER 61 -9.688 5.191 -5.664 355 H LEU 62 HN LEU 62 -8.906 4.952 -2.599 356 HA LEU 62 HA LEU 62 -10.211 3.444 -0.448 357 HB2 LEU 62 HB2 LEU 62 -7.642 2.787 -1.889 358 HB3 LEU 62 HB1 LEU 62 -8.521 1.752 -0.783 359 HG LEU 62 HG LEU 62 -9.584 2.646 -3.461 360 HD11 LEU 62 HD11 LEU 62 -9.074 0.353 -4.200 361 HD12 LEU 62 HD12 LEU 62 -8.243 0.064 -2.672 362 HD13 LEU 62 HD13 LEU 62 -7.624 1.271 -3.798 363 HD21 LEU 62 HD21 LEU 62 -11.344 2.081 -1.915 364 HD22 LEU 62 HD22 LEU 62 -10.526 0.581 -1.475 365 HD23 LEU 62 HD23 LEU 62 -11.177 0.788 -3.102 366 H ARG 63 HN ARG 63 -9.382 3.444 1.584 367 HA ARG 63 HA ARG 63 -7.209 5.349 2.085 368 HB2 ARG 63 HB2 ARG 63 -8.020 5.434 4.396 369 HB3 ARG 63 HB1 ARG 63 -9.292 5.845 3.256 370 HG2 ARG 63 HG2 ARG 63 -10.324 3.701 3.539 371 HG3 ARG 63 HG1 ARG 63 -8.971 3.129 4.517 372 HD2 ARG 63 HD2 ARG 63 -9.498 4.850 6.202 373 HD3 ARG 63 HD1 ARG 63 -10.885 5.349 5.235 374 HE ARG 63 HE ARG 63 -10.608 2.821 6.700 375 HH11 ARG 63 HH11 ARG 63 -14.111 4.267 5.273 376 HH12 ARG 63 HH12 ARG 63 -12.567 5.133 4.901 377 HH21 ARG 63 HH21 ARG 63 -12.546 1.719 7.221 378 HH22 ARG 63 HH22 ARG 63 -14.099 2.364 6.571 379 H PHE 64 HN PHE 64 -5.308 4.671 2.736 380 HA PHE 64 HA PHE 64 -4.922 1.836 3.264 381 HB2 PHE 64 HB2 PHE 64 -2.962 4.099 2.817 382 HB3 PHE 64 HB1 PHE 64 -2.487 2.435 3.138 383 HD1 PHE 64 HD1 PHE 64 -4.065 4.699 0.717 384 HD2 PHE 64 HD2 PHE 64 -2.641 0.756 1.449 385 HE1 PHE 64 HE1 PHE 64 -4.217 4.202 -1.684 386 HE2 PHE 64 HE2 PHE 64 -2.793 0.254 -0.953 387 HZ PHE 64 HZ PHE 64 -3.584 1.980 -2.521 388 H LEU 65 HN LEU 65 -4.929 1.120 5.289 389 HA LEU 65 HA LEU 65 -4.325 3.037 7.438 390 HB2 LEU 65 HB2 LEU 65 -5.986 0.526 7.541 391 HB3 LEU 65 HB1 LEU 65 -5.685 1.603 8.890 392 HG LEU 65 HG LEU 65 -7.102 2.463 6.371 393 HD11 LEU 65 HD11 LEU 65 -8.369 1.708 8.991 394 HD12 LEU 65 HD12 LEU 65 -8.282 0.630 7.600 395 HD13 LEU 65 HD13 LEU 65 -9.175 2.146 7.486 396 HD21 LEU 65 HD21 LEU 65 -6.884 3.697 9.114 397 HD22 LEU 65 HD22 LEU 65 -7.880 4.311 7.794 398 HD23 LEU 65 HD23 LEU 65 -6.124 4.286 7.636 399 H PHE 66 HN PHE 66 -2.710 2.684 8.740 400 HA PHE 66 HA PHE 66 -1.533 0.002 8.921 401 HB2 PHE 66 HB2 PHE 66 -0.254 1.427 7.268 402 HB3 PHE 66 HB1 PHE 66 0.117 2.521 8.594 403 HD1 PHE 66 HD1 PHE 66 0.609 -0.913 7.331 404 HD2 PHE 66 HD2 PHE 66 1.849 2.045 10.122 405 HE1 PHE 66 HE1 PHE 66 2.577 -2.277 7.898 406 HE2 PHE 66 HE2 PHE 66 3.819 0.687 10.696 407 HZ PHE 66 HZ PHE 66 4.184 -1.475 9.581 408 H GLU 67 HN GLU 67 -1.652 -0.534 10.994 409 HA GLU 67 HA GLU 67 -1.625 -0.462 13.258 410 HB2 GLU 67 HB2 GLU 67 0.155 1.936 12.772 411 HB3 GLU 67 HB1 GLU 67 -0.103 1.197 14.346 412 HG2 GLU 67 HG2 GLU 67 1.039 -0.236 11.960 413 HG3 GLU 67 HG1 GLU 67 1.998 0.506 13.239 414 H GLY 68 HN GLY 68 -3.720 0.867 11.785 415 HA2 GLY 68 HA2 GLY 68 -5.696 1.812 12.618 416 HA3 GLY 68 HA1 GLY 68 -4.797 2.436 13.989 417 H GLN 69 HN GLN 69 -2.738 3.559 12.082 418 HA GLN 69 HA GLN 69 -4.093 6.095 11.687 419 HB2 GLN 69 HB2 GLN 69 -1.218 5.390 11.068 420 HB3 GLN 69 HB1 GLN 69 -1.899 7.002 11.234 421 HG2 GLN 69 HG2 GLN 69 -2.404 6.431 13.628 422 HG3 GLN 69 HG1 GLN 69 -1.466 4.957 13.396 423 HE21 GLN 69 HE21 GLN 69 -0.964 7.167 15.193 424 HE22 GLN 69 HE22 GLN 69 0.600 7.782 14.782 425 H ARG 70 HN ARG 70 -4.145 7.230 9.688 426 HA ARG 70 HA ARG 70 -4.300 5.432 7.392 427 HB2 ARG 70 HB2 ARG 70 -5.474 7.292 6.257 428 HB3 ARG 70 HB1 ARG 70 -6.262 6.803 7.748 429 HG2 ARG 70 HG2 ARG 70 -5.098 8.736 8.863 430 HG3 ARG 70 HG1 ARG 70 -4.624 9.270 7.250 431 HD2 ARG 70 HD2 ARG 70 -7.479 8.743 8.043 432 HD3 ARG 70 HD1 ARG 70 -6.718 10.322 8.198 433 HE ARG 70 HE ARG 70 -6.422 10.286 5.759 434 HH11 ARG 70 HH11 ARG 70 -8.783 8.059 7.165 435 HH12 ARG 70 HH12 ARG 70 -9.788 8.025 5.659 436 HH21 ARG 70 HH21 ARG 70 -7.698 10.230 3.851 437 HH22 ARG 70 HH22 ARG 70 -9.186 9.192 3.840 438 H ILE 71 HN ILE 71 -2.870 5.407 5.825 439 HA ILE 71 HA ILE 71 -0.433 6.841 6.052 440 HB ILE 71 HB ILE 71 -1.486 5.188 3.751 441 HG12 ILE 71 HG12 ILE 71 -1.301 3.891 5.811 442 HG13 ILE 71 HG11 ILE 71 -0.040 3.411 4.682 443 HG21 ILE 71 HG21 ILE 71 0.822 5.041 2.996 444 HG22 ILE 71 HG22 ILE 71 1.338 6.079 4.325 445 HG23 ILE 71 HG23 ILE 71 0.295 6.722 3.059 446 HD11 ILE 71 HD11 ILE 71 1.518 4.924 5.926 447 HD12 ILE 71 HD12 ILE 71 0.940 3.526 6.832 448 HD13 ILE 71 HD13 ILE 71 0.247 5.121 7.135 449 H ALA 72 HN ALA 72 0.022 8.803 5.398 450 HA ALA 72 HA ALA 72 -1.801 10.255 3.666 451 HB1 ALA 72 HB1 ALA 72 -0.304 12.178 4.188 452 HB2 ALA 72 HB2 ALA 72 0.684 11.090 5.163 453 HB3 ALA 72 HB3 ALA 72 -0.993 11.404 5.614 454 H ASP 73 HN ASP 73 -0.577 11.814 2.065 455 HA ASP 73 HA ASP 73 0.802 10.067 0.214 456 HB2 ASP 73 HB2 ASP 73 -0.355 12.833 0.041 457 HB3 ASP 73 HB1 ASP 73 0.754 12.261 -1.200 458 H ASN 74 HN ASN 74 1.622 12.184 2.662 459 HA ASN 74 HA ASN 74 4.305 12.675 1.568 460 HB2 ASN 74 HB2 ASN 74 4.521 14.344 3.393 461 HB3 ASN 74 HB1 ASN 74 3.174 14.696 2.315 462 HD21 ASN 74 HD21 ASN 74 4.142 13.932 5.510 463 HD22 ASN 74 HD22 ASN 74 2.576 14.014 6.242 464 H HIS 75 HN HIS 75 3.288 10.153 2.616 465 HA HIS 75 HA HIS 75 4.756 9.798 5.115 466 HB2 HIS 75 HB2 HIS 75 2.427 8.595 3.920 467 HB3 HIS 75 HB1 HIS 75 3.622 7.351 4.267 468 HD2 HIS 75 HD2 HIS 75 4.543 7.523 7.083 469 HE1 HIS 75 HE1 HIS 75 0.714 8.882 8.256 470 HE2 HIS 75 HE2 HIS 75 2.994 8.135 9.068 471 H THR 76 HN THR 76 6.570 8.573 5.284 472 HA THR 76 HA THR 76 7.635 7.401 2.796 473 HB THR 76 HB THR 76 9.619 7.911 4.879 474 HG1 THR 76 HG1 THR 76 8.113 9.716 5.192 475 HG21 THR 76 HG21 THR 76 10.172 7.372 2.559 476 HG22 THR 76 HG22 THR 76 10.814 8.953 3.006 477 HG23 THR 76 HG23 THR 76 9.358 8.838 2.016 478 HA PRO 77 HA PRO 77 7.348 3.460 4.853 479 HB2 PRO 77 HB2 PRO 77 9.786 2.701 3.362 480 HB3 PRO 77 HB1 PRO 77 8.178 1.964 3.346 481 HG2 PRO 77 HG2 PRO 77 9.041 3.392 1.272 482 HG3 PRO 77 HG1 PRO 77 7.346 3.449 1.795 483 HD2 PRO 77 HD2 PRO 77 9.525 5.440 2.246 484 HD3 PRO 77 HD1 PRO 77 7.809 5.704 1.871 485 H LYS 78 HN LYS 78 9.990 5.544 5.186 486 HA LYS 78 HA LYS 78 11.548 3.815 6.905 487 HB2 LYS 78 HB2 LYS 78 12.564 5.512 5.354 488 HB3 LYS 78 HB1 LYS 78 11.904 6.769 6.385 489 HG2 LYS 78 HG2 LYS 78 14.203 6.470 6.936 490 HG3 LYS 78 HG1 LYS 78 13.230 5.845 8.268 491 HD2 LYS 78 HD2 LYS 78 14.982 4.286 7.890 492 HD3 LYS 78 HD1 LYS 78 13.501 3.562 7.265 493 HE2 LYS 78 HE2 LYS 78 15.300 3.173 5.705 494 HE3 LYS 78 HE1 LYS 78 14.148 4.300 4.988 495 HZ1 LYS 78 HZ1 LYS 78 16.746 5.004 6.246 496 HZ2 LYS 78 HZ2 LYS 78 15.634 6.122 5.638 497 HZ3 LYS 78 HZ3 LYS 78 16.395 5.032 4.595 498 H GLU 79 HN GLU 79 8.918 5.973 7.271 499 HA GLU 79 HA GLU 79 9.519 6.328 10.125 500 HB2 GLU 79 HB2 GLU 79 7.872 8.092 10.157 501 HB3 GLU 79 HB1 GLU 79 9.011 8.385 8.853 502 HG2 GLU 79 HG2 GLU 79 7.264 7.248 7.350 503 HG3 GLU 79 HG1 GLU 79 6.156 7.505 8.697 504 H LEU 80 HN LEU 80 7.356 6.430 11.457 505 HA LEU 80 HA LEU 80 5.568 5.376 12.360 506 HB2 LEU 80 HB2 LEU 80 5.054 5.177 9.620 507 HB3 LEU 80 HB1 LEU 80 4.868 3.542 10.224 508 HG LEU 80 HG LEU 80 3.431 5.929 11.391 509 HD11 LEU 80 HD11 LEU 80 1.450 5.065 10.197 510 HD12 LEU 80 HD12 LEU 80 2.490 3.913 9.355 511 HD13 LEU 80 HD13 LEU 80 2.710 5.646 9.108 512 HD21 LEU 80 HD21 LEU 80 3.032 2.955 11.720 513 HD22 LEU 80 HD22 LEU 80 2.001 4.210 12.407 514 HD23 LEU 80 HD23 LEU 80 3.678 4.063 12.931 515 H GLY 81 HN GLY 81 7.078 2.984 10.189 516 HA2 GLY 81 HA2 GLY 81 8.698 1.493 11.506 517 HA3 GLY 81 HA1 GLY 81 7.284 1.161 12.495 518 H MET 82 HN MET 82 8.089 1.278 9.035 519 HA MET 82 HA MET 82 6.400 -1.072 8.604 520 HB2 MET 82 HB2 MET 82 7.561 1.017 6.776 521 HB3 MET 82 HB1 MET 82 6.959 -0.505 6.138 522 HG2 MET 82 HG2 MET 82 4.761 -0.033 7.092 523 HG3 MET 82 HG1 MET 82 5.367 1.498 7.723 524 HE1 MET 82 HE1 MET 82 3.114 2.505 6.355 525 HE2 MET 82 HE2 MET 82 2.835 0.858 5.790 526 HE3 MET 82 HE3 MET 82 2.884 2.190 4.634 527 H GLU 83 HN GLU 83 7.245 -3.026 8.258 528 HA GLU 83 HA GLU 83 10.054 -3.204 7.415 529 HB2 GLU 83 HB2 GLU 83 8.836 -4.214 9.892 530 HB3 GLU 83 HB1 GLU 83 9.775 -5.412 9.013 531 HG2 GLU 83 HG2 GLU 83 10.734 -2.737 10.001 532 HG3 GLU 83 HG1 GLU 83 11.179 -4.325 10.626 533 H GLU 84 HN GLU 84 10.497 -5.700 7.001 534 HA GLU 84 HA GLU 84 8.968 -6.390 4.730 535 HB2 GLU 84 HB2 GLU 84 11.310 -7.009 4.921 536 HB3 GLU 84 HB1 GLU 84 10.971 -7.980 6.345 537 HG2 GLU 84 HG2 GLU 84 11.271 -9.442 4.493 538 HG3 GLU 84 HG1 GLU 84 9.568 -9.464 4.940 539 H GLU 85 HN GLU 85 7.319 -7.767 4.437 540 HA GLU 85 HA GLU 85 5.581 -9.157 4.837 541 HB2 GLU 85 HB2 GLU 85 7.445 -10.067 7.008 542 HB3 GLU 85 HB1 GLU 85 5.830 -10.747 6.848 543 HG2 GLU 85 HG2 GLU 85 7.867 -10.722 4.640 544 HG3 GLU 85 HG1 GLU 85 7.632 -12.066 5.757 545 H ASP 86 HN ASP 86 5.496 -6.499 5.821 546 HA ASP 86 HA ASP 86 4.227 -6.619 8.420 547 HB2 ASP 86 HB2 ASP 86 5.600 -4.639 7.150 548 HB3 ASP 86 HB1 ASP 86 3.937 -4.145 6.840 549 H VAL 87 HN VAL 87 2.060 -5.357 8.591 550 HA VAL 87 HA VAL 87 0.286 -6.413 6.484 551 HB VAL 87 HB VAL 87 -0.405 -6.039 9.401 552 HG11 VAL 87 HG11 VAL 87 -2.431 -7.296 8.847 553 HG12 VAL 87 HG12 VAL 87 -1.939 -7.341 7.153 554 HG13 VAL 87 HG13 VAL 87 -2.324 -5.800 7.918 555 HG21 VAL 87 HG21 VAL 87 0.145 -8.589 7.890 556 HG22 VAL 87 HG22 VAL 87 -0.361 -8.463 9.575 557 HG23 VAL 87 HG23 VAL 87 1.217 -7.850 9.079 558 H ILE 88 HN ILE 88 -0.860 -4.977 5.405 559 HA ILE 88 HA ILE 88 -1.480 -2.399 6.682 560 HB ILE 88 HB ILE 88 0.304 -1.953 5.126 561 HG12 ILE 88 HG12 ILE 88 -2.268 -1.126 3.772 562 HG13 ILE 88 HG11 ILE 88 -1.655 -0.376 5.243 563 HG21 ILE 88 HG21 ILE 88 0.120 -2.465 2.726 564 HG22 ILE 88 HG22 ILE 88 -1.360 -3.368 3.051 565 HG23 ILE 88 HG23 ILE 88 0.174 -3.915 3.731 566 HD11 ILE 88 HD11 ILE 88 0.329 0.363 4.071 567 HD12 ILE 88 HD12 ILE 88 -1.121 0.914 3.232 568 HD13 ILE 88 HD13 ILE 88 -0.210 -0.459 2.606 569 H GLU 89 HN GLU 89 -3.551 -1.695 6.420 570 HA GLU 89 HA GLU 89 -5.354 -3.552 5.025 571 HB2 GLU 89 HB2 GLU 89 -5.950 -1.468 7.132 572 HB3 GLU 89 HB1 GLU 89 -7.134 -2.538 6.399 573 HG2 GLU 89 HG2 GLU 89 -5.994 -4.466 7.345 574 HG3 GLU 89 HG1 GLU 89 -4.779 -3.403 8.056 575 H VAL 90 HN VAL 90 -7.034 -2.761 3.716 576 HA VAL 90 HA VAL 90 -6.891 0.039 2.904 577 HB VAL 90 HB VAL 90 -5.451 -1.121 1.305 578 HG11 VAL 90 HG11 VAL 90 -7.861 -2.819 0.673 579 HG12 VAL 90 HG12 VAL 90 -6.382 -3.362 1.464 580 HG13 VAL 90 HG13 VAL 90 -6.336 -2.821 -0.214 581 HG21 VAL 90 HG21 VAL 90 -8.100 -0.319 0.113 582 HG22 VAL 90 HG22 VAL 90 -6.573 -0.444 -0.763 583 HG23 VAL 90 HG23 VAL 90 -6.765 0.761 0.512 584 H TYR 91 HN TYR 91 -8.854 0.880 2.875 585 HA TYR 91 HA TYR 91 -11.148 -0.837 2.230 586 HB2 TYR 91 HB2 TYR 91 -11.014 1.101 4.555 587 HB3 TYR 91 HB1 TYR 91 -12.459 0.244 4.033 588 HD1 TYR 91 HD1 TYR 91 -12.559 -2.250 4.276 589 HD2 TYR 91 HD2 TYR 91 -9.404 0.058 5.953 590 HE1 TYR 91 HE1 TYR 91 -11.986 -4.125 5.763 591 HE2 TYR 91 HE2 TYR 91 -8.822 -1.810 7.442 592 HH TYR 91 HH TYR 91 -9.242 -3.907 8.031 593 H GLN 92 HN GLN 92 -13.084 0.465 1.608 594 HA GLN 92 HA GLN 92 -12.208 2.688 -0.046 595 HB2 GLN 92 HB2 GLN 92 -13.772 0.832 -0.823 596 HB3 GLN 92 HB1 GLN 92 -15.010 1.589 0.172 597 HG2 GLN 92 HG2 GLN 92 -14.227 3.725 -1.221 598 HG3 GLN 92 HG1 GLN 92 -13.823 2.466 -2.388 599 HE21 GLN 92 HE21 GLN 92 -16.340 4.155 -0.749 600 HE22 GLN 92 HE22 GLN 92 -17.663 3.489 -1.643 601 H GLU 93 HN GLU 93 -12.636 4.774 0.298 602 HA GLU 93 HA GLU 93 -13.627 5.584 2.854 603 HB2 GLU 93 HB2 GLU 93 -12.811 7.128 0.393 604 HB3 GLU 93 HB1 GLU 93 -13.363 7.904 1.871 605 HG2 GLU 93 HG2 GLU 93 -11.048 5.994 1.828 606 HG3 GLU 93 HG1 GLU 93 -10.860 7.719 1.522 607 H GLN 94 HN GLN 94 -15.425 6.992 3.223 608 HA GLN 94 HA GLN 94 -17.803 6.115 1.970 609 HB2 GLN 94 HB2 GLN 94 -17.573 6.954 4.337 610 HB3 GLN 94 HB1 GLN 94 -17.463 8.582 3.684 611 HG2 GLN 94 HG2 GLN 94 -19.703 8.207 2.626 612 HG3 GLN 94 HG1 GLN 94 -19.800 6.701 3.538 613 HE21 GLN 94 HE21 GLN 94 -20.130 6.763 5.735 614 HE22 GLN 94 HE22 GLN 94 -20.595 8.205 6.569 615 H THR 95 HN THR 95 -15.553 8.536 1.148 616 HA THR 95 HA THR 95 -17.306 10.310 -0.235 617 HB THR 95 HB THR 95 -14.854 10.727 -1.363 618 HG1 THR 95 HG1 THR 95 -13.304 10.042 -0.047 619 HG21 THR 95 HG21 THR 95 -16.256 12.406 -0.246 620 HG22 THR 95 HG22 THR 95 -14.582 12.503 0.300 621 HG23 THR 95 HG23 THR 95 -15.800 11.740 1.321 622 H GLY 96 HN GLY 96 -15.931 7.262 -0.977 623 HA2 GLY 96 HA2 GLY 96 -16.389 5.925 -2.822 624 HA3 GLY 96 HA1 GLY 96 -17.150 7.304 -3.599 625 H GLY 97 HN GLY 97 -15.469 9.116 -4.104 626 HA2 GLY 97 HA2 GLY 97 -12.788 8.565 -4.587 627 HA3 GLY 97 HA1 GLY 97 -13.680 8.051 -6.015 628 H1 ASN 357 HT1 ASN 357 -3.487 -20.073 -5.300 629 H2 ASN 357 HT2 ASN 357 -4.238 -20.518 -3.853 630 H3 ASN 357 HT3 ASN 357 -2.732 -21.172 -4.257 631 HA ASN 357 HA ASN 357 -2.463 -19.492 -2.592 632 HB2 ASN 357 HB2 ASN 357 -0.824 -18.074 -3.727 633 HB3 ASN 357 HB1 ASN 357 -0.688 -19.737 -4.284 634 HD21 ASN 357 HD21 ASN 357 0.058 -17.114 -5.500 635 HD22 ASN 357 HD22 ASN 357 -0.685 -17.133 -7.062 636 H ASN 358 HN ASN 358 -3.001 -17.565 -1.707 637 HA ASN 358 HA ASN 358 -5.009 -15.984 -3.166 638 HB2 ASN 358 HB2 ASN 358 -5.830 -15.274 -0.954 639 HB3 ASN 358 HB1 ASN 358 -5.861 -17.025 -1.111 640 HD21 ASN 358 HD21 ASN 358 -5.962 -15.718 1.346 641 HD22 ASN 358 HD22 ASN 358 -4.497 -16.032 2.216 642 H ARG 359 HN ARG 359 -1.994 -15.813 -3.170 643 HA ARG 359 HA ARG 359 -1.698 -13.059 -2.180 644 HB2 ARG 359 HB2 ARG 359 0.418 -15.157 -2.699 645 HB3 ARG 359 HB1 ARG 359 0.733 -13.516 -2.156 646 HG2 ARG 359 HG2 ARG 359 -0.734 -14.055 -0.162 647 HG3 ARG 359 HG1 ARG 359 -0.621 -15.737 -0.667 648 HD2 ARG 359 HD2 ARG 359 1.797 -15.658 -0.482 649 HD3 ARG 359 HD1 ARG 359 1.723 -13.949 -0.062 650 HE ARG 359 HE ARG 359 0.158 -15.220 1.804 651 HH11 ARG 359 HH11 ARG 359 3.514 -15.369 0.746 652 HH12 ARG 359 HH12 ARG 359 4.114 -15.867 2.374 653 HH21 ARG 359 HH21 ARG 359 0.871 -15.862 3.860 654 HH22 ARG 359 HH22 ARG 359 2.639 -16.145 4.120 655 H ASP 360 HN ASP 360 -0.237 -11.677 -3.443 656 HA ASP 360 HA ASP 360 0.284 -12.324 -6.196 657 HB2 ASP 360 HB2 ASP 360 -2.122 -11.670 -6.281 658 HB3 ASP 360 HB1 ASP 360 -1.694 -10.106 -5.594 659 HA PRO 361 HA PRO 361 3.294 -9.292 -4.802 660 HB2 PRO 361 HB2 PRO 361 5.274 -10.037 -6.491 661 HB3 PRO 361 HB1 PRO 361 4.886 -10.938 -5.020 662 HG2 PRO 361 HG2 PRO 361 4.297 -11.608 -7.835 663 HG3 PRO 361 HG1 PRO 361 4.572 -12.680 -6.451 664 HD2 PRO 361 HD2 PRO 361 2.081 -12.004 -7.553 665 HD3 PRO 361 HD1 PRO 361 2.366 -12.814 -6.003 666 H ILE 362 HN ILE 362 2.920 -7.270 -5.436 667 HA ILE 362 HA ILE 362 2.763 -6.681 -8.312 668 HB ILE 362 HB ILE 362 1.825 -4.913 -6.063 669 HG12 ILE 362 HG12 ILE 362 0.061 -6.643 -7.797 670 HG13 ILE 362 HG11 ILE 362 0.643 -7.168 -6.220 671 HG21 ILE 362 HG21 ILE 362 1.238 -4.878 -9.018 672 HG22 ILE 362 HG22 ILE 362 2.282 -3.755 -8.146 673 HG23 ILE 362 HG23 ILE 362 0.549 -3.784 -7.818 674 HD11 ILE 362 HD11 ILE 362 -0.842 -4.592 -6.558 675 HD12 ILE 362 HD12 ILE 362 -0.598 -5.545 -5.096 676 HD13 ILE 362 HD13 ILE 362 -1.683 -6.128 -6.359 677 H VAL 363 HN VAL 363 4.391 -5.629 -9.235 678 HA VAL 363 HA VAL 363 6.333 -4.253 -7.507 679 HB VAL 363 HB VAL 363 6.739 -4.864 -10.430 680 HG11 VAL 363 HG11 VAL 363 9.104 -4.795 -9.808 681 HG12 VAL 363 HG12 VAL 363 8.655 -4.464 -8.136 682 HG13 VAL 363 HG13 VAL 363 8.285 -3.289 -9.398 683 HG21 VAL 363 HG21 VAL 363 7.884 -6.933 -9.774 684 HG22 VAL 363 HG22 VAL 363 6.169 -6.976 -9.365 685 HG23 VAL 363 HG23 VAL 363 7.369 -6.683 -8.108 686 H ILE 364 HN ILE 364 6.579 -2.094 -7.617 687 HA ILE 364 HA ILE 364 4.789 -0.630 -9.397 688 HB ILE 364 HB ILE 364 5.292 1.332 -8.009 689 HG12 ILE 364 HG12 ILE 364 6.516 0.198 -5.744 690 HG13 ILE 364 HG11 ILE 364 7.471 -0.353 -7.114 691 HG21 ILE 364 HG21 ILE 364 4.171 0.563 -5.977 692 HG22 ILE 364 HG22 ILE 364 4.506 -1.109 -6.421 693 HG23 ILE 364 HG23 ILE 364 3.431 -0.134 -7.420 694 HD11 ILE 364 HD11 ILE 364 7.791 1.951 -7.830 695 HD12 ILE 364 HD12 ILE 364 8.358 1.705 -6.179 696 HD13 ILE 364 HD13 ILE 364 6.818 2.513 -6.468 697 H SER 365 HN SER 365 5.619 1.518 -10.189 698 HA SER 365 HA SER 365 8.289 1.150 -11.361 699 HB2 SER 365 HB2 SER 365 6.111 2.925 -12.474 700 HB3 SER 365 HB1 SER 365 7.534 2.292 -13.302 701 HG SER 365 HG SER 365 6.582 0.389 -13.549 702 H ASP 366 HN ASP 366 9.819 2.564 -10.788 703 HA ASP 366 HA ASP 366 8.986 5.066 -9.466 704 HB2 ASP 366 HB2 ASP 366 10.063 3.697 -7.844 705 HB3 ASP 366 HB1 ASP 366 11.353 3.266 -8.961 706 H SER 367 HN SER 367 9.601 6.921 -10.388 707 HA SER 367 HA SER 367 11.979 7.002 -12.060 708 HB2 SER 367 HB2 SER 367 9.294 7.894 -13.143 709 HB3 SER 367 HB1 SER 367 10.839 7.910 -13.993 710 HG SER 367 HG SER 367 10.506 5.452 -13.142 711 HA PRO 368 HA PRO 368 11.656 10.803 -9.548 712 HB2 PRO 368 HB2 PRO 368 14.565 10.814 -9.772 713 HB3 PRO 368 HB1 PRO 368 13.565 10.690 -8.322 714 HG2 PRO 368 HG2 PRO 368 15.040 8.626 -9.230 715 HG3 PRO 368 HG1 PRO 368 13.497 8.401 -8.382 716 HD2 PRO 368 HD2 PRO 368 14.071 8.299 -11.314 717 HD3 PRO 368 HD1 PRO 368 13.033 7.244 -10.330 Start of MODEL 9 1 H TYR 21 HT1 TYR 21 14.631 -4.971 0.208 2 HA TYR 21 HA TYR 21 13.289 -3.144 -0.604 3 HB2 TYR 21 HB2 TYR 21 12.192 -5.262 -2.470 4 HB3 TYR 21 HB1 TYR 21 11.495 -3.663 -2.243 5 HD1 TYR 21 HD1 TYR 21 14.043 -2.054 -2.165 6 HD2 TYR 21 HD2 TYR 21 12.783 -5.192 -4.742 7 HE1 TYR 21 HE1 TYR 21 15.503 -1.174 -3.935 8 HE2 TYR 21 HE2 TYR 21 14.240 -4.321 -6.522 9 HH TYR 21 HH TYR 21 15.252 -2.040 -7.123 10 H ILE 22 HN ILE 22 11.031 -2.924 0.095 11 HA ILE 22 HA ILE 22 10.442 -4.919 2.155 12 HB ILE 22 HB ILE 22 9.340 -2.131 1.758 13 HG12 ILE 22 HG12 ILE 22 11.695 -2.147 2.457 14 HG13 ILE 22 HG11 ILE 22 10.659 -1.545 3.742 15 HG21 ILE 22 HG21 ILE 22 7.706 -3.589 2.823 16 HG22 ILE 22 HG22 ILE 22 8.325 -2.396 3.965 17 HG23 ILE 22 HG23 ILE 22 8.901 -4.062 4.032 18 HD11 ILE 22 HD11 ILE 22 12.302 -2.971 4.703 19 HD12 ILE 22 HD12 ILE 22 11.938 -4.256 3.553 20 HD13 ILE 22 HD13 ILE 22 10.751 -3.806 4.776 21 H LYS 23 HN LYS 23 8.804 -6.307 1.935 22 HA LYS 23 HA LYS 23 6.856 -5.801 -0.210 23 HB2 LYS 23 HB2 LYS 23 8.277 -7.858 -0.397 24 HB3 LYS 23 HB1 LYS 23 7.540 -8.438 1.090 25 HG2 LYS 23 HG2 LYS 23 5.313 -8.013 -0.234 26 HG3 LYS 23 HG1 LYS 23 6.378 -8.191 -1.630 27 HD2 LYS 23 HD2 LYS 23 5.530 -10.352 -1.187 28 HD3 LYS 23 HD1 LYS 23 7.179 -10.348 -0.560 29 HE2 LYS 23 HE2 LYS 23 5.064 -9.541 1.334 30 HE3 LYS 23 HE1 LYS 23 5.044 -11.228 0.831 31 HZ1 LYS 23 HZ1 LYS 23 6.358 -11.036 2.783 32 HZ2 LYS 23 HZ2 LYS 23 7.287 -9.773 2.125 33 HZ3 LYS 23 HZ3 LYS 23 7.412 -11.337 1.489 34 H LEU 24 HN LEU 24 5.111 -4.881 0.625 35 HA LEU 24 HA LEU 24 4.226 -5.553 3.320 36 HB2 LEU 24 HB2 LEU 24 3.129 -3.541 1.352 37 HB3 LEU 24 HB1 LEU 24 2.629 -3.714 3.022 38 HG LEU 24 HG LEU 24 5.411 -2.929 2.151 39 HD11 LEU 24 HD11 LEU 24 3.775 -1.225 1.532 40 HD12 LEU 24 HD12 LEU 24 4.809 -0.673 2.849 41 HD13 LEU 24 HD13 LEU 24 3.162 -1.208 3.184 42 HD21 LEU 24 HD21 LEU 24 5.398 -4.001 4.315 43 HD22 LEU 24 HD22 LEU 24 4.069 -2.977 4.855 44 HD23 LEU 24 HD23 LEU 24 5.649 -2.268 4.524 45 H LYS 25 HN LYS 25 2.410 -6.644 3.814 46 HA LYS 25 HA LYS 25 0.997 -7.937 1.599 47 HB2 LYS 25 HB2 LYS 25 1.333 -8.576 4.517 48 HB3 LYS 25 HB1 LYS 25 0.019 -9.293 3.595 49 HG2 LYS 25 HG2 LYS 25 1.607 -10.298 2.065 50 HG3 LYS 25 HG1 LYS 25 2.943 -9.527 2.920 51 HD2 LYS 25 HD2 LYS 25 2.628 -10.856 4.834 52 HD3 LYS 25 HD1 LYS 25 1.022 -11.366 4.313 53 HE2 LYS 25 HE2 LYS 25 1.919 -12.749 2.606 54 HE3 LYS 25 HE1 LYS 25 3.528 -12.057 2.801 55 HZ1 LYS 25 HZ1 LYS 25 3.026 -14.333 3.832 56 HZ2 LYS 25 HZ2 LYS 25 2.231 -13.464 5.043 57 HZ3 LYS 25 HZ3 LYS 25 3.882 -13.203 4.756 58 H VAL 26 HN VAL 26 -0.749 -6.916 0.928 59 HA VAL 26 HA VAL 26 -2.251 -5.205 2.761 60 HB VAL 26 HB VAL 26 -2.920 -5.579 -0.141 61 HG11 VAL 26 HG11 VAL 26 -3.688 -3.258 0.066 62 HG12 VAL 26 HG12 VAL 26 -3.200 -3.257 1.761 63 HG13 VAL 26 HG13 VAL 26 -4.489 -4.328 1.215 64 HG21 VAL 26 HG21 VAL 26 -0.776 -3.762 0.960 65 HG22 VAL 26 HG22 VAL 26 -1.400 -3.718 -0.690 66 HG23 VAL 26 HG23 VAL 26 -0.532 -5.142 -0.113 67 H ILE 27 HN ILE 27 -3.953 -5.947 3.787 68 HA ILE 27 HA ILE 27 -5.245 -8.402 2.865 69 HB ILE 27 HB ILE 27 -5.597 -6.890 5.457 70 HG12 ILE 27 HG12 ILE 27 -3.348 -7.887 5.193 71 HG13 ILE 27 HG11 ILE 27 -4.268 -8.661 6.476 72 HG21 ILE 27 HG21 ILE 27 -6.764 -8.897 6.243 73 HG22 ILE 27 HG22 ILE 27 -6.606 -9.612 4.641 74 HG23 ILE 27 HG23 ILE 27 -7.589 -8.167 4.865 75 HD11 ILE 27 HD11 ILE 27 -4.810 -10.502 4.915 76 HD12 ILE 27 HD12 ILE 27 -3.083 -10.328 5.231 77 HD13 ILE 27 HD13 ILE 27 -3.765 -9.741 3.715 78 H GLY 28 HN GLY 28 -6.896 -8.161 1.532 79 HA2 GLY 28 HA2 GLY 28 -8.473 -5.723 1.530 80 HA3 GLY 28 HA1 GLY 28 -8.597 -7.052 0.384 81 H GLN 29 HN GLN 29 -10.893 -5.999 1.249 82 HA GLN 29 HA GLN 29 -11.979 -7.073 3.618 83 HB2 GLN 29 HB2 GLN 29 -12.861 -5.180 2.079 84 HB3 GLN 29 HB1 GLN 29 -13.634 -6.477 1.179 85 HG2 GLN 29 HG2 GLN 29 -15.298 -5.780 2.618 86 HG3 GLN 29 HG1 GLN 29 -14.618 -7.172 3.458 87 HE21 GLN 29 HE21 GLN 29 -13.491 -6.862 5.351 88 HE22 GLN 29 HE22 GLN 29 -13.477 -5.358 6.199 89 H ASP 30 HN ASP 30 -11.356 -8.467 0.547 90 HA ASP 30 HA ASP 30 -13.207 -10.682 0.956 91 HB2 ASP 30 HB2 ASP 30 -12.595 -11.392 -1.266 92 HB3 ASP 30 HB1 ASP 30 -12.891 -9.657 -1.309 93 H SER 31 HN SER 31 -10.518 -9.988 2.407 94 HA SER 31 HA SER 31 -8.917 -11.138 3.510 95 HB2 SER 31 HB2 SER 31 -10.292 -13.642 2.514 96 HB3 SER 31 HB1 SER 31 -9.180 -13.522 3.878 97 HG SER 31 HG SER 31 -11.831 -12.605 3.646 98 H SER 32 HN SER 32 -8.131 -10.131 1.189 99 HA SER 32 HA SER 32 -6.765 -12.190 -0.350 100 HB2 SER 32 HB2 SER 32 -5.971 -9.818 -1.438 101 HB3 SER 32 HB1 SER 32 -7.430 -10.686 -1.920 102 HG SER 32 HG SER 32 -8.648 -9.244 -0.940 103 H GLU 33 HN GLU 33 -4.424 -11.718 -0.929 104 HA GLU 33 HA GLU 33 -2.948 -10.549 1.333 105 HB2 GLU 33 HB2 GLU 33 -3.126 -13.107 1.421 106 HB3 GLU 33 HB1 GLU 33 -2.125 -13.125 -0.022 107 HG2 GLU 33 HG2 GLU 33 -0.469 -11.734 1.361 108 HG3 GLU 33 HG1 GLU 33 -1.414 -12.258 2.754 109 H ILE 34 HN ILE 34 -3.067 -8.854 -0.473 110 HA ILE 34 HA ILE 34 -1.572 -9.249 -2.859 111 HB ILE 34 HB ILE 34 -2.126 -6.583 -1.578 112 HG12 ILE 34 HG12 ILE 34 -4.221 -7.854 -1.637 113 HG13 ILE 34 HG11 ILE 34 -4.255 -6.549 -2.815 114 HG21 ILE 34 HG21 ILE 34 -0.626 -6.484 -3.453 115 HG22 ILE 34 HG22 ILE 34 -2.188 -5.815 -3.923 116 HG23 ILE 34 HG23 ILE 34 -1.736 -7.439 -4.437 117 HD11 ILE 34 HD11 ILE 34 -5.226 -8.553 -3.741 118 HD12 ILE 34 HD12 ILE 34 -3.754 -9.459 -3.390 119 HD13 ILE 34 HD13 ILE 34 -3.729 -8.164 -4.587 120 H HIS 35 HN HIS 35 0.531 -8.912 -3.322 121 HA HIS 35 HA HIS 35 2.316 -8.283 -1.072 122 HB2 HIS 35 HB2 HIS 35 2.690 -9.882 -3.595 123 HB3 HIS 35 HB1 HIS 35 4.064 -9.317 -2.655 124 HD2 HIS 35 HD2 HIS 35 1.305 -10.369 -0.307 125 HE1 HIS 35 HE1 HIS 35 3.824 -13.726 -0.832 126 HE2 HIS 35 HE2 HIS 35 1.765 -12.836 0.355 127 H PHE 36 HN PHE 36 2.653 -6.128 -1.104 128 HA PHE 36 HA PHE 36 3.126 -4.813 -3.673 129 HB2 PHE 36 HB2 PHE 36 1.683 -3.986 -1.543 130 HB3 PHE 36 HB1 PHE 36 3.232 -3.242 -1.162 131 HD1 PHE 36 HD1 PHE 36 3.736 -3.096 -4.377 132 HD2 PHE 36 HD2 PHE 36 0.805 -1.658 -1.646 133 HE1 PHE 36 HE1 PHE 36 3.211 -1.254 -5.915 134 HE2 PHE 36 HE2 PHE 36 0.282 0.187 -3.184 135 HZ PHE 36 HZ PHE 36 1.480 0.393 -5.320 136 H LYS 37 HN LYS 37 5.160 -4.748 -4.404 137 HA LYS 37 HA LYS 37 7.370 -4.926 -2.495 138 HB2 LYS 37 HB2 LYS 37 7.406 -6.320 -4.549 139 HB3 LYS 37 HB1 LYS 37 7.440 -4.856 -5.524 140 HG2 LYS 37 HG2 LYS 37 9.593 -4.247 -4.531 141 HG3 LYS 37 HG1 LYS 37 9.558 -5.719 -3.562 142 HD2 LYS 37 HD2 LYS 37 9.433 -5.738 -6.570 143 HD3 LYS 37 HD1 LYS 37 10.949 -5.806 -5.673 144 HE2 LYS 37 HE2 LYS 37 9.996 -7.818 -4.473 145 HE3 LYS 37 HE1 LYS 37 8.696 -7.805 -5.664 146 HZ1 LYS 37 HZ1 LYS 37 10.295 -8.129 -7.413 147 HZ2 LYS 37 HZ2 LYS 37 10.517 -9.325 -6.245 148 HZ3 LYS 37 HZ3 LYS 37 11.585 -8.017 -6.324 149 H VAL 38 HN VAL 38 7.772 -3.030 -1.527 150 HA VAL 38 HA VAL 38 7.898 -0.615 -3.211 151 HB VAL 38 HB VAL 38 7.445 0.730 -1.301 152 HG11 VAL 38 HG11 VAL 38 5.496 -0.376 -2.292 153 HG12 VAL 38 HG12 VAL 38 5.273 -0.075 -0.568 154 HG13 VAL 38 HG13 VAL 38 5.665 -1.698 -1.137 155 HG21 VAL 38 HG21 VAL 38 7.695 -1.764 0.380 156 HG22 VAL 38 HG22 VAL 38 7.219 -0.171 0.969 157 HG23 VAL 38 HG23 VAL 38 8.842 -0.425 0.327 158 H LYS 39 HN LYS 39 9.552 0.984 -2.636 159 HA LYS 39 HA LYS 39 12.048 -0.347 -1.833 160 HB2 LYS 39 HB2 LYS 39 11.863 0.583 -4.180 161 HB3 LYS 39 HB1 LYS 39 11.774 2.183 -3.458 162 HG2 LYS 39 HG2 LYS 39 13.974 1.883 -2.468 163 HG3 LYS 39 HG1 LYS 39 14.065 0.257 -3.146 164 HD2 LYS 39 HD2 LYS 39 14.060 1.119 -5.381 165 HD3 LYS 39 HD1 LYS 39 13.741 2.753 -4.801 166 HE2 LYS 39 HE2 LYS 39 15.921 2.672 -3.595 167 HE3 LYS 39 HE1 LYS 39 16.241 1.127 -4.380 168 HZ1 LYS 39 HZ1 LYS 39 17.249 3.075 -5.508 169 HZ2 LYS 39 HZ2 LYS 39 15.689 3.647 -5.854 170 HZ3 LYS 39 HZ3 LYS 39 16.218 2.172 -6.499 171 H MET 40 HN MET 40 13.329 0.543 -0.267 172 HA MET 40 HA MET 40 12.040 2.409 1.517 173 HB2 MET 40 HB2 MET 40 13.229 0.455 2.410 174 HB3 MET 40 HB1 MET 40 14.730 1.036 1.701 175 HG2 MET 40 HG2 MET 40 14.687 1.503 4.061 176 HG3 MET 40 HG1 MET 40 14.644 3.006 3.143 177 HE1 MET 40 HE1 MET 40 12.799 0.535 5.431 178 HE2 MET 40 HE2 MET 40 11.739 0.409 4.028 179 HE3 MET 40 HE3 MET 40 11.154 1.167 5.510 180 H THR 41 HN THR 41 12.030 4.213 0.065 181 HA THR 41 HA THR 41 13.803 6.212 0.644 182 HB THR 41 HB THR 41 15.513 4.858 -0.606 183 HG1 THR 41 HG1 THR 41 14.766 7.477 -1.314 184 HG21 THR 41 HG21 THR 41 13.822 5.572 -3.005 185 HG22 THR 41 HG22 THR 41 14.059 3.949 -2.355 186 HG23 THR 41 HG23 THR 41 15.422 4.826 -3.050 187 H THR 42 HN THR 42 11.493 4.785 -1.429 188 HA THR 42 HA THR 42 10.836 7.287 -2.762 189 HB THR 42 HB THR 42 9.204 4.814 -3.108 190 HG1 THR 42 HG1 THR 42 11.733 5.128 -4.399 191 HG21 THR 42 HG21 THR 42 8.670 6.832 -4.382 192 HG22 THR 42 HG22 THR 42 9.219 5.540 -5.450 193 HG23 THR 42 HG23 THR 42 10.310 6.862 -5.034 194 H HIS 43 HN HIS 43 8.815 8.308 -2.551 195 HA HIS 43 HA HIS 43 7.622 8.152 0.039 196 HB2 HIS 43 HB2 HIS 43 6.634 9.615 -2.423 197 HB3 HIS 43 HB1 HIS 43 6.083 9.879 -0.775 198 HD2 HIS 43 HD2 HIS 43 8.311 10.811 0.946 199 HE1 HIS 43 HE1 HIS 43 10.027 12.814 -2.360 200 HE2 HIS 43 HE2 HIS 43 9.844 12.749 0.166 201 H LEU 44 HN LEU 44 5.508 7.501 0.580 202 HA LEU 44 HA LEU 44 4.577 5.229 -0.883 203 HB2 LEU 44 HB2 LEU 44 3.428 6.684 1.492 204 HB3 LEU 44 HB1 LEU 44 2.754 5.208 0.828 205 HG LEU 44 HG LEU 44 5.514 5.503 2.023 206 HD11 LEU 44 HD11 LEU 44 3.064 4.087 3.050 207 HD12 LEU 44 HD12 LEU 44 3.732 5.591 3.684 208 HD13 LEU 44 HD13 LEU 44 4.657 4.094 3.806 209 HD21 LEU 44 HD21 LEU 44 5.533 3.014 1.852 210 HD22 LEU 44 HD22 LEU 44 5.602 3.849 0.301 211 HD23 LEU 44 HD23 LEU 44 4.090 3.124 0.846 212 H LYS 45 HN LYS 45 4.172 8.449 -1.423 213 HA LYS 45 HA LYS 45 1.476 8.767 -2.042 214 HB2 LYS 45 HB2 LYS 45 2.735 10.743 -2.088 215 HB3 LYS 45 HB1 LYS 45 3.988 10.035 -3.097 216 HG2 LYS 45 HG2 LYS 45 2.760 10.281 -5.036 217 HG3 LYS 45 HG1 LYS 45 1.226 10.373 -4.171 218 HD2 LYS 45 HD2 LYS 45 2.066 12.571 -3.216 219 HD3 LYS 45 HD1 LYS 45 3.354 12.485 -4.420 220 HE2 LYS 45 HE2 LYS 45 1.245 13.814 -5.020 221 HE3 LYS 45 HE1 LYS 45 1.854 12.659 -6.208 222 HZ1 LYS 45 HZ1 LYS 45 0.159 11.157 -5.731 223 HZ2 LYS 45 HZ2 LYS 45 -0.631 12.655 -5.700 224 HZ3 LYS 45 HZ3 LYS 45 -0.218 11.889 -4.242 225 H LYS 46 HN LYS 46 4.163 7.818 -4.174 226 HA LYS 46 HA LYS 46 2.551 7.364 -6.436 227 HB2 LYS 46 HB2 LYS 46 5.127 7.641 -6.271 228 HB3 LYS 46 HB1 LYS 46 5.136 5.908 -5.972 229 HG2 LYS 46 HG2 LYS 46 5.528 6.262 -8.298 230 HG3 LYS 46 HG1 LYS 46 3.900 5.600 -8.116 231 HD2 LYS 46 HD2 LYS 46 3.171 8.096 -8.091 232 HD3 LYS 46 HD1 LYS 46 4.749 8.384 -8.823 233 HE2 LYS 46 HE2 LYS 46 4.225 7.084 -10.711 234 HE3 LYS 46 HE1 LYS 46 2.822 6.362 -9.923 235 HZ1 LYS 46 HZ1 LYS 46 3.102 9.179 -10.812 236 HZ2 LYS 46 HZ2 LYS 46 1.783 8.588 -9.923 237 HZ3 LYS 46 HZ3 LYS 46 2.090 7.999 -11.482 238 H LEU 47 HN LEU 47 3.463 5.370 -3.728 239 HA LEU 47 HA LEU 47 2.690 2.875 -4.803 240 HB2 LEU 47 HB2 LEU 47 3.052 3.923 -2.012 241 HB3 LEU 47 HB1 LEU 47 2.385 2.323 -2.276 242 HG LEU 47 HG LEU 47 4.678 1.985 -1.873 243 HD11 LEU 47 HD11 LEU 47 5.492 0.988 -3.866 244 HD12 LEU 47 HD12 LEU 47 4.491 2.033 -4.870 245 HD13 LEU 47 HD13 LEU 47 3.738 0.799 -3.858 246 HD21 LEU 47 HD21 LEU 47 5.099 4.351 -3.654 247 HD22 LEU 47 HD22 LEU 47 6.390 3.186 -3.370 248 HD23 LEU 47 HD23 LEU 47 5.687 4.070 -2.016 249 H LYS 48 HN LYS 48 0.959 5.371 -3.012 250 HA LYS 48 HA LYS 48 -1.456 4.021 -2.599 251 HB2 LYS 48 HB2 LYS 48 -0.782 6.939 -2.925 252 HB3 LYS 48 HB1 LYS 48 -2.439 6.412 -2.680 253 HG2 LYS 48 HG2 LYS 48 -1.792 5.381 -0.556 254 HG3 LYS 48 HG1 LYS 48 -0.134 5.931 -0.805 255 HD2 LYS 48 HD2 LYS 48 -1.228 7.473 0.678 256 HD3 LYS 48 HD1 LYS 48 -0.983 8.272 -0.876 257 HE2 LYS 48 HE2 LYS 48 -3.333 7.694 -1.469 258 HE3 LYS 48 HE1 LYS 48 -3.546 7.066 0.162 259 HZ1 LYS 48 HZ1 LYS 48 -3.238 9.215 1.071 260 HZ2 LYS 48 HZ2 LYS 48 -4.326 9.402 -0.216 261 HZ3 LYS 48 HZ3 LYS 48 -2.702 9.855 -0.407 262 H GLU 49 HN GLU 49 -0.482 6.157 -5.275 263 HA GLU 49 HA GLU 49 -2.921 5.815 -6.695 264 HB2 GLU 49 HB2 GLU 49 -1.146 6.610 -8.626 265 HB3 GLU 49 HB1 GLU 49 -2.072 7.681 -7.589 266 HG2 GLU 49 HG2 GLU 49 -0.116 7.591 -5.984 267 HG3 GLU 49 HG1 GLU 49 0.785 6.819 -7.290 268 H SER 50 HN SER 50 0.202 4.174 -6.815 269 HA SER 50 HA SER 50 -0.239 2.738 -9.193 270 HB2 SER 50 HB2 SER 50 1.415 1.962 -6.781 271 HB3 SER 50 HB1 SER 50 1.504 1.191 -8.364 272 HG SER 50 HG SER 50 2.195 3.850 -7.660 273 H TYR 51 HN TYR 51 -1.043 2.003 -5.822 274 HA TYR 51 HA TYR 51 -2.044 -0.598 -6.300 275 HB2 TYR 51 HB2 TYR 51 -1.446 0.455 -4.048 276 HB3 TYR 51 HB1 TYR 51 -3.014 1.247 -4.120 277 HD1 TYR 51 HD1 TYR 51 -1.290 -1.980 -3.782 278 HD2 TYR 51 HD2 TYR 51 -5.053 0.001 -3.767 279 HE1 TYR 51 HE1 TYR 51 -2.334 -3.983 -2.814 280 HE2 TYR 51 HE2 TYR 51 -6.107 -1.998 -2.799 281 HH TYR 51 HH TYR 51 -5.625 -4.490 -2.741 282 H CYS 52 HN CYS 52 -3.501 2.603 -6.368 283 HA CYS 52 HA CYS 52 -6.182 1.828 -6.634 284 HB2 CYS 52 HB2 CYS 52 -4.794 4.284 -7.736 285 HB3 CYS 52 HB1 CYS 52 -6.537 4.078 -7.605 286 HG CYS 52 HG CYS 52 -4.356 4.213 -4.968 287 H GLN 53 HN GLN 53 -3.651 2.388 -9.035 288 HA GLN 53 HA GLN 53 -5.263 1.958 -11.325 289 HB2 GLN 53 HB2 GLN 53 -2.280 1.554 -10.998 290 HB3 GLN 53 HB1 GLN 53 -3.135 1.703 -12.526 291 HG2 GLN 53 HG2 GLN 53 -3.599 3.976 -12.164 292 HG3 GLN 53 HG1 GLN 53 -3.169 3.871 -10.456 293 HE21 GLN 53 HE21 GLN 53 -2.145 5.684 -12.471 294 HE22 GLN 53 HE22 GLN 53 -0.433 5.430 -12.526 295 H ARG 54 HN ARG 54 -3.231 -0.148 -9.347 296 HA ARG 54 HA ARG 54 -3.392 -2.468 -10.903 297 HB2 ARG 54 HB2 ARG 54 -1.843 -2.093 -8.976 298 HB3 ARG 54 HB1 ARG 54 -3.204 -2.317 -7.890 299 HG2 ARG 54 HG2 ARG 54 -1.907 -4.338 -8.007 300 HG3 ARG 54 HG1 ARG 54 -3.486 -4.607 -8.750 301 HD2 ARG 54 HD2 ARG 54 -2.549 -4.425 -10.947 302 HD3 ARG 54 HD1 ARG 54 -0.991 -3.923 -10.294 303 HE ARG 54 HE ARG 54 -1.665 -6.462 -9.250 304 HH11 ARG 54 HH11 ARG 54 -0.702 -4.895 -12.260 305 HH12 ARG 54 HH12 ARG 54 0.091 -6.378 -12.911 306 HH21 ARG 54 HH21 ARG 54 -0.682 -8.361 -10.033 307 HH22 ARG 54 HH22 ARG 54 0.110 -8.317 -11.663 308 H GLN 55 HN GLN 55 -5.539 -1.261 -8.350 309 HA GLN 55 HA GLN 55 -7.239 -3.593 -8.551 310 HB2 GLN 55 HB2 GLN 55 -7.453 -1.045 -6.955 311 HB3 GLN 55 HB1 GLN 55 -8.690 -2.294 -6.933 312 HG2 GLN 55 HG2 GLN 55 -5.901 -2.379 -5.863 313 HG3 GLN 55 HG1 GLN 55 -7.421 -2.762 -5.059 314 HE21 GLN 55 HE21 GLN 55 -8.457 -4.742 -5.563 315 HE22 GLN 55 HE22 GLN 55 -7.559 -6.083 -6.182 316 H GLY 56 HN GLY 56 -7.115 -0.414 -9.927 317 HA2 GLY 56 HA2 GLY 56 -8.310 0.192 -11.871 318 HA3 GLY 56 HA1 GLY 56 -9.472 -1.081 -11.527 319 H VAL 57 HN VAL 57 -8.302 1.479 -9.396 320 HA VAL 57 HA VAL 57 -10.991 2.678 -9.399 321 HB VAL 57 HB VAL 57 -10.571 3.128 -6.898 322 HG11 VAL 57 HG11 VAL 57 -11.529 0.961 -6.249 323 HG12 VAL 57 HG12 VAL 57 -11.130 0.321 -7.843 324 HG13 VAL 57 HG13 VAL 57 -12.305 1.627 -7.685 325 HG21 VAL 57 HG21 VAL 57 -8.651 0.843 -7.324 326 HG22 VAL 57 HG22 VAL 57 -9.207 1.425 -5.753 327 HG23 VAL 57 HG23 VAL 57 -8.245 2.476 -6.794 328 HA PRO 58 HA PRO 58 -8.863 6.518 -9.862 329 HB2 PRO 58 HB2 PRO 58 -10.395 8.199 -8.336 330 HB3 PRO 58 HB1 PRO 58 -10.858 7.637 -9.947 331 HG2 PRO 58 HG2 PRO 58 -11.761 6.660 -7.287 332 HG3 PRO 58 HG1 PRO 58 -12.686 6.868 -8.785 333 HD2 PRO 58 HD2 PRO 58 -11.826 4.454 -7.941 334 HD3 PRO 58 HD1 PRO 58 -11.990 4.868 -9.657 335 H MET 59 HN MET 59 -7.750 8.266 -8.649 336 HA MET 59 HA MET 59 -6.196 7.206 -6.542 337 HB2 MET 59 HB2 MET 59 -5.856 9.220 -8.312 338 HB3 MET 59 HB1 MET 59 -6.270 10.145 -6.875 339 HG2 MET 59 HG2 MET 59 -4.056 8.113 -7.022 340 HG3 MET 59 HG1 MET 59 -3.842 9.851 -7.216 341 HE1 MET 59 HE1 MET 59 -2.069 8.407 -5.146 342 HE2 MET 59 HE2 MET 59 -2.253 9.428 -3.719 343 HE3 MET 59 HE3 MET 59 -2.109 10.162 -5.316 344 H ASN 60 HN ASN 60 -6.284 7.406 -4.415 345 HA ASN 60 HA ASN 60 -6.961 7.862 -2.318 346 HB2 ASN 60 HB2 ASN 60 -7.481 10.334 -3.745 347 HB3 ASN 60 HB1 ASN 60 -8.600 10.106 -2.404 348 HD21 ASN 60 HD21 ASN 60 -6.595 12.103 -2.609 349 HD22 ASN 60 HD22 ASN 60 -5.490 11.859 -1.302 350 H SER 61 HN SER 61 -8.702 6.318 -4.229 351 HA SER 61 HA SER 61 -11.368 6.802 -3.216 352 HB2 SER 61 HB2 SER 61 -11.898 4.702 -4.528 353 HB3 SER 61 HB1 SER 61 -11.227 6.027 -5.479 354 HG SER 61 HG SER 61 -9.422 4.937 -5.788 355 H LEU 62 HN LEU 62 -8.657 4.759 -2.581 356 HA LEU 62 HA LEU 62 -10.169 3.365 -0.480 357 HB2 LEU 62 HB2 LEU 62 -7.637 2.409 -1.816 358 HB3 LEU 62 HB1 LEU 62 -8.652 1.509 -0.707 359 HG LEU 62 HG LEU 62 -9.489 2.385 -3.474 360 HD11 LEU 62 HD11 LEU 62 -9.284 -0.012 -4.032 361 HD12 LEU 62 HD12 LEU 62 -8.546 -0.291 -2.455 362 HD13 LEU 62 HD13 LEU 62 -7.737 0.739 -3.636 363 HD21 LEU 62 HD21 LEU 62 -11.402 2.172 -2.068 364 HD22 LEU 62 HD22 LEU 62 -10.810 0.655 -1.392 365 HD23 LEU 62 HD23 LEU 62 -11.319 0.730 -3.080 366 H ARG 63 HN ARG 63 -9.382 3.368 1.564 367 HA ARG 63 HA ARG 63 -7.083 5.118 2.051 368 HB2 ARG 63 HB2 ARG 63 -7.933 5.260 4.376 369 HB3 ARG 63 HB1 ARG 63 -9.096 5.832 3.191 370 HG2 ARG 63 HG2 ARG 63 -10.372 3.802 3.383 371 HG3 ARG 63 HG1 ARG 63 -9.150 3.096 4.444 372 HD2 ARG 63 HD2 ARG 63 -9.599 4.783 6.131 373 HD3 ARG 63 HD1 ARG 63 -10.758 5.572 5.065 374 HE ARG 63 HE ARG 63 -11.116 2.978 6.402 375 HH11 ARG 63 HH11 ARG 63 -14.126 5.177 4.819 376 HH12 ARG 63 HH12 ARG 63 -12.418 5.716 4.584 377 HH21 ARG 63 HH21 ARG 63 -13.270 2.290 6.703 378 HH22 ARG 63 HH22 ARG 63 -14.604 3.276 5.998 379 H PHE 64 HN PHE 64 -5.236 4.287 2.732 380 HA PHE 64 HA PHE 64 -5.097 1.444 3.339 381 HB2 PHE 64 HB2 PHE 64 -2.879 3.469 2.956 382 HB3 PHE 64 HB1 PHE 64 -2.673 1.727 3.100 383 HD1 PHE 64 HD1 PHE 64 -3.583 4.468 0.908 384 HD2 PHE 64 HD2 PHE 64 -3.422 0.235 1.302 385 HE1 PHE 64 HE1 PHE 64 -3.856 4.236 -1.526 386 HE2 PHE 64 HE2 PHE 64 -3.689 -0.004 -1.129 387 HZ PHE 64 HZ PHE 64 -3.911 2.000 -2.546 388 H LEU 65 HN LEU 65 -5.225 0.802 5.374 389 HA LEU 65 HA LEU 65 -4.512 2.709 7.487 390 HB2 LEU 65 HB2 LEU 65 -6.166 0.192 7.673 391 HB3 LEU 65 HB1 LEU 65 -5.869 1.322 8.978 392 HG LEU 65 HG LEU 65 -7.435 1.891 6.460 393 HD11 LEU 65 HD11 LEU 65 -9.351 2.021 7.936 394 HD12 LEU 65 HD12 LEU 65 -8.330 1.662 9.330 395 HD13 LEU 65 HD13 LEU 65 -8.580 0.441 8.083 396 HD21 LEU 65 HD21 LEU 65 -6.782 3.649 8.821 397 HD22 LEU 65 HD22 LEU 65 -7.981 4.030 7.586 398 HD23 LEU 65 HD23 LEU 65 -6.279 3.890 7.148 399 H PHE 66 HN PHE 66 -2.669 2.470 8.445 400 HA PHE 66 HA PHE 66 -1.522 -0.227 8.746 401 HB2 PHE 66 HB2 PHE 66 -0.289 1.154 7.062 402 HB3 PHE 66 HB1 PHE 66 0.009 2.355 8.314 403 HD1 PHE 66 HD1 PHE 66 0.672 -1.149 7.339 404 HD2 PHE 66 HD2 PHE 66 1.802 2.135 9.795 405 HE1 PHE 66 HE1 PHE 66 2.720 -2.348 7.994 406 HE2 PHE 66 HE2 PHE 66 3.851 0.946 10.456 407 HZ PHE 66 HZ PHE 66 4.314 -1.300 9.553 408 H GLU 67 HN GLU 67 -1.673 -0.737 10.824 409 HA GLU 67 HA GLU 67 -1.563 -0.661 13.080 410 HB2 GLU 67 HB2 GLU 67 0.420 1.376 12.248 411 HB3 GLU 67 HB1 GLU 67 -0.118 1.449 13.921 412 HG2 GLU 67 HG2 GLU 67 1.092 -0.939 12.548 413 HG3 GLU 67 HG1 GLU 67 1.892 0.115 13.715 414 H GLY 68 HN GLY 68 -3.729 0.638 11.708 415 HA2 GLY 68 HA2 GLY 68 -5.675 1.573 12.612 416 HA3 GLY 68 HA1 GLY 68 -4.729 2.207 13.948 417 H GLN 69 HN GLN 69 -2.826 3.248 11.705 418 HA GLN 69 HA GLN 69 -4.279 5.777 11.398 419 HB2 GLN 69 HB2 GLN 69 -1.390 5.396 10.691 420 HB3 GLN 69 HB1 GLN 69 -2.218 6.854 11.224 421 HG2 GLN 69 HG2 GLN 69 -2.484 5.766 13.464 422 HG3 GLN 69 HG1 GLN 69 -1.423 4.482 12.887 423 HE21 GLN 69 HE21 GLN 69 -0.968 6.236 15.088 424 HE22 GLN 69 HE22 GLN 69 0.472 7.128 14.736 425 H ARG 70 HN ARG 70 -4.004 6.964 9.327 426 HA ARG 70 HA ARG 70 -4.156 5.056 7.098 427 HB2 ARG 70 HB2 ARG 70 -5.030 7.658 6.306 428 HB3 ARG 70 HB1 ARG 70 -5.953 6.168 6.390 429 HG2 ARG 70 HG2 ARG 70 -6.217 6.694 8.884 430 HG3 ARG 70 HG1 ARG 70 -5.675 8.317 8.458 431 HD2 ARG 70 HD2 ARG 70 -8.113 6.856 7.463 432 HD3 ARG 70 HD1 ARG 70 -8.054 8.341 8.409 433 HE ARG 70 HE ARG 70 -6.772 9.109 6.208 434 HH11 ARG 70 HH11 ARG 70 -9.776 7.329 6.640 435 HH12 ARG 70 HH12 ARG 70 -10.457 7.847 5.045 436 HH21 ARG 70 HH21 ARG 70 -7.623 9.837 4.196 437 HH22 ARG 70 HH22 ARG 70 -9.262 9.253 3.687 438 H ILE 71 HN ILE 71 -2.716 5.089 5.537 439 HA ILE 71 HA ILE 71 -0.297 6.469 5.757 440 HB ILE 71 HB ILE 71 -1.501 5.117 3.341 441 HG12 ILE 71 HG12 ILE 71 -1.232 3.616 5.252 442 HG13 ILE 71 HG11 ILE 71 -0.071 3.220 3.991 443 HG21 ILE 71 HG21 ILE 71 0.745 5.003 2.439 444 HG22 ILE 71 HG22 ILE 71 1.371 5.876 3.838 445 HG23 ILE 71 HG23 ILE 71 0.277 6.682 2.713 446 HD11 ILE 71 HD11 ILE 71 1.642 4.492 5.265 447 HD12 ILE 71 HD12 ILE 71 1.016 3.074 6.108 448 HD13 ILE 71 HD13 ILE 71 0.461 4.686 6.560 449 H ALA 72 HN ALA 72 0.340 8.421 5.207 450 HA ALA 72 HA ALA 72 -1.452 10.164 3.714 451 HB1 ALA 72 HB1 ALA 72 0.081 11.960 4.386 452 HB2 ALA 72 HB2 ALA 72 1.145 10.767 5.131 453 HB3 ALA 72 HB3 ALA 72 -0.475 11.028 5.776 454 H ASP 73 HN ASP 73 -0.471 11.610 2.035 455 HA ASP 73 HA ASP 73 0.764 10.024 0.031 456 HB2 ASP 73 HB2 ASP 73 -0.312 12.745 0.244 457 HB3 ASP 73 HB1 ASP 73 1.040 12.601 -0.875 458 H ASN 74 HN ASN 74 1.998 12.363 2.338 459 HA ASN 74 HA ASN 74 4.613 12.366 1.059 460 HB2 ASN 74 HB2 ASN 74 5.205 14.138 2.497 461 HB3 ASN 74 HB1 ASN 74 3.520 14.436 2.090 462 HD21 ASN 74 HD21 ASN 74 5.773 13.840 4.585 463 HD22 ASN 74 HD22 ASN 74 4.659 13.857 5.908 464 H HIS 75 HN HIS 75 3.126 10.198 2.905 465 HA HIS 75 HA HIS 75 5.022 9.767 4.993 466 HB2 HIS 75 HB2 HIS 75 2.630 8.367 3.954 467 HB3 HIS 75 HB1 HIS 75 3.813 7.368 4.790 468 HD2 HIS 75 HD2 HIS 75 4.162 10.402 6.721 469 HE1 HIS 75 HE1 HIS 75 0.698 8.589 8.339 470 HE2 HIS 75 HE2 HIS 75 2.575 10.242 8.764 471 H THR 76 HN THR 76 6.645 8.307 5.152 472 HA THR 76 HA THR 76 7.488 6.978 2.656 473 HB THR 76 HB THR 76 9.823 7.170 3.551 474 HG1 THR 76 HG1 THR 76 8.530 8.825 5.496 475 HG21 THR 76 HG21 THR 76 9.056 8.770 1.892 476 HG22 THR 76 HG22 THR 76 10.096 9.577 3.066 477 HG23 THR 76 HG23 THR 76 8.346 9.776 3.155 478 HA PRO 77 HA PRO 77 7.395 3.173 4.936 479 HB2 PRO 77 HB2 PRO 77 9.893 2.247 3.725 480 HB3 PRO 77 HB1 PRO 77 8.245 1.667 3.462 481 HG2 PRO 77 HG2 PRO 77 9.607 3.006 1.568 482 HG3 PRO 77 HG1 PRO 77 7.843 3.113 1.742 483 HD2 PRO 77 HD2 PRO 77 9.946 5.049 2.626 484 HD3 PRO 77 HD1 PRO 77 8.363 5.360 1.879 485 H LYS 78 HN LYS 78 9.972 5.335 5.215 486 HA LYS 78 HA LYS 78 11.570 3.835 7.068 487 HB2 LYS 78 HB2 LYS 78 12.656 5.474 5.675 488 HB3 LYS 78 HB1 LYS 78 11.590 6.744 6.254 489 HG2 LYS 78 HG2 LYS 78 13.805 6.917 7.250 490 HG3 LYS 78 HG1 LYS 78 12.578 6.590 8.474 491 HD2 LYS 78 HD2 LYS 78 14.566 5.252 8.886 492 HD3 LYS 78 HD1 LYS 78 13.207 4.214 8.451 493 HE2 LYS 78 HE2 LYS 78 14.051 3.877 6.263 494 HE3 LYS 78 HE1 LYS 78 15.252 5.155 6.456 495 HZ1 LYS 78 HZ1 LYS 78 16.312 3.040 6.679 496 HZ2 LYS 78 HZ2 LYS 78 15.204 2.534 7.853 497 HZ3 LYS 78 HZ3 LYS 78 16.293 3.777 8.201 498 H GLU 79 HN GLU 79 9.136 6.394 7.289 499 HA GLU 79 HA GLU 79 9.404 6.550 10.160 500 HB2 GLU 79 HB2 GLU 79 7.542 8.145 10.036 501 HB3 GLU 79 HB1 GLU 79 8.834 8.567 8.926 502 HG2 GLU 79 HG2 GLU 79 7.437 7.298 7.174 503 HG3 GLU 79 HG1 GLU 79 6.117 7.481 8.329 504 H LEU 80 HN LEU 80 7.377 6.340 11.503 505 HA LEU 80 HA LEU 80 5.648 5.147 12.351 506 HB2 LEU 80 HB2 LEU 80 5.283 4.741 9.472 507 HB3 LEU 80 HB1 LEU 80 4.630 3.449 10.463 508 HG LEU 80 HG LEU 80 3.951 6.338 10.968 509 HD11 LEU 80 HD11 LEU 80 1.880 5.932 9.699 510 HD12 LEU 80 HD12 LEU 80 2.526 4.374 9.180 511 HD13 LEU 80 HD13 LEU 80 3.320 5.869 8.681 512 HD21 LEU 80 HD21 LEU 80 2.548 3.760 11.663 513 HD22 LEU 80 HD22 LEU 80 2.026 5.385 12.103 514 HD23 LEU 80 HD23 LEU 80 3.518 4.728 12.773 515 H GLY 81 HN GLY 81 7.440 3.116 10.031 516 HA2 GLY 81 HA2 GLY 81 9.023 1.499 11.027 517 HA3 GLY 81 HA1 GLY 81 7.779 1.157 12.223 518 H MET 82 HN MET 82 8.567 0.930 8.795 519 HA MET 82 HA MET 82 6.617 -1.268 8.574 520 HB2 MET 82 HB2 MET 82 7.665 0.431 6.304 521 HB3 MET 82 HB1 MET 82 6.339 -0.725 6.249 522 HG2 MET 82 HG2 MET 82 4.995 0.674 7.667 523 HG3 MET 82 HG1 MET 82 6.336 1.795 7.889 524 HE1 MET 82 HE1 MET 82 3.745 3.039 7.220 525 HE2 MET 82 HE2 MET 82 4.019 4.027 5.786 526 HE3 MET 82 HE3 MET 82 5.215 4.007 7.082 527 H GLU 83 HN GLU 83 7.461 -3.227 8.310 528 HA GLU 83 HA GLU 83 10.148 -3.429 7.113 529 HB2 GLU 83 HB2 GLU 83 9.309 -4.183 9.737 530 HB3 GLU 83 HB1 GLU 83 9.685 -5.647 8.839 531 HG2 GLU 83 HG2 GLU 83 11.529 -3.285 9.127 532 HG3 GLU 83 HG1 GLU 83 11.605 -4.753 10.100 533 H GLU 84 HN GLU 84 10.492 -6.000 6.758 534 HA GLU 84 HA GLU 84 8.766 -6.659 4.602 535 HB2 GLU 84 HB2 GLU 84 10.989 -7.388 4.390 536 HB3 GLU 84 HB1 GLU 84 11.026 -8.046 6.016 537 HG2 GLU 84 HG2 GLU 84 11.002 -9.910 4.625 538 HG3 GLU 84 HG1 GLU 84 9.338 -9.759 5.185 539 H GLU 85 HN GLU 85 7.232 -8.287 4.427 540 HA GLU 85 HA GLU 85 5.561 -9.692 5.041 541 HB2 GLU 85 HB2 GLU 85 7.499 -10.179 7.269 542 HB3 GLU 85 HB1 GLU 85 5.886 -10.869 7.355 543 HG2 GLU 85 HG2 GLU 85 7.857 -11.312 5.127 544 HG3 GLU 85 HG1 GLU 85 7.514 -12.442 6.439 545 H ASP 86 HN ASP 86 5.692 -6.800 5.925 546 HA ASP 86 HA ASP 86 4.173 -6.761 8.373 547 HB2 ASP 86 HB2 ASP 86 5.646 -4.856 6.925 548 HB3 ASP 86 HB1 ASP 86 3.975 -4.295 6.889 549 H VAL 87 HN VAL 87 2.020 -5.731 8.484 550 HA VAL 87 HA VAL 87 0.392 -6.536 6.163 551 HB VAL 87 HB VAL 87 -0.367 -6.662 9.085 552 HG11 VAL 87 HG11 VAL 87 -2.399 -7.784 8.315 553 HG12 VAL 87 HG12 VAL 87 -1.908 -7.519 6.643 554 HG13 VAL 87 HG13 VAL 87 -2.287 -6.143 7.677 555 HG21 VAL 87 HG21 VAL 87 0.239 -8.855 7.108 556 HG22 VAL 87 HG22 VAL 87 -0.394 -9.098 8.737 557 HG23 VAL 87 HG23 VAL 87 1.212 -8.403 8.508 558 H ILE 88 HN ILE 88 -1.049 -5.142 5.373 559 HA ILE 88 HA ILE 88 -1.719 -2.741 6.912 560 HB ILE 88 HB ILE 88 0.093 -2.123 5.365 561 HG12 ILE 88 HG12 ILE 88 -2.528 -0.976 4.388 562 HG13 ILE 88 HG11 ILE 88 -1.785 -0.540 5.923 563 HG21 ILE 88 HG21 ILE 88 -0.274 -2.167 2.936 564 HG22 ILE 88 HG22 ILE 88 -1.777 -3.051 3.197 565 HG23 ILE 88 HG23 ILE 88 -0.237 -3.782 3.643 566 HD11 ILE 88 HD11 ILE 88 0.230 0.193 4.635 567 HD12 ILE 88 HD12 ILE 88 -1.229 1.142 4.354 568 HD13 ILE 88 HD13 ILE 88 -0.709 -0.049 3.162 569 H GLU 89 HN GLU 89 -3.810 -2.007 6.595 570 HA GLU 89 HA GLU 89 -5.552 -3.870 5.150 571 HB2 GLU 89 HB2 GLU 89 -6.068 -1.863 7.340 572 HB3 GLU 89 HB1 GLU 89 -7.372 -2.623 6.440 573 HG2 GLU 89 HG2 GLU 89 -6.735 -4.793 7.224 574 HG3 GLU 89 HG1 GLU 89 -5.284 -4.139 7.984 575 H VAL 90 HN VAL 90 -7.140 -3.151 3.718 576 HA VAL 90 HA VAL 90 -6.915 -0.357 2.843 577 HB VAL 90 HB VAL 90 -5.657 -1.679 1.240 578 HG11 VAL 90 HG11 VAL 90 -8.172 -3.291 0.826 579 HG12 VAL 90 HG12 VAL 90 -6.701 -3.857 1.618 580 HG13 VAL 90 HG13 VAL 90 -6.677 -3.442 -0.096 581 HG21 VAL 90 HG21 VAL 90 -8.324 -0.811 0.139 582 HG22 VAL 90 HG22 VAL 90 -6.866 -1.091 -0.811 583 HG23 VAL 90 HG23 VAL 90 -6.906 0.210 0.379 584 H TYR 91 HN TYR 91 -8.802 0.649 2.883 585 HA TYR 91 HA TYR 91 -11.265 -0.902 2.439 586 HB2 TYR 91 HB2 TYR 91 -10.768 1.099 4.657 587 HB3 TYR 91 HB1 TYR 91 -12.361 0.485 4.227 588 HD1 TYR 91 HD1 TYR 91 -12.730 -2.043 4.375 589 HD2 TYR 91 HD2 TYR 91 -9.416 -0.073 6.171 590 HE1 TYR 91 HE1 TYR 91 -12.398 -3.967 5.864 591 HE2 TYR 91 HE2 TYR 91 -9.076 -1.995 7.669 592 HH TYR 91 HH TYR 91 -9.703 -4.064 8.191 593 H GLN 92 HN GLN 92 -13.081 0.441 1.722 594 HA GLN 92 HA GLN 92 -12.147 2.506 -0.075 595 HB2 GLN 92 HB2 GLN 92 -13.885 0.736 -0.658 596 HB3 GLN 92 HB1 GLN 92 -15.005 1.648 0.346 597 HG2 GLN 92 HG2 GLN 92 -14.306 3.652 -1.152 598 HG3 GLN 92 HG1 GLN 92 -13.762 2.397 -2.263 599 HE21 GLN 92 HE21 GLN 92 -16.475 3.925 -0.768 600 HE22 GLN 92 HE22 GLN 92 -17.699 3.187 -1.746 601 H GLU 93 HN GLU 93 -12.670 4.662 -0.022 602 HA GLU 93 HA GLU 93 -13.293 5.742 2.568 603 HB2 GLU 93 HB2 GLU 93 -12.625 6.924 -0.110 604 HB3 GLU 93 HB1 GLU 93 -13.228 7.948 1.188 605 HG2 GLU 93 HG2 GLU 93 -10.871 6.142 1.581 606 HG3 GLU 93 HG1 GLU 93 -10.700 7.753 0.885 607 H GLN 94 HN GLN 94 -15.045 7.217 2.998 608 HA GLN 94 HA GLN 94 -17.538 6.240 2.030 609 HB2 GLN 94 HB2 GLN 94 -16.811 7.416 4.321 610 HB3 GLN 94 HB1 GLN 94 -17.402 8.839 3.474 611 HG2 GLN 94 HG2 GLN 94 -19.257 6.653 3.213 612 HG3 GLN 94 HG1 GLN 94 -18.897 6.977 4.908 613 HE21 GLN 94 HE21 GLN 94 -19.299 9.080 5.727 614 HE22 GLN 94 HE22 GLN 94 -20.483 10.099 4.985 615 H THR 95 HN THR 95 -15.392 8.742 1.061 616 HA THR 95 HA THR 95 -17.314 10.334 -0.337 617 HB THR 95 HB THR 95 -14.647 10.662 -1.347 618 HG1 THR 95 HG1 THR 95 -13.758 11.224 0.803 619 HG21 THR 95 HG21 THR 95 -16.298 12.443 -1.286 620 HG22 THR 95 HG22 THR 95 -14.904 12.899 -0.307 621 HG23 THR 95 HG23 THR 95 -16.384 12.339 0.471 622 H GLY 96 HN GLY 96 -16.043 7.318 -0.953 623 HA2 GLY 96 HA2 GLY 96 -16.471 5.976 -2.804 624 HA3 GLY 96 HA1 GLY 96 -16.970 7.407 -3.694 625 H GLY 97 HN GLY 97 -15.040 8.991 -4.040 626 HA2 GLY 97 HA2 GLY 97 -12.430 8.523 -4.137 627 HA3 GLY 97 HA1 GLY 97 -12.992 7.439 -5.405 628 H1 ASN 357 HT1 ASN 357 -3.806 -19.314 -5.976 629 H2 ASN 357 HT2 ASN 357 -5.195 -18.383 -5.727 630 H3 ASN 357 HT3 ASN 357 -4.106 -18.634 -4.458 631 HA ASN 357 HA ASN 357 -2.413 -17.388 -5.594 632 HB2 ASN 357 HB2 ASN 357 -3.013 -16.166 -7.679 633 HB3 ASN 357 HB1 ASN 357 -3.012 -17.912 -7.884 634 HD21 ASN 357 HD21 ASN 357 -4.323 -15.918 -9.489 635 HD22 ASN 357 HD22 ASN 357 -6.013 -16.273 -9.448 636 H ASN 358 HN ASN 358 -3.527 -16.838 -3.404 637 HA ASN 358 HA ASN 358 -5.344 -14.596 -3.488 638 HB2 ASN 358 HB2 ASN 358 -5.301 -14.688 -1.076 639 HB3 ASN 358 HB1 ASN 358 -5.420 -16.332 -1.691 640 HD21 ASN 358 HD21 ASN 358 -4.493 -15.451 0.896 641 HD22 ASN 358 HD22 ASN 358 -2.861 -15.994 1.052 642 H ARG 359 HN ARG 359 -2.033 -14.937 -3.837 643 HA ARG 359 HA ARG 359 -1.545 -12.232 -2.810 644 HB2 ARG 359 HB2 ARG 359 0.910 -12.957 -2.873 645 HB3 ARG 359 HB1 ARG 359 -0.114 -13.633 -1.613 646 HG2 ARG 359 HG2 ARG 359 -0.417 -15.633 -3.155 647 HG3 ARG 359 HG1 ARG 359 0.919 -14.961 -4.098 648 HD2 ARG 359 HD2 ARG 359 1.741 -16.610 -2.517 649 HD3 ARG 359 HD1 ARG 359 2.334 -15.011 -2.096 650 HE ARG 359 HE ARG 359 0.870 -14.967 -0.233 651 HH11 ARG 359 HH11 ARG 359 0.802 -17.998 -2.004 652 HH12 ARG 359 HH12 ARG 359 0.048 -18.907 -0.643 653 HH21 ARG 359 HH21 ARG 359 -0.118 -16.060 1.496 654 HH22 ARG 359 HH22 ARG 359 -0.468 -17.827 1.316 655 H ASP 360 HN ASP 360 -1.118 -10.679 -4.159 656 HA ASP 360 HA ASP 360 -0.243 -11.340 -6.896 657 HB2 ASP 360 HB2 ASP 360 -2.533 -10.473 -6.918 658 HB3 ASP 360 HB1 ASP 360 -2.032 -9.071 -5.982 659 HA PRO 361 HA PRO 361 3.183 -8.838 -5.420 660 HB2 PRO 361 HB2 PRO 361 4.947 -9.526 -7.325 661 HB3 PRO 361 HB1 PRO 361 4.493 -10.634 -6.021 662 HG2 PRO 361 HG2 PRO 361 3.581 -10.599 -8.854 663 HG3 PRO 361 HG1 PRO 361 3.955 -11.981 -7.807 664 HD2 PRO 361 HD2 PRO 361 1.407 -11.061 -8.337 665 HD3 PRO 361 HD1 PRO 361 1.862 -12.033 -6.926 666 H ILE 362 HN ILE 362 3.259 -6.715 -5.719 667 HA ILE 362 HA ILE 362 3.017 -5.665 -8.456 668 HB ILE 362 HB ILE 362 2.547 -3.952 -6.051 669 HG12 ILE 362 HG12 ILE 362 0.390 -5.585 -7.404 670 HG13 ILE 362 HG11 ILE 362 1.117 -6.012 -5.856 671 HG21 ILE 362 HG21 ILE 362 1.156 -2.698 -7.602 672 HG22 ILE 362 HG22 ILE 362 1.434 -3.909 -8.854 673 HG23 ILE 362 HG23 ILE 362 2.775 -2.926 -8.263 674 HD11 ILE 362 HD11 ILE 362 -0.441 -3.510 -6.461 675 HD12 ILE 362 HD12 ILE 362 0.320 -3.890 -4.918 676 HD13 ILE 362 HD13 ILE 362 -1.000 -4.891 -5.521 677 H VAL 363 HN VAL 363 4.756 -4.768 -9.301 678 HA VAL 363 HA VAL 363 6.871 -3.823 -7.478 679 HB VAL 363 HB VAL 363 7.264 -4.749 -10.330 680 HG11 VAL 363 HG11 VAL 363 8.970 -3.222 -9.575 681 HG12 VAL 363 HG12 VAL 363 9.641 -4.849 -9.656 682 HG13 VAL 363 HG13 VAL 363 9.201 -4.154 -8.098 683 HG21 VAL 363 HG21 VAL 363 6.506 -6.642 -9.012 684 HG22 VAL 363 HG22 VAL 363 7.709 -6.288 -7.772 685 HG23 VAL 363 HG23 VAL 363 8.226 -6.805 -9.376 686 H ILE 364 HN ILE 364 7.099 -1.687 -7.458 687 HA ILE 364 HA ILE 364 6.092 -0.126 -9.723 688 HB ILE 364 HB ILE 364 6.307 1.828 -8.198 689 HG12 ILE 364 HG12 ILE 364 6.402 0.370 -5.723 690 HG13 ILE 364 HG11 ILE 364 7.837 -0.003 -6.672 691 HG21 ILE 364 HG21 ILE 364 4.402 1.197 -6.748 692 HG22 ILE 364 HG22 ILE 364 4.636 -0.482 -7.227 693 HG23 ILE 364 HG23 ILE 364 4.176 0.720 -8.431 694 HD11 ILE 364 HD11 ILE 364 6.893 2.759 -5.941 695 HD12 ILE 364 HD12 ILE 364 8.354 2.362 -6.845 696 HD13 ILE 364 HD13 ILE 364 8.201 1.872 -5.157 697 H SER 365 HN SER 365 7.435 2.120 -9.770 698 HA SER 365 HA SER 365 10.243 1.337 -10.134 699 HB2 SER 365 HB2 SER 365 8.740 3.429 -11.718 700 HB3 SER 365 HB1 SER 365 10.352 2.790 -12.050 701 HG SER 365 HG SER 365 9.186 0.680 -12.201 702 H ASP 366 HN ASP 366 11.806 2.650 -9.336 703 HA ASP 366 HA ASP 366 10.918 5.026 -7.830 704 HB2 ASP 366 HB2 ASP 366 11.715 3.511 -6.216 705 HB3 ASP 366 HB1 ASP 366 13.025 2.952 -7.251 706 H SER 367 HN SER 367 11.831 6.939 -8.302 707 HA SER 367 HA SER 367 14.387 7.081 -9.659 708 HB2 SER 367 HB2 SER 367 11.937 8.294 -10.967 709 HB3 SER 367 HB1 SER 367 13.589 8.316 -11.583 710 HG SER 367 HG SER 367 13.009 5.797 -11.157 711 HA PRO 368 HA PRO 368 13.649 10.650 -6.864 712 HB2 PRO 368 HB2 PRO 368 15.858 10.414 -5.373 713 HB3 PRO 368 HB1 PRO 368 14.445 9.385 -5.087 714 HG2 PRO 368 HG2 PRO 368 17.005 8.729 -6.458 715 HG3 PRO 368 HG1 PRO 368 16.000 7.720 -5.401 716 HD2 PRO 368 HD2 PRO 368 16.013 7.616 -8.176 717 HD3 PRO 368 HD1 PRO 368 14.727 6.982 -7.130 Start of MODEL 10 1 H TYR 21 HT1 TYR 21 14.880 -4.932 -0.528 2 HA TYR 21 HA TYR 21 13.250 -3.411 -1.461 3 HB2 TYR 21 HB2 TYR 21 12.134 -5.966 -2.641 4 HB3 TYR 21 HB1 TYR 21 11.267 -4.438 -2.586 5 HD1 TYR 21 HD1 TYR 21 13.107 -2.441 -3.445 6 HD2 TYR 21 HD2 TYR 21 12.768 -6.459 -4.798 7 HE1 TYR 21 HE1 TYR 21 14.108 -1.797 -5.596 8 HE2 TYR 21 HE2 TYR 21 13.772 -5.824 -6.948 9 HH TYR 21 HH TYR 21 13.884 -3.437 -8.289 10 H ILE 22 HN ILE 22 10.754 -3.640 -0.803 11 HA ILE 22 HA ILE 22 10.663 -5.160 1.722 12 HB ILE 22 HB ILE 22 9.510 -2.415 1.181 13 HG12 ILE 22 HG12 ILE 22 11.934 -2.426 1.639 14 HG13 ILE 22 HG11 ILE 22 11.031 -1.651 2.934 15 HG21 ILE 22 HG21 ILE 22 9.301 -4.108 3.667 16 HG22 ILE 22 HG22 ILE 22 7.989 -3.747 2.546 17 HG23 ILE 22 HG23 ILE 22 8.721 -2.451 3.492 18 HD11 ILE 22 HD11 ILE 22 12.782 -3.034 3.844 19 HD12 ILE 22 HD12 ILE 22 12.168 -4.436 2.969 20 HD13 ILE 22 HD13 ILE 22 11.209 -3.713 4.261 21 H LYS 23 HN LYS 23 9.102 -6.631 1.739 22 HA LYS 23 HA LYS 23 6.961 -6.406 -0.266 23 HB2 LYS 23 HB2 LYS 23 8.388 -8.416 -0.316 24 HB3 LYS 23 HB1 LYS 23 7.899 -8.793 1.328 25 HG2 LYS 23 HG2 LYS 23 5.521 -8.874 0.435 26 HG3 LYS 23 HG1 LYS 23 6.251 -8.879 -1.174 27 HD2 LYS 23 HD2 LYS 23 6.161 -11.126 -0.838 28 HD3 LYS 23 HD1 LYS 23 7.717 -10.806 -0.066 29 HE2 LYS 23 HE2 LYS 23 5.037 -11.259 1.219 30 HE3 LYS 23 HE1 LYS 23 6.526 -12.174 1.440 31 HZ1 LYS 23 HZ1 LYS 23 6.056 -10.769 3.343 32 HZ2 LYS 23 HZ2 LYS 23 6.062 -9.385 2.359 33 HZ3 LYS 23 HZ3 LYS 23 7.492 -10.262 2.582 34 H LEU 24 HN LEU 24 5.441 -5.161 0.695 35 HA LEU 24 HA LEU 24 4.591 -5.659 3.415 36 HB2 LEU 24 HB2 LEU 24 3.499 -3.795 1.300 37 HB3 LEU 24 HB1 LEU 24 2.940 -3.862 2.960 38 HG LEU 24 HG LEU 24 5.750 -3.116 2.137 39 HD11 LEU 24 HD11 LEU 24 4.153 -1.441 1.382 40 HD12 LEU 24 HD12 LEU 24 5.107 -0.832 2.734 41 HD13 LEU 24 HD13 LEU 24 3.446 -1.366 2.994 42 HD21 LEU 24 HD21 LEU 24 5.655 -4.079 4.358 43 HD22 LEU 24 HD22 LEU 24 4.328 -3.003 4.795 44 HD23 LEU 24 HD23 LEU 24 5.928 -2.339 4.466 45 H LYS 25 HN LYS 25 2.481 -6.326 4.013 46 HA LYS 25 HA LYS 25 1.186 -8.005 1.967 47 HB2 LYS 25 HB2 LYS 25 0.783 -8.261 4.939 48 HB3 LYS 25 HB1 LYS 25 0.448 -9.448 3.687 49 HG2 LYS 25 HG2 LYS 25 2.820 -9.764 3.310 50 HG3 LYS 25 HG1 LYS 25 3.191 -8.519 4.505 51 HD2 LYS 25 HD2 LYS 25 3.449 -10.462 5.729 52 HD3 LYS 25 HD1 LYS 25 1.787 -10.008 6.102 53 HE2 LYS 25 HE2 LYS 25 0.904 -11.638 4.651 54 HE3 LYS 25 HE1 LYS 25 2.460 -11.889 3.862 55 HZ1 LYS 25 HZ1 LYS 25 1.968 -13.694 5.362 56 HZ2 LYS 25 HZ2 LYS 25 1.785 -12.623 6.658 57 HZ3 LYS 25 HZ3 LYS 25 3.306 -12.826 5.935 58 H VAL 26 HN VAL 26 -0.399 -6.856 1.067 59 HA VAL 26 HA VAL 26 -2.001 -5.048 2.696 60 HB VAL 26 HB VAL 26 -2.577 -5.555 -0.194 61 HG11 VAL 26 HG11 VAL 26 -3.213 -3.213 -0.171 62 HG12 VAL 26 HG12 VAL 26 -2.649 -3.059 1.493 63 HG13 VAL 26 HG13 VAL 26 -4.032 -4.087 1.122 64 HG21 VAL 26 HG21 VAL 26 -0.307 -3.838 0.816 65 HG22 VAL 26 HG22 VAL 26 -0.908 -3.869 -0.841 66 HG23 VAL 26 HG23 VAL 26 -0.160 -5.306 -0.148 67 H ILE 27 HN ILE 27 -3.842 -5.626 3.585 68 HA ILE 27 HA ILE 27 -5.034 -8.195 2.889 69 HB ILE 27 HB ILE 27 -5.811 -6.296 5.103 70 HG12 ILE 27 HG12 ILE 27 -3.478 -7.059 5.354 71 HG13 ILE 27 HG11 ILE 27 -4.520 -7.733 6.602 72 HG21 ILE 27 HG21 ILE 27 -6.913 -8.252 6.081 73 HG22 ILE 27 HG22 ILE 27 -6.455 -9.209 4.672 74 HG23 ILE 27 HG23 ILE 27 -7.574 -7.858 4.493 75 HD11 ILE 27 HD11 ILE 27 -4.606 -9.847 5.381 76 HD12 ILE 27 HD12 ILE 27 -2.950 -9.388 5.780 77 HD13 ILE 27 HD13 ILE 27 -3.555 -9.170 4.137 78 H GLY 28 HN GLY 28 -6.502 -8.236 1.358 79 HA2 GLY 28 HA2 GLY 28 -8.010 -5.886 0.613 80 HA3 GLY 28 HA1 GLY 28 -8.094 -7.471 -0.145 81 H GLN 29 HN GLN 29 -10.403 -6.144 0.210 82 HA GLN 29 HA GLN 29 -11.725 -6.528 2.662 83 HB2 GLN 29 HB2 GLN 29 -12.444 -4.997 0.813 84 HB3 GLN 29 HB1 GLN 29 -12.977 -6.407 -0.085 85 HG2 GLN 29 HG2 GLN 29 -14.861 -5.359 0.975 86 HG3 GLN 29 HG1 GLN 29 -14.566 -6.931 1.715 87 HE21 GLN 29 HE21 GLN 29 -13.905 -7.041 3.832 88 HE22 GLN 29 HE22 GLN 29 -13.906 -5.675 4.892 89 H ASP 30 HN ASP 30 -11.140 -8.665 -0.029 90 HA ASP 30 HA ASP 30 -13.031 -10.644 0.974 91 HB2 ASP 30 HB2 ASP 30 -12.608 -11.878 -1.036 92 HB3 ASP 30 HB1 ASP 30 -12.776 -10.186 -1.490 93 H SER 31 HN SER 31 -10.429 -9.766 2.281 94 HA SER 31 HA SER 31 -8.835 -10.673 3.598 95 HB2 SER 31 HB2 SER 31 -10.254 -13.298 3.101 96 HB3 SER 31 HB1 SER 31 -9.117 -12.956 4.403 97 HG SER 31 HG SER 31 -10.588 -11.707 5.396 98 H SER 32 HN SER 32 -8.000 -10.170 1.135 99 HA SER 32 HA SER 32 -6.591 -12.507 0.106 100 HB2 SER 32 HB2 SER 32 -5.817 -10.465 -1.500 101 HB3 SER 32 HB1 SER 32 -7.298 -11.389 -1.759 102 HG SER 32 HG SER 32 -8.448 -9.702 -1.242 103 H GLU 33 HN GLU 33 -4.265 -12.358 -0.308 104 HA GLU 33 HA GLU 33 -2.917 -10.609 1.643 105 HB2 GLU 33 HB2 GLU 33 -2.944 -13.195 1.988 106 HB3 GLU 33 HB1 GLU 33 -1.763 -13.216 0.686 107 HG2 GLU 33 HG2 GLU 33 -0.375 -11.635 2.026 108 HG3 GLU 33 HG1 GLU 33 -1.516 -11.850 3.353 109 H ILE 34 HN ILE 34 -2.847 -9.035 -0.093 110 HA ILE 34 HA ILE 34 -1.416 -9.624 -2.510 111 HB ILE 34 HB ILE 34 -2.012 -6.891 -1.386 112 HG12 ILE 34 HG12 ILE 34 -4.093 -8.172 -1.469 113 HG13 ILE 34 HG11 ILE 34 -4.084 -6.941 -2.726 114 HG21 ILE 34 HG21 ILE 34 -0.436 -6.891 -3.218 115 HG22 ILE 34 HG22 ILE 34 -1.978 -6.215 -3.747 116 HG23 ILE 34 HG23 ILE 34 -1.537 -7.864 -4.193 117 HD11 ILE 34 HD11 ILE 34 -5.009 -9.025 -3.547 118 HD12 ILE 34 HD12 ILE 34 -3.524 -9.872 -3.116 119 HD13 ILE 34 HD13 ILE 34 -3.501 -8.644 -4.381 120 H HIS 35 HN HIS 35 0.705 -9.548 -2.857 121 HA HIS 35 HA HIS 35 2.417 -8.636 -0.658 122 HB2 HIS 35 HB2 HIS 35 2.854 -10.553 -2.941 123 HB3 HIS 35 HB1 HIS 35 4.206 -9.896 -2.028 124 HD2 HIS 35 HD2 HIS 35 1.245 -10.635 0.230 125 HE1 HIS 35 HE1 HIS 35 3.804 -14.001 0.381 126 HE2 HIS 35 HE2 HIS 35 1.666 -12.975 1.278 127 H PHE 36 HN PHE 36 2.335 -6.431 -1.090 128 HA PHE 36 HA PHE 36 3.056 -5.444 -3.707 129 HB2 PHE 36 HB2 PHE 36 1.504 -4.417 -1.754 130 HB3 PHE 36 HB1 PHE 36 3.022 -3.608 -1.379 131 HD1 PHE 36 HD1 PHE 36 1.608 -4.525 -4.695 132 HD2 PHE 36 HD2 PHE 36 2.670 -1.402 -2.002 133 HE1 PHE 36 HE1 PHE 36 1.145 -2.863 -6.444 134 HE2 PHE 36 HE2 PHE 36 2.203 0.264 -3.752 135 HZ PHE 36 HZ PHE 36 1.441 -0.464 -5.977 136 H LYS 37 HN LYS 37 5.106 -5.609 -4.320 137 HA LYS 37 HA LYS 37 7.256 -5.475 -2.362 138 HB2 LYS 37 HB2 LYS 37 7.073 -7.018 -4.472 139 HB3 LYS 37 HB1 LYS 37 7.668 -5.605 -5.334 140 HG2 LYS 37 HG2 LYS 37 9.627 -5.570 -3.802 141 HG3 LYS 37 HG1 LYS 37 9.051 -7.087 -3.106 142 HD2 LYS 37 HD2 LYS 37 9.764 -6.651 -6.007 143 HD3 LYS 37 HD1 LYS 37 10.785 -7.451 -4.813 144 HE2 LYS 37 HE2 LYS 37 9.054 -9.166 -4.502 145 HE3 LYS 37 HE1 LYS 37 8.063 -8.373 -5.725 146 HZ1 LYS 37 HZ1 LYS 37 9.886 -8.751 -7.322 147 HZ2 LYS 37 HZ2 LYS 37 9.229 -10.186 -6.724 148 HZ3 LYS 37 HZ3 LYS 37 10.716 -9.629 -6.139 149 H VAL 38 HN VAL 38 7.439 -3.420 -1.639 150 HA VAL 38 HA VAL 38 7.497 -1.227 -3.567 151 HB VAL 38 HB VAL 38 7.299 0.280 -1.708 152 HG11 VAL 38 HG11 VAL 38 5.483 -2.096 -1.344 153 HG12 VAL 38 HG12 VAL 38 5.233 -0.742 -2.447 154 HG13 VAL 38 HG13 VAL 38 5.190 -0.480 -0.702 155 HG21 VAL 38 HG21 VAL 38 7.641 -2.128 0.076 156 HG22 VAL 38 HG22 VAL 38 7.222 -0.506 0.622 157 HG23 VAL 38 HG23 VAL 38 8.791 -0.807 -0.127 158 H LYS 39 HN LYS 39 9.122 0.475 -3.287 159 HA LYS 39 HA LYS 39 11.770 -0.700 -2.794 160 HB2 LYS 39 HB2 LYS 39 11.147 0.201 -5.101 161 HB3 LYS 39 HB1 LYS 39 11.147 1.800 -4.377 162 HG2 LYS 39 HG2 LYS 39 13.517 1.474 -3.746 163 HG3 LYS 39 HG1 LYS 39 13.493 -0.077 -4.585 164 HD2 LYS 39 HD2 LYS 39 13.039 0.998 -6.686 165 HD3 LYS 39 HD1 LYS 39 12.836 2.560 -5.893 166 HE2 LYS 39 HE2 LYS 39 15.216 2.412 -5.155 167 HE3 LYS 39 HE1 LYS 39 15.379 0.957 -6.133 168 HZ1 LYS 39 HZ1 LYS 39 16.131 3.033 -7.242 169 HZ2 LYS 39 HZ2 LYS 39 14.531 3.587 -7.228 170 HZ3 LYS 39 HZ3 LYS 39 14.940 2.193 -8.096 171 H MET 40 HN MET 40 12.789 -0.059 -1.003 172 HA MET 40 HA MET 40 11.745 1.990 0.671 173 HB2 MET 40 HB2 MET 40 12.829 0.042 1.629 174 HB3 MET 40 HB1 MET 40 14.335 0.440 0.815 175 HG2 MET 40 HG2 MET 40 14.457 1.017 3.153 176 HG3 MET 40 HG1 MET 40 14.526 2.471 2.163 177 HE1 MET 40 HE1 MET 40 12.622 0.313 4.650 178 HE2 MET 40 HE2 MET 40 11.367 0.264 3.410 179 HE3 MET 40 HE3 MET 40 11.091 1.150 4.910 180 H THR 41 HN THR 41 11.771 3.806 -0.686 181 HA THR 41 HA THR 41 13.694 5.699 -0.238 182 HB THR 41 HB THR 41 15.239 4.327 -1.605 183 HG1 THR 41 HG1 THR 41 14.785 6.510 -3.273 184 HG21 THR 41 HG21 THR 41 13.536 3.352 -3.115 185 HG22 THR 41 HG22 THR 41 14.915 4.038 -3.975 186 HG23 THR 41 HG23 THR 41 13.388 4.919 -3.913 187 H THR 42 HN THR 42 11.302 4.371 -2.392 188 HA THR 42 HA THR 42 10.608 6.908 -3.554 189 HB THR 42 HB THR 42 8.914 4.423 -3.669 190 HG1 THR 42 HG1 THR 42 10.921 4.893 -5.593 191 HG21 THR 42 HG21 THR 42 7.981 6.443 -4.667 192 HG22 THR 42 HG22 THR 42 8.392 5.271 -5.921 193 HG23 THR 42 HG23 THR 42 9.444 6.658 -5.630 194 H HIS 43 HN HIS 43 8.938 8.223 -2.990 195 HA HIS 43 HA HIS 43 7.925 8.135 -0.359 196 HB2 HIS 43 HB2 HIS 43 7.977 9.983 -2.461 197 HB3 HIS 43 HB1 HIS 43 6.267 9.684 -2.178 198 HD2 HIS 43 HD2 HIS 43 5.864 9.782 0.878 199 HE1 HIS 43 HE1 HIS 43 8.372 13.185 0.914 200 HE2 HIS 43 HE2 HIS 43 6.731 11.798 2.263 201 H LEU 44 HN LEU 44 5.855 7.581 0.418 202 HA LEU 44 HA LEU 44 4.641 5.372 -0.816 203 HB2 LEU 44 HB2 LEU 44 3.794 7.167 1.432 204 HB3 LEU 44 HB1 LEU 44 2.758 5.868 0.866 205 HG LEU 44 HG LEU 44 5.579 5.477 1.873 206 HD11 LEU 44 HD11 LEU 44 2.968 4.956 3.282 207 HD12 LEU 44 HD12 LEU 44 4.091 6.263 3.655 208 HD13 LEU 44 HD13 LEU 44 4.578 4.585 3.894 209 HD21 LEU 44 HD21 LEU 44 4.841 3.095 2.013 210 HD22 LEU 44 HD22 LEU 44 4.967 3.719 0.366 211 HD23 LEU 44 HD23 LEU 44 3.383 3.549 1.128 212 H LYS 45 HN LYS 45 4.272 8.696 -1.377 213 HA LYS 45 HA LYS 45 1.661 8.968 -2.257 214 HB2 LYS 45 HB2 LYS 45 3.136 10.885 -2.090 215 HB3 LYS 45 HB1 LYS 45 4.219 10.210 -3.299 216 HG2 LYS 45 HG2 LYS 45 3.023 11.871 -4.421 217 HG3 LYS 45 HG1 LYS 45 2.251 10.362 -4.912 218 HD2 LYS 45 HD2 LYS 45 0.673 10.828 -2.902 219 HD3 LYS 45 HD1 LYS 45 1.257 12.486 -3.056 220 HE2 LYS 45 HE2 LYS 45 0.449 12.626 -5.305 221 HE3 LYS 45 HE1 LYS 45 0.054 10.907 -5.326 222 HZ1 LYS 45 HZ1 LYS 45 -1.965 11.978 -4.940 223 HZ2 LYS 45 HZ2 LYS 45 -1.294 13.082 -3.853 224 HZ3 LYS 45 HZ3 LYS 45 -1.489 11.463 -3.395 225 H LYS 46 HN LYS 46 4.525 7.831 -3.982 226 HA LYS 46 HA LYS 46 3.224 7.415 -6.474 227 HB2 LYS 46 HB2 LYS 46 5.770 7.661 -5.867 228 HB3 LYS 46 HB1 LYS 46 5.688 5.914 -5.674 229 HG2 LYS 46 HG2 LYS 46 6.346 6.101 -7.861 230 HG3 LYS 46 HG1 LYS 46 4.592 5.988 -8.036 231 HD2 LYS 46 HD2 LYS 46 4.566 8.521 -8.002 232 HD3 LYS 46 HD1 LYS 46 6.321 8.447 -8.179 233 HE2 LYS 46 HE2 LYS 46 5.396 8.719 -10.358 234 HE3 LYS 46 HE1 LYS 46 5.961 7.055 -10.232 235 HZ1 LYS 46 HZ1 LYS 46 3.148 7.751 -9.646 236 HZ2 LYS 46 HZ2 LYS 46 3.805 6.254 -10.091 237 HZ3 LYS 46 HZ3 LYS 46 3.668 7.487 -11.236 238 H LEU 47 HN LEU 47 3.898 5.394 -3.681 239 HA LEU 47 HA LEU 47 3.186 2.926 -4.887 240 HB2 LEU 47 HB2 LEU 47 3.511 3.854 -2.056 241 HB3 LEU 47 HB1 LEU 47 2.840 2.271 -2.390 242 HG LEU 47 HG LEU 47 5.134 1.930 -1.958 243 HD11 LEU 47 HD11 LEU 47 5.934 0.925 -3.947 244 HD12 LEU 47 HD12 LEU 47 4.976 2.004 -4.957 245 HD13 LEU 47 HD13 LEU 47 4.176 0.783 -3.970 246 HD21 LEU 47 HD21 LEU 47 5.711 4.149 -3.915 247 HD22 LEU 47 HD22 LEU 47 6.924 3.126 -3.146 248 HD23 LEU 47 HD23 LEU 47 5.930 4.204 -2.168 249 H LYS 48 HN LYS 48 1.391 5.298 -2.977 250 HA LYS 48 HA LYS 48 -0.971 3.838 -2.650 251 HB2 LYS 48 HB2 LYS 48 -0.473 6.809 -2.786 252 HB3 LYS 48 HB1 LYS 48 -2.050 6.122 -2.421 253 HG2 LYS 48 HG2 LYS 48 -1.136 5.013 -0.461 254 HG3 LYS 48 HG1 LYS 48 0.464 5.651 -0.834 255 HD2 LYS 48 HD2 LYS 48 -0.369 7.100 0.808 256 HD3 LYS 48 HD1 LYS 48 -0.626 7.964 -0.708 257 HE2 LYS 48 HE2 LYS 48 -2.951 7.351 -0.728 258 HE3 LYS 48 HE1 LYS 48 -2.731 6.297 0.665 259 HZ1 LYS 48 HZ1 LYS 48 -2.207 8.232 2.009 260 HZ2 LYS 48 HZ2 LYS 48 -3.726 8.411 1.294 261 HZ3 LYS 48 HZ3 LYS 48 -2.398 9.255 0.669 262 H GLU 49 HN GLU 49 -0.075 6.127 -5.243 263 HA GLU 49 HA GLU 49 -2.554 5.816 -6.599 264 HB2 GLU 49 HB2 GLU 49 -1.313 6.873 -8.547 265 HB3 GLU 49 HB1 GLU 49 -1.431 7.818 -7.072 266 HG2 GLU 49 HG2 GLU 49 0.867 7.087 -6.489 267 HG3 GLU 49 HG1 GLU 49 0.966 6.300 -8.064 268 H SER 50 HN SER 50 0.601 4.252 -6.948 269 HA SER 50 HA SER 50 0.074 2.875 -9.326 270 HB2 SER 50 HB2 SER 50 1.810 1.998 -7.003 271 HB3 SER 50 HB1 SER 50 1.870 1.332 -8.635 272 HG SER 50 HG SER 50 2.561 3.941 -7.765 273 H TYR 51 HN TYR 51 -0.710 2.096 -5.972 274 HA TYR 51 HA TYR 51 -1.645 -0.529 -6.501 275 HB2 TYR 51 HB2 TYR 51 -1.006 0.481 -4.233 276 HB3 TYR 51 HB1 TYR 51 -2.605 1.217 -4.237 277 HD1 TYR 51 HD1 TYR 51 -0.792 -2.003 -4.218 278 HD2 TYR 51 HD2 TYR 51 -4.550 -0.065 -3.714 279 HE1 TYR 51 HE1 TYR 51 -1.736 -4.081 -3.305 280 HE2 TYR 51 HE2 TYR 51 -5.500 -2.139 -2.798 281 HH TYR 51 HH TYR 51 -5.055 -4.570 -2.900 282 H CYS 52 HN CYS 52 -3.204 2.639 -6.366 283 HA CYS 52 HA CYS 52 -5.862 1.768 -6.627 284 HB2 CYS 52 HB2 CYS 52 -4.635 4.352 -7.615 285 HB3 CYS 52 HB1 CYS 52 -6.352 4.054 -7.385 286 HG CYS 52 HG CYS 52 -3.990 4.176 -4.910 287 H GLN 53 HN GLN 53 -3.399 2.585 -9.025 288 HA GLN 53 HA GLN 53 -4.977 2.377 -11.331 289 HB2 GLN 53 HB2 GLN 53 -2.041 1.747 -10.998 290 HB3 GLN 53 HB1 GLN 53 -2.858 2.002 -12.532 291 HG2 GLN 53 HG2 GLN 53 -3.272 4.293 -12.009 292 HG3 GLN 53 HG1 GLN 53 -2.682 4.072 -10.361 293 HE21 GLN 53 HE21 GLN 53 -1.745 5.932 -12.377 294 HE22 GLN 53 HE22 GLN 53 -0.075 5.571 -12.639 295 H ARG 54 HN ARG 54 -3.155 -0.056 -9.542 296 HA ARG 54 HA ARG 54 -3.621 -2.172 -11.375 297 HB2 ARG 54 HB2 ARG 54 -2.003 -3.058 -10.118 298 HB3 ARG 54 HB1 ARG 54 -2.166 -1.749 -8.962 299 HG2 ARG 54 HG2 ARG 54 -2.503 -3.516 -7.583 300 HG3 ARG 54 HG1 ARG 54 -4.169 -3.233 -8.090 301 HD2 ARG 54 HD2 ARG 54 -3.759 -4.936 -9.924 302 HD3 ARG 54 HD1 ARG 54 -2.253 -5.330 -9.093 303 HE ARG 54 HE ARG 54 -4.754 -5.454 -7.572 304 HH11 ARG 54 HH11 ARG 54 -2.098 -7.129 -9.175 305 HH12 ARG 54 HH12 ARG 54 -2.406 -8.690 -8.310 306 HH21 ARG 54 HH21 ARG 54 -5.201 -7.422 -6.493 307 HH22 ARG 54 HH22 ARG 54 -4.179 -8.864 -6.865 308 H GLN 55 HN GLN 55 -5.440 -0.896 -8.665 309 HA GLN 55 HA GLN 55 -7.197 -3.176 -8.519 310 HB2 GLN 55 HB2 GLN 55 -7.319 -0.439 -7.253 311 HB3 GLN 55 HB1 GLN 55 -8.547 -1.671 -7.000 312 HG2 GLN 55 HG2 GLN 55 -5.653 -1.758 -6.196 313 HG3 GLN 55 HG1 GLN 55 -7.068 -1.747 -5.148 314 HE21 GLN 55 HE21 GLN 55 -8.283 -3.647 -4.913 315 HE22 GLN 55 HE22 GLN 55 -7.659 -5.188 -5.388 316 H GLY 56 HN GLY 56 -7.120 -0.136 -10.208 317 HA2 GLY 56 HA2 GLY 56 -8.371 0.230 -12.190 318 HA3 GLY 56 HA1 GLY 56 -9.549 -0.947 -11.633 319 H VAL 57 HN VAL 57 -8.482 1.351 -9.331 320 HA VAL 57 HA VAL 57 -10.959 2.896 -9.720 321 HB VAL 57 HB VAL 57 -10.997 3.231 -7.242 322 HG11 VAL 57 HG11 VAL 57 -11.941 1.047 -6.709 323 HG12 VAL 57 HG12 VAL 57 -11.178 0.354 -8.140 324 HG13 VAL 57 HG13 VAL 57 -12.444 1.570 -8.315 325 HG21 VAL 57 HG21 VAL 57 -8.909 1.055 -7.244 326 HG22 VAL 57 HG22 VAL 57 -9.713 1.720 -5.821 327 HG23 VAL 57 HG23 VAL 57 -8.648 2.739 -6.790 328 HA PRO 58 HA PRO 58 -8.434 6.515 -9.780 329 HB2 PRO 58 HB2 PRO 58 -10.071 8.339 -8.596 330 HB3 PRO 58 HB1 PRO 58 -10.334 7.737 -10.239 331 HG2 PRO 58 HG2 PRO 58 -11.660 6.902 -7.701 332 HG3 PRO 58 HG1 PRO 58 -12.370 7.179 -9.304 333 HD2 PRO 58 HD2 PRO 58 -11.834 4.704 -8.384 334 HD3 PRO 58 HD1 PRO 58 -11.717 5.124 -10.105 335 H MET 59 HN MET 59 -7.377 8.114 -8.350 336 HA MET 59 HA MET 59 -6.599 6.876 -5.894 337 HB2 MET 59 HB2 MET 59 -5.208 8.395 -7.501 338 HB3 MET 59 HB1 MET 59 -5.914 9.715 -6.581 339 HG2 MET 59 HG2 MET 59 -4.976 8.840 -4.536 340 HG3 MET 59 HG1 MET 59 -4.340 7.441 -5.396 341 HE1 MET 59 HE1 MET 59 -1.936 7.719 -4.573 342 HE2 MET 59 HE2 MET 59 -2.451 9.063 -3.553 343 HE3 MET 59 HE3 MET 59 -1.036 9.235 -4.588 344 H ASN 60 HN ASN 60 -6.651 7.952 -3.802 345 HA ASN 60 HA ASN 60 -7.647 8.978 -2.044 346 HB2 ASN 60 HB2 ASN 60 -7.810 10.881 -4.011 347 HB3 ASN 60 HB1 ASN 60 -9.501 10.683 -3.561 348 HD21 ASN 60 HD21 ASN 60 -9.754 12.621 -2.560 349 HD22 ASN 60 HD22 ASN 60 -8.947 13.050 -1.093 350 H SER 61 HN SER 61 -8.883 6.717 -3.657 351 HA SER 61 HA SER 61 -11.667 6.974 -2.771 352 HB2 SER 61 HB2 SER 61 -12.050 4.955 -4.187 353 HB3 SER 61 HB1 SER 61 -11.400 6.317 -5.099 354 HG SER 61 HG SER 61 -9.730 5.138 -5.578 355 H LEU 62 HN LEU 62 -8.858 4.851 -2.594 356 HA LEU 62 HA LEU 62 -10.095 3.357 -0.397 357 HB2 LEU 62 HB2 LEU 62 -7.575 2.717 -1.926 358 HB3 LEU 62 HB1 LEU 62 -8.399 1.673 -0.787 359 HG LEU 62 HG LEU 62 -9.576 2.561 -3.422 360 HD11 LEU 62 HD11 LEU 62 -9.100 0.258 -4.162 361 HD12 LEU 62 HD12 LEU 62 -8.193 -0.012 -2.674 362 HD13 LEU 62 HD13 LEU 62 -7.634 1.187 -3.841 363 HD21 LEU 62 HD21 LEU 62 -11.150 0.703 -2.997 364 HD22 LEU 62 HD22 LEU 62 -11.270 1.992 -1.803 365 HD23 LEU 62 HD23 LEU 62 -10.433 0.494 -1.399 366 H ARG 63 HN ARG 63 -9.243 3.368 1.624 367 HA ARG 63 HA ARG 63 -6.957 5.165 2.068 368 HB2 ARG 63 HB2 ARG 63 -7.766 5.491 4.326 369 HB3 ARG 63 HB1 ARG 63 -9.066 5.820 3.193 370 HG2 ARG 63 HG2 ARG 63 -10.179 3.811 3.734 371 HG3 ARG 63 HG1 ARG 63 -8.772 3.176 4.588 372 HD2 ARG 63 HD2 ARG 63 -9.018 4.853 6.316 373 HD3 ARG 63 HD1 ARG 63 -10.347 5.604 5.437 374 HE ARG 63 HE ARG 63 -10.435 3.125 6.968 375 HH11 ARG 63 HH11 ARG 63 -13.688 4.732 5.176 376 HH12 ARG 63 HH12 ARG 63 -12.056 5.462 4.882 377 HH21 ARG 63 HH21 ARG 63 -12.498 2.237 7.407 378 HH22 ARG 63 HH22 ARG 63 -13.934 2.947 6.580 379 H PHE 64 HN PHE 64 -5.139 4.411 2.939 380 HA PHE 64 HA PHE 64 -4.961 1.551 3.433 381 HB2 PHE 64 HB2 PHE 64 -2.879 3.712 3.112 382 HB3 PHE 64 HB1 PHE 64 -2.483 2.050 3.534 383 HD1 PHE 64 HD1 PHE 64 -3.316 4.334 0.885 384 HD2 PHE 64 HD2 PHE 64 -3.058 0.220 1.923 385 HE1 PHE 64 HE1 PHE 64 -3.324 3.741 -1.501 386 HE2 PHE 64 HE2 PHE 64 -3.065 -0.386 -0.466 387 HZ PHE 64 HZ PHE 64 -3.197 1.377 -2.180 388 H LEU 65 HN LEU 65 -5.129 0.776 5.390 389 HA LEU 65 HA LEU 65 -4.751 2.577 7.669 390 HB2 LEU 65 HB2 LEU 65 -6.162 -0.076 7.438 391 HB3 LEU 65 HB1 LEU 65 -5.966 0.805 8.941 392 HG LEU 65 HG LEU 65 -7.521 1.730 6.524 393 HD11 LEU 65 HD11 LEU 65 -9.466 1.456 7.926 394 HD12 LEU 65 HD12 LEU 65 -8.457 0.937 9.275 395 HD13 LEU 65 HD13 LEU 65 -8.581 -0.066 7.833 396 HD21 LEU 65 HD21 LEU 65 -7.030 3.065 9.181 397 HD22 LEU 65 HD22 LEU 65 -8.225 3.591 7.996 398 HD23 LEU 65 HD23 LEU 65 -6.509 3.634 7.596 399 H PHE 66 HN PHE 66 -3.086 2.405 8.920 400 HA PHE 66 HA PHE 66 -1.581 -0.125 9.008 401 HB2 PHE 66 HB2 PHE 66 -0.491 1.749 7.662 402 HB3 PHE 66 HB1 PHE 66 -0.351 2.629 9.177 403 HD1 PHE 66 HD1 PHE 66 0.550 -0.627 7.626 404 HD2 PHE 66 HD2 PHE 66 1.553 2.390 10.456 405 HE1 PHE 66 HE1 PHE 66 2.691 -1.756 8.066 406 HE2 PHE 66 HE2 PHE 66 3.693 1.266 10.902 407 HZ PHE 66 HZ PHE 66 4.263 -0.811 9.707 408 H GLU 67 HN GLU 67 -2.339 -0.841 10.937 409 HA GLU 67 HA GLU 67 -2.548 -1.056 13.179 410 HB2 GLU 67 HB2 GLU 67 -0.380 1.004 13.012 411 HB3 GLU 67 HB1 GLU 67 -1.034 0.532 14.575 412 HG2 GLU 67 HG2 GLU 67 0.052 -1.446 12.592 413 HG3 GLU 67 HG1 GLU 67 1.034 -0.683 13.842 414 H GLY 68 HN GLY 68 -4.231 0.885 11.652 415 HA2 GLY 68 HA2 GLY 68 -6.236 1.788 12.653 416 HA3 GLY 68 HA1 GLY 68 -5.258 2.320 14.012 417 H GLN 69 HN GLN 69 -3.149 3.303 12.143 418 HA GLN 69 HA GLN 69 -4.336 5.916 11.705 419 HB2 GLN 69 HB2 GLN 69 -1.501 4.903 11.479 420 HB3 GLN 69 HB1 GLN 69 -1.969 6.547 11.078 421 HG2 GLN 69 HG2 GLN 69 -2.924 6.643 13.455 422 HG3 GLN 69 HG1 GLN 69 -1.950 5.203 13.748 423 HE21 GLN 69 HE21 GLN 69 -1.744 7.900 14.882 424 HE22 GLN 69 HE22 GLN 69 -0.128 8.420 14.551 425 H ARG 70 HN ARG 70 -4.454 6.968 9.724 426 HA ARG 70 HA ARG 70 -4.433 5.160 7.433 427 HB2 ARG 70 HB2 ARG 70 -5.565 7.180 6.285 428 HB3 ARG 70 HB1 ARG 70 -6.484 6.259 7.463 429 HG2 ARG 70 HG2 ARG 70 -5.825 8.000 9.165 430 HG3 ARG 70 HG1 ARG 70 -5.216 8.959 7.813 431 HD2 ARG 70 HD2 ARG 70 -8.030 7.900 7.980 432 HD3 ARG 70 HD1 ARG 70 -7.560 9.503 8.537 433 HE ARG 70 HE ARG 70 -6.770 9.816 6.141 434 HH11 ARG 70 HH11 ARG 70 -9.482 7.746 7.041 435 HH12 ARG 70 HH12 ARG 70 -10.310 7.951 5.443 436 HH21 ARG 70 HH21 ARG 70 -7.806 10.113 4.128 437 HH22 ARG 70 HH22 ARG 70 -9.398 9.290 3.834 438 H ILE 71 HN ILE 71 -2.781 5.106 6.157 439 HA ILE 71 HA ILE 71 -0.487 6.668 6.380 440 HB ILE 71 HB ILE 71 -1.431 5.041 4.017 441 HG12 ILE 71 HG12 ILE 71 -1.264 3.705 6.044 442 HG13 ILE 71 HG11 ILE 71 0.065 3.299 4.960 443 HG21 ILE 71 HG21 ILE 71 0.900 4.962 3.332 444 HG22 ILE 71 HG22 ILE 71 1.346 6.007 4.681 445 HG23 ILE 71 HG23 ILE 71 0.320 6.625 3.387 446 HD11 ILE 71 HD11 ILE 71 1.521 4.807 6.299 447 HD12 ILE 71 HD12 ILE 71 0.904 3.417 7.190 448 HD13 ILE 71 HD13 ILE 71 0.186 5.009 7.433 449 H ALA 72 HN ALA 72 0.075 8.601 5.674 450 HA ALA 72 HA ALA 72 -1.737 10.103 3.970 451 HB1 ALA 72 HB1 ALA 72 -0.382 12.027 4.547 452 HB2 ALA 72 HB2 ALA 72 0.830 10.984 5.292 453 HB3 ALA 72 HB3 ALA 72 -0.776 11.124 6.009 454 H ASP 73 HN ASP 73 -0.649 11.516 2.251 455 HA ASP 73 HA ASP 73 0.731 9.733 0.454 456 HB2 ASP 73 HB2 ASP 73 -0.362 12.525 0.209 457 HB3 ASP 73 HB1 ASP 73 0.615 11.808 -1.068 458 H ASN 74 HN ASN 74 1.572 12.188 2.670 459 HA ASN 74 HA ASN 74 4.173 12.652 1.440 460 HB2 ASN 74 HB2 ASN 74 4.498 14.340 3.156 461 HB3 ASN 74 HB1 ASN 74 2.926 14.562 2.397 462 HD21 ASN 74 HD21 ASN 74 4.618 13.733 5.297 463 HD22 ASN 74 HD22 ASN 74 3.236 13.711 6.341 464 H HIS 75 HN HIS 75 2.978 10.222 3.166 465 HA HIS 75 HA HIS 75 5.021 9.999 5.198 466 HB2 HIS 75 HB2 HIS 75 2.666 8.353 4.362 467 HB3 HIS 75 HB1 HIS 75 3.939 7.595 5.312 468 HD2 HIS 75 HD2 HIS 75 4.285 10.514 7.119 469 HE1 HIS 75 HE1 HIS 75 0.510 9.186 8.488 470 HE2 HIS 75 HE2 HIS 75 2.383 10.852 8.846 471 H THR 76 HN THR 76 6.601 8.361 5.292 472 HA THR 76 HA THR 76 7.247 7.106 2.705 473 HB THR 76 HB THR 76 9.632 7.534 4.254 474 HG1 THR 76 HG1 THR 76 8.107 9.382 4.921 475 HG21 THR 76 HG21 THR 76 9.529 7.175 1.821 476 HG22 THR 76 HG22 THR 76 10.375 8.668 2.218 477 HG23 THR 76 HG23 THR 76 8.714 8.727 1.632 478 HA PRO 77 HA PRO 77 7.326 3.281 4.936 479 HB2 PRO 77 HB2 PRO 77 9.682 2.441 3.383 480 HB3 PRO 77 HB1 PRO 77 8.060 1.740 3.438 481 HG2 PRO 77 HG2 PRO 77 8.902 3.077 1.290 482 HG3 PRO 77 HG1 PRO 77 7.220 3.172 1.847 483 HD2 PRO 77 HD2 PRO 77 9.435 5.147 2.206 484 HD3 PRO 77 HD1 PRO 77 7.724 5.424 1.815 485 H LYS 78 HN LYS 78 9.969 5.399 5.013 486 HA LYS 78 HA LYS 78 11.681 3.803 6.673 487 HB2 LYS 78 HB2 LYS 78 12.520 5.606 5.162 488 HB3 LYS 78 HB1 LYS 78 11.742 6.790 6.200 489 HG2 LYS 78 HG2 LYS 78 14.071 6.712 6.727 490 HG3 LYS 78 HG1 LYS 78 13.168 6.020 8.074 491 HD2 LYS 78 HD2 LYS 78 15.035 4.609 7.731 492 HD3 LYS 78 HD1 LYS 78 13.644 3.754 7.063 493 HE2 LYS 78 HE2 LYS 78 14.268 4.441 4.820 494 HE3 LYS 78 HE1 LYS 78 15.610 5.389 5.460 495 HZ1 LYS 78 HZ1 LYS 78 16.398 3.284 4.636 496 HZ2 LYS 78 HZ2 LYS 78 15.315 2.441 5.620 497 HZ3 LYS 78 HZ3 LYS 78 16.575 3.325 6.316 498 H GLU 79 HN GLU 79 8.948 5.814 7.156 499 HA GLU 79 HA GLU 79 9.497 5.931 10.043 500 HB2 GLU 79 HB2 GLU 79 7.993 7.816 10.181 501 HB3 GLU 79 HB1 GLU 79 9.191 8.133 8.935 502 HG2 GLU 79 HG2 GLU 79 7.394 7.209 7.319 503 HG3 GLU 79 HG1 GLU 79 6.283 7.527 8.649 504 H LEU 80 HN LEU 80 7.191 6.142 11.216 505 HA LEU 80 HA LEU 80 5.266 5.148 11.883 506 HB2 LEU 80 HB2 LEU 80 5.168 4.133 9.047 507 HB3 LEU 80 HB1 LEU 80 3.891 3.888 10.221 508 HG LEU 80 HG LEU 80 4.771 6.681 9.674 509 HD11 LEU 80 HD11 LEU 80 3.229 6.815 7.772 510 HD12 LEU 80 HD12 LEU 80 3.005 5.067 7.844 511 HD13 LEU 80 HD13 LEU 80 4.587 5.738 7.450 512 HD21 LEU 80 HD21 LEU 80 2.107 5.387 10.238 513 HD22 LEU 80 HD22 LEU 80 2.391 7.118 10.056 514 HD23 LEU 80 HD23 LEU 80 3.119 6.242 11.403 515 H GLY 81 HN GLY 81 7.953 3.435 10.845 516 HA2 GLY 81 HA2 GLY 81 8.856 1.517 11.778 517 HA3 GLY 81 HA1 GLY 81 7.352 1.266 12.652 518 H MET 82 HN MET 82 8.218 1.456 9.192 519 HA MET 82 HA MET 82 6.522 -0.867 8.702 520 HB2 MET 82 HB2 MET 82 7.853 1.133 6.881 521 HB3 MET 82 HB1 MET 82 7.099 -0.331 6.266 522 HG2 MET 82 HG2 MET 82 4.980 0.389 7.359 523 HG3 MET 82 HG1 MET 82 5.768 1.913 7.757 524 HE1 MET 82 HE1 MET 82 3.052 1.392 6.100 525 HE2 MET 82 HE2 MET 82 3.168 2.562 4.788 526 HE3 MET 82 HE3 MET 82 3.585 3.041 6.433 527 H GLU 83 HN GLU 83 7.308 -2.835 8.538 528 HA GLU 83 HA GLU 83 10.142 -3.176 7.802 529 HB2 GLU 83 HB2 GLU 83 8.571 -4.460 10.023 530 HB3 GLU 83 HB1 GLU 83 10.000 -5.234 9.354 531 HG2 GLU 83 HG2 GLU 83 10.104 -2.411 10.334 532 HG3 GLU 83 HG1 GLU 83 10.244 -3.769 11.450 533 H GLU 84 HN GLU 84 10.485 -5.671 7.381 534 HA GLU 84 HA GLU 84 8.922 -6.314 5.093 535 HB2 GLU 84 HB2 GLU 84 11.239 -6.937 5.128 536 HB3 GLU 84 HB1 GLU 84 11.046 -7.811 6.638 537 HG2 GLU 84 HG2 GLU 84 11.292 -9.284 4.688 538 HG3 GLU 84 HG1 GLU 84 9.777 -9.531 5.554 539 H GLU 85 HN GLU 85 7.250 -7.687 4.871 540 HA GLU 85 HA GLU 85 5.591 -9.169 5.337 541 HB2 GLU 85 HB2 GLU 85 7.440 -9.794 7.581 542 HB3 GLU 85 HB1 GLU 85 5.772 -10.323 7.731 543 HG2 GLU 85 HG2 GLU 85 7.498 -10.963 5.357 544 HG3 GLU 85 HG1 GLU 85 7.367 -12.003 6.775 545 H ASP 86 HN ASP 86 5.849 -6.298 6.382 546 HA ASP 86 HA ASP 86 4.178 -6.204 8.696 547 HB2 ASP 86 HB2 ASP 86 5.745 -4.357 7.301 548 HB3 ASP 86 HB1 ASP 86 4.095 -3.768 7.128 549 H VAL 87 HN VAL 87 2.021 -5.751 8.859 550 HA VAL 87 HA VAL 87 0.453 -6.417 6.488 551 HB VAL 87 HB VAL 87 -0.300 -6.298 9.412 552 HG11 VAL 87 HG11 VAL 87 -2.442 -7.285 8.751 553 HG12 VAL 87 HG12 VAL 87 -1.995 -7.115 7.053 554 HG13 VAL 87 HG13 VAL 87 -2.226 -5.681 8.055 555 HG21 VAL 87 HG21 VAL 87 0.050 -8.615 7.512 556 HG22 VAL 87 HG22 VAL 87 -0.515 -8.735 9.176 557 HG23 VAL 87 HG23 VAL 87 1.124 -8.178 8.844 558 H ILE 88 HN ILE 88 -0.826 -5.041 5.462 559 HA ILE 88 HA ILE 88 -1.586 -2.518 6.743 560 HB ILE 88 HB ILE 88 0.274 -1.837 5.434 561 HG12 ILE 88 HG12 ILE 88 -2.151 -1.290 3.710 562 HG13 ILE 88 HG11 ILE 88 -1.795 -0.453 5.220 563 HG21 ILE 88 HG21 ILE 88 0.599 -2.387 3.091 564 HG22 ILE 88 HG22 ILE 88 -0.880 -3.344 3.094 565 HG23 ILE 88 HG23 ILE 88 0.500 -3.851 4.067 566 HD11 ILE 88 HD11 ILE 88 0.129 0.563 4.315 567 HD12 ILE 88 HD12 ILE 88 -1.133 0.732 3.096 568 HD13 ILE 88 HD13 ILE 88 0.118 -0.496 2.906 569 H GLU 89 HN GLU 89 -3.712 -2.176 6.557 570 HA GLU 89 HA GLU 89 -5.217 -3.901 4.728 571 HB2 GLU 89 HB2 GLU 89 -6.162 -2.217 7.057 572 HB3 GLU 89 HB1 GLU 89 -7.186 -3.259 6.077 573 HG2 GLU 89 HG2 GLU 89 -5.762 -5.186 6.796 574 HG3 GLU 89 HG1 GLU 89 -4.956 -4.086 7.912 575 H VAL 90 HN VAL 90 -6.971 -3.043 3.476 576 HA VAL 90 HA VAL 90 -6.857 -0.158 2.997 577 HB VAL 90 HB VAL 90 -5.400 -1.124 1.306 578 HG11 VAL 90 HG11 VAL 90 -7.760 -2.816 0.496 579 HG12 VAL 90 HG12 VAL 90 -6.271 -3.389 1.246 580 HG13 VAL 90 HG13 VAL 90 -6.229 -2.698 -0.375 581 HG21 VAL 90 HG21 VAL 90 -8.048 -0.260 0.151 582 HG22 VAL 90 HG22 VAL 90 -6.510 -0.277 -0.710 583 HG23 VAL 90 HG23 VAL 90 -6.736 0.800 0.667 584 H TYR 91 HN TYR 91 -8.807 0.718 2.946 585 HA TYR 91 HA TYR 91 -11.119 -0.918 2.150 586 HB2 TYR 91 HB2 TYR 91 -10.954 0.860 4.596 587 HB3 TYR 91 HB1 TYR 91 -12.440 0.148 3.981 588 HD1 TYR 91 HD1 TYR 91 -12.574 -2.412 3.875 589 HD2 TYR 91 HD2 TYR 91 -9.598 -0.329 6.088 590 HE1 TYR 91 HE1 TYR 91 -12.166 -4.433 5.216 591 HE2 TYR 91 HE2 TYR 91 -9.180 -2.344 7.436 592 HH TYR 91 HH TYR 91 -9.473 -4.726 7.349 593 H GLN 92 HN GLN 92 -12.986 0.405 1.475 594 HA GLN 92 HA GLN 92 -12.021 2.761 0.075 595 HB2 GLN 92 HB2 GLN 92 -13.397 1.049 -1.091 596 HB3 GLN 92 HB1 GLN 92 -14.753 1.483 -0.059 597 HG2 GLN 92 HG2 GLN 92 -14.873 3.663 -0.984 598 HG3 GLN 92 HG1 GLN 92 -13.337 3.460 -1.822 599 HE21 GLN 92 HE21 GLN 92 -16.706 2.592 -1.762 600 HE22 GLN 92 HE22 GLN 92 -16.788 2.001 -3.386 601 H GLU 93 HN GLU 93 -12.625 4.810 0.422 602 HA GLU 93 HA GLU 93 -13.690 5.515 2.971 603 HB2 GLU 93 HB2 GLU 93 -13.139 7.206 0.522 604 HB3 GLU 93 HB1 GLU 93 -13.503 7.837 2.122 605 HG2 GLU 93 HG2 GLU 93 -11.246 5.948 1.932 606 HG3 GLU 93 HG1 GLU 93 -11.020 7.528 1.188 607 H GLN 94 HN GLN 94 -15.555 7.047 3.194 608 HA GLN 94 HA GLN 94 -17.856 5.902 1.933 609 HB2 GLN 94 HB2 GLN 94 -17.822 6.693 4.304 610 HB3 GLN 94 HB1 GLN 94 -17.717 8.344 3.709 611 HG2 GLN 94 HG2 GLN 94 -19.873 8.156 2.662 612 HG3 GLN 94 HG1 GLN 94 -19.971 6.450 3.093 613 HE21 GLN 94 HE21 GLN 94 -20.363 5.877 5.230 614 HE22 GLN 94 HE22 GLN 94 -20.981 7.011 6.381 615 H THR 95 HN THR 95 -15.752 8.471 1.202 616 HA THR 95 HA THR 95 -17.524 10.204 -0.157 617 HB THR 95 HB THR 95 -15.134 10.606 -1.405 618 HG1 THR 95 HG1 THR 95 -13.496 10.106 0.032 619 HG21 THR 95 HG21 THR 95 -16.387 12.311 -0.206 620 HG22 THR 95 HG22 THR 95 -14.710 12.308 0.337 621 HG23 THR 95 HG23 THR 95 -15.961 11.570 1.335 622 H GLY 96 HN GLY 96 -15.724 7.343 -1.103 623 HA2 GLY 96 HA2 GLY 96 -16.410 5.905 -2.856 624 HA3 GLY 96 HA1 GLY 96 -17.262 7.253 -3.595 625 H GLY 97 HN GLY 97 -15.008 9.075 -3.353 626 HA2 GLY 97 HA2 GLY 97 -12.640 8.212 -4.468 627 HA3 GLY 97 HA1 GLY 97 -13.732 8.481 -5.822 628 H1 ASN 357 HT1 ASN 357 -4.650 -20.602 -4.212 629 H2 ASN 357 HT2 ASN 357 -4.197 -20.720 -2.587 630 H3 ASN 357 HT3 ASN 357 -3.209 -21.386 -3.788 631 HA ASN 357 HA ASN 357 -2.212 -19.388 -3.079 632 HB2 ASN 357 HB2 ASN 357 -2.257 -18.054 -5.186 633 HB3 ASN 357 HB1 ASN 357 -2.037 -19.778 -5.465 634 HD21 ASN 357 HD21 ASN 357 -4.047 -17.033 -5.998 635 HD22 ASN 357 HD22 ASN 357 -5.219 -17.827 -6.989 636 H ASN 358 HN ASN 358 -2.462 -17.652 -1.874 637 HA ASN 358 HA ASN 358 -4.983 -16.136 -2.089 638 HB2 ASN 358 HB2 ASN 358 -5.008 -15.822 0.304 639 HB3 ASN 358 HB1 ASN 358 -4.871 -17.545 -0.022 640 HD21 ASN 358 HD21 ASN 358 -4.058 -15.769 2.275 641 HD22 ASN 358 HD22 ASN 358 -2.405 -16.177 2.567 642 H ARG 359 HN ARG 359 -1.720 -16.067 -2.467 643 HA ARG 359 HA ARG 359 -1.525 -13.223 -1.775 644 HB2 ARG 359 HB2 ARG 359 0.998 -13.710 -1.946 645 HB3 ARG 359 HB1 ARG 359 0.125 -14.276 -0.531 646 HG2 ARG 359 HG2 ARG 359 -0.039 -16.509 -1.586 647 HG3 ARG 359 HG1 ARG 359 0.965 -15.916 -2.911 648 HD2 ARG 359 HD2 ARG 359 2.232 -17.174 -1.187 649 HD3 ARG 359 HD1 ARG 359 2.799 -15.522 -1.409 650 HE ARG 359 HE ARG 359 1.058 -15.261 0.629 651 HH11 ARG 359 HH11 ARG 359 3.742 -17.464 0.056 652 HH12 ARG 359 HH12 ARG 359 4.132 -17.620 1.813 653 HH21 ARG 359 HH21 ARG 359 1.538 -15.389 2.826 654 HH22 ARG 359 HH22 ARG 359 2.895 -16.455 3.364 655 H ASP 360 HN ASP 360 -0.413 -11.831 -3.173 656 HA ASP 360 HA ASP 360 0.148 -12.725 -5.884 657 HB2 ASP 360 HB2 ASP 360 -2.324 -12.060 -5.706 658 HB3 ASP 360 HB1 ASP 360 -1.742 -10.414 -5.466 659 HA PRO 361 HA PRO 361 3.194 -9.598 -4.675 660 HB2 PRO 361 HB2 PRO 361 4.961 -10.710 -6.643 661 HB3 PRO 361 HB1 PRO 361 5.052 -10.859 -4.885 662 HG2 PRO 361 HG2 PRO 361 4.513 -12.947 -6.582 663 HG3 PRO 361 HG1 PRO 361 4.062 -12.896 -4.868 664 HD2 PRO 361 HD2 PRO 361 2.387 -12.386 -7.281 665 HD3 PRO 361 HD1 PRO 361 1.967 -13.196 -5.756 666 H ILE 362 HN ILE 362 3.510 -7.629 -5.465 667 HA ILE 362 HA ILE 362 3.393 -7.198 -8.367 668 HB ILE 362 HB ILE 362 2.148 -5.205 -6.504 669 HG12 ILE 362 HG12 ILE 362 0.567 -7.342 -7.936 670 HG13 ILE 362 HG11 ILE 362 1.050 -7.484 -6.247 671 HG21 ILE 362 HG21 ILE 362 1.739 -5.818 -9.425 672 HG22 ILE 362 HG22 ILE 362 2.709 -4.498 -8.768 673 HG23 ILE 362 HG23 ILE 362 0.962 -4.518 -8.521 674 HD11 ILE 362 HD11 ILE 362 -0.649 -5.284 -7.389 675 HD12 ILE 362 HD12 ILE 362 -0.198 -5.485 -5.696 676 HD13 ILE 362 HD13 ILE 362 -1.239 -6.674 -6.480 677 H VAL 363 HN VAL 363 4.816 -5.703 -9.150 678 HA VAL 363 HA VAL 363 6.494 -4.300 -7.168 679 HB VAL 363 HB VAL 363 7.584 -4.949 -9.875 680 HG11 VAL 363 HG11 VAL 363 8.849 -3.509 -8.379 681 HG12 VAL 363 HG12 VAL 363 9.699 -5.035 -8.632 682 HG13 VAL 363 HG13 VAL 363 8.818 -4.750 -7.129 683 HG21 VAL 363 HG21 VAL 363 8.450 -7.102 -9.077 684 HG22 VAL 363 HG22 VAL 363 6.688 -7.091 -9.135 685 HG23 VAL 363 HG23 VAL 363 7.519 -6.920 -7.590 686 H ILE 364 HN ILE 364 7.276 -2.186 -7.830 687 HA ILE 364 HA ILE 364 5.644 -1.003 -9.981 688 HB ILE 364 HB ILE 364 5.584 1.091 -8.754 689 HG12 ILE 364 HG12 ILE 364 6.468 0.114 -6.169 690 HG13 ILE 364 HG11 ILE 364 7.768 0.036 -7.357 691 HG21 ILE 364 HG21 ILE 364 4.123 0.418 -6.906 692 HG22 ILE 364 HG22 ILE 364 4.690 -1.245 -7.073 693 HG23 ILE 364 HG23 ILE 364 3.782 -0.486 -8.382 694 HD11 ILE 364 HD11 ILE 364 7.490 2.397 -7.839 695 HD12 ILE 364 HD12 ILE 364 7.773 2.138 -6.119 696 HD13 ILE 364 HD13 ILE 364 6.144 2.486 -6.702 697 H SER 365 HN SER 365 6.568 1.166 -10.696 698 HA SER 365 HA SER 365 9.425 0.818 -11.237 699 HB2 SER 365 HB2 SER 365 7.624 2.764 -12.661 700 HB3 SER 365 HB1 SER 365 9.100 1.998 -13.244 701 HG SER 365 HG SER 365 7.939 0.000 -13.252 702 H ASP 366 HN ASP 366 10.905 2.316 -10.625 703 HA ASP 366 HA ASP 366 9.909 4.680 -9.163 704 HB2 ASP 366 HB2 ASP 366 10.976 3.161 -7.616 705 HB3 ASP 366 HB1 ASP 366 12.375 2.995 -8.669 706 H SER 367 HN SER 367 10.481 6.602 -9.964 707 HA SER 367 HA SER 367 12.961 6.861 -11.467 708 HB2 SER 367 HB2 SER 367 10.298 7.693 -12.653 709 HB3 SER 367 HB1 SER 367 11.884 7.908 -13.393 710 HG SER 367 HG SER 367 11.514 5.335 -12.669 711 HA PRO 368 HA PRO 368 12.681 10.445 -8.718 712 HB2 PRO 368 HB2 PRO 368 15.391 10.913 -9.795 713 HB3 PRO 368 HB1 PRO 368 14.862 10.739 -8.117 714 HG2 PRO 368 HG2 PRO 368 16.257 8.815 -9.326 715 HG3 PRO 368 HG1 PRO 368 14.973 8.444 -8.159 716 HD2 PRO 368 HD2 PRO 368 14.904 8.302 -11.142 717 HD3 PRO 368 HD1 PRO 368 14.195 7.204 -9.941 Start of MODEL 11 1 H TYR 21 HT1 TYR 21 13.994 -6.181 0.151 2 HA TYR 21 HA TYR 21 13.401 -3.925 -0.315 3 HB2 TYR 21 HB2 TYR 21 11.772 -5.237 -2.486 4 HB3 TYR 21 HB1 TYR 21 11.347 -3.648 -1.860 5 HD1 TYR 21 HD1 TYR 21 13.309 -1.888 -1.866 6 HD2 TYR 21 HD2 TYR 21 13.205 -5.376 -4.303 7 HE1 TYR 21 HE1 TYR 21 14.897 -0.843 -3.425 8 HE2 TYR 21 HE2 TYR 21 14.796 -4.338 -5.864 9 HH TYR 21 HH TYR 21 15.722 -2.334 -6.488 10 H ILE 22 HN ILE 22 11.499 -2.943 0.651 11 HA ILE 22 HA ILE 22 10.336 -4.619 2.633 12 HB ILE 22 HB ILE 22 9.595 -1.789 1.863 13 HG12 ILE 22 HG12 ILE 22 11.943 -1.981 2.548 14 HG13 ILE 22 HG11 ILE 22 11.010 -1.121 3.768 15 HG21 ILE 22 HG21 ILE 22 7.818 -2.885 3.110 16 HG22 ILE 22 HG22 ILE 22 8.600 -1.651 4.100 17 HG23 ILE 22 HG23 ILE 22 8.966 -3.357 4.363 18 HD11 ILE 22 HD11 ILE 22 12.538 -2.640 4.825 19 HD12 ILE 22 HD12 ILE 22 11.906 -3.991 3.884 20 HD13 ILE 22 HD13 ILE 22 10.887 -3.198 5.086 21 H LYS 23 HN LYS 23 8.703 -5.952 2.329 22 HA LYS 23 HA LYS 23 6.812 -5.398 0.153 23 HB2 LYS 23 HB2 LYS 23 8.144 -7.517 0.080 24 HB3 LYS 23 HB1 LYS 23 7.342 -8.016 1.560 25 HG2 LYS 23 HG2 LYS 23 5.163 -7.647 0.226 26 HG3 LYS 23 HG1 LYS 23 6.216 -7.719 -1.188 27 HD2 LYS 23 HD2 LYS 23 5.438 -9.925 -0.834 28 HD3 LYS 23 HD1 LYS 23 7.106 -9.895 -0.258 29 HE2 LYS 23 HE2 LYS 23 5.234 -9.182 1.832 30 HE3 LYS 23 HE1 LYS 23 4.869 -10.764 1.145 31 HZ1 LYS 23 HZ1 LYS 23 6.362 -11.082 2.926 32 HZ2 LYS 23 HZ2 LYS 23 7.427 -9.876 2.373 33 HZ3 LYS 23 HZ3 LYS 23 7.251 -11.325 1.506 34 H LEU 24 HN LEU 24 4.941 -4.595 0.766 35 HA LEU 24 HA LEU 24 3.992 -5.027 3.502 36 HB2 LEU 24 HB2 LEU 24 3.029 -3.149 1.341 37 HB3 LEU 24 HB1 LEU 24 2.340 -3.256 2.951 38 HG LEU 24 HG LEU 24 5.181 -2.422 2.333 39 HD11 LEU 24 HD11 LEU 24 3.581 -0.773 1.544 40 HD12 LEU 24 HD12 LEU 24 4.430 -0.183 2.974 41 HD13 LEU 24 HD13 LEU 24 2.777 -0.781 3.114 42 HD21 LEU 24 HD21 LEU 24 5.042 -3.441 4.507 43 HD22 LEU 24 HD22 LEU 24 3.604 -2.500 4.901 44 HD23 LEU 24 HD23 LEU 24 5.159 -1.692 4.707 45 H LYS 25 HN LYS 25 2.237 -6.209 3.966 46 HA LYS 25 HA LYS 25 0.970 -7.630 1.736 47 HB2 LYS 25 HB2 LYS 25 0.620 -8.230 4.668 48 HB3 LYS 25 HB1 LYS 25 0.339 -9.296 3.298 49 HG2 LYS 25 HG2 LYS 25 2.727 -9.383 2.854 50 HG3 LYS 25 HG1 LYS 25 3.027 -8.280 4.199 51 HD2 LYS 25 HD2 LYS 25 3.462 -10.431 5.046 52 HD3 LYS 25 HD1 LYS 25 1.865 -10.005 5.663 53 HE2 LYS 25 HE2 LYS 25 0.802 -11.341 3.965 54 HE3 LYS 25 HE1 LYS 25 2.355 -11.668 3.197 55 HZ1 LYS 25 HZ1 LYS 25 3.046 -12.905 5.121 56 HZ2 LYS 25 HZ2 LYS 25 1.553 -13.512 4.583 57 HZ3 LYS 25 HZ3 LYS 25 1.618 -12.512 5.944 58 H VAL 26 HN VAL 26 -0.670 -6.476 0.962 59 HA VAL 26 HA VAL 26 -2.393 -4.948 2.731 60 HB VAL 26 HB VAL 26 -3.004 -5.301 -0.175 61 HG11 VAL 26 HG11 VAL 26 -3.775 -3.026 -0.002 62 HG12 VAL 26 HG12 VAL 26 -3.117 -2.889 1.628 63 HG13 VAL 26 HG13 VAL 26 -4.466 -3.979 1.311 64 HG21 VAL 26 HG21 VAL 26 -0.779 -3.559 0.887 65 HG22 VAL 26 HG22 VAL 26 -1.436 -3.487 -0.749 66 HG23 VAL 26 HG23 VAL 26 -0.608 -4.942 -0.195 67 H ILE 27 HN ILE 27 -3.930 -5.962 3.782 68 HA ILE 27 HA ILE 27 -5.078 -8.414 2.706 69 HB ILE 27 HB ILE 27 -5.627 -7.087 5.360 70 HG12 ILE 27 HG12 ILE 27 -3.301 -7.662 5.306 71 HG13 ILE 27 HG11 ILE 27 -4.125 -8.881 6.269 72 HG21 ILE 27 HG21 ILE 27 -6.487 -9.294 6.014 73 HG22 ILE 27 HG22 ILE 27 -6.211 -9.876 4.372 74 HG23 ILE 27 HG23 ILE 27 -7.395 -8.604 4.670 75 HD11 ILE 27 HD11 ILE 27 -4.137 -10.340 4.240 76 HD12 ILE 27 HD12 ILE 27 -2.543 -9.989 4.907 77 HD13 ILE 27 HD13 ILE 27 -3.098 -9.147 3.460 78 H GLY 28 HN GLY 28 -6.806 -8.349 1.484 79 HA2 GLY 28 HA2 GLY 28 -8.524 -5.997 1.482 80 HA3 GLY 28 HA1 GLY 28 -8.592 -7.340 0.349 81 H GLN 29 HN GLN 29 -10.881 -6.266 1.481 82 HA GLN 29 HA GLN 29 -11.729 -7.644 3.801 83 HB2 GLN 29 HB2 GLN 29 -12.712 -5.517 2.844 84 HB3 GLN 29 HB1 GLN 29 -13.517 -6.516 1.646 85 HG2 GLN 29 HG2 GLN 29 -14.967 -5.902 3.534 86 HG3 GLN 29 HG1 GLN 29 -14.777 -7.646 3.350 87 HE21 GLN 29 HE21 GLN 29 -13.737 -8.806 4.925 88 HE22 GLN 29 HE22 GLN 29 -13.302 -8.135 6.462 89 H ASP 30 HN ASP 30 -11.359 -8.666 0.581 90 HA ASP 30 HA ASP 30 -13.320 -10.809 0.817 91 HB2 ASP 30 HB2 ASP 30 -12.864 -11.272 -1.509 92 HB3 ASP 30 HB1 ASP 30 -13.073 -9.535 -1.318 93 H SER 31 HN SER 31 -10.761 -10.572 2.406 94 HA SER 31 HA SER 31 -9.231 -11.969 3.326 95 HB2 SER 31 HB2 SER 31 -10.496 -14.188 1.708 96 HB3 SER 31 HB1 SER 31 -9.558 -14.349 3.192 97 HG SER 31 HG SER 31 -11.583 -12.674 3.639 98 H SER 32 HN SER 32 -8.456 -10.519 1.093 99 HA SER 32 HA SER 32 -6.808 -12.369 -0.472 100 HB2 SER 32 HB2 SER 32 -6.362 -10.139 -1.770 101 HB3 SER 32 HB1 SER 32 -7.908 -10.963 -1.977 102 HG SER 32 HG SER 32 -8.871 -9.288 -1.156 103 H GLU 33 HN GLU 33 -4.569 -12.134 -0.594 104 HA GLU 33 HA GLU 33 -3.375 -10.364 1.437 105 HB2 GLU 33 HB2 GLU 33 -3.320 -12.911 1.858 106 HB3 GLU 33 HB1 GLU 33 -2.155 -12.972 0.544 107 HG2 GLU 33 HG2 GLU 33 -0.792 -11.293 1.830 108 HG3 GLU 33 HG1 GLU 33 -1.883 -11.572 3.187 109 H ILE 34 HN ILE 34 -3.190 -8.759 -0.216 110 HA ILE 34 HA ILE 34 -1.721 -9.283 -2.625 111 HB ILE 34 HB ILE 34 -2.370 -6.608 -1.390 112 HG12 ILE 34 HG12 ILE 34 -4.423 -7.897 -1.694 113 HG13 ILE 34 HG11 ILE 34 -4.343 -6.582 -2.861 114 HG21 ILE 34 HG21 ILE 34 -0.688 -6.416 -3.080 115 HG22 ILE 34 HG22 ILE 34 -2.214 -5.810 -3.729 116 HG23 ILE 34 HG23 ILE 34 -1.631 -7.408 -4.190 117 HD11 ILE 34 HD11 ILE 34 -5.189 -8.612 -3.881 118 HD12 ILE 34 HD12 ILE 34 -3.719 -9.473 -3.418 119 HD13 ILE 34 HD13 ILE 34 -3.640 -8.155 -4.588 120 H HIS 35 HN HIS 35 0.413 -9.252 -2.909 121 HA HIS 35 HA HIS 35 2.095 -8.366 -0.678 122 HB2 HIS 35 HB2 HIS 35 2.530 -10.259 -2.977 123 HB3 HIS 35 HB1 HIS 35 3.894 -9.595 -2.085 124 HD2 HIS 35 HD2 HIS 35 0.802 -10.509 0.022 125 HE1 HIS 35 HE1 HIS 35 3.691 -13.559 0.516 126 HE2 HIS 35 HE2 HIS 35 1.363 -12.774 1.155 127 H PHE 36 HN PHE 36 2.019 -6.164 -1.061 128 HA PHE 36 HA PHE 36 2.805 -5.129 -3.651 129 HB2 PHE 36 HB2 PHE 36 1.017 -4.178 -2.017 130 HB3 PHE 36 HB1 PHE 36 2.393 -3.489 -1.168 131 HD1 PHE 36 HD1 PHE 36 2.194 -3.829 -4.840 132 HD2 PHE 36 HD2 PHE 36 1.831 -1.217 -1.496 133 HE1 PHE 36 HE1 PHE 36 2.148 -1.900 -6.361 134 HE2 PHE 36 HE2 PHE 36 1.784 0.717 -3.014 135 HZ PHE 36 HZ PHE 36 1.941 0.380 -5.450 136 H LYS 37 HN LYS 37 4.904 -5.040 -4.161 137 HA LYS 37 HA LYS 37 6.886 -4.851 -2.022 138 HB2 LYS 37 HB2 LYS 37 7.218 -6.488 -3.843 139 HB3 LYS 37 HB1 LYS 37 7.269 -5.171 -5.008 140 HG2 LYS 37 HG2 LYS 37 9.279 -4.301 -3.998 141 HG3 LYS 37 HG1 LYS 37 9.203 -5.522 -2.727 142 HD2 LYS 37 HD2 LYS 37 9.478 -6.139 -5.667 143 HD3 LYS 37 HD1 LYS 37 10.834 -6.033 -4.545 144 HE2 LYS 37 HE2 LYS 37 9.573 -7.787 -3.160 145 HE3 LYS 37 HE1 LYS 37 8.608 -8.043 -4.611 146 HZ1 LYS 37 HZ1 LYS 37 10.702 -8.489 -5.814 147 HZ2 LYS 37 HZ2 LYS 37 10.387 -9.607 -4.588 148 HZ3 LYS 37 HZ3 LYS 37 11.542 -8.394 -4.349 149 H VAL 38 HN VAL 38 7.461 -2.914 -1.322 150 HA VAL 38 HA VAL 38 7.269 -0.645 -3.170 151 HB VAL 38 HB VAL 38 7.119 0.818 -1.301 152 HG11 VAL 38 HG11 VAL 38 5.448 -1.628 -0.725 153 HG12 VAL 38 HG12 VAL 38 5.051 -0.345 -1.866 154 HG13 VAL 38 HG13 VAL 38 5.130 0.005 -0.140 155 HG21 VAL 38 HG21 VAL 38 7.752 -1.557 0.448 156 HG22 VAL 38 HG22 VAL 38 7.276 0.038 1.031 157 HG23 VAL 38 HG23 VAL 38 8.791 -0.162 0.150 158 H LYS 39 HN LYS 39 8.907 1.025 -3.038 159 HA LYS 39 HA LYS 39 11.576 -0.131 -2.780 160 HB2 LYS 39 HB2 LYS 39 10.761 1.126 -4.864 161 HB3 LYS 39 HB1 LYS 39 10.887 2.586 -3.895 162 HG2 LYS 39 HG2 LYS 39 13.280 2.103 -3.536 163 HG3 LYS 39 HG1 LYS 39 13.126 0.697 -4.592 164 HD2 LYS 39 HD2 LYS 39 12.457 2.142 -6.436 165 HD3 LYS 39 HD1 LYS 39 12.559 3.554 -5.385 166 HE2 LYS 39 HE2 LYS 39 14.937 3.221 -5.106 167 HE3 LYS 39 HE1 LYS 39 14.865 1.732 -6.048 168 HZ1 LYS 39 HZ1 LYS 39 15.673 3.638 -7.340 169 HZ2 LYS 39 HZ2 LYS 39 14.200 4.436 -7.102 170 HZ3 LYS 39 HZ3 LYS 39 14.250 2.994 -7.987 171 H MET 40 HN MET 40 12.759 0.276 -1.039 172 HA MET 40 HA MET 40 11.822 2.020 1.015 173 HB2 MET 40 HB2 MET 40 13.028 -0.151 1.384 174 HB3 MET 40 HB1 MET 40 14.501 0.637 0.840 175 HG2 MET 40 HG2 MET 40 14.345 0.517 3.278 176 HG3 MET 40 HG1 MET 40 14.410 2.178 2.693 177 HE1 MET 40 HE1 MET 40 13.695 2.372 5.422 178 HE2 MET 40 HE2 MET 40 13.250 0.672 5.580 179 HE3 MET 40 HE3 MET 40 12.086 1.929 5.994 180 H THR 41 HN THR 41 11.812 3.961 -0.355 181 HA THR 41 HA THR 41 13.632 5.857 0.365 182 HB THR 41 HB THR 41 15.282 4.477 -0.979 183 HG1 THR 41 HG1 THR 41 15.252 6.939 -0.596 184 HG21 THR 41 HG21 THR 41 13.681 5.558 -3.300 185 HG22 THR 41 HG22 THR 41 13.857 3.864 -2.846 186 HG23 THR 41 HG23 THR 41 15.255 4.770 -3.425 187 H THR 42 HN THR 42 11.356 4.642 -1.932 188 HA THR 42 HA THR 42 10.794 7.254 -3.062 189 HB THR 42 HB THR 42 9.324 4.656 -3.537 190 HG1 THR 42 HG1 THR 42 11.141 5.586 -5.428 191 HG21 THR 42 HG21 THR 42 8.136 6.692 -4.263 192 HG22 THR 42 HG22 THR 42 8.644 5.708 -5.637 193 HG23 THR 42 HG23 THR 42 9.545 7.163 -5.214 194 H HIS 43 HN HIS 43 8.954 8.448 -2.692 195 HA HIS 43 HA HIS 43 7.701 8.236 -0.179 196 HB2 HIS 43 HB2 HIS 43 7.557 10.010 -2.493 197 HB3 HIS 43 HB1 HIS 43 5.995 9.792 -1.710 198 HD2 HIS 43 HD2 HIS 43 6.554 10.023 1.335 199 HE1 HIS 43 HE1 HIS 43 8.934 13.394 0.408 200 HE2 HIS 43 HE2 HIS 43 7.497 12.287 2.177 201 H LEU 44 HN LEU 44 5.668 7.548 0.423 202 HA LEU 44 HA LEU 44 4.641 5.342 -1.023 203 HB2 LEU 44 HB2 LEU 44 3.662 6.833 1.392 204 HB3 LEU 44 HB1 LEU 44 2.782 5.473 0.715 205 HG LEU 44 HG LEU 44 5.647 5.325 1.661 206 HD11 LEU 44 HD11 LEU 44 3.137 4.433 3.064 207 HD12 LEU 44 HD12 LEU 44 4.142 5.808 3.522 208 HD13 LEU 44 HD13 LEU 44 4.791 4.171 3.616 209 HD21 LEU 44 HD21 LEU 44 5.185 2.877 1.616 210 HD22 LEU 44 HD22 LEU 44 5.180 3.639 0.025 211 HD23 LEU 44 HD23 LEU 44 3.656 3.229 0.812 212 H LYS 45 HN LYS 45 4.179 8.629 -1.452 213 HA LYS 45 HA LYS 45 1.491 8.814 -2.212 214 HB2 LYS 45 HB2 LYS 45 2.757 10.839 -2.012 215 HB3 LYS 45 HB1 LYS 45 3.956 10.279 -3.167 216 HG2 LYS 45 HG2 LYS 45 2.736 11.796 -4.406 217 HG3 LYS 45 HG1 LYS 45 1.990 10.257 -4.844 218 HD2 LYS 45 HD2 LYS 45 0.320 10.741 -2.971 219 HD3 LYS 45 HD1 LYS 45 0.958 12.385 -2.990 220 HE2 LYS 45 HE2 LYS 45 0.415 12.516 -5.406 221 HE3 LYS 45 HE1 LYS 45 -0.331 10.924 -5.294 222 HZ1 LYS 45 HZ1 LYS 45 -2.159 12.186 -4.941 223 HZ2 LYS 45 HZ2 LYS 45 -1.290 13.497 -4.324 224 HZ3 LYS 45 HZ3 LYS 45 -1.613 12.163 -3.335 225 H LYS 46 HN LYS 46 4.393 7.971 -4.027 226 HA LYS 46 HA LYS 46 3.126 7.557 -6.521 227 HB2 LYS 46 HB2 LYS 46 5.633 7.877 -6.002 228 HB3 LYS 46 HB1 LYS 46 5.642 6.160 -5.627 229 HG2 LYS 46 HG2 LYS 46 6.372 6.320 -7.847 230 HG3 LYS 46 HG1 LYS 46 4.689 5.795 -7.949 231 HD2 LYS 46 HD2 LYS 46 4.253 8.396 -8.065 232 HD3 LYS 46 HD1 LYS 46 5.917 8.410 -8.653 233 HE2 LYS 46 HE2 LYS 46 5.398 7.151 -10.531 234 HE3 LYS 46 HE1 LYS 46 3.910 6.526 -9.824 235 HZ1 LYS 46 HZ1 LYS 46 4.366 9.328 -10.683 236 HZ2 LYS 46 HZ2 LYS 46 2.936 8.726 -10.001 237 HZ3 LYS 46 HZ3 LYS 46 3.455 8.174 -11.521 238 H LEU 47 HN LEU 47 3.912 5.474 -3.806 239 HA LEU 47 HA LEU 47 3.234 3.008 -4.967 240 HB2 LEU 47 HB2 LEU 47 3.459 4.018 -2.159 241 HB3 LEU 47 HB1 LEU 47 2.782 2.432 -2.447 242 HG LEU 47 HG LEU 47 5.089 2.165 -1.897 243 HD11 LEU 47 HD11 LEU 47 5.936 0.993 -3.818 244 HD12 LEU 47 HD12 LEU 47 4.814 1.844 -4.875 245 HD13 LEU 47 HD13 LEU 47 4.202 0.714 -3.668 246 HD21 LEU 47 HD21 LEU 47 5.673 4.147 -4.094 247 HD22 LEU 47 HD22 LEU 47 6.886 3.184 -3.251 248 HD23 LEU 47 HD23 LEU 47 5.933 4.371 -2.363 249 H LYS 48 HN LYS 48 1.341 5.266 -3.000 250 HA LYS 48 HA LYS 48 -0.997 3.742 -2.829 251 HB2 LYS 48 HB2 LYS 48 -0.513 6.708 -2.670 252 HB3 LYS 48 HB1 LYS 48 -2.102 5.998 -2.427 253 HG2 LYS 48 HG2 LYS 48 -1.328 4.760 -0.525 254 HG3 LYS 48 HG1 LYS 48 0.336 5.270 -0.817 255 HD2 LYS 48 HD2 LYS 48 -0.514 6.626 0.951 256 HD3 LYS 48 HD1 LYS 48 -0.441 7.641 -0.490 257 HE2 LYS 48 HE2 LYS 48 -2.828 7.291 -0.865 258 HE3 LYS 48 HE1 LYS 48 -2.907 6.261 0.565 259 HZ1 LYS 48 HZ1 LYS 48 -2.196 8.180 1.898 260 HZ2 LYS 48 HZ2 LYS 48 -3.661 8.461 1.105 261 HZ3 LYS 48 HZ3 LYS 48 -2.235 9.157 0.508 262 H GLU 49 HN GLU 49 -0.178 6.341 -5.159 263 HA GLU 49 HA GLU 49 -2.654 6.123 -6.523 264 HB2 GLU 49 HB2 GLU 49 -1.596 7.475 -8.297 265 HB3 GLU 49 HB1 GLU 49 -1.408 8.168 -6.695 266 HG2 GLU 49 HG2 GLU 49 0.886 7.329 -6.608 267 HG3 GLU 49 HG1 GLU 49 0.691 6.645 -8.222 268 H SER 50 HN SER 50 0.473 4.565 -7.019 269 HA SER 50 HA SER 50 -0.214 3.430 -9.535 270 HB2 SER 50 HB2 SER 50 1.857 2.479 -7.547 271 HB3 SER 50 HB1 SER 50 1.770 2.041 -9.253 272 HG SER 50 HG SER 50 2.450 4.510 -8.075 273 H TYR 51 HN TYR 51 -0.605 2.415 -6.194 274 HA TYR 51 HA TYR 51 -1.311 -0.273 -6.725 275 HB2 TYR 51 HB2 TYR 51 -0.653 0.603 -4.478 276 HB3 TYR 51 HB1 TYR 51 -2.198 1.441 -4.388 277 HD1 TYR 51 HD1 TYR 51 -0.537 -1.829 -4.292 278 HD2 TYR 51 HD2 TYR 51 -4.251 0.219 -3.980 279 HE1 TYR 51 HE1 TYR 51 -1.562 -3.845 -3.329 280 HE2 TYR 51 HE2 TYR 51 -5.289 -1.788 -3.015 281 HH TYR 51 HH TYR 51 -4.905 -4.232 -2.997 282 H CYS 52 HN CYS 52 -3.160 2.721 -6.494 283 HA CYS 52 HA CYS 52 -5.736 1.623 -6.624 284 HB2 CYS 52 HB2 CYS 52 -4.787 4.275 -7.739 285 HB3 CYS 52 HB1 CYS 52 -6.456 3.845 -7.388 286 HG CYS 52 HG CYS 52 -3.985 4.118 -5.026 287 H GLN 53 HN GLN 53 -3.439 2.530 -9.135 288 HA GLN 53 HA GLN 53 -5.113 2.095 -11.354 289 HB2 GLN 53 HB2 GLN 53 -2.110 1.789 -11.218 290 HB3 GLN 53 HB1 GLN 53 -3.066 2.057 -12.668 291 HG2 GLN 53 HG2 GLN 53 -3.626 4.260 -11.999 292 HG3 GLN 53 HG1 GLN 53 -2.974 4.000 -10.382 293 HE21 GLN 53 HE21 GLN 53 -2.290 6.075 -12.232 294 HE22 GLN 53 HE22 GLN 53 -0.604 5.910 -12.573 295 H ARG 54 HN ARG 54 -3.042 -0.036 -9.478 296 HA ARG 54 HA ARG 54 -3.159 -2.292 -11.166 297 HB2 ARG 54 HB2 ARG 54 -1.480 -2.262 -9.492 298 HB3 ARG 54 HB1 ARG 54 -2.645 -1.953 -8.215 299 HG2 ARG 54 HG2 ARG 54 -1.903 -4.209 -8.024 300 HG3 ARG 54 HG1 ARG 54 -3.572 -4.234 -8.591 301 HD2 ARG 54 HD2 ARG 54 -2.861 -4.683 -10.837 302 HD3 ARG 54 HD1 ARG 54 -1.170 -4.456 -10.399 303 HE ARG 54 HE ARG 54 -1.321 -6.503 -9.103 304 HH11 ARG 54 HH11 ARG 54 -3.978 -5.857 -11.326 305 HH12 ARG 54 HH12 ARG 54 -4.386 -7.603 -11.519 306 HH21 ARG 54 HH21 ARG 54 -1.837 -8.735 -9.277 307 HH22 ARG 54 HH22 ARG 54 -3.207 -9.199 -10.362 308 H GLN 55 HN GLN 55 -5.256 -1.113 -8.604 309 HA GLN 55 HA GLN 55 -6.946 -3.442 -8.645 310 HB2 GLN 55 HB2 GLN 55 -7.429 -0.724 -7.407 311 HB3 GLN 55 HB1 GLN 55 -8.382 -2.170 -7.110 312 HG2 GLN 55 HG2 GLN 55 -5.548 -1.617 -6.290 313 HG3 GLN 55 HG1 GLN 55 -6.948 -1.906 -5.257 314 HE21 GLN 55 HE21 GLN 55 -7.785 -4.033 -5.123 315 HE22 GLN 55 HE22 GLN 55 -6.791 -5.399 -5.483 316 H GLY 56 HN GLY 56 -6.671 -0.563 -10.446 317 HA2 GLY 56 HA2 GLY 56 -7.786 -0.099 -12.444 318 HA3 GLY 56 HA1 GLY 56 -9.003 -1.293 -12.018 319 H VAL 57 HN VAL 57 -8.038 1.206 -9.777 320 HA VAL 57 HA VAL 57 -10.525 2.677 -10.351 321 HB VAL 57 HB VAL 57 -10.766 3.010 -7.839 322 HG11 VAL 57 HG11 VAL 57 -11.912 0.851 -7.502 323 HG12 VAL 57 HG12 VAL 57 -11.150 0.241 -8.972 324 HG13 VAL 57 HG13 VAL 57 -12.291 1.583 -9.061 325 HG21 VAL 57 HG21 VAL 57 -8.901 0.640 -7.766 326 HG22 VAL 57 HG22 VAL 57 -9.788 1.294 -6.390 327 HG23 VAL 57 HG23 VAL 57 -8.541 2.263 -7.178 328 HA PRO 58 HA PRO 58 -7.981 6.274 -9.982 329 HB2 PRO 58 HB2 PRO 58 -9.708 8.112 -8.991 330 HB3 PRO 58 HB1 PRO 58 -9.805 7.515 -10.654 331 HG2 PRO 58 HG2 PRO 58 -11.408 6.704 -8.271 332 HG3 PRO 58 HG1 PRO 58 -11.944 6.993 -9.940 333 HD2 PRO 58 HD2 PRO 58 -11.534 4.505 -8.954 334 HD3 PRO 58 HD1 PRO 58 -11.270 4.918 -10.659 335 H MET 59 HN MET 59 -7.156 7.897 -8.409 336 HA MET 59 HA MET 59 -6.634 6.635 -5.892 337 HB2 MET 59 HB2 MET 59 -5.040 8.120 -7.273 338 HB3 MET 59 HB1 MET 59 -5.919 9.480 -6.586 339 HG2 MET 59 HG2 MET 59 -5.321 8.731 -4.338 340 HG3 MET 59 HG1 MET 59 -4.439 7.370 -5.026 341 HE1 MET 59 HE1 MET 59 -3.200 9.463 -2.942 342 HE2 MET 59 HE2 MET 59 -1.598 9.675 -3.645 343 HE3 MET 59 HE3 MET 59 -2.333 8.072 -3.599 344 H ASN 60 HN ASN 60 -6.888 7.779 -3.815 345 HA ASN 60 HA ASN 60 -8.055 8.833 -2.189 346 HB2 ASN 60 HB2 ASN 60 -9.160 10.377 -4.528 347 HB3 ASN 60 HB1 ASN 60 -9.719 10.656 -2.883 348 HD21 ASN 60 HD21 ASN 60 -8.934 12.761 -2.876 349 HD22 ASN 60 HD22 ASN 60 -7.248 13.117 -2.783 350 H SER 61 HN SER 61 -9.086 6.503 -3.923 351 HA SER 61 HA SER 61 -11.912 6.591 -3.168 352 HB2 SER 61 HB2 SER 61 -12.021 4.461 -4.523 353 HB3 SER 61 HB1 SER 61 -11.522 5.879 -5.445 354 HG SER 61 HG SER 61 -9.699 4.925 -5.845 355 H LEU 62 HN LEU 62 -9.001 4.641 -2.809 356 HA LEU 62 HA LEU 62 -10.249 3.217 -0.572 357 HB2 LEU 62 HB2 LEU 62 -7.772 2.467 -2.118 358 HB3 LEU 62 HB1 LEU 62 -8.598 1.487 -0.925 359 HG LEU 62 HG LEU 62 -9.810 2.309 -3.564 360 HD11 LEU 62 HD11 LEU 62 -9.397 0.006 -4.271 361 HD12 LEU 62 HD12 LEU 62 -8.539 -0.306 -2.762 362 HD13 LEU 62 HD13 LEU 62 -7.890 0.852 -3.922 363 HD21 LEU 62 HD21 LEU 62 -11.475 1.852 -1.870 364 HD22 LEU 62 HD22 LEU 62 -10.681 0.330 -1.459 365 HD23 LEU 62 HD23 LEU 62 -11.437 0.532 -3.040 366 H ARG 63 HN ARG 63 -9.257 3.121 1.398 367 HA ARG 63 HA ARG 63 -7.001 4.969 1.792 368 HB2 ARG 63 HB2 ARG 63 -7.821 5.195 4.131 369 HB3 ARG 63 HB1 ARG 63 -8.958 5.790 2.932 370 HG2 ARG 63 HG2 ARG 63 -10.334 3.844 3.176 371 HG3 ARG 63 HG1 ARG 63 -9.132 3.071 4.215 372 HD2 ARG 63 HD2 ARG 63 -9.446 4.784 5.898 373 HD3 ARG 63 HD1 ARG 63 -10.585 5.633 4.858 374 HE ARG 63 HE ARG 63 -11.071 2.989 6.083 375 HH11 ARG 63 HH11 ARG 63 -13.923 5.749 5.259 376 HH12 ARG 63 HH12 ARG 63 -12.224 6.043 4.717 377 HH21 ARG 63 HH21 ARG 63 -13.218 2.600 6.751 378 HH22 ARG 63 HH22 ARG 63 -14.482 3.829 6.376 379 H PHE 64 HN PHE 64 -5.185 4.211 2.681 380 HA PHE 64 HA PHE 64 -5.077 1.361 3.313 381 HB2 PHE 64 HB2 PHE 64 -2.828 3.355 2.943 382 HB3 PHE 64 HB1 PHE 64 -2.643 1.617 3.149 383 HD1 PHE 64 HD1 PHE 64 -3.534 4.294 0.859 384 HD2 PHE 64 HD2 PHE 64 -3.260 0.079 1.359 385 HE1 PHE 64 HE1 PHE 64 -3.700 4.002 -1.579 386 HE2 PHE 64 HE2 PHE 64 -3.426 -0.224 -1.077 387 HZ PHE 64 HZ PHE 64 -3.647 1.739 -2.545 388 H LEU 65 HN LEU 65 -5.078 0.688 5.342 389 HA LEU 65 HA LEU 65 -4.486 2.641 7.462 390 HB2 LEU 65 HB2 LEU 65 -6.110 0.101 7.566 391 HB3 LEU 65 HB1 LEU 65 -5.782 1.135 8.941 392 HG LEU 65 HG LEU 65 -7.387 1.891 6.499 393 HD11 LEU 65 HD11 LEU 65 -9.242 2.005 8.128 394 HD12 LEU 65 HD12 LEU 65 -8.170 1.318 9.349 395 HD13 LEU 65 HD13 LEU 65 -8.597 0.378 7.917 396 HD21 LEU 65 HD21 LEU 65 -6.686 3.474 8.968 397 HD22 LEU 65 HD22 LEU 65 -7.909 3.945 7.787 398 HD23 LEU 65 HD23 LEU 65 -6.215 3.836 7.307 399 H PHE 66 HN PHE 66 -2.696 2.429 8.530 400 HA PHE 66 HA PHE 66 -1.470 -0.231 8.834 401 HB2 PHE 66 HB2 PHE 66 -0.279 1.203 7.132 402 HB3 PHE 66 HB1 PHE 66 0.058 2.352 8.420 403 HD1 PHE 66 HD1 PHE 66 0.895 -0.872 6.969 404 HD2 PHE 66 HD2 PHE 66 1.642 1.801 10.195 405 HE1 PHE 66 HE1 PHE 66 2.944 -2.115 7.517 406 HE2 PHE 66 HE2 PHE 66 3.692 0.562 10.753 407 HZ PHE 66 HZ PHE 66 4.345 -1.396 9.408 408 H GLU 67 HN GLU 67 -1.436 -0.736 10.915 409 HA GLU 67 HA GLU 67 -1.242 -0.624 13.169 410 HB2 GLU 67 HB2 GLU 67 0.369 1.705 12.281 411 HB3 GLU 67 HB1 GLU 67 -0.080 1.647 13.980 412 HG2 GLU 67 HG2 GLU 67 1.362 -0.534 12.490 413 HG3 GLU 67 HG1 GLU 67 2.119 0.658 13.547 414 H GLY 68 HN GLY 68 -3.504 0.724 11.632 415 HA2 GLY 68 HA2 GLY 68 -5.567 1.324 12.661 416 HA3 GLY 68 HA1 GLY 68 -4.663 2.037 13.989 417 H GLN 69 HN GLN 69 -2.832 3.290 11.907 418 HA GLN 69 HA GLN 69 -4.480 5.671 11.507 419 HB2 GLN 69 HB2 GLN 69 -1.520 5.146 11.471 420 HB3 GLN 69 HB1 GLN 69 -2.181 6.631 10.800 421 HG2 GLN 69 HG2 GLN 69 -3.377 6.745 13.142 422 HG3 GLN 69 HG1 GLN 69 -2.023 5.721 13.618 423 HE21 GLN 69 HE21 GLN 69 -1.128 7.306 14.922 424 HE22 GLN 69 HE22 GLN 69 -0.358 8.711 14.278 425 H ARG 70 HN ARG 70 -3.966 6.910 9.411 426 HA ARG 70 HA ARG 70 -4.100 4.971 7.210 427 HB2 ARG 70 HB2 ARG 70 -4.859 7.538 6.281 428 HB3 ARG 70 HB1 ARG 70 -5.867 6.112 6.473 429 HG2 ARG 70 HG2 ARG 70 -6.017 6.889 8.954 430 HG3 ARG 70 HG1 ARG 70 -5.529 8.447 8.289 431 HD2 ARG 70 HD2 ARG 70 -7.932 6.811 7.509 432 HD3 ARG 70 HD1 ARG 70 -7.934 8.346 8.374 433 HE ARG 70 HE ARG 70 -6.708 9.006 6.083 434 HH11 ARG 70 HH11 ARG 70 -9.697 7.277 6.772 435 HH12 ARG 70 HH12 ARG 70 -10.463 7.738 5.194 436 HH21 ARG 70 HH21 ARG 70 -7.660 9.636 4.091 437 HH22 ARG 70 HH22 ARG 70 -9.346 9.084 3.727 438 H ILE 71 HN ILE 71 -2.657 5.027 5.607 439 HA ILE 71 HA ILE 71 -0.203 6.373 5.983 440 HB ILE 71 HB ILE 71 -1.291 4.957 3.549 441 HG12 ILE 71 HG12 ILE 71 -1.068 3.479 5.453 442 HG13 ILE 71 HG11 ILE 71 0.213 3.127 4.297 443 HG21 ILE 71 HG21 ILE 71 0.970 4.872 2.704 444 HG22 ILE 71 HG22 ILE 71 1.558 5.763 4.109 445 HG23 ILE 71 HG23 ILE 71 0.485 6.549 2.951 446 HD11 ILE 71 HD11 ILE 71 1.736 4.531 5.687 447 HD12 ILE 71 HD12 ILE 71 1.149 3.068 6.477 448 HD13 ILE 71 HD13 ILE 71 0.448 4.633 6.887 449 H ALA 72 HN ALA 72 0.277 8.416 5.584 450 HA ALA 72 HA ALA 72 -1.498 10.099 4.071 451 HB1 ALA 72 HB1 ALA 72 0.023 11.899 4.687 452 HB2 ALA 72 HB2 ALA 72 1.180 10.720 5.308 453 HB3 ALA 72 HB3 ALA 72 -0.388 10.914 6.093 454 H ASP 73 HN ASP 73 -0.550 11.612 2.409 455 HA ASP 73 HA ASP 73 0.585 10.039 0.308 456 HB2 ASP 73 HB2 ASP 73 -0.379 12.858 0.572 457 HB3 ASP 73 HB1 ASP 73 0.610 12.419 -0.816 458 H ASN 74 HN ASN 74 1.773 12.299 2.639 459 HA ASN 74 HA ASN 74 4.371 12.456 1.304 460 HB2 ASN 74 HB2 ASN 74 4.900 14.181 2.993 461 HB3 ASN 74 HB1 ASN 74 3.453 14.579 2.077 462 HD21 ASN 74 HD21 ASN 74 4.447 15.325 4.803 463 HD22 ASN 74 HD22 ASN 74 3.133 14.957 5.869 464 H HIS 75 HN HIS 75 3.298 10.045 2.664 465 HA HIS 75 HA HIS 75 5.120 9.781 4.935 466 HB2 HIS 75 HB2 HIS 75 2.578 8.569 4.178 467 HB3 HIS 75 HB1 HIS 75 3.770 7.370 4.662 468 HD2 HIS 75 HD2 HIS 75 5.021 9.589 6.987 469 HE1 HIS 75 HE1 HIS 75 1.278 8.675 8.728 470 HE2 HIS 75 HE2 HIS 75 3.654 9.434 9.183 471 H THR 76 HN THR 76 6.551 8.010 5.110 472 HA THR 76 HA THR 76 7.209 6.588 2.630 473 HB THR 76 HB THR 76 9.677 7.139 3.847 474 HG1 THR 76 HG1 THR 76 8.154 8.983 4.723 475 HG21 THR 76 HG21 THR 76 8.606 8.667 1.496 476 HG22 THR 76 HG22 THR 76 8.983 6.946 1.393 477 HG23 THR 76 HG23 THR 76 10.252 8.104 1.791 478 HA PRO 77 HA PRO 77 7.616 3.124 5.398 479 HB2 PRO 77 HB2 PRO 77 9.939 2.165 3.860 480 HB3 PRO 77 HB1 PRO 77 8.352 1.418 4.075 481 HG2 PRO 77 HG2 PRO 77 9.087 2.474 1.733 482 HG3 PRO 77 HG1 PRO 77 7.410 2.540 2.312 483 HD2 PRO 77 HD2 PRO 77 9.493 4.684 2.314 484 HD3 PRO 77 HD1 PRO 77 7.757 4.794 1.960 485 H LYS 78 HN LYS 78 10.056 5.385 4.923 486 HA LYS 78 HA LYS 78 12.095 4.300 6.600 487 HB2 LYS 78 HB2 LYS 78 12.282 6.102 4.755 488 HB3 LYS 78 HB1 LYS 78 11.719 7.222 5.985 489 HG2 LYS 78 HG2 LYS 78 14.045 7.409 6.007 490 HG3 LYS 78 HG1 LYS 78 13.659 6.403 7.406 491 HD2 LYS 78 HD2 LYS 78 14.464 4.474 6.397 492 HD3 LYS 78 HD1 LYS 78 14.302 5.137 4.768 493 HE2 LYS 78 HE2 LYS 78 16.156 6.664 5.200 494 HE3 LYS 78 HE1 LYS 78 16.298 6.041 6.843 495 HZ1 LYS 78 HZ1 LYS 78 16.682 4.427 4.380 496 HZ2 LYS 78 HZ2 LYS 78 16.902 3.897 5.969 497 HZ3 LYS 78 HZ3 LYS 78 17.931 5.070 5.323 498 H GLU 79 HN GLU 79 9.108 5.854 7.192 499 HA GLU 79 HA GLU 79 9.907 6.369 9.980 500 HB2 GLU 79 HB2 GLU 79 8.188 8.112 10.066 501 HB3 GLU 79 HB1 GLU 79 9.371 8.452 8.809 502 HG2 GLU 79 HG2 GLU 79 7.582 7.160 7.328 503 HG3 GLU 79 HG1 GLU 79 6.502 7.761 8.586 504 H LEU 80 HN LEU 80 7.807 6.418 11.396 505 HA LEU 80 HA LEU 80 6.029 5.360 12.317 506 HB2 LEU 80 HB2 LEU 80 5.459 5.217 9.574 507 HB3 LEU 80 HB1 LEU 80 5.201 3.595 10.187 508 HG LEU 80 HG LEU 80 3.914 6.076 11.332 509 HD11 LEU 80 HD11 LEU 80 1.869 5.291 10.252 510 HD12 LEU 80 HD12 LEU 80 2.774 3.987 9.483 511 HD13 LEU 80 HD13 LEU 80 3.123 5.665 9.070 512 HD21 LEU 80 HD21 LEU 80 3.402 3.144 11.829 513 HD22 LEU 80 HD22 LEU 80 2.463 4.480 12.495 514 HD23 LEU 80 HD23 LEU 80 4.153 4.275 12.955 515 H GLY 81 HN GLY 81 7.512 3.041 10.053 516 HA2 GLY 81 HA2 GLY 81 9.091 1.439 11.192 517 HA3 GLY 81 HA1 GLY 81 7.773 1.171 12.324 518 H MET 82 HN MET 82 8.652 0.923 8.909 519 HA MET 82 HA MET 82 6.651 -1.218 8.624 520 HB2 MET 82 HB2 MET 82 7.894 0.537 6.492 521 HB3 MET 82 HB1 MET 82 6.728 -0.750 6.198 522 HG2 MET 82 HG2 MET 82 5.037 0.423 7.415 523 HG3 MET 82 HG1 MET 82 6.190 1.654 7.921 524 HE1 MET 82 HE1 MET 82 4.054 3.817 5.573 525 HE2 MET 82 HE2 MET 82 4.885 3.705 7.124 526 HE3 MET 82 HE3 MET 82 3.534 2.630 6.768 527 H GLU 83 HN GLU 83 7.430 -3.207 8.538 528 HA GLU 83 HA GLU 83 10.212 -3.583 7.619 529 HB2 GLU 83 HB2 GLU 83 8.645 -5.057 9.735 530 HB3 GLU 83 HB1 GLU 83 10.191 -5.609 9.114 531 HG2 GLU 83 HG2 GLU 83 11.140 -3.390 9.849 532 HG3 GLU 83 HG1 GLU 83 9.615 -3.123 10.692 533 H GLU 84 HN GLU 84 10.374 -6.211 7.346 534 HA GLU 84 HA GLU 84 8.914 -6.748 4.950 535 HB2 GLU 84 HB2 GLU 84 11.142 -7.586 5.074 536 HB3 GLU 84 HB1 GLU 84 10.843 -8.359 6.624 537 HG2 GLU 84 HG2 GLU 84 10.917 -10.083 5.035 538 HG3 GLU 84 HG1 GLU 84 9.217 -9.862 5.430 539 H GLU 85 HN GLU 85 7.246 -8.143 4.616 540 HA GLU 85 HA GLU 85 5.409 -9.404 5.022 541 HB2 GLU 85 HB2 GLU 85 7.174 -10.239 7.285 542 HB3 GLU 85 HB1 GLU 85 5.485 -10.728 7.302 543 HG2 GLU 85 HG2 GLU 85 7.344 -11.250 5.002 544 HG3 GLU 85 HG1 GLU 85 7.075 -12.385 6.324 545 H ASP 86 HN ASP 86 5.740 -6.601 6.080 546 HA ASP 86 HA ASP 86 4.167 -6.521 8.476 547 HB2 ASP 86 HB2 ASP 86 5.776 -4.685 7.115 548 HB3 ASP 86 HB1 ASP 86 4.145 -4.030 6.993 549 H VAL 87 HN VAL 87 2.029 -6.313 8.691 550 HA VAL 87 HA VAL 87 0.422 -6.676 6.305 551 HB VAL 87 HB VAL 87 -0.387 -6.739 9.216 552 HG11 VAL 87 HG11 VAL 87 -2.408 -7.875 8.415 553 HG12 VAL 87 HG12 VAL 87 -1.879 -7.627 6.753 554 HG13 VAL 87 HG13 VAL 87 -2.274 -6.241 7.767 555 HG21 VAL 87 HG21 VAL 87 0.213 -9.001 7.312 556 HG22 VAL 87 HG22 VAL 87 -0.391 -9.175 8.960 557 HG23 VAL 87 HG23 VAL 87 1.213 -8.497 8.676 558 H ILE 88 HN ILE 88 -0.902 -5.239 5.445 559 HA ILE 88 HA ILE 88 -1.610 -2.819 6.940 560 HB ILE 88 HB ILE 88 0.272 -2.259 5.414 561 HG12 ILE 88 HG12 ILE 88 -2.319 -1.046 4.446 562 HG13 ILE 88 HG11 ILE 88 -1.560 -0.627 5.976 563 HG21 ILE 88 HG21 ILE 88 0.002 -2.323 3.012 564 HG22 ILE 88 HG22 ILE 88 -1.611 -3.013 3.188 565 HG23 ILE 88 HG23 ILE 88 -0.197 -3.943 3.685 566 HD11 ILE 88 HD11 ILE 88 -1.005 1.031 4.352 567 HD12 ILE 88 HD12 ILE 88 -0.437 -0.197 3.222 568 HD13 ILE 88 HD13 ILE 88 0.446 0.099 4.719 569 H GLU 89 HN GLU 89 -3.684 -1.978 6.357 570 HA GLU 89 HA GLU 89 -5.297 -3.908 4.818 571 HB2 GLU 89 HB2 GLU 89 -6.173 -2.101 7.077 572 HB3 GLU 89 HB1 GLU 89 -7.203 -3.233 6.211 573 HG2 GLU 89 HG2 GLU 89 -5.969 -5.098 7.052 574 HG3 GLU 89 HG1 GLU 89 -4.764 -4.033 7.773 575 H VAL 90 HN VAL 90 -7.102 -3.080 3.621 576 HA VAL 90 HA VAL 90 -6.918 -0.239 2.930 577 HB VAL 90 HB VAL 90 -5.661 -1.480 1.221 578 HG11 VAL 90 HG11 VAL 90 -8.255 -2.934 0.723 579 HG12 VAL 90 HG12 VAL 90 -6.764 -3.632 1.357 580 HG13 VAL 90 HG13 VAL 90 -6.819 -3.028 -0.299 581 HG21 VAL 90 HG21 VAL 90 -8.284 -0.368 0.246 582 HG22 VAL 90 HG22 VAL 90 -6.858 -0.634 -0.757 583 HG23 VAL 90 HG23 VAL 90 -6.807 0.544 0.556 584 H TYR 91 HN TYR 91 -8.816 0.748 2.785 585 HA TYR 91 HA TYR 91 -11.261 -0.846 2.455 586 HB2 TYR 91 HB2 TYR 91 -10.621 1.073 4.677 587 HB3 TYR 91 HB1 TYR 91 -12.287 0.831 4.162 588 HD1 TYR 91 HD1 TYR 91 -13.368 -1.358 4.459 589 HD2 TYR 91 HD2 TYR 91 -9.444 -0.612 5.921 590 HE1 TYR 91 HE1 TYR 91 -13.526 -3.355 5.882 591 HE2 TYR 91 HE2 TYR 91 -9.590 -2.605 7.349 592 HH TYR 91 HH TYR 91 -11.994 -4.964 6.987 593 H GLN 92 HN GLN 92 -13.187 0.769 2.151 594 HA GLN 92 HA GLN 92 -12.308 2.678 0.110 595 HB2 GLN 92 HB2 GLN 92 -14.029 0.905 -0.420 596 HB3 GLN 92 HB1 GLN 92 -15.126 1.740 0.674 597 HG2 GLN 92 HG2 GLN 92 -14.401 3.789 -0.919 598 HG3 GLN 92 HG1 GLN 92 -14.257 2.443 -2.052 599 HE21 GLN 92 HE21 GLN 92 -16.405 4.347 -0.114 600 HE22 GLN 92 HE22 GLN 92 -17.881 3.747 -0.791 601 H GLU 93 HN GLU 93 -12.760 4.829 0.190 602 HA GLU 93 HA GLU 93 -13.310 5.969 2.755 603 HB2 GLU 93 HB2 GLU 93 -12.883 7.123 0.005 604 HB3 GLU 93 HB1 GLU 93 -13.324 8.142 1.368 605 HG2 GLU 93 HG2 GLU 93 -10.967 6.304 1.514 606 HG3 GLU 93 HG1 GLU 93 -10.845 7.895 0.762 607 H GLN 94 HN GLN 94 -15.074 7.429 3.250 608 HA GLN 94 HA GLN 94 -17.598 6.371 2.621 609 HB2 GLN 94 HB2 GLN 94 -16.644 8.827 4.019 610 HB3 GLN 94 HB1 GLN 94 -18.340 8.726 3.569 611 HG2 GLN 94 HG2 GLN 94 -18.420 6.529 4.781 612 HG3 GLN 94 HG1 GLN 94 -16.811 6.902 5.396 613 HE21 GLN 94 HE21 GLN 94 -16.552 8.574 6.858 614 HE22 GLN 94 HE22 GLN 94 -17.881 9.254 7.728 615 H THR 95 HN THR 95 -15.740 8.946 1.174 616 HA THR 95 HA THR 95 -17.909 10.037 -0.342 617 HB THR 95 HB THR 95 -15.681 10.946 -1.594 618 HG1 THR 95 HG1 THR 95 -13.962 10.776 -0.329 619 HG21 THR 95 HG21 THR 95 -17.361 12.383 -0.640 620 HG22 THR 95 HG22 THR 95 -15.790 12.861 0.004 621 HG23 THR 95 HG23 THR 95 -16.899 11.913 0.995 622 H GLY 96 HN GLY 96 -16.068 7.245 -0.661 623 HA2 GLY 96 HA2 GLY 96 -16.223 5.633 -2.329 624 HA3 GLY 96 HA1 GLY 96 -17.087 6.791 -3.331 625 H GLY 97 HN GLY 97 -15.177 8.867 -3.244 626 HA2 GLY 97 HA2 GLY 97 -12.564 8.354 -3.763 627 HA3 GLY 97 HA1 GLY 97 -13.372 7.935 -5.269 628 H1 ASN 357 HT1 ASN 357 -5.075 -20.279 -3.394 629 H2 ASN 357 HT2 ASN 357 -4.774 -19.981 -1.756 630 H3 ASN 357 HT3 ASN 357 -3.804 -21.074 -2.609 631 HA ASN 357 HA ASN 357 -2.668 -18.991 -2.271 632 HB2 ASN 357 HB2 ASN 357 -2.057 -18.537 -4.618 633 HB3 ASN 357 HB1 ASN 357 -2.137 -20.262 -4.297 634 HD21 ASN 357 HD21 ASN 357 -2.494 -18.469 -6.726 635 HD22 ASN 357 HD22 ASN 357 -3.957 -19.045 -7.445 636 H ASN 358 HN ASN 358 -2.964 -16.931 -1.761 637 HA ASN 358 HA ASN 358 -4.947 -15.384 -3.271 638 HB2 ASN 358 HB2 ASN 358 -5.747 -14.320 -1.161 639 HB3 ASN 358 HB1 ASN 358 -6.163 -16.023 -1.296 640 HD21 ASN 358 HD21 ASN 358 -6.480 -15.870 0.998 641 HD22 ASN 358 HD22 ASN 358 -5.129 -16.026 2.065 642 H ARG 359 HN ARG 359 -1.880 -15.626 -2.739 643 HA ARG 359 HA ARG 359 -1.417 -12.791 -2.119 644 HB2 ARG 359 HB2 ARG 359 1.001 -13.576 -1.808 645 HB3 ARG 359 HB1 ARG 359 -0.175 -14.041 -0.586 646 HG2 ARG 359 HG2 ARG 359 -0.359 -16.255 -1.642 647 HG3 ARG 359 HG1 ARG 359 0.880 -15.782 -2.805 648 HD2 ARG 359 HD2 ARG 359 1.765 -17.122 -0.911 649 HD3 ARG 359 HD1 ARG 359 2.508 -15.532 -1.055 650 HE ARG 359 HE ARG 359 0.631 -14.990 0.730 651 HH11 ARG 359 HH11 ARG 359 2.788 -17.785 0.531 652 HH12 ARG 359 HH12 ARG 359 2.811 -18.010 2.320 653 HH21 ARG 359 HH21 ARG 359 0.614 -15.291 2.969 654 HH22 ARG 359 HH22 ARG 359 1.627 -16.615 3.681 655 H ASP 360 HN ASP 360 -0.424 -11.474 -3.527 656 HA ASP 360 HA ASP 360 0.743 -12.564 -5.973 657 HB2 ASP 360 HB2 ASP 360 -1.638 -12.125 -6.486 658 HB3 ASP 360 HB1 ASP 360 -1.434 -10.456 -5.972 659 HA PRO 361 HA PRO 361 3.494 -9.246 -4.716 660 HB2 PRO 361 HB2 PRO 361 5.550 -9.889 -6.332 661 HB3 PRO 361 HB1 PRO 361 5.169 -10.824 -4.877 662 HG2 PRO 361 HG2 PRO 361 4.579 -11.457 -7.725 663 HG3 PRO 361 HG1 PRO 361 5.059 -12.539 -6.406 664 HD2 PRO 361 HD2 PRO 361 2.472 -12.230 -7.306 665 HD3 PRO 361 HD1 PRO 361 2.922 -12.828 -5.698 666 H ILE 362 HN ILE 362 3.429 -7.211 -5.388 667 HA ILE 362 HA ILE 362 3.395 -6.665 -8.279 668 HB ILE 362 HB ILE 362 1.795 -5.141 -6.223 669 HG12 ILE 362 HG12 ILE 362 0.534 -6.717 -8.424 670 HG13 ILE 362 HG11 ILE 362 1.112 -7.587 -7.005 671 HG21 ILE 362 HG21 ILE 362 0.796 -4.015 -8.141 672 HG22 ILE 362 HG22 ILE 362 1.825 -4.939 -9.235 673 HG23 ILE 362 HG23 ILE 362 2.545 -3.782 -8.117 674 HD11 ILE 362 HD11 ILE 362 -0.359 -6.437 -5.582 675 HD12 ILE 362 HD12 ILE 362 -1.310 -6.892 -6.998 676 HD13 ILE 362 HD13 ILE 362 -0.733 -5.236 -6.814 677 H VAL 363 HN VAL 363 4.744 -5.123 -8.984 678 HA VAL 363 HA VAL 363 6.154 -3.488 -6.975 679 HB VAL 363 HB VAL 363 7.471 -4.309 -9.549 680 HG11 VAL 363 HG11 VAL 363 8.480 -2.522 -8.217 681 HG12 VAL 363 HG12 VAL 363 9.521 -3.945 -8.281 682 HG13 VAL 363 HG13 VAL 363 8.574 -3.608 -6.831 683 HG21 VAL 363 HG21 VAL 363 8.531 -6.201 -8.376 684 HG22 VAL 363 HG22 VAL 363 6.790 -6.410 -8.559 685 HG23 VAL 363 HG23 VAL 363 7.462 -5.923 -7.004 686 H ILE 364 HN ILE 364 6.745 -1.356 -7.673 687 HA ILE 364 HA ILE 364 5.254 -0.448 -10.051 688 HB ILE 364 HB ILE 364 4.955 1.714 -8.989 689 HG12 ILE 364 HG12 ILE 364 5.858 0.858 -6.318 690 HG13 ILE 364 HG11 ILE 364 7.153 1.077 -7.489 691 HG21 ILE 364 HG21 ILE 364 3.203 0.151 -8.578 692 HG22 ILE 364 HG22 ILE 364 3.505 1.018 -7.072 693 HG23 ILE 364 HG23 ILE 364 4.117 -0.622 -7.285 694 HD11 ILE 364 HD11 ILE 364 6.469 3.350 -7.882 695 HD12 ILE 364 HD12 ILE 364 6.706 3.089 -6.154 696 HD13 ILE 364 HD13 ILE 364 5.075 3.146 -6.822 697 H SER 365 HN SER 365 6.126 1.780 -10.799 698 HA SER 365 HA SER 365 9.021 1.494 -11.132 699 HB2 SER 365 HB2 SER 365 7.295 3.340 -12.756 700 HB3 SER 365 HB1 SER 365 8.811 2.559 -13.204 701 HG SER 365 HG SER 365 7.167 0.606 -12.695 702 H ASP 366 HN ASP 366 10.208 2.712 -9.843 703 HA ASP 366 HA ASP 366 9.204 5.040 -8.515 704 HB2 ASP 366 HB2 ASP 366 10.794 3.833 -7.280 705 HB3 ASP 366 HB1 ASP 366 11.880 3.675 -8.652 706 H SER 367 HN SER 367 8.755 6.766 -9.735 707 HA SER 367 HA SER 367 10.931 7.877 -11.346 708 HB2 SER 367 HB2 SER 367 8.298 8.277 -12.568 709 HB3 SER 367 HB1 SER 367 9.824 7.800 -13.311 710 HG SER 367 HG SER 367 8.644 5.883 -11.707 711 HA PRO 368 HA PRO 368 9.245 11.318 -8.936 712 HB2 PRO 368 HB2 PRO 368 11.538 12.697 -8.730 713 HB3 PRO 368 HB1 PRO 368 11.233 11.261 -7.739 714 HG2 PRO 368 HG2 PRO 368 12.934 11.550 -10.159 715 HG3 PRO 368 HG1 PRO 368 13.191 10.563 -8.711 716 HD2 PRO 368 HD2 PRO 368 12.222 9.615 -11.129 717 HD3 PRO 368 HD1 PRO 368 12.041 8.805 -9.562 Start of MODEL 12 1 H TYR 21 HT1 TYR 21 14.689 -5.337 -0.629 2 HA TYR 21 HA TYR 21 13.402 -3.419 -1.140 3 HB2 TYR 21 HB2 TYR 21 11.842 -5.310 -2.913 4 HB3 TYR 21 HB1 TYR 21 11.335 -3.674 -2.513 5 HD1 TYR 21 HD1 TYR 21 12.631 -1.740 -3.361 6 HD2 TYR 21 HD2 TYR 21 13.501 -5.720 -4.586 7 HE1 TYR 21 HE1 TYR 21 13.907 -0.867 -5.273 8 HE2 TYR 21 HE2 TYR 21 14.780 -4.855 -6.501 9 HH TYR 21 HH TYR 21 14.885 -2.806 -7.870 10 H ILE 22 HN ILE 22 11.288 -2.963 -0.147 11 HA ILE 22 HA ILE 22 10.749 -4.898 1.966 12 HB ILE 22 HB ILE 22 9.775 -2.060 1.574 13 HG12 ILE 22 HG12 ILE 22 12.188 -2.330 2.142 14 HG13 ILE 22 HG11 ILE 22 11.272 -1.477 3.378 15 HG21 ILE 22 HG21 ILE 22 8.108 -3.384 2.763 16 HG22 ILE 22 HG22 ILE 22 8.865 -2.207 3.838 17 HG23 ILE 22 HG23 ILE 22 9.337 -3.904 3.916 18 HD11 ILE 22 HD11 ILE 22 12.842 -3.040 4.362 19 HD12 ILE 22 HD12 ILE 22 12.095 -4.370 3.478 20 HD13 ILE 22 HD13 ILE 22 11.182 -3.510 4.719 21 H LYS 23 HN LYS 23 9.077 -6.264 1.859 22 HA LYS 23 HA LYS 23 7.004 -5.720 -0.153 23 HB2 LYS 23 HB2 LYS 23 8.314 -7.835 -0.341 24 HB3 LYS 23 HB1 LYS 23 7.659 -8.330 1.214 25 HG2 LYS 23 HG2 LYS 23 5.378 -7.773 -0.094 26 HG3 LYS 23 HG1 LYS 23 6.399 -8.281 -1.442 27 HD2 LYS 23 HD2 LYS 23 5.329 -10.238 -0.653 28 HD3 LYS 23 HD1 LYS 23 6.991 -10.312 -0.064 29 HE2 LYS 23 HE2 LYS 23 5.248 -8.941 1.796 30 HE3 LYS 23 HE1 LYS 23 4.669 -10.567 1.441 31 HZ1 LYS 23 HZ1 LYS 23 6.102 -10.855 3.215 32 HZ2 LYS 23 HZ2 LYS 23 7.250 -9.743 2.626 33 HZ3 LYS 23 HZ3 LYS 23 7.067 -11.252 1.881 34 H LEU 24 HN LEU 24 5.117 -5.033 0.533 35 HA LEU 24 HA LEU 24 4.361 -5.475 3.341 36 HB2 LEU 24 HB2 LEU 24 3.273 -3.496 1.335 37 HB3 LEU 24 HB1 LEU 24 2.779 -3.623 3.013 38 HG LEU 24 HG LEU 24 5.576 -2.900 2.117 39 HD11 LEU 24 HD11 LEU 24 3.974 -1.178 1.451 40 HD12 LEU 24 HD12 LEU 24 5.003 -0.615 2.768 41 HD13 LEU 24 HD13 LEU 24 3.345 -1.117 3.099 42 HD21 LEU 24 HD21 LEU 24 5.506 -3.921 4.318 43 HD22 LEU 24 HD22 LEU 24 4.226 -2.816 4.816 44 HD23 LEU 24 HD23 LEU 24 5.838 -2.195 4.464 45 H LYS 25 HN LYS 25 2.418 -6.401 3.884 46 HA LYS 25 HA LYS 25 1.066 -7.850 1.718 47 HB2 LYS 25 HB2 LYS 25 0.771 -8.275 4.694 48 HB3 LYS 25 HB1 LYS 25 0.232 -9.341 3.409 49 HG2 LYS 25 HG2 LYS 25 2.271 -10.256 3.121 50 HG3 LYS 25 HG1 LYS 25 3.116 -8.741 3.445 51 HD2 LYS 25 HD2 LYS 25 3.651 -10.186 5.242 52 HD3 LYS 25 HD1 LYS 25 2.461 -9.045 5.871 53 HE2 LYS 25 HE2 LYS 25 1.738 -11.106 6.674 54 HE3 LYS 25 HE1 LYS 25 0.724 -10.826 5.263 55 HZ1 LYS 25 HZ1 LYS 25 1.938 -12.364 4.004 56 HZ2 LYS 25 HZ2 LYS 25 1.733 -13.109 5.510 57 HZ3 LYS 25 HZ3 LYS 25 3.223 -12.409 5.114 58 H VAL 26 HN VAL 26 -0.508 -6.611 0.896 59 HA VAL 26 HA VAL 26 -2.147 -4.955 2.638 60 HB VAL 26 HB VAL 26 -2.731 -5.347 -0.277 61 HG11 VAL 26 HG11 VAL 26 -3.433 -3.010 -0.132 62 HG12 VAL 26 HG12 VAL 26 -2.933 -2.963 1.560 63 HG13 VAL 26 HG13 VAL 26 -4.262 -4.010 1.061 64 HG21 VAL 26 HG21 VAL 26 -0.536 -3.587 0.820 65 HG22 VAL 26 HG22 VAL 26 -1.141 -3.553 -0.836 66 HG23 VAL 26 HG23 VAL 26 -0.330 -4.994 -0.225 67 H ILE 27 HN ILE 27 -3.748 -5.890 3.695 68 HA ILE 27 HA ILE 27 -4.982 -8.312 2.615 69 HB ILE 27 HB ILE 27 -5.434 -7.028 5.309 70 HG12 ILE 27 HG12 ILE 27 -3.085 -7.665 5.067 71 HG13 ILE 27 HG11 ILE 27 -3.905 -8.741 6.195 72 HG21 ILE 27 HG21 ILE 27 -6.325 -9.224 5.938 73 HG22 ILE 27 HG22 ILE 27 -6.066 -9.797 4.290 74 HG23 ILE 27 HG23 ILE 27 -7.234 -8.515 4.601 75 HD11 ILE 27 HD11 ILE 27 -4.104 -10.416 4.396 76 HD12 ILE 27 HD12 ILE 27 -2.433 -10.008 4.781 77 HD13 ILE 27 HD13 ILE 27 -3.192 -9.346 3.335 78 H GLY 28 HN GLY 28 -6.722 -8.135 1.425 79 HA2 GLY 28 HA2 GLY 28 -8.368 -5.735 1.545 80 HA3 GLY 28 HA1 GLY 28 -8.488 -7.025 0.357 81 H GLN 29 HN GLN 29 -10.784 -6.060 1.368 82 HA GLN 29 HA GLN 29 -11.738 -7.286 3.716 83 HB2 GLN 29 HB2 GLN 29 -12.805 -5.338 2.645 84 HB3 GLN 29 HB1 GLN 29 -13.290 -6.349 1.295 85 HG2 GLN 29 HG2 GLN 29 -15.159 -6.005 2.763 86 HG3 GLN 29 HG1 GLN 29 -14.667 -7.697 2.819 87 HE21 GLN 29 HE21 GLN 29 -13.740 -8.513 4.691 88 HE22 GLN 29 HE22 GLN 29 -13.808 -7.670 6.201 89 H ASP 30 HN ASP 30 -11.381 -8.423 0.466 90 HA ASP 30 HA ASP 30 -13.097 -10.728 0.859 91 HB2 ASP 30 HB2 ASP 30 -12.283 -11.322 -1.469 92 HB3 ASP 30 HB1 ASP 30 -13.163 -9.803 -1.338 93 H SER 31 HN SER 31 -10.555 -10.226 2.410 94 HA SER 31 HA SER 31 -8.817 -11.377 3.275 95 HB2 SER 31 HB2 SER 31 -10.573 -13.627 2.326 96 HB3 SER 31 HB1 SER 31 -9.060 -13.930 3.179 97 HG SER 31 HG SER 31 -11.451 -12.850 4.108 98 H SER 32 HN SER 32 -7.982 -10.247 1.112 99 HA SER 32 HA SER 32 -6.531 -12.292 -0.414 100 HB2 SER 32 HB2 SER 32 -6.144 -9.957 -1.789 101 HB3 SER 32 HB1 SER 32 -7.427 -11.116 -2.138 102 HG SER 32 HG SER 32 -8.826 -9.685 -1.528 103 H GLU 33 HN GLU 33 -4.310 -12.238 -0.453 104 HA GLU 33 HA GLU 33 -3.069 -10.266 1.340 105 HB2 GLU 33 HB2 GLU 33 -2.950 -12.779 1.874 106 HB3 GLU 33 HB1 GLU 33 -1.823 -12.881 0.528 107 HG2 GLU 33 HG2 GLU 33 -0.366 -11.253 1.635 108 HG3 GLU 33 HG1 GLU 33 -1.489 -11.188 2.991 109 H ILE 34 HN ILE 34 -2.814 -8.685 -0.227 110 HA ILE 34 HA ILE 34 -1.451 -9.258 -2.700 111 HB ILE 34 HB ILE 34 -1.950 -6.531 -1.516 112 HG12 ILE 34 HG12 ILE 34 -4.067 -7.775 -1.548 113 HG13 ILE 34 HG11 ILE 34 -4.072 -6.489 -2.749 114 HG21 ILE 34 HG21 ILE 34 -0.438 -6.540 -3.391 115 HG22 ILE 34 HG22 ILE 34 -1.981 -5.843 -3.881 116 HG23 ILE 34 HG23 ILE 34 -1.576 -7.496 -4.341 117 HD11 ILE 34 HD11 ILE 34 -5.088 -8.489 -3.637 118 HD12 ILE 34 HD12 ILE 34 -3.632 -9.417 -3.273 119 HD13 ILE 34 HD13 ILE 34 -3.583 -8.144 -4.491 120 H HIS 35 HN HIS 35 0.664 -9.354 -2.963 121 HA HIS 35 HA HIS 35 2.404 -8.441 -0.793 122 HB2 HIS 35 HB2 HIS 35 2.712 -10.448 -3.010 123 HB3 HIS 35 HB1 HIS 35 4.134 -9.784 -2.209 124 HD2 HIS 35 HD2 HIS 35 1.200 -10.376 0.170 125 HE1 HIS 35 HE1 HIS 35 3.873 -13.634 0.557 126 HE2 HIS 35 HE2 HIS 35 1.762 -12.559 1.465 127 H PHE 36 HN PHE 36 2.373 -6.232 -1.282 128 HA PHE 36 HA PHE 36 3.234 -5.383 -3.921 129 HB2 PHE 36 HB2 PHE 36 1.499 -4.237 -2.261 130 HB3 PHE 36 HB1 PHE 36 2.957 -3.451 -1.666 131 HD1 PHE 36 HD1 PHE 36 4.519 -2.533 -3.661 132 HD2 PHE 36 HD2 PHE 36 0.312 -3.132 -3.866 133 HE1 PHE 36 HE1 PHE 36 4.383 -0.899 -5.492 134 HE2 PHE 36 HE2 PHE 36 0.163 -1.494 -5.701 135 HZ PHE 36 HZ PHE 36 2.203 -0.378 -6.516 136 H LYS 37 HN LYS 37 5.272 -5.207 -4.458 137 HA LYS 37 HA LYS 37 7.335 -5.131 -2.395 138 HB2 LYS 37 HB2 LYS 37 7.314 -6.513 -4.640 139 HB3 LYS 37 HB1 LYS 37 7.896 -5.008 -5.339 140 HG2 LYS 37 HG2 LYS 37 9.787 -5.035 -3.774 141 HG3 LYS 37 HG1 LYS 37 9.215 -6.576 -3.134 142 HD2 LYS 37 HD2 LYS 37 9.979 -6.086 -6.014 143 HD3 LYS 37 HD1 LYS 37 11.040 -6.809 -4.806 144 HE2 LYS 37 HE2 LYS 37 9.333 -8.600 -4.476 145 HE3 LYS 37 HE1 LYS 37 8.415 -7.910 -5.815 146 HZ1 LYS 37 HZ1 LYS 37 9.700 -9.661 -6.697 147 HZ2 LYS 37 HZ2 LYS 37 11.106 -9.152 -5.913 148 HZ3 LYS 37 HZ3 LYS 37 10.474 -8.241 -7.188 149 H VAL 38 HN VAL 38 7.629 -3.144 -1.542 150 HA VAL 38 HA VAL 38 7.442 -0.823 -3.314 151 HB VAL 38 HB VAL 38 7.155 0.553 -1.396 152 HG11 VAL 38 HG11 VAL 38 5.568 -1.982 -0.991 153 HG12 VAL 38 HG12 VAL 38 5.177 -0.692 -2.127 154 HG13 VAL 38 HG13 VAL 38 5.140 -0.378 -0.393 155 HG21 VAL 38 HG21 VAL 38 7.779 -1.871 0.292 156 HG22 VAL 38 HG22 VAL 38 7.251 -0.303 0.904 157 HG23 VAL 38 HG23 VAL 38 8.805 -0.450 0.084 158 H LYS 39 HN LYS 39 8.929 0.958 -2.936 159 HA LYS 39 HA LYS 39 11.681 0.000 -2.808 160 HB2 LYS 39 HB2 LYS 39 10.327 1.779 -4.470 161 HB3 LYS 39 HB1 LYS 39 11.271 2.823 -3.422 162 HG2 LYS 39 HG2 LYS 39 13.289 1.460 -4.055 163 HG3 LYS 39 HG1 LYS 39 12.275 0.682 -5.275 164 HD2 LYS 39 HD2 LYS 39 11.757 2.953 -6.181 165 HD3 LYS 39 HD1 LYS 39 12.942 3.616 -5.056 166 HE2 LYS 39 HE2 LYS 39 14.597 1.988 -6.115 167 HE3 LYS 39 HE1 LYS 39 13.394 1.781 -7.388 168 HZ1 LYS 39 HZ1 LYS 39 15.025 4.123 -6.740 169 HZ2 LYS 39 HZ2 LYS 39 13.478 4.390 -7.376 170 HZ3 LYS 39 HZ3 LYS 39 14.612 3.480 -8.251 171 H MET 40 HN MET 40 12.888 0.339 -1.026 172 HA MET 40 HA MET 40 11.820 1.890 1.156 173 HB2 MET 40 HB2 MET 40 13.127 -0.312 1.327 174 HB3 MET 40 HB1 MET 40 14.567 0.655 1.051 175 HG2 MET 40 HG2 MET 40 14.073 0.169 3.444 176 HG3 MET 40 HG1 MET 40 14.231 1.882 3.058 177 HE1 MET 40 HE1 MET 40 13.092 1.768 5.696 178 HE2 MET 40 HE2 MET 40 12.684 0.060 5.541 179 HE3 MET 40 HE3 MET 40 11.430 1.232 5.946 180 H THR 41 HN THR 41 11.901 3.799 -0.443 181 HA THR 41 HA THR 41 13.760 5.658 0.513 182 HB THR 41 HB THR 41 15.384 4.473 -0.897 183 HG1 THR 41 HG1 THR 41 14.686 7.111 -1.235 184 HG21 THR 41 HG21 THR 41 13.907 3.563 -2.595 185 HG22 THR 41 HG22 THR 41 15.175 4.529 -3.349 186 HG23 THR 41 HG23 THR 41 13.548 5.187 -3.183 187 H THR 42 HN THR 42 11.451 4.693 -1.920 188 HA THR 42 HA THR 42 10.862 7.434 -2.660 189 HB THR 42 HB THR 42 9.256 5.041 -3.528 190 HG1 THR 42 HG1 THR 42 11.227 5.620 -5.285 191 HG21 THR 42 HG21 THR 42 8.445 7.232 -4.217 192 HG22 THR 42 HG22 THR 42 9.063 6.348 -5.612 193 HG23 THR 42 HG23 THR 42 10.027 7.633 -4.885 194 H HIS 43 HN HIS 43 8.882 8.457 -2.293 195 HA HIS 43 HA HIS 43 7.685 7.979 0.218 196 HB2 HIS 43 HB2 HIS 43 6.689 9.689 -2.073 197 HB3 HIS 43 HB1 HIS 43 6.116 9.770 -0.411 198 HD2 HIS 43 HD2 HIS 43 7.860 10.986 1.405 199 HE1 HIS 43 HE1 HIS 43 10.481 12.428 -1.591 200 HE2 HIS 43 HE2 HIS 43 9.940 12.451 0.886 201 H LEU 44 HN LEU 44 5.489 7.430 0.681 202 HA LEU 44 HA LEU 44 4.617 5.134 -0.718 203 HB2 LEU 44 HB2 LEU 44 3.432 6.783 1.485 204 HB3 LEU 44 HB1 LEU 44 2.544 5.446 0.775 205 HG LEU 44 HG LEU 44 5.313 5.063 1.882 206 HD11 LEU 44 HD11 LEU 44 2.743 4.709 3.402 207 HD12 LEU 44 HD12 LEU 44 3.866 6.048 3.632 208 HD13 LEU 44 HD13 LEU 44 4.377 4.397 3.987 209 HD21 LEU 44 HD21 LEU 44 4.556 2.745 2.105 210 HD22 LEU 44 HD22 LEU 44 4.446 3.307 0.437 211 HD23 LEU 44 HD23 LEU 44 2.991 3.194 1.427 212 H LYS 45 HN LYS 45 4.198 8.381 -1.405 213 HA LYS 45 HA LYS 45 1.622 8.553 -2.449 214 HB2 LYS 45 HB2 LYS 45 3.004 10.522 -2.219 215 HB3 LYS 45 HB1 LYS 45 4.201 9.873 -3.329 216 HG2 LYS 45 HG2 LYS 45 3.000 11.494 -4.537 217 HG3 LYS 45 HG1 LYS 45 2.400 9.933 -5.105 218 HD2 LYS 45 HD2 LYS 45 0.524 10.166 -3.459 219 HD3 LYS 45 HD1 LYS 45 1.083 11.809 -3.150 220 HE2 LYS 45 HE2 LYS 45 0.702 12.411 -5.456 221 HE3 LYS 45 HE1 LYS 45 0.253 10.753 -5.849 222 HZ1 LYS 45 HZ1 LYS 45 -1.801 11.064 -5.091 223 HZ2 LYS 45 HZ2 LYS 45 -1.467 12.721 -5.130 224 HZ3 LYS 45 HZ3 LYS 45 -1.284 11.853 -3.684 225 H LYS 46 HN LYS 46 4.639 7.503 -3.942 226 HA LYS 46 HA LYS 46 3.616 7.013 -6.529 227 HB2 LYS 46 HB2 LYS 46 6.050 7.290 -5.817 228 HB3 LYS 46 HB1 LYS 46 5.980 5.623 -5.266 229 HG2 LYS 46 HG2 LYS 46 6.939 5.535 -7.398 230 HG3 LYS 46 HG1 LYS 46 5.264 5.028 -7.628 231 HD2 LYS 46 HD2 LYS 46 4.956 7.643 -8.034 232 HD3 LYS 46 HD1 LYS 46 6.647 7.497 -8.510 233 HE2 LYS 46 HE2 LYS 46 6.162 6.281 -10.361 234 HE3 LYS 46 HE1 LYS 46 4.791 5.470 -9.599 235 HZ1 LYS 46 HZ1 LYS 46 4.872 8.174 -10.798 236 HZ2 LYS 46 HZ2 LYS 46 3.619 7.682 -9.768 237 HZ3 LYS 46 HZ3 LYS 46 3.889 6.866 -11.228 238 H LEU 47 HN LEU 47 3.806 5.072 -3.627 239 HA LEU 47 HA LEU 47 3.165 2.597 -4.931 240 HB2 LEU 47 HB2 LEU 47 3.261 3.423 -2.036 241 HB3 LEU 47 HB1 LEU 47 2.785 1.813 -2.540 242 HG LEU 47 HG LEU 47 5.007 1.505 -2.018 243 HD11 LEU 47 HD11 LEU 47 4.517 0.817 -4.357 244 HD12 LEU 47 HD12 LEU 47 6.220 1.130 -4.027 245 HD13 LEU 47 HD13 LEU 47 5.254 2.321 -4.900 246 HD21 LEU 47 HD21 LEU 47 5.493 4.257 -3.118 247 HD22 LEU 47 HD22 LEU 47 6.802 3.142 -2.732 248 HD23 LEU 47 HD23 LEU 47 5.701 3.679 -1.466 249 H LYS 48 HN LYS 48 1.386 4.930 -2.944 250 HA LYS 48 HA LYS 48 -1.036 3.515 -2.845 251 HB2 LYS 48 HB2 LYS 48 -0.412 6.450 -2.602 252 HB3 LYS 48 HB1 LYS 48 -2.037 5.813 -2.402 253 HG2 LYS 48 HG2 LYS 48 -1.342 4.491 -0.513 254 HG3 LYS 48 HG1 LYS 48 0.340 4.956 -0.764 255 HD2 LYS 48 HD2 LYS 48 -0.489 6.296 1.015 256 HD3 LYS 48 HD1 LYS 48 -0.370 7.340 -0.402 257 HE2 LYS 48 HE2 LYS 48 -2.824 6.852 -0.796 258 HE3 LYS 48 HE1 LYS 48 -2.840 6.115 0.806 259 HZ1 LYS 48 HZ1 LYS 48 -2.225 8.194 1.780 260 HZ2 LYS 48 HZ2 LYS 48 -3.557 8.464 0.775 261 HZ3 LYS 48 HZ3 LYS 48 -2.007 8.914 0.257 262 H GLU 49 HN GLU 49 0.072 5.994 -5.152 263 HA GLU 49 HA GLU 49 -2.364 6.115 -6.576 264 HB2 GLU 49 HB2 GLU 49 -1.138 7.315 -8.287 265 HB3 GLU 49 HB1 GLU 49 -0.643 7.873 -6.697 266 HG2 GLU 49 HG2 GLU 49 1.385 6.560 -6.837 267 HG3 GLU 49 HG1 GLU 49 0.879 5.919 -8.399 268 H SER 50 HN SER 50 0.517 4.117 -7.008 269 HA SER 50 HA SER 50 -0.345 2.982 -9.464 270 HB2 SER 50 HB2 SER 50 1.655 1.881 -7.483 271 HB3 SER 50 HB1 SER 50 1.513 1.450 -9.187 272 HG SER 50 HG SER 50 2.550 3.767 -8.002 273 H TYR 51 HN TYR 51 -0.798 2.118 -6.079 274 HA TYR 51 HA TYR 51 -1.750 -0.502 -6.502 275 HB2 TYR 51 HB2 TYR 51 -1.087 0.392 -4.273 276 HB3 TYR 51 HB1 TYR 51 -2.530 1.400 -4.279 277 HD1 TYR 51 HD1 TYR 51 -1.373 -2.120 -4.315 278 HD2 TYR 51 HD2 TYR 51 -4.613 0.530 -3.566 279 HE1 TYR 51 HE1 TYR 51 -2.652 -3.974 -3.329 280 HE2 TYR 51 HE2 TYR 51 -5.901 -1.316 -2.576 281 HH TYR 51 HH TYR 51 -5.936 -3.852 -2.774 282 H CYS 52 HN CYS 52 -3.319 2.643 -6.505 283 HA CYS 52 HA CYS 52 -5.984 1.759 -6.641 284 HB2 CYS 52 HB2 CYS 52 -4.792 4.292 -7.797 285 HB3 CYS 52 HB1 CYS 52 -6.495 4.014 -7.443 286 HG CYS 52 HG CYS 52 -3.962 4.267 -5.153 287 H GLN 53 HN GLN 53 -3.570 2.419 -9.132 288 HA GLN 53 HA GLN 53 -5.225 2.064 -11.382 289 HB2 GLN 53 HB2 GLN 53 -2.276 1.419 -11.175 290 HB3 GLN 53 HB1 GLN 53 -3.177 1.761 -12.646 291 HG2 GLN 53 HG2 GLN 53 -3.443 4.037 -12.059 292 HG3 GLN 53 HG1 GLN 53 -2.853 3.753 -10.421 293 HE21 GLN 53 HE21 GLN 53 -1.872 5.630 -12.396 294 HE22 GLN 53 HE22 GLN 53 -0.211 5.231 -12.664 295 H ARG 54 HN ARG 54 -3.323 -0.173 -9.448 296 HA ARG 54 HA ARG 54 -3.685 -2.467 -11.047 297 HB2 ARG 54 HB2 ARG 54 -1.964 -2.283 -9.296 298 HB3 ARG 54 HB1 ARG 54 -3.219 -2.268 -8.066 299 HG2 ARG 54 HG2 ARG 54 -2.469 -4.452 -8.027 300 HG3 ARG 54 HG1 ARG 54 -3.905 -4.548 -9.045 301 HD2 ARG 54 HD2 ARG 54 -2.663 -4.812 -10.987 302 HD3 ARG 54 HD1 ARG 54 -1.214 -4.104 -10.275 303 HE ARG 54 HE ARG 54 -2.016 -6.559 -9.021 304 HH11 ARG 54 HH11 ARG 54 -0.270 -5.162 -11.742 305 HH12 ARG 54 HH12 ARG 54 0.827 -6.579 -11.914 306 HH21 ARG 54 HH21 ARG 54 -0.623 -8.372 -9.188 307 HH22 ARG 54 HH22 ARG 54 0.632 -8.369 -10.495 308 H GLN 55 HN GLN 55 -5.527 -1.122 -8.354 309 HA GLN 55 HA GLN 55 -7.393 -3.274 -8.200 310 HB2 GLN 55 HB2 GLN 55 -7.436 -0.447 -7.145 311 HB3 GLN 55 HB1 GLN 55 -8.741 -1.590 -6.860 312 HG2 GLN 55 HG2 GLN 55 -5.875 -1.923 -6.011 313 HG3 GLN 55 HG1 GLN 55 -7.228 -1.493 -4.966 314 HE21 GLN 55 HE21 GLN 55 -8.825 -3.059 -4.530 315 HE22 GLN 55 HE22 GLN 55 -8.494 -4.745 -4.716 316 H GLY 56 HN GLY 56 -7.175 -0.331 -10.037 317 HA2 GLY 56 HA2 GLY 56 -8.318 0.015 -12.069 318 HA3 GLY 56 HA1 GLY 56 -9.525 -1.159 -11.566 319 H VAL 57 HN VAL 57 -8.433 1.392 -9.461 320 HA VAL 57 HA VAL 57 -10.892 2.915 -9.968 321 HB VAL 57 HB VAL 57 -11.070 3.252 -7.446 322 HG11 VAL 57 HG11 VAL 57 -12.351 1.180 -7.106 323 HG12 VAL 57 HG12 VAL 57 -11.633 0.512 -8.572 324 HG13 VAL 57 HG13 VAL 57 -12.686 1.922 -8.671 325 HG21 VAL 57 HG21 VAL 57 -9.347 0.775 -7.410 326 HG22 VAL 57 HG22 VAL 57 -10.152 1.498 -6.016 327 HG23 VAL 57 HG23 VAL 57 -8.866 2.374 -6.847 328 HA PRO 58 HA PRO 58 -8.236 6.437 -9.740 329 HB2 PRO 58 HB2 PRO 58 -9.878 8.247 -8.477 330 HB3 PRO 58 HB1 PRO 58 -9.973 7.847 -10.195 331 HG2 PRO 58 HG2 PRO 58 -11.652 6.858 -7.946 332 HG3 PRO 58 HG1 PRO 58 -12.120 7.279 -9.605 333 HD2 PRO 58 HD2 PRO 58 -11.829 4.724 -8.811 334 HD3 PRO 58 HD1 PRO 58 -11.438 5.258 -10.459 335 H MET 59 HN MET 59 -7.110 7.850 -8.237 336 HA MET 59 HA MET 59 -6.478 6.515 -5.807 337 HB2 MET 59 HB2 MET 59 -4.921 7.931 -7.263 338 HB3 MET 59 HB1 MET 59 -5.664 9.331 -6.505 339 HG2 MET 59 HG2 MET 59 -4.968 8.492 -4.307 340 HG3 MET 59 HG1 MET 59 -4.191 7.122 -5.095 341 HE1 MET 59 HE1 MET 59 -2.541 8.835 -3.092 342 HE2 MET 59 HE2 MET 59 -1.048 9.045 -4.006 343 HE3 MET 59 HE3 MET 59 -1.899 7.501 -4.052 344 H ASN 60 HN ASN 60 -6.658 7.322 -3.689 345 HA ASN 60 HA ASN 60 -7.533 8.410 -1.903 346 HB2 ASN 60 HB2 ASN 60 -8.317 10.261 -4.035 347 HB3 ASN 60 HB1 ASN 60 -9.429 10.240 -2.669 348 HD21 ASN 60 HD21 ASN 60 -8.910 12.209 -1.853 349 HD22 ASN 60 HD22 ASN 60 -7.362 12.598 -1.186 350 H SER 61 HN SER 61 -9.246 6.725 -4.229 351 HA SER 61 HA SER 61 -11.819 6.752 -2.966 352 HB2 SER 61 HB2 SER 61 -10.684 4.702 -4.884 353 HB3 SER 61 HB1 SER 61 -12.384 4.963 -4.508 354 HG SER 61 HG SER 61 -11.289 7.274 -5.293 355 H LEU 62 HN LEU 62 -8.875 4.977 -2.629 356 HA LEU 62 HA LEU 62 -10.140 3.196 -0.660 357 HB2 LEU 62 HB2 LEU 62 -7.538 2.780 -2.136 358 HB3 LEU 62 HB1 LEU 62 -8.308 1.647 -1.044 359 HG LEU 62 HG LEU 62 -9.453 2.530 -3.691 360 HD11 LEU 62 HD11 LEU 62 -8.863 0.290 -4.460 361 HD12 LEU 62 HD12 LEU 62 -8.095 -0.043 -2.909 362 HD13 LEU 62 HD13 LEU 62 -7.433 1.198 -3.973 363 HD21 LEU 62 HD21 LEU 62 -11.182 1.909 -2.103 364 HD22 LEU 62 HD22 LEU 62 -10.334 0.405 -1.741 365 HD23 LEU 62 HD23 LEU 62 -11.019 0.668 -3.345 366 H ARG 63 HN ARG 63 -9.407 3.199 1.385 367 HA ARG 63 HA ARG 63 -7.312 5.150 2.032 368 HB2 ARG 63 HB2 ARG 63 -8.232 5.109 4.325 369 HB3 ARG 63 HB1 ARG 63 -9.426 5.598 3.131 370 HG2 ARG 63 HG2 ARG 63 -10.580 3.564 3.287 371 HG3 ARG 63 HG1 ARG 63 -9.232 2.765 4.100 372 HD2 ARG 63 HD2 ARG 63 -9.585 4.056 6.085 373 HD3 ARG 63 HD1 ARG 63 -10.789 5.059 5.278 374 HE ARG 63 HE ARG 63 -11.140 2.331 6.249 375 HH11 ARG 63 HH11 ARG 63 -14.143 4.574 4.721 376 HH12 ARG 63 HH12 ARG 63 -12.433 5.151 4.583 377 HH21 ARG 63 HH21 ARG 63 -13.294 1.581 6.462 378 HH22 ARG 63 HH22 ARG 63 -14.625 2.588 5.778 379 H PHE 64 HN PHE 64 -5.469 4.541 2.948 380 HA PHE 64 HA PHE 64 -5.009 1.686 3.336 381 HB2 PHE 64 HB2 PHE 64 -3.193 4.064 2.994 382 HB3 PHE 64 HB1 PHE 64 -2.578 2.511 3.543 383 HD1 PHE 64 HD1 PHE 64 -4.390 4.157 0.756 384 HD2 PHE 64 HD2 PHE 64 -2.038 0.841 2.014 385 HE1 PHE 64 HE1 PHE 64 -4.168 3.433 -1.582 386 HE2 PHE 64 HE2 PHE 64 -1.813 0.112 -0.324 387 HZ PHE 64 HZ PHE 64 -2.877 1.411 -2.124 388 H LEU 65 HN LEU 65 -5.172 0.878 5.314 389 HA LEU 65 HA LEU 65 -4.812 2.688 7.604 390 HB2 LEU 65 HB2 LEU 65 -6.261 0.047 7.402 391 HB3 LEU 65 HB1 LEU 65 -6.053 0.954 8.888 392 HG LEU 65 HG LEU 65 -7.598 1.856 6.458 393 HD11 LEU 65 HD11 LEU 65 -9.546 1.645 7.879 394 HD12 LEU 65 HD12 LEU 65 -8.536 1.122 9.226 395 HD13 LEU 65 HD13 LEU 65 -8.693 0.103 7.797 396 HD21 LEU 65 HD21 LEU 65 -6.596 3.782 7.460 397 HD22 LEU 65 HD22 LEU 65 -7.027 3.232 9.077 398 HD23 LEU 65 HD23 LEU 65 -8.288 3.738 7.956 399 H PHE 66 HN PHE 66 -2.995 2.552 8.649 400 HA PHE 66 HA PHE 66 -1.705 -0.064 8.982 401 HB2 PHE 66 HB2 PHE 66 -0.620 1.243 7.107 402 HB3 PHE 66 HB1 PHE 66 -0.189 2.463 8.298 403 HD1 PHE 66 HD1 PHE 66 0.382 -0.992 7.206 404 HD2 PHE 66 HD2 PHE 66 1.629 2.137 9.796 405 HE1 PHE 66 HE1 PHE 66 2.435 -2.245 7.718 406 HE2 PHE 66 HE2 PHE 66 3.687 0.891 10.318 407 HZ PHE 66 HZ PHE 66 4.092 -1.304 9.276 408 H GLU 67 HN GLU 67 -1.328 -0.420 11.074 409 HA GLU 67 HA GLU 67 -1.001 -0.115 13.300 410 HB2 GLU 67 HB2 GLU 67 0.313 2.300 12.139 411 HB3 GLU 67 HB1 GLU 67 0.035 2.264 13.874 412 HG2 GLU 67 HG2 GLU 67 1.419 0.028 12.441 413 HG3 GLU 67 HG1 GLU 67 2.283 1.445 13.037 414 H GLY 68 HN GLY 68 -3.428 0.953 11.791 415 HA2 GLY 68 HA2 GLY 68 -5.495 1.585 12.693 416 HA3 GLY 68 HA1 GLY 68 -4.660 2.202 14.113 417 H GLN 69 HN GLN 69 -2.867 3.436 11.773 418 HA GLN 69 HA GLN 69 -4.400 5.936 11.738 419 HB2 GLN 69 HB2 GLN 69 -1.488 5.492 11.060 420 HB3 GLN 69 HB1 GLN 69 -2.297 7.043 11.245 421 HG2 GLN 69 HG2 GLN 69 -2.775 6.332 13.637 422 HG3 GLN 69 HG1 GLN 69 -1.612 5.034 13.365 423 HE21 GLN 69 HE21 GLN 69 -1.465 7.247 15.223 424 HE22 GLN 69 HE22 GLN 69 -0.029 8.123 14.828 425 H ARG 70 HN ARG 70 -4.127 7.275 9.739 426 HA ARG 70 HA ARG 70 -4.626 5.576 7.411 427 HB2 ARG 70 HB2 ARG 70 -4.953 8.553 7.418 428 HB3 ARG 70 HB1 ARG 70 -5.831 7.349 6.488 429 HG2 ARG 70 HG2 ARG 70 -6.352 6.852 9.225 430 HG3 ARG 70 HG1 ARG 70 -6.549 8.582 8.945 431 HD2 ARG 70 HD2 ARG 70 -7.916 6.328 7.483 432 HD3 ARG 70 HD1 ARG 70 -8.660 7.495 8.575 433 HE ARG 70 HE ARG 70 -7.468 8.934 6.523 434 HH11 ARG 70 HH11 ARG 70 -10.103 6.634 6.984 435 HH12 ARG 70 HH12 ARG 70 -10.983 7.186 5.499 436 HH21 ARG 70 HH21 ARG 70 -8.579 9.689 4.697 437 HH22 ARG 70 HH22 ARG 70 -10.160 8.919 4.250 438 H ILE 71 HN ILE 71 -3.083 5.288 5.941 439 HA ILE 71 HA ILE 71 -0.566 6.597 6.135 440 HB ILE 71 HB ILE 71 -1.716 4.819 3.985 441 HG12 ILE 71 HG12 ILE 71 -1.316 3.721 6.132 442 HG13 ILE 71 HG11 ILE 71 -0.172 3.152 4.921 443 HG21 ILE 71 HG21 ILE 71 0.523 4.646 3.059 444 HG22 ILE 71 HG22 ILE 71 1.111 5.818 4.237 445 HG23 ILE 71 HG23 ILE 71 -0.050 6.313 3.006 446 HD11 ILE 71 HD11 ILE 71 1.482 4.783 5.870 447 HD12 ILE 71 HD12 ILE 71 1.026 3.450 6.929 448 HD13 ILE 71 HD13 ILE 71 0.340 5.054 7.186 449 H ALA 72 HN ALA 72 -0.102 8.562 5.507 450 HA ALA 72 HA ALA 72 -1.818 9.956 3.628 451 HB1 ALA 72 HB1 ALA 72 -0.583 11.940 4.242 452 HB2 ALA 72 HB2 ALA 72 0.600 10.966 5.115 453 HB3 ALA 72 HB3 ALA 72 -1.062 11.064 5.698 454 H ASP 73 HN ASP 73 -0.863 11.237 1.886 455 HA ASP 73 HA ASP 73 0.709 9.624 0.169 456 HB2 ASP 73 HB2 ASP 73 -0.435 12.381 0.038 457 HB3 ASP 73 HB1 ASP 73 0.754 11.893 -1.163 458 H ASN 74 HN ASN 74 1.522 12.012 2.502 459 HA ASN 74 HA ASN 74 4.170 12.451 1.353 460 HB2 ASN 74 HB2 ASN 74 4.450 14.177 3.020 461 HB3 ASN 74 HB1 ASN 74 2.865 14.370 2.282 462 HD21 ASN 74 HD21 ASN 74 4.599 13.882 5.171 463 HD22 ASN 74 HD22 ASN 74 3.239 13.720 6.237 464 H HIS 75 HN HIS 75 2.890 10.039 3.042 465 HA HIS 75 HA HIS 75 4.854 9.827 5.150 466 HB2 HIS 75 HB2 HIS 75 2.494 8.234 4.277 467 HB3 HIS 75 HB1 HIS 75 3.741 7.412 5.209 468 HD2 HIS 75 HD2 HIS 75 4.271 10.126 7.176 469 HE1 HIS 75 HE1 HIS 75 0.310 9.216 8.346 470 HE2 HIS 75 HE2 HIS 75 2.364 10.607 8.864 471 H THR 76 HN THR 76 6.439 8.240 5.322 472 HA THR 76 HA THR 76 7.265 7.002 2.780 473 HB THR 76 HB THR 76 9.422 7.564 4.686 474 HG1 THR 76 HG1 THR 76 8.095 9.422 5.036 475 HG21 THR 76 HG21 THR 76 8.981 8.227 1.771 476 HG22 THR 76 HG22 THR 76 9.887 6.857 2.412 477 HG23 THR 76 HG23 THR 76 10.486 8.498 2.646 478 HA PRO 77 HA PRO 77 7.102 3.149 5.007 479 HB2 PRO 77 HB2 PRO 77 9.454 2.312 3.416 480 HB3 PRO 77 HB1 PRO 77 7.849 1.578 3.522 481 HG2 PRO 77 HG2 PRO 77 8.581 2.908 1.341 482 HG3 PRO 77 HG1 PRO 77 6.922 3.007 1.968 483 HD2 PRO 77 HD2 PRO 77 9.149 4.986 2.201 484 HD3 PRO 77 HD1 PRO 77 7.419 5.260 1.909 485 H LYS 78 HN LYS 78 9.883 5.142 4.962 486 HA LYS 78 HA LYS 78 11.504 3.520 6.689 487 HB2 LYS 78 HB2 LYS 78 12.092 5.539 5.003 488 HB3 LYS 78 HB1 LYS 78 12.018 6.432 6.515 489 HG2 LYS 78 HG2 LYS 78 14.131 5.834 6.824 490 HG3 LYS 78 HG1 LYS 78 13.527 4.209 7.149 491 HD2 LYS 78 HD2 LYS 78 15.087 3.809 5.492 492 HD3 LYS 78 HD1 LYS 78 13.601 3.960 4.555 493 HE2 LYS 78 HE2 LYS 78 15.270 5.237 3.440 494 HE3 LYS 78 HE1 LYS 78 14.164 6.374 4.210 495 HZ1 LYS 78 HZ1 LYS 78 15.719 6.856 5.872 496 HZ2 LYS 78 HZ2 LYS 78 16.630 6.824 4.447 497 HZ3 LYS 78 HZ3 LYS 78 16.681 5.513 5.511 498 H GLU 79 HN GLU 79 8.964 5.802 7.131 499 HA GLU 79 HA GLU 79 9.649 6.073 9.979 500 HB2 GLU 79 HB2 GLU 79 8.190 8.014 10.029 501 HB3 GLU 79 HB1 GLU 79 9.374 8.194 8.744 502 HG2 GLU 79 HG2 GLU 79 7.620 7.351 7.158 503 HG3 GLU 79 HG1 GLU 79 6.467 7.503 8.484 504 H LEU 80 HN LEU 80 7.445 6.441 11.266 505 HA LEU 80 HA LEU 80 5.543 5.565 12.133 506 HB2 LEU 80 HB2 LEU 80 5.233 4.431 9.358 507 HB3 LEU 80 HB1 LEU 80 4.059 4.166 10.633 508 HG LEU 80 HG LEU 80 4.846 6.932 9.740 509 HD11 LEU 80 HD11 LEU 80 2.800 6.918 8.371 510 HD12 LEU 80 HD12 LEU 80 2.621 5.192 8.686 511 HD13 LEU 80 HD13 LEU 80 4.015 5.785 7.781 512 HD21 LEU 80 HD21 LEU 80 2.420 5.851 11.168 513 HD22 LEU 80 HD22 LEU 80 2.697 7.534 10.725 514 HD23 LEU 80 HD23 LEU 80 3.743 6.752 11.909 515 H GLY 81 HN GLY 81 6.888 3.025 10.012 516 HA2 GLY 81 HA2 GLY 81 8.253 1.395 11.498 517 HA3 GLY 81 HA1 GLY 81 6.697 1.167 12.282 518 H MET 82 HN MET 82 8.261 1.019 9.098 519 HA MET 82 HA MET 82 6.437 -1.198 8.435 520 HB2 MET 82 HB2 MET 82 7.660 0.916 6.663 521 HB3 MET 82 HB1 MET 82 6.982 -0.574 6.019 522 HG2 MET 82 HG2 MET 82 4.823 0.003 7.062 523 HG3 MET 82 HG1 MET 82 5.522 1.531 7.596 524 HE1 MET 82 HE1 MET 82 2.860 1.016 5.795 525 HE2 MET 82 HE2 MET 82 2.978 2.336 4.630 526 HE3 MET 82 HE3 MET 82 3.324 2.628 6.334 527 H GLU 83 HN GLU 83 7.356 -3.104 8.249 528 HA GLU 83 HA GLU 83 10.182 -3.253 7.434 529 HB2 GLU 83 HB2 GLU 83 8.804 -4.577 9.749 530 HB3 GLU 83 HB1 GLU 83 10.198 -5.337 8.999 531 HG2 GLU 83 HG2 GLU 83 11.595 -3.494 9.553 532 HG3 GLU 83 HG1 GLU 83 10.214 -2.540 10.088 533 H GLU 84 HN GLU 84 10.489 -5.933 7.282 534 HA GLU 84 HA GLU 84 9.014 -6.575 4.919 535 HB2 GLU 84 HB2 GLU 84 11.376 -7.229 5.218 536 HB3 GLU 84 HB1 GLU 84 10.916 -8.278 6.549 537 HG2 GLU 84 HG2 GLU 84 11.318 -9.435 4.381 538 HG3 GLU 84 HG1 GLU 84 9.737 -9.739 5.101 539 H GLU 85 HN GLU 85 7.497 -8.177 4.627 540 HA GLU 85 HA GLU 85 5.692 -9.459 5.103 541 HB2 GLU 85 HB2 GLU 85 7.647 -10.228 7.182 542 HB3 GLU 85 HB1 GLU 85 5.973 -10.636 7.532 543 HG2 GLU 85 HG2 GLU 85 7.459 -11.422 5.034 544 HG3 GLU 85 HG1 GLU 85 7.189 -12.462 6.433 545 H ASP 86 HN ASP 86 5.758 -6.659 5.921 546 HA ASP 86 HA ASP 86 4.317 -6.530 8.411 547 HB2 ASP 86 HB2 ASP 86 5.753 -4.688 6.877 548 HB3 ASP 86 HB1 ASP 86 4.080 -4.138 6.799 549 H VAL 87 HN VAL 87 2.161 -5.710 8.628 550 HA VAL 87 HA VAL 87 0.464 -6.550 6.375 551 HB VAL 87 HB VAL 87 -0.315 -6.435 9.288 552 HG11 VAL 87 HG11 VAL 87 -2.256 -7.677 8.640 553 HG12 VAL 87 HG12 VAL 87 -1.664 -7.831 6.987 554 HG13 VAL 87 HG13 VAL 87 -2.141 -6.251 7.610 555 HG21 VAL 87 HG21 VAL 87 0.498 -8.841 7.656 556 HG22 VAL 87 HG22 VAL 87 -0.091 -8.859 9.318 557 HG23 VAL 87 HG23 VAL 87 1.452 -8.096 8.942 558 H ILE 88 HN ILE 88 -0.906 -5.161 5.494 559 HA ILE 88 HA ILE 88 -1.645 -2.724 6.939 560 HB ILE 88 HB ILE 88 0.222 -2.097 5.472 561 HG12 ILE 88 HG12 ILE 88 -2.341 -1.042 4.273 562 HG13 ILE 88 HG11 ILE 88 -1.769 -0.574 5.871 563 HG21 ILE 88 HG21 ILE 88 0.085 -2.257 3.064 564 HG22 ILE 88 HG22 ILE 88 -1.492 -3.038 3.182 565 HG23 ILE 88 HG23 ILE 88 -0.053 -3.859 3.789 566 HD11 ILE 88 HD11 ILE 88 0.269 0.320 4.880 567 HD12 ILE 88 HD12 ILE 88 -1.173 1.079 4.206 568 HD13 ILE 88 HD13 ILE 88 -0.306 -0.146 3.278 569 H GLU 89 HN GLU 89 -3.730 -2.001 6.477 570 HA GLU 89 HA GLU 89 -5.317 -3.857 4.830 571 HB2 GLU 89 HB2 GLU 89 -6.274 -2.078 7.082 572 HB3 GLU 89 HB1 GLU 89 -7.227 -3.274 6.215 573 HG2 GLU 89 HG2 GLU 89 -5.818 -5.054 7.100 574 HG3 GLU 89 HG1 GLU 89 -4.843 -3.859 7.953 575 H VAL 90 HN VAL 90 -7.009 -3.018 3.545 576 HA VAL 90 HA VAL 90 -6.929 -0.138 3.027 577 HB VAL 90 HB VAL 90 -5.464 -1.220 1.358 578 HG11 VAL 90 HG11 VAL 90 -7.943 -2.700 0.492 579 HG12 VAL 90 HG12 VAL 90 -6.521 -3.414 1.253 580 HG13 VAL 90 HG13 VAL 90 -6.398 -2.696 -0.355 581 HG21 VAL 90 HG21 VAL 90 -8.034 -0.131 0.221 582 HG22 VAL 90 HG22 VAL 90 -6.503 -0.254 -0.645 583 HG23 VAL 90 HG23 VAL 90 -6.642 0.813 0.752 584 H TYR 91 HN TYR 91 -8.892 0.750 2.684 585 HA TYR 91 HA TYR 91 -11.161 -1.018 2.106 586 HB2 TYR 91 HB2 TYR 91 -10.960 0.886 4.442 587 HB3 TYR 91 HB1 TYR 91 -12.498 0.271 3.843 588 HD1 TYR 91 HD1 TYR 91 -12.802 -2.272 3.784 589 HD2 TYR 91 HD2 TYR 91 -9.714 -0.347 5.983 590 HE1 TYR 91 HE1 TYR 91 -12.531 -4.292 5.157 591 HE2 TYR 91 HE2 TYR 91 -9.431 -2.363 7.363 592 HH TYR 91 HH TYR 91 -10.583 -5.324 6.551 593 H GLN 92 HN GLN 92 -13.188 0.383 1.722 594 HA GLN 92 HA GLN 92 -12.419 2.416 -0.200 595 HB2 GLN 92 HB2 GLN 92 -14.068 0.646 -0.774 596 HB3 GLN 92 HB1 GLN 92 -15.156 1.309 0.439 597 HG2 GLN 92 HG2 GLN 92 -15.319 3.380 -0.784 598 HG3 GLN 92 HG1 GLN 92 -14.141 2.806 -1.966 599 HE21 GLN 92 HE21 GLN 92 -17.389 2.486 -0.767 600 HE22 GLN 92 HE22 GLN 92 -18.018 1.629 -2.131 601 H GLU 93 HN GLU 93 -12.823 4.548 -0.036 602 HA GLU 93 HA GLU 93 -13.470 5.608 2.555 603 HB2 GLU 93 HB2 GLU 93 -12.600 6.750 -0.065 604 HB3 GLU 93 HB1 GLU 93 -13.311 7.822 1.134 605 HG2 GLU 93 HG2 GLU 93 -10.963 6.022 1.670 606 HG3 GLU 93 HG1 GLU 93 -10.827 7.710 1.181 607 H GLN 94 HN GLN 94 -15.154 7.045 3.043 608 HA GLN 94 HA GLN 94 -17.703 6.262 2.188 609 HB2 GLN 94 HB2 GLN 94 -17.463 7.201 4.351 610 HB3 GLN 94 HB1 GLN 94 -16.710 8.656 3.719 611 HG2 GLN 94 HG2 GLN 94 -18.925 9.123 2.571 612 HG3 GLN 94 HG1 GLN 94 -19.593 7.845 3.588 613 HE21 GLN 94 HE21 GLN 94 -19.788 8.179 5.792 614 HE22 GLN 94 HE22 GLN 94 -19.635 9.746 6.509 615 H THR 95 HN THR 95 -15.647 8.935 1.174 616 HA THR 95 HA THR 95 -17.619 10.294 -0.348 617 HB THR 95 HB THR 95 -15.526 11.281 -1.494 618 HG1 THR 95 HG1 THR 95 -13.655 10.479 -0.917 619 HG21 THR 95 HG21 THR 95 -16.760 12.431 0.277 620 HG22 THR 95 HG22 THR 95 -15.024 12.677 0.455 621 HG23 THR 95 HG23 THR 95 -15.862 11.530 1.501 622 H GLY 96 HN GLY 96 -15.555 7.578 -0.974 623 HA2 GLY 96 HA2 GLY 96 -15.721 6.051 -2.723 624 HA3 GLY 96 HA1 GLY 96 -16.851 7.137 -3.527 625 H GLY 97 HN GLY 97 -14.288 8.943 -2.557 626 HA2 GLY 97 HA2 GLY 97 -12.189 8.412 -4.267 627 HA3 GLY 97 HA1 GLY 97 -13.333 9.379 -5.192 628 H1 ASN 357 HT1 ASN 357 -5.987 -20.069 -3.529 629 H2 ASN 357 HT2 ASN 357 -5.696 -19.791 -1.889 630 H3 ASN 357 HT3 ASN 357 -4.804 -20.967 -2.717 631 HA ASN 357 HA ASN 357 -3.452 -19.038 -2.412 632 HB2 ASN 357 HB2 ASN 357 -2.855 -18.590 -4.735 633 HB3 ASN 357 HB1 ASN 357 -3.218 -20.300 -4.530 634 HD21 ASN 357 HD21 ASN 357 -3.301 -18.400 -6.849 635 HD22 ASN 357 HD22 ASN 357 -4.866 -18.642 -7.540 636 H ASN 358 HN ASN 358 -3.164 -16.813 -2.470 637 HA ASN 358 HA ASN 358 -5.076 -15.043 -3.649 638 HB2 ASN 358 HB2 ASN 358 -5.862 -13.987 -1.554 639 HB3 ASN 358 HB1 ASN 358 -6.415 -15.645 -1.716 640 HD21 ASN 358 HD21 ASN 358 -6.804 -15.559 0.557 641 HD22 ASN 358 HD22 ASN 358 -5.510 -15.783 1.681 642 H ARG 359 HN ARG 359 -2.129 -15.608 -3.325 643 HA ARG 359 HA ARG 359 -1.253 -13.025 -2.246 644 HB2 ARG 359 HB2 ARG 359 0.179 -15.616 -2.784 645 HB3 ARG 359 HB1 ARG 359 1.065 -14.120 -2.541 646 HG2 ARG 359 HG2 ARG 359 0.306 -13.901 -0.329 647 HG3 ARG 359 HG1 ARG 359 -0.940 -15.136 -0.559 648 HD2 ARG 359 HD2 ARG 359 1.072 -15.893 0.735 649 HD3 ARG 359 HD1 ARG 359 0.691 -16.868 -0.678 650 HE ARG 359 HE ARG 359 2.482 -15.109 -1.650 651 HH11 ARG 359 HH11 ARG 359 2.467 -17.231 1.155 652 HH12 ARG 359 HH12 ARG 359 4.263 -17.453 1.133 653 HH21 ARG 359 HH21 ARG 359 4.748 -15.362 -1.699 654 HH22 ARG 359 HH22 ARG 359 5.531 -16.401 -0.448 655 H ASP 360 HN ASP 360 -0.758 -11.437 -3.603 656 HA ASP 360 HA ASP 360 0.031 -12.152 -6.346 657 HB2 ASP 360 HB2 ASP 360 -2.368 -11.304 -6.087 658 HB3 ASP 360 HB1 ASP 360 -1.659 -9.738 -5.710 659 HA PRO 361 HA PRO 361 3.349 -9.415 -4.953 660 HB2 PRO 361 HB2 PRO 361 4.890 -10.405 -7.183 661 HB3 PRO 361 HB1 PRO 361 5.126 -10.716 -5.461 662 HG2 PRO 361 HG2 PRO 361 4.340 -12.632 -7.232 663 HG3 PRO 361 HG1 PRO 361 3.973 -12.665 -5.497 664 HD2 PRO 361 HD2 PRO 361 2.218 -11.862 -7.782 665 HD3 PRO 361 HD1 PRO 361 1.821 -12.776 -6.310 666 H ILE 362 HN ILE 362 3.399 -7.329 -5.498 667 HA ILE 362 HA ILE 362 3.134 -6.622 -8.348 668 HB ILE 362 HB ILE 362 2.190 -4.878 -6.083 669 HG12 ILE 362 HG12 ILE 362 0.511 -6.674 -7.849 670 HG13 ILE 362 HG11 ILE 362 0.872 -6.978 -6.151 671 HG21 ILE 362 HG21 ILE 362 1.006 -3.674 -7.853 672 HG22 ILE 362 HG22 ILE 362 1.655 -4.791 -9.052 673 HG23 ILE 362 HG23 ILE 362 2.742 -3.723 -8.163 674 HD11 ILE 362 HD11 ILE 362 -0.613 -4.575 -7.191 675 HD12 ILE 362 HD12 ILE 362 -0.339 -4.999 -5.502 676 HD13 ILE 362 HD13 ILE 362 -1.365 -6.017 -6.512 677 H VAL 363 HN VAL 363 4.680 -5.403 -9.203 678 HA VAL 363 HA VAL 363 6.421 -3.838 -7.415 679 HB VAL 363 HB VAL 363 7.446 -5.256 -9.881 680 HG11 VAL 363 HG11 VAL 363 9.638 -4.795 -8.885 681 HG12 VAL 363 HG12 VAL 363 8.849 -3.975 -7.540 682 HG13 VAL 363 HG13 VAL 363 8.726 -3.315 -9.171 683 HG21 VAL 363 HG21 VAL 363 8.514 -6.873 -8.347 684 HG22 VAL 363 HG22 VAL 363 6.756 -6.987 -8.347 685 HG23 VAL 363 HG23 VAL 363 7.588 -6.183 -7.016 686 H ILE 364 HN ILE 364 6.648 -1.750 -8.067 687 HA ILE 364 HA ILE 364 5.716 -1.108 -10.787 688 HB ILE 364 HB ILE 364 5.058 1.110 -9.933 689 HG12 ILE 364 HG12 ILE 364 4.906 0.409 -7.130 690 HG13 ILE 364 HG11 ILE 364 6.575 0.369 -7.689 691 HG21 ILE 364 HG21 ILE 364 3.077 0.319 -8.626 692 HG22 ILE 364 HG22 ILE 364 3.797 -1.289 -8.627 693 HG23 ILE 364 HG23 ILE 364 3.344 -0.526 -10.151 694 HD11 ILE 364 HD11 ILE 364 4.669 2.685 -7.900 695 HD12 ILE 364 HD12 ILE 364 6.304 2.656 -8.558 696 HD13 ILE 364 HD13 ILE 364 6.055 2.547 -6.816 697 H SER 365 HN SER 365 6.660 0.827 -11.750 698 HA SER 365 HA SER 365 9.518 0.898 -11.265 699 HB2 SER 365 HB2 SER 365 8.034 2.392 -13.426 700 HB3 SER 365 HB1 SER 365 9.708 1.842 -13.424 701 HG SER 365 HG SER 365 7.974 0.592 -14.629 702 H ASP 366 HN ASP 366 10.692 2.785 -10.882 703 HA ASP 366 HA ASP 366 9.249 4.820 -9.387 704 HB2 ASP 366 HB2 ASP 366 11.478 3.642 -8.722 705 HB3 ASP 366 HB1 ASP 366 12.222 4.782 -9.835 706 H SER 367 HN SER 367 9.742 7.117 -9.737 707 HA SER 367 HA SER 367 10.786 7.907 -12.303 708 HB2 SER 367 HB2 SER 367 8.597 9.120 -12.891 709 HB3 SER 367 HB1 SER 367 8.648 7.379 -13.152 710 HG SER 367 HG SER 367 7.649 8.562 -10.783 711 HA PRO 368 HA PRO 368 11.252 11.120 -9.029 712 HB2 PRO 368 HB2 PRO 368 14.026 11.261 -9.837 713 HB3 PRO 368 HB1 PRO 368 13.359 10.732 -8.289 714 HG2 PRO 368 HG2 PRO 368 14.613 9.049 -10.019 715 HG3 PRO 368 HG1 PRO 368 13.360 8.530 -8.871 716 HD2 PRO 368 HD2 PRO 368 13.110 9.113 -11.797 717 HD3 PRO 368 HD1 PRO 368 12.391 7.797 -10.843 Start of MODEL 13 1 H TYR 21 HT1 TYR 21 14.521 -6.161 -0.402 2 HA TYR 21 HA TYR 21 13.653 -4.038 -0.851 3 HB2 TYR 21 HB2 TYR 21 11.707 -5.525 -2.626 4 HB3 TYR 21 HB1 TYR 21 11.489 -3.845 -2.143 5 HD1 TYR 21 HD1 TYR 21 13.910 -2.507 -2.457 6 HD2 TYR 21 HD2 TYR 21 12.440 -5.744 -4.789 7 HE1 TYR 21 HE1 TYR 21 15.314 -1.779 -4.337 8 HE2 TYR 21 HE2 TYR 21 13.845 -5.033 -6.676 9 HH TYR 21 HH TYR 21 14.920 -2.889 -7.468 10 H ILE 22 HN ILE 22 11.019 -3.442 -0.405 11 HA ILE 22 HA ILE 22 10.487 -4.954 2.065 12 HB ILE 22 HB ILE 22 9.421 -2.221 1.354 13 HG12 ILE 22 HG12 ILE 22 11.881 -2.144 1.473 14 HG13 ILE 22 HG11 ILE 22 11.140 -1.272 2.809 15 HG21 ILE 22 HG21 ILE 22 8.124 -3.420 3.022 16 HG22 ILE 22 HG22 ILE 22 8.965 -2.054 3.756 17 HG23 ILE 22 HG23 ILE 22 9.580 -3.693 3.980 18 HD11 ILE 22 HD11 ILE 22 13.031 -2.522 3.591 19 HD12 ILE 22 HD12 ILE 22 12.369 -4.012 2.922 20 HD13 ILE 22 HD13 ILE 22 11.553 -3.210 4.264 21 H LYS 23 HN LYS 23 8.846 -6.346 1.934 22 HA LYS 23 HA LYS 23 6.775 -5.869 -0.090 23 HB2 LYS 23 HB2 LYS 23 8.046 -7.974 -0.244 24 HB3 LYS 23 HB1 LYS 23 7.507 -8.408 1.370 25 HG2 LYS 23 HG2 LYS 23 5.135 -8.193 0.416 26 HG3 LYS 23 HG1 LYS 23 5.925 -8.251 -1.162 27 HD2 LYS 23 HD2 LYS 23 5.312 -10.481 -0.634 28 HD3 LYS 23 HD1 LYS 23 7.056 -10.368 -0.391 29 HE2 LYS 23 HE2 LYS 23 5.311 -9.816 1.943 30 HE3 LYS 23 HE1 LYS 23 5.417 -11.486 1.393 31 HZ1 LYS 23 HZ1 LYS 23 7.101 -11.307 2.945 32 HZ2 LYS 23 HZ2 LYS 23 7.562 -9.748 2.453 33 HZ3 LYS 23 HZ3 LYS 23 7.930 -11.089 1.483 34 H LEU 24 HN LEU 24 4.930 -5.058 0.609 35 HA LEU 24 HA LEU 24 4.159 -5.459 3.417 36 HB2 LEU 24 HB2 LEU 24 3.124 -3.445 1.417 37 HB3 LEU 24 HB1 LEU 24 2.701 -3.522 3.116 38 HG LEU 24 HG LEU 24 5.480 -2.954 2.078 39 HD11 LEU 24 HD11 LEU 24 3.945 -1.159 1.484 40 HD12 LEU 24 HD12 LEU 24 5.057 -0.647 2.752 41 HD13 LEU 24 HD13 LEU 24 3.392 -1.067 3.156 42 HD21 LEU 24 HD21 LEU 24 5.496 -3.948 4.284 43 HD22 LEU 24 HD22 LEU 24 4.281 -2.795 4.839 44 HD23 LEU 24 HD23 LEU 24 5.892 -2.231 4.396 45 H LYS 25 HN LYS 25 2.306 -6.458 3.961 46 HA LYS 25 HA LYS 25 0.840 -7.829 1.847 47 HB2 LYS 25 HB2 LYS 25 0.670 -8.057 4.859 48 HB3 LYS 25 HB1 LYS 25 -0.204 -9.068 3.719 49 HG2 LYS 25 HG2 LYS 25 1.643 -10.270 3.148 50 HG3 LYS 25 HG1 LYS 25 2.752 -8.939 3.485 51 HD2 LYS 25 HD2 LYS 25 2.881 -9.435 5.712 52 HD3 LYS 25 HD1 LYS 25 1.248 -10.094 5.771 53 HE2 LYS 25 HE2 LYS 25 3.252 -11.562 4.158 54 HE3 LYS 25 HE1 LYS 25 3.419 -11.627 5.911 55 HZ1 LYS 25 HZ1 LYS 25 2.069 -13.447 5.082 56 HZ2 LYS 25 HZ2 LYS 25 0.976 -12.362 4.378 57 HZ3 LYS 25 HZ3 LYS 25 1.148 -12.427 6.066 58 H VAL 26 HN VAL 26 -0.787 -6.726 0.958 59 HA VAL 26 HA VAL 26 -2.320 -4.846 2.605 60 HB VAL 26 HB VAL 26 -2.746 -5.239 -0.341 61 HG11 VAL 26 HG11 VAL 26 -3.425 -2.921 -0.266 62 HG12 VAL 26 HG12 VAL 26 -2.949 -2.808 1.427 63 HG13 VAL 26 HG13 VAL 26 -4.303 -3.839 0.959 64 HG21 VAL 26 HG21 VAL 26 -0.598 -3.529 0.910 65 HG22 VAL 26 HG22 VAL 26 -1.059 -3.520 -0.793 66 HG23 VAL 26 HG23 VAL 26 -0.339 -4.964 -0.080 67 H ILE 27 HN ILE 27 -4.035 -5.661 3.598 68 HA ILE 27 HA ILE 27 -5.328 -8.065 2.652 69 HB ILE 27 HB ILE 27 -6.094 -6.288 4.978 70 HG12 ILE 27 HG12 ILE 27 -3.827 -7.192 5.236 71 HG13 ILE 27 HG11 ILE 27 -4.933 -7.946 6.378 72 HG21 ILE 27 HG21 ILE 27 -7.320 -8.258 5.777 73 HG22 ILE 27 HG22 ILE 27 -6.894 -9.114 4.295 74 HG23 ILE 27 HG23 ILE 27 -7.928 -7.688 4.223 75 HD11 ILE 27 HD11 ILE 27 -5.085 -9.898 4.870 76 HD12 ILE 27 HD12 ILE 27 -3.453 -9.604 5.470 77 HD13 ILE 27 HD13 ILE 27 -3.884 -9.142 3.824 78 H GLY 28 HN GLY 28 -6.908 -8.095 1.224 79 HA2 GLY 28 HA2 GLY 28 -8.323 -5.627 0.574 80 HA3 GLY 28 HA1 GLY 28 -8.349 -7.120 -0.353 81 H GLN 29 HN GLN 29 -10.668 -5.842 0.014 82 HA GLN 29 HA GLN 29 -12.128 -6.526 2.328 83 HB2 GLN 29 HB2 GLN 29 -12.697 -4.735 0.633 84 HB3 GLN 29 HB1 GLN 29 -13.262 -6.015 -0.428 85 HG2 GLN 29 HG2 GLN 29 -15.204 -5.263 0.567 86 HG3 GLN 29 HG1 GLN 29 -14.787 -6.677 1.535 87 HE21 GLN 29 HE21 GLN 29 -14.162 -6.414 3.652 88 HE22 GLN 29 HE22 GLN 29 -14.300 -4.912 4.495 89 H ASP 30 HN ASP 30 -11.507 -8.226 -0.668 90 HA ASP 30 HA ASP 30 -13.469 -10.294 -0.067 91 HB2 ASP 30 HB2 ASP 30 -12.741 -11.268 -2.230 92 HB3 ASP 30 HB1 ASP 30 -13.256 -9.592 -2.384 93 H SER 31 HN SER 31 -11.169 -9.896 1.703 94 HA SER 31 HA SER 31 -9.711 -11.126 2.926 95 HB2 SER 31 HB2 SER 31 -10.716 -13.571 1.464 96 HB3 SER 31 HB1 SER 31 -10.021 -13.487 3.081 97 HG SER 31 HG SER 31 -11.919 -12.079 3.551 98 H SER 32 HN SER 32 -8.946 -10.032 0.353 99 HA SER 32 HA SER 32 -7.114 -11.937 -0.814 100 HB2 SER 32 HB2 SER 32 -6.508 -9.594 -2.017 101 HB3 SER 32 HB1 SER 32 -7.859 -10.612 -2.521 102 HG SER 32 HG SER 32 -9.104 -9.001 -2.025 103 H GLU 33 HN GLU 33 -4.805 -11.457 -1.030 104 HA GLU 33 HA GLU 33 -3.731 -9.741 1.096 105 HB2 GLU 33 HB2 GLU 33 -3.821 -12.270 1.679 106 HB3 GLU 33 HB1 GLU 33 -2.527 -12.436 0.502 107 HG2 GLU 33 HG2 GLU 33 -1.343 -10.611 1.868 108 HG3 GLU 33 HG1 GLU 33 -2.513 -11.004 3.126 109 H ILE 34 HN ILE 34 -3.472 -8.349 -0.777 110 HA ILE 34 HA ILE 34 -1.792 -9.099 -2.961 111 HB ILE 34 HB ILE 34 -2.337 -6.264 -2.093 112 HG12 ILE 34 HG12 ILE 34 -4.492 -7.425 -2.100 113 HG13 ILE 34 HG11 ILE 34 -4.382 -6.327 -3.469 114 HG21 ILE 34 HG21 ILE 34 -0.736 -6.502 -3.874 115 HG22 ILE 34 HG22 ILE 34 -2.241 -5.852 -4.525 116 HG23 ILE 34 HG23 ILE 34 -1.837 -7.550 -4.771 117 HD11 ILE 34 HD11 ILE 34 -4.014 -9.315 -3.552 118 HD12 ILE 34 HD12 ILE 34 -3.857 -8.226 -4.931 119 HD13 ILE 34 HD13 ILE 34 -5.415 -8.412 -4.126 120 H HIS 35 HN HIS 35 0.377 -8.999 -3.134 121 HA HIS 35 HA HIS 35 1.828 -7.963 -0.798 122 HB2 HIS 35 HB2 HIS 35 2.412 -10.162 -2.751 123 HB3 HIS 35 HB1 HIS 35 3.738 -9.379 -1.896 124 HD2 HIS 35 HD2 HIS 35 0.717 -9.650 0.353 125 HE1 HIS 35 HE1 HIS 35 3.172 -12.994 1.168 126 HE2 HIS 35 HE2 HIS 35 1.070 -11.745 1.844 127 H PHE 36 HN PHE 36 2.198 -5.862 -1.241 128 HA PHE 36 HA PHE 36 3.168 -5.100 -3.881 129 HB2 PHE 36 HB2 PHE 36 1.496 -3.802 -2.233 130 HB3 PHE 36 HB1 PHE 36 3.014 -3.108 -1.673 131 HD1 PHE 36 HD1 PHE 36 4.550 -2.923 -4.173 132 HD2 PHE 36 HD2 PHE 36 0.445 -2.098 -3.401 133 HE1 PHE 36 HE1 PHE 36 4.513 -1.352 -6.060 134 HE2 PHE 36 HE2 PHE 36 0.407 -0.521 -5.287 135 HZ PHE 36 HZ PHE 36 2.441 -0.146 -6.621 136 H LYS 37 HN LYS 37 5.253 -4.997 -4.347 137 HA LYS 37 HA LYS 37 7.197 -5.107 -2.164 138 HB2 LYS 37 HB2 LYS 37 7.218 -6.705 -4.175 139 HB3 LYS 37 HB1 LYS 37 7.780 -5.329 -5.114 140 HG2 LYS 37 HG2 LYS 37 9.769 -5.160 -3.824 141 HG3 LYS 37 HG1 LYS 37 9.183 -6.352 -2.660 142 HD2 LYS 37 HD2 LYS 37 9.629 -6.972 -5.576 143 HD3 LYS 37 HD1 LYS 37 10.873 -7.191 -4.345 144 HE2 LYS 37 HE2 LYS 37 9.192 -8.641 -3.115 145 HE3 LYS 37 HE1 LYS 37 8.217 -8.587 -4.582 146 HZ1 LYS 37 HZ1 LYS 37 9.647 -10.567 -4.428 147 HZ2 LYS 37 HZ2 LYS 37 11.017 -9.578 -4.462 148 HZ3 LYS 37 HZ3 LYS 37 9.983 -9.633 -5.800 149 H VAL 38 HN VAL 38 7.542 -3.113 -1.414 150 HA VAL 38 HA VAL 38 7.882 -0.896 -3.309 151 HB VAL 38 HB VAL 38 7.444 0.610 -1.525 152 HG11 VAL 38 HG11 VAL 38 5.617 -1.764 -1.202 153 HG12 VAL 38 HG12 VAL 38 5.464 -0.492 -2.414 154 HG13 VAL 38 HG13 VAL 38 5.257 -0.111 -0.704 155 HG21 VAL 38 HG21 VAL 38 7.639 -1.734 0.365 156 HG22 VAL 38 HG22 VAL 38 7.182 -0.090 0.813 157 HG23 VAL 38 HG23 VAL 38 8.806 -0.420 0.211 158 H LYS 39 HN LYS 39 9.543 0.754 -2.625 159 HA LYS 39 HA LYS 39 11.995 -0.629 -1.772 160 HB2 LYS 39 HB2 LYS 39 11.988 0.189 -4.126 161 HB3 LYS 39 HB1 LYS 39 11.752 1.825 -3.524 162 HG2 LYS 39 HG2 LYS 39 13.892 1.704 -2.346 163 HG3 LYS 39 HG1 LYS 39 14.134 0.069 -2.956 164 HD2 LYS 39 HD2 LYS 39 14.091 0.945 -5.255 165 HD3 LYS 39 HD1 LYS 39 13.903 2.578 -4.614 166 HE2 LYS 39 HE2 LYS 39 16.049 2.317 -3.415 167 HE3 LYS 39 HE1 LYS 39 16.244 0.731 -4.155 168 HZ1 LYS 39 HZ1 LYS 39 17.489 2.395 -5.354 169 HZ2 LYS 39 HZ2 LYS 39 16.096 3.319 -5.600 170 HZ3 LYS 39 HZ3 LYS 39 16.242 1.802 -6.330 171 H MET 40 HN MET 40 13.096 0.160 -0.059 172 HA MET 40 HA MET 40 11.839 2.158 1.566 173 HB2 MET 40 HB2 MET 40 12.934 0.230 2.591 174 HB3 MET 40 HB1 MET 40 14.474 0.703 1.890 175 HG2 MET 40 HG2 MET 40 14.435 1.303 4.205 176 HG3 MET 40 HG1 MET 40 14.413 2.769 3.227 177 HE1 MET 40 HE1 MET 40 12.595 0.466 5.684 178 HE2 MET 40 HE2 MET 40 11.500 0.224 4.323 179 HE3 MET 40 HE3 MET 40 10.952 1.100 5.752 180 H THR 41 HN THR 41 11.914 3.971 0.195 181 HA THR 41 HA THR 41 13.807 5.871 0.727 182 HB THR 41 HB THR 41 15.211 4.203 -0.757 183 HG1 THR 41 HG1 THR 41 15.195 7.039 -1.017 184 HG21 THR 41 HG21 THR 41 13.896 5.896 -2.886 185 HG22 THR 41 HG22 THR 41 13.628 4.170 -2.647 186 HG23 THR 41 HG23 THR 41 15.220 4.756 -3.124 187 H THR 42 HN THR 42 11.432 4.557 -1.440 188 HA THR 42 HA THR 42 10.794 7.169 -2.547 189 HB THR 42 HB THR 42 9.282 4.625 -3.064 190 HG1 THR 42 HG1 THR 42 11.553 5.440 -4.562 191 HG21 THR 42 HG21 THR 42 8.337 6.690 -3.968 192 HG22 THR 42 HG22 THR 42 8.919 5.649 -5.265 193 HG23 THR 42 HG23 THR 42 9.867 7.051 -4.769 194 H HIS 43 HN HIS 43 8.871 8.242 -2.200 195 HA HIS 43 HA HIS 43 7.623 7.876 0.321 196 HB2 HIS 43 HB2 HIS 43 6.811 9.601 -2.032 197 HB3 HIS 43 HB1 HIS 43 6.112 9.704 -0.421 198 HD2 HIS 43 HD2 HIS 43 7.469 11.249 1.352 199 HE1 HIS 43 HE1 HIS 43 10.848 11.931 -1.103 200 HE2 HIS 43 HE2 HIS 43 9.818 12.340 1.175 201 H LEU 44 HN LEU 44 5.449 7.318 0.766 202 HA LEU 44 HA LEU 44 4.506 5.097 -0.721 203 HB2 LEU 44 HB2 LEU 44 3.292 6.714 1.510 204 HB3 LEU 44 HB1 LEU 44 2.493 5.320 0.806 205 HG LEU 44 HG LEU 44 5.276 5.063 1.889 206 HD11 LEU 44 HD11 LEU 44 2.740 4.835 3.499 207 HD12 LEU 44 HD12 LEU 44 3.963 6.094 3.668 208 HD13 LEU 44 HD13 LEU 44 4.363 4.418 4.048 209 HD21 LEU 44 HD21 LEU 44 4.573 2.747 2.235 210 HD22 LEU 44 HD22 LEU 44 4.370 3.235 0.552 211 HD23 LEU 44 HD23 LEU 44 2.968 3.142 1.617 212 H LYS 45 HN LYS 45 4.223 8.368 -1.257 213 HA LYS 45 HA LYS 45 1.685 8.820 -2.224 214 HB2 LYS 45 HB2 LYS 45 3.163 10.659 -2.087 215 HB3 LYS 45 HB1 LYS 45 4.391 9.849 -3.047 216 HG2 LYS 45 HG2 LYS 45 3.525 11.468 -4.472 217 HG3 LYS 45 HG1 LYS 45 2.717 9.982 -4.974 218 HD2 LYS 45 HD2 LYS 45 0.988 10.878 -3.107 219 HD3 LYS 45 HD1 LYS 45 1.618 12.407 -3.720 220 HE2 LYS 45 HE2 LYS 45 1.063 11.707 -6.001 221 HE3 LYS 45 HE1 LYS 45 0.416 10.196 -5.372 222 HZ1 LYS 45 HZ1 LYS 45 -1.422 11.580 -5.669 223 HZ2 LYS 45 HZ2 LYS 45 -0.643 12.927 -5.007 224 HZ3 LYS 45 HZ3 LYS 45 -1.117 11.649 -4.001 225 H LYS 46 HN LYS 46 4.506 7.661 -4.044 226 HA LYS 46 HA LYS 46 3.073 7.250 -6.458 227 HB2 LYS 46 HB2 LYS 46 5.613 7.583 -6.090 228 HB3 LYS 46 HB1 LYS 46 5.648 5.855 -5.773 229 HG2 LYS 46 HG2 LYS 46 6.233 6.235 -8.060 230 HG3 LYS 46 HG1 LYS 46 4.643 5.470 -8.001 231 HD2 LYS 46 HD2 LYS 46 3.624 7.739 -8.224 232 HD3 LYS 46 HD1 LYS 46 5.246 8.391 -8.465 233 HE2 LYS 46 HE2 LYS 46 5.506 7.258 -10.507 234 HE3 LYS 46 HE1 LYS 46 4.159 6.170 -10.169 235 HZ1 LYS 46 HZ1 LYS 46 3.938 9.084 -10.703 236 HZ2 LYS 46 HZ2 LYS 46 2.643 8.042 -10.364 237 HZ3 LYS 46 HZ3 LYS 46 3.542 7.844 -11.785 238 H LEU 47 HN LEU 47 3.746 5.253 -3.683 239 HA LEU 47 HA LEU 47 3.103 2.762 -4.908 240 HB2 LEU 47 HB2 LEU 47 3.378 3.687 -2.068 241 HB3 LEU 47 HB1 LEU 47 2.771 2.084 -2.427 242 HG LEU 47 HG LEU 47 5.055 1.783 -1.995 243 HD11 LEU 47 HD11 LEU 47 5.957 0.943 -4.025 244 HD12 LEU 47 HD12 LEU 47 4.952 2.023 -4.989 245 HD13 LEU 47 HD13 LEU 47 4.210 0.704 -4.082 246 HD21 LEU 47 HD21 LEU 47 5.581 4.159 -3.771 247 HD22 LEU 47 HD22 LEU 47 6.829 3.110 -3.099 248 HD23 LEU 47 HD23 LEU 47 5.808 4.062 -2.025 249 H LYS 48 HN LYS 48 1.283 5.104 -2.991 250 HA LYS 48 HA LYS 48 -1.066 3.599 -2.705 251 HB2 LYS 48 HB2 LYS 48 -0.542 6.562 -2.676 252 HB3 LYS 48 HB1 LYS 48 -2.147 5.894 -2.408 253 HG2 LYS 48 HG2 LYS 48 -1.419 4.736 -0.450 254 HG3 LYS 48 HG1 LYS 48 0.267 5.139 -0.776 255 HD2 LYS 48 HD2 LYS 48 -0.388 6.647 0.895 256 HD3 LYS 48 HD1 LYS 48 -0.468 7.581 -0.597 257 HE2 LYS 48 HE2 LYS 48 -2.900 7.122 -0.700 258 HE3 LYS 48 HE1 LYS 48 -2.782 6.308 0.858 259 HZ1 LYS 48 HZ1 LYS 48 -2.102 8.346 1.883 260 HZ2 LYS 48 HZ2 LYS 48 -3.520 8.645 1.012 261 HZ3 LYS 48 HZ3 LYS 48 -2.030 9.141 0.384 262 H GLU 49 HN GLU 49 -0.131 5.942 -5.235 263 HA GLU 49 HA GLU 49 -2.627 5.710 -6.591 264 HB2 GLU 49 HB2 GLU 49 -1.433 6.832 -8.498 265 HB3 GLU 49 HB1 GLU 49 -1.410 7.710 -6.977 266 HG2 GLU 49 HG2 GLU 49 0.855 7.159 -6.592 267 HG3 GLU 49 HG1 GLU 49 0.858 5.982 -7.903 268 H SER 50 HN SER 50 0.457 4.032 -6.850 269 HA SER 50 HA SER 50 -0.080 2.690 -9.276 270 HB2 SER 50 HB2 SER 50 1.695 1.878 -6.963 271 HB3 SER 50 HB1 SER 50 1.697 1.108 -8.550 272 HG SER 50 HG SER 50 2.483 3.732 -7.847 273 H TYR 51 HN TYR 51 -0.828 1.951 -5.906 274 HA TYR 51 HA TYR 51 -1.761 -0.682 -6.330 275 HB2 TYR 51 HB2 TYR 51 -1.209 0.243 -4.084 276 HB3 TYR 51 HB1 TYR 51 -2.637 1.265 -4.184 277 HD1 TYR 51 HD1 TYR 51 -1.577 -2.303 -4.210 278 HD2 TYR 51 HD2 TYR 51 -4.706 0.474 -3.445 279 HE1 TYR 51 HE1 TYR 51 -2.936 -4.111 -3.250 280 HE2 TYR 51 HE2 TYR 51 -6.072 -1.326 -2.476 281 HH TYR 51 HH TYR 51 -4.841 -4.302 -1.597 282 H CYS 52 HN CYS 52 -3.323 2.470 -6.434 283 HA CYS 52 HA CYS 52 -5.979 1.623 -6.694 284 HB2 CYS 52 HB2 CYS 52 -4.682 4.074 -7.913 285 HB3 CYS 52 HB1 CYS 52 -6.408 3.835 -7.661 286 HG CYS 52 HG CYS 52 -4.082 4.053 -5.156 287 H GLN 53 HN GLN 53 -3.453 2.160 -9.097 288 HA GLN 53 HA GLN 53 -5.022 1.693 -11.388 289 HB2 GLN 53 HB2 GLN 53 -2.056 1.264 -10.991 290 HB3 GLN 53 HB1 GLN 53 -2.874 1.390 -12.542 291 HG2 GLN 53 HG2 GLN 53 -3.508 3.682 -12.044 292 HG3 GLN 53 HG1 GLN 53 -2.747 3.562 -10.460 293 HE21 GLN 53 HE21 GLN 53 -2.217 5.376 -12.689 294 HE22 GLN 53 HE22 GLN 53 -0.544 5.172 -13.072 295 H ARG 54 HN ARG 54 -3.151 -0.439 -9.300 296 HA ARG 54 HA ARG 54 -3.415 -2.786 -10.860 297 HB2 ARG 54 HB2 ARG 54 -1.737 -3.026 -9.308 298 HB3 ARG 54 HB1 ARG 54 -2.606 -2.132 -8.070 299 HG2 ARG 54 HG2 ARG 54 -2.495 -4.307 -7.254 300 HG3 ARG 54 HG1 ARG 54 -4.124 -4.178 -7.909 301 HD2 ARG 54 HD2 ARG 54 -3.435 -5.333 -9.932 302 HD3 ARG 54 HD1 ARG 54 -1.773 -5.401 -9.348 303 HE ARG 54 HE ARG 54 -2.327 -7.192 -8.029 304 HH11 ARG 54 HH11 ARG 54 -5.275 -5.607 -9.154 305 HH12 ARG 54 HH12 ARG 54 -6.353 -6.850 -8.416 306 HH21 ARG 54 HH21 ARG 54 -3.646 -8.775 -7.078 307 HH22 ARG 54 HH22 ARG 54 -5.446 -8.645 -7.276 308 H GLN 55 HN GLN 55 -5.481 -1.198 -8.554 309 HA GLN 55 HA GLN 55 -7.303 -3.451 -8.377 310 HB2 GLN 55 HB2 GLN 55 -7.344 -0.681 -7.185 311 HB3 GLN 55 HB1 GLN 55 -8.659 -1.829 -6.980 312 HG2 GLN 55 HG2 GLN 55 -5.820 -2.123 -6.031 313 HG3 GLN 55 HG1 GLN 55 -7.267 -1.912 -5.044 314 HE21 GLN 55 HE21 GLN 55 -8.733 -3.641 -4.858 315 HE22 GLN 55 HE22 GLN 55 -8.244 -5.263 -5.187 316 H GLY 56 HN GLY 56 -6.782 -0.862 -10.452 317 HA2 GLY 56 HA2 GLY 56 -7.910 -0.240 -12.361 318 HA3 GLY 56 HA1 GLY 56 -9.120 -1.457 -11.988 319 H VAL 57 HN VAL 57 -8.278 1.014 -9.683 320 HA VAL 57 HA VAL 57 -10.758 2.460 -10.324 321 HB VAL 57 HB VAL 57 -11.110 2.755 -7.837 322 HG11 VAL 57 HG11 VAL 57 -12.198 0.564 -7.547 323 HG12 VAL 57 HG12 VAL 57 -11.349 -0.027 -8.974 324 HG13 VAL 57 HG13 VAL 57 -12.527 1.277 -9.125 325 HG21 VAL 57 HG21 VAL 57 -9.138 0.481 -7.694 326 HG22 VAL 57 HG22 VAL 57 -10.146 1.037 -6.359 327 HG23 VAL 57 HG23 VAL 57 -8.919 2.104 -7.043 328 HA PRO 58 HA PRO 58 -8.246 6.074 -9.932 329 HB2 PRO 58 HB2 PRO 58 -10.055 7.885 -9.003 330 HB3 PRO 58 HB1 PRO 58 -10.029 7.316 -10.680 331 HG2 PRO 58 HG2 PRO 58 -11.771 6.435 -8.423 332 HG3 PRO 58 HG1 PRO 58 -12.202 6.748 -10.116 333 HD2 PRO 58 HD2 PRO 58 -11.838 4.252 -9.182 334 HD3 PRO 58 HD1 PRO 58 -11.407 4.713 -10.841 335 H MET 59 HN MET 59 -7.446 7.668 -8.363 336 HA MET 59 HA MET 59 -6.939 6.455 -5.838 337 HB2 MET 59 HB2 MET 59 -5.490 8.106 -7.286 338 HB3 MET 59 HB1 MET 59 -6.341 9.338 -6.365 339 HG2 MET 59 HG2 MET 59 -5.564 8.186 -4.284 340 HG3 MET 59 HG1 MET 59 -4.559 7.161 -5.308 341 HE1 MET 59 HE1 MET 59 -3.252 8.779 -2.961 342 HE2 MET 59 HE2 MET 59 -1.840 9.456 -3.774 343 HE3 MET 59 HE3 MET 59 -2.345 7.801 -4.114 344 H ASN 60 HN ASN 60 -7.167 7.643 -3.771 345 HA ASN 60 HA ASN 60 -8.309 8.702 -2.133 346 HB2 ASN 60 HB2 ASN 60 -9.294 10.157 -4.497 347 HB3 ASN 60 HB1 ASN 60 -10.366 10.189 -3.102 348 HD21 ASN 60 HD21 ASN 60 -9.738 11.254 -1.252 349 HD22 ASN 60 HD22 ASN 60 -8.364 12.303 -1.199 350 H SER 61 HN SER 61 -9.482 6.390 -4.079 351 HA SER 61 HA SER 61 -12.155 6.257 -2.957 352 HB2 SER 61 HB2 SER 61 -12.283 4.139 -4.312 353 HB3 SER 61 HB1 SER 61 -11.915 5.578 -5.262 354 HG SER 61 HG SER 61 -10.081 4.710 -5.804 355 H LEU 62 HN LEU 62 -9.110 4.484 -2.799 356 HA LEU 62 HA LEU 62 -10.137 2.902 -0.560 357 HB2 LEU 62 HB2 LEU 62 -7.618 2.526 -2.178 358 HB3 LEU 62 HB1 LEU 62 -8.233 1.432 -0.955 359 HG LEU 62 HG LEU 62 -9.700 2.077 -3.515 360 HD11 LEU 62 HD11 LEU 62 -8.945 -0.075 -4.334 361 HD12 LEU 62 HD12 LEU 62 -8.010 -0.333 -2.861 362 HD13 LEU 62 HD13 LEU 62 -7.563 0.959 -3.975 363 HD21 LEU 62 HD21 LEU 62 -11.145 1.321 -1.716 364 HD22 LEU 62 HD22 LEU 62 -10.094 -0.065 -1.426 365 HD23 LEU 62 HD23 LEU 62 -10.985 0.062 -2.942 366 H ARG 63 HN ARG 63 -9.265 2.982 1.431 367 HA ARG 63 HA ARG 63 -7.217 5.041 1.905 368 HB2 ARG 63 HB2 ARG 63 -8.082 5.109 4.224 369 HB3 ARG 63 HB1 ARG 63 -9.311 5.524 3.035 370 HG2 ARG 63 HG2 ARG 63 -10.436 3.497 3.319 371 HG3 ARG 63 HG1 ARG 63 -9.050 2.736 4.099 372 HD2 ARG 63 HD2 ARG 63 -9.328 4.144 6.045 373 HD3 ARG 63 HD1 ARG 63 -10.647 5.010 5.261 374 HE ARG 63 HE ARG 63 -10.737 2.254 6.266 375 HH11 ARG 63 HH11 ARG 63 -14.001 4.487 5.389 376 HH12 ARG 63 HH12 ARG 63 -12.359 5.088 4.925 377 HH21 ARG 63 HH21 ARG 63 -12.815 1.457 6.832 378 HH22 ARG 63 HH22 ARG 63 -14.258 2.464 6.430 379 H PHE 64 HN PHE 64 -5.362 4.536 2.953 380 HA PHE 64 HA PHE 64 -4.883 1.692 3.465 381 HB2 PHE 64 HB2 PHE 64 -3.010 4.013 2.988 382 HB3 PHE 64 HB1 PHE 64 -2.453 2.427 3.511 383 HD1 PHE 64 HD1 PHE 64 -3.938 4.337 0.760 384 HD2 PHE 64 HD2 PHE 64 -2.423 0.562 2.006 385 HE1 PHE 64 HE1 PHE 64 -3.869 3.598 -1.586 386 HE2 PHE 64 HE2 PHE 64 -2.349 -0.188 -0.335 387 HZ PHE 64 HZ PHE 64 -3.073 1.333 -2.133 388 H LEU 65 HN LEU 65 -4.893 0.988 5.470 389 HA LEU 65 HA LEU 65 -4.440 2.925 7.639 390 HB2 LEU 65 HB2 LEU 65 -6.071 0.388 7.601 391 HB3 LEU 65 HB1 LEU 65 -5.737 1.321 9.050 392 HG LEU 65 HG LEU 65 -7.197 2.421 6.648 393 HD11 LEU 65 HD11 LEU 65 -9.237 2.098 7.875 394 HD12 LEU 65 HD12 LEU 65 -8.354 1.417 9.241 395 HD13 LEU 65 HD13 LEU 65 -8.413 0.549 7.708 396 HD21 LEU 65 HD21 LEU 65 -6.754 3.435 9.452 397 HD22 LEU 65 HD22 LEU 65 -7.917 4.126 8.323 398 HD23 LEU 65 HD23 LEU 65 -6.196 4.162 7.945 399 H PHE 66 HN PHE 66 -2.417 2.756 8.295 400 HA PHE 66 HA PHE 66 -1.307 0.059 8.726 401 HB2 PHE 66 HB2 PHE 66 -0.067 1.376 7.038 402 HB3 PHE 66 HB1 PHE 66 0.182 2.651 8.225 403 HD1 PHE 66 HD1 PHE 66 0.820 -0.987 7.717 404 HD2 PHE 66 HD2 PHE 66 2.129 2.668 9.466 405 HE1 PHE 66 HE1 PHE 66 2.894 -2.086 8.457 406 HE2 PHE 66 HE2 PHE 66 4.202 1.573 10.213 407 HZ PHE 66 HZ PHE 66 4.587 -0.808 9.710 408 H GLU 67 HN GLU 67 -1.242 -0.491 10.788 409 HA GLU 67 HA GLU 67 -1.079 -0.420 13.053 410 HB2 GLU 67 HB2 GLU 67 0.348 2.192 12.507 411 HB3 GLU 67 HB1 GLU 67 0.297 1.391 14.069 412 HG2 GLU 67 HG2 GLU 67 1.485 0.236 11.559 413 HG3 GLU 67 HG1 GLU 67 2.398 0.993 12.863 414 H GLY 68 HN GLY 68 -3.255 0.978 11.476 415 HA2 GLY 68 HA2 GLY 68 -5.326 1.723 12.288 416 HA3 GLY 68 HA1 GLY 68 -4.542 2.203 13.786 417 H GLN 69 HN GLN 69 -2.502 3.393 11.627 418 HA GLN 69 HA GLN 69 -3.743 6.033 11.721 419 HB2 GLN 69 HB2 GLN 69 -0.936 5.185 10.976 420 HB3 GLN 69 HB1 GLN 69 -1.497 6.849 11.072 421 HG2 GLN 69 HG2 GLN 69 -1.427 4.904 13.368 422 HG3 GLN 69 HG1 GLN 69 -0.232 6.162 13.055 423 HE21 GLN 69 HE21 GLN 69 -2.023 5.731 15.349 424 HE22 GLN 69 HE22 GLN 69 -2.926 7.198 15.518 425 H ARG 70 HN ARG 70 -4.020 7.330 9.915 426 HA ARG 70 HA ARG 70 -4.547 5.897 7.458 427 HB2 ARG 70 HB2 ARG 70 -4.861 8.851 8.049 428 HB3 ARG 70 HB1 ARG 70 -5.551 7.976 6.690 429 HG2 ARG 70 HG2 ARG 70 -6.298 6.879 9.290 430 HG3 ARG 70 HG1 ARG 70 -6.824 8.542 9.033 431 HD2 ARG 70 HD2 ARG 70 -7.349 6.237 7.165 432 HD3 ARG 70 HD1 ARG 70 -8.504 6.903 8.317 433 HE ARG 70 HE ARG 70 -7.483 8.897 6.544 434 HH11 ARG 70 HH11 ARG 70 -9.891 6.368 6.957 435 HH12 ARG 70 HH12 ARG 70 -10.919 6.965 5.588 436 HH21 ARG 70 HH21 ARG 70 -8.805 9.740 4.877 437 HH22 ARG 70 HH22 ARG 70 -10.337 8.863 4.461 438 H ILE 71 HN ILE 71 -2.874 5.490 6.186 439 HA ILE 71 HA ILE 71 -0.418 6.839 6.204 440 HB ILE 71 HB ILE 71 -1.672 5.003 4.176 441 HG12 ILE 71 HG12 ILE 71 -1.057 4.013 6.335 442 HG13 ILE 71 HG11 ILE 71 -0.030 3.398 5.044 443 HG21 ILE 71 HG21 ILE 71 0.501 4.834 3.076 444 HG22 ILE 71 HG22 ILE 71 1.143 6.090 4.136 445 HG23 ILE 71 HG23 ILE 71 -0.136 6.475 2.985 446 HD11 ILE 71 HD11 ILE 71 1.670 5.129 5.761 447 HD12 ILE 71 HD12 ILE 71 1.388 3.790 6.873 448 HD13 ILE 71 HD13 ILE 71 0.673 5.368 7.195 449 H ALA 72 HN ALA 72 0.084 8.783 5.516 450 HA ALA 72 HA ALA 72 -1.641 10.215 3.679 451 HB1 ALA 72 HB1 ALA 72 -0.183 12.128 4.123 452 HB2 ALA 72 HB2 ALA 72 0.914 11.088 5.033 453 HB3 ALA 72 HB3 ALA 72 -0.722 11.380 5.627 454 H ASP 73 HN ASP 73 -0.513 11.518 1.903 455 HA ASP 73 HA ASP 73 0.751 9.657 0.140 456 HB2 ASP 73 HB2 ASP 73 -0.150 12.493 -0.044 457 HB3 ASP 73 HB1 ASP 73 0.994 11.905 -1.245 458 H ASN 74 HN ASN 74 1.847 12.340 2.106 459 HA ASN 74 HA ASN 74 4.491 12.322 0.925 460 HB2 ASN 74 HB2 ASN 74 4.980 14.156 2.435 461 HB3 ASN 74 HB1 ASN 74 3.423 14.434 1.664 462 HD21 ASN 74 HD21 ASN 74 5.087 13.886 4.609 463 HD22 ASN 74 HD22 ASN 74 3.729 14.081 5.661 464 H HIS 75 HN HIS 75 3.112 10.176 2.836 465 HA HIS 75 HA HIS 75 5.051 10.002 4.957 466 HB2 HIS 75 HB2 HIS 75 2.608 8.526 4.176 467 HB3 HIS 75 HB1 HIS 75 3.831 7.585 5.021 468 HD2 HIS 75 HD2 HIS 75 4.648 10.234 7.012 469 HE1 HIS 75 HE1 HIS 75 0.712 9.503 8.388 470 HE2 HIS 75 HE2 HIS 75 2.973 10.492 8.972 471 H THR 76 HN THR 76 6.693 8.546 5.185 472 HA THR 76 HA THR 76 7.418 7.010 2.771 473 HB THR 76 HB THR 76 9.785 7.432 4.185 474 HG1 THR 76 HG1 THR 76 8.278 9.229 5.132 475 HG21 THR 76 HG21 THR 76 9.479 7.395 1.734 476 HG22 THR 76 HG22 THR 76 10.454 8.762 2.276 477 HG23 THR 76 HG23 THR 76 8.767 9.007 1.820 478 HA PRO 77 HA PRO 77 7.424 3.410 5.369 479 HB2 PRO 77 HB2 PRO 77 9.733 2.435 3.814 480 HB3 PRO 77 HB1 PRO 77 8.122 1.732 3.992 481 HG2 PRO 77 HG2 PRO 77 8.875 2.868 1.699 482 HG3 PRO 77 HG1 PRO 77 7.208 2.992 2.299 483 HD2 PRO 77 HD2 PRO 77 9.399 5.025 2.375 484 HD3 PRO 77 HD1 PRO 77 7.665 5.241 2.057 485 H LYS 78 HN LYS 78 10.083 5.488 5.016 486 HA LYS 78 HA LYS 78 11.991 4.205 6.665 487 HB2 LYS 78 HB2 LYS 78 12.569 6.001 5.081 488 HB3 LYS 78 HB1 LYS 78 11.641 7.143 6.039 489 HG2 LYS 78 HG2 LYS 78 13.773 7.580 6.747 490 HG3 LYS 78 HG1 LYS 78 13.240 6.415 7.961 491 HD2 LYS 78 HD2 LYS 78 15.436 5.781 7.284 492 HD3 LYS 78 HD1 LYS 78 14.314 4.620 6.571 493 HE2 LYS 78 HE2 LYS 78 14.558 5.513 4.431 494 HE3 LYS 78 HE1 LYS 78 15.199 7.039 5.041 495 HZ1 LYS 78 HZ1 LYS 78 16.868 5.557 4.000 496 HZ2 LYS 78 HZ2 LYS 78 16.628 4.453 5.258 497 HZ3 LYS 78 HZ3 LYS 78 17.239 5.993 5.591 498 H GLU 79 HN GLU 79 9.339 6.448 7.302 499 HA GLU 79 HA GLU 79 10.022 6.433 10.151 500 HB2 GLU 79 HB2 GLU 79 8.498 8.272 10.418 501 HB3 GLU 79 HB1 GLU 79 9.541 8.623 9.050 502 HG2 GLU 79 HG2 GLU 79 7.390 7.383 7.880 503 HG3 GLU 79 HG1 GLU 79 6.657 8.323 9.179 504 H LEU 80 HN LEU 80 7.707 6.597 11.434 505 HA LEU 80 HA LEU 80 5.901 5.475 12.219 506 HB2 LEU 80 HB2 LEU 80 5.770 4.363 9.415 507 HB3 LEU 80 HB1 LEU 80 4.579 4.030 10.657 508 HG LEU 80 HG LEU 80 5.191 6.856 9.847 509 HD11 LEU 80 HD11 LEU 80 3.333 6.718 8.249 510 HD12 LEU 80 HD12 LEU 80 3.249 4.977 8.511 511 HD13 LEU 80 HD13 LEU 80 4.687 5.690 7.781 512 HD21 LEU 80 HD21 LEU 80 2.757 5.490 10.990 513 HD22 LEU 80 HD22 LEU 80 2.878 7.204 10.594 514 HD23 LEU 80 HD23 LEU 80 3.886 6.520 11.870 515 H GLY 81 HN GLY 81 7.624 3.211 10.052 516 HA2 GLY 81 HA2 GLY 81 9.149 1.641 11.319 517 HA3 GLY 81 HA1 GLY 81 7.744 1.328 12.330 518 H MET 82 HN MET 82 8.606 1.351 8.864 519 HA MET 82 HA MET 82 6.824 -0.943 8.498 520 HB2 MET 82 HB2 MET 82 8.032 1.040 6.587 521 HB3 MET 82 HB1 MET 82 7.339 -0.471 6.016 522 HG2 MET 82 HG2 MET 82 5.209 0.150 7.112 523 HG3 MET 82 HG1 MET 82 5.920 1.708 7.526 524 HE1 MET 82 HE1 MET 82 3.204 1.057 5.843 525 HE2 MET 82 HE2 MET 82 3.271 2.305 4.599 526 HE3 MET 82 HE3 MET 82 3.666 2.704 6.272 527 H GLU 83 HN GLU 83 7.593 -2.925 8.246 528 HA GLU 83 HA GLU 83 10.405 -3.273 7.441 529 HB2 GLU 83 HB2 GLU 83 8.926 -4.476 9.756 530 HB3 GLU 83 HB1 GLU 83 10.256 -5.350 9.011 531 HG2 GLU 83 HG2 GLU 83 10.736 -2.530 9.770 532 HG3 GLU 83 HG1 GLU 83 10.585 -3.713 11.067 533 H GLU 84 HN GLU 84 10.594 -5.912 7.256 534 HA GLU 84 HA GLU 84 9.028 -6.523 4.934 535 HB2 GLU 84 HB2 GLU 84 11.349 -7.165 4.978 536 HB3 GLU 84 HB1 GLU 84 11.129 -8.053 6.477 537 HG2 GLU 84 HG2 GLU 84 11.322 -9.594 4.666 538 HG3 GLU 84 HG1 GLU 84 9.674 -9.640 5.282 539 H GLU 85 HN GLU 85 7.520 -8.142 4.694 540 HA GLU 85 HA GLU 85 5.821 -9.544 5.220 541 HB2 GLU 85 HB2 GLU 85 7.545 -10.049 7.642 542 HB3 GLU 85 HB1 GLU 85 6.024 -10.885 7.373 543 HG2 GLU 85 HG2 GLU 85 8.141 -10.909 5.269 544 HG3 GLU 85 HG1 GLU 85 8.246 -11.995 6.653 545 H ASP 86 HN ASP 86 5.886 -6.668 6.134 546 HA ASP 86 HA ASP 86 4.310 -6.659 8.548 547 HB2 ASP 86 HB2 ASP 86 5.909 -4.784 7.488 548 HB3 ASP 86 HB1 ASP 86 4.374 -4.246 6.810 549 H VAL 87 HN VAL 87 2.163 -5.514 8.568 550 HA VAL 87 HA VAL 87 0.575 -6.364 6.229 551 HB VAL 87 HB VAL 87 -0.360 -6.418 9.102 552 HG11 VAL 87 HG11 VAL 87 -2.248 -7.701 8.212 553 HG12 VAL 87 HG12 VAL 87 -1.609 -7.499 6.581 554 HG13 VAL 87 HG13 VAL 87 -2.157 -6.093 7.493 555 HG21 VAL 87 HG21 VAL 87 0.549 -8.691 7.341 556 HG22 VAL 87 HG22 VAL 87 -0.239 -8.872 8.908 557 HG23 VAL 87 HG23 VAL 87 1.348 -8.108 8.801 558 H ILE 88 HN ILE 88 -0.815 -4.947 5.396 559 HA ILE 88 HA ILE 88 -1.513 -2.551 6.934 560 HB ILE 88 HB ILE 88 0.330 -1.925 5.418 561 HG12 ILE 88 HG12 ILE 88 -2.258 -0.765 4.383 562 HG13 ILE 88 HG11 ILE 88 -1.585 -0.358 5.959 563 HG21 ILE 88 HG21 ILE 88 0.031 -1.959 2.993 564 HG22 ILE 88 HG22 ILE 88 -1.510 -2.793 3.197 565 HG23 ILE 88 HG23 ILE 88 -0.009 -3.585 3.675 566 HD11 ILE 88 HD11 ILE 88 0.453 0.461 4.825 567 HD12 ILE 88 HD12 ILE 88 -1.003 1.343 4.370 568 HD13 ILE 88 HD13 ILE 88 -0.323 0.141 3.273 569 H GLU 89 HN GLU 89 -3.623 -1.976 6.738 570 HA GLU 89 HA GLU 89 -5.286 -3.769 5.130 571 HB2 GLU 89 HB2 GLU 89 -5.939 -1.952 7.444 572 HB3 GLU 89 HB1 GLU 89 -7.150 -2.842 6.531 573 HG2 GLU 89 HG2 GLU 89 -6.306 -4.923 7.243 574 HG3 GLU 89 HG1 GLU 89 -4.842 -4.187 7.894 575 H VAL 90 HN VAL 90 -6.842 -3.050 3.710 576 HA VAL 90 HA VAL 90 -6.882 -0.176 3.125 577 HB VAL 90 HB VAL 90 -5.414 -1.352 1.482 578 HG11 VAL 90 HG11 VAL 90 -7.953 -2.714 0.594 579 HG12 VAL 90 HG12 VAL 90 -6.607 -3.494 1.420 580 HG13 VAL 90 HG13 VAL 90 -6.375 -2.819 -0.192 581 HG21 VAL 90 HG21 VAL 90 -7.953 -0.164 0.375 582 HG22 VAL 90 HG22 VAL 90 -6.441 -0.358 -0.513 583 HG23 VAL 90 HG23 VAL 90 -6.513 0.721 0.881 584 H TYR 91 HN TYR 91 -8.862 0.645 2.867 585 HA TYR 91 HA TYR 91 -11.110 -1.161 2.331 586 HB2 TYR 91 HB2 TYR 91 -11.008 0.824 4.619 587 HB3 TYR 91 HB1 TYR 91 -12.447 -0.052 4.115 588 HD1 TYR 91 HD1 TYR 91 -12.495 -2.553 4.350 589 HD2 TYR 91 HD2 TYR 91 -9.411 -0.170 6.052 590 HE1 TYR 91 HE1 TYR 91 -11.886 -4.412 5.840 591 HE2 TYR 91 HE2 TYR 91 -8.798 -2.019 7.549 592 HH TYR 91 HH TYR 91 -9.194 -4.096 8.161 593 H GLN 92 HN GLN 92 -13.112 0.099 1.745 594 HA GLN 92 HA GLN 92 -12.328 2.268 -0.003 595 HB2 GLN 92 HB2 GLN 92 -14.033 0.293 -0.445 596 HB3 GLN 92 HB1 GLN 92 -15.171 1.420 0.283 597 HG2 GLN 92 HG2 GLN 92 -14.772 3.045 -1.394 598 HG3 GLN 92 HG1 GLN 92 -13.394 2.148 -2.027 599 HE21 GLN 92 HE21 GLN 92 -16.825 2.455 -1.960 600 HE22 GLN 92 HE22 GLN 92 -17.164 1.282 -3.182 601 H GLU 93 HN GLU 93 -12.793 4.365 0.241 602 HA GLU 93 HA GLU 93 -13.454 5.322 2.829 603 HB2 GLU 93 HB2 GLU 93 -12.875 6.567 0.181 604 HB3 GLU 93 HB1 GLU 93 -13.590 7.560 1.446 605 HG2 GLU 93 HG2 GLU 93 -11.087 5.948 1.835 606 HG3 GLU 93 HG1 GLU 93 -11.091 7.625 1.290 607 H GLN 94 HN GLN 94 -15.169 6.702 3.422 608 HA GLN 94 HA GLN 94 -17.720 5.741 2.762 609 HB2 GLN 94 HB2 GLN 94 -17.043 6.801 4.918 610 HB3 GLN 94 HB1 GLN 94 -17.026 8.355 4.101 611 HG2 GLN 94 HG2 GLN 94 -19.407 8.152 3.637 612 HG3 GLN 94 HG1 GLN 94 -19.427 6.571 4.423 613 HE21 GLN 94 HE21 GLN 94 -19.376 6.439 6.624 614 HE22 GLN 94 HE22 GLN 94 -19.547 7.811 7.660 615 H THR 95 HN THR 95 -15.882 8.489 1.590 616 HA THR 95 HA THR 95 -18.052 9.723 0.200 617 HB THR 95 HB THR 95 -15.895 10.748 -1.034 618 HG1 THR 95 HG1 THR 95 -14.106 10.629 0.260 619 HG21 THR 95 HG21 THR 95 -17.511 12.005 0.315 620 HG22 THR 95 HG22 THR 95 -15.856 12.485 0.685 621 HG23 THR 95 HG23 THR 95 -16.734 11.424 1.788 622 H GLY 96 HN GLY 96 -15.849 7.158 -0.482 623 HA2 GLY 96 HA2 GLY 96 -16.090 5.621 -2.235 624 HA3 GLY 96 HA1 GLY 96 -17.082 6.790 -3.096 625 H GLY 97 HN GLY 97 -15.024 8.907 -2.571 626 HA2 GLY 97 HA2 GLY 97 -12.542 8.752 -3.305 627 HA3 GLY 97 HA1 GLY 97 -13.270 8.173 -4.799 628 H1 ASN 357 HT1 ASN 357 -6.057 -18.237 -6.571 629 H2 ASN 357 HT2 ASN 357 -5.938 -18.601 -4.927 630 H3 ASN 357 HT3 ASN 357 -4.978 -19.426 -6.047 631 HA ASN 357 HA ASN 357 -3.741 -17.758 -4.810 632 HB2 ASN 357 HB2 ASN 357 -2.919 -16.481 -6.913 633 HB3 ASN 357 HB1 ASN 357 -2.743 -18.231 -6.867 634 HD21 ASN 357 HD21 ASN 357 -4.257 -15.552 -8.427 635 HD22 ASN 357 HD22 ASN 357 -5.035 -16.457 -9.680 636 H ASN 358 HN ASN 358 -4.617 -16.330 -3.430 637 HA ASN 358 HA ASN 358 -6.008 -13.992 -4.561 638 HB2 ASN 358 HB2 ASN 358 -6.994 -13.671 -2.342 639 HB3 ASN 358 HB1 ASN 358 -7.318 -15.297 -2.923 640 HD21 ASN 358 HD21 ASN 358 -7.487 -14.486 -0.245 641 HD22 ASN 358 HD22 ASN 358 -6.278 -15.325 0.660 642 H ARG 359 HN ARG 359 -3.137 -14.488 -4.464 643 HA ARG 359 HA ARG 359 -2.315 -12.047 -3.097 644 HB2 ARG 359 HB2 ARG 359 -1.804 -13.683 -1.447 645 HB3 ARG 359 HB1 ARG 359 -1.169 -14.797 -2.644 646 HG2 ARG 359 HG2 ARG 359 0.640 -13.061 -3.071 647 HG3 ARG 359 HG1 ARG 359 0.080 -12.293 -1.584 648 HD2 ARG 359 HD2 ARG 359 1.013 -15.147 -1.826 649 HD3 ARG 359 HD1 ARG 359 1.972 -13.805 -1.199 650 HE ARG 359 HE ARG 359 -0.309 -13.810 0.318 651 HH11 ARG 359 HH11 ARG 359 2.204 -16.135 -0.451 652 HH12 ARG 359 HH12 ARG 359 2.050 -17.003 1.124 653 HH21 ARG 359 HH21 ARG 359 -0.503 -14.819 2.357 654 HH22 ARG 359 HH22 ARG 359 0.572 -16.236 2.720 655 H ASP 360 HN ASP 360 -1.143 -10.848 -4.474 656 HA ASP 360 HA ASP 360 0.627 -12.199 -6.366 657 HB2 ASP 360 HB2 ASP 360 -0.105 -10.941 -8.259 658 HB3 ASP 360 HB1 ASP 360 -1.538 -11.652 -7.530 659 HA PRO 361 HA PRO 361 3.253 -8.886 -5.005 660 HB2 PRO 361 HB2 PRO 361 5.386 -9.605 -6.666 661 HB3 PRO 361 HB1 PRO 361 5.054 -10.258 -5.058 662 HG2 PRO 361 HG2 PRO 361 4.933 -11.651 -7.510 663 HG3 PRO 361 HG1 PRO 361 4.433 -12.236 -5.916 664 HD2 PRO 361 HD2 PRO 361 2.782 -11.176 -8.131 665 HD3 PRO 361 HD1 PRO 361 2.362 -12.325 -6.847 666 H ILE 362 HN ILE 362 3.512 -6.816 -5.558 667 HA ILE 362 HA ILE 362 3.486 -6.123 -8.424 668 HB ILE 362 HB ILE 362 2.650 -4.159 -6.326 669 HG12 ILE 362 HG12 ILE 362 0.730 -6.082 -7.648 670 HG13 ILE 362 HG11 ILE 362 1.329 -6.285 -6.003 671 HG21 ILE 362 HG21 ILE 362 1.869 -4.560 -9.212 672 HG22 ILE 362 HG22 ILE 362 3.033 -3.382 -8.602 673 HG23 ILE 362 HG23 ILE 362 1.326 -3.245 -8.173 674 HD11 ILE 362 HD11 ILE 362 -0.251 -3.936 -7.024 675 HD12 ILE 362 HD12 ILE 362 0.326 -4.159 -5.373 676 HD13 ILE 362 HD13 ILE 362 -0.878 -5.260 -6.041 677 H VAL 363 HN VAL 363 5.256 -5.109 -9.172 678 HA VAL 363 HA VAL 363 6.962 -3.708 -7.215 679 HB VAL 363 HB VAL 363 8.043 -5.074 -9.678 680 HG11 VAL 363 HG11 VAL 363 9.465 -3.354 -8.765 681 HG12 VAL 363 HG12 VAL 363 10.175 -4.935 -8.433 682 HG13 VAL 363 HG13 VAL 363 9.338 -4.059 -7.152 683 HG21 VAL 363 HG21 VAL 363 6.987 -6.771 -8.235 684 HG22 VAL 363 HG22 VAL 363 7.986 -6.223 -6.891 685 HG23 VAL 363 HG23 VAL 363 8.740 -6.945 -8.310 686 H ILE 364 HN ILE 364 7.300 -1.607 -7.689 687 HA ILE 364 HA ILE 364 6.873 -0.752 -10.475 688 HB ILE 364 HB ILE 364 5.953 1.344 -9.733 689 HG12 ILE 364 HG12 ILE 364 5.871 0.486 -6.872 690 HG13 ILE 364 HG11 ILE 364 7.372 1.156 -7.501 691 HG21 ILE 364 HG21 ILE 364 3.892 0.552 -8.569 692 HG22 ILE 364 HG22 ILE 364 4.657 -1.029 -8.416 693 HG23 ILE 364 HG23 ILE 364 4.323 -0.361 -10.013 694 HD11 ILE 364 HD11 ILE 364 6.135 3.171 -8.200 695 HD12 ILE 364 HD12 ILE 364 6.083 2.890 -6.461 696 HD13 ILE 364 HD13 ILE 364 4.681 2.501 -7.458 697 H SER 365 HN SER 365 7.707 1.813 -10.386 698 HA SER 365 HA SER 365 10.234 2.041 -9.024 699 HB2 SER 365 HB2 SER 365 11.212 2.565 -11.487 700 HB3 SER 365 HB1 SER 365 11.344 0.988 -10.709 701 HG SER 365 HG SER 365 9.003 1.466 -12.126 702 H ASP 366 HN ASP 366 10.982 4.162 -8.951 703 HA ASP 366 HA ASP 366 9.302 6.158 -10.306 704 HB2 ASP 366 HB2 ASP 366 8.774 5.926 -7.839 705 HB3 ASP 366 HB1 ASP 366 10.409 6.491 -7.509 706 H SER 367 HN SER 367 10.343 8.163 -10.752 707 HA SER 367 HA SER 367 13.278 8.056 -10.661 708 HB2 SER 367 HB2 SER 367 11.765 9.161 -13.027 709 HB3 SER 367 HB1 SER 367 13.478 8.747 -12.920 710 HG SER 367 HG SER 367 12.365 6.529 -12.376 711 HA PRO 368 HA PRO 368 12.239 11.972 -8.698 712 HB2 PRO 368 HB2 PRO 368 14.811 12.504 -7.913 713 HB3 PRO 368 HB1 PRO 368 13.688 11.493 -6.993 714 HG2 PRO 368 HG2 PRO 368 15.900 10.678 -8.812 715 HG3 PRO 368 HG1 PRO 368 15.365 9.947 -7.288 716 HD2 PRO 368 HD2 PRO 368 14.742 8.901 -9.700 717 HD3 PRO 368 HD1 PRO 368 13.675 8.762 -8.288 Start of MODEL 14 1 H TYR 21 HT1 TYR 21 14.956 -4.728 -1.009 2 HA TYR 21 HA TYR 21 13.021 -3.809 -2.122 3 HB2 TYR 21 HB2 TYR 21 12.728 -6.682 -2.989 4 HB3 TYR 21 HB1 TYR 21 11.354 -5.589 -2.941 5 HD1 TYR 21 HD1 TYR 21 11.296 -3.616 -4.458 6 HD2 TYR 21 HD2 TYR 21 14.332 -6.582 -4.753 7 HE1 TYR 21 HE1 TYR 21 11.841 -2.827 -6.722 8 HE2 TYR 21 HE2 TYR 21 14.888 -5.800 -7.013 9 HH TYR 21 HH TYR 21 13.914 -4.589 -8.827 10 H ILE 22 HN ILE 22 11.168 -3.583 -0.875 11 HA ILE 22 HA ILE 22 11.106 -5.256 1.549 12 HB ILE 22 HB ILE 22 9.946 -2.494 1.116 13 HG12 ILE 22 HG12 ILE 22 12.409 -2.503 1.189 14 HG13 ILE 22 HG11 ILE 22 11.719 -1.702 2.591 15 HG21 ILE 22 HG21 ILE 22 8.653 -3.800 2.718 16 HG22 ILE 22 HG22 ILE 22 9.527 -2.499 3.527 17 HG23 ILE 22 HG23 ILE 22 10.124 -4.155 3.627 18 HD11 ILE 22 HD11 ILE 22 13.575 -3.048 3.278 19 HD12 ILE 22 HD12 ILE 22 12.886 -4.470 2.497 20 HD13 ILE 22 HD13 ILE 22 12.088 -3.761 3.899 21 H LYS 23 HN LYS 23 9.401 -6.555 1.869 22 HA LYS 23 HA LYS 23 7.216 -6.387 -0.083 23 HB2 LYS 23 HB2 LYS 23 8.330 -8.592 1.601 24 HB3 LYS 23 HB1 LYS 23 6.694 -8.709 0.969 25 HG2 LYS 23 HG2 LYS 23 7.397 -8.864 -1.210 26 HG3 LYS 23 HG1 LYS 23 8.927 -8.050 -0.886 27 HD2 LYS 23 HD2 LYS 23 9.091 -10.518 -1.353 28 HD3 LYS 23 HD1 LYS 23 9.833 -9.984 0.155 29 HE2 LYS 23 HE2 LYS 23 7.010 -10.803 0.343 30 HE3 LYS 23 HE1 LYS 23 8.150 -12.086 -0.056 31 HZ1 LYS 23 HZ1 LYS 23 7.612 -11.041 2.443 32 HZ2 LYS 23 HZ2 LYS 23 9.170 -10.485 2.044 33 HZ3 LYS 23 HZ3 LYS 23 8.832 -12.143 2.032 34 H LEU 24 HN LEU 24 5.554 -5.229 0.547 35 HA LEU 24 HA LEU 24 4.697 -5.327 3.356 36 HB2 LEU 24 HB2 LEU 24 3.952 -3.451 1.104 37 HB3 LEU 24 HB1 LEU 24 3.246 -3.396 2.708 38 HG LEU 24 HG LEU 24 6.173 -2.968 2.106 39 HD11 LEU 24 HD11 LEU 24 4.821 -1.168 1.191 40 HD12 LEU 24 HD12 LEU 24 5.720 -0.618 2.605 41 HD13 LEU 24 HD13 LEU 24 3.998 -0.980 2.740 42 HD21 LEU 24 HD21 LEU 24 5.854 -3.830 4.328 43 HD22 LEU 24 HD22 LEU 24 4.555 -2.676 4.632 44 HD23 LEU 24 HD23 LEU 24 6.213 -2.107 4.432 45 H LYS 25 HN LYS 25 2.784 -6.269 3.917 46 HA LYS 25 HA LYS 25 1.351 -7.627 1.750 47 HB2 LYS 25 HB2 LYS 25 1.117 -8.153 4.710 48 HB3 LYS 25 HB1 LYS 25 0.556 -9.174 3.391 49 HG2 LYS 25 HG2 LYS 25 2.805 -9.676 2.742 50 HG3 LYS 25 HG1 LYS 25 3.447 -8.518 3.908 51 HD2 LYS 25 HD2 LYS 25 3.705 -10.538 5.007 52 HD3 LYS 25 HD1 LYS 25 2.175 -9.945 5.652 53 HE2 LYS 25 HE2 LYS 25 0.929 -11.482 4.474 54 HE3 LYS 25 HE1 LYS 25 2.171 -11.699 3.240 55 HZ1 LYS 25 HZ1 LYS 25 2.012 -13.628 4.679 56 HZ2 LYS 25 HZ2 LYS 25 2.331 -12.673 6.042 57 HZ3 LYS 25 HZ3 LYS 25 3.526 -12.878 4.856 58 H VAL 26 HN VAL 26 -0.371 -6.655 1.021 59 HA VAL 26 HA VAL 26 -1.931 -4.915 2.791 60 HB VAL 26 HB VAL 26 -2.442 -5.299 -0.153 61 HG11 VAL 26 HG11 VAL 26 -3.370 -3.054 -0.003 62 HG12 VAL 26 HG12 VAL 26 -2.928 -2.973 1.702 63 HG13 VAL 26 HG13 VAL 26 -4.141 -4.133 1.161 64 HG21 VAL 26 HG21 VAL 26 -0.478 -3.368 1.079 65 HG22 VAL 26 HG22 VAL 26 -0.987 -3.377 -0.611 66 HG23 VAL 26 HG23 VAL 26 -0.081 -4.741 0.046 67 H ILE 27 HN ILE 27 -3.654 -5.743 3.771 68 HA ILE 27 HA ILE 27 -4.783 -8.253 2.821 69 HB ILE 27 HB ILE 27 -5.498 -6.635 5.270 70 HG12 ILE 27 HG12 ILE 27 -3.184 -7.472 5.327 71 HG13 ILE 27 HG11 ILE 27 -4.192 -8.284 6.519 72 HG21 ILE 27 HG21 ILE 27 -6.566 -8.740 6.035 73 HG22 ILE 27 HG22 ILE 27 -6.269 -9.428 4.440 74 HG23 ILE 27 HG23 ILE 27 -7.342 -8.041 4.616 75 HD11 ILE 27 HD11 ILE 27 -4.407 -10.194 4.961 76 HD12 ILE 27 HD12 ILE 27 -2.750 -9.883 5.478 77 HD13 ILE 27 HD13 ILE 27 -3.280 -9.384 3.872 78 H GLY 28 HN GLY 28 -6.164 -8.062 1.193 79 HA2 GLY 28 HA2 GLY 28 -7.773 -5.744 0.749 80 HA3 GLY 28 HA1 GLY 28 -7.859 -7.258 -0.140 81 H GLN 29 HN GLN 29 -10.193 -6.213 0.170 82 HA GLN 29 HA GLN 29 -11.530 -6.642 2.613 83 HB2 GLN 29 HB2 GLN 29 -12.306 -5.210 0.684 84 HB3 GLN 29 HB1 GLN 29 -12.784 -6.691 -0.131 85 HG2 GLN 29 HG2 GLN 29 -14.745 -5.913 0.834 86 HG3 GLN 29 HG1 GLN 29 -14.195 -7.166 1.941 87 HE21 GLN 29 HE21 GLN 29 -13.532 -6.621 3.978 88 HE22 GLN 29 HE22 GLN 29 -13.755 -5.044 4.652 89 H ASP 30 HN ASP 30 -10.751 -8.774 -0.031 90 HA ASP 30 HA ASP 30 -12.529 -10.857 0.956 91 HB2 ASP 30 HB2 ASP 30 -12.021 -12.068 -1.018 92 HB3 ASP 30 HB1 ASP 30 -12.163 -10.387 -1.520 93 H SER 31 HN SER 31 -9.865 -9.729 2.150 94 HA SER 31 HA SER 31 -8.203 -10.490 3.482 95 HB2 SER 31 HB2 SER 31 -9.640 -13.146 3.349 96 HB3 SER 31 HB1 SER 31 -8.472 -12.646 4.571 97 HG SER 31 HG SER 31 -11.132 -11.859 4.203 98 H SER 32 HN SER 32 -7.339 -10.238 1.037 99 HA SER 32 HA SER 32 -6.038 -12.716 0.207 100 HB2 SER 32 HB2 SER 32 -5.274 -10.936 -1.655 101 HB3 SER 32 HB1 SER 32 -6.827 -11.771 -1.724 102 HG SER 32 HG SER 32 -7.838 -9.961 -1.310 103 H GLU 33 HN GLU 33 -3.716 -12.645 -0.358 104 HA GLU 33 HA GLU 33 -2.241 -10.965 1.553 105 HB2 GLU 33 HB2 GLU 33 -1.790 -13.681 0.410 106 HB3 GLU 33 HB1 GLU 33 -0.380 -12.716 0.814 107 HG2 GLU 33 HG2 GLU 33 -1.366 -12.458 3.121 108 HG3 GLU 33 HG1 GLU 33 -2.549 -13.679 2.655 109 H ILE 34 HN ILE 34 -2.522 -9.203 -0.051 110 HA ILE 34 HA ILE 34 -1.174 -9.403 -2.574 111 HB ILE 34 HB ILE 34 -2.021 -6.887 -1.135 112 HG12 ILE 34 HG12 ILE 34 -3.940 -8.394 -1.364 113 HG13 ILE 34 HG11 ILE 34 -4.103 -7.020 -2.451 114 HG21 ILE 34 HG21 ILE 34 -2.031 -5.880 -3.339 115 HG22 ILE 34 HG22 ILE 34 -1.578 -7.419 -4.070 116 HG23 ILE 34 HG23 ILE 34 -0.449 -6.579 -3.004 117 HD11 ILE 34 HD11 ILE 34 -3.250 -9.808 -3.196 118 HD12 ILE 34 HD12 ILE 34 -3.302 -8.436 -4.302 119 HD13 ILE 34 HD13 ILE 34 -4.790 -9.033 -3.568 120 H HIS 35 HN HIS 35 0.963 -9.613 -2.636 121 HA HIS 35 HA HIS 35 2.620 -8.377 -0.583 122 HB2 HIS 35 HB2 HIS 35 2.897 -10.629 -2.441 123 HB3 HIS 35 HB1 HIS 35 4.349 -9.643 -2.310 124 HD2 HIS 35 HD2 HIS 35 4.477 -9.082 0.832 125 HE1 HIS 35 HE1 HIS 35 4.068 -13.276 1.222 126 HE2 HIS 35 HE2 HIS 35 4.987 -11.165 2.298 127 H PHE 36 HN PHE 36 2.780 -6.221 -1.023 128 HA PHE 36 HA PHE 36 3.370 -5.371 -3.736 129 HB2 PHE 36 HB2 PHE 36 1.948 -4.156 -1.799 130 HB3 PHE 36 HB1 PHE 36 3.520 -3.415 -1.512 131 HD1 PHE 36 HD1 PHE 36 4.686 -2.922 -4.029 132 HD2 PHE 36 HD2 PHE 36 0.564 -2.760 -2.975 133 HE1 PHE 36 HE1 PHE 36 4.277 -1.358 -5.882 134 HE2 PHE 36 HE2 PHE 36 0.152 -1.195 -4.829 135 HZ PHE 36 HZ PHE 36 2.008 -0.492 -6.284 136 H LYS 37 HN LYS 37 5.360 -5.483 -4.467 137 HA LYS 37 HA LYS 37 7.595 -5.555 -2.618 138 HB2 LYS 37 HB2 LYS 37 7.325 -7.052 -4.679 139 HB3 LYS 37 HB1 LYS 37 7.746 -5.636 -5.630 140 HG2 LYS 37 HG2 LYS 37 9.900 -5.506 -4.588 141 HG3 LYS 37 HG1 LYS 37 9.481 -6.803 -3.468 142 HD2 LYS 37 HD2 LYS 37 9.453 -7.202 -6.446 143 HD3 LYS 37 HD1 LYS 37 10.923 -7.408 -5.494 144 HE2 LYS 37 HE2 LYS 37 9.626 -9.032 -4.064 145 HE3 LYS 37 HE1 LYS 37 8.340 -8.940 -5.267 146 HZ1 LYS 37 HZ1 LYS 37 9.851 -9.768 -6.929 147 HZ2 LYS 37 HZ2 LYS 37 9.821 -10.840 -5.622 148 HZ3 LYS 37 HZ3 LYS 37 11.128 -9.784 -5.825 149 H VAL 38 HN VAL 38 7.759 -3.505 -1.800 150 HA VAL 38 HA VAL 38 7.950 -1.271 -3.674 151 HB VAL 38 HB VAL 38 7.693 0.201 -1.808 152 HG11 VAL 38 HG11 VAL 38 5.845 -2.163 -1.514 153 HG12 VAL 38 HG12 VAL 38 5.640 -0.804 -2.619 154 HG13 VAL 38 HG13 VAL 38 5.545 -0.546 -0.878 155 HG21 VAL 38 HG21 VAL 38 7.999 -2.232 -0.049 156 HG22 VAL 38 HG22 VAL 38 7.529 -0.628 0.514 157 HG23 VAL 38 HG23 VAL 38 9.126 -0.883 -0.189 158 H LYS 39 HN LYS 39 9.592 0.391 -3.229 159 HA LYS 39 HA LYS 39 12.187 -0.850 -2.634 160 HB2 LYS 39 HB2 LYS 39 11.744 0.082 -4.952 161 HB3 LYS 39 HB1 LYS 39 11.672 1.675 -4.211 162 HG2 LYS 39 HG2 LYS 39 13.975 1.415 -3.435 163 HG3 LYS 39 HG1 LYS 39 14.047 -0.174 -4.199 164 HD2 LYS 39 HD2 LYS 39 13.617 0.856 -6.377 165 HD3 LYS 39 HD1 LYS 39 13.550 2.444 -5.612 166 HE2 LYS 39 HE2 LYS 39 15.849 2.330 -5.001 167 HE3 LYS 39 HE1 LYS 39 15.948 0.637 -5.486 168 HZ1 LYS 39 HZ1 LYS 39 16.906 2.200 -7.117 169 HZ2 LYS 39 HZ2 LYS 39 15.375 2.871 -7.353 170 HZ3 LYS 39 HZ3 LYS 39 15.661 1.254 -7.757 171 H MET 40 HN MET 40 13.299 -0.116 -0.920 172 HA MET 40 HA MET 40 12.087 1.851 0.774 173 HB2 MET 40 HB2 MET 40 13.196 -0.111 1.736 174 HB3 MET 40 HB1 MET 40 14.731 0.416 1.059 175 HG2 MET 40 HG2 MET 40 14.556 0.926 3.442 176 HG3 MET 40 HG1 MET 40 14.727 2.377 2.462 177 HE1 MET 40 HE1 MET 40 11.502 0.131 3.400 178 HE2 MET 40 HE2 MET 40 11.015 1.058 4.817 179 HE3 MET 40 HE3 MET 40 12.586 0.261 4.785 180 H THR 41 HN THR 41 12.115 3.679 -0.519 181 HA THR 41 HA THR 41 13.977 5.604 0.023 182 HB THR 41 HB THR 41 15.579 4.263 -1.349 183 HG1 THR 41 HG1 THR 41 14.841 6.841 -2.326 184 HG21 THR 41 HG21 THR 41 14.094 3.334 -3.011 185 HG22 THR 41 HG22 THR 41 15.319 4.313 -3.816 186 HG23 THR 41 HG23 THR 41 13.685 4.942 -3.600 187 H THR 42 HN THR 42 11.691 4.277 -2.245 188 HA THR 42 HA THR 42 10.956 6.847 -3.328 189 HB THR 42 HB THR 42 9.340 4.343 -3.686 190 HG1 THR 42 HG1 THR 42 11.804 4.951 -5.001 191 HG21 THR 42 HG21 THR 42 8.582 6.463 -4.707 192 HG22 THR 42 HG22 THR 42 8.993 5.248 -5.920 193 HG23 THR 42 HG23 THR 42 10.112 6.568 -5.580 194 H HIS 43 HN HIS 43 9.054 7.950 -2.918 195 HA HIS 43 HA HIS 43 7.978 7.724 -0.308 196 HB2 HIS 43 HB2 HIS 43 7.858 9.587 -2.484 197 HB3 HIS 43 HB1 HIS 43 6.220 9.261 -1.924 198 HD2 HIS 43 HD2 HIS 43 6.022 9.577 1.007 199 HE1 HIS 43 HE1 HIS 43 8.980 12.596 0.915 200 HE2 HIS 43 HE2 HIS 43 7.268 11.407 2.355 201 H LEU 44 HN LEU 44 5.929 7.080 0.379 202 HA LEU 44 HA LEU 44 4.850 4.820 -0.893 203 HB2 LEU 44 HB2 LEU 44 3.906 6.578 1.342 204 HB3 LEU 44 HB1 LEU 44 2.878 5.298 0.725 205 HG LEU 44 HG LEU 44 5.663 4.849 1.797 206 HD11 LEU 44 HD11 LEU 44 2.988 4.601 3.149 207 HD12 LEU 44 HD12 LEU 44 4.344 5.627 3.617 208 HD13 LEU 44 HD13 LEU 44 4.473 3.874 3.761 209 HD21 LEU 44 HD21 LEU 44 4.873 2.493 1.919 210 HD22 LEU 44 HD22 LEU 44 5.012 3.118 0.278 211 HD23 LEU 44 HD23 LEU 44 3.428 2.978 1.037 212 H LYS 45 HN LYS 45 4.369 8.130 -1.447 213 HA LYS 45 HA LYS 45 1.775 8.365 -2.337 214 HB2 LYS 45 HB2 LYS 45 3.116 10.316 -2.229 215 HB3 LYS 45 HB1 LYS 45 4.346 9.621 -3.274 216 HG2 LYS 45 HG2 LYS 45 3.182 11.260 -4.530 217 HG3 LYS 45 HG1 LYS 45 2.686 9.679 -5.138 218 HD2 LYS 45 HD2 LYS 45 0.658 9.822 -3.731 219 HD3 LYS 45 HD1 LYS 45 1.146 11.442 -3.236 220 HE2 LYS 45 HE2 LYS 45 1.048 12.180 -5.574 221 HE3 LYS 45 HE1 LYS 45 0.551 10.559 -6.062 222 HZ1 LYS 45 HZ1 LYS 45 -1.537 10.917 -5.382 223 HZ2 LYS 45 HZ2 LYS 45 -1.132 12.557 -5.454 224 HZ3 LYS 45 HZ3 LYS 45 -1.067 11.733 -3.973 225 H LYS 46 HN LYS 46 4.630 7.386 -4.217 226 HA LYS 46 HA LYS 46 3.235 6.925 -6.625 227 HB2 LYS 46 HB2 LYS 46 5.773 7.218 -6.230 228 HB3 LYS 46 HB1 LYS 46 5.772 5.494 -5.886 229 HG2 LYS 46 HG2 LYS 46 6.384 5.795 -8.166 230 HG3 LYS 46 HG1 LYS 46 4.753 5.114 -8.127 231 HD2 LYS 46 HD2 LYS 46 3.920 7.512 -8.308 232 HD3 LYS 46 HD1 LYS 46 5.583 7.947 -8.696 233 HE2 LYS 46 HE2 LYS 46 5.567 6.668 -10.673 234 HE3 LYS 46 HE1 LYS 46 4.090 5.822 -10.205 235 HZ1 LYS 46 HZ1 LYS 46 4.292 8.703 -10.879 236 HZ2 LYS 46 HZ2 LYS 46 2.869 7.899 -10.422 237 HZ3 LYS 46 HZ3 LYS 46 3.645 7.499 -11.875 238 H LEU 47 HN LEU 47 4.002 4.853 -3.898 239 HA LEU 47 HA LEU 47 3.225 2.420 -5.145 240 HB2 LEU 47 HB2 LEU 47 3.570 3.234 -2.268 241 HB3 LEU 47 HB1 LEU 47 3.025 1.628 -2.713 242 HG LEU 47 HG LEU 47 5.313 1.358 -2.348 243 HD11 LEU 47 HD11 LEU 47 6.272 0.805 -4.461 244 HD12 LEU 47 HD12 LEU 47 5.189 1.914 -5.300 245 HD13 LEU 47 HD13 LEU 47 4.542 0.463 -4.535 246 HD21 LEU 47 HD21 LEU 47 5.760 3.919 -3.867 247 HD22 LEU 47 HD22 LEU 47 7.041 2.859 -3.278 248 HD23 LEU 47 HD23 LEU 47 5.966 3.665 -2.134 249 H LYS 48 HN LYS 48 1.545 4.809 -3.181 250 HA LYS 48 HA LYS 48 -0.857 3.366 -2.834 251 HB2 LYS 48 HB2 LYS 48 -0.262 6.321 -2.753 252 HB3 LYS 48 HB1 LYS 48 -1.833 5.642 -2.349 253 HG2 LYS 48 HG2 LYS 48 -0.920 4.456 -0.488 254 HG3 LYS 48 HG1 LYS 48 0.725 4.888 -0.957 255 HD2 LYS 48 HD2 LYS 48 0.150 6.348 0.813 256 HD3 LYS 48 HD1 LYS 48 0.035 7.307 -0.664 257 HE2 LYS 48 HE2 LYS 48 -2.433 6.803 -0.669 258 HE3 LYS 48 HE1 LYS 48 -2.221 6.104 0.935 259 HZ1 LYS 48 HZ1 LYS 48 -1.193 8.344 1.523 260 HZ2 LYS 48 HZ2 LYS 48 -2.873 8.288 1.331 261 HZ3 LYS 48 HZ3 LYS 48 -1.902 8.925 0.092 262 H GLU 49 HN GLU 49 0.095 5.815 -5.256 263 HA GLU 49 HA GLU 49 -2.428 5.830 -6.553 264 HB2 GLU 49 HB2 GLU 49 -1.261 6.993 -8.401 265 HB3 GLU 49 HB1 GLU 49 -0.941 7.709 -6.830 266 HG2 GLU 49 HG2 GLU 49 1.219 6.551 -6.765 267 HG3 GLU 49 HG1 GLU 49 0.900 5.891 -8.367 268 H SER 50 HN SER 50 0.514 3.946 -7.045 269 HA SER 50 HA SER 50 -0.240 2.745 -9.478 270 HB2 SER 50 HB2 SER 50 1.562 1.647 -7.305 271 HB3 SER 50 HB1 SER 50 1.480 1.062 -8.968 272 HG SER 50 HG SER 50 2.457 3.522 -7.990 273 H TYR 51 HN TYR 51 -0.870 1.895 -6.115 274 HA TYR 51 HA TYR 51 -1.991 -0.646 -6.583 275 HB2 TYR 51 HB2 TYR 51 -1.304 0.135 -4.339 276 HB3 TYR 51 HB1 TYR 51 -2.612 1.311 -4.352 277 HD1 TYR 51 HD1 TYR 51 -1.882 -2.328 -4.357 278 HD2 TYR 51 HD2 TYR 51 -4.793 0.705 -3.697 279 HE1 TYR 51 HE1 TYR 51 -3.399 -4.003 -3.385 280 HE2 TYR 51 HE2 TYR 51 -6.314 -0.960 -2.722 281 HH TYR 51 HH TYR 51 -6.699 -3.352 -2.766 282 H CYS 52 HN CYS 52 -3.393 2.584 -6.439 283 HA CYS 52 HA CYS 52 -6.090 1.846 -6.686 284 HB2 CYS 52 HB2 CYS 52 -4.789 4.392 -7.674 285 HB3 CYS 52 HB1 CYS 52 -6.492 4.162 -7.299 286 HG CYS 52 HG CYS 52 -3.919 4.143 -5.032 287 H GLN 53 HN GLN 53 -3.626 2.617 -9.118 288 HA GLN 53 HA GLN 53 -5.296 2.521 -11.374 289 HB2 GLN 53 HB2 GLN 53 -2.362 1.822 -11.176 290 HB3 GLN 53 HB1 GLN 53 -3.231 2.159 -12.665 291 HG2 GLN 53 HG2 GLN 53 -3.663 4.441 -11.892 292 HG3 GLN 53 HG1 GLN 53 -2.770 4.097 -10.410 293 HE21 GLN 53 HE21 GLN 53 -2.200 6.120 -12.359 294 HE22 GLN 53 HE22 GLN 53 -0.625 5.789 -12.988 295 H ARG 54 HN ARG 54 -3.487 -0.002 -9.687 296 HA ARG 54 HA ARG 54 -3.979 -2.079 -11.531 297 HB2 ARG 54 HB2 ARG 54 -2.234 -2.333 -9.893 298 HB3 ARG 54 HB1 ARG 54 -3.376 -2.139 -8.571 299 HG2 ARG 54 HG2 ARG 54 -4.510 -4.243 -9.531 300 HG3 ARG 54 HG1 ARG 54 -2.991 -4.479 -10.398 301 HD2 ARG 54 HD2 ARG 54 -1.805 -4.889 -8.477 302 HD3 ARG 54 HD1 ARG 54 -2.896 -3.937 -7.472 303 HE ARG 54 HE ARG 54 -4.458 -5.763 -7.531 304 HH11 ARG 54 HH11 ARG 54 -1.235 -6.471 -8.774 305 HH12 ARG 54 HH12 ARG 54 -1.399 -8.253 -8.510 306 HH21 ARG 54 HH21 ARG 54 -4.713 -8.011 -7.219 307 HH22 ARG 54 HH22 ARG 54 -3.360 -9.109 -7.688 308 H GLN 55 HN GLN 55 -5.766 -0.922 -8.723 309 HA GLN 55 HA GLN 55 -7.709 -3.030 -8.854 310 HB2 GLN 55 HB2 GLN 55 -7.784 -0.412 -7.348 311 HB3 GLN 55 HB1 GLN 55 -8.892 -1.758 -7.115 312 HG2 GLN 55 HG2 GLN 55 -5.933 -1.737 -6.565 313 HG3 GLN 55 HG1 GLN 55 -7.234 -1.764 -5.377 314 HE21 GLN 55 HE21 GLN 55 -8.372 -3.669 -5.032 315 HE22 GLN 55 HE22 GLN 55 -7.787 -5.201 -5.583 316 H GLY 56 HN GLY 56 -7.234 -0.125 -10.530 317 HA2 GLY 56 HA2 GLY 56 -8.435 0.677 -12.343 318 HA3 GLY 56 HA1 GLY 56 -9.693 -0.499 -11.998 319 H VAL 57 HN VAL 57 -8.478 1.735 -9.601 320 HA VAL 57 HA VAL 57 -10.938 3.328 -9.861 321 HB VAL 57 HB VAL 57 -10.995 3.484 -7.339 322 HG11 VAL 57 HG11 VAL 57 -12.159 1.346 -7.045 323 HG12 VAL 57 HG12 VAL 57 -11.460 0.760 -8.555 324 HG13 VAL 57 HG13 VAL 57 -12.591 2.113 -8.573 325 HG21 VAL 57 HG21 VAL 57 -9.160 1.096 -7.518 326 HG22 VAL 57 HG22 VAL 57 -9.906 1.727 -6.050 327 HG23 VAL 57 HG23 VAL 57 -8.714 2.693 -6.919 328 HA PRO 58 HA PRO 58 -8.215 6.791 -9.493 329 HB2 PRO 58 HB2 PRO 58 -10.204 8.311 -7.995 330 HB3 PRO 58 HB1 PRO 58 -9.648 8.547 -9.655 331 HG2 PRO 58 HG2 PRO 58 -12.136 7.675 -9.072 332 HG3 PRO 58 HG1 PRO 58 -11.268 7.205 -10.548 333 HD2 PRO 58 HD2 PRO 58 -11.666 5.658 -8.021 334 HD3 PRO 58 HD1 PRO 58 -11.710 5.101 -9.708 335 H MET 59 HN MET 59 -7.126 8.197 -7.934 336 HA MET 59 HA MET 59 -6.562 6.819 -5.499 337 HB2 MET 59 HB2 MET 59 -5.060 8.396 -6.997 338 HB3 MET 59 HB1 MET 59 -5.703 9.646 -5.940 339 HG2 MET 59 HG2 MET 59 -4.877 8.391 -3.993 340 HG3 MET 59 HG1 MET 59 -4.183 7.193 -5.084 341 HE1 MET 59 HE1 MET 59 -1.140 9.120 -3.562 342 HE2 MET 59 HE2 MET 59 -1.571 7.525 -4.175 343 HE3 MET 59 HE3 MET 59 -2.572 8.296 -2.945 344 H ASN 60 HN ASN 60 -6.735 7.747 -3.362 345 HA ASN 60 HA ASN 60 -7.701 8.858 -1.633 346 HB2 ASN 60 HB2 ASN 60 -8.020 10.737 -3.668 347 HB3 ASN 60 HB1 ASN 60 -9.637 10.533 -3.002 348 HD21 ASN 60 HD21 ASN 60 -10.056 11.190 -0.907 349 HD22 ASN 60 HD22 ASN 60 -8.941 12.137 0.010 350 H SER 61 HN SER 61 -9.418 7.244 -4.077 351 HA SER 61 HA SER 61 -11.980 7.172 -2.856 352 HB2 SER 61 HB2 SER 61 -10.914 4.970 -4.607 353 HB3 SER 61 HB1 SER 61 -12.553 5.609 -4.511 354 HG SER 61 HG SER 61 -10.424 6.450 -6.012 355 H LEU 62 HN LEU 62 -9.055 5.343 -2.510 356 HA LEU 62 HA LEU 62 -10.347 3.609 -0.525 357 HB2 LEU 62 HB2 LEU 62 -7.775 3.199 -2.053 358 HB3 LEU 62 HB1 LEU 62 -8.407 2.108 -0.837 359 HG LEU 62 HG LEU 62 -9.774 2.744 -3.456 360 HD11 LEU 62 HD11 LEU 62 -9.128 0.456 -4.083 361 HD12 LEU 62 HD12 LEU 62 -8.174 0.337 -2.603 362 HD13 LEU 62 HD13 LEU 62 -7.733 1.510 -3.846 363 HD21 LEU 62 HD21 LEU 62 -11.474 2.111 -2.004 364 HD22 LEU 62 HD22 LEU 62 -10.445 0.971 -1.138 365 HD23 LEU 62 HD23 LEU 62 -11.014 0.587 -2.763 366 H ARG 63 HN ARG 63 -9.405 3.368 1.492 367 HA ARG 63 HA ARG 63 -7.348 5.368 2.145 368 HB2 ARG 63 HB2 ARG 63 -8.316 5.349 4.459 369 HB3 ARG 63 HB1 ARG 63 -9.365 6.032 3.229 370 HG2 ARG 63 HG2 ARG 63 -10.645 3.949 3.162 371 HG3 ARG 63 HG1 ARG 63 -9.589 3.263 4.401 372 HD2 ARG 63 HD2 ARG 63 -10.283 4.956 5.980 373 HD3 ARG 63 HD1 ARG 63 -11.240 5.761 4.743 374 HE ARG 63 HE ARG 63 -11.876 3.033 5.676 375 HH11 ARG 63 HH11 ARG 63 -14.554 6.063 5.306 376 HH12 ARG 63 HH12 ARG 63 -12.818 6.345 4.887 377 HH21 ARG 63 HH21 ARG 63 -14.075 2.649 6.198 378 HH22 ARG 63 HH22 ARG 63 -15.253 4.005 6.017 379 H PHE 64 HN PHE 64 -5.507 4.638 2.918 380 HA PHE 64 HA PHE 64 -5.234 1.795 3.475 381 HB2 PHE 64 HB2 PHE 64 -3.263 4.027 3.017 382 HB3 PHE 64 HB1 PHE 64 -2.751 2.466 3.649 383 HD1 PHE 64 HD1 PHE 64 -3.771 4.329 0.733 384 HD2 PHE 64 HD2 PHE 64 -3.034 0.428 2.262 385 HE1 PHE 64 HE1 PHE 64 -3.632 3.458 -1.562 386 HE2 PHE 64 HE2 PHE 64 -2.893 -0.450 -0.034 387 HZ PHE 64 HZ PHE 64 -3.192 1.069 -1.950 388 H LEU 65 HN LEU 65 -5.267 1.024 5.470 389 HA LEU 65 HA LEU 65 -4.850 2.909 7.694 390 HB2 LEU 65 HB2 LEU 65 -6.410 0.323 7.655 391 HB3 LEU 65 HB1 LEU 65 -6.208 1.368 9.049 392 HG LEU 65 HG LEU 65 -7.658 2.091 6.496 393 HD11 LEU 65 HD11 LEU 65 -9.662 2.035 7.854 394 HD12 LEU 65 HD12 LEU 65 -8.716 1.570 9.267 395 HD13 LEU 65 HD13 LEU 65 -8.852 0.469 7.896 396 HD21 LEU 65 HD21 LEU 65 -7.152 3.657 9.022 397 HD22 LEU 65 HD22 LEU 65 -8.368 4.092 7.821 398 HD23 LEU 65 HD23 LEU 65 -6.660 4.072 7.379 399 H PHE 66 HN PHE 66 -3.206 2.625 8.994 400 HA PHE 66 HA PHE 66 -1.908 -0.003 9.162 401 HB2 PHE 66 HB2 PHE 66 -0.728 1.590 7.551 402 HB3 PHE 66 HB1 PHE 66 -0.360 2.582 8.956 403 HD1 PHE 66 HD1 PHE 66 0.060 -0.847 7.591 404 HD2 PHE 66 HD2 PHE 66 1.537 2.166 10.212 405 HE1 PHE 66 HE1 PHE 66 2.074 -2.194 7.997 406 HE2 PHE 66 HE2 PHE 66 3.556 0.820 10.624 407 HZ PHE 66 HZ PHE 66 3.827 -1.363 9.515 408 H GLU 67 HN GLU 67 -2.044 -0.584 11.220 409 HA GLU 67 HA GLU 67 -1.971 -0.571 13.488 410 HB2 GLU 67 HB2 GLU 67 -0.345 1.929 13.020 411 HB3 GLU 67 HB1 GLU 67 -0.568 1.190 14.601 412 HG2 GLU 67 HG2 GLU 67 0.589 -0.274 12.249 413 HG3 GLU 67 HG1 GLU 67 1.571 0.625 13.406 414 H GLY 68 HN GLY 68 -3.972 1.177 11.867 415 HA2 GLY 68 HA2 GLY 68 -6.045 1.858 12.888 416 HA3 GLY 68 HA1 GLY 68 -5.123 2.434 14.268 417 H GLN 69 HN GLN 69 -3.174 3.500 12.104 418 HA GLN 69 HA GLN 69 -4.544 6.081 11.841 419 HB2 GLN 69 HB2 GLN 69 -1.630 5.396 11.385 420 HB3 GLN 69 HB1 GLN 69 -2.330 7.008 11.386 421 HG2 GLN 69 HG2 GLN 69 -2.917 6.732 13.753 422 HG3 GLN 69 HG1 GLN 69 -2.153 5.143 13.738 423 HE21 GLN 69 HE21 GLN 69 -1.518 7.521 15.306 424 HE22 GLN 69 HE22 GLN 69 0.139 7.880 14.973 425 H ARG 70 HN ARG 70 -4.315 7.248 9.772 426 HA ARG 70 HA ARG 70 -4.479 5.352 7.550 427 HB2 ARG 70 HB2 ARG 70 -5.458 7.333 6.296 428 HB3 ARG 70 HB1 ARG 70 -6.430 6.683 7.607 429 HG2 ARG 70 HG2 ARG 70 -5.768 8.504 9.048 430 HG3 ARG 70 HG1 ARG 70 -4.680 9.126 7.804 431 HD2 ARG 70 HD2 ARG 70 -7.674 8.857 7.526 432 HD3 ARG 70 HD1 ARG 70 -6.821 10.354 7.897 433 HE ARG 70 HE ARG 70 -5.708 10.065 5.689 434 HH11 ARG 70 HH11 ARG 70 -8.891 8.633 6.310 435 HH12 ARG 70 HH12 ARG 70 -9.306 8.542 4.550 436 HH21 ARG 70 HH21 ARG 70 -6.234 9.983 3.480 437 HH22 ARG 70 HH22 ARG 70 -7.819 9.276 2.986 438 H ILE 71 HN ILE 71 -3.080 5.334 5.924 439 HA ILE 71 HA ILE 71 -0.574 6.635 6.242 440 HB ILE 71 HB ILE 71 -1.686 5.070 3.911 441 HG12 ILE 71 HG12 ILE 71 -1.485 3.741 5.940 442 HG13 ILE 71 HG11 ILE 71 -0.236 3.266 4.800 443 HG21 ILE 71 HG21 ILE 71 0.605 4.879 3.109 444 HG22 ILE 71 HG22 ILE 71 1.170 5.894 4.435 445 HG23 ILE 71 HG23 ILE 71 0.119 6.573 3.192 446 HD11 ILE 71 HD11 ILE 71 1.352 4.725 6.057 447 HD12 ILE 71 HD12 ILE 71 0.743 3.334 6.955 448 HD13 ILE 71 HD13 ILE 71 0.089 4.942 7.271 449 H ALA 72 HN ALA 72 -0.077 8.642 5.735 450 HA ALA 72 HA ALA 72 -1.779 10.340 4.211 451 HB1 ALA 72 HB1 ALA 72 -0.003 12.018 4.514 452 HB2 ALA 72 HB2 ALA 72 1.057 10.765 5.160 453 HB3 ALA 72 HB3 ALA 72 -0.411 11.211 6.027 454 H ASP 73 HN ASP 73 -0.722 11.728 2.375 455 HA ASP 73 HA ASP 73 0.065 9.852 0.321 456 HB2 ASP 73 HB2 ASP 73 -1.159 12.441 0.388 457 HB3 ASP 73 HB1 ASP 73 0.247 12.494 -0.677 458 H ASN 74 HN ASN 74 1.553 12.223 2.331 459 HA ASN 74 HA ASN 74 4.090 12.017 0.881 460 HB2 ASN 74 HB2 ASN 74 4.828 13.825 2.451 461 HB3 ASN 74 HB1 ASN 74 3.444 14.279 1.462 462 HD21 ASN 74 HD21 ASN 74 4.606 13.700 4.639 463 HD22 ASN 74 HD22 ASN 74 3.162 14.141 5.482 464 H HIS 75 HN HIS 75 2.793 9.909 2.541 465 HA HIS 75 HA HIS 75 4.343 9.639 4.935 466 HB2 HIS 75 HB2 HIS 75 1.979 8.621 4.103 467 HB3 HIS 75 HB1 HIS 75 3.037 7.257 3.771 468 HD2 HIS 75 HD2 HIS 75 4.393 6.248 6.089 469 HE1 HIS 75 HE1 HIS 75 1.531 7.927 8.713 470 HE2 HIS 75 HE2 HIS 75 3.565 6.428 8.539 471 H THR 76 HN THR 76 6.111 8.390 5.304 472 HA THR 76 HA THR 76 7.377 7.164 2.940 473 HB THR 76 HB THR 76 9.186 7.705 5.150 474 HG1 THR 76 HG1 THR 76 7.673 9.464 5.463 475 HG21 THR 76 HG21 THR 76 9.789 7.226 2.772 476 HG22 THR 76 HG22 THR 76 10.530 8.690 3.414 477 HG23 THR 76 HG23 THR 76 9.137 8.806 2.338 478 HA PRO 77 HA PRO 77 7.041 3.306 5.145 479 HB2 PRO 77 HB2 PRO 77 9.399 2.349 3.685 480 HB3 PRO 77 HB1 PRO 77 7.725 1.791 3.597 481 HG2 PRO 77 HG2 PRO 77 8.875 3.136 1.576 482 HG3 PRO 77 HG1 PRO 77 7.150 3.291 1.961 483 HD2 PRO 77 HD2 PRO 77 9.398 5.152 2.608 484 HD3 PRO 77 HD1 PRO 77 7.745 5.518 2.071 485 H LYS 78 HN LYS 78 9.689 5.378 5.390 486 HA LYS 78 HA LYS 78 11.226 3.638 7.137 487 HB2 LYS 78 HB2 LYS 78 12.316 5.176 5.479 488 HB3 LYS 78 HB1 LYS 78 11.740 6.531 6.434 489 HG2 LYS 78 HG2 LYS 78 13.909 6.290 7.167 490 HG3 LYS 78 HG1 LYS 78 12.999 5.393 8.383 491 HD2 LYS 78 HD2 LYS 78 14.887 4.065 7.801 492 HD3 LYS 78 HD1 LYS 78 13.476 3.309 7.056 493 HE2 LYS 78 HE2 LYS 78 14.097 3.962 4.922 494 HE3 LYS 78 HE1 LYS 78 15.101 5.286 5.509 495 HZ1 LYS 78 HZ1 LYS 78 16.355 3.354 4.624 496 HZ2 LYS 78 HZ2 LYS 78 15.766 2.420 5.904 497 HZ3 LYS 78 HZ3 LYS 78 16.756 3.754 6.216 498 H GLU 79 HN GLU 79 8.694 5.882 7.385 499 HA GLU 79 HA GLU 79 9.330 6.503 10.180 500 HB2 GLU 79 HB2 GLU 79 7.778 8.278 10.066 501 HB3 GLU 79 HB1 GLU 79 8.638 8.326 8.535 502 HG2 GLU 79 HG2 GLU 79 6.725 7.021 7.551 503 HG3 GLU 79 HG1 GLU 79 5.862 7.310 9.061 504 H LEU 80 HN LEU 80 7.474 6.436 11.718 505 HA LEU 80 HA LEU 80 5.806 5.393 12.833 506 HB2 LEU 80 HB2 LEU 80 4.783 5.531 10.325 507 HB3 LEU 80 HB1 LEU 80 4.819 3.794 10.553 508 HG LEU 80 HG LEU 80 3.477 5.676 12.493 509 HD11 LEU 80 HD11 LEU 80 1.362 4.965 11.420 510 HD12 LEU 80 HD12 LEU 80 2.303 4.184 10.149 511 HD13 LEU 80 HD13 LEU 80 2.386 5.933 10.358 512 HD21 LEU 80 HD21 LEU 80 3.230 2.699 12.054 513 HD22 LEU 80 HD22 LEU 80 2.346 3.649 13.247 514 HD23 LEU 80 HD23 LEU 80 4.095 3.475 13.377 515 H GLY 81 HN GLY 81 6.752 3.014 10.340 516 HA2 GLY 81 HA2 GLY 81 8.508 1.424 11.458 517 HA3 GLY 81 HA1 GLY 81 7.129 1.049 12.480 518 H MET 82 HN MET 82 8.218 1.074 9.107 519 HA MET 82 HA MET 82 6.288 -1.082 8.560 520 HB2 MET 82 HB2 MET 82 7.476 1.051 6.805 521 HB3 MET 82 HB1 MET 82 6.834 -0.430 6.105 522 HG2 MET 82 HG2 MET 82 4.661 0.038 7.123 523 HG3 MET 82 HG1 MET 82 5.306 1.528 7.808 524 HE1 MET 82 HE1 MET 82 2.719 0.995 5.825 525 HE2 MET 82 HE2 MET 82 2.783 2.453 4.833 526 HE3 MET 82 HE3 MET 82 3.033 2.561 6.576 527 H GLU 83 HN GLU 83 7.120 -3.043 8.354 528 HA GLU 83 HA GLU 83 9.912 -3.288 7.445 529 HB2 GLU 83 HB2 GLU 83 8.974 -3.838 9.992 530 HB3 GLU 83 HB1 GLU 83 9.018 -5.415 9.218 531 HG2 GLU 83 HG2 GLU 83 11.344 -5.171 8.726 532 HG3 GLU 83 HG1 GLU 83 11.332 -3.505 9.309 533 H GLU 84 HN GLU 84 10.203 -5.898 7.234 534 HA GLU 84 HA GLU 84 8.731 -6.586 4.909 535 HB2 GLU 84 HB2 GLU 84 11.083 -7.274 5.340 536 HB3 GLU 84 HB1 GLU 84 10.516 -8.318 6.635 537 HG2 GLU 84 HG2 GLU 84 10.711 -9.826 4.946 538 HG3 GLU 84 HG1 GLU 84 9.030 -9.340 4.738 539 H GLU 85 HN GLU 85 7.040 -7.926 4.642 540 HA GLU 85 HA GLU 85 5.237 -9.214 5.069 541 HB2 GLU 85 HB2 GLU 85 6.892 -10.098 7.431 542 HB3 GLU 85 HB1 GLU 85 5.329 -10.793 7.032 543 HG2 GLU 85 HG2 GLU 85 7.832 -10.869 5.368 544 HG3 GLU 85 HG1 GLU 85 7.045 -12.219 6.184 545 H ASP 86 HN ASP 86 5.559 -6.461 6.261 546 HA ASP 86 HA ASP 86 4.055 -6.505 8.699 547 HB2 ASP 86 HB2 ASP 86 5.510 -4.557 7.263 548 HB3 ASP 86 HB1 ASP 86 3.851 -3.967 7.346 549 H VAL 87 HN VAL 87 1.887 -5.648 8.953 550 HA VAL 87 HA VAL 87 0.226 -6.381 6.644 551 HB VAL 87 HB VAL 87 -0.517 -6.306 9.568 552 HG11 VAL 87 HG11 VAL 87 -2.565 -7.473 8.829 553 HG12 VAL 87 HG12 VAL 87 -2.076 -7.217 7.155 554 HG13 VAL 87 HG13 VAL 87 -2.443 -5.835 8.188 555 HG21 VAL 87 HG21 VAL 87 -0.017 -8.647 7.734 556 HG22 VAL 87 HG22 VAL 87 -0.557 -8.743 9.410 557 HG23 VAL 87 HG23 VAL 87 1.046 -8.107 9.033 558 H ILE 88 HN ILE 88 -0.916 -4.922 5.629 559 HA ILE 88 HA ILE 88 -1.746 -2.486 7.046 560 HB ILE 88 HB ILE 88 0.177 -1.901 5.634 561 HG12 ILE 88 HG12 ILE 88 -2.353 -0.837 4.366 562 HG13 ILE 88 HG11 ILE 88 -1.776 -0.334 5.954 563 HG21 ILE 88 HG21 ILE 88 0.082 -2.079 3.207 564 HG22 ILE 88 HG22 ILE 88 -1.476 -2.898 3.322 565 HG23 ILE 88 HG23 ILE 88 -0.025 -3.667 3.968 566 HD11 ILE 88 HD11 ILE 88 0.297 0.471 4.922 567 HD12 ILE 88 HD12 ILE 88 -1.134 1.272 4.275 568 HD13 ILE 88 HD13 ILE 88 -0.330 0.014 3.337 569 H GLU 89 HN GLU 89 -3.796 -1.717 6.474 570 HA GLU 89 HA GLU 89 -5.351 -3.579 4.798 571 HB2 GLU 89 HB2 GLU 89 -6.230 -1.880 7.138 572 HB3 GLU 89 HB1 GLU 89 -7.317 -2.834 6.138 573 HG2 GLU 89 HG2 GLU 89 -6.189 -4.873 6.819 574 HG3 GLU 89 HG1 GLU 89 -5.050 -3.932 7.784 575 H VAL 90 HN VAL 90 -7.108 -2.693 3.562 576 HA VAL 90 HA VAL 90 -7.030 0.179 3.065 577 HB VAL 90 HB VAL 90 -5.449 -0.707 1.438 578 HG11 VAL 90 HG11 VAL 90 -7.697 -2.480 0.496 579 HG12 VAL 90 HG12 VAL 90 -6.237 -3.007 1.334 580 HG13 VAL 90 HG13 VAL 90 -6.125 -2.308 -0.283 581 HG21 VAL 90 HG21 VAL 90 -8.074 0.054 0.168 582 HG22 VAL 90 HG22 VAL 90 -6.500 0.102 -0.627 583 HG23 VAL 90 HG23 VAL 90 -6.830 1.162 0.745 584 H TYR 91 HN TYR 91 -9.019 0.992 2.802 585 HA TYR 91 HA TYR 91 -11.181 -0.783 1.909 586 HB2 TYR 91 HB2 TYR 91 -11.284 0.980 4.367 587 HB3 TYR 91 HB1 TYR 91 -12.663 0.126 3.678 588 HD1 TYR 91 HD1 TYR 91 -12.543 -2.418 3.552 589 HD2 TYR 91 HD2 TYR 91 -9.861 -0.094 5.896 590 HE1 TYR 91 HE1 TYR 91 -11.958 -4.418 4.856 591 HE2 TYR 91 HE2 TYR 91 -9.272 -2.088 7.207 592 HH TYR 91 HH TYR 91 -9.519 -4.275 7.445 593 H GLN 92 HN GLN 92 -13.234 0.581 1.528 594 HA GLN 92 HA GLN 92 -12.433 2.802 -0.164 595 HB2 GLN 92 HB2 GLN 92 -14.056 1.028 -0.912 596 HB3 GLN 92 HB1 GLN 92 -15.198 1.654 0.267 597 HG2 GLN 92 HG2 GLN 92 -14.712 3.918 -1.010 598 HG3 GLN 92 HG1 GLN 92 -14.308 2.803 -2.314 599 HE21 GLN 92 HE21 GLN 92 -16.823 4.084 -0.311 600 HE22 GLN 92 HE22 GLN 92 -18.152 3.387 -1.181 601 H GLU 93 HN GLU 93 -12.968 4.917 0.141 602 HA GLU 93 HA GLU 93 -13.635 5.755 2.797 603 HB2 GLU 93 HB2 GLU 93 -13.289 7.289 0.214 604 HB3 GLU 93 HB1 GLU 93 -13.608 8.056 1.763 605 HG2 GLU 93 HG2 GLU 93 -11.286 6.202 1.483 606 HG3 GLU 93 HG1 GLU 93 -11.173 7.852 0.872 607 H GLN 94 HN GLN 94 -15.391 7.453 3.119 608 HA GLN 94 HA GLN 94 -17.899 6.293 2.590 609 HB2 GLN 94 HB2 GLN 94 -17.328 7.747 4.539 610 HB3 GLN 94 HB1 GLN 94 -17.334 9.130 3.456 611 HG2 GLN 94 HG2 GLN 94 -19.735 8.392 2.890 612 HG3 GLN 94 HG1 GLN 94 -19.624 7.442 4.371 613 HE21 GLN 94 HE21 GLN 94 -19.427 8.508 6.352 614 HE22 GLN 94 HE22 GLN 94 -19.824 10.182 6.525 615 H THR 95 HN THR 95 -16.142 8.908 1.026 616 HA THR 95 HA THR 95 -18.340 9.742 -0.604 617 HB THR 95 HB THR 95 -16.485 10.942 -1.891 618 HG1 THR 95 HG1 THR 95 -14.480 10.543 -1.321 619 HG21 THR 95 HG21 THR 95 -16.871 11.390 1.069 620 HG22 THR 95 HG22 THR 95 -17.779 12.127 -0.249 621 HG23 THR 95 HG23 THR 95 -16.083 12.542 -0.007 622 H GLY 96 HN GLY 96 -15.811 7.372 -0.860 623 HA2 GLY 96 HA2 GLY 96 -15.654 5.597 -2.356 624 HA3 GLY 96 HA1 GLY 96 -17.010 6.276 -3.251 625 H GLY 97 HN GLY 97 -14.761 8.640 -2.656 626 HA2 GLY 97 HA2 GLY 97 -12.659 8.364 -4.349 627 HA3 GLY 97 HA1 GLY 97 -13.993 8.781 -5.417 628 H1 ASN 357 HT1 ASN 357 -5.039 -20.053 -2.863 629 H2 ASN 357 HT2 ASN 357 -5.469 -19.274 -1.425 630 H3 ASN 357 HT3 ASN 357 -4.421 -20.600 -1.383 631 HA ASN 357 HA ASN 357 -3.212 -18.554 -1.087 632 HB2 ASN 357 HB2 ASN 357 -1.567 -18.841 -2.909 633 HB3 ASN 357 HB1 ASN 357 -2.052 -20.383 -2.216 634 HD21 ASN 357 HD21 ASN 357 -1.039 -19.378 -4.928 635 HD22 ASN 357 HD22 ASN 357 -2.099 -20.146 -6.058 636 H ASN 358 HN ASN 358 -2.939 -16.455 -1.563 637 HA ASN 358 HA ASN 358 -3.984 -15.356 -4.039 638 HB2 ASN 358 HB2 ASN 358 -5.198 -13.554 -2.658 639 HB3 ASN 358 HB1 ASN 358 -5.968 -15.124 -2.824 640 HD21 ASN 358 HD21 ASN 358 -7.191 -14.886 -0.987 641 HD22 ASN 358 HD22 ASN 358 -6.508 -14.947 0.602 642 H ARG 359 HN ARG 359 -1.384 -15.601 -3.385 643 HA ARG 359 HA ARG 359 -0.516 -13.000 -2.356 644 HB2 ARG 359 HB2 ARG 359 1.025 -15.520 -2.989 645 HB3 ARG 359 HB1 ARG 359 1.772 -14.024 -2.448 646 HG2 ARG 359 HG2 ARG 359 0.577 -14.153 -0.351 647 HG3 ARG 359 HG1 ARG 359 -0.256 -15.612 -0.896 648 HD2 ARG 359 HD2 ARG 359 1.971 -16.711 -1.123 649 HD3 ARG 359 HD1 ARG 359 2.702 -15.275 -0.406 650 HE ARG 359 HE ARG 359 0.834 -15.967 1.421 651 HH11 ARG 359 HH11 ARG 359 3.365 -17.760 -0.252 652 HH12 ARG 359 HH12 ARG 359 3.633 -18.897 1.122 653 HH21 ARG 359 HH21 ARG 359 1.156 -17.381 3.196 654 HH22 ARG 359 HH22 ARG 359 2.390 -18.692 3.052 655 H ASP 360 HN ASP 360 -0.118 -11.418 -3.762 656 HA ASP 360 HA ASP 360 0.885 -12.163 -6.420 657 HB2 ASP 360 HB2 ASP 360 -1.630 -11.421 -6.200 658 HB3 ASP 360 HB1 ASP 360 -0.929 -9.807 -6.139 659 HA PRO 361 HA PRO 361 3.950 -9.219 -4.888 660 HB2 PRO 361 HB2 PRO 361 5.527 -10.226 -7.137 661 HB3 PRO 361 HB1 PRO 361 5.879 -10.293 -5.407 662 HG2 PRO 361 HG2 PRO 361 5.258 -12.495 -6.814 663 HG3 PRO 361 HG1 PRO 361 4.799 -12.293 -5.112 664 HD2 PRO 361 HD2 PRO 361 3.124 -11.955 -7.567 665 HD3 PRO 361 HD1 PRO 361 2.712 -12.709 -6.010 666 H ILE 362 HN ILE 362 3.345 -7.207 -5.455 667 HA ILE 362 HA ILE 362 3.093 -6.504 -8.280 668 HB ILE 362 HB ILE 362 2.572 -4.716 -5.911 669 HG12 ILE 362 HG12 ILE 362 0.586 -6.434 -7.415 670 HG13 ILE 362 HG11 ILE 362 1.184 -6.767 -5.792 671 HG21 ILE 362 HG21 ILE 362 1.167 -3.482 -7.514 672 HG22 ILE 362 HG22 ILE 362 1.670 -4.593 -8.786 673 HG23 ILE 362 HG23 ILE 362 2.857 -3.544 -8.015 674 HD11 ILE 362 HD11 ILE 362 -0.357 -4.311 -6.592 675 HD12 ILE 362 HD12 ILE 362 0.162 -4.749 -4.963 676 HD13 ILE 362 HD13 ILE 362 -1.038 -5.734 -5.803 677 H VAL 363 HN VAL 363 4.627 -5.476 -9.362 678 HA VAL 363 HA VAL 363 6.699 -4.019 -7.857 679 HB VAL 363 HB VAL 363 7.230 -5.472 -10.449 680 HG11 VAL 363 HG11 VAL 363 8.745 -3.637 -9.870 681 HG12 VAL 363 HG12 VAL 363 9.567 -5.195 -9.823 682 HG13 VAL 363 HG13 VAL 363 9.082 -4.408 -8.322 683 HG21 VAL 363 HG21 VAL 363 8.421 -7.165 -9.016 684 HG22 VAL 363 HG22 VAL 363 6.660 -7.215 -8.940 685 HG23 VAL 363 HG23 VAL 363 7.580 -6.472 -7.630 686 H ILE 364 HN ILE 364 6.957 -1.957 -8.471 687 HA ILE 364 HA ILE 364 5.967 -1.132 -11.119 688 HB ILE 364 HB ILE 364 5.201 0.982 -10.179 689 HG12 ILE 364 HG12 ILE 364 5.165 0.318 -7.380 690 HG13 ILE 364 HG11 ILE 364 6.818 0.248 -7.980 691 HG21 ILE 364 HG21 ILE 364 3.315 0.111 -8.775 692 HG22 ILE 364 HG22 ILE 364 4.087 -1.472 -8.840 693 HG23 ILE 364 HG23 ILE 364 3.529 -0.699 -10.324 694 HD11 ILE 364 HD11 ILE 364 6.590 2.521 -8.846 695 HD12 ILE 364 HD12 ILE 364 6.305 2.446 -7.108 696 HD13 ILE 364 HD13 ILE 364 4.943 2.587 -8.220 697 H SER 365 HN SER 365 6.871 1.170 -11.626 698 HA SER 365 HA SER 365 9.514 1.628 -10.512 699 HB2 SER 365 HB2 SER 365 10.334 1.776 -13.014 700 HB3 SER 365 HB1 SER 365 10.312 0.227 -12.173 701 HG SER 365 HG SER 365 9.012 -0.432 -13.673 702 H ASP 366 HN ASP 366 9.566 3.721 -10.084 703 HA ASP 366 HA ASP 366 7.821 5.577 -11.443 704 HB2 ASP 366 HB2 ASP 366 8.424 5.624 -8.946 705 HB3 ASP 366 HB1 ASP 366 9.972 6.294 -9.450 706 H SER 367 HN SER 367 8.768 7.711 -12.192 707 HA SER 367 HA SER 367 11.410 7.416 -13.416 708 HB2 SER 367 HB2 SER 367 9.017 8.322 -15.029 709 HB3 SER 367 HB1 SER 367 10.647 7.986 -15.617 710 HG SER 367 HG SER 367 9.609 5.858 -14.304 711 HA PRO 368 HA PRO 368 11.142 11.556 -11.565 712 HB2 PRO 368 HB2 PRO 368 14.060 11.466 -11.734 713 HB3 PRO 368 HB1 PRO 368 13.030 11.594 -10.304 714 HG2 PRO 368 HG2 PRO 368 14.453 9.375 -10.842 715 HG3 PRO 368 HG1 PRO 368 12.882 9.329 -10.016 716 HD2 PRO 368 HD2 PRO 368 13.525 8.738 -12.879 717 HD3 PRO 368 HD1 PRO 368 12.418 7.897 -11.771 Start of MODEL 15 1 H TYR 21 HT1 TYR 21 14.673 -5.183 -0.717 2 HA TYR 21 HA TYR 21 13.244 -3.268 -1.253 3 HB2 TYR 21 HB2 TYR 21 12.039 -5.300 -3.143 4 HB3 TYR 21 HB1 TYR 21 11.246 -3.797 -2.679 5 HD1 TYR 21 HD1 TYR 21 13.255 -1.775 -2.852 6 HD2 TYR 21 HD2 TYR 21 12.721 -5.185 -5.346 7 HE1 TYR 21 HE1 TYR 21 14.391 -0.607 -4.693 8 HE2 TYR 21 HE2 TYR 21 13.856 -4.017 -7.187 9 HH TYR 21 HH TYR 21 14.201 -1.448 -7.806 10 H ILE 22 HN ILE 22 11.150 -3.117 -0.191 11 HA ILE 22 HA ILE 22 10.789 -5.330 1.698 12 HB ILE 22 HB ILE 22 9.801 -2.473 1.846 13 HG12 ILE 22 HG12 ILE 22 12.239 -2.635 2.082 14 HG13 ILE 22 HG11 ILE 22 11.489 -2.190 3.611 15 HG21 ILE 22 HG21 ILE 22 8.323 -4.032 3.016 16 HG22 ILE 22 HG22 ILE 22 9.170 -2.964 4.136 17 HG23 ILE 22 HG23 ILE 22 9.699 -4.635 3.940 18 HD11 ILE 22 HD11 ILE 22 13.221 -3.777 4.032 19 HD12 ILE 22 HD12 ILE 22 12.563 -4.887 2.829 20 HD13 ILE 22 HD13 ILE 22 11.668 -4.566 4.315 21 H LYS 23 HN LYS 23 8.902 -6.446 1.871 22 HA LYS 23 HA LYS 23 6.843 -5.829 -0.142 23 HB2 LYS 23 HB2 LYS 23 7.698 -8.381 1.195 24 HB3 LYS 23 HB1 LYS 23 6.143 -8.248 0.386 25 HG2 LYS 23 HG2 LYS 23 7.060 -8.296 -1.671 26 HG3 LYS 23 HG1 LYS 23 8.477 -7.368 -1.179 27 HD2 LYS 23 HD2 LYS 23 8.843 -9.806 -1.855 28 HD3 LYS 23 HD1 LYS 23 9.568 -9.266 -0.340 29 HE2 LYS 23 HE2 LYS 23 6.847 -10.334 -0.083 30 HE3 LYS 23 HE1 LYS 23 8.043 -11.506 -0.633 31 HZ1 LYS 23 HZ1 LYS 23 8.796 -9.837 1.640 32 HZ2 LYS 23 HZ2 LYS 23 9.108 -11.471 1.342 33 HZ3 LYS 23 HZ3 LYS 23 7.588 -10.997 1.922 34 H LEU 24 HN LEU 24 5.077 -4.907 0.582 35 HA LEU 24 HA LEU 24 4.310 -5.268 3.391 36 HB2 LEU 24 HB2 LEU 24 3.413 -3.251 1.325 37 HB3 LEU 24 HB1 LEU 24 2.775 -3.346 2.957 38 HG LEU 24 HG LEU 24 5.679 -2.814 2.318 39 HD11 LEU 24 HD11 LEU 24 4.314 -0.991 1.476 40 HD12 LEU 24 HD12 LEU 24 5.199 -0.490 2.917 41 HD13 LEU 24 HD13 LEU 24 3.483 -0.876 3.027 42 HD21 LEU 24 HD21 LEU 24 5.343 -3.770 4.514 43 HD22 LEU 24 HD22 LEU 24 4.075 -2.593 4.861 44 HD23 LEU 24 HD23 LEU 24 5.743 -2.058 4.660 45 H LYS 25 HN LYS 25 2.640 -6.541 3.898 46 HA LYS 25 HA LYS 25 1.132 -7.763 1.735 47 HB2 LYS 25 HB2 LYS 25 1.042 -8.350 4.700 48 HB3 LYS 25 HB1 LYS 25 0.341 -9.332 3.419 49 HG2 LYS 25 HG2 LYS 25 2.482 -9.937 2.594 50 HG3 LYS 25 HG1 LYS 25 3.285 -8.748 3.619 51 HD2 LYS 25 HD2 LYS 25 3.625 -10.484 5.000 52 HD3 LYS 25 HD1 LYS 25 1.941 -10.237 5.459 53 HE2 LYS 25 HE2 LYS 25 1.200 -12.031 4.228 54 HE3 LYS 25 HE1 LYS 25 2.558 -11.959 3.105 55 HZ1 LYS 25 HZ1 LYS 25 2.632 -13.873 4.647 56 HZ2 LYS 25 HZ2 LYS 25 2.798 -12.798 5.938 57 HZ3 LYS 25 HZ3 LYS 25 4.002 -12.877 4.749 58 H VAL 26 HN VAL 26 -0.517 -6.649 1.017 59 HA VAL 26 HA VAL 26 -2.110 -4.985 2.794 60 HB VAL 26 HB VAL 26 -2.756 -5.423 -0.105 61 HG11 VAL 26 HG11 VAL 26 -3.557 -3.140 0.021 62 HG12 VAL 26 HG12 VAL 26 -2.959 -2.999 1.676 63 HG13 VAL 26 HG13 VAL 26 -4.279 -4.109 1.307 64 HG21 VAL 26 HG21 VAL 26 -0.615 -3.556 0.923 65 HG22 VAL 26 HG22 VAL 26 -1.213 -3.633 -0.734 66 HG23 VAL 26 HG23 VAL 26 -0.342 -5.006 -0.047 67 H ILE 27 HN ILE 27 -3.862 -5.721 3.777 68 HA ILE 27 HA ILE 27 -4.990 -8.287 2.936 69 HB ILE 27 HB ILE 27 -5.586 -6.650 5.406 70 HG12 ILE 27 HG12 ILE 27 -3.247 -7.456 5.325 71 HG13 ILE 27 HG11 ILE 27 -4.173 -8.215 6.615 72 HG21 ILE 27 HG21 ILE 27 -6.631 -8.688 6.262 73 HG22 ILE 27 HG22 ILE 27 -6.307 -9.499 4.732 74 HG23 ILE 27 HG23 ILE 27 -7.420 -8.135 4.785 75 HD11 ILE 27 HD11 ILE 27 -4.430 -10.219 5.261 76 HD12 ILE 27 HD12 ILE 27 -2.730 -9.811 5.488 77 HD13 ILE 27 HD13 ILE 27 -3.524 -9.459 3.952 78 H GLY 28 HN GLY 28 -6.538 -8.148 1.439 79 HA2 GLY 28 HA2 GLY 28 -8.276 -5.833 1.275 80 HA3 GLY 28 HA1 GLY 28 -8.281 -7.225 0.199 81 H GLN 29 HN GLN 29 -10.644 -6.101 1.152 82 HA GLN 29 HA GLN 29 -11.594 -7.454 3.469 83 HB2 GLN 29 HB2 GLN 29 -12.515 -5.297 2.544 84 HB3 GLN 29 HB1 GLN 29 -13.265 -6.241 1.268 85 HG2 GLN 29 HG2 GLN 29 -14.779 -5.639 3.152 86 HG3 GLN 29 HG1 GLN 29 -14.679 -7.362 2.802 87 HE21 GLN 29 HE21 GLN 29 -13.686 -8.735 4.280 88 HE22 GLN 29 HE22 GLN 29 -13.341 -8.245 5.904 89 H ASP 30 HN ASP 30 -10.959 -8.518 0.370 90 HA ASP 30 HA ASP 30 -13.018 -10.588 0.354 91 HB2 ASP 30 HB2 ASP 30 -12.247 -11.122 -1.860 92 HB3 ASP 30 HB1 ASP 30 -12.364 -9.369 -1.754 93 H SER 31 HN SER 31 -10.373 -10.194 2.035 94 HA SER 31 HA SER 31 -8.984 -11.549 3.199 95 HB2 SER 31 HB2 SER 31 -10.433 -13.862 1.885 96 HB3 SER 31 HB1 SER 31 -9.421 -13.936 3.328 97 HG SER 31 HG SER 31 -11.715 -13.836 3.749 98 H SER 32 HN SER 32 -7.696 -10.432 1.379 99 HA SER 32 HA SER 32 -6.251 -12.491 -0.143 100 HB2 SER 32 HB2 SER 32 -5.583 -10.329 -1.516 101 HB3 SER 32 HB1 SER 32 -7.119 -11.144 -1.817 102 HG SER 32 HG SER 32 -8.118 -9.412 -1.177 103 H GLU 33 HN GLU 33 -3.938 -11.919 -0.549 104 HA GLU 33 HA GLU 33 -2.742 -10.326 1.612 105 HB2 GLU 33 HB2 GLU 33 -2.204 -13.191 0.905 106 HB3 GLU 33 HB1 GLU 33 -0.880 -12.196 1.497 107 HG2 GLU 33 HG2 GLU 33 -2.009 -11.794 3.559 108 HG3 GLU 33 HG1 GLU 33 -3.482 -12.554 2.961 109 H ILE 34 HN ILE 34 -2.675 -8.790 -0.178 110 HA ILE 34 HA ILE 34 -1.175 -9.303 -2.535 111 HB ILE 34 HB ILE 34 -1.708 -6.607 -1.290 112 HG12 ILE 34 HG12 ILE 34 -3.802 -7.916 -1.526 113 HG13 ILE 34 HG11 ILE 34 -3.763 -6.522 -2.597 114 HG21 ILE 34 HG21 ILE 34 -1.604 -5.826 -3.634 115 HG22 ILE 34 HG22 ILE 34 -1.135 -7.454 -4.122 116 HG23 ILE 34 HG23 ILE 34 -0.085 -6.514 -3.063 117 HD11 ILE 34 HD11 ILE 34 -4.689 -8.456 -3.718 118 HD12 ILE 34 HD12 ILE 34 -3.224 -9.377 -3.383 119 HD13 ILE 34 HD13 ILE 34 -3.160 -7.982 -4.462 120 H HIS 35 HN HIS 35 0.945 -9.096 -2.966 121 HA HIS 35 HA HIS 35 2.702 -8.363 -0.725 122 HB2 HIS 35 HB2 HIS 35 2.781 -10.482 -2.736 123 HB3 HIS 35 HB1 HIS 35 4.290 -9.584 -2.643 124 HD2 HIS 35 HD2 HIS 35 4.142 -9.207 0.693 125 HE1 HIS 35 HE1 HIS 35 4.493 -13.416 0.517 126 HE2 HIS 35 HE2 HIS 35 5.012 -11.346 1.884 127 H PHE 36 HN PHE 36 2.463 -6.094 -1.241 128 HA PHE 36 HA PHE 36 3.343 -5.172 -3.828 129 HB2 PHE 36 HB2 PHE 36 1.678 -4.076 -2.019 130 HB3 PHE 36 HB1 PHE 36 3.167 -3.254 -1.566 131 HD1 PHE 36 HD1 PHE 36 4.542 -2.444 -3.783 132 HD2 PHE 36 HD2 PHE 36 0.332 -2.934 -3.446 133 HE1 PHE 36 HE1 PHE 36 4.213 -0.863 -5.637 134 HE2 PHE 36 HE2 PHE 36 -0.004 -1.354 -5.301 135 HZ PHE 36 HZ PHE 36 1.937 -0.318 -6.398 136 H LYS 37 HN LYS 37 5.380 -4.935 -4.420 137 HA LYS 37 HA LYS 37 7.465 -4.925 -2.368 138 HB2 LYS 37 HB2 LYS 37 7.375 -6.372 -4.578 139 HB3 LYS 37 HB1 LYS 37 8.044 -4.919 -5.305 140 HG2 LYS 37 HG2 LYS 37 9.960 -5.006 -3.890 141 HG3 LYS 37 HG1 LYS 37 9.265 -6.316 -2.938 142 HD2 LYS 37 HD2 LYS 37 9.903 -6.530 -5.875 143 HD3 LYS 37 HD1 LYS 37 11.005 -7.024 -4.593 144 HE2 LYS 37 HE2 LYS 37 9.115 -8.511 -3.759 145 HE3 LYS 37 HE1 LYS 37 8.323 -8.182 -5.297 146 HZ1 LYS 37 HZ1 LYS 37 10.188 -9.137 -6.454 147 HZ2 LYS 37 HZ2 LYS 37 9.612 -10.248 -5.318 148 HZ3 LYS 37 HZ3 LYS 37 11.026 -9.378 -5.005 149 H VAL 38 HN VAL 38 7.836 -2.949 -1.573 150 HA VAL 38 HA VAL 38 7.741 -0.654 -3.398 151 HB VAL 38 HB VAL 38 7.546 0.755 -1.447 152 HG11 VAL 38 HG11 VAL 38 5.708 -1.625 -1.221 153 HG12 VAL 38 HG12 VAL 38 5.507 -0.268 -2.329 154 HG13 VAL 38 HG13 VAL 38 5.402 -0.007 -0.589 155 HG21 VAL 38 HG21 VAL 38 8.999 -0.432 0.084 156 HG22 VAL 38 HG22 VAL 38 7.860 -1.777 0.162 157 HG23 VAL 38 HG23 VAL 38 7.412 -0.203 0.819 158 H LYS 39 HN LYS 39 9.306 1.046 -3.156 159 HA LYS 39 HA LYS 39 12.004 0.003 -2.741 160 HB2 LYS 39 HB2 LYS 39 11.428 1.133 -4.895 161 HB3 LYS 39 HB1 LYS 39 11.118 2.611 -3.997 162 HG2 LYS 39 HG2 LYS 39 13.439 2.708 -3.302 163 HG3 LYS 39 HG1 LYS 39 13.766 1.183 -4.123 164 HD2 LYS 39 HD2 LYS 39 13.298 2.171 -6.263 165 HD3 LYS 39 HD1 LYS 39 12.759 3.668 -5.502 166 HE2 LYS 39 HE2 LYS 39 15.038 3.982 -4.596 167 HE3 LYS 39 HE1 LYS 39 15.556 2.542 -5.467 168 HZ1 LYS 39 HZ1 LYS 39 15.943 4.816 -6.531 169 HZ2 LYS 39 HZ2 LYS 39 14.292 4.801 -6.894 170 HZ3 LYS 39 HZ3 LYS 39 15.308 3.590 -7.503 171 H MET 40 HN MET 40 13.219 0.632 -1.047 172 HA MET 40 HA MET 40 11.982 2.238 0.983 173 HB2 MET 40 HB2 MET 40 13.311 0.210 1.502 174 HB3 MET 40 HB1 MET 40 14.755 1.051 0.960 175 HG2 MET 40 HG2 MET 40 14.494 1.021 3.411 176 HG3 MET 40 HG1 MET 40 14.572 2.644 2.733 177 HE1 MET 40 HE1 MET 40 12.606 0.068 4.735 178 HE2 MET 40 HE2 MET 40 11.661 -0.060 3.252 179 HE3 MET 40 HE3 MET 40 10.939 0.642 4.699 180 H THR 41 HN THR 41 11.868 4.166 -0.372 181 HA THR 41 HA THR 41 13.449 6.205 0.523 182 HB THR 41 HB THR 41 15.284 5.061 -0.847 183 HG1 THR 41 HG1 THR 41 14.708 7.746 -1.612 184 HG21 THR 41 HG21 THR 41 13.736 6.261 -3.145 185 HG22 THR 41 HG22 THR 41 13.952 4.539 -2.842 186 HG23 THR 41 HG23 THR 41 15.345 5.546 -3.239 187 H THR 42 HN THR 42 11.552 4.880 -2.088 188 HA THR 42 HA THR 42 10.692 7.417 -3.104 189 HB THR 42 HB THR 42 9.327 4.748 -3.498 190 HG1 THR 42 HG1 THR 42 11.068 5.535 -5.477 191 HG21 THR 42 HG21 THR 42 8.074 6.660 -4.331 192 HG22 THR 42 HG22 THR 42 8.715 5.728 -5.685 193 HG23 THR 42 HG23 THR 42 9.491 7.238 -5.205 194 H HIS 43 HN HIS 43 8.847 8.537 -2.611 195 HA HIS 43 HA HIS 43 7.623 8.094 -0.101 196 HB2 HIS 43 HB2 HIS 43 7.345 10.032 -2.306 197 HB3 HIS 43 HB1 HIS 43 5.882 9.775 -1.359 198 HD2 HIS 43 HD2 HIS 43 6.250 10.269 1.468 199 HE1 HIS 43 HE1 HIS 43 9.542 12.831 0.751 200 HE2 HIS 43 HE2 HIS 43 7.749 12.161 2.416 201 H LEU 44 HN LEU 44 5.574 7.349 0.417 202 HA LEU 44 HA LEU 44 4.661 5.170 -1.106 203 HB2 LEU 44 HB2 LEU 44 3.506 6.625 1.248 204 HB3 LEU 44 HB1 LEU 44 2.683 5.266 0.507 205 HG LEU 44 HG LEU 44 5.479 5.134 1.632 206 HD11 LEU 44 HD11 LEU 44 2.936 4.093 2.856 207 HD12 LEU 44 HD12 LEU 44 3.753 5.574 3.358 208 HD13 LEU 44 HD13 LEU 44 4.565 4.019 3.537 209 HD21 LEU 44 HD21 LEU 44 4.985 2.664 1.538 210 HD22 LEU 44 HD22 LEU 44 5.215 3.463 -0.017 211 HD23 LEU 44 HD23 LEU 44 3.587 3.068 0.535 212 H LYS 45 HN LYS 45 4.140 8.421 -1.618 213 HA LYS 45 HA LYS 45 1.483 8.558 -2.462 214 HB2 LYS 45 HB2 LYS 45 2.713 10.584 -2.235 215 HB3 LYS 45 HB1 LYS 45 3.969 10.031 -3.330 216 HG2 LYS 45 HG2 LYS 45 2.596 11.712 -4.400 217 HG3 LYS 45 HG1 LYS 45 2.386 10.155 -5.201 218 HD2 LYS 45 HD2 LYS 45 0.275 9.811 -4.163 219 HD3 LYS 45 HD1 LYS 45 0.514 11.184 -3.082 220 HE2 LYS 45 HE2 LYS 45 0.523 12.673 -5.077 221 HE3 LYS 45 HE1 LYS 45 0.124 11.274 -6.070 222 HZ1 LYS 45 HZ1 LYS 45 -1.984 11.166 -5.233 223 HZ2 LYS 45 HZ2 LYS 45 -1.730 12.838 -5.155 224 HZ3 LYS 45 HZ3 LYS 45 -1.575 11.893 -3.756 225 H LYS 46 HN LYS 46 4.426 7.621 -4.197 226 HA LYS 46 HA LYS 46 3.112 7.200 -6.701 227 HB2 LYS 46 HB2 LYS 46 5.637 7.667 -6.167 228 HB3 LYS 46 HB1 LYS 46 5.729 5.920 -5.999 229 HG2 LYS 46 HG2 LYS 46 6.364 6.393 -8.214 230 HG3 LYS 46 HG1 LYS 46 4.715 5.773 -8.313 231 HD2 LYS 46 HD2 LYS 46 3.883 8.097 -8.416 232 HD3 LYS 46 HD1 LYS 46 5.549 8.673 -8.395 233 HE2 LYS 46 HE2 LYS 46 4.814 8.674 -10.661 234 HE3 LYS 46 HE1 LYS 46 5.955 7.345 -10.467 235 HZ1 LYS 46 HZ1 LYS 46 3.029 6.930 -10.261 236 HZ2 LYS 46 HZ2 LYS 46 4.244 5.776 -10.531 237 HZ3 LYS 46 HZ3 LYS 46 3.840 6.875 -11.747 238 H LEU 47 HN LEU 47 3.577 5.312 -3.860 239 HA LEU 47 HA LEU 47 3.175 2.771 -5.172 240 HB2 LEU 47 HB2 LEU 47 3.442 3.624 -2.300 241 HB3 LEU 47 HB1 LEU 47 2.951 1.997 -2.717 242 HG LEU 47 HG LEU 47 5.266 1.884 -2.281 243 HD11 LEU 47 HD11 LEU 47 4.476 0.722 -4.340 244 HD12 LEU 47 HD12 LEU 47 6.198 1.098 -4.324 245 HD13 LEU 47 HD13 LEU 47 5.091 2.085 -5.275 246 HD21 LEU 47 HD21 LEU 47 5.487 4.362 -3.955 247 HD22 LEU 47 HD22 LEU 47 6.879 3.342 -3.600 248 HD23 LEU 47 HD23 LEU 47 5.992 4.109 -2.286 249 H LYS 48 HN LYS 48 1.329 4.961 -3.103 250 HA LYS 48 HA LYS 48 -0.965 3.377 -2.831 251 HB2 LYS 48 HB2 LYS 48 -0.592 6.370 -2.728 252 HB3 LYS 48 HB1 LYS 48 -2.108 5.573 -2.330 253 HG2 LYS 48 HG2 LYS 48 -1.159 4.501 -0.446 254 HG3 LYS 48 HG1 LYS 48 0.480 4.922 -0.949 255 HD2 LYS 48 HD2 LYS 48 -0.023 6.425 0.785 256 HD3 LYS 48 HD1 LYS 48 -0.250 7.354 -0.695 257 HE2 LYS 48 HE2 LYS 48 -2.674 6.900 -0.568 258 HE3 LYS 48 HE1 LYS 48 -2.411 6.055 0.957 259 HZ1 LYS 48 HZ1 LYS 48 -1.509 8.136 1.866 260 HZ2 LYS 48 HZ2 LYS 48 -3.118 8.293 1.379 261 HZ3 LYS 48 HZ3 LYS 48 -1.881 8.929 0.411 262 H GLU 49 HN GLU 49 -0.136 5.831 -5.274 263 HA GLU 49 HA GLU 49 -2.640 5.741 -6.584 264 HB2 GLU 49 HB2 GLU 49 -1.420 6.775 -8.512 265 HB3 GLU 49 HB1 GLU 49 -1.234 7.629 -6.991 266 HG2 GLU 49 HG2 GLU 49 0.978 6.764 -6.701 267 HG3 GLU 49 HG1 GLU 49 0.790 5.700 -8.094 268 H SER 50 HN SER 50 0.355 3.937 -7.034 269 HA SER 50 HA SER 50 -0.360 2.612 -9.402 270 HB2 SER 50 HB2 SER 50 1.500 1.733 -7.183 271 HB3 SER 50 HB1 SER 50 1.410 0.989 -8.782 272 HG SER 50 HG SER 50 2.477 3.449 -8.006 273 H TYR 51 HN TYR 51 -0.964 1.850 -6.012 274 HA TYR 51 HA TYR 51 -1.989 -0.753 -6.407 275 HB2 TYR 51 HB2 TYR 51 -1.292 0.217 -4.194 276 HB3 TYR 51 HB1 TYR 51 -2.762 1.185 -4.211 277 HD1 TYR 51 HD1 TYR 51 -1.465 -2.275 -4.083 278 HD2 TYR 51 HD2 TYR 51 -4.859 0.239 -3.587 279 HE1 TYR 51 HE1 TYR 51 -2.683 -4.136 -3.043 280 HE2 TYR 51 HE2 TYR 51 -6.087 -1.619 -2.544 281 HH TYR 51 HH TYR 51 -6.027 -4.074 -2.509 282 H CYS 52 HN CYS 52 -3.545 2.425 -6.226 283 HA CYS 52 HA CYS 52 -6.197 1.538 -6.496 284 HB2 CYS 52 HB2 CYS 52 -5.074 4.177 -7.463 285 HB3 CYS 52 HB1 CYS 52 -6.744 3.834 -7.026 286 HG CYS 52 HG CYS 52 -4.095 3.908 -4.852 287 H GLN 53 HN GLN 53 -3.779 2.516 -8.882 288 HA GLN 53 HA GLN 53 -5.433 2.355 -11.141 289 HB2 GLN 53 HB2 GLN 53 -2.449 2.136 -10.788 290 HB3 GLN 53 HB1 GLN 53 -3.216 2.068 -12.370 291 HG2 GLN 53 HG2 GLN 53 -4.048 4.274 -12.163 292 HG3 GLN 53 HG1 GLN 53 -3.632 4.343 -10.454 293 HE21 GLN 53 HE21 GLN 53 -2.884 6.091 -12.677 294 HE22 GLN 53 HE22 GLN 53 -1.155 6.135 -12.670 295 H ARG 54 HN ARG 54 -3.412 -0.080 -9.546 296 HA ARG 54 HA ARG 54 -3.766 -2.102 -11.482 297 HB2 ARG 54 HB2 ARG 54 -1.998 -2.220 -9.787 298 HB3 ARG 54 HB1 ARG 54 -3.208 -2.377 -8.521 299 HG2 ARG 54 HG2 ARG 54 -3.692 -4.398 -10.455 300 HG3 ARG 54 HG1 ARG 54 -1.974 -4.416 -10.051 301 HD2 ARG 54 HD2 ARG 54 -2.375 -4.878 -7.815 302 HD3 ARG 54 HD1 ARG 54 -4.020 -4.254 -7.879 303 HE ARG 54 HE ARG 54 -4.756 -6.282 -8.757 304 HH11 ARG 54 HH11 ARG 54 -1.263 -6.267 -8.314 305 HH12 ARG 54 HH12 ARG 54 -1.119 -8.066 -8.436 306 HH21 ARG 54 HH21 ARG 54 -4.613 -8.559 -8.944 307 HH22 ARG 54 HH22 ARG 54 -2.989 -9.340 -8.823 308 H GLN 55 HN GLN 55 -5.664 -1.124 -8.692 309 HA GLN 55 HA GLN 55 -7.443 -3.378 -8.873 310 HB2 GLN 55 HB2 GLN 55 -7.567 -0.812 -7.290 311 HB3 GLN 55 HB1 GLN 55 -8.798 -2.063 -7.202 312 HG2 GLN 55 HG2 GLN 55 -5.902 -2.307 -6.426 313 HG3 GLN 55 HG1 GLN 55 -7.302 -2.310 -5.353 314 HE21 GLN 55 HE21 GLN 55 -8.635 -4.135 -5.278 315 HE22 GLN 55 HE22 GLN 55 -8.113 -5.670 -5.876 316 H GLY 56 HN GLY 56 -7.091 -0.528 -10.601 317 HA2 GLY 56 HA2 GLY 56 -8.341 0.199 -12.411 318 HA3 GLY 56 HA1 GLY 56 -9.569 -0.988 -12.003 319 H VAL 57 HN VAL 57 -8.321 1.418 -9.767 320 HA VAL 57 HA VAL 57 -10.825 2.935 -10.033 321 HB VAL 57 HB VAL 57 -10.730 3.216 -7.479 322 HG11 VAL 57 HG11 VAL 57 -12.013 1.127 -7.111 323 HG12 VAL 57 HG12 VAL 57 -11.517 0.581 -8.714 324 HG13 VAL 57 HG13 VAL 57 -12.521 2.020 -8.543 325 HG21 VAL 57 HG21 VAL 57 -9.078 0.705 -7.743 326 HG22 VAL 57 HG22 VAL 57 -9.760 1.327 -6.242 327 HG23 VAL 57 HG23 VAL 57 -8.531 2.254 -7.101 328 HA PRO 58 HA PRO 58 -8.194 6.485 -9.793 329 HB2 PRO 58 HB2 PRO 58 -9.780 8.301 -8.546 330 HB3 PRO 58 HB1 PRO 58 -10.068 7.782 -10.213 331 HG2 PRO 58 HG2 PRO 58 -11.418 6.888 -7.704 332 HG3 PRO 58 HG1 PRO 58 -12.122 7.247 -9.294 333 HD2 PRO 58 HD2 PRO 58 -11.641 4.721 -8.443 334 HD3 PRO 58 HD1 PRO 58 -11.574 5.191 -10.151 335 H MET 59 HN MET 59 -7.151 8.001 -8.205 336 HA MET 59 HA MET 59 -6.478 6.540 -5.825 337 HB2 MET 59 HB2 MET 59 -4.918 8.030 -7.256 338 HB3 MET 59 HB1 MET 59 -5.632 9.372 -6.371 339 HG2 MET 59 HG2 MET 59 -4.980 8.138 -4.259 340 HG3 MET 59 HG1 MET 59 -4.008 7.096 -5.291 341 HE1 MET 59 HE1 MET 59 -1.561 9.519 -3.321 342 HE2 MET 59 HE2 MET 59 -1.804 7.830 -3.755 343 HE3 MET 59 HE3 MET 59 -3.033 8.684 -2.825 344 H ASN 60 HN ASN 60 -6.573 7.421 -3.680 345 HA ASN 60 HA ASN 60 -7.510 8.419 -1.884 346 HB2 ASN 60 HB2 ASN 60 -8.493 10.306 -3.995 347 HB3 ASN 60 HB1 ASN 60 -9.113 10.422 -2.353 348 HD21 ASN 60 HD21 ASN 60 -7.830 11.214 -0.752 349 HD22 ASN 60 HD22 ASN 60 -6.262 11.892 -1.030 350 H SER 61 HN SER 61 -8.913 6.443 -3.858 351 HA SER 61 HA SER 61 -11.660 6.694 -2.937 352 HB2 SER 61 HB2 SER 61 -11.964 4.590 -4.313 353 HB3 SER 61 HB1 SER 61 -11.391 5.986 -5.228 354 HG SER 61 HG SER 61 -9.632 4.930 -5.678 355 H LEU 62 HN LEU 62 -8.819 4.708 -2.532 356 HA LEU 62 HA LEU 62 -10.126 3.216 -0.367 357 HB2 LEU 62 HB2 LEU 62 -7.683 2.514 -2.000 358 HB3 LEU 62 HB1 LEU 62 -8.359 1.535 -0.713 359 HG LEU 62 HG LEU 62 -9.918 2.240 -3.192 360 HD11 LEU 62 HD11 LEU 62 -9.315 0.012 -4.040 361 HD12 LEU 62 HD12 LEU 62 -8.181 -0.177 -2.701 362 HD13 LEU 62 HD13 LEU 62 -7.917 1.080 -3.909 363 HD21 LEU 62 HD21 LEU 62 -11.222 0.255 -2.550 364 HD22 LEU 62 HD22 LEU 62 -11.250 1.501 -1.305 365 HD23 LEU 62 HD23 LEU 62 -10.224 0.081 -1.106 366 H ARG 63 HN ARG 63 -9.323 3.342 1.639 367 HA ARG 63 HA ARG 63 -7.039 5.135 2.062 368 HB2 ARG 63 HB2 ARG 63 -7.863 5.300 4.401 369 HB3 ARG 63 HB1 ARG 63 -9.036 5.854 3.218 370 HG2 ARG 63 HG2 ARG 63 -10.384 3.942 3.501 371 HG3 ARG 63 HG1 ARG 63 -9.105 3.073 4.353 372 HD2 ARG 63 HD2 ARG 63 -9.309 4.508 6.258 373 HD3 ARG 63 HD1 ARG 63 -10.401 5.588 5.393 374 HE ARG 63 HE ARG 63 -11.056 2.891 6.374 375 HH11 ARG 63 HH11 ARG 63 -13.782 5.748 5.471 376 HH12 ARG 63 HH12 ARG 63 -12.039 6.016 5.058 377 HH21 ARG 63 HH21 ARG 63 -13.250 2.523 6.874 378 HH22 ARG 63 HH22 ARG 63 -14.456 3.801 6.469 379 H PHE 64 HN PHE 64 -5.202 4.431 2.954 380 HA PHE 64 HA PHE 64 -4.950 1.580 3.498 381 HB2 PHE 64 HB2 PHE 64 -2.978 3.806 3.028 382 HB3 PHE 64 HB1 PHE 64 -2.461 2.264 3.698 383 HD1 PHE 64 HD1 PHE 64 -3.499 4.037 0.719 384 HD2 PHE 64 HD2 PHE 64 -2.687 0.201 2.368 385 HE1 PHE 64 HE1 PHE 64 -3.327 3.103 -1.551 386 HE2 PHE 64 HE2 PHE 64 -2.515 -0.743 0.105 387 HZ PHE 64 HZ PHE 64 -2.832 0.709 -1.862 388 H LEU 65 HN LEU 65 -5.305 0.928 5.500 389 HA LEU 65 HA LEU 65 -4.774 2.781 7.712 390 HB2 LEU 65 HB2 LEU 65 -6.503 0.322 7.512 391 HB3 LEU 65 HB1 LEU 65 -6.130 1.097 9.040 392 HG LEU 65 HG LEU 65 -7.556 2.428 6.734 393 HD11 LEU 65 HD11 LEU 65 -9.546 2.256 8.158 394 HD12 LEU 65 HD12 LEU 65 -8.621 1.308 9.320 395 HD13 LEU 65 HD13 LEU 65 -8.920 0.673 7.702 396 HD21 LEU 65 HD21 LEU 65 -6.982 3.338 9.551 397 HD22 LEU 65 HD22 LEU 65 -8.073 4.156 8.433 398 HD23 LEU 65 HD23 LEU 65 -6.354 4.040 8.060 399 H PHE 66 HN PHE 66 -2.905 2.558 8.663 400 HA PHE 66 HA PHE 66 -1.756 -0.139 8.949 401 HB2 PHE 66 HB2 PHE 66 -0.464 1.485 7.522 402 HB3 PHE 66 HB1 PHE 66 -0.274 2.499 8.947 403 HD1 PHE 66 HD1 PHE 66 0.379 -0.956 7.736 404 HD2 PHE 66 HD2 PHE 66 1.566 2.218 10.309 405 HE1 PHE 66 HE1 PHE 66 2.401 -2.214 8.352 406 HE2 PHE 66 HE2 PHE 66 3.592 0.967 10.924 407 HZ PHE 66 HZ PHE 66 4.010 -1.251 9.944 408 H GLU 67 HN GLU 67 -2.497 -0.737 10.911 409 HA GLU 67 HA GLU 67 -2.640 -0.872 13.172 410 HB2 GLU 67 HB2 GLU 67 -0.302 0.846 12.727 411 HB3 GLU 67 HB1 GLU 67 -1.063 1.071 14.295 412 HG2 GLU 67 HG2 GLU 67 -0.577 -1.713 13.431 413 HG3 GLU 67 HG1 GLU 67 0.833 -0.741 13.850 414 H GLY 68 HN GLY 68 -4.359 0.890 11.615 415 HA2 GLY 68 HA2 GLY 68 -6.292 1.990 12.409 416 HA3 GLY 68 HA1 GLY 68 -5.398 2.487 13.837 417 H GLN 69 HN GLN 69 -3.110 3.350 12.132 418 HA GLN 69 HA GLN 69 -4.095 6.027 11.629 419 HB2 GLN 69 HB2 GLN 69 -1.316 4.849 11.456 420 HB3 GLN 69 HB1 GLN 69 -1.700 6.554 11.261 421 HG2 GLN 69 HG2 GLN 69 -2.348 6.771 13.511 422 HG3 GLN 69 HG1 GLN 69 -2.394 5.026 13.745 423 HE21 GLN 69 HE21 GLN 69 -0.946 7.106 15.194 424 HE22 GLN 69 HE22 GLN 69 0.723 6.652 15.131 425 H ARG 70 HN ARG 70 -4.590 6.826 9.682 426 HA ARG 70 HA ARG 70 -4.297 5.139 7.361 427 HB2 ARG 70 HB2 ARG 70 -5.414 7.102 6.183 428 HB3 ARG 70 HB1 ARG 70 -6.352 6.285 7.421 429 HG2 ARG 70 HG2 ARG 70 -5.574 8.105 9.007 430 HG3 ARG 70 HG1 ARG 70 -5.015 8.962 7.572 431 HD2 ARG 70 HD2 ARG 70 -7.826 7.939 7.844 432 HD3 ARG 70 HD1 ARG 70 -7.348 9.533 8.423 433 HE ARG 70 HE ARG 70 -6.607 9.908 6.031 434 HH11 ARG 70 HH11 ARG 70 -9.250 7.737 6.911 435 HH12 ARG 70 HH12 ARG 70 -10.100 7.949 5.328 436 HH21 ARG 70 HH21 ARG 70 -7.674 10.202 4.026 437 HH22 ARG 70 HH22 ARG 70 -9.245 9.341 3.741 438 H ILE 71 HN ILE 71 -2.654 5.131 6.055 439 HA ILE 71 HA ILE 71 -0.385 6.766 6.417 440 HB ILE 71 HB ILE 71 -1.096 4.997 4.077 441 HG12 ILE 71 HG12 ILE 71 -1.070 3.705 6.113 442 HG13 ILE 71 HG11 ILE 71 0.414 3.367 5.229 443 HG21 ILE 71 HG21 ILE 71 1.293 4.963 3.609 444 HG22 ILE 71 HG22 ILE 71 1.579 6.083 4.940 445 HG23 ILE 71 HG23 ILE 71 0.659 6.606 3.530 446 HD11 ILE 71 HD11 ILE 71 1.534 5.078 6.709 447 HD12 ILE 71 HD12 ILE 71 1.026 3.582 7.492 448 HD13 ILE 71 HD13 ILE 71 0.069 5.051 7.693 449 H ALA 72 HN ALA 72 0.161 8.663 5.606 450 HA ALA 72 HA ALA 72 -1.668 10.032 3.825 451 HB1 ALA 72 HB1 ALA 72 -0.272 11.998 4.248 452 HB2 ALA 72 HB2 ALA 72 0.876 10.993 5.133 453 HB3 ALA 72 HB3 ALA 72 -0.760 11.221 5.754 454 H ASP 73 HN ASP 73 -0.607 11.419 2.072 455 HA ASP 73 HA ASP 73 0.648 9.662 0.213 456 HB2 ASP 73 HB2 ASP 73 -0.162 12.548 0.177 457 HB3 ASP 73 HB1 ASP 73 0.851 11.910 -1.112 458 H ASN 74 HN ASN 74 1.758 12.264 2.266 459 HA ASN 74 HA ASN 74 4.423 12.228 1.116 460 HB2 ASN 74 HB2 ASN 74 4.869 14.017 2.815 461 HB3 ASN 74 HB1 ASN 74 3.560 14.393 1.701 462 HD21 ASN 74 HD21 ASN 74 4.436 13.697 4.958 463 HD22 ASN 74 HD22 ASN 74 2.900 14.048 5.672 464 H HIS 75 HN HIS 75 3.407 9.839 2.498 465 HA HIS 75 HA HIS 75 5.191 9.746 4.825 466 HB2 HIS 75 HB2 HIS 75 2.678 8.376 4.102 467 HB3 HIS 75 HB1 HIS 75 3.890 7.355 4.867 468 HD2 HIS 75 HD2 HIS 75 4.931 9.785 6.948 469 HE1 HIS 75 HE1 HIS 75 0.976 9.369 8.379 470 HE2 HIS 75 HE2 HIS 75 3.233 10.437 8.790 471 H THR 76 HN THR 76 6.684 8.058 5.070 472 HA THR 76 HA THR 76 7.325 6.596 2.595 473 HB THR 76 HB THR 76 9.751 6.854 3.903 474 HG1 THR 76 HG1 THR 76 8.284 8.733 4.938 475 HG21 THR 76 HG21 THR 76 9.360 6.987 1.484 476 HG22 THR 76 HG22 THR 76 10.360 8.324 2.052 477 HG23 THR 76 HG23 THR 76 8.657 8.592 1.689 478 HA PRO 77 HA PRO 77 7.234 2.951 5.112 479 HB2 PRO 77 HB2 PRO 77 9.478 1.839 3.576 480 HB3 PRO 77 HB1 PRO 77 7.797 1.293 3.665 481 HG2 PRO 77 HG2 PRO 77 8.789 2.441 1.453 482 HG3 PRO 77 HG1 PRO 77 7.106 2.663 1.961 483 HD2 PRO 77 HD2 PRO 77 9.421 4.526 2.255 484 HD3 PRO 77 HD1 PRO 77 7.733 4.877 1.826 485 H LYS 78 HN LYS 78 9.883 4.999 5.037 486 HA LYS 78 HA LYS 78 11.655 3.432 6.681 487 HB2 LYS 78 HB2 LYS 78 12.466 5.127 5.040 488 HB3 LYS 78 HB1 LYS 78 11.756 6.387 6.037 489 HG2 LYS 78 HG2 LYS 78 14.072 6.330 6.517 490 HG3 LYS 78 HG1 LYS 78 13.240 5.627 7.904 491 HD2 LYS 78 HD2 LYS 78 15.125 4.248 7.459 492 HD3 LYS 78 HD1 LYS 78 13.707 3.363 6.897 493 HE2 LYS 78 HE2 LYS 78 14.176 3.945 4.617 494 HE3 LYS 78 HE1 LYS 78 15.463 5.040 5.111 495 HZ1 LYS 78 HZ1 LYS 78 16.341 2.946 4.304 496 HZ2 LYS 78 HZ2 LYS 78 15.476 2.096 5.483 497 HZ3 LYS 78 HZ3 LYS 78 16.710 3.155 5.937 498 H GLU 79 HN GLU 79 9.010 5.580 7.175 499 HA GLU 79 HA GLU 79 9.722 5.852 10.018 500 HB2 GLU 79 HB2 GLU 79 8.232 7.757 10.107 501 HB3 GLU 79 HB1 GLU 79 9.366 7.971 8.783 502 HG2 GLU 79 HG2 GLU 79 7.426 6.890 7.380 503 HG3 GLU 79 HG1 GLU 79 6.438 7.477 8.716 504 H LEU 80 HN LEU 80 7.472 6.169 11.301 505 HA LEU 80 HA LEU 80 5.561 5.268 12.126 506 HB2 LEU 80 HB2 LEU 80 5.355 3.956 9.416 507 HB3 LEU 80 HB1 LEU 80 4.129 3.828 10.663 508 HG LEU 80 HG LEU 80 4.935 6.571 9.887 509 HD11 LEU 80 HD11 LEU 80 3.515 6.557 7.909 510 HD12 LEU 80 HD12 LEU 80 3.259 4.823 8.096 511 HD13 LEU 80 HD13 LEU 80 4.868 5.441 7.723 512 HD21 LEU 80 HD21 LEU 80 2.262 5.261 10.367 513 HD22 LEU 80 HD22 LEU 80 2.569 6.991 10.201 514 HD23 LEU 80 HD23 LEU 80 3.217 6.110 11.585 515 H GLY 81 HN GLY 81 7.624 2.983 10.408 516 HA2 GLY 81 HA2 GLY 81 8.829 1.373 11.833 517 HA3 GLY 81 HA1 GLY 81 7.313 1.136 12.694 518 H MET 82 HN MET 82 7.643 1.415 9.201 519 HA MET 82 HA MET 82 6.185 -1.025 8.817 520 HB2 MET 82 HB2 MET 82 7.512 0.902 6.910 521 HB3 MET 82 HB1 MET 82 6.669 -0.543 6.371 522 HG2 MET 82 HG2 MET 82 4.617 0.275 7.420 523 HG3 MET 82 HG1 MET 82 5.467 1.735 7.925 524 HE1 MET 82 HE1 MET 82 2.727 1.567 6.166 525 HE2 MET 82 HE2 MET 82 3.024 2.897 5.046 526 HE3 MET 82 HE3 MET 82 3.443 3.069 6.749 527 H GLU 83 HN GLU 83 6.972 -3.013 8.553 528 HA GLU 83 HA GLU 83 9.835 -3.267 7.915 529 HB2 GLU 83 HB2 GLU 83 8.390 -4.184 10.215 530 HB3 GLU 83 HB1 GLU 83 9.026 -5.565 9.328 531 HG2 GLU 83 HG2 GLU 83 10.559 -3.244 10.466 532 HG3 GLU 83 HG1 GLU 83 10.658 -4.943 10.928 533 H GLU 84 HN GLU 84 10.255 -5.726 7.371 534 HA GLU 84 HA GLU 84 8.887 -6.208 4.920 535 HB2 GLU 84 HB2 GLU 84 11.133 -6.870 4.931 536 HB3 GLU 84 HB1 GLU 84 11.000 -7.638 6.503 537 HG2 GLU 84 HG2 GLU 84 11.217 -9.408 5.015 538 HG3 GLU 84 HG1 GLU 84 9.493 -9.344 5.354 539 H GLU 85 HN GLU 85 7.274 -7.603 4.434 540 HA GLU 85 HA GLU 85 5.534 -9.046 4.676 541 HB2 GLU 85 HB2 GLU 85 7.235 -10.076 6.947 542 HB3 GLU 85 HB1 GLU 85 5.717 -10.821 6.462 543 HG2 GLU 85 HG2 GLU 85 7.945 -10.400 4.506 544 HG3 GLU 85 HG1 GLU 85 7.886 -11.816 5.554 545 H ASP 86 HN ASP 86 5.515 -6.448 5.938 546 HA ASP 86 HA ASP 86 4.170 -6.686 8.460 547 HB2 ASP 86 HB2 ASP 86 5.488 -4.641 7.270 548 HB3 ASP 86 HB1 ASP 86 3.823 -4.198 6.900 549 H VAL 87 HN VAL 87 1.977 -5.569 8.701 550 HA VAL 87 HA VAL 87 0.202 -6.553 6.554 551 HB VAL 87 HB VAL 87 -0.372 -6.478 9.524 552 HG11 VAL 87 HG11 VAL 87 -2.435 -7.671 8.951 553 HG12 VAL 87 HG12 VAL 87 -2.048 -7.511 7.239 554 HG13 VAL 87 HG13 VAL 87 -2.378 -6.074 8.207 555 HG21 VAL 87 HG21 VAL 87 0.152 -8.806 7.677 556 HG22 VAL 87 HG22 VAL 87 -0.385 -8.939 9.352 557 HG23 VAL 87 HG23 VAL 87 1.194 -8.243 8.983 558 H ILE 88 HN ILE 88 -1.043 -5.080 5.619 559 HA ILE 88 HA ILE 88 -1.802 -2.689 7.140 560 HB ILE 88 HB ILE 88 0.107 -2.127 5.647 561 HG12 ILE 88 HG12 ILE 88 -2.413 -0.793 4.668 562 HG13 ILE 88 HG11 ILE 88 -1.759 -0.513 6.277 563 HG21 ILE 88 HG21 ILE 88 -0.276 -2.017 3.215 564 HG22 ILE 88 HG22 ILE 88 -1.805 -2.864 3.442 565 HG23 ILE 88 HG23 ILE 88 -0.286 -3.668 3.836 566 HD11 ILE 88 HD11 ILE 88 0.353 0.248 5.214 567 HD12 ILE 88 HD12 ILE 88 -1.049 1.251 4.852 568 HD13 ILE 88 HD13 ILE 88 -0.448 0.112 3.647 569 H GLU 89 HN GLU 89 -3.862 -1.922 6.721 570 HA GLU 89 HA GLU 89 -5.550 -3.758 5.170 571 HB2 GLU 89 HB2 GLU 89 -6.375 -1.696 7.217 572 HB3 GLU 89 HB1 GLU 89 -7.409 -2.912 6.483 573 HG2 GLU 89 HG2 GLU 89 -6.667 -4.553 7.830 574 HG3 GLU 89 HG1 GLU 89 -5.021 -3.925 7.874 575 H VAL 90 HN VAL 90 -7.242 -2.927 3.851 576 HA VAL 90 HA VAL 90 -6.990 -0.123 3.060 577 HB VAL 90 HB VAL 90 -5.623 -1.359 1.463 578 HG11 VAL 90 HG11 VAL 90 -8.105 -2.955 0.857 579 HG12 VAL 90 HG12 VAL 90 -6.638 -3.551 1.635 580 HG13 VAL 90 HG13 VAL 90 -6.592 -3.022 -0.047 581 HG21 VAL 90 HG21 VAL 90 -8.222 -0.443 0.249 582 HG22 VAL 90 HG22 VAL 90 -6.694 -0.635 -0.608 583 HG23 VAL 90 HG23 VAL 90 -6.846 0.579 0.662 584 H TYR 91 HN TYR 91 -8.902 0.840 2.973 585 HA TYR 91 HA TYR 91 -11.302 -0.767 2.409 586 HB2 TYR 91 HB2 TYR 91 -10.775 0.980 4.790 587 HB3 TYR 91 HB1 TYR 91 -12.418 0.804 4.183 588 HD1 TYR 91 HD1 TYR 91 -13.619 -1.262 4.437 589 HD2 TYR 91 HD2 TYR 91 -9.590 -0.941 5.765 590 HE1 TYR 91 HE1 TYR 91 -13.866 -3.368 5.677 591 HE2 TYR 91 HE2 TYR 91 -9.827 -3.049 7.006 592 HH TYR 91 HH TYR 91 -12.547 -5.125 6.586 593 H GLN 92 HN GLN 92 -13.206 0.633 1.831 594 HA GLN 92 HA GLN 92 -12.264 2.741 0.069 595 HB2 GLN 92 HB2 GLN 92 -13.998 0.991 -0.582 596 HB3 GLN 92 HB1 GLN 92 -15.122 1.857 0.459 597 HG2 GLN 92 HG2 GLN 92 -14.309 3.915 -0.992 598 HG3 GLN 92 HG1 GLN 92 -13.968 2.639 -2.159 599 HE21 GLN 92 HE21 GLN 92 -16.430 4.310 -0.369 600 HE22 GLN 92 HE22 GLN 92 -17.781 3.713 -1.273 601 H GLU 93 HN GLU 93 -12.670 4.875 0.271 602 HA GLU 93 HA GLU 93 -13.356 5.856 2.881 603 HB2 GLU 93 HB2 GLU 93 -12.631 7.195 0.277 604 HB3 GLU 93 HB1 GLU 93 -13.074 8.110 1.712 605 HG2 GLU 93 HG2 GLU 93 -10.948 6.061 1.965 606 HG3 GLU 93 HG1 GLU 93 -10.565 7.564 1.126 607 H GLN 94 HN GLN 94 -15.005 7.511 3.248 608 HA GLN 94 HA GLN 94 -17.553 6.710 2.312 609 HB2 GLN 94 HB2 GLN 94 -17.095 7.733 4.543 610 HB3 GLN 94 HB1 GLN 94 -16.807 9.269 3.739 611 HG2 GLN 94 HG2 GLN 94 -19.073 9.407 3.027 612 HG3 GLN 94 HG1 GLN 94 -19.396 7.757 3.560 613 HE21 GLN 94 HE21 GLN 94 -19.575 7.326 5.765 614 HE22 GLN 94 HE22 GLN 94 -19.863 8.584 6.920 615 H THR 95 HN THR 95 -15.237 9.013 1.203 616 HA THR 95 HA THR 95 -16.983 10.675 -0.289 617 HB THR 95 HB THR 95 -14.651 10.992 -1.578 618 HG1 THR 95 HG1 THR 95 -12.964 10.304 -0.398 619 HG21 THR 95 HG21 THR 95 -15.790 12.734 -0.311 620 HG22 THR 95 HG22 THR 95 -14.079 12.703 0.110 621 HG23 THR 95 HG23 THR 95 -15.271 11.999 1.204 622 H GLY 96 HN GLY 96 -15.681 7.534 -0.798 623 HA2 GLY 96 HA2 GLY 96 -16.363 6.020 -2.444 624 HA3 GLY 96 HA1 GLY 96 -17.044 7.356 -3.359 625 H GLY 97 HN GLY 97 -14.971 9.024 -3.716 626 HA2 GLY 97 HA2 GLY 97 -12.549 8.785 -4.338 627 HA3 GLY 97 HA1 GLY 97 -13.065 7.365 -5.240 628 H1 ASN 357 HT1 ASN 357 -3.341 -19.553 -5.289 629 H2 ASN 357 HT2 ASN 357 -4.016 -20.053 -3.824 630 H3 ASN 357 HT3 ASN 357 -2.567 -20.734 -4.359 631 HA ASN 357 HA ASN 357 -2.124 -19.150 -2.625 632 HB2 ASN 357 HB2 ASN 357 -0.536 -17.705 -3.829 633 HB3 ASN 357 HB1 ASN 357 -0.458 -19.363 -4.414 634 HD21 ASN 357 HD21 ASN 357 0.211 -16.714 -5.636 635 HD22 ASN 357 HD22 ASN 357 -0.641 -16.697 -7.142 636 H ASN 358 HN ASN 358 -2.288 -17.033 -1.792 637 HA ASN 358 HA ASN 358 -4.396 -15.410 -3.061 638 HB2 ASN 358 HB2 ASN 358 -5.164 -14.735 -0.871 639 HB3 ASN 358 HB1 ASN 358 -5.123 -16.490 -0.938 640 HD21 ASN 358 HD21 ASN 358 -5.247 -15.273 1.469 641 HD22 ASN 358 HD22 ASN 358 -3.729 -15.382 2.298 642 H ARG 359 HN ARG 359 -1.282 -15.447 -2.928 643 HA ARG 359 HA ARG 359 -0.899 -12.649 -2.127 644 HB2 ARG 359 HB2 ARG 359 1.044 -14.933 -2.413 645 HB3 ARG 359 HB1 ARG 359 1.574 -13.265 -2.275 646 HG2 ARG 359 HG2 ARG 359 1.487 -13.441 -0.083 647 HG3 ARG 359 HG1 ARG 359 -0.258 -13.699 -0.186 648 HD2 ARG 359 HD2 ARG 359 0.306 -16.141 -0.653 649 HD3 ARG 359 HD1 ARG 359 1.938 -15.749 -0.110 650 HE ARG 359 HE ARG 359 0.067 -14.866 1.802 651 HH11 ARG 359 HH11 ARG 359 1.443 -17.832 0.502 652 HH12 ARG 359 HH12 ARG 359 1.173 -18.753 2.032 653 HH21 ARG 359 HH21 ARG 359 -0.302 -15.980 3.728 654 HH22 ARG 359 HH22 ARG 359 0.222 -17.710 3.845 655 H ASP 360 HN ASP 360 0.124 -11.208 -3.503 656 HA ASP 360 HA ASP 360 0.763 -12.038 -6.218 657 HB2 ASP 360 HB2 ASP 360 -1.735 -11.325 -5.999 658 HB3 ASP 360 HB1 ASP 360 -1.088 -9.691 -5.870 659 HA PRO 361 HA PRO 361 3.816 -8.991 -4.851 660 HB2 PRO 361 HB2 PRO 361 5.738 -9.702 -6.617 661 HB3 PRO 361 HB1 PRO 361 5.419 -10.613 -5.135 662 HG2 PRO 361 HG2 PRO 361 4.571 -11.215 -7.922 663 HG3 PRO 361 HG1 PRO 361 5.144 -12.318 -6.658 664 HD2 PRO 361 HD2 PRO 361 2.511 -12.003 -7.289 665 HD3 PRO 361 HD1 PRO 361 3.084 -12.482 -5.679 666 H ILE 362 HN ILE 362 3.684 -6.946 -5.458 667 HA ILE 362 HA ILE 362 3.371 -6.333 -8.323 668 HB ILE 362 HB ILE 362 2.526 -4.527 -6.063 669 HG12 ILE 362 HG12 ILE 362 0.779 -6.402 -7.672 670 HG13 ILE 362 HG11 ILE 362 1.244 -6.654 -5.993 671 HG21 ILE 362 HG21 ILE 362 1.249 -3.385 -7.801 672 HG22 ILE 362 HG22 ILE 362 1.811 -4.550 -8.998 673 HG23 ILE 362 HG23 ILE 362 2.958 -3.454 -8.229 674 HD11 ILE 362 HD11 ILE 362 -0.394 -4.361 -7.046 675 HD12 ILE 362 HD12 ILE 362 0.074 -4.607 -5.364 676 HD13 ILE 362 HD13 ILE 362 -1.001 -5.757 -6.159 677 H VAL 363 HN VAL 363 4.947 -5.225 -9.264 678 HA VAL 363 HA VAL 363 6.778 -3.643 -7.579 679 HB VAL 363 HB VAL 363 7.611 -5.114 -10.083 680 HG11 VAL 363 HG11 VAL 363 9.875 -4.652 -9.297 681 HG12 VAL 363 HG12 VAL 363 9.219 -3.815 -7.889 682 HG13 VAL 363 HG13 VAL 363 8.954 -3.162 -9.507 683 HG21 VAL 363 HG21 VAL 363 8.719 -6.745 -8.633 684 HG22 VAL 363 HG22 VAL 363 6.970 -6.755 -8.398 685 HG23 VAL 363 HG23 VAL 363 8.014 -5.964 -7.217 686 H ILE 364 HN ILE 364 7.103 -1.584 -8.252 687 HA ILE 364 HA ILE 364 6.009 -0.835 -10.887 688 HB ILE 364 HB ILE 364 5.468 1.352 -10.035 689 HG12 ILE 364 HG12 ILE 364 6.263 0.558 -7.245 690 HG13 ILE 364 HG11 ILE 364 7.462 1.238 -8.341 691 HG21 ILE 364 HG21 ILE 364 3.742 0.786 -8.386 692 HG22 ILE 364 HG22 ILE 364 4.482 -0.799 -8.163 693 HG23 ILE 364 HG23 ILE 364 3.783 -0.363 -9.722 694 HD11 ILE 364 HD11 ILE 364 4.890 2.559 -7.504 695 HD12 ILE 364 HD12 ILE 364 6.100 3.248 -8.585 696 HD13 ILE 364 HD13 ILE 364 6.499 2.938 -6.896 697 H SER 365 HN SER 365 7.012 1.312 -11.667 698 HA SER 365 HA SER 365 9.917 1.037 -11.441 699 HB2 SER 365 HB2 SER 365 8.441 2.679 -13.494 700 HB3 SER 365 HB1 SER 365 10.075 2.022 -13.589 701 HG SER 365 HG SER 365 8.464 0.839 -14.806 702 H ASP 366 HN ASP 366 10.939 2.385 -10.155 703 HA ASP 366 HA ASP 366 9.729 4.741 -9.085 704 HB2 ASP 366 HB2 ASP 366 11.278 3.432 -7.742 705 HB3 ASP 366 HB1 ASP 366 12.566 3.696 -8.913 706 H SER 367 HN SER 367 10.178 6.882 -9.512 707 HA SER 367 HA SER 367 12.148 7.596 -11.499 708 HB2 SER 367 HB2 SER 367 10.008 8.890 -12.621 709 HB3 SER 367 HB1 SER 367 10.705 7.388 -13.230 710 HG SER 367 HG SER 367 9.170 6.386 -11.625 711 HA PRO 368 HA PRO 368 11.748 10.911 -8.398 712 HB2 PRO 368 HB2 PRO 368 14.451 11.572 -9.331 713 HB3 PRO 368 HB1 PRO 368 13.903 11.147 -7.703 714 HG2 PRO 368 HG2 PRO 368 15.424 9.490 -9.157 715 HG3 PRO 368 HG1 PRO 368 14.175 8.898 -8.043 716 HD2 PRO 368 HD2 PRO 368 14.062 9.163 -11.026 717 HD3 PRO 368 HD1 PRO 368 13.471 7.847 -9.989 Start of MODEL 16 1 H TYR 21 HT1 TYR 21 14.479 -5.634 -0.493 2 HA TYR 21 HA TYR 21 13.255 -3.682 -1.164 3 HB2 TYR 21 HB2 TYR 21 11.630 -5.633 -2.810 4 HB3 TYR 21 HB1 TYR 21 11.307 -3.913 -2.624 5 HD1 TYR 21 HD1 TYR 21 13.873 -2.647 -3.027 6 HD2 TYR 21 HD2 TYR 21 12.222 -6.031 -5.010 7 HE1 TYR 21 HE1 TYR 21 15.261 -2.164 -4.998 8 HE2 TYR 21 HE2 TYR 21 13.609 -5.556 -6.981 9 HH TYR 21 HH TYR 21 14.885 -2.852 -7.724 10 H ILE 22 HN ILE 22 11.208 -3.140 -0.136 11 HA ILE 22 HA ILE 22 10.609 -4.979 2.036 12 HB ILE 22 HB ILE 22 9.547 -2.202 1.477 13 HG12 ILE 22 HG12 ILE 22 12.003 -2.348 1.957 14 HG13 ILE 22 HG11 ILE 22 11.090 -1.398 3.125 15 HG21 ILE 22 HG21 ILE 22 8.002 -3.506 2.831 16 HG22 ILE 22 HG22 ILE 22 8.748 -2.225 3.785 17 HG23 ILE 22 HG23 ILE 22 9.298 -3.891 3.964 18 HD11 ILE 22 HD11 ILE 22 12.052 -4.223 3.494 19 HD12 ILE 22 HD12 ILE 22 11.106 -3.302 4.663 20 HD13 ILE 22 HD13 ILE 22 12.733 -2.775 4.234 21 H LYS 23 HN LYS 23 9.051 -6.454 1.829 22 HA LYS 23 HA LYS 23 6.915 -5.959 -0.124 23 HB2 LYS 23 HB2 LYS 23 8.274 -8.033 -0.323 24 HB3 LYS 23 HB1 LYS 23 7.668 -8.540 1.245 25 HG2 LYS 23 HG2 LYS 23 5.331 -8.187 0.110 26 HG3 LYS 23 HG1 LYS 23 6.266 -8.388 -1.372 27 HD2 LYS 23 HD2 LYS 23 5.448 -10.539 -0.757 28 HD3 LYS 23 HD1 LYS 23 7.178 -10.513 -0.397 29 HE2 LYS 23 HE2 LYS 23 5.368 -9.677 1.780 30 HE3 LYS 23 HE1 LYS 23 5.308 -11.378 1.325 31 HZ1 LYS 23 HZ1 LYS 23 6.920 -11.253 2.981 32 HZ2 LYS 23 HZ2 LYS 23 7.616 -9.832 2.366 33 HZ3 LYS 23 HZ3 LYS 23 7.825 -11.304 1.550 34 H LEU 24 HN LEU 24 5.100 -5.163 0.642 35 HA LEU 24 HA LEU 24 4.369 -5.666 3.443 36 HB2 LEU 24 HB2 LEU 24 3.200 -3.661 1.512 37 HB3 LEU 24 HB1 LEU 24 2.887 -3.761 3.231 38 HG LEU 24 HG LEU 24 5.632 -3.184 2.134 39 HD11 LEU 24 HD11 LEU 24 4.132 -1.465 1.303 40 HD12 LEU 24 HD12 LEU 24 5.166 -0.815 2.578 41 HD13 LEU 24 HD13 LEU 24 3.485 -1.222 2.925 42 HD21 LEU 24 HD21 LEU 24 5.533 -3.966 4.442 43 HD22 LEU 24 HD22 LEU 24 4.354 -2.712 4.823 44 HD23 LEU 24 HD23 LEU 24 6.000 -2.267 4.373 45 H LYS 25 HN LYS 25 2.574 -6.780 3.989 46 HA LYS 25 HA LYS 25 1.083 -8.058 1.838 47 HB2 LYS 25 HB2 LYS 25 1.269 -8.515 4.811 48 HB3 LYS 25 HB1 LYS 25 0.011 -9.276 3.848 49 HG2 LYS 25 HG2 LYS 25 1.655 -10.421 2.514 50 HG3 LYS 25 HG1 LYS 25 2.963 -9.570 3.335 51 HD2 LYS 25 HD2 LYS 25 2.582 -10.725 5.355 52 HD3 LYS 25 HD1 LYS 25 1.004 -11.308 4.815 53 HE2 LYS 25 HE2 LYS 25 2.003 -12.796 3.254 54 HE3 LYS 25 HE1 LYS 25 3.590 -12.065 3.474 55 HZ1 LYS 25 HZ1 LYS 25 3.036 -14.277 4.653 56 HZ2 LYS 25 HZ2 LYS 25 2.226 -13.303 5.771 57 HZ3 LYS 25 HZ3 LYS 25 3.886 -13.082 5.499 58 H VAL 26 HN VAL 26 -0.496 -6.867 1.031 59 HA VAL 26 HA VAL 26 -2.014 -5.046 2.733 60 HB VAL 26 HB VAL 26 -2.517 -5.440 -0.200 61 HG11 VAL 26 HG11 VAL 26 -4.085 -4.059 1.011 62 HG12 VAL 26 HG12 VAL 26 -3.124 -3.061 -0.082 63 HG13 VAL 26 HG13 VAL 26 -2.766 -3.077 1.645 64 HG21 VAL 26 HG21 VAL 26 -0.332 -3.758 1.011 65 HG22 VAL 26 HG22 VAL 26 -0.859 -3.677 -0.670 66 HG23 VAL 26 HG23 VAL 26 -0.123 -5.155 -0.047 67 H ILE 27 HN ILE 27 -3.743 -5.778 3.733 68 HA ILE 27 HA ILE 27 -5.095 -8.169 2.769 69 HB ILE 27 HB ILE 27 -5.670 -6.547 5.251 70 HG12 ILE 27 HG12 ILE 27 -3.387 -7.417 5.324 71 HG13 ILE 27 HG11 ILE 27 -4.408 -8.287 6.462 72 HG21 ILE 27 HG21 ILE 27 -6.784 -8.624 6.013 73 HG22 ILE 27 HG22 ILE 27 -6.525 -9.312 4.410 74 HG23 ILE 27 HG23 ILE 27 -7.554 -7.892 4.605 75 HD11 ILE 27 HD11 ILE 27 -4.584 -10.141 4.863 76 HD12 ILE 27 HD12 ILE 27 -2.914 -9.806 5.328 77 HD13 ILE 27 HD13 ILE 27 -3.518 -9.268 3.760 78 H GLY 28 HN GLY 28 -6.750 -8.035 1.437 79 HA2 GLY 28 HA2 GLY 28 -8.140 -5.509 1.083 80 HA3 GLY 28 HA1 GLY 28 -8.321 -6.948 0.092 81 H GLN 29 HN GLN 29 -10.539 -5.609 0.753 82 HA GLN 29 HA GLN 29 -11.798 -6.373 3.161 83 HB2 GLN 29 HB2 GLN 29 -12.531 -4.490 1.721 84 HB3 GLN 29 HB1 GLN 29 -13.064 -5.646 0.510 85 HG2 GLN 29 HG2 GLN 29 -14.992 -4.965 1.662 86 HG3 GLN 29 HG1 GLN 29 -14.621 -6.581 2.259 87 HE21 GLN 29 HE21 GLN 29 -14.031 -6.850 4.385 88 HE22 GLN 29 HE22 GLN 29 -14.105 -5.581 5.557 89 H ASP 30 HN ASP 30 -11.291 -7.996 0.153 90 HA ASP 30 HA ASP 30 -13.306 -10.022 0.689 91 HB2 ASP 30 HB2 ASP 30 -12.710 -10.946 -1.470 92 HB3 ASP 30 HB1 ASP 30 -12.935 -9.208 -1.627 93 H SER 31 HN SER 31 -10.700 -9.551 2.261 94 HA SER 31 HA SER 31 -9.295 -10.817 3.515 95 HB2 SER 31 HB2 SER 31 -10.505 -13.338 2.390 96 HB3 SER 31 HB1 SER 31 -9.843 -13.055 3.999 97 HG SER 31 HG SER 31 -11.659 -11.977 4.576 98 H SER 32 HN SER 32 -8.582 -10.005 0.830 99 HA SER 32 HA SER 32 -7.033 -12.166 -0.310 100 HB2 SER 32 HB2 SER 32 -6.249 -10.056 -1.743 101 HB3 SER 32 HB1 SER 32 -7.816 -10.825 -2.008 102 HG SER 32 HG SER 32 -8.738 -9.042 -1.413 103 H GLU 33 HN GLU 33 -4.731 -12.139 -0.557 104 HA GLU 33 HA GLU 33 -3.341 -10.533 1.494 105 HB2 GLU 33 HB2 GLU 33 -3.462 -13.068 1.803 106 HB3 GLU 33 HB1 GLU 33 -2.420 -13.194 0.395 107 HG2 GLU 33 HG2 GLU 33 -0.816 -11.674 1.664 108 HG3 GLU 33 HG1 GLU 33 -1.800 -12.025 3.083 109 H ILE 34 HN ILE 34 -3.258 -8.904 -0.285 110 HA ILE 34 HA ILE 34 -1.733 -9.462 -2.643 111 HB ILE 34 HB ILE 34 -2.493 -6.804 -1.431 112 HG12 ILE 34 HG12 ILE 34 -4.456 -8.135 -1.961 113 HG13 ILE 34 HG11 ILE 34 -4.303 -6.808 -3.107 114 HG21 ILE 34 HG21 ILE 34 -1.448 -7.493 -4.164 115 HG22 ILE 34 HG22 ILE 34 -0.664 -6.493 -2.940 116 HG23 ILE 34 HG23 ILE 34 -2.142 -5.933 -3.725 117 HD11 ILE 34 HD11 ILE 34 -4.963 -8.799 -4.267 118 HD12 ILE 34 HD12 ILE 34 -3.608 -9.695 -3.583 119 HD13 ILE 34 HD13 ILE 34 -3.311 -8.388 -4.730 120 H HIS 35 HN HIS 35 0.403 -9.225 -3.021 121 HA HIS 35 HA HIS 35 2.080 -8.445 -0.733 122 HB2 HIS 35 HB2 HIS 35 2.555 -10.250 -3.095 123 HB3 HIS 35 HB1 HIS 35 3.899 -9.603 -2.161 124 HD2 HIS 35 HD2 HIS 35 1.063 -10.432 0.174 125 HE1 HIS 35 HE1 HIS 35 3.568 -13.834 0.031 126 HE2 HIS 35 HE2 HIS 35 1.470 -12.841 1.052 127 H PHE 36 HN PHE 36 2.145 -6.227 -1.008 128 HA PHE 36 HA PHE 36 2.877 -5.135 -3.597 129 HB2 PHE 36 HB2 PHE 36 1.235 -4.130 -1.810 130 HB3 PHE 36 HB1 PHE 36 2.709 -3.507 -1.086 131 HD1 PHE 36 HD1 PHE 36 3.345 -3.604 -4.499 132 HD2 PHE 36 HD2 PHE 36 1.075 -1.441 -1.615 133 HE1 PHE 36 HE1 PHE 36 3.252 -1.683 -6.019 134 HE2 PHE 36 HE2 PHE 36 0.984 0.491 -3.138 135 HZ PHE 36 HZ PHE 36 2.072 0.369 -5.342 136 H LYS 37 HN LYS 37 4.961 -5.129 -4.189 137 HA LYS 37 HA LYS 37 7.016 -5.122 -2.097 138 HB2 LYS 37 HB2 LYS 37 6.967 -6.711 -4.155 139 HB3 LYS 37 HB1 LYS 37 7.580 -5.321 -5.039 140 HG2 LYS 37 HG2 LYS 37 9.499 -5.199 -3.538 141 HG3 LYS 37 HG1 LYS 37 8.882 -6.582 -2.633 142 HD2 LYS 37 HD2 LYS 37 9.615 -6.627 -5.559 143 HD3 LYS 37 HD1 LYS 37 10.666 -7.169 -4.252 144 HE2 LYS 37 HE2 LYS 37 8.861 -8.782 -3.595 145 HE3 LYS 37 HE1 LYS 37 8.017 -8.338 -5.077 146 HZ1 LYS 37 HZ1 LYS 37 10.054 -9.030 -6.302 147 HZ2 LYS 37 HZ2 LYS 37 9.267 -10.294 -5.501 148 HZ3 LYS 37 HZ3 LYS 37 10.675 -9.630 -4.849 149 H VAL 38 HN VAL 38 7.690 -3.229 -1.420 150 HA VAL 38 HA VAL 38 7.909 -1.009 -3.351 151 HB VAL 38 HB VAL 38 7.415 0.551 -1.651 152 HG11 VAL 38 HG11 VAL 38 5.627 -1.819 -1.114 153 HG12 VAL 38 HG12 VAL 38 5.450 -0.683 -2.451 154 HG13 VAL 38 HG13 VAL 38 5.249 -0.127 -0.791 155 HG21 VAL 38 HG21 VAL 38 7.706 -1.680 0.362 156 HG22 VAL 38 HG22 VAL 38 7.177 -0.037 0.730 157 HG23 VAL 38 HG23 VAL 38 8.811 -0.325 0.130 158 H LYS 39 HN LYS 39 9.588 0.674 -2.553 159 HA LYS 39 HA LYS 39 11.962 -0.776 -1.585 160 HB2 LYS 39 HB2 LYS 39 12.019 -0.029 -4.010 161 HB3 LYS 39 HB1 LYS 39 12.008 1.627 -3.411 162 HG2 LYS 39 HG2 LYS 39 14.106 1.297 -2.288 163 HG3 LYS 39 HG1 LYS 39 14.095 -0.421 -2.692 164 HD2 LYS 39 HD2 LYS 39 15.576 0.657 -4.212 165 HD3 LYS 39 HD1 LYS 39 14.115 0.251 -5.114 166 HE2 LYS 39 HE2 LYS 39 13.366 2.486 -5.096 167 HE3 LYS 39 HE1 LYS 39 14.530 2.943 -3.853 168 HZ1 LYS 39 HZ1 LYS 39 16.223 3.057 -5.348 169 HZ2 LYS 39 HZ2 LYS 39 14.938 3.491 -6.367 170 HZ3 LYS 39 HZ3 LYS 39 15.551 1.913 -6.391 171 H MET 40 HN MET 40 13.129 0.116 0.036 172 HA MET 40 HA MET 40 11.852 2.111 1.631 173 HB2 MET 40 HB2 MET 40 13.064 0.229 2.632 174 HB3 MET 40 HB1 MET 40 14.565 0.802 1.918 175 HG2 MET 40 HG2 MET 40 14.519 1.394 4.236 176 HG3 MET 40 HG1 MET 40 14.383 2.860 3.268 177 HE1 MET 40 HE1 MET 40 12.755 0.562 5.926 178 HE2 MET 40 HE2 MET 40 11.861 0.071 4.487 179 HE3 MET 40 HE3 MET 40 11.036 0.937 5.785 180 H THR 41 HN THR 41 11.842 3.854 0.076 181 HA THR 41 HA THR 41 13.619 5.876 0.638 182 HB THR 41 HB THR 41 15.044 4.155 -0.896 183 HG1 THR 41 HG1 THR 41 15.351 6.953 -1.254 184 HG21 THR 41 HG21 THR 41 13.885 6.153 -2.844 185 HG22 THR 41 HG22 THR 41 13.604 4.412 -2.862 186 HG23 THR 41 HG23 THR 41 15.219 5.051 -3.170 187 H THR 42 HN THR 42 11.498 4.416 -1.745 188 HA THR 42 HA THR 42 10.814 6.911 -2.990 189 HB THR 42 HB THR 42 9.201 4.391 -3.233 190 HG1 THR 42 HG1 THR 42 11.337 4.749 -4.993 191 HG21 THR 42 HG21 THR 42 8.435 6.433 -4.380 192 HG22 THR 42 HG22 THR 42 8.899 5.171 -5.524 193 HG23 THR 42 HG23 THR 42 9.983 6.530 -5.219 194 H HIS 43 HN HIS 43 9.108 8.205 -2.578 195 HA HIS 43 HA HIS 43 7.792 8.123 -0.098 196 HB2 HIS 43 HB2 HIS 43 7.936 9.874 -2.355 197 HB3 HIS 43 HB1 HIS 43 6.241 9.647 -1.939 198 HD2 HIS 43 HD2 HIS 43 5.534 10.493 0.670 199 HE1 HIS 43 HE1 HIS 43 9.036 12.826 1.128 200 HE2 HIS 43 HE2 HIS 43 6.827 12.159 2.181 201 H LEU 44 HN LEU 44 5.723 7.496 0.491 202 HA LEU 44 HA LEU 44 4.642 5.288 -0.901 203 HB2 LEU 44 HB2 LEU 44 3.670 6.920 1.424 204 HB3 LEU 44 HB1 LEU 44 2.712 5.608 0.759 205 HG LEU 44 HG LEU 44 5.535 5.233 1.753 206 HD11 LEU 44 HD11 LEU 44 2.948 4.789 3.231 207 HD12 LEU 44 HD12 LEU 44 4.171 6.004 3.604 208 HD13 LEU 44 HD13 LEU 44 4.548 4.290 3.783 209 HD21 LEU 44 HD21 LEU 44 4.837 2.867 1.855 210 HD22 LEU 44 HD22 LEU 44 4.804 3.522 0.220 211 HD23 LEU 44 HD23 LEU 44 3.299 3.313 1.115 212 H LYS 45 HN LYS 45 4.329 8.557 -1.490 213 HA LYS 45 HA LYS 45 1.684 8.903 -2.273 214 HB2 LYS 45 HB2 LYS 45 3.163 10.796 -2.170 215 HB3 LYS 45 HB1 LYS 45 4.251 10.083 -3.352 216 HG2 LYS 45 HG2 LYS 45 3.108 11.729 -4.535 217 HG3 LYS 45 HG1 LYS 45 2.290 10.231 -4.984 218 HD2 LYS 45 HD2 LYS 45 0.650 10.756 -3.111 219 HD3 LYS 45 HD1 LYS 45 1.369 12.368 -3.082 220 HE2 LYS 45 HE2 LYS 45 0.822 12.617 -5.474 221 HE3 LYS 45 HE1 LYS 45 0.034 11.041 -5.439 222 HZ1 LYS 45 HZ1 LYS 45 -1.696 12.530 -5.139 223 HZ2 LYS 45 HZ2 LYS 45 -0.802 13.552 -4.135 224 HZ3 LYS 45 HZ3 LYS 45 -1.345 12.055 -3.548 225 H LYS 46 HN LYS 46 4.483 7.876 -4.214 226 HA LYS 46 HA LYS 46 2.996 7.400 -6.578 227 HB2 LYS 46 HB2 LYS 46 5.457 7.814 -6.514 228 HB3 LYS 46 HB1 LYS 46 5.669 6.221 -5.802 229 HG2 LYS 46 HG2 LYS 46 6.132 5.899 -8.056 230 HG3 LYS 46 HG1 LYS 46 4.471 5.329 -7.881 231 HD2 LYS 46 HD2 LYS 46 3.783 7.696 -8.575 232 HD3 LYS 46 HD1 LYS 46 5.456 7.897 -9.095 233 HE2 LYS 46 HE2 LYS 46 4.502 7.173 -11.047 234 HE3 LYS 46 HE1 LYS 46 4.995 5.632 -10.348 235 HZ1 LYS 46 HZ1 LYS 46 2.677 5.728 -11.250 236 HZ2 LYS 46 HZ2 LYS 46 2.283 6.784 -9.981 237 HZ3 LYS 46 HZ3 LYS 46 2.794 5.198 -9.646 238 H LEU 47 HN LEU 47 3.761 5.443 -3.791 239 HA LEU 47 HA LEU 47 3.159 2.930 -4.957 240 HB2 LEU 47 HB2 LEU 47 3.422 3.935 -2.149 241 HB3 LEU 47 HB1 LEU 47 2.765 2.338 -2.443 242 HG LEU 47 HG LEU 47 5.082 2.078 -1.959 243 HD11 LEU 47 HD11 LEU 47 4.863 1.889 -4.952 244 HD12 LEU 47 HD12 LEU 47 4.109 0.746 -3.840 245 HD13 LEU 47 HD13 LEU 47 5.864 0.916 -3.874 246 HD21 LEU 47 HD21 LEU 47 5.628 4.099 -4.126 247 HD22 LEU 47 HD22 LEU 47 6.844 3.183 -3.237 248 HD23 LEU 47 HD23 LEU 47 5.830 4.353 -2.392 249 H LYS 48 HN LYS 48 1.262 5.210 -3.017 250 HA LYS 48 HA LYS 48 -1.060 3.647 -2.819 251 HB2 LYS 48 HB2 LYS 48 -0.682 6.641 -2.730 252 HB3 LYS 48 HB1 LYS 48 -2.202 5.837 -2.361 253 HG2 LYS 48 HG2 LYS 48 -1.216 4.708 -0.489 254 HG3 LYS 48 HG1 LYS 48 0.383 5.326 -0.906 255 HD2 LYS 48 HD2 LYS 48 -0.446 6.664 0.884 256 HD3 LYS 48 HD1 LYS 48 -0.535 7.641 -0.584 257 HE2 LYS 48 HE2 LYS 48 -2.923 7.108 -0.784 258 HE3 LYS 48 HE1 LYS 48 -2.825 6.135 0.682 259 HZ1 LYS 48 HZ1 LYS 48 -2.275 8.102 1.942 260 HZ2 LYS 48 HZ2 LYS 48 -3.709 8.369 1.083 261 HZ3 LYS 48 HZ3 LYS 48 -2.265 9.054 0.532 262 H GLU 49 HN GLU 49 -0.201 6.172 -5.185 263 HA GLU 49 HA GLU 49 -2.645 6.054 -6.592 264 HB2 GLU 49 HB2 GLU 49 -1.353 7.181 -8.437 265 HB3 GLU 49 HB1 GLU 49 -1.310 7.990 -6.876 266 HG2 GLU 49 HG2 GLU 49 0.893 7.141 -6.442 267 HG3 GLU 49 HG1 GLU 49 0.859 6.193 -7.925 268 H SER 50 HN SER 50 0.430 4.362 -7.115 269 HA SER 50 HA SER 50 -0.311 3.156 -9.558 270 HB2 SER 50 HB2 SER 50 1.686 2.093 -7.546 271 HB3 SER 50 HB1 SER 50 1.630 1.743 -9.274 272 HG SER 50 HG SER 50 2.491 4.039 -7.934 273 H TYR 51 HN TYR 51 -0.841 2.277 -6.208 274 HA TYR 51 HA TYR 51 -1.663 -0.401 -6.706 275 HB2 TYR 51 HB2 TYR 51 -0.941 0.539 -4.472 276 HB3 TYR 51 HB1 TYR 51 -2.503 1.345 -4.389 277 HD1 TYR 51 HD1 TYR 51 -0.782 -1.894 -4.271 278 HD2 TYR 51 HD2 TYR 51 -4.527 0.095 -3.932 279 HE1 TYR 51 HE1 TYR 51 -1.763 -3.920 -3.282 280 HE2 TYR 51 HE2 TYR 51 -5.517 -1.928 -2.945 281 HH TYR 51 HH TYR 51 -3.743 -4.439 -1.735 282 H CYS 52 HN CYS 52 -3.330 2.696 -6.522 283 HA CYS 52 HA CYS 52 -5.974 1.766 -6.602 284 HB2 CYS 52 HB2 CYS 52 -4.872 4.324 -7.795 285 HB3 CYS 52 HB1 CYS 52 -6.559 4.008 -7.410 286 HG CYS 52 HG CYS 52 -4.020 4.256 -5.125 287 H GLN 53 HN GLN 53 -3.662 2.506 -9.164 288 HA GLN 53 HA GLN 53 -5.402 2.113 -11.347 289 HB2 GLN 53 HB2 GLN 53 -2.409 1.722 -11.211 290 HB3 GLN 53 HB1 GLN 53 -3.354 1.898 -12.682 291 HG2 GLN 53 HG2 GLN 53 -3.820 4.156 -12.242 292 HG3 GLN 53 HG1 GLN 53 -3.305 4.013 -10.559 293 HE21 GLN 53 HE21 GLN 53 -2.414 5.852 -12.661 294 HE22 GLN 53 HE22 GLN 53 -0.705 5.619 -12.789 295 H ARG 54 HN ARG 54 -3.380 -0.066 -9.477 296 HA ARG 54 HA ARG 54 -3.611 -2.339 -11.133 297 HB2 ARG 54 HB2 ARG 54 -1.891 -2.204 -9.434 298 HB3 ARG 54 HB1 ARG 54 -3.096 -2.084 -8.165 299 HG2 ARG 54 HG2 ARG 54 -2.281 -4.287 -8.088 300 HG3 ARG 54 HG1 ARG 54 -3.871 -4.388 -8.842 301 HD2 ARG 54 HD2 ARG 54 -2.982 -4.795 -10.950 302 HD3 ARG 54 HD1 ARG 54 -1.406 -4.132 -10.520 303 HE ARG 54 HE ARG 54 -2.089 -6.471 -9.006 304 HH11 ARG 54 HH11 ARG 54 -0.778 -5.342 -12.075 305 HH12 ARG 54 HH12 ARG 54 0.205 -6.834 -12.328 306 HH21 ARG 54 HH21 ARG 54 -0.838 -8.356 -9.277 307 HH22 ARG 54 HH22 ARG 54 0.172 -8.506 -10.771 308 H GLN 55 HN GLN 55 -5.656 -1.028 -8.590 309 HA GLN 55 HA GLN 55 -7.392 -3.360 -8.633 310 HB2 GLN 55 HB2 GLN 55 -7.639 -0.754 -7.118 311 HB3 GLN 55 HB1 GLN 55 -8.697 -2.143 -6.924 312 HG2 GLN 55 HG2 GLN 55 -5.779 -1.948 -6.241 313 HG3 GLN 55 HG1 GLN 55 -7.137 -2.153 -5.135 314 HE21 GLN 55 HE21 GLN 55 -8.143 -4.170 -4.980 315 HE22 GLN 55 HE22 GLN 55 -7.379 -5.612 -5.543 316 H GLY 56 HN GLY 56 -7.009 -0.692 -10.534 317 HA2 GLY 56 HA2 GLY 56 -8.267 0.097 -12.290 318 HA3 GLY 56 HA1 GLY 56 -9.460 -1.140 -11.923 319 H VAL 57 HN VAL 57 -8.350 1.347 -9.680 320 HA VAL 57 HA VAL 57 -10.962 2.682 -9.930 321 HB VAL 57 HB VAL 57 -10.922 3.008 -7.422 322 HG11 VAL 57 HG11 VAL 57 -11.835 0.780 -6.929 323 HG12 VAL 57 HG12 VAL 57 -11.186 0.191 -8.461 324 HG13 VAL 57 HG13 VAL 57 -12.442 1.430 -8.452 325 HG21 VAL 57 HG21 VAL 57 -8.806 0.868 -7.598 326 HG22 VAL 57 HG22 VAL 57 -9.637 1.338 -6.117 327 HG23 VAL 57 HG23 VAL 57 -8.615 2.500 -6.961 328 HA PRO 58 HA PRO 58 -8.613 6.436 -9.882 329 HB2 PRO 58 HB2 PRO 58 -10.269 8.153 -8.589 330 HB3 PRO 58 HB1 PRO 58 -10.600 7.572 -10.226 331 HG2 PRO 58 HG2 PRO 58 -11.739 6.623 -7.635 332 HG3 PRO 58 HG1 PRO 58 -12.558 6.921 -9.182 333 HD2 PRO 58 HD2 PRO 58 -11.868 4.438 -8.376 334 HD3 PRO 58 HD1 PRO 58 -11.878 4.918 -10.084 335 H MET 59 HN MET 59 -7.629 8.065 -8.384 336 HA MET 59 HA MET 59 -6.704 6.746 -6.013 337 HB2 MET 59 HB2 MET 59 -5.346 8.308 -7.516 338 HB3 MET 59 HB1 MET 59 -6.197 9.629 -6.727 339 HG2 MET 59 HG2 MET 59 -5.315 8.963 -4.577 340 HG3 MET 59 HG1 MET 59 -4.536 7.560 -5.306 341 HE1 MET 59 HE1 MET 59 -2.880 9.436 -3.477 342 HE2 MET 59 HE2 MET 59 -1.422 9.663 -4.444 343 HE3 MET 59 HE3 MET 59 -2.196 8.079 -4.372 344 H ASN 60 HN ASN 60 -6.872 7.563 -3.863 345 HA ASN 60 HA ASN 60 -7.848 8.515 -2.048 346 HB2 ASN 60 HB2 ASN 60 -9.102 10.268 -4.139 347 HB3 ASN 60 HB1 ASN 60 -9.637 10.346 -2.463 348 HD21 ASN 60 HD21 ASN 60 -8.190 11.051 -0.870 349 HD22 ASN 60 HD22 ASN 60 -6.785 11.976 -1.282 350 H SER 61 HN SER 61 -9.210 6.515 -4.148 351 HA SER 61 HA SER 61 -11.902 6.484 -3.098 352 HB2 SER 61 HB2 SER 61 -12.130 4.423 -4.493 353 HB3 SER 61 HB1 SER 61 -11.560 5.817 -5.414 354 HG SER 61 HG SER 61 -9.756 4.806 -5.801 355 H LEU 62 HN LEU 62 -8.942 4.613 -2.811 356 HA LEU 62 HA LEU 62 -10.100 3.101 -0.576 357 HB2 LEU 62 HB2 LEU 62 -7.630 2.475 -2.191 358 HB3 LEU 62 HB1 LEU 62 -8.360 1.458 -0.964 359 HG LEU 62 HG LEU 62 -9.718 2.200 -3.558 360 HD11 LEU 62 HD11 LEU 62 -9.179 -0.072 -4.284 361 HD12 LEU 62 HD12 LEU 62 -8.229 -0.316 -2.817 362 HD13 LEU 62 HD13 LEU 62 -7.722 0.884 -4.008 363 HD21 LEU 62 HD21 LEU 62 -11.286 1.613 -1.819 364 HD22 LEU 62 HD22 LEU 62 -10.356 0.169 -1.421 365 HD23 LEU 62 HD23 LEU 62 -11.177 0.289 -2.976 366 H ARG 63 HN ARG 63 -9.086 3.080 1.388 367 HA ARG 63 HA ARG 63 -6.842 4.962 1.702 368 HB2 ARG 63 HB2 ARG 63 -7.639 5.309 4.021 369 HB3 ARG 63 HB1 ARG 63 -8.825 5.796 2.822 370 HG2 ARG 63 HG2 ARG 63 -10.017 3.677 3.165 371 HG3 ARG 63 HG1 ARG 63 -8.853 3.248 4.420 372 HD2 ARG 63 HD2 ARG 63 -9.523 5.115 5.761 373 HD3 ARG 63 HD1 ARG 63 -10.553 5.727 4.468 374 HE ARG 63 HE ARG 63 -11.100 3.113 5.687 375 HH11 ARG 63 HH11 ARG 63 -13.774 6.148 5.518 376 HH12 ARG 63 HH12 ARG 63 -12.095 6.414 4.898 377 HH21 ARG 63 HH21 ARG 63 -13.222 2.737 6.368 378 HH22 ARG 63 HH22 ARG 63 -14.419 4.082 6.285 379 H PHE 64 HN PHE 64 -5.027 4.247 2.611 380 HA PHE 64 HA PHE 64 -4.861 1.415 3.265 381 HB2 PHE 64 HB2 PHE 64 -2.740 3.536 2.875 382 HB3 PHE 64 HB1 PHE 64 -2.392 1.865 3.298 383 HD1 PHE 64 HD1 PHE 64 -3.580 4.115 0.671 384 HD2 PHE 64 HD2 PHE 64 -2.585 0.107 1.679 385 HE1 PHE 64 HE1 PHE 64 -3.582 3.520 -1.715 386 HE2 PHE 64 HE2 PHE 64 -2.585 -0.497 -0.707 387 HZ PHE 64 HZ PHE 64 -3.083 1.215 -2.403 388 H LEU 65 HN LEU 65 -4.954 0.740 5.291 389 HA LEU 65 HA LEU 65 -4.458 2.684 7.439 390 HB2 LEU 65 HB2 LEU 65 -6.029 0.109 7.480 391 HB3 LEU 65 HB1 LEU 65 -5.764 1.140 8.871 392 HG LEU 65 HG LEU 65 -7.321 1.868 6.390 393 HD11 LEU 65 HD11 LEU 65 -9.237 1.883 7.907 394 HD12 LEU 65 HD12 LEU 65 -8.195 1.347 9.226 395 HD13 LEU 65 HD13 LEU 65 -8.475 0.292 7.840 396 HD21 LEU 65 HD21 LEU 65 -6.710 3.468 8.873 397 HD22 LEU 65 HD22 LEU 65 -7.928 3.907 7.676 398 HD23 LEU 65 HD23 LEU 65 -6.226 3.844 7.219 399 H PHE 66 HN PHE 66 -2.633 2.513 8.454 400 HA PHE 66 HA PHE 66 -1.407 -0.142 8.798 401 HB2 PHE 66 HB2 PHE 66 -0.150 1.149 7.105 402 HB3 PHE 66 HB1 PHE 66 0.037 2.469 8.253 403 HD1 PHE 66 HD1 PHE 66 0.785 -1.148 7.843 404 HD2 PHE 66 HD2 PHE 66 1.923 2.569 9.570 405 HE1 PHE 66 HE1 PHE 66 2.871 -2.169 8.660 406 HE2 PHE 66 HE2 PHE 66 4.010 1.559 10.391 407 HZ PHE 66 HZ PHE 66 4.486 -0.815 9.935 408 H GLU 67 HN GLU 67 -1.294 -0.637 10.877 409 HA GLU 67 HA GLU 67 -1.161 -0.491 13.140 410 HB2 GLU 67 HB2 GLU 67 0.244 2.032 12.328 411 HB3 GLU 67 HB1 GLU 67 -0.062 1.697 14.025 412 HG2 GLU 67 HG2 GLU 67 1.157 -0.518 12.547 413 HG3 GLU 67 HG1 GLU 67 2.153 0.932 12.659 414 H GLY 68 HN GLY 68 -3.426 0.694 11.521 415 HA2 GLY 68 HA2 GLY 68 -5.545 1.283 12.356 416 HA3 GLY 68 HA1 GLY 68 -4.775 1.921 13.798 417 H GLN 69 HN GLN 69 -2.844 3.241 11.722 418 HA GLN 69 HA GLN 69 -4.452 5.677 11.503 419 HB2 GLN 69 HB2 GLN 69 -1.478 5.231 11.182 420 HB3 GLN 69 HB1 GLN 69 -2.279 6.791 11.071 421 HG2 GLN 69 HG2 GLN 69 -3.092 6.397 13.428 422 HG3 GLN 69 HG1 GLN 69 -1.982 5.028 13.483 423 HE21 GLN 69 HE21 GLN 69 -1.998 7.489 15.046 424 HE22 GLN 69 HE22 GLN 69 -0.451 8.224 14.792 425 H ARG 70 HN ARG 70 -4.395 6.931 9.526 426 HA ARG 70 HA ARG 70 -4.427 5.171 7.206 427 HB2 ARG 70 HB2 ARG 70 -5.534 7.077 6.047 428 HB3 ARG 70 HB1 ARG 70 -6.413 6.503 7.456 429 HG2 ARG 70 HG2 ARG 70 -5.512 8.385 8.756 430 HG3 ARG 70 HG1 ARG 70 -4.688 8.969 7.308 431 HD2 ARG 70 HD2 ARG 70 -7.670 8.579 7.553 432 HD3 ARG 70 HD1 ARG 70 -6.843 10.121 7.752 433 HE ARG 70 HE ARG 70 -6.073 9.778 5.379 434 HH11 ARG 70 HH11 ARG 70 -9.085 8.386 6.588 435 HH12 ARG 70 HH12 ARG 70 -9.848 8.348 4.952 436 HH21 ARG 70 HH21 ARG 70 -7.036 9.752 3.298 437 HH22 ARG 70 HH22 ARG 70 -8.734 9.129 3.133 438 H ILE 71 HN ILE 71 -2.863 5.117 5.782 439 HA ILE 71 HA ILE 71 -0.485 6.590 6.112 440 HB ILE 71 HB ILE 71 -1.466 4.940 3.782 441 HG12 ILE 71 HG12 ILE 71 -1.130 3.655 5.818 442 HG13 ILE 71 HG11 ILE 71 0.146 3.276 4.664 443 HG21 ILE 71 HG21 ILE 71 0.818 4.936 2.950 444 HG22 ILE 71 HG22 ILE 71 1.309 6.018 4.254 445 HG23 ILE 71 HG23 ILE 71 0.184 6.582 3.019 446 HD11 ILE 71 HD11 ILE 71 1.578 4.946 5.899 447 HD12 ILE 71 HD12 ILE 71 1.183 3.458 6.761 448 HD13 ILE 71 HD13 ILE 71 0.329 4.952 7.144 449 H ALA 72 HN ALA 72 -0.062 8.600 5.580 450 HA ALA 72 HA ALA 72 -1.853 10.108 3.896 451 HB1 ALA 72 HB1 ALA 72 -0.406 12.018 4.468 452 HB2 ALA 72 HB2 ALA 72 0.688 10.916 5.306 453 HB3 ALA 72 HB3 ALA 72 -0.958 11.148 5.897 454 H ASP 73 HN ASP 73 -0.890 11.559 2.189 455 HA ASP 73 HA ASP 73 0.486 9.914 0.287 456 HB2 ASP 73 HB2 ASP 73 -0.662 12.681 0.241 457 HB3 ASP 73 HB1 ASP 73 0.417 12.163 -1.050 458 H ASN 74 HN ASN 74 1.483 12.010 2.725 459 HA ASN 74 HA ASN 74 4.067 12.513 1.419 460 HB2 ASN 74 HB2 ASN 74 4.427 14.234 3.098 461 HB3 ASN 74 HB1 ASN 74 2.862 14.483 2.327 462 HD21 ASN 74 HD21 ASN 74 4.520 13.838 5.252 463 HD22 ASN 74 HD22 ASN 74 3.138 13.817 6.289 464 H HIS 75 HN HIS 75 2.885 10.076 2.984 465 HA HIS 75 HA HIS 75 4.780 9.822 5.157 466 HB2 HIS 75 HB2 HIS 75 2.509 8.179 4.117 467 HB3 HIS 75 HB1 HIS 75 3.717 7.415 5.142 468 HD2 HIS 75 HD2 HIS 75 3.526 10.736 6.642 469 HE1 HIS 75 HE1 HIS 75 0.301 8.612 8.376 470 HE2 HIS 75 HE2 HIS 75 1.852 10.600 8.623 471 H THR 76 HN THR 76 6.372 8.243 5.307 472 HA THR 76 HA THR 76 7.205 7.008 2.768 473 HB THR 76 HB THR 76 9.586 7.281 3.726 474 HG1 THR 76 HG1 THR 76 8.091 9.069 5.359 475 HG21 THR 76 HG21 THR 76 8.870 8.480 1.755 476 HG22 THR 76 HG22 THR 76 9.798 9.565 2.791 477 HG23 THR 76 HG23 THR 76 8.038 9.679 2.745 478 HA PRO 77 HA PRO 77 7.372 3.197 5.028 479 HB2 PRO 77 HB2 PRO 77 9.905 2.511 3.681 480 HB3 PRO 77 HB1 PRO 77 8.331 1.710 3.586 481 HG2 PRO 77 HG2 PRO 77 9.297 3.111 1.527 482 HG3 PRO 77 HG1 PRO 77 7.565 3.075 1.907 483 HD2 PRO 77 HD2 PRO 77 9.572 5.216 2.473 484 HD3 PRO 77 HD1 PRO 77 7.888 5.359 1.927 485 H LYS 78 HN LYS 78 9.957 5.429 5.065 486 HA LYS 78 HA LYS 78 11.675 4.117 6.912 487 HB2 LYS 78 HB2 LYS 78 12.611 5.806 5.499 488 HB3 LYS 78 HB1 LYS 78 11.422 6.989 6.014 489 HG2 LYS 78 HG2 LYS 78 13.500 7.532 7.041 490 HG3 LYS 78 HG1 LYS 78 12.422 6.912 8.293 491 HD2 LYS 78 HD2 LYS 78 14.589 5.952 8.628 492 HD3 LYS 78 HD1 LYS 78 13.517 4.686 8.031 493 HE2 LYS 78 HE2 LYS 78 14.495 4.704 5.903 494 HE3 LYS 78 HE1 LYS 78 15.258 6.272 6.170 495 HZ1 LYS 78 HZ1 LYS 78 16.835 4.423 6.292 496 HZ2 LYS 78 HZ2 LYS 78 15.978 3.764 7.590 497 HZ3 LYS 78 HZ3 LYS 78 16.741 5.264 7.758 498 H GLU 79 HN GLU 79 9.002 6.390 7.194 499 HA GLU 79 HA GLU 79 9.366 6.547 10.079 500 HB2 GLU 79 HB2 GLU 79 7.611 8.227 10.043 501 HB3 GLU 79 HB1 GLU 79 8.821 8.609 8.830 502 HG2 GLU 79 HG2 GLU 79 7.276 7.442 7.173 503 HG3 GLU 79 HG1 GLU 79 6.050 7.545 8.434 504 H LEU 80 HN LEU 80 7.149 6.446 11.308 505 HA LEU 80 HA LEU 80 5.381 5.240 12.066 506 HB2 LEU 80 HB2 LEU 80 5.315 4.055 9.287 507 HB3 LEU 80 HB1 LEU 80 4.098 3.791 10.523 508 HG LEU 80 HG LEU 80 4.684 6.610 9.801 509 HD11 LEU 80 HD11 LEU 80 3.167 6.488 7.866 510 HD12 LEU 80 HD12 LEU 80 3.171 4.728 7.992 511 HD13 LEU 80 HD13 LEU 80 4.662 5.590 7.610 512 HD21 LEU 80 HD21 LEU 80 2.141 5.076 10.340 513 HD22 LEU 80 HD22 LEU 80 2.273 6.820 10.125 514 HD23 LEU 80 HD23 LEU 80 3.034 6.045 11.512 515 H GLY 81 HN GLY 81 7.557 3.298 10.051 516 HA2 GLY 81 HA2 GLY 81 9.074 1.767 11.194 517 HA3 GLY 81 HA1 GLY 81 7.757 1.385 12.289 518 H MET 82 HN MET 82 8.159 1.491 8.742 519 HA MET 82 HA MET 82 6.556 -0.915 8.493 520 HB2 MET 82 HB2 MET 82 7.758 1.018 6.530 521 HB3 MET 82 HB1 MET 82 7.154 -0.544 5.990 522 HG2 MET 82 HG2 MET 82 4.960 -0.002 6.954 523 HG3 MET 82 HG1 MET 82 5.578 1.587 7.410 524 HE1 MET 82 HE1 MET 82 2.953 0.935 5.574 525 HE2 MET 82 HE2 MET 82 3.097 2.247 4.403 526 HE3 MET 82 HE3 MET 82 3.418 2.551 6.110 527 H GLU 83 HN GLU 83 7.321 -2.905 8.279 528 HA GLU 83 HA GLU 83 10.183 -3.225 7.644 529 HB2 GLU 83 HB2 GLU 83 8.735 -4.015 10.030 530 HB3 GLU 83 HB1 GLU 83 9.490 -5.396 9.247 531 HG2 GLU 83 HG2 GLU 83 10.956 -2.865 9.918 532 HG3 GLU 83 HG1 GLU 83 10.873 -4.259 10.991 533 H GLU 84 HN GLU 84 10.495 -5.811 7.406 534 HA GLU 84 HA GLU 84 9.029 -6.470 5.025 535 HB2 GLU 84 HB2 GLU 84 11.422 -7.023 5.326 536 HB3 GLU 84 HB1 GLU 84 10.996 -8.132 6.618 537 HG2 GLU 84 HG2 GLU 84 11.467 -9.178 4.395 538 HG3 GLU 84 HG1 GLU 84 9.922 -9.608 5.125 539 H GLU 85 HN GLU 85 7.599 -8.196 4.717 540 HA GLU 85 HA GLU 85 5.886 -9.599 5.211 541 HB2 GLU 85 HB2 GLU 85 7.725 -10.098 7.520 542 HB3 GLU 85 HB1 GLU 85 6.106 -10.778 7.557 543 HG2 GLU 85 HG2 GLU 85 8.071 -11.220 5.326 544 HG3 GLU 85 HG1 GLU 85 7.839 -12.317 6.687 545 H ASP 86 HN ASP 86 5.920 -6.748 6.047 546 HA ASP 86 HA ASP 86 4.400 -6.586 8.468 547 HB2 ASP 86 HB2 ASP 86 5.865 -4.779 7.031 548 HB3 ASP 86 HB1 ASP 86 4.220 -4.311 6.610 549 H VAL 87 HN VAL 87 2.249 -5.404 8.435 550 HA VAL 87 HA VAL 87 0.586 -6.460 6.246 551 HB VAL 87 HB VAL 87 -0.088 -6.436 9.193 552 HG11 VAL 87 HG11 VAL 87 -2.213 -7.437 8.583 553 HG12 VAL 87 HG12 VAL 87 -1.794 -7.333 6.875 554 HG13 VAL 87 HG13 VAL 87 -2.037 -5.860 7.814 555 HG21 VAL 87 HG21 VAL 87 0.282 -8.729 7.268 556 HG22 VAL 87 HG22 VAL 87 -0.209 -8.865 8.956 557 HG23 VAL 87 HG23 VAL 87 1.397 -8.260 8.550 558 H ILE 88 HN ILE 88 -0.675 -5.029 5.292 559 HA ILE 88 HA ILE 88 -1.453 -2.610 6.750 560 HB ILE 88 HB ILE 88 0.445 -1.971 5.348 561 HG12 ILE 88 HG12 ILE 88 -2.030 -0.906 3.998 562 HG13 ILE 88 HG11 ILE 88 -1.623 -0.487 5.661 563 HG21 ILE 88 HG21 ILE 88 0.360 -2.112 2.916 564 HG22 ILE 88 HG22 ILE 88 -1.178 -2.966 3.017 565 HG23 ILE 88 HG23 ILE 88 0.285 -3.712 3.656 566 HD11 ILE 88 HD11 ILE 88 0.602 0.306 4.775 567 HD12 ILE 88 HD12 ILE 88 -0.807 1.260 4.315 568 HD13 ILE 88 HD13 ILE 88 -0.085 0.139 3.161 569 H GLU 89 HN GLU 89 -3.569 -2.150 6.539 570 HA GLU 89 HA GLU 89 -5.150 -3.925 4.834 571 HB2 GLU 89 HB2 GLU 89 -6.038 -2.065 7.041 572 HB3 GLU 89 HB1 GLU 89 -7.045 -3.244 6.209 573 HG2 GLU 89 HG2 GLU 89 -5.742 -5.061 7.123 574 HG3 GLU 89 HG1 GLU 89 -4.628 -3.919 7.874 575 H VAL 90 HN VAL 90 -6.776 -3.162 3.458 576 HA VAL 90 HA VAL 90 -6.698 -0.290 2.848 577 HB VAL 90 HB VAL 90 -5.301 -1.402 1.180 578 HG11 VAL 90 HG11 VAL 90 -7.732 -3.046 0.492 579 HG12 VAL 90 HG12 VAL 90 -6.273 -3.640 1.280 580 HG13 VAL 90 HG13 VAL 90 -6.197 -3.045 -0.377 581 HG21 VAL 90 HG21 VAL 90 -7.956 -0.533 0.053 582 HG22 VAL 90 HG22 VAL 90 -6.441 -0.635 -0.846 583 HG23 VAL 90 HG23 VAL 90 -6.607 0.520 0.476 584 H TYR 91 HN TYR 91 -8.659 0.601 2.784 585 HA TYR 91 HA TYR 91 -10.984 -1.091 2.168 586 HB2 TYR 91 HB2 TYR 91 -10.774 0.804 4.521 587 HB3 TYR 91 HB1 TYR 91 -12.255 0.012 3.998 588 HD1 TYR 91 HD1 TYR 91 -12.474 -2.456 4.203 589 HD2 TYR 91 HD2 TYR 91 -9.149 -0.355 5.823 590 HE1 TYR 91 HE1 TYR 91 -11.938 -4.402 5.608 591 HE2 TYR 91 HE2 TYR 91 -8.604 -2.292 7.236 592 HH TYR 91 HH TYR 91 -9.185 -4.314 7.882 593 H GLN 92 HN GLN 92 -12.936 0.235 1.649 594 HA GLN 92 HA GLN 92 -12.152 2.406 -0.085 595 HB2 GLN 92 HB2 GLN 92 -13.879 0.673 -0.684 596 HB3 GLN 92 HB1 GLN 92 -14.947 1.420 0.498 597 HG2 GLN 92 HG2 GLN 92 -14.590 3.584 -0.816 598 HG3 GLN 92 HG1 GLN 92 -13.926 2.557 -2.082 599 HE21 GLN 92 HE21 GLN 92 -16.765 3.439 -0.290 600 HE22 GLN 92 HE22 GLN 92 -17.917 2.714 -1.362 601 H GLU 93 HN GLU 93 -12.611 4.539 0.123 602 HA GLU 93 HA GLU 93 -13.132 5.518 2.773 603 HB2 GLU 93 HB2 GLU 93 -12.591 6.835 0.119 604 HB3 GLU 93 HB1 GLU 93 -13.028 7.776 1.538 605 HG2 GLU 93 HG2 GLU 93 -10.855 5.860 1.969 606 HG3 GLU 93 HG1 GLU 93 -10.497 7.141 0.811 607 H GLN 94 HN GLN 94 -14.812 7.004 3.311 608 HA GLN 94 HA GLN 94 -17.375 6.115 2.643 609 HB2 GLN 94 HB2 GLN 94 -16.814 7.219 4.760 610 HB3 GLN 94 HB1 GLN 94 -16.534 8.728 3.907 611 HG2 GLN 94 HG2 GLN 94 -18.858 8.866 3.297 612 HG3 GLN 94 HG1 GLN 94 -19.171 7.285 4.008 613 HE21 GLN 94 HE21 GLN 94 -19.204 7.068 6.240 614 HE22 GLN 94 HE22 GLN 94 -19.360 8.431 7.293 615 H THR 95 HN THR 95 -15.437 8.727 1.311 616 HA THR 95 HA THR 95 -17.569 9.975 -0.098 617 HB THR 95 HB THR 95 -15.014 10.438 -1.335 618 HG1 THR 95 HG1 THR 95 -14.406 11.394 0.993 619 HG21 THR 95 HG21 THR 95 -16.905 12.023 -1.237 620 HG22 THR 95 HG22 THR 95 -15.420 12.720 -0.591 621 HG23 THR 95 HG23 THR 95 -16.680 12.160 0.507 622 H GLY 96 HN GLY 96 -15.509 7.259 -0.752 623 HA2 GLY 96 HA2 GLY 96 -15.947 5.644 -2.401 624 HA3 GLY 96 HA1 GLY 96 -16.947 6.812 -3.249 625 H GLY 97 HN GLY 97 -14.774 8.860 -3.043 626 HA2 GLY 97 HA2 GLY 97 -12.408 8.779 -3.905 627 HA3 GLY 97 HA1 GLY 97 -13.062 7.753 -5.176 628 H1 ASN 357 HT1 ASN 357 -3.612 -19.920 -4.578 629 H2 ASN 357 HT2 ASN 357 -4.711 -19.758 -3.301 630 H3 ASN 357 HT3 ASN 357 -3.350 -20.740 -3.120 631 HA ASN 357 HA ASN 357 -2.983 -18.733 -1.951 632 HB2 ASN 357 HB2 ASN 357 -0.967 -17.872 -3.121 633 HB3 ASN 357 HB1 ASN 357 -1.008 -19.628 -3.043 634 HD21 ASN 357 HD21 ASN 357 0.321 -17.669 -4.907 635 HD22 ASN 357 HD22 ASN 357 -0.152 -18.196 -6.488 636 H ASN 358 HN ASN 358 -3.732 -16.771 -1.606 637 HA ASN 358 HA ASN 358 -4.890 -15.295 -3.865 638 HB2 ASN 358 HB2 ASN 358 -6.032 -13.964 -2.022 639 HB3 ASN 358 HB1 ASN 358 -6.543 -15.634 -2.220 640 HD21 ASN 358 HD21 ASN 358 -7.346 -15.660 -0.123 641 HD22 ASN 358 HD22 ASN 358 -6.304 -15.779 1.253 642 H ARG 359 HN ARG 359 -2.035 -15.446 -2.877 643 HA ARG 359 HA ARG 359 -1.567 -12.649 -2.215 644 HB2 ARG 359 HB2 ARG 359 0.850 -13.465 -2.015 645 HB3 ARG 359 HB1 ARG 359 -0.300 -14.019 -0.808 646 HG2 ARG 359 HG2 ARG 359 -0.531 -16.141 -2.014 647 HG3 ARG 359 HG1 ARG 359 0.675 -15.589 -3.183 648 HD2 ARG 359 HD2 ARG 359 1.675 -17.038 -1.492 649 HD3 ARG 359 HD1 ARG 359 2.327 -15.403 -1.385 650 HE ARG 359 HE ARG 359 0.690 -15.086 0.497 651 HH11 ARG 359 HH11 ARG 359 2.043 -18.239 -0.315 652 HH12 ARG 359 HH12 ARG 359 1.683 -18.935 1.308 653 HH21 ARG 359 HH21 ARG 359 0.274 -15.912 2.572 654 HH22 ARG 359 HH22 ARG 359 0.751 -17.620 2.941 655 H ASP 360 HN ASP 360 -1.098 -11.235 -3.695 656 HA ASP 360 HA ASP 360 0.048 -12.151 -6.257 657 HB2 ASP 360 HB2 ASP 360 -2.232 -11.441 -6.649 658 HB3 ASP 360 HB1 ASP 360 -1.967 -9.950 -5.750 659 HA PRO 361 HA PRO 361 3.193 -9.291 -4.825 660 HB2 PRO 361 HB2 PRO 361 5.137 -10.093 -6.496 661 HB3 PRO 361 HB1 PRO 361 4.653 -11.049 -5.091 662 HG2 PRO 361 HG2 PRO 361 3.995 -11.464 -7.959 663 HG3 PRO 361 HG1 PRO 361 4.313 -12.658 -6.686 664 HD2 PRO 361 HD2 PRO 361 1.797 -11.929 -7.590 665 HD3 PRO 361 HD1 PRO 361 2.142 -12.716 -6.039 666 H ILE 362 HN ILE 362 3.138 -7.233 -5.373 667 HA ILE 362 HA ILE 362 3.082 -6.518 -8.225 668 HB ILE 362 HB ILE 362 2.121 -4.758 -5.979 669 HG12 ILE 362 HG12 ILE 362 0.386 -6.439 -7.805 670 HG13 ILE 362 HG11 ILE 362 0.794 -6.891 -6.152 671 HG21 ILE 362 HG21 ILE 362 1.659 -4.653 -8.961 672 HG22 ILE 362 HG22 ILE 362 2.754 -3.617 -8.045 673 HG23 ILE 362 HG23 ILE 362 1.013 -3.519 -7.773 674 HD11 ILE 362 HD11 ILE 362 -0.665 -4.385 -6.942 675 HD12 ILE 362 HD12 ILE 362 -0.321 -4.930 -5.302 676 HD13 ILE 362 HD13 ILE 362 -1.419 -5.856 -6.326 677 H VAL 363 HN VAL 363 4.843 -5.597 -8.970 678 HA VAL 363 HA VAL 363 6.590 -4.153 -7.091 679 HB VAL 363 HB VAL 363 7.515 -5.485 -9.638 680 HG11 VAL 363 HG11 VAL 363 8.975 -3.732 -8.862 681 HG12 VAL 363 HG12 VAL 363 9.741 -5.293 -8.565 682 HG13 VAL 363 HG13 VAL 363 8.988 -4.412 -7.235 683 HG21 VAL 363 HG21 VAL 363 6.655 -7.227 -8.175 684 HG22 VAL 363 HG22 VAL 363 7.618 -6.604 -6.837 685 HG23 VAL 363 HG23 VAL 363 8.415 -7.297 -8.248 686 H ILE 364 HN ILE 364 6.910 -2.042 -7.551 687 HA ILE 364 HA ILE 364 5.957 -1.073 -10.163 688 HB ILE 364 HB ILE 364 5.812 1.157 -9.133 689 HG12 ILE 364 HG12 ILE 364 5.981 0.238 -6.367 690 HG13 ILE 364 HG11 ILE 364 7.520 0.109 -7.216 691 HG21 ILE 364 HG21 ILE 364 4.352 -0.996 -7.619 692 HG22 ILE 364 HG22 ILE 364 3.856 -0.281 -9.153 693 HG23 ILE 364 HG23 ILE 364 3.882 0.702 -7.687 694 HD11 ILE 364 HD11 ILE 364 7.392 2.469 -7.806 695 HD12 ILE 364 HD12 ILE 364 7.306 2.235 -6.060 696 HD13 ILE 364 HD13 ILE 364 5.841 2.598 -6.975 697 H SER 365 HN SER 365 7.120 0.825 -11.048 698 HA SER 365 HA SER 365 9.987 0.338 -10.916 699 HB2 SER 365 HB2 SER 365 8.608 2.226 -12.814 700 HB3 SER 365 HB1 SER 365 10.132 1.366 -13.029 701 HG SER 365 HG SER 365 8.531 -0.561 -12.739 702 H ASP 366 HN ASP 366 11.273 1.585 -9.736 703 HA ASP 366 HA ASP 366 10.249 4.027 -8.555 704 HB2 ASP 366 HB2 ASP 366 11.463 2.684 -7.035 705 HB3 ASP 366 HB1 ASP 366 12.772 2.418 -8.179 706 H SER 367 HN SER 367 10.737 6.051 -9.166 707 HA SER 367 HA SER 367 12.977 6.477 -11.000 708 HB2 SER 367 HB2 SER 367 10.237 7.669 -11.476 709 HB3 SER 367 HB1 SER 367 11.647 7.772 -12.531 710 HG SER 367 HG SER 367 11.309 5.237 -12.219 711 HA PRO 368 HA PRO 368 13.566 9.773 -8.053 712 HB2 PRO 368 HB2 PRO 368 15.728 10.907 -9.224 713 HB3 PRO 368 HB1 PRO 368 15.822 9.385 -8.328 714 HG2 PRO 368 HG2 PRO 368 15.699 9.825 -11.275 715 HG3 PRO 368 HG1 PRO 368 16.684 8.678 -10.348 716 HD2 PRO 368 HD2 PRO 368 14.403 7.964 -11.636 717 HD3 PRO 368 HD1 PRO 368 14.988 7.154 -10.168 Start of MODEL 17 1 H TYR 21 HT1 TYR 21 14.712 -5.014 -0.434 2 HA TYR 21 HA TYR 21 13.092 -3.575 -1.416 3 HB2 TYR 21 HB2 TYR 21 12.379 -6.059 -2.977 4 HB3 TYR 21 HB1 TYR 21 11.293 -4.684 -2.830 5 HD1 TYR 21 HD1 TYR 21 12.331 -2.364 -3.544 6 HD2 TYR 21 HD2 TYR 21 13.829 -6.152 -4.769 7 HE1 TYR 21 HE1 TYR 21 13.413 -1.303 -5.484 8 HE2 TYR 21 HE2 TYR 21 14.917 -5.102 -6.706 9 HH TYR 21 HH TYR 21 14.703 -3.100 -8.079 10 H ILE 22 HN ILE 22 11.504 -3.191 0.026 11 HA ILE 22 HA ILE 22 10.840 -5.260 1.934 12 HB ILE 22 HB ILE 22 9.918 -2.386 1.746 13 HG12 ILE 22 HG12 ILE 22 12.352 -2.747 2.216 14 HG13 ILE 22 HG11 ILE 22 11.491 -1.919 3.509 15 HG21 ILE 22 HG21 ILE 22 8.266 -3.733 2.909 16 HG22 ILE 22 HG22 ILE 22 9.103 -2.667 4.038 17 HG23 ILE 22 HG23 ILE 22 9.518 -4.380 3.972 18 HD11 ILE 22 HD11 ILE 22 12.222 -4.840 3.481 19 HD12 ILE 22 HD12 ILE 22 11.402 -3.984 4.786 20 HD13 ILE 22 HD13 ILE 22 13.065 -3.570 4.368 21 H LYS 23 HN LYS 23 9.057 -6.491 1.907 22 HA LYS 23 HA LYS 23 6.997 -5.827 -0.088 23 HB2 LYS 23 HB2 LYS 23 8.133 -7.951 -0.461 24 HB3 LYS 23 HB1 LYS 23 7.733 -8.475 1.167 25 HG2 LYS 23 HG2 LYS 23 5.289 -8.166 0.448 26 HG3 LYS 23 HG1 LYS 23 5.931 -8.136 -1.197 27 HD2 LYS 23 HD2 LYS 23 5.335 -10.379 -0.780 28 HD3 LYS 23 HD1 LYS 23 7.091 -10.317 -0.640 29 HE2 LYS 23 HE2 LYS 23 5.465 -9.922 1.819 30 HE3 LYS 23 HE1 LYS 23 5.589 -11.550 1.157 31 HZ1 LYS 23 HZ1 LYS 23 7.353 -11.445 2.610 32 HZ2 LYS 23 HZ2 LYS 23 7.720 -9.827 2.251 33 HZ3 LYS 23 HZ3 LYS 23 8.098 -11.052 1.141 34 H LEU 24 HN LEU 24 5.097 -5.169 0.612 35 HA LEU 24 HA LEU 24 4.380 -5.630 3.426 36 HB2 LEU 24 HB2 LEU 24 3.236 -3.633 1.468 37 HB3 LEU 24 HB1 LEU 24 2.825 -3.760 3.167 38 HG LEU 24 HG LEU 24 5.547 -3.001 2.103 39 HD11 LEU 24 HD11 LEU 24 3.894 -1.279 1.644 40 HD12 LEU 24 HD12 LEU 24 5.006 -0.760 2.910 41 HD13 LEU 24 HD13 LEU 24 3.382 -1.304 3.331 42 HD21 LEU 24 HD21 LEU 24 5.695 -4.108 4.251 43 HD22 LEU 24 HD22 LEU 24 4.440 -3.055 4.905 44 HD23 LEU 24 HD23 LEU 24 6.001 -2.380 4.437 45 H LYS 25 HN LYS 25 2.408 -6.541 3.971 46 HA LYS 25 HA LYS 25 1.062 -7.955 1.772 47 HB2 LYS 25 HB2 LYS 25 0.862 -8.485 4.740 48 HB3 LYS 25 HB1 LYS 25 0.259 -9.505 3.442 49 HG2 LYS 25 HG2 LYS 25 2.260 -10.449 3.083 50 HG3 LYS 25 HG1 LYS 25 3.135 -8.933 3.317 51 HD2 LYS 25 HD2 LYS 25 3.821 -10.254 5.114 52 HD3 LYS 25 HD1 LYS 25 2.565 -9.229 5.808 53 HE2 LYS 25 HE2 LYS 25 2.009 -11.327 6.622 54 HE3 LYS 25 HE1 LYS 25 0.981 -11.182 5.198 55 HZ1 LYS 25 HZ1 LYS 25 2.230 -12.684 4.022 56 HZ2 LYS 25 HZ2 LYS 25 2.350 -13.325 5.587 57 HZ3 LYS 25 HZ3 LYS 25 3.637 -12.423 4.940 58 H VAL 26 HN VAL 26 -0.653 -6.899 1.034 59 HA VAL 26 HA VAL 26 -2.238 -5.240 2.841 60 HB VAL 26 HB VAL 26 -2.954 -5.615 -0.041 61 HG11 VAL 26 HG11 VAL 26 -3.722 -3.344 0.142 62 HG12 VAL 26 HG12 VAL 26 -2.991 -3.185 1.738 63 HG13 VAL 26 HG13 VAL 26 -4.354 -4.278 1.500 64 HG21 VAL 26 HG21 VAL 26 -0.701 -3.857 0.935 65 HG22 VAL 26 HG22 VAL 26 -1.394 -3.826 -0.688 66 HG23 VAL 26 HG23 VAL 26 -0.545 -5.264 -0.118 67 H ILE 27 HN ILE 27 -4.050 -5.932 3.735 68 HA ILE 27 HA ILE 27 -5.036 -8.577 3.057 69 HB ILE 27 HB ILE 27 -6.048 -6.720 5.212 70 HG12 ILE 27 HG12 ILE 27 -3.663 -7.144 5.562 71 HG13 ILE 27 HG11 ILE 27 -4.620 -7.999 6.766 72 HG21 ILE 27 HG21 ILE 27 -6.892 -8.788 6.233 73 HG22 ILE 27 HG22 ILE 27 -6.321 -9.699 4.836 74 HG23 ILE 27 HG23 ILE 27 -7.597 -8.497 4.643 75 HD11 ILE 27 HD11 ILE 27 -4.334 -10.076 5.530 76 HD12 ILE 27 HD12 ILE 27 -2.779 -9.361 5.952 77 HD13 ILE 27 HD13 ILE 27 -3.393 -9.224 4.306 78 H GLY 28 HN GLY 28 -6.450 -8.774 1.474 79 HA2 GLY 28 HA2 GLY 28 -8.233 -6.587 0.780 80 HA3 GLY 28 HA1 GLY 28 -8.058 -8.109 -0.085 81 H GLN 29 HN GLN 29 -10.520 -6.760 0.700 82 HA GLN 29 HA GLN 29 -11.692 -7.955 2.974 83 HB2 GLN 29 HB2 GLN 29 -12.583 -5.931 1.853 84 HB3 GLN 29 HB1 GLN 29 -13.078 -6.929 0.493 85 HG2 GLN 29 HG2 GLN 29 -14.987 -6.530 1.862 86 HG3 GLN 29 HG1 GLN 29 -14.528 -8.222 2.040 87 HE21 GLN 29 HE21 GLN 29 -13.531 -8.895 3.976 88 HE22 GLN 29 HE22 GLN 29 -13.669 -7.968 5.429 89 H ASP 30 HN ASP 30 -11.337 -8.998 -0.332 90 HA ASP 30 HA ASP 30 -13.184 -11.193 -0.085 91 HB2 ASP 30 HB2 ASP 30 -12.231 -11.894 -2.302 92 HB3 ASP 30 HB1 ASP 30 -12.896 -10.265 -2.282 93 H SER 31 HN SER 31 -10.465 -10.712 1.441 94 HA SER 31 HA SER 31 -9.034 -11.992 2.613 95 HB2 SER 31 HB2 SER 31 -10.531 -14.380 1.513 96 HB3 SER 31 HB1 SER 31 -9.465 -14.361 2.918 97 HG SER 31 HG SER 31 -11.702 -12.648 2.796 98 H SER 32 HN SER 32 -7.654 -11.047 0.861 99 HA SER 32 HA SER 32 -6.208 -13.233 -0.458 100 HB2 SER 32 HB2 SER 32 -5.720 -11.287 -2.218 101 HB3 SER 32 HB1 SER 32 -7.129 -12.336 -2.371 102 HG SER 32 HG SER 32 -8.376 -10.686 -2.032 103 H GLU 33 HN GLU 33 -3.940 -12.849 -0.723 104 HA GLU 33 HA GLU 33 -2.910 -10.851 1.188 105 HB2 GLU 33 HB2 GLU 33 -2.456 -13.341 1.546 106 HB3 GLU 33 HB1 GLU 33 -1.420 -13.252 0.128 107 HG2 GLU 33 HG2 GLU 33 -0.124 -11.461 1.289 108 HG3 GLU 33 HG1 GLU 33 -1.083 -11.784 2.732 109 H ILE 34 HN ILE 34 -2.740 -9.083 -0.150 110 HA ILE 34 HA ILE 34 -1.497 -9.303 -2.744 111 HB ILE 34 HB ILE 34 -1.993 -6.738 -1.247 112 HG12 ILE 34 HG12 ILE 34 -4.083 -8.049 -1.235 113 HG13 ILE 34 HG11 ILE 34 -4.216 -6.638 -2.279 114 HG21 ILE 34 HG21 ILE 34 -0.670 -6.437 -3.191 115 HG22 ILE 34 HG22 ILE 34 -2.297 -5.870 -3.569 116 HG23 ILE 34 HG23 ILE 34 -1.749 -7.441 -4.159 117 HD11 ILE 34 HD11 ILE 34 -5.257 -8.514 -3.344 118 HD12 ILE 34 HD12 ILE 34 -3.802 -9.487 -3.142 119 HD13 ILE 34 HD13 ILE 34 -3.787 -8.101 -4.229 120 H HIS 35 HN HIS 35 0.639 -9.457 -3.021 121 HA HIS 35 HA HIS 35 2.403 -8.595 -0.854 122 HB2 HIS 35 HB2 HIS 35 2.675 -10.462 -3.175 123 HB3 HIS 35 HB1 HIS 35 4.125 -9.758 -2.473 124 HD2 HIS 35 HD2 HIS 35 1.953 -10.251 0.443 125 HE1 HIS 35 HE1 HIS 35 3.918 -13.956 -0.099 126 HE2 HIS 35 HE2 HIS 35 2.379 -12.619 1.413 127 H PHE 36 HN PHE 36 2.133 -6.314 -1.295 128 HA PHE 36 HA PHE 36 3.054 -5.319 -3.851 129 HB2 PHE 36 HB2 PHE 36 1.262 -4.275 -2.212 130 HB3 PHE 36 HB1 PHE 36 2.679 -3.538 -1.474 131 HD1 PHE 36 HD1 PHE 36 3.993 -3.558 -4.452 132 HD2 PHE 36 HD2 PHE 36 0.505 -1.934 -2.633 133 HE1 PHE 36 HE1 PHE 36 3.936 -1.786 -6.155 134 HE2 PHE 36 HE2 PHE 36 0.443 -0.158 -4.335 135 HZ PHE 36 HZ PHE 36 2.159 -0.084 -6.100 136 H LYS 37 HN LYS 37 5.133 -5.215 -4.318 137 HA LYS 37 HA LYS 37 7.109 -5.157 -2.182 138 HB2 LYS 37 HB2 LYS 37 7.288 -6.671 -4.201 139 HB3 LYS 37 HB1 LYS 37 7.583 -5.230 -5.164 140 HG2 LYS 37 HG2 LYS 37 9.628 -4.799 -4.076 141 HG3 LYS 37 HG1 LYS 37 9.279 -5.961 -2.797 142 HD2 LYS 37 HD2 LYS 37 9.651 -6.696 -5.699 143 HD3 LYS 37 HD1 LYS 37 10.938 -6.756 -4.495 144 HE2 LYS 37 HE2 LYS 37 9.291 -8.252 -3.172 145 HE3 LYS 37 HE1 LYS 37 8.470 -8.440 -4.718 146 HZ1 LYS 37 HZ1 LYS 37 11.320 -9.091 -4.199 147 HZ2 LYS 37 HZ2 LYS 37 10.504 -9.301 -5.669 148 HZ3 LYS 37 HZ3 LYS 37 10.062 -10.215 -4.318 149 H VAL 38 HN VAL 38 7.628 -3.250 -1.359 150 HA VAL 38 HA VAL 38 7.532 -0.882 -3.091 151 HB VAL 38 HB VAL 38 7.413 0.475 -1.104 152 HG11 VAL 38 HG11 VAL 38 5.545 -1.884 -0.888 153 HG12 VAL 38 HG12 VAL 38 5.315 -0.460 -1.903 154 HG13 VAL 38 HG13 VAL 38 5.297 -0.303 -0.145 155 HG21 VAL 38 HG21 VAL 38 7.727 -2.084 0.471 156 HG22 VAL 38 HG22 VAL 38 7.375 -0.496 1.153 157 HG23 VAL 38 HG23 VAL 38 8.914 -0.786 0.342 158 H LYS 39 HN LYS 39 9.180 0.815 -2.599 159 HA LYS 39 HA LYS 39 11.821 -0.435 -2.252 160 HB2 LYS 39 HB2 LYS 39 11.207 0.493 -4.536 161 HB3 LYS 39 HB1 LYS 39 11.198 2.088 -3.798 162 HG2 LYS 39 HG2 LYS 39 13.552 1.816 -3.197 163 HG3 LYS 39 HG1 LYS 39 13.555 0.226 -3.957 164 HD2 LYS 39 HD2 LYS 39 13.059 1.212 -6.114 165 HD3 LYS 39 HD1 LYS 39 12.916 2.811 -5.381 166 HE2 LYS 39 HE2 LYS 39 15.277 2.698 -4.711 167 HE3 LYS 39 HE1 LYS 39 15.413 1.121 -5.485 168 HZ1 LYS 39 HZ1 LYS 39 15.103 2.066 -7.593 169 HZ2 LYS 39 HZ2 LYS 39 16.187 3.098 -6.807 170 HZ3 LYS 39 HZ3 LYS 39 14.561 3.542 -6.964 171 H MET 40 HN MET 40 12.905 0.183 -0.494 172 HA MET 40 HA MET 40 11.933 2.254 1.213 173 HB2 MET 40 HB2 MET 40 12.997 0.244 2.121 174 HB3 MET 40 HB1 MET 40 14.507 0.673 1.330 175 HG2 MET 40 HG2 MET 40 14.622 1.218 3.666 176 HG3 MET 40 HG1 MET 40 14.642 2.695 2.709 177 HE1 MET 40 HE1 MET 40 12.790 0.483 5.249 178 HE2 MET 40 HE2 MET 40 11.656 0.321 3.910 179 HE3 MET 40 HE3 MET 40 11.185 1.203 5.361 180 H THR 41 HN THR 41 11.997 4.043 -0.202 181 HA THR 41 HA THR 41 13.923 5.914 0.234 182 HB THR 41 HB THR 41 15.443 4.372 -1.097 183 HG1 THR 41 HG1 THR 41 15.350 6.939 -1.011 184 HG21 THR 41 HG21 THR 41 13.799 5.359 -3.429 185 HG22 THR 41 HG22 THR 41 13.792 3.710 -2.810 186 HG23 THR 41 HG23 THR 41 15.261 4.378 -3.520 187 H THR 42 HN THR 42 11.565 4.542 -1.901 188 HA THR 42 HA THR 42 10.883 7.107 -3.076 189 HB THR 42 HB THR 42 9.378 4.524 -3.475 190 HG1 THR 42 HG1 THR 42 11.229 5.053 -5.411 191 HG21 THR 42 HG21 THR 42 8.367 6.561 -4.388 192 HG22 THR 42 HG22 THR 42 8.914 5.495 -5.683 193 HG23 THR 42 HG23 THR 42 9.861 6.920 -5.256 194 H HIS 43 HN HIS 43 9.080 8.269 -2.580 195 HA HIS 43 HA HIS 43 7.904 7.925 -0.042 196 HB2 HIS 43 HB2 HIS 43 7.765 9.854 -2.216 197 HB3 HIS 43 HB1 HIS 43 6.192 9.596 -1.467 198 HD2 HIS 43 HD2 HIS 43 6.007 10.325 1.227 199 HE1 HIS 43 HE1 HIS 43 9.681 12.419 1.241 200 HE2 HIS 43 HE2 HIS 43 7.650 11.775 2.614 201 H LEU 44 HN LEU 44 5.781 7.376 0.529 202 HA LEU 44 HA LEU 44 4.714 5.169 -0.886 203 HB2 LEU 44 HB2 LEU 44 3.675 6.797 1.422 204 HB3 LEU 44 HB1 LEU 44 2.797 5.428 0.765 205 HG LEU 44 HG LEU 44 5.621 5.204 1.796 206 HD11 LEU 44 HD11 LEU 44 3.061 4.632 3.280 207 HD12 LEU 44 HD12 LEU 44 4.148 5.987 3.591 208 HD13 LEU 44 HD13 LEU 44 4.698 4.333 3.861 209 HD21 LEU 44 HD21 LEU 44 5.000 2.808 1.964 210 HD22 LEU 44 HD22 LEU 44 4.979 3.419 0.310 211 HD23 LEU 44 HD23 LEU 44 3.465 3.185 1.183 212 H LYS 45 HN LYS 45 4.433 8.425 -1.471 213 HA LYS 45 HA LYS 45 1.814 8.863 -2.248 214 HB2 LYS 45 HB2 LYS 45 3.342 10.699 -2.221 215 HB3 LYS 45 HB1 LYS 45 4.431 9.898 -3.345 216 HG2 LYS 45 HG2 LYS 45 3.386 11.529 -4.629 217 HG3 LYS 45 HG1 LYS 45 2.503 10.053 -5.026 218 HD2 LYS 45 HD2 LYS 45 0.876 10.755 -3.178 219 HD3 LYS 45 HD1 LYS 45 1.655 12.335 -3.268 220 HE2 LYS 45 HE2 LYS 45 1.091 12.475 -5.645 221 HE3 LYS 45 HE1 LYS 45 0.318 10.891 -5.556 222 HZ1 LYS 45 HZ1 LYS 45 -1.421 12.386 -5.341 223 HZ2 LYS 45 HZ2 LYS 45 -0.549 13.433 -4.351 224 HZ3 LYS 45 HZ3 LYS 45 -1.099 11.952 -3.731 225 H LYS 46 HN LYS 46 4.516 7.636 -4.206 226 HA LYS 46 HA LYS 46 2.940 7.196 -6.526 227 HB2 LYS 46 HB2 LYS 46 5.503 7.479 -6.316 228 HB3 LYS 46 HB1 LYS 46 5.515 5.760 -5.948 229 HG2 LYS 46 HG2 LYS 46 5.972 6.035 -8.272 230 HG3 LYS 46 HG1 LYS 46 4.353 5.348 -8.108 231 HD2 LYS 46 HD2 LYS 46 3.431 7.654 -8.345 232 HD3 LYS 46 HD1 LYS 46 5.066 8.225 -8.682 233 HE2 LYS 46 HE2 LYS 46 5.177 7.031 -10.699 234 HE3 LYS 46 HE1 LYS 46 3.797 6.020 -10.275 235 HZ1 LYS 46 HZ1 LYS 46 3.724 8.910 -10.933 236 HZ2 LYS 46 HZ2 LYS 46 2.386 8.012 -10.408 237 HZ3 LYS 46 HZ3 LYS 46 3.132 7.641 -11.886 238 H LEU 47 HN LEU 47 3.787 5.244 -3.753 239 HA LEU 47 HA LEU 47 3.027 2.737 -4.839 240 HB2 LEU 47 HB2 LEU 47 3.451 3.774 -2.057 241 HB3 LEU 47 HB1 LEU 47 2.740 2.193 -2.297 242 HG LEU 47 HG LEU 47 5.059 1.866 -1.905 243 HD11 LEU 47 HD11 LEU 47 5.786 0.729 -3.887 244 HD12 LEU 47 HD12 LEU 47 4.662 1.653 -4.882 245 HD13 LEU 47 HD13 LEU 47 4.048 0.501 -3.696 246 HD21 LEU 47 HD21 LEU 47 5.583 3.876 -4.089 247 HD22 LEU 47 HD22 LEU 47 6.811 2.917 -3.261 248 HD23 LEU 47 HD23 LEU 47 5.866 4.105 -2.363 249 H LYS 48 HN LYS 48 1.311 5.171 -2.939 250 HA LYS 48 HA LYS 48 -1.060 3.733 -2.528 251 HB2 LYS 48 HB2 LYS 48 -0.520 6.697 -2.678 252 HB3 LYS 48 HB1 LYS 48 -2.100 6.037 -2.279 253 HG2 LYS 48 HG2 LYS 48 -1.153 4.919 -0.328 254 HG3 LYS 48 HG1 LYS 48 0.443 5.549 -0.740 255 HD2 LYS 48 HD2 LYS 48 -0.438 6.969 0.951 256 HD3 LYS 48 HD1 LYS 48 -0.541 7.863 -0.566 257 HE2 LYS 48 HE2 LYS 48 -2.900 7.281 -0.759 258 HE3 LYS 48 HE1 LYS 48 -2.805 6.346 0.731 259 HZ1 LYS 48 HZ1 LYS 48 -2.297 8.362 1.937 260 HZ2 LYS 48 HZ2 LYS 48 -3.744 8.551 1.084 261 HZ3 LYS 48 HZ3 LYS 48 -2.325 9.273 0.504 262 H GLU 49 HN GLU 49 -0.182 6.001 -5.135 263 HA GLU 49 HA GLU 49 -2.710 5.767 -6.422 264 HB2 GLU 49 HB2 GLU 49 -1.467 6.793 -8.397 265 HB3 GLU 49 HB1 GLU 49 -1.571 7.742 -6.924 266 HG2 GLU 49 HG2 GLU 49 0.697 7.178 -6.347 267 HG3 GLU 49 HG1 GLU 49 0.810 6.098 -7.736 268 H SER 50 HN SER 50 0.365 4.073 -6.775 269 HA SER 50 HA SER 50 -0.257 2.723 -9.170 270 HB2 SER 50 HB2 SER 50 1.561 1.878 -6.900 271 HB3 SER 50 HB1 SER 50 1.505 1.105 -8.484 272 HG SER 50 HG SER 50 2.348 3.727 -7.818 273 H TYR 51 HN TYR 51 -1.012 2.037 -5.801 274 HA TYR 51 HA TYR 51 -1.996 -0.589 -6.207 275 HB2 TYR 51 HB2 TYR 51 -1.406 0.499 -3.972 276 HB3 TYR 51 HB1 TYR 51 -2.961 1.318 -4.074 277 HD1 TYR 51 HD1 TYR 51 -1.347 -2.003 -3.870 278 HD2 TYR 51 HD2 TYR 51 -4.970 0.197 -3.508 279 HE1 TYR 51 HE1 TYR 51 -2.438 -3.971 -2.885 280 HE2 TYR 51 HE2 TYR 51 -6.070 -1.768 -2.521 281 HH TYR 51 HH TYR 51 -5.740 -4.286 -2.572 282 H CYS 52 HN CYS 52 -3.418 2.612 -6.429 283 HA CYS 52 HA CYS 52 -6.116 1.807 -6.667 284 HB2 CYS 52 HB2 CYS 52 -4.815 4.285 -7.829 285 HB3 CYS 52 HB1 CYS 52 -6.528 4.057 -7.501 286 HG CYS 52 HG CYS 52 -4.144 4.069 -5.040 287 H GLN 53 HN GLN 53 -3.479 2.156 -8.951 288 HA GLN 53 HA GLN 53 -5.025 1.875 -11.321 289 HB2 GLN 53 HB2 GLN 53 -2.102 1.223 -10.881 290 HB3 GLN 53 HB1 GLN 53 -2.884 1.476 -12.434 291 HG2 GLN 53 HG2 GLN 53 -3.234 3.785 -11.966 292 HG3 GLN 53 HG1 GLN 53 -2.705 3.578 -10.297 293 HE21 GLN 53 HE21 GLN 53 -1.684 5.369 -12.311 294 HE22 GLN 53 HE22 GLN 53 -0.008 4.989 -12.507 295 H ARG 54 HN ARG 54 -3.347 -0.357 -9.184 296 HA ARG 54 HA ARG 54 -3.612 -2.676 -10.763 297 HB2 ARG 54 HB2 ARG 54 -2.056 -2.515 -8.876 298 HB3 ARG 54 HB1 ARG 54 -3.407 -2.403 -7.760 299 HG2 ARG 54 HG2 ARG 54 -2.534 -4.623 -7.682 300 HG3 ARG 54 HG1 ARG 54 -4.112 -4.677 -8.465 301 HD2 ARG 54 HD2 ARG 54 -3.243 -5.290 -10.468 302 HD3 ARG 54 HD1 ARG 54 -1.786 -4.324 -10.246 303 HE ARG 54 HE ARG 54 -2.008 -6.706 -8.596 304 HH11 ARG 54 HH11 ARG 54 -0.789 -5.243 -11.559 305 HH12 ARG 54 HH12 ARG 54 0.551 -6.436 -11.736 306 HH21 ARG 54 HH21 ARG 54 -0.330 -8.253 -8.776 307 HH22 ARG 54 HH22 ARG 54 0.791 -8.135 -10.196 308 H GLN 55 HN GLN 55 -5.701 -1.204 -8.326 309 HA GLN 55 HA GLN 55 -7.617 -3.350 -8.437 310 HB2 GLN 55 HB2 GLN 55 -7.832 -0.599 -7.196 311 HB3 GLN 55 HB1 GLN 55 -8.992 -1.903 -6.980 312 HG2 GLN 55 HG2 GLN 55 -6.184 -1.706 -5.959 313 HG3 GLN 55 HG1 GLN 55 -7.677 -1.926 -5.049 314 HE21 GLN 55 HE21 GLN 55 -8.694 -3.975 -5.089 315 HE22 GLN 55 HE22 GLN 55 -7.807 -5.404 -5.479 316 H GLY 56 HN GLY 56 -7.144 -0.273 -9.995 317 HA2 GLY 56 HA2 GLY 56 -8.087 0.342 -12.051 318 HA3 GLY 56 HA1 GLY 56 -9.313 -0.901 -11.841 319 H VAL 57 HN VAL 57 -8.401 1.633 -9.551 320 HA VAL 57 HA VAL 57 -10.984 2.948 -10.017 321 HB VAL 57 HB VAL 57 -11.049 3.284 -7.448 322 HG11 VAL 57 HG11 VAL 57 -12.333 1.197 -7.154 323 HG12 VAL 57 HG12 VAL 57 -11.701 0.617 -8.695 324 HG13 VAL 57 HG13 VAL 57 -12.741 2.041 -8.649 325 HG21 VAL 57 HG21 VAL 57 -9.314 0.826 -7.629 326 HG22 VAL 57 HG22 VAL 57 -10.128 1.387 -6.168 327 HG23 VAL 57 HG23 VAL 57 -8.873 2.378 -6.916 328 HA PRO 58 HA PRO 58 -8.705 6.715 -9.724 329 HB2 PRO 58 HB2 PRO 58 -10.431 8.353 -8.386 330 HB3 PRO 58 HB1 PRO 58 -10.628 7.909 -10.087 331 HG2 PRO 58 HG2 PRO 58 -11.995 6.794 -7.685 332 HG3 PRO 58 HG1 PRO 58 -12.655 7.159 -9.291 333 HD2 PRO 58 HD2 PRO 58 -12.027 4.647 -8.523 334 HD3 PRO 58 HD1 PRO 58 -11.889 5.196 -10.204 335 H MET 59 HN MET 59 -7.735 8.270 -8.193 336 HA MET 59 HA MET 59 -6.868 6.897 -5.828 337 HB2 MET 59 HB2 MET 59 -5.530 8.519 -7.381 338 HB3 MET 59 HB1 MET 59 -6.245 9.778 -6.382 339 HG2 MET 59 HG2 MET 59 -5.251 8.804 -4.398 340 HG3 MET 59 HG1 MET 59 -4.586 7.482 -5.357 341 HE1 MET 59 HE1 MET 59 -2.810 9.099 -3.404 342 HE2 MET 59 HE2 MET 59 -1.386 9.490 -4.371 343 HE3 MET 59 HE3 MET 59 -2.115 7.885 -4.478 344 H ASN 60 HN ASN 60 -7.004 7.716 -3.682 345 HA ASN 60 HA ASN 60 -7.950 8.673 -1.856 346 HB2 ASN 60 HB2 ASN 60 -8.033 10.767 -3.463 347 HB3 ASN 60 HB1 ASN 60 -9.762 10.440 -3.456 348 HD21 ASN 60 HD21 ASN 60 -10.958 10.959 -1.689 349 HD22 ASN 60 HD22 ASN 60 -10.305 11.741 -0.285 350 H SER 61 HN SER 61 -9.424 6.761 -4.008 351 HA SER 61 HA SER 61 -12.106 6.851 -2.931 352 HB2 SER 61 HB2 SER 61 -12.482 4.869 -4.393 353 HB3 SER 61 HB1 SER 61 -11.803 6.237 -5.275 354 HG SER 61 HG SER 61 -10.041 5.134 -5.645 355 H LEU 62 HN LEU 62 -9.140 5.155 -2.409 356 HA LEU 62 HA LEU 62 -10.425 3.521 -0.327 357 HB2 LEU 62 HB2 LEU 62 -7.914 2.800 -1.834 358 HB3 LEU 62 HB1 LEU 62 -8.814 1.787 -0.720 359 HG LEU 62 HG LEU 62 -9.933 2.739 -3.356 360 HD11 LEU 62 HD11 LEU 62 -9.416 0.478 -4.188 361 HD12 LEU 62 HD12 LEU 62 -8.522 0.154 -2.701 362 HD13 LEU 62 HD13 LEU 62 -7.967 1.409 -3.811 363 HD21 LEU 62 HD21 LEU 62 -11.666 2.098 -1.859 364 HD22 LEU 62 HD22 LEU 62 -10.783 0.659 -1.350 365 HD23 LEU 62 HD23 LEU 62 -11.437 0.760 -2.985 366 H ARG 63 HN ARG 63 -9.461 3.455 1.660 367 HA ARG 63 HA ARG 63 -7.237 5.337 2.053 368 HB2 ARG 63 HB2 ARG 63 -7.966 5.469 4.403 369 HB3 ARG 63 HB1 ARG 63 -9.246 5.942 3.296 370 HG2 ARG 63 HG2 ARG 63 -10.357 3.837 3.596 371 HG3 ARG 63 HG1 ARG 63 -9.020 3.225 4.570 372 HD2 ARG 63 HD2 ARG 63 -9.482 4.807 6.312 373 HD3 ARG 63 HD1 ARG 63 -10.676 5.631 5.312 374 HE ARG 63 HE ARG 63 -11.010 3.099 6.715 375 HH11 ARG 63 HH11 ARG 63 -13.968 4.853 4.572 376 HH12 ARG 63 HH12 ARG 63 -12.306 5.565 4.550 377 HH21 ARG 63 HH21 ARG 63 -13.119 2.221 6.821 378 HH22 ARG 63 HH22 ARG 63 -14.430 3.005 5.866 379 H PHE 64 HN PHE 64 -5.351 4.637 2.808 380 HA PHE 64 HA PHE 64 -5.031 1.775 3.266 381 HB2 PHE 64 HB2 PHE 64 -2.982 3.980 2.927 382 HB3 PHE 64 HB1 PHE 64 -2.605 2.269 3.100 383 HD1 PHE 64 HD1 PHE 64 -4.162 4.788 0.911 384 HD2 PHE 64 HD2 PHE 64 -2.779 0.781 1.269 385 HE1 PHE 64 HE1 PHE 64 -4.372 4.508 -1.521 386 HE2 PHE 64 HE2 PHE 64 -2.985 0.490 -1.166 387 HZ PHE 64 HZ PHE 64 -3.782 2.355 -2.564 388 H LEU 65 HN LEU 65 -5.103 1.042 5.276 389 HA LEU 65 HA LEU 65 -4.616 2.915 7.480 390 HB2 LEU 65 HB2 LEU 65 -5.908 0.197 7.540 391 HB3 LEU 65 HB1 LEU 65 -5.835 1.342 8.864 392 HG LEU 65 HG LEU 65 -7.204 2.030 6.280 393 HD11 LEU 65 HD11 LEU 65 -9.294 1.292 7.213 394 HD12 LEU 65 HD12 LEU 65 -8.490 0.772 8.695 395 HD13 LEU 65 HD13 LEU 65 -8.166 -0.062 7.177 396 HD21 LEU 65 HD21 LEU 65 -7.480 3.033 9.110 397 HD22 LEU 65 HD22 LEU 65 -8.424 3.591 7.729 398 HD23 LEU 65 HD23 LEU 65 -6.684 3.870 7.779 399 H PHE 66 HN PHE 66 -2.971 2.729 8.791 400 HA PHE 66 HA PHE 66 -1.517 0.218 9.058 401 HB2 PHE 66 HB2 PHE 66 -0.475 1.528 7.166 402 HB3 PHE 66 HB1 PHE 66 -0.096 2.788 8.334 403 HD1 PHE 66 HD1 PHE 66 0.438 -0.825 7.660 404 HD2 PHE 66 HD2 PHE 66 1.901 2.720 9.501 405 HE1 PHE 66 HE1 PHE 66 2.542 -1.981 8.202 406 HE2 PHE 66 HE2 PHE 66 4.007 1.573 10.048 407 HZ PHE 66 HZ PHE 66 4.329 -0.781 9.395 408 H GLU 67 HN GLU 67 -1.212 -0.100 11.156 409 HA GLU 67 HA GLU 67 -0.935 0.219 13.385 410 HB2 GLU 67 HB2 GLU 67 0.224 2.845 12.448 411 HB3 GLU 67 HB1 GLU 67 0.237 2.324 14.127 412 HG2 GLU 67 HG2 GLU 67 1.379 0.551 12.024 413 HG3 GLU 67 HG1 GLU 67 2.310 1.927 12.615 414 H GLY 68 HN GLY 68 -3.395 1.110 11.950 415 HA2 GLY 68 HA2 GLY 68 -5.454 1.700 12.943 416 HA3 GLY 68 HA1 GLY 68 -4.576 2.538 14.213 417 H GLN 69 HN GLN 69 -2.901 3.842 12.058 418 HA GLN 69 HA GLN 69 -4.755 6.047 11.549 419 HB2 GLN 69 HB2 GLN 69 -1.742 5.925 11.285 420 HB3 GLN 69 HB1 GLN 69 -2.731 7.366 11.078 421 HG2 GLN 69 HG2 GLN 69 -3.443 7.183 13.425 422 HG3 GLN 69 HG1 GLN 69 -2.391 5.781 13.612 423 HE21 GLN 69 HE21 GLN 69 -2.372 8.375 14.970 424 HE22 GLN 69 HE22 GLN 69 -0.787 9.020 14.722 425 H ARG 70 HN ARG 70 -4.141 7.242 9.371 426 HA ARG 70 HA ARG 70 -4.146 5.167 7.298 427 HB2 ARG 70 HB2 ARG 70 -5.222 7.049 5.894 428 HB3 ARG 70 HB1 ARG 70 -6.205 6.219 7.089 429 HG2 ARG 70 HG2 ARG 70 -5.631 8.128 8.665 430 HG3 ARG 70 HG1 ARG 70 -5.025 8.972 7.238 431 HD2 ARG 70 HD2 ARG 70 -7.798 7.822 7.459 432 HD3 ARG 70 HD1 ARG 70 -7.402 9.493 7.848 433 HE ARG 70 HE ARG 70 -6.485 9.408 5.393 434 HH11 ARG 70 HH11 ARG 70 -9.440 7.959 6.668 435 HH12 ARG 70 HH12 ARG 70 -10.326 8.127 5.100 436 HH21 ARG 70 HH21 ARG 70 -7.595 9.647 3.407 437 HH22 ARG 70 HH22 ARG 70 -9.320 9.091 3.309 438 H ILE 71 HN ILE 71 -2.717 5.194 5.722 439 HA ILE 71 HA ILE 71 -0.316 6.632 6.000 440 HB ILE 71 HB ILE 71 -1.395 5.029 3.679 441 HG12 ILE 71 HG12 ILE 71 -1.019 3.732 5.717 442 HG13 ILE 71 HG11 ILE 71 0.165 3.303 4.487 443 HG21 ILE 71 HG21 ILE 71 0.846 5.004 2.766 444 HG22 ILE 71 HG22 ILE 71 1.421 6.019 4.089 445 HG23 ILE 71 HG23 ILE 71 0.274 6.665 2.915 446 HD11 ILE 71 HD11 ILE 71 1.779 4.825 5.625 447 HD12 ILE 71 HD12 ILE 71 1.281 3.431 6.583 448 HD13 ILE 71 HD13 ILE 71 0.594 5.020 6.917 449 H ALA 72 HN ALA 72 0.183 8.607 5.442 450 HA ALA 72 HA ALA 72 -1.607 10.192 3.812 451 HB1 ALA 72 HB1 ALA 72 0.100 12.001 4.316 452 HB2 ALA 72 HB2 ALA 72 0.908 10.814 5.340 453 HB3 ALA 72 HB3 ALA 72 -0.744 11.314 5.704 454 H ASP 73 HN ASP 73 -0.716 11.544 2.042 455 HA ASP 73 HA ASP 73 0.629 9.886 0.146 456 HB2 ASP 73 HB2 ASP 73 -0.469 12.675 0.116 457 HB3 ASP 73 HB1 ASP 73 0.594 12.150 -1.186 458 H ASN 74 HN ASN 74 1.638 12.106 2.502 459 HA ASN 74 HA ASN 74 4.254 12.497 1.233 460 HB2 ASN 74 HB2 ASN 74 4.599 14.233 2.963 461 HB3 ASN 74 HB1 ASN 74 3.156 14.536 2.001 462 HD21 ASN 74 HD21 ASN 74 4.402 13.818 5.126 463 HD22 ASN 74 HD22 ASN 74 2.905 13.922 5.982 464 H HIS 75 HN HIS 75 3.175 10.039 2.683 465 HA HIS 75 HA HIS 75 5.003 9.891 4.950 466 HB2 HIS 75 HB2 HIS 75 2.637 8.334 4.048 467 HB3 HIS 75 HB1 HIS 75 3.874 7.463 4.947 468 HD2 HIS 75 HD2 HIS 75 4.200 10.549 6.701 469 HE1 HIS 75 HE1 HIS 75 0.689 8.880 8.372 470 HE2 HIS 75 HE2 HIS 75 2.607 10.495 8.743 471 H THR 76 HN THR 76 6.599 8.339 5.160 472 HA THR 76 HA THR 76 7.421 6.976 2.676 473 HB THR 76 HB THR 76 9.691 7.501 4.340 474 HG1 THR 76 HG1 THR 76 8.176 9.320 4.961 475 HG21 THR 76 HG21 THR 76 9.690 7.105 1.899 476 HG22 THR 76 HG22 THR 76 10.547 8.580 2.342 477 HG23 THR 76 HG23 THR 76 8.922 8.678 1.667 478 HA PRO 77 HA PRO 77 7.422 3.266 5.132 479 HB2 PRO 77 HB2 PRO 77 9.814 2.388 3.632 480 HB3 PRO 77 HB1 PRO 77 8.211 1.647 3.725 481 HG2 PRO 77 HG2 PRO 77 9.019 2.883 1.507 482 HG3 PRO 77 HG1 PRO 77 7.334 2.971 2.058 483 HD2 PRO 77 HD2 PRO 77 9.502 5.013 2.292 484 HD3 PRO 77 HD1 PRO 77 7.783 5.227 1.907 485 H LYS 78 HN LYS 78 10.040 5.412 5.068 486 HA LYS 78 HA LYS 78 11.783 3.979 6.829 487 HB2 LYS 78 HB2 LYS 78 12.637 5.636 5.223 488 HB3 LYS 78 HB1 LYS 78 11.737 6.902 6.045 489 HG2 LYS 78 HG2 LYS 78 14.036 7.033 6.688 490 HG3 LYS 78 HG1 LYS 78 13.088 6.492 8.072 491 HD2 LYS 78 HD2 LYS 78 15.012 5.138 8.059 492 HD3 LYS 78 HD1 LYS 78 13.727 4.128 7.397 493 HE2 LYS 78 HE2 LYS 78 14.517 4.580 5.138 494 HE3 LYS 78 HE1 LYS 78 15.764 5.651 5.776 495 HZ1 LYS 78 HZ1 LYS 78 16.830 3.628 5.387 496 HZ2 LYS 78 HZ2 LYS 78 15.564 2.714 6.042 497 HZ3 LYS 78 HZ3 LYS 78 16.553 3.632 7.058 498 H GLU 79 HN GLU 79 9.040 6.039 7.194 499 HA GLU 79 HA GLU 79 9.624 6.399 10.051 500 HB2 GLU 79 HB2 GLU 79 8.030 8.201 10.051 501 HB3 GLU 79 HB1 GLU 79 9.124 8.441 8.697 502 HG2 GLU 79 HG2 GLU 79 7.301 7.225 7.324 503 HG3 GLU 79 HG1 GLU 79 6.253 7.626 8.681 504 H LEU 80 HN LEU 80 7.406 6.503 11.323 505 HA LEU 80 HA LEU 80 5.583 5.452 12.162 506 HB2 LEU 80 HB2 LEU 80 5.403 4.214 9.420 507 HB3 LEU 80 HB1 LEU 80 4.219 3.960 10.687 508 HG LEU 80 HG LEU 80 4.861 6.746 9.800 509 HD11 LEU 80 HD11 LEU 80 3.054 6.586 8.148 510 HD12 LEU 80 HD12 LEU 80 2.966 4.848 8.430 511 HD13 LEU 80 HD13 LEU 80 4.425 5.556 7.736 512 HD21 LEU 80 HD21 LEU 80 2.401 5.400 10.904 513 HD22 LEU 80 HD22 LEU 80 2.506 7.096 10.434 514 HD23 LEU 80 HD23 LEU 80 3.485 6.490 11.769 515 H GLY 81 HN GLY 81 7.478 3.184 10.177 516 HA2 GLY 81 HA2 GLY 81 8.879 1.612 11.510 517 HA3 GLY 81 HA1 GLY 81 7.442 1.335 12.486 518 H MET 82 HN MET 82 8.455 1.254 9.076 519 HA MET 82 HA MET 82 6.613 -0.975 8.638 520 HB2 MET 82 HB2 MET 82 8.030 0.919 6.780 521 HB3 MET 82 HB1 MET 82 7.317 -0.576 6.191 522 HG2 MET 82 HG2 MET 82 5.145 0.156 7.167 523 HG3 MET 82 HG1 MET 82 5.898 1.708 7.533 524 HE1 MET 82 HE1 MET 82 3.745 2.695 6.149 525 HE2 MET 82 HE2 MET 82 3.237 1.061 5.726 526 HE3 MET 82 HE3 MET 82 3.428 2.280 4.464 527 H GLU 83 HN GLU 83 7.279 -2.971 8.449 528 HA GLU 83 HA GLU 83 10.144 -3.492 7.952 529 HB2 GLU 83 HB2 GLU 83 8.270 -4.648 9.990 530 HB3 GLU 83 HB1 GLU 83 9.623 -5.603 9.402 531 HG2 GLU 83 HG2 GLU 83 9.994 -2.847 10.519 532 HG3 GLU 83 HG1 GLU 83 9.955 -4.280 11.548 533 H GLU 84 HN GLU 84 10.418 -5.921 7.404 534 HA GLU 84 HA GLU 84 8.962 -6.446 5.022 535 HB2 GLU 84 HB2 GLU 84 11.310 -7.111 5.337 536 HB3 GLU 84 HB1 GLU 84 10.835 -8.210 6.622 537 HG2 GLU 84 HG2 GLU 84 11.313 -9.296 4.447 538 HG3 GLU 84 HG1 GLU 84 9.714 -9.637 5.100 539 H GLU 85 HN GLU 85 7.331 -7.891 4.637 540 HA GLU 85 HA GLU 85 5.521 -9.200 5.010 541 HB2 GLU 85 HB2 GLU 85 7.062 -10.082 7.453 542 HB3 GLU 85 HB1 GLU 85 5.590 -10.843 6.869 543 HG2 GLU 85 HG2 GLU 85 8.004 -10.595 5.120 544 HG3 GLU 85 HG1 GLU 85 7.854 -11.902 6.290 545 H ASP 86 HN ASP 86 5.543 -6.497 5.954 546 HA ASP 86 HA ASP 86 4.170 -6.470 8.493 547 HB2 ASP 86 HB2 ASP 86 5.544 -4.551 6.947 548 HB3 ASP 86 HB1 ASP 86 3.874 -4.000 7.048 549 H VAL 87 HN VAL 87 2.016 -5.687 8.805 550 HA VAL 87 HA VAL 87 0.248 -6.515 6.610 551 HB VAL 87 HB VAL 87 -0.361 -6.214 9.559 552 HG11 VAL 87 HG11 VAL 87 -2.473 -7.334 9.047 553 HG12 VAL 87 HG12 VAL 87 -2.060 -7.339 7.333 554 HG13 VAL 87 HG13 VAL 87 -2.328 -5.810 8.171 555 HG21 VAL 87 HG21 VAL 87 0.056 -8.690 7.885 556 HG22 VAL 87 HG22 VAL 87 -0.456 -8.664 9.573 557 HG23 VAL 87 HG23 VAL 87 1.145 -8.074 9.128 558 H ILE 88 HN ILE 88 -0.939 -5.085 5.566 559 HA ILE 88 HA ILE 88 -1.613 -2.543 6.870 560 HB ILE 88 HB ILE 88 0.244 -2.040 5.383 561 HG12 ILE 88 HG12 ILE 88 -2.259 -1.125 3.971 562 HG13 ILE 88 HG11 ILE 88 -1.777 -0.494 5.541 563 HG21 ILE 88 HG21 ILE 88 0.137 -2.438 2.979 564 HG22 ILE 88 HG22 ILE 88 -1.408 -3.265 3.181 565 HG23 ILE 88 HG23 ILE 88 0.059 -3.951 3.882 566 HD11 ILE 88 HD11 ILE 88 0.296 0.339 4.584 567 HD12 ILE 88 HD12 ILE 88 -1.103 0.975 3.721 568 HD13 ILE 88 HD13 ILE 88 -0.152 -0.329 3.015 569 H GLU 89 HN GLU 89 -3.673 -1.772 6.411 570 HA GLU 89 HA GLU 89 -5.367 -3.654 4.903 571 HB2 GLU 89 HB2 GLU 89 -6.249 -1.723 7.048 572 HB3 GLU 89 HB1 GLU 89 -7.208 -2.993 6.304 573 HG2 GLU 89 HG2 GLU 89 -5.800 -4.687 7.315 574 HG3 GLU 89 HG1 GLU 89 -4.773 -3.437 8.017 575 H VAL 90 HN VAL 90 -7.138 -2.795 3.686 576 HA VAL 90 HA VAL 90 -6.993 0.046 3.037 577 HB VAL 90 HB VAL 90 -5.578 -0.983 1.350 578 HG11 VAL 90 HG11 VAL 90 -7.939 -2.739 0.689 579 HG12 VAL 90 HG12 VAL 90 -6.425 -3.263 1.429 580 HG13 VAL 90 HG13 VAL 90 -6.435 -2.650 -0.225 581 HG21 VAL 90 HG21 VAL 90 -8.273 -0.205 0.246 582 HG22 VAL 90 HG22 VAL 90 -6.772 -0.269 -0.677 583 HG23 VAL 90 HG23 VAL 90 -6.946 0.885 0.645 584 H TYR 91 HN TYR 91 -8.955 0.907 3.060 585 HA TYR 91 HA TYR 91 -11.257 -0.793 2.389 586 HB2 TYR 91 HB2 TYR 91 -10.861 0.892 4.844 587 HB3 TYR 91 HB1 TYR 91 -12.481 0.619 4.217 588 HD1 TYR 91 HD1 TYR 91 -13.476 -1.619 4.275 589 HD2 TYR 91 HD2 TYR 91 -9.606 -0.894 5.887 590 HE1 TYR 91 HE1 TYR 91 -13.571 -3.772 5.457 591 HE2 TYR 91 HE2 TYR 91 -9.689 -3.044 7.073 592 HH TYR 91 HH TYR 91 -11.613 -4.582 7.952 593 H GLN 92 HN GLN 92 -13.184 0.460 1.787 594 HA GLN 92 HA GLN 92 -12.451 2.589 0.006 595 HB2 GLN 92 HB2 GLN 92 -14.141 0.761 -0.457 596 HB3 GLN 92 HB1 GLN 92 -15.228 1.602 0.639 597 HG2 GLN 92 HG2 GLN 92 -14.546 3.619 -1.015 598 HG3 GLN 92 HG1 GLN 92 -14.442 2.244 -2.117 599 HE21 GLN 92 HE21 GLN 92 -16.499 4.292 -0.288 600 HE22 GLN 92 HE22 GLN 92 -18.008 3.637 -0.834 601 H GLU 93 HN GLU 93 -12.870 4.709 0.157 602 HA GLU 93 HA GLU 93 -13.529 5.801 2.736 603 HB2 GLU 93 HB2 GLU 93 -12.887 7.018 0.048 604 HB3 GLU 93 HB1 GLU 93 -13.342 7.998 1.437 605 HG2 GLU 93 HG2 GLU 93 -11.095 6.040 1.629 606 HG3 GLU 93 HG1 GLU 93 -10.849 7.636 0.916 607 H GLN 94 HN GLN 94 -15.324 7.270 3.131 608 HA GLN 94 HA GLN 94 -17.757 6.330 1.958 609 HB2 GLN 94 HB2 GLN 94 -17.413 7.126 4.357 610 HB3 GLN 94 HB1 GLN 94 -17.482 8.762 3.718 611 HG2 GLN 94 HG2 GLN 94 -19.721 8.578 3.140 612 HG3 GLN 94 HG1 GLN 94 -19.677 6.816 3.143 613 HE21 GLN 94 HE21 GLN 94 -21.467 6.702 4.500 614 HE22 GLN 94 HE22 GLN 94 -21.361 7.076 6.185 615 H THR 95 HN THR 95 -15.523 8.728 1.094 616 HA THR 95 HA THR 95 -17.377 10.494 -0.208 617 HB THR 95 HB THR 95 -15.269 11.430 -1.264 618 HG1 THR 95 HG1 THR 95 -13.440 10.394 -0.968 619 HG21 THR 95 HG21 THR 95 -16.248 12.408 0.752 620 HG22 THR 95 HG22 THR 95 -14.487 12.464 0.825 621 HG23 THR 95 HG23 THR 95 -15.367 11.250 1.752 622 H GLY 96 HN GLY 96 -15.424 7.723 -1.070 623 HA2 GLY 96 HA2 GLY 96 -15.763 6.297 -2.886 624 HA3 GLY 96 HA1 GLY 96 -16.849 7.487 -3.591 625 H GLY 97 HN GLY 97 -14.174 9.125 -2.645 626 HA2 GLY 97 HA2 GLY 97 -12.097 8.601 -4.308 627 HA3 GLY 97 HA1 GLY 97 -13.246 9.443 -5.341 628 H1 ASN 357 HT1 ASN 357 -5.292 -20.377 -2.922 629 H2 ASN 357 HT2 ASN 357 -4.103 -21.520 -2.557 630 H3 ASN 357 HT3 ASN 357 -4.219 -20.891 -4.123 631 HA ASN 357 HA ASN 357 -3.384 -19.480 -1.667 632 HB2 ASN 357 HB2 ASN 357 -1.292 -19.102 -2.880 633 HB3 ASN 357 HB1 ASN 357 -1.635 -20.826 -2.785 634 HD21 ASN 357 HD21 ASN 357 0.052 -19.360 -4.652 635 HD22 ASN 357 HD22 ASN 357 -0.557 -19.724 -6.229 636 H ASN 358 HN ASN 358 -3.111 -17.241 -1.802 637 HA ASN 358 HA ASN 358 -4.110 -15.886 -4.182 638 HB2 ASN 358 HB2 ASN 358 -5.513 -14.407 -2.565 639 HB3 ASN 358 HB1 ASN 358 -6.164 -15.953 -3.098 640 HD21 ASN 358 HD21 ASN 358 -7.473 -16.314 -1.380 641 HD22 ASN 358 HD22 ASN 358 -6.906 -16.572 0.234 642 H ARG 359 HN ARG 359 -1.763 -15.490 -4.167 643 HA ARG 359 HA ARG 359 -1.235 -12.979 -2.796 644 HB2 ARG 359 HB2 ARG 359 1.125 -13.829 -2.280 645 HB3 ARG 359 HB1 ARG 359 -0.179 -14.382 -1.241 646 HG2 ARG 359 HG2 ARG 359 -0.209 -16.520 -2.281 647 HG3 ARG 359 HG1 ARG 359 0.875 -15.975 -3.561 648 HD2 ARG 359 HD2 ARG 359 1.949 -17.372 -1.769 649 HD3 ARG 359 HD1 ARG 359 2.702 -15.806 -2.062 650 HE ARG 359 HE ARG 359 0.844 -15.477 -0.007 651 HH11 ARG 359 HH11 ARG 359 3.853 -17.204 -0.623 652 HH12 ARG 359 HH12 ARG 359 4.388 -17.123 1.101 653 HH21 ARG 359 HH21 ARG 359 1.486 -15.323 2.168 654 HH22 ARG 359 HH22 ARG 359 3.065 -16.058 2.657 655 H ASP 360 HN ASP 360 -0.260 -11.544 -4.116 656 HA ASP 360 HA ASP 360 1.291 -12.558 -6.363 657 HB2 ASP 360 HB2 ASP 360 0.210 -11.168 -7.984 658 HB3 ASP 360 HB1 ASP 360 -1.023 -12.109 -7.160 659 HA PRO 361 HA PRO 361 3.940 -9.332 -4.801 660 HB2 PRO 361 HB2 PRO 361 5.894 -10.154 -6.769 661 HB3 PRO 361 HB1 PRO 361 5.922 -10.405 -5.021 662 HG2 PRO 361 HG2 PRO 361 5.635 -12.427 -6.828 663 HG3 PRO 361 HG1 PRO 361 5.028 -12.493 -5.162 664 HD2 PRO 361 HD2 PRO 361 3.543 -11.929 -7.690 665 HD3 PRO 361 HD1 PRO 361 3.049 -12.871 -6.267 666 H ILE 362 HN ILE 362 3.449 -7.318 -5.435 667 HA ILE 362 HA ILE 362 3.400 -6.696 -8.300 668 HB ILE 362 HB ILE 362 2.524 -4.837 -6.102 669 HG12 ILE 362 HG12 ILE 362 0.808 -6.869 -7.549 670 HG13 ILE 362 HG11 ILE 362 1.309 -6.988 -5.866 671 HG21 ILE 362 HG21 ILE 362 1.787 -5.058 -9.017 672 HG22 ILE 362 HG22 ILE 362 2.855 -3.852 -8.299 673 HG23 ILE 362 HG23 ILE 362 1.142 -3.871 -7.881 674 HD11 ILE 362 HD11 ILE 362 -0.414 -4.813 -7.029 675 HD12 ILE 362 HD12 ILE 362 0.061 -4.974 -5.339 676 HD13 ILE 362 HD13 ILE 362 -0.980 -6.188 -6.080 677 H VAL 363 HN VAL 363 5.114 -5.780 -9.189 678 HA VAL 363 HA VAL 363 6.856 -4.108 -7.493 679 HB VAL 363 HB VAL 363 7.691 -5.624 -9.971 680 HG11 VAL 363 HG11 VAL 363 9.059 -3.679 -9.522 681 HG12 VAL 363 HG12 VAL 363 9.968 -5.149 -9.183 682 HG13 VAL 363 HG13 VAL 363 9.299 -4.202 -7.855 683 HG21 VAL 363 HG21 VAL 363 8.049 -6.373 -7.075 684 HG22 VAL 363 HG22 VAL 363 8.875 -7.153 -8.422 685 HG23 VAL 363 HG23 VAL 363 7.120 -7.249 -8.292 686 H ILE 364 HN ILE 364 6.988 -2.018 -8.093 687 HA ILE 364 HA ILE 364 5.942 -1.294 -10.747 688 HB ILE 364 HB ILE 364 5.555 0.963 -9.842 689 HG12 ILE 364 HG12 ILE 364 6.074 -0.119 -7.087 690 HG13 ILE 364 HG11 ILE 364 7.373 0.620 -8.017 691 HG21 ILE 364 HG21 ILE 364 3.666 0.362 -8.358 692 HG22 ILE 364 HG22 ILE 364 4.280 -1.291 -8.302 693 HG23 ILE 364 HG23 ILE 364 3.731 -0.607 -9.832 694 HD11 ILE 364 HD11 ILE 364 4.783 1.939 -7.227 695 HD12 ILE 364 HD12 ILE 364 6.065 2.681 -8.186 696 HD13 ILE 364 HD13 ILE 364 6.369 2.227 -6.510 697 H SER 365 HN SER 365 6.898 1.059 -11.328 698 HA SER 365 HA SER 365 9.801 0.653 -11.420 699 HB2 SER 365 HB2 SER 365 8.390 2.638 -13.150 700 HB3 SER 365 HB1 SER 365 9.804 1.645 -13.508 701 HG SER 365 HG SER 365 8.239 -0.181 -13.378 702 H ASP 366 HN ASP 366 11.169 2.082 -10.540 703 HA ASP 366 HA ASP 366 10.037 4.488 -9.284 704 HB2 ASP 366 HB2 ASP 366 11.058 3.057 -7.655 705 HB3 ASP 366 HB1 ASP 366 12.483 2.822 -8.658 706 H SER 367 HN SER 367 10.317 6.250 -10.510 707 HA SER 367 HA SER 367 12.960 6.898 -11.501 708 HB2 SER 367 HB2 SER 367 10.601 6.666 -13.386 709 HB3 SER 367 HB1 SER 367 12.180 7.328 -13.809 710 HG SER 367 HG SER 367 12.486 4.916 -12.676 711 HA PRO 368 HA PRO 368 11.495 10.877 -10.140 712 HB2 PRO 368 HB2 PRO 368 13.614 12.010 -11.837 713 HB3 PRO 368 HB1 PRO 368 13.410 12.110 -10.084 714 HG2 PRO 368 HG2 PRO 368 15.344 10.621 -11.184 715 HG3 PRO 368 HG1 PRO 368 14.520 10.144 -9.687 716 HD2 PRO 368 HD2 PRO 368 14.134 9.113 -12.461 717 HD3 PRO 368 HD1 PRO 368 14.126 8.242 -10.914 Start of MODEL 18 1 H TYR 21 HT1 TYR 21 14.770 -4.121 0.219 2 HA TYR 21 HA TYR 21 12.988 -3.028 -0.938 3 HB2 TYR 21 HB2 TYR 21 12.333 -5.829 -1.873 4 HB3 TYR 21 HB1 TYR 21 11.241 -4.458 -2.029 5 HD1 TYR 21 HD1 TYR 21 12.432 -2.330 -3.199 6 HD2 TYR 21 HD2 TYR 21 13.542 -6.401 -3.738 7 HE1 TYR 21 HE1 TYR 21 13.447 -1.760 -5.363 8 HE2 TYR 21 HE2 TYR 21 14.564 -5.842 -5.902 9 HH TYR 21 HH TYR 21 14.018 -3.670 -7.685 10 H ILE 22 HN ILE 22 10.618 -3.213 -0.249 11 HA ILE 22 HA ILE 22 10.425 -4.692 2.299 12 HB ILE 22 HB ILE 22 9.177 -2.002 1.707 13 HG12 ILE 22 HG12 ILE 22 11.659 -1.892 1.940 14 HG13 ILE 22 HG11 ILE 22 10.797 -1.013 3.196 15 HG21 ILE 22 HG21 ILE 22 7.886 -3.366 3.260 16 HG22 ILE 22 HG22 ILE 22 8.610 -1.985 4.084 17 HG23 ILE 22 HG23 ILE 22 9.318 -3.590 4.267 18 HD11 ILE 22 HD11 ILE 22 12.667 -2.204 4.141 19 HD12 ILE 22 HD12 ILE 22 12.075 -3.725 3.472 20 HD13 ILE 22 HD13 ILE 22 11.159 -2.898 4.733 21 H LYS 23 HN LYS 23 8.991 -6.299 1.998 22 HA LYS 23 HA LYS 23 6.858 -5.954 0.036 23 HB2 LYS 23 HB2 LYS 23 8.268 -8.017 0.107 24 HB3 LYS 23 HB1 LYS 23 7.562 -8.389 1.672 25 HG2 LYS 23 HG2 LYS 23 5.309 -8.316 0.503 26 HG3 LYS 23 HG1 LYS 23 6.220 -8.337 -1.008 27 HD2 LYS 23 HD2 LYS 23 5.744 -10.591 -0.612 28 HD3 LYS 23 HD1 LYS 23 7.402 -10.402 -0.041 29 HE2 LYS 23 HE2 LYS 23 5.241 -9.952 1.933 30 HE3 LYS 23 HE1 LYS 23 5.488 -11.609 1.389 31 HZ1 LYS 23 HZ1 LYS 23 6.817 -11.318 3.287 32 HZ2 LYS 23 HZ2 LYS 23 7.439 -9.829 2.750 33 HZ3 LYS 23 HZ3 LYS 23 7.891 -11.265 1.979 34 H LEU 24 HN LEU 24 5.163 -4.861 0.787 35 HA LEU 24 HA LEU 24 4.239 -5.269 3.528 36 HB2 LEU 24 HB2 LEU 24 3.262 -3.361 1.401 37 HB3 LEU 24 HB1 LEU 24 2.739 -3.383 3.072 38 HG LEU 24 HG LEU 24 5.565 -2.787 2.185 39 HD11 LEU 24 HD11 LEU 24 4.043 -1.054 1.414 40 HD12 LEU 24 HD12 LEU 24 5.039 -0.461 2.743 41 HD13 LEU 24 HD13 LEU 24 3.360 -0.913 3.033 42 HD21 LEU 24 HD21 LEU 24 5.449 -3.687 4.436 43 HD22 LEU 24 HD22 LEU 24 4.187 -2.529 4.858 44 HD23 LEU 24 HD23 LEU 24 5.817 -1.965 4.490 45 H LYS 25 HN LYS 25 2.528 -6.493 4.013 46 HA LYS 25 HA LYS 25 1.094 -7.775 1.818 47 HB2 LYS 25 HB2 LYS 25 0.845 -8.362 4.771 48 HB3 LYS 25 HB1 LYS 25 0.362 -9.390 3.428 49 HG2 LYS 25 HG2 LYS 25 2.616 -9.850 2.852 50 HG3 LYS 25 HG1 LYS 25 3.218 -8.596 3.936 51 HD2 LYS 25 HD2 LYS 25 3.598 -10.579 5.108 52 HD3 LYS 25 HD1 LYS 25 2.100 -9.961 5.805 53 HE2 LYS 25 HE2 LYS 25 0.791 -11.492 4.519 54 HE3 LYS 25 HE1 LYS 25 2.199 -11.992 3.584 55 HZ1 LYS 25 HZ1 LYS 25 1.963 -13.676 5.120 56 HZ2 LYS 25 HZ2 LYS 25 1.511 -12.640 6.377 57 HZ3 LYS 25 HZ3 LYS 25 3.128 -12.696 5.864 58 H VAL 26 HN VAL 26 -0.519 -6.548 1.074 59 HA VAL 26 HA VAL 26 -2.161 -5.006 2.925 60 HB VAL 26 HB VAL 26 -2.663 -5.165 -0.030 61 HG11 VAL 26 HG11 VAL 26 -3.451 -2.877 0.292 62 HG12 VAL 26 HG12 VAL 26 -2.993 -2.953 1.993 63 HG13 VAL 26 HG13 VAL 26 -4.279 -3.992 1.380 64 HG21 VAL 26 HG21 VAL 26 -0.609 -3.397 1.293 65 HG22 VAL 26 HG22 VAL 26 -1.101 -3.331 -0.401 66 HG23 VAL 26 HG23 VAL 26 -0.261 -4.752 0.221 67 H ILE 27 HN ILE 27 -4.029 -5.724 3.696 68 HA ILE 27 HA ILE 27 -5.063 -8.269 2.774 69 HB ILE 27 HB ILE 27 -6.081 -6.473 4.981 70 HG12 ILE 27 HG12 ILE 27 -3.808 -7.247 5.434 71 HG13 ILE 27 HG11 ILE 27 -4.953 -8.058 6.499 72 HG21 ILE 27 HG21 ILE 27 -7.248 -8.507 5.762 73 HG22 ILE 27 HG22 ILE 27 -6.729 -9.337 4.294 74 HG23 ILE 27 HG23 ILE 27 -7.814 -7.951 4.185 75 HD11 ILE 27 HD11 ILE 27 -4.886 -10.018 4.988 76 HD12 ILE 27 HD12 ILE 27 -3.336 -9.641 5.738 77 HD13 ILE 27 HD13 ILE 27 -3.628 -9.205 4.055 78 H GLY 28 HN GLY 28 -6.447 -8.396 1.168 79 HA2 GLY 28 HA2 GLY 28 -8.000 -6.085 0.348 80 HA3 GLY 28 HA1 GLY 28 -7.898 -7.629 -0.486 81 H GLN 29 HN GLN 29 -10.297 -6.228 -0.084 82 HA GLN 29 HA GLN 29 -11.757 -7.090 2.163 83 HB2 GLN 29 HB2 GLN 29 -12.335 -5.202 0.594 84 HB3 GLN 29 HB1 GLN 29 -12.907 -6.416 -0.541 85 HG2 GLN 29 HG2 GLN 29 -14.740 -5.441 0.722 86 HG3 GLN 29 HG1 GLN 29 -14.569 -7.161 1.067 87 HE21 GLN 29 HE21 GLN 29 -13.947 -7.815 3.097 88 HE22 GLN 29 HE22 GLN 29 -13.907 -6.741 4.454 89 H ASP 30 HN ASP 30 -11.046 -8.647 -0.869 90 HA ASP 30 HA ASP 30 -13.030 -10.738 -0.409 91 HB2 ASP 30 HB2 ASP 30 -12.334 -11.605 -2.592 92 HB3 ASP 30 HB1 ASP 30 -12.710 -9.889 -2.701 93 H SER 31 HN SER 31 -10.704 -10.335 1.380 94 HA SER 31 HA SER 31 -9.238 -11.587 2.574 95 HB2 SER 31 HB2 SER 31 -10.340 -14.014 1.143 96 HB3 SER 31 HB1 SER 31 -9.600 -13.945 2.743 97 HG SER 31 HG SER 31 -11.392 -12.825 3.497 98 H SER 32 HN SER 32 -8.332 -10.412 0.244 99 HA SER 32 HA SER 32 -6.543 -12.365 -0.993 100 HB2 SER 32 HB2 SER 32 -6.045 -10.170 -2.395 101 HB3 SER 32 HB1 SER 32 -7.482 -11.142 -2.716 102 HG SER 32 HG SER 32 -8.570 -9.401 -2.292 103 H GLU 33 HN GLU 33 -4.292 -11.992 -1.084 104 HA GLU 33 HA GLU 33 -3.292 -10.118 0.953 105 HB2 GLU 33 HB2 GLU 33 -2.609 -12.941 0.359 106 HB3 GLU 33 HB1 GLU 33 -1.273 -11.876 0.765 107 HG2 GLU 33 HG2 GLU 33 -2.606 -11.240 2.829 108 HG3 GLU 33 HG1 GLU 33 -3.643 -12.615 2.449 109 H ILE 34 HN ILE 34 -2.953 -8.447 -0.462 110 HA ILE 34 HA ILE 34 -1.431 -8.855 -2.889 111 HB ILE 34 HB ILE 34 -2.201 -6.231 -1.606 112 HG12 ILE 34 HG12 ILE 34 -4.215 -7.583 -1.958 113 HG13 ILE 34 HG11 ILE 34 -4.167 -6.236 -3.090 114 HG21 ILE 34 HG21 ILE 34 -0.482 -6.040 -3.303 115 HG22 ILE 34 HG22 ILE 34 -1.999 -5.355 -3.891 116 HG23 ILE 34 HG23 ILE 34 -1.478 -6.946 -4.442 117 HD11 ILE 34 HD11 ILE 34 -4.936 -8.241 -4.189 118 HD12 ILE 34 HD12 ILE 34 -3.477 -9.102 -3.697 119 HD13 ILE 34 HD13 ILE 34 -3.369 -7.762 -4.838 120 H HIS 35 HN HIS 35 0.660 -9.351 -2.581 121 HA HIS 35 HA HIS 35 2.127 -8.118 -0.391 122 HB2 HIS 35 HB2 HIS 35 2.822 -10.271 -2.388 123 HB3 HIS 35 HB1 HIS 35 4.012 -9.598 -1.282 124 HD2 HIS 35 HD2 HIS 35 0.620 -10.017 0.383 125 HE1 HIS 35 HE1 HIS 35 2.930 -13.425 1.348 126 HE2 HIS 35 HE2 HIS 35 0.711 -12.247 1.715 127 H PHE 36 HN PHE 36 1.955 -5.971 -1.252 128 HA PHE 36 HA PHE 36 3.226 -5.295 -3.732 129 HB2 PHE 36 HB2 PHE 36 1.466 -4.031 -1.960 130 HB3 PHE 36 HB1 PHE 36 2.942 -3.075 -1.892 131 HD1 PHE 36 HD1 PHE 36 0.188 -4.209 -4.007 132 HD2 PHE 36 HD2 PHE 36 3.714 -1.837 -3.816 133 HE1 PHE 36 HE1 PHE 36 -0.453 -3.099 -6.105 134 HE2 PHE 36 HE2 PHE 36 3.079 -0.723 -5.916 135 HZ PHE 36 HZ PHE 36 0.994 -1.353 -7.061 136 H LYS 37 HN LYS 37 5.348 -5.233 -4.033 137 HA LYS 37 HA LYS 37 7.097 -4.979 -1.709 138 HB2 LYS 37 HB2 LYS 37 7.255 -6.549 -3.961 139 HB3 LYS 37 HB1 LYS 37 8.368 -5.242 -4.335 140 HG2 LYS 37 HG2 LYS 37 9.585 -5.664 -2.274 141 HG3 LYS 37 HG1 LYS 37 8.453 -6.954 -1.863 142 HD2 LYS 37 HD2 LYS 37 10.092 -6.948 -4.389 143 HD3 LYS 37 HD1 LYS 37 10.648 -7.682 -2.885 144 HE2 LYS 37 HE2 LYS 37 8.476 -9.016 -2.923 145 HE3 LYS 37 HE1 LYS 37 8.292 -8.462 -4.587 146 HZ1 LYS 37 HZ1 LYS 37 10.387 -9.490 -5.144 147 HZ2 LYS 37 HZ2 LYS 37 9.353 -10.638 -4.458 148 HZ3 LYS 37 HZ3 LYS 37 10.616 -9.984 -3.544 149 H VAL 38 HN VAL 38 7.367 -2.946 -1.101 150 HA VAL 38 HA VAL 38 7.529 -0.832 -3.100 151 HB VAL 38 HB VAL 38 7.329 0.742 -1.317 152 HG11 VAL 38 HG11 VAL 38 5.532 -1.594 -0.677 153 HG12 VAL 38 HG12 VAL 38 5.282 -0.461 -2.004 154 HG13 VAL 38 HG13 VAL 38 5.216 0.109 -0.336 155 HG21 VAL 38 HG21 VAL 38 7.597 -1.537 0.639 156 HG22 VAL 38 HG22 VAL 38 7.389 0.171 1.024 157 HG23 VAL 38 HG23 VAL 38 8.876 -0.384 0.256 158 H LYS 39 HN LYS 39 9.185 0.858 -2.832 159 HA LYS 39 HA LYS 39 11.807 -0.379 -2.364 160 HB2 LYS 39 HB2 LYS 39 11.139 0.544 -4.659 161 HB3 LYS 39 HB1 LYS 39 11.258 2.139 -3.932 162 HG2 LYS 39 HG2 LYS 39 13.593 1.781 -3.445 163 HG3 LYS 39 HG1 LYS 39 13.495 0.133 -4.072 164 HD2 LYS 39 HD2 LYS 39 13.024 0.946 -6.284 165 HD3 LYS 39 HD1 LYS 39 12.895 2.604 -5.696 166 HE2 LYS 39 HE2 LYS 39 15.277 2.485 -5.016 167 HE3 LYS 39 HE1 LYS 39 15.372 0.891 -5.760 168 HZ1 LYS 39 HZ1 LYS 39 16.172 2.734 -7.185 169 HZ2 LYS 39 HZ2 LYS 39 14.596 3.359 -7.223 170 HZ3 LYS 39 HZ3 LYS 39 14.926 1.830 -7.881 171 H MET 40 HN MET 40 13.041 0.347 -0.738 172 HA MET 40 HA MET 40 12.045 2.404 0.996 173 HB2 MET 40 HB2 MET 40 13.160 0.448 1.931 174 HB3 MET 40 HB1 MET 40 14.632 0.837 1.054 175 HG2 MET 40 HG2 MET 40 14.862 1.459 3.365 176 HG3 MET 40 HG1 MET 40 14.851 2.903 2.355 177 HE1 MET 40 HE1 MET 40 13.206 0.936 5.212 178 HE2 MET 40 HE2 MET 40 12.068 0.545 3.923 179 HE3 MET 40 HE3 MET 40 11.558 1.562 5.270 180 H THR 41 HN THR 41 12.042 4.220 -0.377 181 HA THR 41 HA THR 41 14.064 6.040 -0.063 182 HB THR 41 HB THR 41 15.412 4.498 -1.530 183 HG1 THR 41 HG1 THR 41 15.251 7.120 -1.556 184 HG21 THR 41 HG21 THR 41 14.983 4.397 -3.897 185 HG22 THR 41 HG22 THR 41 13.604 5.484 -3.739 186 HG23 THR 41 HG23 THR 41 13.532 3.865 -3.046 187 H THR 42 HN THR 42 11.441 4.828 -1.994 188 HA THR 42 HA THR 42 10.795 7.509 -2.975 189 HB THR 42 HB THR 42 9.172 5.091 -3.656 190 HG1 THR 42 HG1 THR 42 11.154 5.367 -5.450 191 HG21 THR 42 HG21 THR 42 8.531 7.307 -4.514 192 HG22 THR 42 HG22 THR 42 9.002 6.219 -5.820 193 HG23 THR 42 HG23 THR 42 10.117 7.468 -5.268 194 H HIS 43 HN HIS 43 8.762 8.453 -2.599 195 HA HIS 43 HA HIS 43 7.631 7.956 -0.040 196 HB2 HIS 43 HB2 HIS 43 7.126 9.844 -2.279 197 HB3 HIS 43 HB1 HIS 43 5.773 9.534 -1.197 198 HD2 HIS 43 HD2 HIS 43 6.948 9.702 1.669 199 HE1 HIS 43 HE1 HIS 43 8.952 13.207 0.407 200 HE2 HIS 43 HE2 HIS 43 8.353 11.755 2.396 201 H LEU 44 HN LEU 44 5.530 7.211 0.459 202 HA LEU 44 HA LEU 44 4.714 4.962 -1.048 203 HB2 LEU 44 HB2 LEU 44 3.445 6.424 1.258 204 HB3 LEU 44 HB1 LEU 44 2.726 4.997 0.534 205 HG LEU 44 HG LEU 44 5.506 5.037 1.710 206 HD11 LEU 44 HD11 LEU 44 4.577 3.957 3.662 207 HD12 LEU 44 HD12 LEU 44 2.954 4.074 2.984 208 HD13 LEU 44 HD13 LEU 44 3.830 5.538 3.429 209 HD21 LEU 44 HD21 LEU 44 5.180 2.580 1.724 210 HD22 LEU 44 HD22 LEU 44 5.192 3.275 0.103 211 HD23 LEU 44 HD23 LEU 44 3.665 2.810 0.852 212 H LYS 45 HN LYS 45 4.158 8.201 -1.584 213 HA LYS 45 HA LYS 45 1.522 8.339 -2.472 214 HB2 LYS 45 HB2 LYS 45 2.771 10.362 -2.264 215 HB3 LYS 45 HB1 LYS 45 4.024 9.782 -3.349 216 HG2 LYS 45 HG2 LYS 45 2.716 11.427 -4.489 217 HG3 LYS 45 HG1 LYS 45 2.384 9.848 -5.206 218 HD2 LYS 45 HD2 LYS 45 0.299 9.689 -4.055 219 HD3 LYS 45 HD1 LYS 45 0.655 11.123 -3.092 220 HE2 LYS 45 HE2 LYS 45 0.617 12.488 -5.128 221 HE3 LYS 45 HE1 LYS 45 0.249 11.052 -6.082 222 HZ1 LYS 45 HZ1 LYS 45 -1.861 10.890 -5.160 223 HZ2 LYS 45 HZ2 LYS 45 -1.675 12.556 -5.376 224 HZ3 LYS 45 HZ3 LYS 45 -1.483 11.877 -3.835 225 H LYS 46 HN LYS 46 4.479 7.485 -4.242 226 HA LYS 46 HA LYS 46 3.208 7.021 -6.731 227 HB2 LYS 46 HB2 LYS 46 5.665 7.482 -6.354 228 HB3 LYS 46 HB1 LYS 46 5.817 5.828 -5.780 229 HG2 LYS 46 HG2 LYS 46 6.534 5.955 -8.066 230 HG3 LYS 46 HG1 LYS 46 5.038 5.025 -7.976 231 HD2 LYS 46 HD2 LYS 46 3.789 7.052 -8.641 232 HD3 LYS 46 HD1 LYS 46 5.321 7.908 -8.813 233 HE2 LYS 46 HE2 LYS 46 5.978 6.600 -10.638 234 HE3 LYS 46 HE1 LYS 46 4.784 5.353 -10.287 235 HZ1 LYS 46 HZ1 LYS 46 4.316 8.048 -11.412 236 HZ2 LYS 46 HZ2 LYS 46 3.061 7.095 -10.796 237 HZ3 LYS 46 HZ3 LYS 46 3.972 6.554 -12.123 238 H LEU 47 HN LEU 47 3.650 5.100 -3.889 239 HA LEU 47 HA LEU 47 3.122 2.580 -5.177 240 HB2 LEU 47 HB2 LEU 47 3.455 3.471 -2.332 241 HB3 LEU 47 HB1 LEU 47 2.804 1.883 -2.682 242 HG LEU 47 HG LEU 47 5.132 1.640 -2.237 243 HD11 LEU 47 HD11 LEU 47 5.899 0.557 -4.218 244 HD12 LEU 47 HD12 LEU 47 4.812 1.513 -5.224 245 HD13 LEU 47 HD13 LEU 47 4.154 0.322 -4.104 246 HD21 LEU 47 HD21 LEU 47 5.601 3.738 -4.350 247 HD22 LEU 47 HD22 LEU 47 6.859 2.793 -3.554 248 HD23 LEU 47 HD23 LEU 47 5.873 3.915 -2.616 249 H LYS 48 HN LYS 48 1.355 4.850 -3.129 250 HA LYS 48 HA LYS 48 -1.008 3.390 -2.831 251 HB2 LYS 48 HB2 LYS 48 -0.472 6.356 -2.809 252 HB3 LYS 48 HB1 LYS 48 -2.056 5.677 -2.459 253 HG2 LYS 48 HG2 LYS 48 -1.231 4.554 -0.528 254 HG3 LYS 48 HG1 LYS 48 0.437 4.952 -0.945 255 HD2 LYS 48 HD2 LYS 48 -0.155 6.482 0.740 256 HD3 LYS 48 HD1 LYS 48 -0.264 7.394 -0.764 257 HE2 LYS 48 HE2 LYS 48 -2.699 6.993 -0.796 258 HE3 LYS 48 HE1 LYS 48 -2.561 6.156 0.751 259 HZ1 LYS 48 HZ1 LYS 48 -1.667 8.232 1.695 260 HZ2 LYS 48 HZ2 LYS 48 -3.247 8.405 1.123 261 HZ3 LYS 48 HZ3 LYS 48 -1.952 9.019 0.216 262 H GLU 49 HN GLU 49 -0.071 5.736 -5.339 263 HA GLU 49 HA GLU 49 -2.578 5.681 -6.656 264 HB2 GLU 49 HB2 GLU 49 -1.376 6.694 -8.574 265 HB3 GLU 49 HB1 GLU 49 -1.085 7.528 -7.055 266 HG2 GLU 49 HG2 GLU 49 1.096 6.669 -6.883 267 HG3 GLU 49 HG1 GLU 49 0.807 5.472 -8.145 268 H SER 50 HN SER 50 0.424 3.869 -7.142 269 HA SER 50 HA SER 50 -0.366 2.482 -9.447 270 HB2 SER 50 HB2 SER 50 1.540 1.608 -7.262 271 HB3 SER 50 HB1 SER 50 1.437 0.901 -8.873 272 HG SER 50 HG SER 50 2.436 3.405 -8.074 273 H TYR 51 HN TYR 51 -0.858 1.825 -6.014 274 HA TYR 51 HA TYR 51 -1.896 -0.778 -6.290 275 HB2 TYR 51 HB2 TYR 51 -1.178 0.288 -4.130 276 HB3 TYR 51 HB1 TYR 51 -2.650 1.251 -4.175 277 HD1 TYR 51 HD1 TYR 51 -1.267 -2.104 -3.671 278 HD2 TYR 51 HD2 TYR 51 -4.811 0.248 -3.714 279 HE1 TYR 51 HE1 TYR 51 -2.480 -3.920 -2.539 280 HE2 TYR 51 HE2 TYR 51 -6.033 -1.559 -2.583 281 HH TYR 51 HH TYR 51 -5.852 -4.015 -2.311 282 H CYS 52 HN CYS 52 -3.434 2.406 -6.291 283 HA CYS 52 HA CYS 52 -6.098 1.508 -6.481 284 HB2 CYS 52 HB2 CYS 52 -4.950 4.104 -7.535 285 HB3 CYS 52 HB1 CYS 52 -6.639 3.780 -7.160 286 HG CYS 52 HG CYS 52 -4.083 3.935 -4.886 287 H GLN 53 HN GLN 53 -3.677 2.335 -8.919 288 HA GLN 53 HA GLN 53 -5.312 2.070 -11.190 289 HB2 GLN 53 HB2 GLN 53 -2.338 1.597 -10.906 290 HB3 GLN 53 HB1 GLN 53 -3.188 1.767 -12.435 291 HG2 GLN 53 HG2 GLN 53 -3.754 4.044 -11.937 292 HG3 GLN 53 HG1 GLN 53 -3.103 3.892 -10.306 293 HE21 GLN 53 HE21 GLN 53 -2.372 5.755 -12.430 294 HE22 GLN 53 HE22 GLN 53 -0.683 5.523 -12.708 295 H ARG 54 HN ARG 54 -3.527 -0.268 -9.285 296 HA ARG 54 HA ARG 54 -3.919 -2.456 -11.077 297 HB2 ARG 54 HB2 ARG 54 -2.080 -2.444 -9.455 298 HB3 ARG 54 HB1 ARG 54 -3.232 -2.427 -8.129 299 HG2 ARG 54 HG2 ARG 54 -3.908 -4.636 -8.542 300 HG3 ARG 54 HG1 ARG 54 -3.165 -4.648 -10.143 301 HD2 ARG 54 HD2 ARG 54 -0.955 -4.581 -9.160 302 HD3 ARG 54 HD1 ARG 54 -1.643 -4.430 -7.546 303 HE ARG 54 HE ARG 54 -2.053 -6.690 -7.526 304 HH11 ARG 54 HH11 ARG 54 -1.190 -5.676 -10.787 305 HH12 ARG 54 HH12 ARG 54 -1.024 -7.369 -11.386 306 HH21 ARG 54 HH21 ARG 54 -1.773 -8.852 -8.237 307 HH22 ARG 54 HH22 ARG 54 -1.342 -9.134 -9.965 308 H GLN 55 HN GLN 55 -5.636 -1.163 -8.296 309 HA GLN 55 HA GLN 55 -7.476 -3.307 -8.023 310 HB2 GLN 55 HB2 GLN 55 -7.558 -0.427 -7.130 311 HB3 GLN 55 HB1 GLN 55 -8.841 -1.569 -6.766 312 HG2 GLN 55 HG2 GLN 55 -5.979 -1.671 -5.853 313 HG3 GLN 55 HG1 GLN 55 -7.422 -1.429 -4.867 314 HE21 GLN 55 HE21 GLN 55 -8.863 -3.204 -4.586 315 HE22 GLN 55 HE22 GLN 55 -8.290 -4.829 -4.742 316 H GLY 56 HN GLY 56 -7.525 -0.250 -9.788 317 HA2 GLY 56 HA2 GLY 56 -8.664 -0.187 -11.935 318 HA3 GLY 56 HA1 GLY 56 -9.883 -1.254 -11.251 319 H VAL 57 HN VAL 57 -8.905 1.070 -9.042 320 HA VAL 57 HA VAL 57 -11.162 2.823 -9.754 321 HB VAL 57 HB VAL 57 -11.542 3.191 -7.332 322 HG11 VAL 57 HG11 VAL 57 -12.632 1.049 -6.869 323 HG12 VAL 57 HG12 VAL 57 -11.716 0.300 -8.177 324 HG13 VAL 57 HG13 VAL 57 -12.898 1.558 -8.536 325 HG21 VAL 57 HG21 VAL 57 -9.547 0.955 -6.974 326 HG22 VAL 57 HG22 VAL 57 -10.546 1.651 -5.699 327 HG23 VAL 57 HG23 VAL 57 -9.323 2.638 -6.498 328 HA PRO 58 HA PRO 58 -8.339 6.208 -9.483 329 HB2 PRO 58 HB2 PRO 58 -10.291 7.821 -7.998 330 HB3 PRO 58 HB1 PRO 58 -9.659 8.054 -9.632 331 HG2 PRO 58 HG2 PRO 58 -12.192 7.288 -9.209 332 HG3 PRO 58 HG1 PRO 58 -11.252 6.722 -10.605 333 HD2 PRO 58 HD2 PRO 58 -11.874 5.293 -8.052 334 HD3 PRO 58 HD1 PRO 58 -11.861 4.678 -9.718 335 H MET 59 HN MET 59 -7.236 7.702 -7.983 336 HA MET 59 HA MET 59 -6.569 6.361 -5.549 337 HB2 MET 59 HB2 MET 59 -5.068 7.815 -7.098 338 HB3 MET 59 HB1 MET 59 -5.731 9.173 -6.199 339 HG2 MET 59 HG2 MET 59 -4.982 7.924 -4.108 340 HG3 MET 59 HG1 MET 59 -4.032 6.920 -5.200 341 HE1 MET 59 HE1 MET 59 -2.911 8.354 -2.827 342 HE2 MET 59 HE2 MET 59 -1.577 9.399 -3.313 343 HE3 MET 59 HE3 MET 59 -1.648 7.731 -3.886 344 H ASN 60 HN ASN 60 -6.563 7.421 -3.434 345 HA ASN 60 HA ASN 60 -7.404 8.619 -1.693 346 HB2 ASN 60 HB2 ASN 60 -7.576 10.570 -3.279 347 HB3 ASN 60 HB1 ASN 60 -9.233 10.074 -3.606 348 HD21 ASN 60 HD21 ASN 60 -10.805 10.735 -2.266 349 HD22 ASN 60 HD22 ASN 60 -10.540 11.586 -0.784 350 H SER 61 HN SER 61 -9.531 7.145 -4.014 351 HA SER 61 HA SER 61 -11.860 6.956 -2.479 352 HB2 SER 61 HB2 SER 61 -11.136 4.673 -4.241 353 HB3 SER 61 HB1 SER 61 -12.630 5.609 -4.164 354 HG SER 61 HG SER 61 -10.429 5.959 -5.747 355 H LEU 62 HN LEU 62 -8.904 5.109 -2.435 356 HA LEU 62 HA LEU 62 -10.028 3.303 -0.409 357 HB2 LEU 62 HB2 LEU 62 -7.535 2.981 -2.082 358 HB3 LEU 62 HB1 LEU 62 -8.143 1.822 -0.917 359 HG LEU 62 HG LEU 62 -9.613 2.640 -3.424 360 HD11 LEU 62 HD11 LEU 62 -8.967 0.465 -4.300 361 HD12 LEU 62 HD12 LEU 62 -8.012 0.152 -2.850 362 HD13 LEU 62 HD13 LEU 62 -7.547 1.450 -3.950 363 HD21 LEU 62 HD21 LEU 62 -11.102 1.887 -1.666 364 HD22 LEU 62 HD22 LEU 62 -10.112 0.451 -1.410 365 HD23 LEU 62 HD23 LEU 62 -10.990 0.661 -2.926 366 H ARG 63 HN ARG 63 -9.322 3.420 1.617 367 HA ARG 63 HA ARG 63 -7.059 5.209 2.176 368 HB2 ARG 63 HB2 ARG 63 -7.950 5.319 4.487 369 HB3 ARG 63 HB1 ARG 63 -9.094 5.907 3.291 370 HG2 ARG 63 HG2 ARG 63 -10.424 3.961 3.471 371 HG3 ARG 63 HG1 ARG 63 -9.184 3.114 4.397 372 HD2 ARG 63 HD2 ARG 63 -9.496 4.583 6.266 373 HD3 ARG 63 HD1 ARG 63 -10.586 5.607 5.339 374 HE ARG 63 HE ARG 63 -11.186 2.900 6.324 375 HH11 ARG 63 HH11 ARG 63 -13.964 5.659 5.285 376 HH12 ARG 63 HH12 ARG 63 -12.213 5.997 4.978 377 HH21 ARG 63 HH21 ARG 63 -13.390 2.446 6.708 378 HH22 ARG 63 HH22 ARG 63 -14.621 3.675 6.234 379 H PHE 64 HN PHE 64 -5.230 4.396 2.923 380 HA PHE 64 HA PHE 64 -5.104 1.542 3.508 381 HB2 PHE 64 HB2 PHE 64 -2.883 3.566 3.121 382 HB3 PHE 64 HB1 PHE 64 -2.668 1.830 3.309 383 HD1 PHE 64 HD1 PHE 64 -3.852 4.486 1.073 384 HD2 PHE 64 HD2 PHE 64 -3.083 0.326 1.504 385 HE1 PHE 64 HE1 PHE 64 -4.064 4.203 -1.363 386 HE2 PHE 64 HE2 PHE 64 -3.292 0.029 -0.931 387 HZ PHE 64 HZ PHE 64 -3.785 1.970 -2.369 388 H LEU 65 HN LEU 65 -5.308 0.937 5.540 389 HA LEU 65 HA LEU 65 -4.639 2.842 7.662 390 HB2 LEU 65 HB2 LEU 65 -6.244 0.292 7.727 391 HB3 LEU 65 HB1 LEU 65 -5.889 1.272 9.135 392 HG LEU 65 HG LEU 65 -7.532 2.130 6.750 393 HD11 LEU 65 HD11 LEU 65 -9.381 2.150 8.340 394 HD12 LEU 65 HD12 LEU 65 -8.311 1.539 9.601 395 HD13 LEU 65 HD13 LEU 65 -8.677 0.539 8.196 396 HD21 LEU 65 HD21 LEU 65 -6.773 3.608 9.268 397 HD22 LEU 65 HD22 LEU 65 -8.022 4.131 8.138 398 HD23 LEU 65 HD23 LEU 65 -6.342 4.035 7.611 399 H PHE 66 HN PHE 66 -2.870 2.648 8.766 400 HA PHE 66 HA PHE 66 -1.583 0.013 9.012 401 HB2 PHE 66 HB2 PHE 66 -0.397 1.415 7.334 402 HB3 PHE 66 HB1 PHE 66 -0.164 2.652 8.565 403 HD1 PHE 66 HD1 PHE 66 0.492 -0.970 7.985 404 HD2 PHE 66 HD2 PHE 66 1.812 2.672 9.742 405 HE1 PHE 66 HE1 PHE 66 2.584 -2.066 8.674 406 HE2 PHE 66 HE2 PHE 66 3.909 1.582 10.432 407 HZ PHE 66 HZ PHE 66 4.295 -0.789 9.898 408 H GLU 67 HN GLU 67 -1.746 -0.506 11.078 409 HA GLU 67 HA GLU 67 -1.686 -0.440 13.341 410 HB2 GLU 67 HB2 GLU 67 0.111 1.924 12.785 411 HB3 GLU 67 HB1 GLU 67 -0.157 1.260 14.391 412 HG2 GLU 67 HG2 GLU 67 1.048 -0.186 12.043 413 HG3 GLU 67 HG1 GLU 67 1.905 0.411 13.466 414 H GLY 68 HN GLY 68 -3.810 0.959 11.915 415 HA2 GLY 68 HA2 GLY 68 -5.752 1.869 12.930 416 HA3 GLY 68 HA1 GLY 68 -4.739 2.582 14.172 417 H GLN 69 HN GLN 69 -2.840 3.720 12.315 418 HA GLN 69 HA GLN 69 -4.317 6.126 11.674 419 HB2 GLN 69 HB2 GLN 69 -1.392 5.411 11.419 420 HB3 GLN 69 HB1 GLN 69 -2.058 6.985 11.007 421 HG2 GLN 69 HG2 GLN 69 -2.770 7.301 13.309 422 HG3 GLN 69 HG1 GLN 69 -2.150 5.707 13.729 423 HE21 GLN 69 HE21 GLN 69 -1.436 8.426 14.681 424 HE22 GLN 69 HE22 GLN 69 0.270 8.560 14.431 425 H ARG 70 HN ARG 70 -4.108 7.168 9.546 426 HA ARG 70 HA ARG 70 -4.194 5.142 7.428 427 HB2 ARG 70 HB2 ARG 70 -5.294 7.062 6.108 428 HB3 ARG 70 HB1 ARG 70 -6.234 6.262 7.358 429 HG2 ARG 70 HG2 ARG 70 -5.499 8.153 8.893 430 HG3 ARG 70 HG1 ARG 70 -4.956 8.975 7.429 431 HD2 ARG 70 HD2 ARG 70 -7.746 7.904 7.772 432 HD3 ARG 70 HD1 ARG 70 -7.287 9.543 8.228 433 HE ARG 70 HE ARG 70 -6.540 9.700 5.786 434 HH11 ARG 70 HH11 ARG 70 -9.279 7.781 6.922 435 HH12 ARG 70 HH12 ARG 70 -10.170 7.919 5.349 436 HH21 ARG 70 HH21 ARG 70 -7.654 9.873 3.781 437 HH22 ARG 70 HH22 ARG 70 -9.291 9.110 3.627 438 H ILE 71 HN ILE 71 -2.753 5.107 5.864 439 HA ILE 71 HA ILE 71 -0.373 6.612 6.046 440 HB ILE 71 HB ILE 71 -1.419 4.876 3.811 441 HG12 ILE 71 HG12 ILE 71 -1.036 3.685 5.914 442 HG13 ILE 71 HG11 ILE 71 0.160 3.215 4.712 443 HG21 ILE 71 HG21 ILE 71 0.850 4.832 2.932 444 HG22 ILE 71 HG22 ILE 71 1.372 5.957 4.186 445 HG23 ILE 71 HG23 ILE 71 0.223 6.480 2.955 446 HD11 ILE 71 HD11 ILE 71 1.758 4.778 5.773 447 HD12 ILE 71 HD12 ILE 71 1.238 3.466 6.829 448 HD13 ILE 71 HD13 ILE 71 0.563 5.083 7.033 449 H ALA 72 HN ALA 72 0.092 8.560 5.358 450 HA ALA 72 HA ALA 72 -1.768 10.036 3.703 451 HB1 ALA 72 HB1 ALA 72 -0.299 11.943 4.140 452 HB2 ALA 72 HB2 ALA 72 0.870 10.874 4.914 453 HB3 ALA 72 HB3 ALA 72 -0.721 11.110 5.637 454 H ASP 73 HN ASP 73 -0.520 11.570 2.036 455 HA ASP 73 HA ASP 73 0.539 9.766 0.054 456 HB2 ASP 73 HB2 ASP 73 -0.284 12.638 0.099 457 HB3 ASP 73 HB1 ASP 73 0.769 12.084 -1.199 458 H ASN 74 HN ASN 74 1.772 12.160 2.253 459 HA ASN 74 HA ASN 74 4.417 12.049 1.011 460 HB2 ASN 74 HB2 ASN 74 5.013 13.896 2.507 461 HB3 ASN 74 HB1 ASN 74 3.557 14.272 1.594 462 HD21 ASN 74 HD21 ASN 74 4.845 14.824 4.407 463 HD22 ASN 74 HD22 ASN 74 3.463 14.771 5.449 464 H HIS 75 HN HIS 75 3.284 9.765 2.459 465 HA HIS 75 HA HIS 75 4.931 9.652 4.860 466 HB2 HIS 75 HB2 HIS 75 2.542 8.260 3.916 467 HB3 HIS 75 HB1 HIS 75 3.744 7.173 4.604 468 HD2 HIS 75 HD2 HIS 75 4.730 9.286 6.988 469 HE1 HIS 75 HE1 HIS 75 0.710 8.869 8.219 470 HE2 HIS 75 HE2 HIS 75 2.986 9.793 8.831 471 H THR 76 HN THR 76 6.724 8.464 5.071 472 HA THR 76 HA THR 76 7.692 7.050 2.669 473 HB THR 76 HB THR 76 9.722 7.663 4.666 474 HG1 THR 76 HG1 THR 76 8.217 9.473 4.964 475 HG21 THR 76 HG21 THR 76 9.341 8.366 1.753 476 HG22 THR 76 HG22 THR 76 10.327 7.063 2.420 477 HG23 THR 76 HG23 THR 76 10.792 8.745 2.677 478 HA PRO 77 HA PRO 77 7.510 3.232 4.957 479 HB2 PRO 77 HB2 PRO 77 9.952 2.444 3.477 480 HB3 PRO 77 HB1 PRO 77 8.365 1.666 3.526 481 HG2 PRO 77 HG2 PRO 77 9.166 2.993 1.362 482 HG3 PRO 77 HG1 PRO 77 7.475 3.036 1.903 483 HD2 PRO 77 HD2 PRO 77 9.607 5.103 2.207 484 HD3 PRO 77 HD1 PRO 77 7.881 5.303 1.846 485 H LYS 78 HN LYS 78 10.220 5.313 4.993 486 HA LYS 78 HA LYS 78 11.876 3.819 6.774 487 HB2 LYS 78 HB2 LYS 78 12.852 5.498 5.320 488 HB3 LYS 78 HB1 LYS 78 11.846 6.751 6.031 489 HG2 LYS 78 HG2 LYS 78 14.009 7.005 6.941 490 HG3 LYS 78 HG1 LYS 78 13.007 6.305 8.212 491 HD2 LYS 78 HD2 LYS 78 15.018 5.095 8.291 492 HD3 LYS 78 HD1 LYS 78 13.897 4.045 7.426 493 HE2 LYS 78 HE2 LYS 78 14.864 4.630 5.322 494 HE3 LYS 78 HE1 LYS 78 15.834 5.902 6.062 495 HZ1 LYS 78 HZ1 LYS 78 17.145 3.923 5.610 496 HZ2 LYS 78 HZ2 LYS 78 16.124 2.998 6.592 497 HZ3 LYS 78 HZ3 LYS 78 17.062 4.226 7.270 498 H GLU 79 HN GLU 79 9.338 6.203 7.132 499 HA GLU 79 HA GLU 79 9.794 6.406 9.997 500 HB2 GLU 79 HB2 GLU 79 8.092 8.129 9.972 501 HB3 GLU 79 HB1 GLU 79 9.258 8.438 8.696 502 HG2 GLU 79 HG2 GLU 79 7.618 7.262 7.148 503 HG3 GLU 79 HG1 GLU 79 6.451 7.432 8.459 504 H LEU 80 HN LEU 80 7.511 6.505 11.218 505 HA LEU 80 HA LEU 80 5.703 5.405 12.039 506 HB2 LEU 80 HB2 LEU 80 5.670 4.014 9.361 507 HB3 LEU 80 HB1 LEU 80 4.437 3.824 10.592 508 HG LEU 80 HG LEU 80 5.042 6.576 9.615 509 HD11 LEU 80 HD11 LEU 80 3.448 6.296 7.778 510 HD12 LEU 80 HD12 LEU 80 3.374 4.566 8.115 511 HD13 LEU 80 HD13 LEU 80 4.881 5.293 7.559 512 HD21 LEU 80 HD21 LEU 80 2.504 5.172 10.434 513 HD22 LEU 80 HD22 LEU 80 2.670 6.884 10.048 514 HD23 LEU 80 HD23 LEU 80 3.480 6.217 11.466 515 H GLY 81 HN GLY 81 7.523 3.027 10.109 516 HA2 GLY 81 HA2 GLY 81 9.056 1.617 11.558 517 HA3 GLY 81 HA1 GLY 81 7.613 1.317 12.514 518 H MET 82 HN MET 82 8.171 1.397 9.006 519 HA MET 82 HA MET 82 6.613 -1.019 8.699 520 HB2 MET 82 HB2 MET 82 7.897 0.917 6.795 521 HB3 MET 82 HB1 MET 82 7.310 -0.639 6.223 522 HG2 MET 82 HG2 MET 82 5.077 -0.108 7.034 523 HG3 MET 82 HG1 MET 82 5.660 1.442 7.639 524 HE1 MET 82 HE1 MET 82 3.188 0.797 5.564 525 HE2 MET 82 HE2 MET 82 3.341 2.191 4.492 526 HE3 MET 82 HE3 MET 82 3.509 2.396 6.235 527 H GLU 83 HN GLU 83 7.344 -3.014 8.219 528 HA GLU 83 HA GLU 83 10.219 -3.386 7.727 529 HB2 GLU 83 HB2 GLU 83 8.848 -4.006 10.161 530 HB3 GLU 83 HB1 GLU 83 9.317 -5.512 9.390 531 HG2 GLU 83 HG2 GLU 83 11.229 -3.247 9.885 532 HG3 GLU 83 HG1 GLU 83 10.963 -4.569 11.021 533 H GLU 84 HN GLU 84 10.341 -6.094 7.632 534 HA GLU 84 HA GLU 84 8.920 -6.665 5.187 535 HB2 GLU 84 HB2 GLU 84 11.306 -7.353 5.693 536 HB3 GLU 84 HB1 GLU 84 10.650 -8.532 6.819 537 HG2 GLU 84 HG2 GLU 84 11.278 -9.290 4.449 538 HG3 GLU 84 HG1 GLU 84 9.752 -9.836 5.140 539 H GLU 85 HN GLU 85 7.427 -8.355 4.875 540 HA GLU 85 HA GLU 85 5.585 -9.601 5.365 541 HB2 GLU 85 HB2 GLU 85 7.334 -10.179 7.728 542 HB3 GLU 85 HB1 GLU 85 5.682 -10.783 7.701 543 HG2 GLU 85 HG2 GLU 85 7.730 -11.324 5.567 544 HG3 GLU 85 HG1 GLU 85 7.370 -12.408 6.909 545 H ASP 86 HN ASP 86 5.738 -6.766 6.079 546 HA ASP 86 HA ASP 86 4.286 -6.375 8.511 547 HB2 ASP 86 HB2 ASP 86 5.787 -4.744 6.942 548 HB3 ASP 86 HB1 ASP 86 4.162 -4.257 6.463 549 H VAL 87 HN VAL 87 2.129 -5.420 8.623 550 HA VAL 87 HA VAL 87 0.422 -6.400 6.427 551 HB VAL 87 HB VAL 87 -0.237 -6.433 9.377 552 HG11 VAL 87 HG11 VAL 87 -2.313 -7.495 8.761 553 HG12 VAL 87 HG12 VAL 87 -1.859 -7.476 7.058 554 HG13 VAL 87 HG13 VAL 87 -2.177 -5.960 7.903 555 HG21 VAL 87 HG21 VAL 87 0.271 -8.707 7.460 556 HG22 VAL 87 HG22 VAL 87 -0.208 -8.863 9.151 557 HG23 VAL 87 HG23 VAL 87 1.359 -8.168 8.739 558 H ILE 88 HN ILE 88 -0.853 -4.973 5.531 559 HA ILE 88 HA ILE 88 -1.668 -2.600 7.050 560 HB ILE 88 HB ILE 88 0.206 -1.899 5.652 561 HG12 ILE 88 HG12 ILE 88 -2.348 -0.903 4.379 562 HG13 ILE 88 HG11 ILE 88 -1.808 -0.407 5.982 563 HG21 ILE 88 HG21 ILE 88 0.093 -2.018 3.211 564 HG22 ILE 88 HG22 ILE 88 -1.401 -2.947 3.332 565 HG23 ILE 88 HG23 ILE 88 0.106 -3.618 3.953 566 HD11 ILE 88 HD11 ILE 88 0.308 0.398 4.908 567 HD12 ILE 88 HD12 ILE 88 -1.152 1.280 4.461 568 HD13 ILE 88 HD13 ILE 88 -0.457 0.101 3.348 569 H GLU 89 HN GLU 89 -3.755 -1.926 6.635 570 HA GLU 89 HA GLU 89 -5.333 -3.780 4.984 571 HB2 GLU 89 HB2 GLU 89 -6.198 -1.927 7.207 572 HB3 GLU 89 HB1 GLU 89 -7.268 -2.989 6.304 573 HG2 GLU 89 HG2 GLU 89 -6.261 -4.924 7.218 574 HG3 GLU 89 HG1 GLU 89 -4.926 -3.991 7.895 575 H VAL 90 HN VAL 90 -6.977 -2.997 3.621 576 HA VAL 90 HA VAL 90 -6.851 -0.136 2.985 577 HB VAL 90 HB VAL 90 -5.516 -1.295 1.308 578 HG11 VAL 90 HG11 VAL 90 -7.999 -2.882 0.685 579 HG12 VAL 90 HG12 VAL 90 -6.528 -3.505 1.433 580 HG13 VAL 90 HG13 VAL 90 -6.489 -2.916 -0.228 581 HG21 VAL 90 HG21 VAL 90 -8.166 -0.343 0.236 582 HG22 VAL 90 HG22 VAL 90 -6.686 -0.521 -0.707 583 HG23 VAL 90 HG23 VAL 90 -6.759 0.657 0.604 584 H TYR 91 HN TYR 91 -8.772 0.782 3.053 585 HA TYR 91 HA TYR 91 -11.163 -0.840 2.492 586 HB2 TYR 91 HB2 TYR 91 -10.804 1.116 4.776 587 HB3 TYR 91 HB1 TYR 91 -12.345 0.404 4.307 588 HD1 TYR 91 HD1 TYR 91 -12.672 -2.068 4.537 589 HD2 TYR 91 HD2 TYR 91 -9.256 -0.081 6.113 590 HE1 TYR 91 HE1 TYR 91 -12.224 -4.004 5.983 591 HE2 TYR 91 HE2 TYR 91 -8.797 -2.015 7.563 592 HH TYR 91 HH TYR 91 -9.355 -4.113 8.089 593 H GLN 92 HN GLN 92 -13.075 0.566 1.957 594 HA GLN 92 HA GLN 92 -12.131 2.749 0.266 595 HB2 GLN 92 HB2 GLN 92 -13.722 0.821 -0.477 596 HB3 GLN 92 HB1 GLN 92 -14.967 1.778 0.316 597 HG2 GLN 92 HG2 GLN 92 -14.575 3.627 -1.139 598 HG3 GLN 92 HG1 GLN 92 -13.157 2.845 -1.835 599 HE21 GLN 92 HE21 GLN 92 -16.597 3.004 -1.766 600 HE22 GLN 92 HE22 GLN 92 -16.881 1.996 -3.139 601 H GLU 93 HN GLU 93 -12.704 4.829 0.497 602 HA GLU 93 HA GLU 93 -13.619 5.717 3.051 603 HB2 GLU 93 HB2 GLU 93 -13.131 7.228 0.476 604 HB3 GLU 93 HB1 GLU 93 -13.440 7.980 2.035 605 HG2 GLU 93 HG2 GLU 93 -11.233 6.033 1.960 606 HG3 GLU 93 HG1 GLU 93 -10.987 7.526 1.055 607 H GLN 94 HN GLN 94 -15.383 7.517 3.097 608 HA GLN 94 HA GLN 94 -17.811 6.263 2.161 609 HB2 GLN 94 HB2 GLN 94 -17.498 7.372 4.436 610 HB3 GLN 94 HB1 GLN 94 -17.608 8.910 3.591 611 HG2 GLN 94 HG2 GLN 94 -19.838 8.304 2.788 612 HG3 GLN 94 HG1 GLN 94 -19.725 6.768 3.645 613 HE21 GLN 94 HE21 GLN 94 -19.971 6.722 5.856 614 HE22 GLN 94 HE22 GLN 94 -20.537 8.080 6.763 615 H THR 95 HN THR 95 -15.747 8.801 1.111 616 HA THR 95 HA THR 95 -17.662 10.260 -0.415 617 HB THR 95 HB THR 95 -15.590 11.123 -1.623 618 HG1 THR 95 HG1 THR 95 -13.699 10.270 -1.144 619 HG21 THR 95 HG21 THR 95 -16.583 12.345 0.235 620 HG22 THR 95 HG22 THR 95 -14.824 12.432 0.324 621 HG23 THR 95 HG23 THR 95 -15.707 11.340 1.390 622 H GLY 96 HN GLY 96 -15.504 7.565 -1.063 623 HA2 GLY 96 HA2 GLY 96 -15.671 5.953 -2.722 624 HA3 GLY 96 HA1 GLY 96 -17.024 6.843 -3.410 625 H GLY 97 HN GLY 97 -14.135 8.559 -2.691 626 HA2 GLY 97 HA2 GLY 97 -12.377 8.303 -4.653 627 HA3 GLY 97 HA1 GLY 97 -13.708 9.055 -5.524 628 H1 ASN 357 HT1 ASN 357 -4.391 -21.149 -2.097 629 H2 ASN 357 HT2 ASN 357 -4.135 -20.565 -0.532 630 H3 ASN 357 HT3 ASN 357 -3.016 -21.621 -1.234 631 HA ASN 357 HA ASN 357 -2.170 -19.389 -1.266 632 HB2 ASN 357 HB2 ASN 357 -1.670 -19.221 -3.663 633 HB3 ASN 357 HB1 ASN 357 -1.568 -20.891 -3.120 634 HD21 ASN 357 HD21 ASN 357 -2.040 -19.722 -5.788 635 HD22 ASN 357 HD22 ASN 357 -3.512 -20.435 -6.346 636 H ASN 358 HN ASN 358 -2.500 -17.244 -1.455 637 HA ASN 358 HA ASN 358 -4.585 -16.073 -3.017 638 HB2 ASN 358 HB2 ASN 358 -5.978 -15.202 -1.248 639 HB3 ASN 358 HB1 ASN 358 -5.887 -16.948 -1.054 640 HD21 ASN 358 HD21 ASN 358 -6.537 -14.856 0.878 641 HD22 ASN 358 HD22 ASN 358 -5.404 -15.039 2.175 642 H ARG 359 HN ARG 359 -1.714 -15.876 -2.551 643 HA ARG 359 HA ARG 359 -1.559 -13.018 -1.885 644 HB2 ARG 359 HB2 ARG 359 0.731 -13.585 -0.853 645 HB3 ARG 359 HB1 ARG 359 -0.706 -13.945 0.089 646 HG2 ARG 359 HG2 ARG 359 -0.575 -16.277 -0.517 647 HG3 ARG 359 HG1 ARG 359 0.791 -15.952 -1.576 648 HD2 ARG 359 HD2 ARG 359 1.510 -16.901 0.564 649 HD3 ARG 359 HD1 ARG 359 2.143 -15.272 0.321 650 HE ARG 359 HE ARG 359 0.032 -14.664 1.746 651 HH11 ARG 359 HH11 ARG 359 2.244 -17.369 2.199 652 HH12 ARG 359 HH12 ARG 359 1.932 -17.466 3.970 653 HH21 ARG 359 HH21 ARG 359 -0.383 -14.749 3.963 654 HH22 ARG 359 HH22 ARG 359 0.455 -16.006 4.963 655 H ASP 360 HN ASP 360 -0.467 -11.844 -3.343 656 HA ASP 360 HA ASP 360 1.529 -13.168 -4.998 657 HB2 ASP 360 HB2 ASP 360 0.636 -12.488 -7.065 658 HB3 ASP 360 HB1 ASP 360 -0.741 -13.116 -6.171 659 HA PRO 361 HA PRO 361 3.597 -9.362 -4.134 660 HB2 PRO 361 HB2 PRO 361 5.952 -9.939 -5.236 661 HB3 PRO 361 HB1 PRO 361 5.359 -10.831 -3.829 662 HG2 PRO 361 HG2 PRO 361 5.445 -11.669 -6.678 663 HG3 PRO 361 HG1 PRO 361 5.671 -12.636 -5.210 664 HD2 PRO 361 HD2 PRO 361 3.313 -12.443 -6.721 665 HD3 PRO 361 HD1 PRO 361 3.471 -13.135 -5.094 666 H ILE 362 HN ILE 362 4.053 -7.416 -5.063 667 HA ILE 362 HA ILE 362 4.061 -7.210 -7.996 668 HB ILE 362 HB ILE 362 2.442 -5.425 -6.164 669 HG12 ILE 362 HG12 ILE 362 0.678 -6.432 -7.971 670 HG13 ILE 362 HG11 ILE 362 1.775 -7.796 -7.788 671 HG21 ILE 362 HG21 ILE 362 1.615 -4.442 -8.297 672 HG22 ILE 362 HG22 ILE 362 2.872 -5.348 -9.141 673 HG23 ILE 362 HG23 ILE 362 3.316 -4.118 -7.957 674 HD11 ILE 362 HD11 ILE 362 0.331 -6.403 -5.550 675 HD12 ILE 362 HD12 ILE 362 1.394 -7.803 -5.398 676 HD13 ILE 362 HD13 ILE 362 -0.127 -7.942 -6.278 677 H VAL 363 HN VAL 363 5.596 -5.911 -8.785 678 HA VAL 363 HA VAL 363 6.927 -4.010 -6.962 679 HB VAL 363 HB VAL 363 8.254 -5.603 -9.169 680 HG11 VAL 363 HG11 VAL 363 9.213 -3.370 -8.807 681 HG12 VAL 363 HG12 VAL 363 10.330 -4.655 -8.351 682 HG13 VAL 363 HG13 VAL 363 9.456 -3.762 -7.105 683 HG21 VAL 363 HG21 VAL 363 9.300 -6.930 -7.520 684 HG22 VAL 363 HG22 VAL 363 7.591 -6.884 -7.081 685 HG23 VAL 363 HG23 VAL 363 8.752 -5.875 -6.220 686 H ILE 364 HN ILE 364 6.694 -1.970 -7.639 687 HA ILE 364 HA ILE 364 5.844 -1.471 -10.384 688 HB ILE 364 HB ILE 364 5.370 0.813 -9.659 689 HG12 ILE 364 HG12 ILE 364 5.876 0.166 -6.799 690 HG13 ILE 364 HG11 ILE 364 7.283 0.523 -7.797 691 HG21 ILE 364 HG21 ILE 364 4.270 -1.287 -7.799 692 HG22 ILE 364 HG22 ILE 364 3.648 -0.877 -9.397 693 HG23 ILE 364 HG23 ILE 364 3.558 0.300 -8.086 694 HD11 ILE 364 HD11 ILE 364 6.320 2.668 -8.407 695 HD12 ILE 364 HD12 ILE 364 6.466 2.508 -6.656 696 HD13 ILE 364 HD13 ILE 364 4.894 2.316 -7.433 697 H SER 365 HN SER 365 6.716 0.993 -10.954 698 HA SER 365 HA SER 365 9.610 0.619 -11.202 699 HB2 SER 365 HB2 SER 365 7.932 2.480 -12.875 700 HB3 SER 365 HB1 SER 365 9.504 1.777 -13.254 701 HG SER 365 HG SER 365 6.965 0.704 -13.515 702 H ASP 366 HN ASP 366 10.834 1.854 -9.947 703 HA ASP 366 HA ASP 366 9.781 4.207 -8.654 704 HB2 ASP 366 HB2 ASP 366 11.256 2.866 -7.333 705 HB3 ASP 366 HB1 ASP 366 12.472 2.838 -8.604 706 H SER 367 HN SER 367 9.428 5.804 -10.097 707 HA SER 367 HA SER 367 11.767 6.833 -11.537 708 HB2 SER 367 HB2 SER 367 9.188 7.156 -12.928 709 HB3 SER 367 HB1 SER 367 10.775 6.742 -13.576 710 HG SER 367 HG SER 367 8.955 5.009 -12.253 711 HA PRO 368 HA PRO 368 10.264 10.516 -9.443 712 HB2 PRO 368 HB2 PRO 368 12.449 11.916 -10.767 713 HB3 PRO 368 HB1 PRO 368 12.236 11.565 -9.046 714 HG2 PRO 368 HG2 PRO 368 14.148 10.386 -10.558 715 HG3 PRO 368 HG1 PRO 368 13.399 9.607 -9.153 716 HD2 PRO 368 HD2 PRO 368 12.857 9.178 -12.057 717 HD3 PRO 368 HD1 PRO 368 12.932 8.000 -10.729 Start of MODEL 19 1 H TYR 21 HT1 TYR 21 15.304 -5.627 -0.193 2 HA TYR 21 HA TYR 21 13.984 -3.919 -1.219 3 HB2 TYR 21 HB2 TYR 21 12.830 -6.300 -2.642 4 HB3 TYR 21 HB1 TYR 21 11.855 -4.854 -2.400 5 HD1 TYR 21 HD1 TYR 21 12.436 -2.763 -3.522 6 HD2 TYR 21 HD2 TYR 21 14.690 -6.307 -4.194 7 HE1 TYR 21 HE1 TYR 21 13.441 -1.740 -5.519 8 HE2 TYR 21 HE2 TYR 21 15.701 -5.289 -6.192 9 HH TYR 21 HH TYR 21 15.121 -3.496 -7.835 10 H ILE 22 HN ILE 22 11.480 -3.669 -0.693 11 HA ILE 22 HA ILE 22 11.058 -5.047 1.884 12 HB ILE 22 HB ILE 22 9.879 -2.390 1.059 13 HG12 ILE 22 HG12 ILE 22 12.334 -2.205 1.189 14 HG13 ILE 22 HG11 ILE 22 11.550 -1.315 2.488 15 HG21 ILE 22 HG21 ILE 22 8.628 -3.590 2.766 16 HG22 ILE 22 HG22 ILE 22 9.393 -2.152 3.442 17 HG23 ILE 22 HG23 ILE 22 10.089 -3.744 3.744 18 HD11 ILE 22 HD11 ILE 22 13.481 -2.451 3.341 19 HD12 ILE 22 HD12 ILE 22 12.911 -3.989 2.700 20 HD13 ILE 22 HD13 ILE 22 12.034 -3.202 4.012 21 H LYS 23 HN LYS 23 9.366 -6.409 1.946 22 HA LYS 23 HA LYS 23 7.342 -6.125 -0.176 23 HB2 LYS 23 HB2 LYS 23 8.793 -8.249 0.056 24 HB3 LYS 23 HB1 LYS 23 7.774 -8.612 1.442 25 HG2 LYS 23 HG2 LYS 23 5.796 -8.509 -0.023 26 HG3 LYS 23 HG1 LYS 23 6.863 -8.240 -1.403 27 HD2 LYS 23 HD2 LYS 23 6.411 -10.541 -1.435 28 HD3 LYS 23 HD1 LYS 23 8.016 -10.414 -0.712 29 HE2 LYS 23 HE2 LYS 23 5.650 -10.395 1.089 30 HE3 LYS 23 HE1 LYS 23 6.111 -11.922 0.343 31 HZ1 LYS 23 HZ1 LYS 23 7.104 -11.527 2.554 32 HZ2 LYS 23 HZ2 LYS 23 7.972 -10.217 1.918 33 HZ3 LYS 23 HZ3 LYS 23 8.255 -11.784 1.338 34 H LEU 24 HN LEU 24 5.475 -5.333 0.422 35 HA LEU 24 HA LEU 24 4.642 -5.570 3.232 36 HB2 LEU 24 HB2 LEU 24 3.710 -3.687 1.061 37 HB3 LEU 24 HB1 LEU 24 3.093 -3.712 2.700 38 HG LEU 24 HG LEU 24 5.961 -3.107 1.977 39 HD11 LEU 24 HD11 LEU 24 4.483 -1.381 1.106 40 HD12 LEU 24 HD12 LEU 24 5.403 -0.779 2.486 41 HD13 LEU 24 HD13 LEU 24 3.709 -1.231 2.685 42 HD21 LEU 24 HD21 LEU 24 5.743 -3.989 4.212 43 HD22 LEU 24 HD22 LEU 24 4.422 -2.871 4.559 44 HD23 LEU 24 HD23 LEU 24 6.053 -2.254 4.294 45 H LYS 25 HN LYS 25 2.617 -6.376 3.763 46 HA LYS 25 HA LYS 25 1.295 -7.858 1.595 47 HB2 LYS 25 HB2 LYS 25 1.282 -8.365 4.574 48 HB3 LYS 25 HB1 LYS 25 0.418 -9.323 3.381 49 HG2 LYS 25 HG2 LYS 25 2.324 -10.308 2.585 50 HG3 LYS 25 HG1 LYS 25 3.351 -8.957 3.068 51 HD2 LYS 25 HD2 LYS 25 3.857 -10.789 4.502 52 HD3 LYS 25 HD1 LYS 25 2.947 -9.612 5.449 53 HE2 LYS 25 HE2 LYS 25 1.004 -10.917 5.411 54 HE3 LYS 25 HE1 LYS 25 1.599 -11.918 4.086 55 HZ1 LYS 25 HZ1 LYS 25 1.851 -13.235 5.963 56 HZ2 LYS 25 HZ2 LYS 25 2.400 -11.959 6.925 57 HZ3 LYS 25 HZ3 LYS 25 3.407 -12.603 5.727 58 H VAL 26 HN VAL 26 -0.485 -6.968 0.879 59 HA VAL 26 HA VAL 26 -2.058 -5.243 2.659 60 HB VAL 26 HB VAL 26 -2.673 -5.637 -0.253 61 HG11 VAL 26 HG11 VAL 26 -3.523 -3.365 -0.074 62 HG12 VAL 26 HG12 VAL 26 -2.966 -3.274 1.598 63 HG13 VAL 26 HG13 VAL 26 -4.249 -4.400 1.156 64 HG21 VAL 26 HG21 VAL 26 -0.587 -3.753 0.845 65 HG22 VAL 26 HG22 VAL 26 -1.176 -3.780 -0.816 66 HG23 VAL 26 HG23 VAL 26 -0.281 -5.157 -0.175 67 H ILE 27 HN ILE 27 -3.854 -5.989 3.565 68 HA ILE 27 HA ILE 27 -4.853 -8.603 2.734 69 HB ILE 27 HB ILE 27 -5.648 -6.939 5.128 70 HG12 ILE 27 HG12 ILE 27 -3.279 -7.579 5.219 71 HG13 ILE 27 HG11 ILE 27 -4.217 -8.445 6.430 72 HG21 ILE 27 HG21 ILE 27 -6.577 -9.051 5.981 73 HG22 ILE 27 HG22 ILE 27 -6.181 -9.829 4.450 74 HG23 ILE 27 HG23 ILE 27 -7.366 -8.525 4.495 75 HD11 ILE 27 HD11 ILE 27 -4.241 -10.417 4.967 76 HD12 ILE 27 HD12 ILE 27 -2.607 -9.916 5.399 77 HD13 ILE 27 HD13 ILE 27 -3.250 -9.545 3.799 78 H GLY 28 HN GLY 28 -6.407 -8.669 1.270 79 HA2 GLY 28 HA2 GLY 28 -8.140 -6.380 0.829 80 HA3 GLY 28 HA1 GLY 28 -8.087 -7.851 -0.131 81 H GLN 29 HN GLN 29 -10.511 -6.777 0.486 82 HA GLN 29 HA GLN 29 -11.637 -7.821 2.885 83 HB2 GLN 29 HB2 GLN 29 -12.525 -5.874 1.546 84 HB3 GLN 29 HB1 GLN 29 -13.107 -7.037 0.366 85 HG2 GLN 29 HG2 GLN 29 -14.818 -6.206 1.986 86 HG3 GLN 29 HG1 GLN 29 -14.657 -7.960 1.901 87 HE21 GLN 29 HE21 GLN 29 -13.952 -9.078 3.665 88 HE22 GLN 29 HE22 GLN 29 -13.723 -8.357 5.221 89 H ASP 30 HN ASP 30 -10.778 -9.213 -0.066 90 HA ASP 30 HA ASP 30 -12.663 -11.427 0.123 91 HB2 ASP 30 HB2 ASP 30 -11.606 -12.202 -1.978 92 HB3 ASP 30 HB1 ASP 30 -12.185 -10.546 -2.111 93 H SER 31 HN SER 31 -10.198 -10.652 1.874 94 HA SER 31 HA SER 31 -8.759 -11.730 3.234 95 HB2 SER 31 HB2 SER 31 -9.956 -14.296 2.159 96 HB3 SER 31 HB1 SER 31 -9.032 -14.102 3.651 97 HG SER 31 HG SER 31 -11.617 -13.120 3.033 98 H SER 32 HN SER 32 -8.012 -11.018 0.537 99 HA SER 32 HA SER 32 -6.181 -13.099 -0.323 100 HB2 SER 32 HB2 SER 32 -5.593 -11.370 -2.089 101 HB3 SER 32 HB1 SER 32 -7.270 -11.923 -2.098 102 HG SER 32 HG SER 32 -7.912 -9.977 -1.600 103 H GLU 33 HN GLU 33 -3.883 -12.586 -0.665 104 HA GLU 33 HA GLU 33 -2.885 -10.668 1.333 105 HB2 GLU 33 HB2 GLU 33 -2.659 -13.291 1.684 106 HB3 GLU 33 HB1 GLU 33 -1.282 -13.077 0.614 107 HG2 GLU 33 HG2 GLU 33 -0.392 -11.371 2.171 108 HG3 GLU 33 HG1 GLU 33 -1.728 -11.727 3.267 109 H ILE 34 HN ILE 34 -2.758 -9.112 -0.336 110 HA ILE 34 HA ILE 34 -1.317 -9.518 -2.748 111 HB ILE 34 HB ILE 34 -1.699 -6.853 -1.402 112 HG12 ILE 34 HG12 ILE 34 -3.860 -8.066 -1.385 113 HG13 ILE 34 HG11 ILE 34 -3.892 -6.673 -2.458 114 HG21 ILE 34 HG21 ILE 34 -1.829 -6.041 -3.725 115 HG22 ILE 34 HG22 ILE 34 -1.535 -7.685 -4.293 116 HG23 ILE 34 HG23 ILE 34 -0.296 -6.839 -3.369 117 HD11 ILE 34 HD11 ILE 34 -5.026 -8.599 -3.424 118 HD12 ILE 34 HD12 ILE 34 -3.533 -9.532 -3.316 119 HD13 ILE 34 HD13 ILE 34 -3.621 -8.129 -4.380 120 H HIS 35 HN HIS 35 0.832 -9.706 -3.002 121 HA HIS 35 HA HIS 35 2.548 -8.755 -0.821 122 HB2 HIS 35 HB2 HIS 35 2.868 -10.855 -2.936 123 HB3 HIS 35 HB1 HIS 35 4.293 -10.150 -2.178 124 HD2 HIS 35 HD2 HIS 35 1.512 -10.473 0.360 125 HE1 HIS 35 HE1 HIS 35 3.918 -13.928 0.726 126 HE2 HIS 35 HE2 HIS 35 1.946 -12.661 1.690 127 H PHE 36 HN PHE 36 2.612 -6.590 -1.324 128 HA PHE 36 HA PHE 36 3.486 -5.749 -3.963 129 HB2 PHE 36 HB2 PHE 36 1.795 -4.592 -2.231 130 HB3 PHE 36 HB1 PHE 36 3.283 -3.805 -1.719 131 HD1 PHE 36 HD1 PHE 36 4.750 -2.958 -3.822 132 HD2 PHE 36 HD2 PHE 36 0.528 -3.482 -3.760 133 HE1 PHE 36 HE1 PHE 36 4.526 -1.346 -5.664 134 HE2 PHE 36 HE2 PHE 36 0.296 -1.872 -5.603 135 HZ PHE 36 HZ PHE 36 2.294 -0.798 -6.559 136 H LYS 37 HN LYS 37 5.564 -5.635 -4.481 137 HA LYS 37 HA LYS 37 7.551 -5.529 -2.328 138 HB2 LYS 37 HB2 LYS 37 7.683 -7.269 -4.169 139 HB3 LYS 37 HB1 LYS 37 8.070 -5.955 -5.273 140 HG2 LYS 37 HG2 LYS 37 10.014 -5.398 -3.809 141 HG3 LYS 37 HG1 LYS 37 9.668 -6.861 -2.888 142 HD2 LYS 37 HD2 LYS 37 10.231 -6.806 -5.852 143 HD3 LYS 37 HD1 LYS 37 11.445 -7.136 -4.616 144 HE2 LYS 37 HE2 LYS 37 9.784 -8.976 -3.843 145 HE3 LYS 37 HE1 LYS 37 9.093 -8.788 -5.455 146 HZ1 LYS 37 HZ1 LYS 37 11.424 -9.134 -6.305 147 HZ2 LYS 37 HZ2 LYS 37 10.685 -10.490 -5.619 148 HZ3 LYS 37 HZ3 LYS 37 11.843 -9.626 -4.743 149 H VAL 38 HN VAL 38 8.156 -3.574 -1.734 150 HA VAL 38 HA VAL 38 8.347 -1.467 -3.783 151 HB VAL 38 HB VAL 38 7.902 0.179 -2.099 152 HG11 VAL 38 HG11 VAL 38 5.986 -2.132 -1.805 153 HG12 VAL 38 HG12 VAL 38 5.937 -0.882 -3.048 154 HG13 VAL 38 HG13 VAL 38 5.648 -0.458 -1.361 155 HG21 VAL 38 HG21 VAL 38 7.929 -2.080 -0.099 156 HG22 VAL 38 HG22 VAL 38 7.471 -0.413 0.250 157 HG23 VAL 38 HG23 VAL 38 9.123 -0.790 -0.239 158 H LYS 39 HN LYS 39 9.915 0.328 -3.011 159 HA LYS 39 HA LYS 39 12.406 -0.957 -2.106 160 HB2 LYS 39 HB2 LYS 39 12.304 -0.181 -4.521 161 HB3 LYS 39 HB1 LYS 39 12.182 1.460 -3.907 162 HG2 LYS 39 HG2 LYS 39 14.347 1.119 -2.739 163 HG3 LYS 39 HG1 LYS 39 14.479 -0.448 -3.540 164 HD2 LYS 39 HD2 LYS 39 14.398 0.669 -5.720 165 HD3 LYS 39 HD1 LYS 39 14.275 2.233 -4.909 166 HE2 LYS 39 HE2 LYS 39 16.450 1.658 -3.761 167 HE3 LYS 39 HE1 LYS 39 16.585 0.305 -4.881 168 HZ1 LYS 39 HZ1 LYS 39 17.806 2.235 -5.652 169 HZ2 LYS 39 HZ2 LYS 39 16.395 3.166 -5.649 170 HZ3 LYS 39 HZ3 LYS 39 16.548 1.864 -6.717 171 H MET 40 HN MET 40 13.634 0.121 -0.569 172 HA MET 40 HA MET 40 12.200 2.025 1.039 173 HB2 MET 40 HB2 MET 40 13.576 0.260 2.062 174 HB3 MET 40 HB1 MET 40 15.015 0.967 1.344 175 HG2 MET 40 HG2 MET 40 14.758 1.539 3.716 176 HG3 MET 40 HG1 MET 40 14.765 2.959 2.675 177 HE1 MET 40 HE1 MET 40 12.916 0.917 5.333 178 HE2 MET 40 HE2 MET 40 12.075 0.305 3.909 179 HE3 MET 40 HE3 MET 40 11.213 1.303 5.082 180 H THR 41 HN THR 41 12.004 3.688 -0.511 181 HA THR 41 HA THR 41 13.623 5.879 -0.157 182 HB THR 41 HB THR 41 15.302 4.444 -1.463 183 HG1 THR 41 HG1 THR 41 14.585 7.096 -1.915 184 HG21 THR 41 HG21 THR 41 13.738 3.594 -3.159 185 HG22 THR 41 HG22 THR 41 15.105 4.438 -3.886 186 HG23 THR 41 HG23 THR 41 13.534 5.234 -3.778 187 H THR 42 HN THR 42 11.317 4.098 -1.961 188 HA THR 42 HA THR 42 10.398 6.357 -3.511 189 HB THR 42 HB THR 42 8.746 3.899 -3.284 190 HG1 THR 42 HG1 THR 42 10.810 3.549 -5.050 191 HG21 THR 42 HG21 THR 42 8.214 5.720 -4.860 192 HG22 THR 42 HG22 THR 42 8.558 4.206 -5.695 193 HG23 THR 42 HG23 THR 42 9.775 5.482 -5.645 194 H HIS 43 HN HIS 43 8.855 7.740 -2.918 195 HA HIS 43 HA HIS 43 7.774 7.787 -0.320 196 HB2 HIS 43 HB2 HIS 43 7.851 9.524 -2.526 197 HB3 HIS 43 HB1 HIS 43 6.140 9.255 -2.211 198 HD2 HIS 43 HD2 HIS 43 5.705 9.561 0.797 199 HE1 HIS 43 HE1 HIS 43 8.358 12.855 0.709 200 HE2 HIS 43 HE2 HIS 43 6.694 11.559 2.121 201 H LEU 44 HN LEU 44 5.729 7.263 0.472 202 HA LEU 44 HA LEU 44 4.471 5.022 -0.661 203 HB2 LEU 44 HB2 LEU 44 3.687 6.918 1.528 204 HB3 LEU 44 HB1 LEU 44 2.598 5.646 1.005 205 HG LEU 44 HG LEU 44 5.409 5.116 1.952 206 HD11 LEU 44 HD11 LEU 44 2.841 5.016 3.518 207 HD12 LEU 44 HD12 LEU 44 4.168 6.153 3.752 208 HD13 LEU 44 HD13 LEU 44 4.411 4.437 4.076 209 HD21 LEU 44 HD21 LEU 44 4.517 2.832 2.282 210 HD22 LEU 44 HD22 LEU 44 4.511 3.348 0.594 211 HD23 LEU 44 HD23 LEU 44 3.009 3.346 1.522 212 H LYS 45 HN LYS 45 4.090 8.367 -1.264 213 HA LYS 45 HA LYS 45 1.464 8.533 -2.170 214 HB2 LYS 45 HB2 LYS 45 2.725 10.542 -1.930 215 HB3 LYS 45 HB1 LYS 45 3.994 9.959 -2.994 216 HG2 LYS 45 HG2 LYS 45 2.703 11.652 -4.108 217 HG3 LYS 45 HG1 LYS 45 2.446 10.096 -4.894 218 HD2 LYS 45 HD2 LYS 45 0.297 9.863 -3.950 219 HD3 LYS 45 HD1 LYS 45 0.576 11.171 -2.798 220 HE2 LYS 45 HE2 LYS 45 0.607 12.790 -4.600 221 HE3 LYS 45 HE1 LYS 45 0.439 11.503 -5.791 222 HZ1 LYS 45 HZ1 LYS 45 -1.745 11.062 -5.084 223 HZ2 LYS 45 HZ2 LYS 45 -1.645 12.742 -5.196 224 HZ3 LYS 45 HZ3 LYS 45 -1.578 11.992 -3.674 225 H LYS 46 HN LYS 46 4.411 7.496 -3.822 226 HA LYS 46 HA LYS 46 3.215 7.119 -6.368 227 HB2 LYS 46 HB2 LYS 46 5.690 7.390 -5.883 228 HB3 LYS 46 HB1 LYS 46 5.679 5.725 -5.323 229 HG2 LYS 46 HG2 LYS 46 6.478 5.787 -7.581 230 HG3 LYS 46 HG1 LYS 46 4.891 5.015 -7.556 231 HD2 LYS 46 HD2 LYS 46 3.906 7.237 -8.174 232 HD3 LYS 46 HD1 LYS 46 5.548 7.836 -8.396 233 HE2 LYS 46 HE2 LYS 46 5.947 6.314 -10.176 234 HE3 LYS 46 HE1 LYS 46 4.462 5.426 -9.838 235 HZ1 LYS 46 HZ1 LYS 46 4.706 8.172 -10.932 236 HZ2 LYS 46 HZ2 LYS 46 3.242 7.512 -10.389 237 HZ3 LYS 46 HZ3 LYS 46 4.056 6.810 -11.700 238 H LEU 47 HN LEU 47 3.682 5.066 -3.562 239 HA LEU 47 HA LEU 47 2.920 2.645 -4.874 240 HB2 LEU 47 HB2 LEU 47 3.194 3.435 -1.987 241 HB3 LEU 47 HB1 LEU 47 2.566 1.865 -2.446 242 HG LEU 47 HG LEU 47 4.781 1.375 -2.076 243 HD11 LEU 47 HD11 LEU 47 5.829 0.924 -4.162 244 HD12 LEU 47 HD12 LEU 47 4.918 2.204 -4.965 245 HD13 LEU 47 HD13 LEU 47 4.086 0.757 -4.392 246 HD21 LEU 47 HD21 LEU 47 5.460 4.057 -3.266 247 HD22 LEU 47 HD22 LEU 47 6.658 2.848 -2.803 248 HD23 LEU 47 HD23 LEU 47 5.605 3.558 -1.582 249 H LYS 48 HN LYS 48 1.237 5.073 -2.964 250 HA LYS 48 HA LYS 48 -1.209 3.718 -2.685 251 HB2 LYS 48 HB2 LYS 48 -0.536 6.659 -2.690 252 HB3 LYS 48 HB1 LYS 48 -2.157 6.057 -2.381 253 HG2 LYS 48 HG2 LYS 48 -1.375 4.850 -0.433 254 HG3 LYS 48 HG1 LYS 48 0.284 5.347 -0.764 255 HD2 LYS 48 HD2 LYS 48 -0.474 6.814 0.915 256 HD3 LYS 48 HD1 LYS 48 -0.566 7.744 -0.584 257 HE2 LYS 48 HE2 LYS 48 -2.967 7.219 -0.734 258 HE3 LYS 48 HE1 LYS 48 -2.857 6.339 0.789 259 HZ1 LYS 48 HZ1 LYS 48 -2.357 8.329 1.951 260 HZ2 LYS 48 HZ2 LYS 48 -3.697 8.658 0.969 261 HZ3 LYS 48 HZ3 LYS 48 -2.164 9.212 0.509 262 H GLU 49 HN GLU 49 -0.102 6.013 -5.185 263 HA GLU 49 HA GLU 49 -2.574 5.952 -6.594 264 HB2 GLU 49 HB2 GLU 49 -1.322 7.031 -8.444 265 HB3 GLU 49 HB1 GLU 49 -1.120 7.844 -6.901 266 HG2 GLU 49 HG2 GLU 49 1.073 6.935 -6.635 267 HG3 GLU 49 HG1 GLU 49 0.872 5.910 -8.055 268 H SER 50 HN SER 50 0.417 4.100 -6.850 269 HA SER 50 HA SER 50 -0.221 2.787 -9.264 270 HB2 SER 50 HB2 SER 50 1.556 1.852 -6.998 271 HB3 SER 50 HB1 SER 50 1.521 1.165 -8.623 272 HG SER 50 HG SER 50 2.465 3.679 -7.764 273 H TYR 51 HN TYR 51 -0.932 2.061 -5.886 274 HA TYR 51 HA TYR 51 -1.981 -0.528 -6.319 275 HB2 TYR 51 HB2 TYR 51 -1.323 0.530 -4.084 276 HB3 TYR 51 HB1 TYR 51 -2.885 1.342 -4.135 277 HD1 TYR 51 HD1 TYR 51 -1.258 -1.979 -4.055 278 HD2 TYR 51 HD2 TYR 51 -4.869 0.202 -3.529 279 HE1 TYR 51 HE1 TYR 51 -2.313 -3.976 -3.087 280 HE2 TYR 51 HE2 TYR 51 -5.936 -1.787 -2.557 281 HH TYR 51 HH TYR 51 -5.621 -4.278 -2.658 282 H CYS 52 HN CYS 52 -3.367 2.701 -6.440 283 HA CYS 52 HA CYS 52 -6.075 1.958 -6.640 284 HB2 CYS 52 HB2 CYS 52 -4.683 4.386 -7.802 285 HB3 CYS 52 HB1 CYS 52 -6.422 4.204 -7.599 286 HG CYS 52 HG CYS 52 -4.147 4.314 -5.039 287 H GLN 53 HN GLN 53 -3.525 2.375 -9.031 288 HA GLN 53 HA GLN 53 -5.165 1.942 -11.314 289 HB2 GLN 53 HB2 GLN 53 -2.182 1.570 -10.983 290 HB3 GLN 53 HB1 GLN 53 -3.038 1.651 -12.515 291 HG2 GLN 53 HG2 GLN 53 -3.639 3.940 -12.130 292 HG3 GLN 53 HG1 GLN 53 -2.973 3.883 -10.498 293 HE21 GLN 53 HE21 GLN 53 -2.310 5.618 -12.766 294 HE22 GLN 53 HE22 GLN 53 -0.615 5.413 -13.034 295 H ARG 54 HN ARG 54 -3.373 -0.120 -9.135 296 HA ARG 54 HA ARG 54 -3.465 -2.500 -10.659 297 HB2 ARG 54 HB2 ARG 54 -1.903 -2.331 -8.847 298 HB3 ARG 54 HB1 ARG 54 -3.182 -1.986 -7.695 299 HG2 ARG 54 HG2 ARG 54 -2.440 -4.223 -7.348 300 HG3 ARG 54 HG1 ARG 54 -4.052 -4.285 -8.064 301 HD2 ARG 54 HD2 ARG 54 -3.179 -4.879 -10.189 302 HD3 ARG 54 HD1 ARG 54 -1.530 -4.509 -9.690 303 HE ARG 54 HE ARG 54 -1.928 -6.444 -8.041 304 HH11 ARG 54 HH11 ARG 54 -3.241 -6.231 -11.300 305 HH12 ARG 54 HH12 ARG 54 -3.352 -8.020 -11.493 306 HH21 ARG 54 HH21 ARG 54 -1.992 -8.719 -8.250 307 HH22 ARG 54 HH22 ARG 54 -2.656 -9.414 -9.788 308 H GLN 55 HN GLN 55 -5.646 -1.090 -8.265 309 HA GLN 55 HA GLN 55 -7.444 -3.343 -8.345 310 HB2 GLN 55 HB2 GLN 55 -7.846 -0.589 -7.163 311 HB3 GLN 55 HB1 GLN 55 -8.887 -1.980 -6.901 312 HG2 GLN 55 HG2 GLN 55 -6.103 -1.509 -5.906 313 HG3 GLN 55 HG1 GLN 55 -7.567 -1.836 -4.982 314 HE21 GLN 55 HE21 GLN 55 -8.400 -3.973 -4.978 315 HE22 GLN 55 HE22 GLN 55 -7.380 -5.324 -5.323 316 H GLY 56 HN GLY 56 -7.222 -0.168 -9.819 317 HA2 GLY 56 HA2 GLY 56 -8.165 0.279 -11.957 318 HA3 GLY 56 HA1 GLY 56 -9.375 -0.956 -11.651 319 H VAL 57 HN VAL 57 -8.437 1.615 -9.452 320 HA VAL 57 HA VAL 57 -10.976 3.004 -9.950 321 HB VAL 57 HB VAL 57 -11.186 3.311 -7.427 322 HG11 VAL 57 HG11 VAL 57 -12.713 1.896 -8.660 323 HG12 VAL 57 HG12 VAL 57 -12.335 1.165 -7.100 324 HG13 VAL 57 HG13 VAL 57 -11.577 0.551 -8.569 325 HG21 VAL 57 HG21 VAL 57 -9.355 0.916 -7.382 326 HG22 VAL 57 HG22 VAL 57 -10.168 1.642 -5.993 327 HG23 VAL 57 HG23 VAL 57 -8.920 2.543 -6.857 328 HA PRO 58 HA PRO 58 -8.474 6.643 -9.608 329 HB2 PRO 58 HB2 PRO 58 -10.192 8.403 -8.408 330 HB3 PRO 58 HB1 PRO 58 -10.303 7.943 -10.112 331 HG2 PRO 58 HG2 PRO 58 -11.882 6.941 -7.788 332 HG3 PRO 58 HG1 PRO 58 -12.419 7.318 -9.438 333 HD2 PRO 58 HD2 PRO 58 -11.983 4.784 -8.612 334 HD3 PRO 58 HD1 PRO 58 -11.694 5.307 -10.283 335 H MET 59 HN MET 59 -7.434 8.096 -8.065 336 HA MET 59 HA MET 59 -6.827 6.757 -5.615 337 HB2 MET 59 HB2 MET 59 -5.289 8.257 -7.070 338 HB3 MET 59 HB1 MET 59 -6.034 9.596 -6.206 339 HG2 MET 59 HG2 MET 59 -5.337 8.517 -4.075 340 HG3 MET 59 HG1 MET 59 -4.459 7.324 -5.026 341 HE1 MET 59 HE1 MET 59 -2.124 7.892 -3.796 342 HE2 MET 59 HE2 MET 59 -3.144 8.899 -2.770 343 HE3 MET 59 HE3 MET 59 -1.656 9.556 -3.448 344 H ASN 60 HN ASN 60 -6.989 7.672 -3.496 345 HA ASN 60 HA ASN 60 -7.919 8.767 -1.743 346 HB2 ASN 60 HB2 ASN 60 -8.128 10.732 -3.531 347 HB3 ASN 60 HB1 ASN 60 -9.844 10.377 -3.341 348 HD21 ASN 60 HD21 ASN 60 -8.388 12.757 -2.588 349 HD22 ASN 60 HD22 ASN 60 -8.604 12.948 -0.883 350 H SER 61 HN SER 61 -9.664 7.091 -4.117 351 HA SER 61 HA SER 61 -12.179 6.968 -2.797 352 HB2 SER 61 HB2 SER 61 -11.179 4.761 -4.567 353 HB3 SER 61 HB1 SER 61 -12.798 5.456 -4.459 354 HG SER 61 HG SER 61 -10.666 6.203 -6.009 355 H LEU 62 HN LEU 62 -9.175 5.250 -2.541 356 HA LEU 62 HA LEU 62 -10.326 3.501 -0.476 357 HB2 LEU 62 HB2 LEU 62 -7.911 3.008 -2.224 358 HB3 LEU 62 HB1 LEU 62 -8.492 1.933 -0.970 359 HG LEU 62 HG LEU 62 -10.095 2.653 -3.424 360 HD11 LEU 62 HD11 LEU 62 -9.469 0.409 -4.241 361 HD12 LEU 62 HD12 LEU 62 -8.345 0.252 -2.891 362 HD13 LEU 62 HD13 LEU 62 -8.086 1.495 -4.115 363 HD21 LEU 62 HD21 LEU 62 -11.332 1.877 -1.397 364 HD22 LEU 62 HD22 LEU 62 -10.423 0.369 -1.483 365 HD23 LEU 62 HD23 LEU 62 -11.504 0.823 -2.800 366 H ARG 63 HN ARG 63 -9.531 3.700 1.521 367 HA ARG 63 HA ARG 63 -7.202 5.452 1.876 368 HB2 ARG 63 HB2 ARG 63 -7.991 5.751 4.199 369 HB3 ARG 63 HB1 ARG 63 -9.164 6.289 3.009 370 HG2 ARG 63 HG2 ARG 63 -10.525 4.353 3.377 371 HG3 ARG 63 HG1 ARG 63 -9.283 3.622 4.401 372 HD2 ARG 63 HD2 ARG 63 -9.555 5.345 6.056 373 HD3 ARG 63 HD1 ARG 63 -10.658 6.235 5.011 374 HE ARG 63 HE ARG 63 -11.352 3.556 6.034 375 HH11 ARG 63 HH11 ARG 63 -13.680 6.858 6.347 376 HH12 ARG 63 HH12 ARG 63 -12.103 6.951 5.470 377 HH21 ARG 63 HH21 ARG 63 -13.396 3.388 7.065 378 HH22 ARG 63 HH22 ARG 63 -14.421 4.866 7.199 379 H PHE 64 HN PHE 64 -5.386 4.696 2.688 380 HA PHE 64 HA PHE 64 -5.200 1.869 3.319 381 HB2 PHE 64 HB2 PHE 64 -3.105 4.016 2.939 382 HB3 PHE 64 HB1 PHE 64 -2.729 2.351 3.366 383 HD1 PHE 64 HD1 PHE 64 -4.072 4.546 0.745 384 HD2 PHE 64 HD2 PHE 64 -2.816 0.607 1.747 385 HE1 PHE 64 HE1 PHE 64 -4.085 3.938 -1.639 386 HE2 PHE 64 HE2 PHE 64 -2.825 -0.005 -0.633 387 HZ PHE 64 HZ PHE 64 -3.461 1.660 -2.326 388 H LEU 65 HN LEU 65 -5.043 1.084 5.316 389 HA LEU 65 HA LEU 65 -4.647 3.017 7.500 390 HB2 LEU 65 HB2 LEU 65 -6.239 0.452 7.510 391 HB3 LEU 65 HB1 LEU 65 -5.985 1.485 8.902 392 HG LEU 65 HG LEU 65 -7.399 2.377 6.388 393 HD11 LEU 65 HD11 LEU 65 -9.470 2.074 7.571 394 HD12 LEU 65 HD12 LEU 65 -8.611 1.510 9.006 395 HD13 LEU 65 HD13 LEU 65 -8.595 0.542 7.530 396 HD21 LEU 65 HD21 LEU 65 -7.194 3.598 9.139 397 HD22 LEU 65 HD22 LEU 65 -8.202 4.202 7.824 398 HD23 LEU 65 HD23 LEU 65 -6.447 4.208 7.663 399 H PHE 66 HN PHE 66 -2.954 2.782 8.685 400 HA PHE 66 HA PHE 66 -1.769 0.155 9.170 401 HB2 PHE 66 HB2 PHE 66 -0.539 1.141 7.237 402 HB3 PHE 66 HB1 PHE 66 -0.168 2.549 8.224 403 HD1 PHE 66 HD1 PHE 66 0.215 -1.156 8.231 404 HD2 PHE 66 HD2 PHE 66 1.829 2.612 9.374 405 HE1 PHE 66 HE1 PHE 66 2.246 -2.276 9.049 406 HE2 PHE 66 HE2 PHE 66 3.862 1.498 10.194 407 HZ PHE 66 HZ PHE 66 4.072 -0.949 10.033 408 H GLU 67 HN GLU 67 -1.134 -0.029 11.273 409 HA GLU 67 HA GLU 67 -0.811 0.489 13.465 410 HB2 GLU 67 HB2 GLU 67 0.067 3.075 12.192 411 HB3 GLU 67 HB1 GLU 67 0.025 2.887 13.941 412 HG2 GLU 67 HG2 GLU 67 1.497 0.932 12.220 413 HG3 GLU 67 HG1 GLU 67 2.231 2.464 12.698 414 H GLY 68 HN GLY 68 -3.349 1.107 11.911 415 HA2 GLY 68 HA2 GLY 68 -5.490 1.610 12.653 416 HA3 GLY 68 HA1 GLY 68 -4.795 2.269 14.125 417 H GLN 69 HN GLN 69 -3.159 3.575 11.570 418 HA GLN 69 HA GLN 69 -4.900 5.957 11.528 419 HB2 GLN 69 HB2 GLN 69 -1.906 5.888 11.129 420 HB3 GLN 69 HB1 GLN 69 -2.918 7.313 11.308 421 HG2 GLN 69 HG2 GLN 69 -3.088 7.083 13.567 422 HG3 GLN 69 HG1 GLN 69 -2.913 5.330 13.510 423 HE21 GLN 69 HE21 GLN 69 -1.546 7.292 15.189 424 HE22 GLN 69 HE22 GLN 69 0.143 7.063 14.894 425 H ARG 70 HN ARG 70 -4.761 7.247 9.507 426 HA ARG 70 HA ARG 70 -4.645 5.441 7.224 427 HB2 ARG 70 HB2 ARG 70 -5.668 7.356 5.967 428 HB3 ARG 70 HB1 ARG 70 -6.640 6.744 7.295 429 HG2 ARG 70 HG2 ARG 70 -5.701 8.630 8.683 430 HG3 ARG 70 HG1 ARG 70 -5.053 9.289 7.180 431 HD2 ARG 70 HD2 ARG 70 -7.957 8.606 7.585 432 HD3 ARG 70 HD1 ARG 70 -7.287 10.207 7.890 433 HE ARG 70 HE ARG 70 -6.584 10.106 5.452 434 HH11 ARG 70 HH11 ARG 70 -9.406 8.382 6.674 435 HH12 ARG 70 HH12 ARG 70 -10.305 8.511 5.111 436 HH21 ARG 70 HH21 ARG 70 -7.704 10.304 3.461 437 HH22 ARG 70 HH22 ARG 70 -9.359 9.576 3.320 438 H ILE 71 HN ILE 71 -3.096 5.415 5.777 439 HA ILE 71 HA ILE 71 -0.680 6.821 6.191 440 HB ILE 71 HB ILE 71 -1.624 5.217 3.812 441 HG12 ILE 71 HG12 ILE 71 -1.409 3.908 5.859 442 HG13 ILE 71 HG11 ILE 71 -0.123 3.482 4.736 443 HG21 ILE 71 HG21 ILE 71 0.691 5.149 3.073 444 HG22 ILE 71 HG22 ILE 71 1.163 6.197 4.413 445 HG23 ILE 71 HG23 ILE 71 0.108 6.812 3.138 446 HD11 ILE 71 HD11 ILE 71 1.333 5.110 6.030 447 HD12 ILE 71 HD12 ILE 71 0.894 3.607 6.839 448 HD13 ILE 71 HD13 ILE 71 0.059 5.105 7.250 449 H ALA 72 HN ALA 72 -0.193 8.831 5.681 450 HA ALA 72 HA ALA 72 -1.896 10.410 3.975 451 HB1 ALA 72 HB1 ALA 72 -0.382 12.251 4.551 452 HB2 ALA 72 HB2 ALA 72 0.704 11.109 5.339 453 HB3 ALA 72 HB3 ALA 72 -0.912 11.377 5.988 454 H ASP 73 HN ASP 73 -0.901 11.794 2.240 455 HA ASP 73 HA ASP 73 0.383 10.102 0.326 456 HB2 ASP 73 HB2 ASP 73 -0.627 12.915 0.342 457 HB3 ASP 73 HB1 ASP 73 0.489 12.429 -0.928 458 H ASN 74 HN ASN 74 1.499 12.353 2.675 459 HA ASN 74 HA ASN 74 4.099 12.623 1.369 460 HB2 ASN 74 HB2 ASN 74 4.600 14.333 2.969 461 HB3 ASN 74 HB1 ASN 74 2.967 14.622 2.378 462 HD21 ASN 74 HD21 ASN 74 4.930 13.842 5.096 463 HD22 ASN 74 HD22 ASN 74 3.673 13.884 6.285 464 H HIS 75 HN HIS 75 2.739 10.336 3.186 465 HA HIS 75 HA HIS 75 4.739 9.957 5.206 466 HB2 HIS 75 HB2 HIS 75 2.316 8.496 4.296 467 HB3 HIS 75 HB1 HIS 75 3.547 7.561 5.138 468 HD2 HIS 75 HD2 HIS 75 4.148 10.318 7.145 469 HE1 HIS 75 HE1 HIS 75 0.349 9.124 8.566 470 HE2 HIS 75 HE2 HIS 75 2.480 10.376 9.126 471 H THR 76 HN THR 76 6.389 8.493 5.266 472 HA THR 76 HA THR 76 7.068 7.175 2.715 473 HB THR 76 HB THR 76 9.420 7.584 4.272 474 HG1 THR 76 HG1 THR 76 7.953 9.358 5.124 475 HG21 THR 76 HG21 THR 76 9.416 7.383 1.865 476 HG22 THR 76 HG22 THR 76 10.079 8.958 2.306 477 HG23 THR 76 HG23 THR 76 8.424 8.832 1.708 478 HA PRO 77 HA PRO 77 7.153 3.338 4.950 479 HB2 PRO 77 HB2 PRO 77 9.537 2.555 3.397 480 HB3 PRO 77 HB1 PRO 77 7.935 1.812 3.453 481 HG2 PRO 77 HG2 PRO 77 8.742 3.172 1.306 482 HG3 PRO 77 HG1 PRO 77 7.056 3.219 1.862 483 HD2 PRO 77 HD2 PRO 77 9.217 5.255 2.217 484 HD3 PRO 77 HD1 PRO 77 7.497 5.488 1.840 485 H LYS 78 HN LYS 78 9.855 5.431 4.911 486 HA LYS 78 HA LYS 78 11.592 3.926 6.592 487 HB2 LYS 78 HB2 LYS 78 12.447 5.695 5.139 488 HB3 LYS 78 HB1 LYS 78 11.482 6.890 5.991 489 HG2 LYS 78 HG2 LYS 78 13.728 7.097 6.747 490 HG3 LYS 78 HG1 LYS 78 12.788 6.374 8.051 491 HD2 LYS 78 HD2 LYS 78 14.838 5.178 7.939 492 HD3 LYS 78 HD1 LYS 78 13.599 4.129 7.248 493 HE2 LYS 78 HE2 LYS 78 14.322 4.629 5.022 494 HE3 LYS 78 HE1 LYS 78 15.413 5.885 5.604 495 HZ1 LYS 78 HZ1 LYS 78 16.531 3.769 5.030 496 HZ2 LYS 78 HZ2 LYS 78 15.684 3.002 6.275 497 HZ3 LYS 78 HZ3 LYS 78 16.782 4.238 6.635 498 H GLU 79 HN GLU 79 8.921 6.095 7.125 499 HA GLU 79 HA GLU 79 9.474 6.160 10.004 500 HB2 GLU 79 HB2 GLU 79 7.880 7.975 10.137 501 HB3 GLU 79 HB1 GLU 79 9.048 8.324 8.872 502 HG2 GLU 79 HG2 GLU 79 7.295 7.310 7.279 503 HG3 GLU 79 HG1 GLU 79 6.172 7.551 8.615 504 H LEU 80 HN LEU 80 7.153 6.351 11.192 505 HA LEU 80 HA LEU 80 5.253 5.341 11.903 506 HB2 LEU 80 HB2 LEU 80 5.230 4.083 9.164 507 HB3 LEU 80 HB1 LEU 80 3.953 3.892 10.349 508 HG LEU 80 HG LEU 80 4.698 6.672 9.636 509 HD11 LEU 80 HD11 LEU 80 3.288 6.627 7.636 510 HD12 LEU 80 HD12 LEU 80 3.134 4.876 7.787 511 HD13 LEU 80 HD13 LEU 80 4.707 5.599 7.450 512 HD21 LEU 80 HD21 LEU 80 2.072 5.255 10.064 513 HD22 LEU 80 HD22 LEU 80 2.295 6.993 9.860 514 HD23 LEU 80 HD23 LEU 80 2.957 6.181 11.280 515 H GLY 81 HN GLY 81 7.484 3.183 10.212 516 HA2 GLY 81 HA2 GLY 81 8.702 1.562 11.565 517 HA3 GLY 81 HA1 GLY 81 7.233 1.335 12.502 518 H MET 82 HN MET 82 7.761 1.415 8.990 519 HA MET 82 HA MET 82 6.147 -0.955 8.683 520 HB2 MET 82 HB2 MET 82 7.552 0.875 6.747 521 HB3 MET 82 HB1 MET 82 6.793 -0.621 6.217 522 HG2 MET 82 HG2 MET 82 4.652 0.164 7.100 523 HG3 MET 82 HG1 MET 82 5.415 1.666 7.606 524 HE1 MET 82 HE1 MET 82 2.809 1.179 5.635 525 HE2 MET 82 HE2 MET 82 3.066 2.509 4.505 526 HE3 MET 82 HE3 MET 82 3.314 2.762 6.232 527 H GLU 83 HN GLU 83 6.871 -2.969 8.675 528 HA GLU 83 HA GLU 83 9.756 -3.391 8.224 529 HB2 GLU 83 HB2 GLU 83 7.905 -5.179 9.798 530 HB3 GLU 83 HB1 GLU 83 9.655 -5.280 9.707 531 HG2 GLU 83 HG2 GLU 83 9.659 -2.945 10.752 532 HG3 GLU 83 HG1 GLU 83 7.967 -3.265 11.138 533 H GLU 84 HN GLU 84 10.008 -5.949 7.766 534 HA GLU 84 HA GLU 84 8.793 -6.333 5.184 535 HB2 GLU 84 HB2 GLU 84 11.083 -6.994 5.387 536 HB3 GLU 84 HB1 GLU 84 10.754 -7.927 6.837 537 HG2 GLU 84 HG2 GLU 84 11.095 -9.471 5.099 538 HG3 GLU 84 HG1 GLU 84 9.363 -9.454 5.424 539 H GLU 85 HN GLU 85 7.232 -7.820 4.661 540 HA GLU 85 HA GLU 85 5.478 -9.242 4.908 541 HB2 GLU 85 HB2 GLU 85 7.133 -10.090 7.271 542 HB3 GLU 85 HB1 GLU 85 5.532 -10.765 7.008 543 HG2 GLU 85 HG2 GLU 85 7.610 -10.817 4.856 544 HG3 GLU 85 HG1 GLU 85 7.562 -12.046 6.119 545 H ASP 86 HN ASP 86 5.560 -6.516 6.062 546 HA ASP 86 HA ASP 86 4.012 -6.544 8.459 547 HB2 ASP 86 HB2 ASP 86 5.509 -4.644 7.232 548 HB3 ASP 86 HB1 ASP 86 3.888 -4.131 6.768 549 H VAL 87 HN VAL 87 1.841 -5.516 8.603 550 HA VAL 87 HA VAL 87 0.184 -6.405 6.332 551 HB VAL 87 HB VAL 87 -0.501 -6.367 9.277 552 HG11 VAL 87 HG11 VAL 87 -2.652 -7.271 8.695 553 HG12 VAL 87 HG12 VAL 87 -2.229 -7.280 6.983 554 HG13 VAL 87 HG13 VAL 87 -2.420 -5.748 7.835 555 HG21 VAL 87 HG21 VAL 87 -0.160 -8.663 7.350 556 HG22 VAL 87 HG22 VAL 87 -0.675 -8.798 9.029 557 HG23 VAL 87 HG23 VAL 87 0.945 -8.219 8.651 558 H ILE 88 HN ILE 88 -0.891 -4.883 5.308 559 HA ILE 88 HA ILE 88 -1.644 -2.437 6.761 560 HB ILE 88 HB ILE 88 0.230 -1.896 5.295 561 HG12 ILE 88 HG12 ILE 88 -2.318 -0.841 4.061 562 HG13 ILE 88 HG11 ILE 88 -1.666 -0.272 5.594 563 HG21 ILE 88 HG21 ILE 88 0.034 -2.105 2.848 564 HG22 ILE 88 HG22 ILE 88 -1.473 -2.992 3.067 565 HG23 ILE 88 HG23 ILE 88 0.042 -3.666 3.666 566 HD11 ILE 88 HD11 ILE 88 0.395 0.409 4.399 567 HD12 ILE 88 HD12 ILE 88 -1.056 1.258 3.864 568 HD13 ILE 88 HD13 ILE 88 -0.383 -0.045 2.882 569 H GLU 89 HN GLU 89 -3.699 -1.702 6.415 570 HA GLU 89 HA GLU 89 -5.418 -3.469 4.812 571 HB2 GLU 89 HB2 GLU 89 -6.089 -1.610 7.095 572 HB3 GLU 89 HB1 GLU 89 -7.276 -2.525 6.179 573 HG2 GLU 89 HG2 GLU 89 -6.163 -4.610 6.894 574 HG3 GLU 89 HG1 GLU 89 -5.073 -3.647 7.891 575 H VAL 90 HN VAL 90 -7.163 -2.531 3.607 576 HA VAL 90 HA VAL 90 -6.999 0.310 3.008 577 HB VAL 90 HB VAL 90 -5.430 -0.591 1.403 578 HG11 VAL 90 HG11 VAL 90 -7.623 -2.468 0.527 579 HG12 VAL 90 HG12 VAL 90 -6.148 -2.920 1.384 580 HG13 VAL 90 HG13 VAL 90 -6.053 -2.277 -0.257 581 HG21 VAL 90 HG21 VAL 90 -8.061 0.014 0.069 582 HG22 VAL 90 HG22 VAL 90 -6.472 0.112 -0.688 583 HG23 VAL 90 HG23 VAL 90 -6.888 1.203 0.634 584 H TYR 91 HN TYR 91 -8.998 1.102 2.895 585 HA TYR 91 HA TYR 91 -11.172 -0.643 1.969 586 HB2 TYR 91 HB2 TYR 91 -11.214 1.027 4.494 587 HB3 TYR 91 HB1 TYR 91 -12.627 0.243 3.796 588 HD1 TYR 91 HD1 TYR 91 -12.595 -2.293 3.583 589 HD2 TYR 91 HD2 TYR 91 -9.797 -0.139 5.951 590 HE1 TYR 91 HE1 TYR 91 -12.053 -4.354 4.806 591 HE2 TYR 91 HE2 TYR 91 -9.249 -2.193 7.184 592 HH TYR 91 HH TYR 91 -9.581 -4.363 7.380 593 H GLN 92 HN GLN 92 -13.150 0.584 1.444 594 HA GLN 92 HA GLN 92 -12.465 2.880 -0.135 595 HB2 GLN 92 HB2 GLN 92 -14.110 1.083 -0.808 596 HB3 GLN 92 HB1 GLN 92 -15.218 1.752 0.381 597 HG2 GLN 92 HG2 GLN 92 -14.706 3.983 -0.963 598 HG3 GLN 92 HG1 GLN 92 -14.377 2.822 -2.251 599 HE21 GLN 92 HE21 GLN 92 -16.777 4.272 -0.243 600 HE22 GLN 92 HE22 GLN 92 -18.158 3.576 -1.025 601 H GLU 93 HN GLU 93 -12.889 4.971 0.251 602 HA GLU 93 HA GLU 93 -13.569 5.774 2.913 603 HB2 GLU 93 HB2 GLU 93 -13.015 7.277 0.359 604 HB3 GLU 93 HB1 GLU 93 -13.521 8.103 1.825 605 HG2 GLU 93 HG2 GLU 93 -11.297 6.273 2.251 606 HG3 GLU 93 HG1 GLU 93 -10.940 7.556 1.095 607 H GLN 94 HN GLN 94 -15.341 7.271 3.416 608 HA GLN 94 HA GLN 94 -17.831 6.312 2.443 609 HB2 GLN 94 HB2 GLN 94 -17.354 7.222 4.757 610 HB3 GLN 94 HB1 GLN 94 -17.372 8.828 4.044 611 HG2 GLN 94 HG2 GLN 94 -19.683 8.484 3.324 612 HG3 GLN 94 HG1 GLN 94 -19.661 6.878 4.048 613 HE21 GLN 94 HE21 GLN 94 -19.654 6.675 6.288 614 HE22 GLN 94 HE22 GLN 94 -20.109 7.986 7.321 615 H THR 95 HN THR 95 -15.722 8.848 1.516 616 HA THR 95 HA THR 95 -17.601 10.520 0.192 617 HB THR 95 HB THR 95 -15.420 11.276 -1.021 618 HG1 THR 95 HG1 THR 95 -13.535 10.629 0.162 619 HG21 THR 95 HG21 THR 95 -16.504 12.526 0.796 620 HG22 THR 95 HG22 THR 95 -14.748 12.597 0.923 621 HG23 THR 95 HG23 THR 95 -15.666 11.528 1.982 622 H GLY 96 HN GLY 96 -15.075 8.366 -1.088 623 HA2 GLY 96 HA2 GLY 96 -15.701 6.653 -2.730 624 HA3 GLY 96 HA1 GLY 96 -16.817 7.829 -3.411 625 H GLY 97 HN GLY 97 -14.127 9.473 -2.489 626 HA2 GLY 97 HA2 GLY 97 -11.982 9.165 -3.944 627 HA3 GLY 97 HA1 GLY 97 -13.124 9.516 -5.236 628 H1 ASN 357 HT1 ASN 357 -4.177 -20.189 -4.769 629 H2 ASN 357 HT2 ASN 357 -4.863 -19.965 -3.240 630 H3 ASN 357 HT3 ASN 357 -3.642 -21.115 -3.461 631 HA ASN 357 HA ASN 357 -2.748 -19.193 -2.383 632 HB2 ASN 357 HB2 ASN 357 -0.928 -18.688 -3.935 633 HB3 ASN 357 HB1 ASN 357 -1.311 -20.406 -3.981 634 HD21 ASN 357 HD21 ASN 357 -0.058 -18.513 -5.945 635 HD22 ASN 357 HD22 ASN 357 -0.962 -18.751 -7.402 636 H ASN 358 HN ASN 358 -2.609 -16.994 -2.165 637 HA ASN 358 HA ASN 358 -3.871 -15.329 -4.212 638 HB2 ASN 358 HB2 ASN 358 -5.083 -14.065 -2.409 639 HB3 ASN 358 HB1 ASN 358 -5.693 -15.685 -2.712 640 HD21 ASN 358 HD21 ASN 358 -6.651 -15.749 -0.696 641 HD22 ASN 358 HD22 ASN 358 -5.737 -15.967 0.756 642 H ARG 359 HN ARG 359 -1.139 -15.688 -3.558 643 HA ARG 359 HA ARG 359 -0.465 -13.065 -2.394 644 HB2 ARG 359 HB2 ARG 359 1.086 -15.657 -2.427 645 HB3 ARG 359 HB1 ARG 359 1.814 -14.115 -1.989 646 HG2 ARG 359 HG2 ARG 359 0.434 -13.915 -0.077 647 HG3 ARG 359 HG1 ARG 359 -0.593 -15.248 -0.594 648 HD2 ARG 359 HD2 ARG 359 1.068 -16.845 -0.152 649 HD3 ARG 359 HD1 ARG 359 2.332 -15.622 -0.029 650 HE ARG 359 HE ARG 359 0.953 -14.852 2.004 651 HH11 ARG 359 HH11 ARG 359 1.402 -18.200 0.974 652 HH12 ARG 359 HH12 ARG 359 1.107 -18.862 2.626 653 HH21 ARG 359 HH21 ARG 359 0.572 -15.645 4.079 654 HH22 ARG 359 HH22 ARG 359 0.702 -17.421 4.380 655 H ASP 360 HN ASP 360 -0.447 -11.819 -4.253 656 HA ASP 360 HA ASP 360 1.293 -12.755 -6.419 657 HB2 ASP 360 HB2 ASP 360 0.150 -11.108 -7.863 658 HB3 ASP 360 HB1 ASP 360 -0.954 -12.298 -7.191 659 HA PRO 361 HA PRO 361 4.157 -9.652 -5.066 660 HB2 PRO 361 HB2 PRO 361 6.137 -10.257 -6.780 661 HB3 PRO 361 HB1 PRO 361 5.725 -11.314 -5.423 662 HG2 PRO 361 HG2 PRO 361 5.025 -11.599 -8.303 663 HG3 PRO 361 HG1 PRO 361 5.497 -12.842 -7.130 664 HD2 PRO 361 HD2 PRO 361 2.903 -12.326 -7.886 665 HD3 PRO 361 HD1 PRO 361 3.374 -13.095 -6.357 666 H ILE 362 HN ILE 362 3.599 -7.621 -5.578 667 HA ILE 362 HA ILE 362 3.518 -6.844 -8.408 668 HB ILE 362 HB ILE 362 2.560 -5.202 -6.065 669 HG12 ILE 362 HG12 ILE 362 0.924 -6.953 -7.910 670 HG13 ILE 362 HG11 ILE 362 1.325 -7.351 -6.243 671 HG21 ILE 362 HG21 ILE 362 1.300 -3.991 -7.795 672 HG22 ILE 362 HG22 ILE 362 2.042 -5.003 -9.033 673 HG23 ILE 362 HG23 ILE 362 3.041 -3.914 -8.069 674 HD11 ILE 362 HD11 ILE 362 -0.928 -6.485 -6.410 675 HD12 ILE 362 HD12 ILE 362 -0.321 -5.009 -7.162 676 HD13 ILE 362 HD13 ILE 362 0.092 -5.378 -5.488 677 H VAL 363 HN VAL 363 5.212 -5.864 -9.235 678 HA VAL 363 HA VAL 363 6.911 -4.227 -7.468 679 HB VAL 363 HB VAL 363 7.930 -5.560 -9.968 680 HG11 VAL 363 HG11 VAL 363 9.224 -3.698 -9.029 681 HG12 VAL 363 HG12 VAL 363 10.104 -5.225 -8.941 682 HG13 VAL 363 HG13 VAL 363 9.340 -4.563 -7.495 683 HG21 VAL 363 HG21 VAL 363 8.024 -6.708 -7.179 684 HG22 VAL 363 HG22 VAL 363 8.851 -7.359 -8.592 685 HG23 VAL 363 HG23 VAL 363 7.090 -7.347 -8.531 686 H ILE 364 HN ILE 364 6.596 -2.139 -7.933 687 HA ILE 364 HA ILE 364 5.987 -1.416 -10.716 688 HB ILE 364 HB ILE 364 5.059 0.674 -9.887 689 HG12 ILE 364 HG12 ILE 364 4.803 0.199 -7.108 690 HG13 ILE 364 HG11 ILE 364 6.505 -0.018 -7.504 691 HG21 ILE 364 HG21 ILE 364 3.107 -0.223 -8.685 692 HG22 ILE 364 HG22 ILE 364 3.969 -1.744 -8.458 693 HG23 ILE 364 HG23 ILE 364 3.552 -1.200 -10.084 694 HD11 ILE 364 HD11 ILE 364 6.470 2.204 -8.603 695 HD12 ILE 364 HD12 ILE 364 6.143 2.250 -6.871 696 HD13 ILE 364 HD13 ILE 364 4.817 2.412 -8.022 697 H SER 365 HN SER 365 6.893 0.572 -11.552 698 HA SER 365 HA SER 365 9.574 1.100 -10.447 699 HB2 SER 365 HB2 SER 365 8.768 1.469 -13.337 700 HB3 SER 365 HB1 SER 365 10.397 1.401 -12.659 701 HG SER 365 HG SER 365 9.695 -0.830 -11.985 702 H ASP 366 HN ASP 366 10.326 3.250 -10.484 703 HA ASP 366 HA ASP 366 8.190 5.250 -10.812 704 HB2 ASP 366 HB2 ASP 366 8.987 5.000 -8.473 705 HB3 ASP 366 HB1 ASP 366 10.614 5.413 -9.006 706 H SER 367 HN SER 367 8.842 7.336 -11.629 707 HA SER 367 HA SER 367 11.380 7.334 -13.084 708 HB2 SER 367 HB2 SER 367 9.884 8.515 -14.958 709 HB3 SER 367 HB1 SER 367 10.120 6.768 -14.915 710 HG SER 367 HG SER 367 8.036 7.643 -13.354 711 HA PRO 368 HA PRO 368 11.812 11.395 -11.429 712 HB2 PRO 368 HB2 PRO 368 13.185 12.529 -13.563 713 HB3 PRO 368 HB1 PRO 368 13.926 11.604 -12.254 714 HG2 PRO 368 HG2 PRO 368 13.203 10.721 -14.997 715 HG3 PRO 368 HG1 PRO 368 14.597 10.270 -13.996 716 HD2 PRO 368 HD2 PRO 368 12.512 8.619 -14.320 717 HD3 PRO 368 HD1 PRO 368 13.398 8.716 -12.784 Start of MODEL 20 1 H TYR 21 HT1 TYR 21 15.017 -4.190 -0.440 2 HA TYR 21 HA TYR 21 13.158 -3.262 -1.576 3 HB2 TYR 21 HB2 TYR 21 13.061 -6.002 -2.794 4 HB3 TYR 21 HB1 TYR 21 11.576 -5.072 -2.629 5 HD1 TYR 21 HD1 TYR 21 11.651 -2.646 -3.615 6 HD2 TYR 21 HD2 TYR 21 14.363 -5.739 -4.688 7 HE1 TYR 21 HE1 TYR 21 12.153 -1.466 -5.715 8 HE2 TYR 21 HE2 TYR 21 14.876 -4.571 -6.787 9 HH TYR 21 HH TYR 21 13.844 -2.929 -8.285 10 H ILE 22 HN ILE 22 11.102 -3.224 -0.575 11 HA ILE 22 HA ILE 22 10.862 -5.094 1.696 12 HB ILE 22 HB ILE 22 9.957 -2.212 1.503 13 HG12 ILE 22 HG12 ILE 22 12.366 -2.510 1.924 14 HG13 ILE 22 HG11 ILE 22 11.548 -1.834 3.328 15 HG21 ILE 22 HG21 ILE 22 8.283 -3.430 2.715 16 HG22 ILE 22 HG22 ILE 22 9.247 -2.511 3.873 17 HG23 ILE 22 HG23 ILE 22 9.509 -4.246 3.685 18 HD11 ILE 22 HD11 ILE 22 13.091 -3.446 4.111 19 HD12 ILE 22 HD12 ILE 22 12.535 -4.647 2.948 20 HD13 ILE 22 HD13 ILE 22 11.487 -4.156 4.279 21 H LYS 23 HN LYS 23 9.138 -6.382 1.691 22 HA LYS 23 HA LYS 23 6.936 -5.729 -0.154 23 HB2 LYS 23 HB2 LYS 23 8.239 -7.848 -0.504 24 HB3 LYS 23 HB1 LYS 23 7.625 -8.410 1.042 25 HG2 LYS 23 HG2 LYS 23 5.307 -7.799 -0.110 26 HG3 LYS 23 HG1 LYS 23 6.257 -8.144 -1.560 27 HD2 LYS 23 HD2 LYS 23 5.327 -10.210 -0.962 28 HD3 LYS 23 HD1 LYS 23 6.983 -10.275 -0.361 29 HE2 LYS 23 HE2 LYS 23 5.213 -9.141 1.613 30 HE3 LYS 23 HE1 LYS 23 4.638 -10.722 1.087 31 HZ1 LYS 23 HZ1 LYS 23 6.081 -11.063 2.899 32 HZ2 LYS 23 HZ2 LYS 23 7.285 -10.058 2.247 33 HZ3 LYS 23 HZ3 LYS 23 6.936 -11.547 1.516 34 H LEU 24 HN LEU 24 5.056 -5.163 0.680 35 HA LEU 24 HA LEU 24 4.572 -5.686 3.534 36 HB2 LEU 24 HB2 LEU 24 3.262 -3.647 1.735 37 HB3 LEU 24 HB1 LEU 24 3.017 -3.814 3.461 38 HG LEU 24 HG LEU 24 5.677 -3.106 2.227 39 HD11 LEU 24 HD11 LEU 24 4.060 -1.362 1.713 40 HD12 LEU 24 HD12 LEU 24 5.207 -0.809 2.932 41 HD13 LEU 24 HD13 LEU 24 3.580 -1.292 3.408 42 HD21 LEU 24 HD21 LEU 24 5.827 -4.100 4.437 43 HD22 LEU 24 HD22 LEU 24 4.638 -2.952 5.050 44 HD23 LEU 24 HD23 LEU 24 6.215 -2.380 4.507 45 H LYS 25 HN LYS 25 2.532 -6.423 4.227 46 HA LYS 25 HA LYS 25 1.113 -7.985 2.192 47 HB2 LYS 25 HB2 LYS 25 0.798 -8.089 5.197 48 HB3 LYS 25 HB1 LYS 25 0.167 -9.241 4.032 49 HG2 LYS 25 HG2 LYS 25 2.182 -10.261 3.729 50 HG3 LYS 25 HG1 LYS 25 3.101 -8.802 4.108 51 HD2 LYS 25 HD2 LYS 25 3.478 -10.166 5.952 52 HD3 LYS 25 HD1 LYS 25 2.180 -9.104 6.496 53 HE2 LYS 25 HE2 LYS 25 1.601 -11.297 7.181 54 HE3 LYS 25 HE1 LYS 25 0.568 -10.909 5.805 55 HZ1 LYS 25 HZ1 LYS 25 1.808 -12.284 4.401 56 HZ2 LYS 25 HZ2 LYS 25 1.643 -13.177 5.834 57 HZ3 LYS 25 HZ3 LYS 25 3.110 -12.395 5.491 58 H VAL 26 HN VAL 26 -0.284 -6.571 1.218 59 HA VAL 26 HA VAL 26 -1.914 -4.812 2.871 60 HB VAL 26 HB VAL 26 -2.195 -5.117 -0.104 61 HG11 VAL 26 HG11 VAL 26 -2.978 -2.841 -0.015 62 HG12 VAL 26 HG12 VAL 26 -2.606 -2.748 1.705 63 HG13 VAL 26 HG13 VAL 26 -3.885 -3.820 1.137 64 HG21 VAL 26 HG21 VAL 26 -0.189 -3.382 1.331 65 HG22 VAL 26 HG22 VAL 26 -0.546 -3.325 -0.394 66 HG23 VAL 26 HG23 VAL 26 0.180 -4.769 0.309 67 H ILE 27 HN ILE 27 -3.639 -5.620 3.796 68 HA ILE 27 HA ILE 27 -5.004 -7.921 2.646 69 HB ILE 27 HB ILE 27 -5.642 -6.464 5.216 70 HG12 ILE 27 HG12 ILE 27 -3.333 -7.265 5.287 71 HG13 ILE 27 HG11 ILE 27 -4.347 -8.233 6.351 72 HG21 ILE 27 HG21 ILE 27 -6.779 -8.519 5.841 73 HG22 ILE 27 HG22 ILE 27 -6.335 -9.253 4.300 74 HG23 ILE 27 HG23 ILE 27 -7.441 -7.880 4.335 75 HD11 ILE 27 HD11 ILE 27 -4.463 -9.952 4.565 76 HD12 ILE 27 HD12 ILE 27 -2.837 -9.676 5.190 77 HD13 ILE 27 HD13 ILE 27 -3.312 -8.996 3.633 78 H GLY 28 HN GLY 28 -6.586 -7.611 1.237 79 HA2 GLY 28 HA2 GLY 28 -7.989 -5.050 1.174 80 HA3 GLY 28 HA1 GLY 28 -8.034 -6.290 -0.067 81 H GLN 29 HN GLN 29 -10.334 -5.071 0.698 82 HA GLN 29 HA GLN 29 -11.760 -6.369 2.764 83 HB2 GLN 29 HB2 GLN 29 -12.446 -4.205 1.853 84 HB3 GLN 29 HB1 GLN 29 -12.765 -4.943 0.292 85 HG2 GLN 29 HG2 GLN 29 -14.844 -4.592 1.401 86 HG3 GLN 29 HG1 GLN 29 -14.524 -6.327 1.359 87 HE21 GLN 29 HE21 GLN 29 -13.935 -7.384 3.278 88 HE22 GLN 29 HE22 GLN 29 -14.269 -6.696 4.828 89 H ASP 30 HN ASP 30 -10.932 -7.307 -0.424 90 HA ASP 30 HA ASP 30 -13.023 -9.293 -0.687 91 HB2 ASP 30 HB2 ASP 30 -11.804 -9.896 -2.786 92 HB3 ASP 30 HB1 ASP 30 -12.296 -8.209 -2.709 93 H SER 31 HN SER 31 -10.686 -9.216 1.370 94 HA SER 31 HA SER 31 -9.455 -10.693 2.555 95 HB2 SER 31 HB2 SER 31 -11.163 -12.784 1.190 96 HB3 SER 31 HB1 SER 31 -10.271 -12.980 2.700 97 HG SER 31 HG SER 31 -11.644 -10.985 3.290 98 H SER 32 HN SER 32 -7.888 -9.840 0.779 99 HA SER 32 HA SER 32 -6.543 -12.204 -0.321 100 HB2 SER 32 HB2 SER 32 -5.850 -10.648 -2.247 101 HB3 SER 32 HB1 SER 32 -7.509 -11.247 -2.253 102 HG SER 32 HG SER 32 -8.096 -9.241 -2.269 103 H GLU 33 HN GLU 33 -4.249 -11.997 -0.496 104 HA GLU 33 HA GLU 33 -3.156 -9.932 1.293 105 HB2 GLU 33 HB2 GLU 33 -2.946 -12.441 1.876 106 HB3 GLU 33 HB1 GLU 33 -1.768 -12.510 0.573 107 HG2 GLU 33 HG2 GLU 33 -0.521 -10.673 1.752 108 HG3 GLU 33 HG1 GLU 33 -1.615 -10.909 3.113 109 H ILE 34 HN ILE 34 -2.872 -8.350 -0.294 110 HA ILE 34 HA ILE 34 -1.507 -8.945 -2.751 111 HB ILE 34 HB ILE 34 -2.159 -6.287 -1.479 112 HG12 ILE 34 HG12 ILE 34 -4.136 -7.576 -2.141 113 HG13 ILE 34 HG11 ILE 34 -3.927 -6.171 -3.182 114 HG21 ILE 34 HG21 ILE 34 -0.286 -5.937 -2.898 115 HG22 ILE 34 HG22 ILE 34 -1.711 -5.376 -3.773 116 HG23 ILE 34 HG23 ILE 34 -0.990 -6.934 -4.172 117 HD11 ILE 34 HD11 ILE 34 -4.540 -7.962 -4.581 118 HD12 ILE 34 HD12 ILE 34 -3.380 -9.052 -3.823 119 HD13 ILE 34 HD13 ILE 34 -2.810 -7.721 -4.833 120 H HIS 35 HN HIS 35 0.574 -9.209 -2.974 121 HA HIS 35 HA HIS 35 2.379 -8.385 -0.832 122 HB2 HIS 35 HB2 HIS 35 2.491 -10.413 -3.029 123 HB3 HIS 35 HB1 HIS 35 3.997 -9.809 -2.345 124 HD2 HIS 35 HD2 HIS 35 1.280 -10.124 0.290 125 HE1 HIS 35 HE1 HIS 35 3.652 -13.620 0.499 126 HE2 HIS 35 HE2 HIS 35 1.942 -12.189 1.711 127 H PHE 36 HN PHE 36 2.048 -6.127 -1.586 128 HA PHE 36 HA PHE 36 3.217 -5.381 -4.106 129 HB2 PHE 36 HB2 PHE 36 1.378 -4.179 -2.552 130 HB3 PHE 36 HB1 PHE 36 2.819 -3.329 -1.999 131 HD1 PHE 36 HD1 PHE 36 0.259 -3.384 -4.400 132 HD2 PHE 36 HD2 PHE 36 4.369 -2.400 -3.908 133 HE1 PHE 36 HE1 PHE 36 0.141 -1.929 -6.380 134 HE2 PHE 36 HE2 PHE 36 4.258 -0.940 -5.886 135 HZ PHE 36 HZ PHE 36 2.143 -0.702 -7.121 136 H LYS 37 HN LYS 37 5.300 -5.216 -4.485 137 HA LYS 37 HA LYS 37 7.154 -5.053 -2.228 138 HB2 LYS 37 HB2 LYS 37 7.375 -6.674 -4.223 139 HB3 LYS 37 HB1 LYS 37 7.914 -5.269 -5.132 140 HG2 LYS 37 HG2 LYS 37 9.906 -5.162 -4.068 141 HG3 LYS 37 HG1 LYS 37 9.255 -5.779 -2.548 142 HD2 LYS 37 HD2 LYS 37 9.554 -7.517 -4.983 143 HD3 LYS 37 HD1 LYS 37 10.862 -7.295 -3.823 144 HE2 LYS 37 HE2 LYS 37 9.452 -8.155 -2.039 145 HE3 LYS 37 HE1 LYS 37 8.103 -8.318 -3.162 146 HZ1 LYS 37 HZ1 LYS 37 9.559 -9.885 -4.442 147 HZ2 LYS 37 HZ2 LYS 37 9.064 -10.441 -2.930 148 HZ3 LYS 37 HZ3 LYS 37 10.635 -9.854 -3.139 149 H VAL 38 HN VAL 38 7.711 -3.110 -1.535 150 HA VAL 38 HA VAL 38 7.625 -0.858 -3.412 151 HB VAL 38 HB VAL 38 7.419 0.609 -1.547 152 HG11 VAL 38 HG11 VAL 38 5.716 -1.820 -1.006 153 HG12 VAL 38 HG12 VAL 38 5.378 -0.581 -2.214 154 HG13 VAL 38 HG13 VAL 38 5.372 -0.165 -0.499 155 HG21 VAL 38 HG21 VAL 38 7.907 -1.767 0.253 156 HG22 VAL 38 HG22 VAL 38 7.521 -0.128 0.780 157 HG23 VAL 38 HG23 VAL 38 9.042 -0.450 -0.051 158 H LYS 39 HN LYS 39 9.262 0.780 -3.285 159 HA LYS 39 HA LYS 39 11.917 -0.363 -2.814 160 HB2 LYS 39 HB2 LYS 39 11.255 0.537 -5.095 161 HB3 LYS 39 HB1 LYS 39 11.221 2.137 -4.366 162 HG2 LYS 39 HG2 LYS 39 13.515 2.195 -4.072 163 HG3 LYS 39 HG1 LYS 39 13.671 0.439 -4.168 164 HD2 LYS 39 HD2 LYS 39 13.208 0.471 -6.525 165 HD3 LYS 39 HD1 LYS 39 12.842 2.197 -6.473 166 HE2 LYS 39 HE2 LYS 39 15.524 1.093 -5.687 167 HE3 LYS 39 HE1 LYS 39 15.138 1.513 -7.354 168 HZ1 LYS 39 HZ1 LYS 39 16.204 3.366 -6.377 169 HZ2 LYS 39 HZ2 LYS 39 15.210 3.326 -5.013 170 HZ3 LYS 39 HZ3 LYS 39 14.563 3.779 -6.514 171 H MET 40 HN MET 40 13.036 0.307 -1.093 172 HA MET 40 HA MET 40 12.001 2.349 0.620 173 HB2 MET 40 HB2 MET 40 13.087 0.410 1.589 174 HB3 MET 40 HB1 MET 40 14.578 0.780 0.738 175 HG2 MET 40 HG2 MET 40 14.718 1.408 3.077 176 HG3 MET 40 HG1 MET 40 14.828 2.823 2.031 177 HE1 MET 40 HE1 MET 40 12.804 0.773 4.517 178 HE2 MET 40 HE2 MET 40 11.580 0.767 3.248 179 HE3 MET 40 HE3 MET 40 11.305 1.671 4.740 180 H THR 41 HN THR 41 12.023 4.235 -0.536 181 HA THR 41 HA THR 41 14.034 6.021 -0.179 182 HB THR 41 HB THR 41 15.204 4.379 -1.882 183 HG1 THR 41 HG1 THR 41 15.303 7.159 -1.629 184 HG21 THR 41 HG21 THR 41 13.448 4.466 -3.592 185 HG22 THR 41 HG22 THR 41 14.978 5.082 -4.211 186 HG23 THR 41 HG23 THR 41 13.698 6.205 -3.759 187 H THR 42 HN THR 42 11.403 4.873 -2.119 188 HA THR 42 HA THR 42 10.701 7.581 -2.963 189 HB THR 42 HB THR 42 9.032 5.232 -3.713 190 HG1 THR 42 HG1 THR 42 10.936 5.262 -5.516 191 HG21 THR 42 HG21 THR 42 8.482 7.425 -4.589 192 HG22 THR 42 HG22 THR 42 9.054 6.395 -5.902 193 HG23 THR 42 HG23 THR 42 10.118 7.621 -5.212 194 H HIS 43 HN HIS 43 8.678 8.500 -2.470 195 HA HIS 43 HA HIS 43 7.647 7.905 0.110 196 HB2 HIS 43 HB2 HIS 43 6.924 9.808 -2.078 197 HB3 HIS 43 HB1 HIS 43 5.741 9.505 -0.809 198 HD2 HIS 43 HD2 HIS 43 7.168 9.818 1.874 199 HE1 HIS 43 HE1 HIS 43 9.213 13.139 0.237 200 HE2 HIS 43 HE2 HIS 43 8.740 11.827 2.353 201 H LEU 44 HN LEU 44 5.493 7.241 0.644 202 HA LEU 44 HA LEU 44 4.658 4.948 -0.777 203 HB2 LEU 44 HB2 LEU 44 3.409 6.536 1.445 204 HB3 LEU 44 HB1 LEU 44 2.632 5.118 0.765 205 HG LEU 44 HG LEU 44 5.348 5.153 2.093 206 HD11 LEU 44 HD11 LEU 44 2.747 3.994 3.074 207 HD12 LEU 44 HD12 LEU 44 3.448 5.510 3.634 208 HD13 LEU 44 HD13 LEU 44 4.296 3.991 3.916 209 HD21 LEU 44 HD21 LEU 44 4.986 2.646 2.021 210 HD22 LEU 44 HD22 LEU 44 5.374 3.427 0.488 211 HD23 LEU 44 HD23 LEU 44 3.710 2.962 0.847 212 H LYS 45 HN LYS 45 4.079 8.206 -1.335 213 HA LYS 45 HA LYS 45 1.482 8.364 -2.273 214 HB2 LYS 45 HB2 LYS 45 2.909 10.324 -2.075 215 HB3 LYS 45 HB1 LYS 45 3.992 9.700 -3.309 216 HG2 LYS 45 HG2 LYS 45 2.815 11.164 -4.573 217 HG3 LYS 45 HG1 LYS 45 1.773 9.751 -4.757 218 HD2 LYS 45 HD2 LYS 45 0.352 10.566 -2.943 219 HD3 LYS 45 HD1 LYS 45 1.407 11.965 -2.744 220 HE2 LYS 45 HE2 LYS 45 0.897 12.637 -5.065 221 HE3 LYS 45 HE1 LYS 45 -0.230 11.287 -5.185 222 HZ1 LYS 45 HZ1 LYS 45 -1.499 13.189 -4.648 223 HZ2 LYS 45 HZ2 LYS 45 -0.432 13.664 -3.428 224 HZ3 LYS 45 HZ3 LYS 45 -1.398 12.288 -3.213 225 H LYS 46 HN LYS 46 4.424 7.451 -4.036 226 HA LYS 46 HA LYS 46 3.143 6.965 -6.509 227 HB2 LYS 46 HB2 LYS 46 5.546 7.447 -6.308 228 HB3 LYS 46 HB1 LYS 46 5.783 5.924 -5.464 229 HG2 LYS 46 HG2 LYS 46 6.481 5.686 -7.747 230 HG3 LYS 46 HG1 LYS 46 5.027 4.722 -7.481 231 HD2 LYS 46 HD2 LYS 46 3.775 6.822 -8.346 232 HD3 LYS 46 HD1 LYS 46 5.345 7.284 -9.003 233 HE2 LYS 46 HE2 LYS 46 5.449 5.341 -10.352 234 HE3 LYS 46 HE1 LYS 46 4.089 4.603 -9.510 235 HZ1 LYS 46 HZ1 LYS 46 4.044 6.881 -11.392 236 HZ2 LYS 46 HZ2 LYS 46 2.735 6.527 -10.379 237 HZ3 LYS 46 HZ3 LYS 46 3.250 5.395 -11.535 238 H LEU 47 HN LEU 47 3.737 4.981 -3.699 239 HA LEU 47 HA LEU 47 3.156 2.498 -5.004 240 HB2 LEU 47 HB2 LEU 47 3.415 3.305 -2.115 241 HB3 LEU 47 HB1 LEU 47 2.944 1.683 -2.584 242 HG LEU 47 HG LEU 47 5.223 1.478 -2.194 243 HD11 LEU 47 HD11 LEU 47 6.268 1.047 -4.303 244 HD12 LEU 47 HD12 LEU 47 5.141 2.118 -5.131 245 HD13 LEU 47 HD13 LEU 47 4.563 0.614 -4.418 246 HD21 LEU 47 HD21 LEU 47 5.562 4.143 -3.544 247 HD22 LEU 47 HD22 LEU 47 6.906 3.088 -3.110 248 HD23 LEU 47 HD23 LEU 47 5.854 3.738 -1.853 249 H LYS 48 HN LYS 48 1.355 4.780 -3.011 250 HA LYS 48 HA LYS 48 -0.985 3.242 -2.719 251 HB2 LYS 48 HB2 LYS 48 -0.549 6.226 -2.628 252 HB3 LYS 48 HB1 LYS 48 -2.078 5.456 -2.225 253 HG2 LYS 48 HG2 LYS 48 -1.114 4.335 -0.362 254 HG3 LYS 48 HG1 LYS 48 0.515 4.811 -0.846 255 HD2 LYS 48 HD2 LYS 48 -0.011 6.293 0.879 256 HD3 LYS 48 HD1 LYS 48 -0.324 7.224 -0.585 257 HE2 LYS 48 HE2 LYS 48 -2.719 6.648 -0.395 258 HE3 LYS 48 HE1 LYS 48 -2.374 5.802 1.114 259 HZ1 LYS 48 HZ1 LYS 48 -1.375 8.037 1.828 260 HZ2 LYS 48 HZ2 LYS 48 -3.059 7.880 1.807 261 HZ3 LYS 48 HZ3 LYS 48 -2.268 8.698 0.544 262 H GLU 49 HN GLU 49 -0.098 5.698 -5.145 263 HA GLU 49 HA GLU 49 -2.600 5.612 -6.476 264 HB2 GLU 49 HB2 GLU 49 -1.415 6.719 -8.357 265 HB3 GLU 49 HB1 GLU 49 -1.171 7.518 -6.813 266 HG2 GLU 49 HG2 GLU 49 1.034 6.629 -6.622 267 HG3 GLU 49 HG1 GLU 49 0.795 5.596 -8.032 268 H SER 50 HN SER 50 0.406 3.810 -6.898 269 HA SER 50 HA SER 50 -0.328 2.527 -9.303 270 HB2 SER 50 HB2 SER 50 1.579 1.600 -7.147 271 HB3 SER 50 HB1 SER 50 1.486 0.954 -8.786 272 HG SER 50 HG SER 50 2.437 3.436 -7.885 273 H TYR 51 HN TYR 51 -0.921 1.786 -5.917 274 HA TYR 51 HA TYR 51 -1.876 -0.844 -6.257 275 HB2 TYR 51 HB2 TYR 51 -1.311 0.195 -4.051 276 HB3 TYR 51 HB1 TYR 51 -2.773 1.167 -4.178 277 HD1 TYR 51 HD1 TYR 51 -1.484 -2.269 -3.784 278 HD2 TYR 51 HD2 TYR 51 -4.924 0.236 -3.682 279 HE1 TYR 51 HE1 TYR 51 -2.773 -4.085 -2.741 280 HE2 TYR 51 HE2 TYR 51 -6.219 -1.574 -2.638 281 HH TYR 51 HH TYR 51 -6.040 -4.192 -2.607 282 H CYS 52 HN CYS 52 -3.468 2.307 -6.336 283 HA CYS 52 HA CYS 52 -6.106 1.389 -6.679 284 HB2 CYS 52 HB2 CYS 52 -4.937 3.977 -7.727 285 HB3 CYS 52 HB1 CYS 52 -6.627 3.649 -7.356 286 HG CYS 52 HG CYS 52 -4.122 3.766 -5.019 287 H GLN 53 HN GLN 53 -3.560 2.255 -8.974 288 HA GLN 53 HA GLN 53 -5.035 1.977 -11.346 289 HB2 GLN 53 HB2 GLN 53 -2.079 1.541 -10.855 290 HB3 GLN 53 HB1 GLN 53 -2.822 1.680 -12.441 291 HG2 GLN 53 HG2 GLN 53 -3.475 3.952 -11.988 292 HG3 GLN 53 HG1 GLN 53 -2.885 3.825 -10.333 293 HE21 GLN 53 HE21 GLN 53 -2.116 5.685 -12.428 294 HE22 GLN 53 HE22 GLN 53 -0.416 5.486 -12.656 295 H ARG 54 HN ARG 54 -3.084 -0.361 -9.526 296 HA ARG 54 HA ARG 54 -3.386 -2.525 -11.314 297 HB2 ARG 54 HB2 ARG 54 -1.646 -2.758 -9.763 298 HB3 ARG 54 HB1 ARG 54 -2.662 -2.296 -8.406 299 HG2 ARG 54 HG2 ARG 54 -2.256 -4.597 -8.161 300 HG3 ARG 54 HG1 ARG 54 -3.909 -4.463 -8.763 301 HD2 ARG 54 HD2 ARG 54 -2.845 -4.763 -11.094 302 HD3 ARG 54 HD1 ARG 54 -1.437 -5.354 -10.210 303 HE ARG 54 HE ARG 54 -4.097 -6.603 -10.294 304 HH11 ARG 54 HH11 ARG 54 -0.675 -6.756 -9.460 305 HH12 ARG 54 HH12 ARG 54 -0.764 -8.491 -8.947 306 HH21 ARG 54 HH21 ARG 54 -4.210 -8.819 -9.708 307 HH22 ARG 54 HH22 ARG 54 -2.704 -9.633 -9.135 308 H GLN 55 HN GLN 55 -5.265 -1.539 -8.467 309 HA GLN 55 HA GLN 55 -7.003 -3.776 -8.515 310 HB2 GLN 55 HB2 GLN 55 -7.380 -1.029 -7.316 311 HB3 GLN 55 HB1 GLN 55 -8.467 -2.385 -7.051 312 HG2 GLN 55 HG2 GLN 55 -5.582 -2.182 -6.220 313 HG3 GLN 55 HG1 GLN 55 -6.998 -2.180 -5.173 314 HE21 GLN 55 HE21 GLN 55 -8.094 -4.104 -4.796 315 HE22 GLN 55 HE22 GLN 55 -7.382 -5.645 -5.130 316 H GLY 56 HN GLY 56 -7.115 -0.594 -10.001 317 HA2 GLY 56 HA2 GLY 56 -8.214 -0.280 -12.109 318 HA3 GLY 56 HA1 GLY 56 -9.361 -1.535 -11.656 319 H VAL 57 HN VAL 57 -8.386 0.930 -9.416 320 HA VAL 57 HA VAL 57 -10.998 2.253 -9.736 321 HB VAL 57 HB VAL 57 -10.963 2.610 -7.235 322 HG11 VAL 57 HG11 VAL 57 -11.780 0.335 -6.708 323 HG12 VAL 57 HG12 VAL 57 -11.159 -0.217 -8.261 324 HG13 VAL 57 HG13 VAL 57 -12.453 0.979 -8.204 325 HG21 VAL 57 HG21 VAL 57 -8.875 0.435 -7.299 326 HG22 VAL 57 HG22 VAL 57 -9.600 1.155 -5.862 327 HG23 VAL 57 HG23 VAL 57 -8.567 2.127 -6.909 328 HA PRO 58 HA PRO 58 -8.711 6.032 -9.779 329 HB2 PRO 58 HB2 PRO 58 -10.406 7.750 -8.532 330 HB3 PRO 58 HB1 PRO 58 -10.700 7.135 -10.165 331 HG2 PRO 58 HG2 PRO 58 -11.878 6.227 -7.581 332 HG3 PRO 58 HG1 PRO 58 -12.663 6.459 -9.157 333 HD2 PRO 58 HD2 PRO 58 -11.936 4.021 -8.247 334 HD3 PRO 58 HD1 PRO 58 -11.937 4.439 -9.971 335 H MET 59 HN MET 59 -7.503 7.482 -8.449 336 HA MET 59 HA MET 59 -6.676 6.358 -5.977 337 HB2 MET 59 HB2 MET 59 -5.278 7.762 -7.573 338 HB3 MET 59 HB1 MET 59 -6.098 9.169 -6.912 339 HG2 MET 59 HG2 MET 59 -5.228 8.690 -4.712 340 HG3 MET 59 HG1 MET 59 -4.490 7.201 -5.300 341 HE1 MET 59 HE1 MET 59 -1.380 9.453 -4.589 342 HE2 MET 59 HE2 MET 59 -2.127 7.877 -4.323 343 HE3 MET 59 HE3 MET 59 -2.873 9.328 -3.656 344 H ASN 60 HN ASN 60 -6.880 7.166 -3.884 345 HA ASN 60 HA ASN 60 -7.737 8.277 -2.094 346 HB2 ASN 60 HB2 ASN 60 -7.833 10.272 -3.824 347 HB3 ASN 60 HB1 ASN 60 -9.566 9.984 -3.726 348 HD21 ASN 60 HD21 ASN 60 -10.665 10.487 -1.842 349 HD22 ASN 60 HD22 ASN 60 -9.934 11.374 -0.547 350 H SER 61 HN SER 61 -9.367 6.354 -4.187 351 HA SER 61 HA SER 61 -11.969 6.546 -2.952 352 HB2 SER 61 HB2 SER 61 -12.525 4.575 -4.344 353 HB3 SER 61 HB1 SER 61 -11.817 5.877 -5.300 354 HG SER 61 HG SER 61 -10.104 4.683 -5.687 355 H LEU 62 HN LEU 62 -9.040 4.812 -2.499 356 HA LEU 62 HA LEU 62 -10.293 3.191 -0.386 357 HB2 LEU 62 HB2 LEU 62 -7.796 2.535 -1.958 358 HB3 LEU 62 HB1 LEU 62 -8.555 1.525 -0.744 359 HG LEU 62 HG LEU 62 -9.840 2.269 -3.372 360 HD11 LEU 62 HD11 LEU 62 -9.340 -0.063 -4.014 361 HD12 LEU 62 HD12 LEU 62 -8.369 -0.229 -2.550 362 HD13 LEU 62 HD13 LEU 62 -7.891 0.922 -3.800 363 HD21 LEU 62 HD21 LEU 62 -11.477 1.744 -1.695 364 HD22 LEU 62 HD22 LEU 62 -10.587 0.297 -1.215 365 HD23 LEU 62 HD23 LEU 62 -11.345 0.382 -2.807 366 H ARG 63 HN ARG 63 -9.268 3.103 1.597 367 HA ARG 63 HA ARG 63 -7.017 4.972 1.945 368 HB2 ARG 63 HB2 ARG 63 -7.824 5.462 4.172 369 HB3 ARG 63 HB1 ARG 63 -9.109 5.751 3.013 370 HG2 ARG 63 HG2 ARG 63 -10.257 3.775 3.656 371 HG3 ARG 63 HG1 ARG 63 -8.883 3.215 4.611 372 HD2 ARG 63 HD2 ARG 63 -9.170 5.058 6.158 373 HD3 ARG 63 HD1 ARG 63 -10.485 5.706 5.179 374 HE ARG 63 HE ARG 63 -10.575 3.362 6.922 375 HH11 ARG 63 HH11 ARG 63 -13.832 4.839 5.020 376 HH12 ARG 63 HH12 ARG 63 -12.194 5.511 4.636 377 HH21 ARG 63 HH21 ARG 63 -12.639 2.573 7.483 378 HH22 ARG 63 HH22 ARG 63 -14.082 3.225 6.616 379 H PHE 64 HN PHE 64 -5.256 4.288 2.999 380 HA PHE 64 HA PHE 64 -5.102 1.446 3.642 381 HB2 PHE 64 HB2 PHE 64 -3.001 3.577 3.234 382 HB3 PHE 64 HB1 PHE 64 -2.617 1.963 3.817 383 HD1 PHE 64 HD1 PHE 64 -3.789 3.925 0.951 384 HD2 PHE 64 HD2 PHE 64 -2.636 0.074 2.346 385 HE1 PHE 64 HE1 PHE 64 -3.643 3.131 -1.371 386 HE2 PHE 64 HE2 PHE 64 -2.488 -0.725 0.023 387 HZ PHE 64 HZ PHE 64 -2.991 0.805 -1.839 388 H LEU 65 HN LEU 65 -5.129 0.741 5.664 389 HA LEU 65 HA LEU 65 -4.790 2.713 7.820 390 HB2 LEU 65 HB2 LEU 65 -6.298 0.102 7.805 391 HB3 LEU 65 HB1 LEU 65 -6.123 1.150 9.200 392 HG LEU 65 HG LEU 65 -7.470 2.002 6.636 393 HD11 LEU 65 HD11 LEU 65 -9.574 1.580 7.668 394 HD12 LEU 65 HD12 LEU 65 -8.808 1.150 9.195 395 HD13 LEU 65 HD13 LEU 65 -8.625 0.099 7.792 396 HD21 LEU 65 HD21 LEU 65 -8.395 3.772 8.102 397 HD22 LEU 65 HD22 LEU 65 -6.642 3.856 7.926 398 HD23 LEU 65 HD23 LEU 65 -7.350 3.195 9.402 399 H PHE 66 HN PHE 66 -2.983 2.596 8.876 400 HA PHE 66 HA PHE 66 -1.728 -0.025 9.353 401 HB2 PHE 66 HB2 PHE 66 -0.494 1.282 7.617 402 HB3 PHE 66 HB1 PHE 66 -0.272 2.571 8.792 403 HD1 PHE 66 HD1 PHE 66 0.380 -1.075 8.355 404 HD2 PHE 66 HD2 PHE 66 1.662 2.617 10.048 405 HE1 PHE 66 HE1 PHE 66 2.451 -2.154 9.130 406 HE2 PHE 66 HE2 PHE 66 3.734 1.542 10.828 407 HZ PHE 66 HZ PHE 66 4.134 -0.845 10.367 408 H GLU 67 HN GLU 67 -1.564 -0.430 11.462 409 HA GLU 67 HA GLU 67 -1.449 -0.184 13.718 410 HB2 GLU 67 HB2 GLU 67 -0.328 2.519 12.960 411 HB3 GLU 67 HB1 GLU 67 -0.423 1.942 14.617 412 HG2 GLU 67 HG2 GLU 67 1.040 0.458 12.453 413 HG3 GLU 67 HG1 GLU 67 1.801 1.679 13.472 414 H GLY 68 HN GLY 68 -3.744 0.823 11.985 415 HA2 GLY 68 HA2 GLY 68 -5.918 1.358 12.669 416 HA3 GLY 68 HA1 GLY 68 -5.270 1.952 14.189 417 H GLN 69 HN GLN 69 -3.376 3.261 11.868 418 HA GLN 69 HA GLN 69 -4.986 5.723 11.811 419 HB2 GLN 69 HB2 GLN 69 -1.999 5.313 11.593 420 HB3 GLN 69 HB1 GLN 69 -2.800 6.861 11.358 421 HG2 GLN 69 HG2 GLN 69 -3.616 6.794 13.656 422 HG3 GLN 69 HG1 GLN 69 -2.829 5.234 13.892 423 HE21 GLN 69 HE21 GLN 69 -2.439 7.842 15.226 424 HE22 GLN 69 HE22 GLN 69 -0.752 8.183 15.066 425 H ARG 70 HN ARG 70 -4.755 7.057 9.839 426 HA ARG 70 HA ARG 70 -4.794 5.309 7.505 427 HB2 ARG 70 HB2 ARG 70 -5.802 7.326 6.359 428 HB3 ARG 70 HB1 ARG 70 -6.768 6.602 7.633 429 HG2 ARG 70 HG2 ARG 70 -5.967 8.361 9.179 430 HG3 ARG 70 HG1 ARG 70 -5.124 9.115 7.825 431 HD2 ARG 70 HD2 ARG 70 -8.091 8.616 7.992 432 HD3 ARG 70 HD1 ARG 70 -7.301 10.166 8.267 433 HE ARG 70 HE ARG 70 -6.559 10.011 5.895 434 HH11 ARG 70 HH11 ARG 70 -9.434 8.282 7.006 435 HH12 ARG 70 HH12 ARG 70 -10.179 8.261 5.360 436 HH21 ARG 70 HH21 ARG 70 -7.504 10.012 3.811 437 HH22 ARG 70 HH22 ARG 70 -9.117 9.211 3.591 438 H ILE 71 HN ILE 71 -3.187 5.218 6.149 439 HA ILE 71 HA ILE 71 -0.809 6.704 6.473 440 HB ILE 71 HB ILE 71 -1.750 4.991 4.168 441 HG12 ILE 71 HG12 ILE 71 -1.510 3.780 6.285 442 HG13 ILE 71 HG11 ILE 71 -0.246 3.298 5.155 443 HG21 ILE 71 HG21 ILE 71 0.567 4.916 3.427 444 HG22 ILE 71 HG22 ILE 71 1.031 6.017 4.724 445 HG23 ILE 71 HG23 ILE 71 -0.028 6.575 3.430 446 HD11 ILE 71 HD11 ILE 71 1.252 4.958 6.339 447 HD12 ILE 71 HD12 ILE 71 0.791 3.521 7.252 448 HD13 ILE 71 HD13 ILE 71 -0.005 5.062 7.572 449 H ALA 72 HN ALA 72 -0.227 8.621 5.736 450 HA ALA 72 HA ALA 72 -2.041 10.195 4.136 451 HB1 ALA 72 HB1 ALA 72 -0.496 12.018 4.528 452 HB2 ALA 72 HB2 ALA 72 0.716 10.894 5.149 453 HB3 ALA 72 HB3 ALA 72 -0.787 11.155 6.037 454 H ASP 73 HN ASP 73 -0.621 11.707 2.476 455 HA ASP 73 HA ASP 73 0.285 9.765 0.491 456 HB2 ASP 73 HB2 ASP 73 -0.869 12.495 0.392 457 HB3 ASP 73 HB1 ASP 73 0.273 12.076 -0.881 458 H ASN 74 HN ASN 74 1.563 11.929 2.722 459 HA ASN 74 HA ASN 74 4.078 12.207 1.232 460 HB2 ASN 74 HB2 ASN 74 4.661 13.985 2.754 461 HB3 ASN 74 HB1 ASN 74 3.034 14.282 2.157 462 HD21 ASN 74 HD21 ASN 74 4.498 15.101 4.629 463 HD22 ASN 74 HD22 ASN 74 3.441 14.657 5.927 464 H HIS 75 HN HIS 75 2.930 9.868 2.859 465 HA HIS 75 HA HIS 75 4.803 9.602 5.036 466 HB2 HIS 75 HB2 HIS 75 2.438 8.155 4.063 467 HB3 HIS 75 HB1 HIS 75 3.695 7.118 4.727 468 HD2 HIS 75 HD2 HIS 75 4.585 9.134 7.189 469 HE1 HIS 75 HE1 HIS 75 0.552 8.586 8.354 470 HE2 HIS 75 HE2 HIS 75 2.885 9.170 9.146 471 H THR 76 HN THR 76 6.534 8.270 5.158 472 HA THR 76 HA THR 76 7.426 6.989 2.658 473 HB THR 76 HB THR 76 9.544 7.571 4.575 474 HG1 THR 76 HG1 THR 76 8.093 9.389 4.942 475 HG21 THR 76 HG21 THR 76 9.096 8.359 1.694 476 HG22 THR 76 HG22 THR 76 9.985 6.950 2.268 477 HG23 THR 76 HG23 THR 76 10.605 8.569 2.582 478 HA PRO 77 HA PRO 77 7.347 3.185 4.972 479 HB2 PRO 77 HB2 PRO 77 9.693 2.318 3.402 480 HB3 PRO 77 HB1 PRO 77 8.076 1.611 3.489 481 HG2 PRO 77 HG2 PRO 77 8.888 2.915 1.310 482 HG3 PRO 77 HG1 PRO 77 7.212 3.014 1.883 483 HD2 PRO 77 HD2 PRO 77 9.421 5.002 2.177 484 HD3 PRO 77 HD1 PRO 77 7.703 5.269 1.816 485 H LYS 78 HN LYS 78 9.950 5.334 5.029 486 HA LYS 78 HA LYS 78 11.720 3.768 6.664 487 HB2 LYS 78 HB2 LYS 78 12.553 5.530 5.146 488 HB3 LYS 78 HB1 LYS 78 11.710 6.739 6.099 489 HG2 LYS 78 HG2 LYS 78 14.015 6.786 6.699 490 HG3 LYS 78 HG1 LYS 78 13.113 6.095 8.049 491 HD2 LYS 78 HD2 LYS 78 15.090 4.783 7.757 492 HD3 LYS 78 HD1 LYS 78 13.730 3.822 7.179 493 HE2 LYS 78 HE2 LYS 78 14.288 4.247 4.906 494 HE3 LYS 78 HE1 LYS 78 15.456 5.488 5.358 495 HZ1 LYS 78 HZ1 LYS 78 16.532 3.408 4.737 496 HZ2 LYS 78 HZ2 LYS 78 15.710 2.590 5.968 497 HZ3 LYS 78 HZ3 LYS 78 16.839 3.789 6.354 498 H GLU 79 HN GLU 79 9.118 6.031 7.176 499 HA GLU 79 HA GLU 79 9.691 6.150 10.046 500 HB2 GLU 79 HB2 GLU 79 7.998 7.894 10.153 501 HB3 GLU 79 HB1 GLU 79 9.163 8.273 8.895 502 HG2 GLU 79 HG2 GLU 79 7.403 7.064 7.365 503 HG3 GLU 79 HG1 GLU 79 6.306 7.513 8.670 504 H LEU 80 HN LEU 80 7.452 6.188 11.331 505 HA LEU 80 HA LEU 80 5.621 5.076 12.097 506 HB2 LEU 80 HB2 LEU 80 5.538 3.839 9.346 507 HB3 LEU 80 HB1 LEU 80 4.319 3.601 10.580 508 HG LEU 80 HG LEU 80 4.973 6.374 9.669 509 HD11 LEU 80 HD11 LEU 80 3.257 6.189 7.939 510 HD12 LEU 80 HD12 LEU 80 3.101 4.466 8.272 511 HD13 LEU 80 HD13 LEU 80 4.607 5.103 7.617 512 HD21 LEU 80 HD21 LEU 80 2.453 5.048 10.661 513 HD22 LEU 80 HD22 LEU 80 2.640 6.756 10.262 514 HD23 LEU 80 HD23 LEU 80 3.533 6.064 11.616 515 H GLY 81 HN GLY 81 7.905 3.083 10.278 516 HA2 GLY 81 HA2 GLY 81 9.235 1.451 11.477 517 HA3 GLY 81 HA1 GLY 81 7.849 1.167 12.521 518 H MET 82 HN MET 82 8.198 1.304 8.990 519 HA MET 82 HA MET 82 6.616 -1.123 8.756 520 HB2 MET 82 HB2 MET 82 7.598 0.939 6.800 521 HB3 MET 82 HB1 MET 82 6.949 -0.596 6.243 522 HG2 MET 82 HG2 MET 82 4.842 -0.117 7.374 523 HG3 MET 82 HG1 MET 82 5.494 1.419 7.940 524 HE1 MET 82 HE1 MET 82 2.746 0.929 6.199 525 HE2 MET 82 HE2 MET 82 2.821 2.352 5.157 526 HE3 MET 82 HE3 MET 82 3.236 2.487 6.866 527 H GLU 83 HN GLU 83 7.476 -3.068 8.527 528 HA GLU 83 HA GLU 83 10.233 -3.279 7.488 529 HB2 GLU 83 HB2 GLU 83 8.888 -5.058 9.528 530 HB3 GLU 83 HB1 GLU 83 10.512 -5.270 8.900 531 HG2 GLU 83 HG2 GLU 83 11.076 -3.033 9.870 532 HG3 GLU 83 HG1 GLU 83 9.501 -3.059 10.664 533 H GLU 84 HN GLU 84 10.520 -5.832 7.018 534 HA GLU 84 HA GLU 84 8.852 -6.373 4.775 535 HB2 GLU 84 HB2 GLU 84 11.170 -7.054 4.737 536 HB3 GLU 84 HB1 GLU 84 10.968 -7.996 6.202 537 HG2 GLU 84 HG2 GLU 84 11.091 -9.464 4.313 538 HG3 GLU 84 HG1 GLU 84 9.469 -9.518 4.996 539 H GLU 85 HN GLU 85 7.167 -7.783 4.591 540 HA GLU 85 HA GLU 85 5.475 -9.187 5.157 541 HB2 GLU 85 HB2 GLU 85 7.561 -9.990 7.112 542 HB3 GLU 85 HB1 GLU 85 5.911 -10.480 7.465 543 HG2 GLU 85 HG2 GLU 85 7.391 -11.082 4.914 544 HG3 GLU 85 HG1 GLU 85 7.179 -12.199 6.262 545 H ASP 86 HN ASP 86 5.744 -6.390 6.216 546 HA ASP 86 HA ASP 86 4.371 -6.445 8.749 547 HB2 ASP 86 HB2 ASP 86 5.799 -4.500 7.337 548 HB3 ASP 86 HB1 ASP 86 4.138 -3.915 7.342 549 H VAL 87 HN VAL 87 2.192 -5.806 9.113 550 HA VAL 87 HA VAL 87 0.462 -6.483 6.849 551 HB VAL 87 HB VAL 87 -0.283 -6.326 9.771 552 HG11 VAL 87 HG11 VAL 87 -2.237 -7.641 9.084 553 HG12 VAL 87 HG12 VAL 87 -1.698 -7.556 7.405 554 HG13 VAL 87 HG13 VAL 87 -2.176 -6.084 8.254 555 HG21 VAL 87 HG21 VAL 87 0.471 -8.727 8.107 556 HG22 VAL 87 HG22 VAL 87 -0.150 -8.776 9.758 557 HG23 VAL 87 HG23 VAL 87 1.416 -8.035 9.425 558 H ILE 88 HN ILE 88 -0.881 -5.115 5.941 559 HA ILE 88 HA ILE 88 -1.725 -2.694 7.332 560 HB ILE 88 HB ILE 88 0.247 -2.033 5.987 561 HG12 ILE 88 HG12 ILE 88 -2.282 -0.931 4.755 562 HG13 ILE 88 HG11 ILE 88 -1.730 -0.512 6.375 563 HG21 ILE 88 HG21 ILE 88 0.211 -2.103 3.567 564 HG22 ILE 88 HG22 ILE 88 -1.366 -2.889 3.592 565 HG23 ILE 88 HG23 ILE 88 0.047 -3.728 4.228 566 HD11 ILE 88 HD11 ILE 88 0.371 0.331 5.385 567 HD12 ILE 88 HD12 ILE 88 -1.064 1.204 4.852 568 HD13 ILE 88 HD13 ILE 88 -0.300 0.025 3.784 569 H GLU 89 HN GLU 89 -3.810 -2.042 6.721 570 HA GLU 89 HA GLU 89 -5.168 -3.910 4.887 571 HB2 GLU 89 HB2 GLU 89 -6.429 -2.409 7.183 572 HB3 GLU 89 HB1 GLU 89 -7.155 -3.690 6.221 573 HG2 GLU 89 HG2 GLU 89 -5.733 -5.330 7.159 574 HG3 GLU 89 HG1 GLU 89 -4.703 -4.110 7.903 575 H VAL 90 HN VAL 90 -6.916 -3.089 3.616 576 HA VAL 90 HA VAL 90 -6.916 -0.169 3.273 577 HB VAL 90 HB VAL 90 -5.471 -1.045 1.535 578 HG11 VAL 90 HG11 VAL 90 -7.797 -2.786 0.736 579 HG12 VAL 90 HG12 VAL 90 -6.279 -3.332 1.449 580 HG13 VAL 90 HG13 VAL 90 -6.289 -2.611 -0.162 581 HG21 VAL 90 HG21 VAL 90 -8.162 -0.269 0.422 582 HG22 VAL 90 HG22 VAL 90 -6.625 -0.192 -0.443 583 HG23 VAL 90 HG23 VAL 90 -6.903 0.842 0.961 584 H TYR 91 HN TYR 91 -8.878 0.726 3.067 585 HA TYR 91 HA TYR 91 -11.171 -1.001 2.428 586 HB2 TYR 91 HB2 TYR 91 -10.889 0.836 4.805 587 HB3 TYR 91 HB1 TYR 91 -12.460 0.315 4.206 588 HD1 TYR 91 HD1 TYR 91 -13.068 -2.092 4.278 589 HD2 TYR 91 HD2 TYR 91 -9.505 -0.629 6.077 590 HE1 TYR 91 HE1 TYR 91 -12.878 -4.168 5.577 591 HE2 TYR 91 HE2 TYR 91 -9.306 -2.703 7.385 592 HH TYR 91 HH TYR 91 -11.227 -5.470 6.713 593 H GLN 92 HN GLN 92 -13.178 0.389 1.980 594 HA GLN 92 HA GLN 92 -12.384 2.409 0.068 595 HB2 GLN 92 HB2 GLN 92 -14.123 0.683 -0.434 596 HB3 GLN 92 HB1 GLN 92 -15.166 1.449 0.754 597 HG2 GLN 92 HG2 GLN 92 -15.072 3.536 -0.576 598 HG3 GLN 92 HG1 GLN 92 -14.133 2.672 -1.794 599 HE21 GLN 92 HE21 GLN 92 -17.259 3.037 -0.311 600 HE22 GLN 92 HE22 GLN 92 -18.151 2.164 -1.509 601 H GLU 93 HN GLU 93 -12.788 4.549 0.143 602 HA GLU 93 HA GLU 93 -13.316 5.714 2.725 603 HB2 GLU 93 HB2 GLU 93 -12.623 6.812 0.015 604 HB3 GLU 93 HB1 GLU 93 -13.112 7.879 1.324 605 HG2 GLU 93 HG2 GLU 93 -10.884 5.909 1.661 606 HG3 GLU 93 HG1 GLU 93 -10.617 7.497 0.941 607 H GLN 94 HN GLN 94 -14.978 7.303 3.119 608 HA GLN 94 HA GLN 94 -17.539 6.455 2.252 609 HB2 GLN 94 HB2 GLN 94 -17.150 7.426 4.457 610 HB3 GLN 94 HB1 GLN 94 -16.699 8.956 3.722 611 HG2 GLN 94 HG2 GLN 94 -19.036 8.968 2.711 612 HG3 GLN 94 HG1 GLN 94 -19.401 7.675 3.854 613 HE21 GLN 94 HE21 GLN 94 -19.455 8.125 6.048 614 HE22 GLN 94 HE22 GLN 94 -19.540 9.746 6.653 615 H THR 95 HN THR 95 -15.380 9.007 1.218 616 HA THR 95 HA THR 95 -17.281 10.479 -0.291 617 HB THR 95 HB THR 95 -15.150 11.325 -1.473 618 HG1 THR 95 HG1 THR 95 -13.349 10.350 -0.951 619 HG21 THR 95 HG21 THR 95 -16.255 12.612 0.246 620 HG22 THR 95 HG22 THR 95 -14.513 12.676 0.510 621 HG23 THR 95 HG23 THR 95 -15.519 11.628 1.509 622 H GLY 96 HN GLY 96 -15.512 7.575 -0.880 623 HA2 GLY 96 HA2 GLY 96 -15.670 6.084 -2.644 624 HA3 GLY 96 HA1 GLY 96 -16.851 7.158 -3.382 625 H GLY 97 HN GLY 97 -13.986 8.712 -2.497 626 HA2 GLY 97 HA2 GLY 97 -12.080 8.240 -4.325 627 HA3 GLY 97 HA1 GLY 97 -13.278 9.120 -5.266 628 H1 ASN 357 HT1 ASN 357 -4.018 -20.435 -2.817 629 H2 ASN 357 HT2 ASN 357 -3.457 -19.898 -1.316 630 H3 ASN 357 HT3 ASN 357 -2.547 -21.009 -2.214 631 HA ASN 357 HA ASN 357 -1.597 -18.813 -2.345 632 HB2 ASN 357 HB2 ASN 357 -1.570 -18.592 -4.839 633 HB3 ASN 357 HB1 ASN 357 -1.236 -20.219 -4.267 634 HD21 ASN 357 HD21 ASN 357 -2.082 -19.438 -6.858 635 HD22 ASN 357 HD22 ASN 357 -3.607 -20.196 -7.163 636 H ASN 358 HN ASN 358 -2.784 -17.312 -1.155 637 HA ASN 358 HA ASN 358 -4.813 -15.804 -2.670 638 HB2 ASN 358 HB2 ASN 358 -5.630 -14.999 -0.496 639 HB3 ASN 358 HB1 ASN 358 -5.659 -16.756 -0.571 640 HD21 ASN 358 HD21 ASN 358 -5.705 -15.176 1.781 641 HD22 ASN 358 HD22 ASN 358 -4.279 -15.539 2.688 642 H ARG 359 HN ARG 359 -1.776 -15.628 -2.609 643 HA ARG 359 HA ARG 359 -1.585 -12.777 -1.896 644 HB2 ARG 359 HB2 ARG 359 0.960 -13.387 -1.753 645 HB3 ARG 359 HB1 ARG 359 -0.110 -13.738 -0.404 646 HG2 ARG 359 HG2 ARG 359 -0.332 -16.067 -1.278 647 HG3 ARG 359 HG1 ARG 359 0.898 -15.670 -2.479 648 HD2 ARG 359 HD2 ARG 359 1.788 -16.839 -0.478 649 HD3 ARG 359 HD1 ARG 359 2.527 -15.267 -0.777 650 HE ARG 359 HE ARG 359 0.422 -14.848 0.985 651 HH11 ARG 359 HH11 ARG 359 3.472 -16.603 0.906 652 HH12 ARG 359 HH12 ARG 359 3.753 -16.423 2.680 653 HH21 ARG 359 HH21 ARG 359 0.727 -14.564 3.206 654 HH22 ARG 359 HH22 ARG 359 2.202 -15.279 3.975 655 H ASP 360 HN ASP 360 -0.852 -11.396 -3.397 656 HA ASP 360 HA ASP 360 0.182 -12.499 -5.930 657 HB2 ASP 360 HB2 ASP 360 -2.245 -11.730 -6.040 658 HB3 ASP 360 HB1 ASP 360 -1.650 -10.098 -5.756 659 HA PRO 361 HA PRO 361 3.317 -9.500 -4.730 660 HB2 PRO 361 HB2 PRO 361 5.262 -10.416 -6.342 661 HB3 PRO 361 HB1 PRO 361 4.784 -11.267 -4.866 662 HG2 PRO 361 HG2 PRO 361 4.087 -11.875 -7.694 663 HG3 PRO 361 HG1 PRO 361 4.476 -12.983 -6.366 664 HD2 PRO 361 HD2 PRO 361 1.922 -12.418 -7.218 665 HD3 PRO 361 HD1 PRO 361 2.336 -13.019 -5.602 666 H ILE 362 HN ILE 362 3.625 -7.500 -5.471 667 HA ILE 362 HA ILE 362 3.464 -7.029 -8.368 668 HB ILE 362 HB ILE 362 2.390 -5.045 -6.384 669 HG12 ILE 362 HG12 ILE 362 0.769 -7.099 -7.902 670 HG13 ILE 362 HG11 ILE 362 1.143 -7.204 -6.184 671 HG21 ILE 362 HG21 ILE 362 1.886 -5.441 -9.331 672 HG22 ILE 362 HG22 ILE 362 2.981 -4.251 -8.631 673 HG23 ILE 362 HG23 ILE 362 1.248 -4.139 -8.327 674 HD11 ILE 362 HD11 ILE 362 -0.385 -4.955 -7.465 675 HD12 ILE 362 HD12 ILE 362 -0.128 -5.226 -5.739 676 HD13 ILE 362 HD13 ILE 362 -1.115 -6.351 -6.670 677 H VAL 363 HN VAL 363 5.160 -6.017 -9.175 678 HA VAL 363 HA VAL 363 6.742 -4.253 -7.422 679 HB VAL 363 HB VAL 363 7.974 -5.957 -9.589 680 HG11 VAL 363 HG11 VAL 363 9.241 -3.985 -8.950 681 HG12 VAL 363 HG12 VAL 363 10.063 -5.443 -8.394 682 HG13 VAL 363 HG13 VAL 363 9.154 -4.453 -7.252 683 HG21 VAL 363 HG21 VAL 363 7.099 -7.532 -8.018 684 HG22 VAL 363 HG22 VAL 363 7.700 -6.591 -6.654 685 HG23 VAL 363 HG23 VAL 363 8.834 -7.398 -7.736 686 H ILE 364 HN ILE 364 6.362 -2.259 -8.183 687 HA ILE 364 HA ILE 364 5.933 -1.842 -11.038 688 HB ILE 364 HB ILE 364 5.312 0.462 -10.415 689 HG12 ILE 364 HG12 ILE 364 5.448 -0.354 -7.526 690 HG13 ILE 364 HG11 ILE 364 6.858 0.343 -8.317 691 HG21 ILE 364 HG21 ILE 364 3.252 -0.120 -9.178 692 HG22 ILE 364 HG22 ILE 364 3.918 -1.723 -8.868 693 HG23 ILE 364 HG23 ILE 364 3.579 -1.213 -10.523 694 HD11 ILE 364 HD11 ILE 364 5.499 2.322 -8.888 695 HD12 ILE 364 HD12 ILE 364 5.648 2.058 -7.151 696 HD13 ILE 364 HD13 ILE 364 4.155 1.623 -7.986 697 H SER 365 HN SER 365 6.800 0.601 -11.569 698 HA SER 365 HA SER 365 9.700 0.316 -11.462 699 HB2 SER 365 HB2 SER 365 9.334 2.360 -13.160 700 HB3 SER 365 HB1 SER 365 9.204 0.677 -13.669 701 HG SER 365 HG SER 365 7.215 2.603 -13.289 702 H ASP 366 HN ASP 366 11.056 2.147 -11.015 703 HA ASP 366 HA ASP 366 9.802 4.123 -9.219 704 HB2 ASP 366 HB2 ASP 366 11.225 2.538 -8.004 705 HB3 ASP 366 HB1 ASP 366 12.574 2.913 -9.066 706 H SER 367 HN SER 367 9.551 5.803 -10.619 707 HA SER 367 HA SER 367 12.014 6.914 -11.788 708 HB2 SER 367 HB2 SER 367 9.359 7.266 -13.143 709 HB3 SER 367 HB1 SER 367 10.978 7.373 -13.830 710 HG SER 367 HG SER 367 10.681 4.924 -12.868 711 HA PRO 368 HA PRO 368 10.427 10.263 -9.165 712 HB2 PRO 368 HB2 PRO 368 13.046 11.466 -9.660 713 HB3 PRO 368 HB1 PRO 368 12.338 10.934 -8.130 714 HG2 PRO 368 HG2 PRO 368 14.412 9.651 -9.272 715 HG3 PRO 368 HG1 PRO 368 13.183 8.811 -8.305 716 HD2 PRO 368 HD2 PRO 368 13.460 8.969 -11.279 717 HD3 PRO 368 HD1 PRO 368 13.016 7.585 -10.257
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